USER MOD reduce.3.24.130724 H: found=0, std=0, add=984, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 980 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 20 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 55 THR OG1 : rot 119:sc= 0.775 USER MOD Set 1.3: A 57 SER OG : rot 180:sc= 0.704 USER MOD Set 2.1: A 7 THR OG1 : rot 123:sc= 1.74 USER MOD Set 2.2: A 9 THR OG1 : rot 170:sc= 0.804 USER MOD Single : A 1 MET CE :methyl -170:sc= -0.0809 (180deg=-0.158) USER MOD Single : A 1 MET N :NH3+ 174:sc= 1.01 (180deg=0.987) USER MOD Single : A 2 GLN : amide:sc= -0.0439 X(o=-0.044,f=0) USER MOD Single : A 6 LYS NZ :NH3+ -178:sc= 1.25 (180deg=1.23) USER MOD Single : A 11 LYS NZ :NH3+ -175:sc= 1.22 (180deg=1.16) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0.0519 USER MOD Single : A 25 ASN : amide:sc= -0.654 K(o=-0.65,f=-1.9!) USER MOD Single : A 27 LYS NZ :NH3+ 157:sc= 2.16 (180deg=1.73) USER MOD Single : A 29 LYS NZ :NH3+ 171:sc= 0.997 (180deg=0.935) USER MOD Single : A 31 GLN : amide:sc= 0 X(o=0,f=-0.034) USER MOD Single : A 33 LYS NZ :NH3+ -164:sc= 0.846 (180deg=0.697) USER MOD Single : A 40 GLN : amide:sc= 0 K(o=0,f=-0.68) USER MOD Single : A 41 GLN : amide:sc= 0.96 K(o=0.96,f=-4.9!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= 0.736 K(o=0.74,f=-4.4!) USER MOD Single : A 59 TYR OH : rot 50:sc=-0.00892 USER MOD Single : A 60 ASN : amide:sc= 0.103 X(o=0.1,f=0) USER MOD Single : A 62 GLN : amide:sc= 0.851 K(o=0.85,f=0) USER MOD Single : A 63 LYS NZ :NH3+ 173:sc= 1.22 (180deg=1.02) USER MOD Single : A 65 SER OG : rot 57:sc= 1.03 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HE2:sc= -0.0748 K(o=-0.075,f=-0.62) USER MOD Single : B -1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B -2 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B -3 GLY N :NH3+ -100:sc= 0.0124 (180deg=0) USER MOD Single : B 676 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 678 THR OG1 : rot 180:sc= 0 USER MOD Single : B 681 SER OG : rot 180:sc= 0.00146 USER MOD Single : B 686 GLN : amide:sc= -0.021 X(o=-0.021,f=0) USER MOD Single : B 689 TYR OH : rot 180:sc= 0 USER MOD Single : B 696 GLN : amide:sc= -0.387 X(o=-0.39,f=-0.28) USER MOD Single : B 697 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 704 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 706 THR OG1 : rot -93:sc= 1.16 USER MOD Single : B 708 SER OG : rot 180:sc= 0 USER MOD Single : B 711 HIS : no HD1:sc= -0.757 X(o=-0.76,f=-0.31) USER MOD Single : B 714 HIS : no HD1:sc=-0.00635 K(o=-0.0064,f=-1.9!) USER MOD Single : B 715 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.565 1.677 0.270 1.00 0.00 N ATOM 2 CA MET A 1 2.357 1.622 -1.004 1.00 0.00 C ATOM 3 C MET A 1 2.061 2.825 -1.894 1.00 0.00 C ATOM 4 O MET A 1 1.118 3.548 -1.614 1.00 0.00 O ATOM 5 CB MET A 1 2.152 0.312 -1.812 1.00 0.00 C ATOM 6 CG MET A 1 0.792 0.084 -2.498 1.00 0.00 C ATOM 7 SD MET A 1 0.714 -1.524 -3.328 1.00 0.00 S ATOM 8 CE MET A 1 -0.486 -1.206 -4.647 1.00 0.00 C ATOM 0 H1 MET A 1 1.710 0.798 0.807 1.00 0.00 H new ATOM 0 H2 MET A 1 1.881 2.487 0.840 1.00 0.00 H new ATOM 0 H3 MET A 1 0.555 1.783 0.046 1.00 0.00 H new ATOM 0 HA MET A 1 3.401 1.645 -0.692 1.00 0.00 H new ATOM 0 HB2 MET A 1 2.923 0.271 -2.581 1.00 0.00 H new ATOM 0 HB3 MET A 1 2.329 -0.526 -1.138 1.00 0.00 H new ATOM 0 HG2 MET A 1 -0.004 0.148 -1.756 1.00 0.00 H new ATOM 0 HG3 MET A 1 0.615 0.877 -3.225 1.00 0.00 H new ATOM 0 HE1 MET A 1 -0.763 -2.147 -5.122 1.00 0.00 H new ATOM 0 HE2 MET A 1 -1.375 -0.737 -4.225 1.00 0.00 H new ATOM 0 HE3 MET A 1 -0.043 -0.542 -5.389 1.00 0.00 H new ATOM 20 N GLN A 2 2.754 2.992 -3.029 1.00 0.00 N ATOM 21 CA GLN A 2 2.431 4.026 -4.018 1.00 0.00 C ATOM 22 C GLN A 2 2.385 3.438 -5.409 1.00 0.00 C ATOM 23 O GLN A 2 3.072 2.449 -5.661 1.00 0.00 O ATOM 24 CB GLN A 2 3.412 5.217 -3.928 1.00 0.00 C ATOM 25 CG GLN A 2 4.712 5.183 -4.757 1.00 0.00 C ATOM 26 CD GLN A 2 5.743 4.271 -4.116 1.00 0.00 C ATOM 27 OE1 GLN A 2 6.614 4.684 -3.356 1.00 0.00 O ATOM 28 NE2 GLN A 2 5.602 2.992 -4.388 1.00 0.00 N ATOM 0 H GLN A 2 3.554 2.413 -3.286 1.00 0.00 H new ATOM 0 HA GLN A 2 1.438 4.415 -3.791 1.00 0.00 H new ATOM 0 HB2 GLN A 2 2.865 6.116 -4.212 1.00 0.00 H new ATOM 0 HB3 GLN A 2 3.693 5.333 -2.881 1.00 0.00 H new ATOM 0 HG2 GLN A 2 4.494 4.838 -5.768 1.00 0.00 H new ATOM 0 HG3 GLN A 2 5.118 6.191 -4.845 1.00 0.00 H new ATOM 0 HE21 GLN A 2 4.867 2.684 -5.024 1.00 0.00 H new ATOM 0 HE22 GLN A 2 6.228 2.308 -3.962 1.00 0.00 H new ATOM 37 N ILE A 3 1.679 4.100 -6.314 1.00 0.00 N ATOM 38 CA ILE A 3 1.622 3.738 -7.728 1.00 0.00 C ATOM 39 C ILE A 3 1.659 5.016 -8.551 1.00 0.00 C ATOM 40 O ILE A 3 1.317 6.088 -8.059 1.00 0.00 O ATOM 41 CB ILE A 3 0.401 2.845 -8.017 1.00 0.00 C ATOM 42 CG1 ILE A 3 -0.892 3.384 -7.371 1.00 0.00 C ATOM 43 CG2 ILE A 3 0.658 1.422 -7.485 1.00 0.00 C ATOM 44 CD1 ILE A 3 -2.106 3.260 -8.286 1.00 0.00 C ATOM 0 H ILE A 3 1.118 4.920 -6.084 1.00 0.00 H new ATOM 0 HA ILE A 3 2.486 3.136 -8.011 1.00 0.00 H new ATOM 0 HB ILE A 3 0.263 2.839 -9.098 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -1.084 2.842 -6.445 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -0.750 4.431 -7.103 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -0.209 0.794 -7.692 1.00 0.00 H new ATOM 0 HG22 ILE A 3 1.536 1.003 -7.977 1.00 0.00 H new ATOM 0 HG23 ILE A 3 0.829 1.461 -6.409 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -2.986 3.655 -7.778 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -1.931 3.825 -9.201 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -2.270 2.211 -8.533 1.00 0.00 H new ATOM 56 N PHE A 4 2.109 4.880 -9.787 1.00 0.00 N ATOM 57 CA PHE A 4 2.448 5.952 -10.703 1.00 0.00 C ATOM 58 C PHE A 4 1.402 6.005 -11.801 1.00 0.00 C ATOM 59 O PHE A 4 1.426 5.230 -12.747 1.00 0.00 O ATOM 60 CB PHE A 4 3.849 5.686 -11.274 1.00 0.00 C ATOM 61 CG PHE A 4 4.887 5.140 -10.318 1.00 0.00 C ATOM 62 CD1 PHE A 4 5.156 5.839 -9.131 1.00 0.00 C ATOM 63 CD2 PHE A 4 5.609 3.974 -10.621 1.00 0.00 C ATOM 64 CE1 PHE A 4 6.121 5.367 -8.230 1.00 0.00 C ATOM 65 CE2 PHE A 4 6.609 3.534 -9.738 1.00 0.00 C ATOM 66 CZ PHE A 4 6.867 4.220 -8.542 1.00 0.00 C ATOM 0 H PHE A 4 2.256 3.960 -10.202 1.00 0.00 H new ATOM 0 HA PHE A 4 2.460 6.916 -10.194 1.00 0.00 H new ATOM 0 HB2 PHE A 4 3.750 4.985 -12.103 1.00 0.00 H new ATOM 0 HB3 PHE A 4 4.229 6.619 -11.689 1.00 0.00 H new ATOM 0 HD1 PHE A 4 4.615 6.747 -8.910 1.00 0.00 H new ATOM 0 HD2 PHE A 4 5.397 3.421 -11.524 1.00 0.00 H new ATOM 0 HE1 PHE A 4 6.290 5.885 -7.298 1.00 0.00 H new ATOM 0 HE2 PHE A 4 7.187 2.655 -9.983 1.00 0.00 H new ATOM 0 HZ PHE A 4 7.633 3.868 -7.867 1.00 0.00 H new ATOM 76 N VAL A 5 0.439 6.897 -11.697 1.00 0.00 N ATOM 77 CA VAL A 5 -0.579 7.037 -12.734 1.00 0.00 C ATOM 78 C VAL A 5 0.002 7.994 -13.762 1.00 0.00 C ATOM 79 O VAL A 5 0.103 9.191 -13.520 1.00 0.00 O ATOM 80 CB VAL A 5 -1.931 7.444 -12.125 1.00 0.00 C ATOM 81 CG1 VAL A 5 -3.041 7.431 -13.189 1.00 0.00 C ATOM 82 CG2 VAL A 5 -2.265 6.471 -10.980 1.00 0.00 C ATOM 0 H VAL A 5 0.334 7.537 -10.910 1.00 0.00 H new ATOM 0 HA VAL A 5 -0.814 6.100 -13.239 1.00 0.00 H new ATOM 0 HB VAL A 5 -1.864 8.461 -11.738 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -3.987 7.723 -12.732 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -2.791 8.133 -13.984 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -3.134 6.428 -13.606 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -3.222 6.746 -10.537 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -2.325 5.455 -11.371 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -1.485 6.522 -10.220 1.00 0.00 H new ATOM 92 N LYS A 6 0.459 7.467 -14.895 1.00 0.00 N ATOM 93 CA LYS A 6 0.916 8.294 -16.002 1.00 0.00 C ATOM 94 C LYS A 6 -0.338 8.874 -16.632 1.00 0.00 C ATOM 95 O LYS A 6 -1.231 8.118 -17.022 1.00 0.00 O ATOM 96 CB LYS A 6 1.751 7.434 -16.969 1.00 0.00 C ATOM 97 CG LYS A 6 2.500 8.335 -17.965 1.00 0.00 C ATOM 98 CD LYS A 6 3.380 7.554 -18.955 1.00 0.00 C ATOM 99 CE LYS A 6 4.357 8.474 -19.713 1.00 0.00 C ATOM 100 NZ LYS A 6 5.389 7.696 -20.456 1.00 0.00 N ATOM 0 H LYS A 6 0.522 6.464 -15.068 1.00 0.00 H new ATOM 0 HA LYS A 6 1.570 9.109 -15.693 1.00 0.00 H new ATOM 0 HB2 LYS A 6 2.463 6.829 -16.408 1.00 0.00 H new ATOM 0 HB3 LYS A 6 1.102 6.744 -17.508 1.00 0.00 H new ATOM 0 HG2 LYS A 6 1.775 8.927 -18.524 1.00 0.00 H new ATOM 0 HG3 LYS A 6 3.124 9.036 -17.411 1.00 0.00 H new ATOM 0 HD2 LYS A 6 3.944 6.793 -18.416 1.00 0.00 H new ATOM 0 HD3 LYS A 6 2.745 7.032 -19.671 1.00 0.00 H new ATOM 0 HE2 LYS A 6 3.800 9.098 -20.412 1.00 0.00 H new ATOM 0 HE3 LYS A 6 4.846 9.145 -19.007 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 6.047 8.351 -20.925 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 5.915 7.094 -19.791 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 4.926 7.100 -21.171 1.00 0.00 H new ATOM 114 N THR A 7 -0.447 10.197 -16.724 1.00 0.00 N ATOM 115 CA THR A 7 -1.518 10.753 -17.518 1.00 0.00 C ATOM 116 C THR A 7 -1.241 10.441 -18.963 1.00 0.00 C ATOM 117 O THR A 7 -0.110 10.178 -19.349 1.00 0.00 O ATOM 118 CB THR A 7 -1.720 12.240 -17.285 1.00 0.00 C ATOM 119 OG1 THR A 7 -0.495 12.892 -17.480 1.00 0.00 O ATOM 120 CG2 THR A 7 -2.229 12.468 -15.877 1.00 0.00 C ATOM 0 H THR A 7 0.170 10.874 -16.275 1.00 0.00 H new ATOM 0 HA THR A 7 -2.458 10.294 -17.212 1.00 0.00 H new ATOM 0 HB THR A 7 -2.456 12.638 -17.984 1.00 0.00 H new ATOM 0 HG1 THR A 7 -0.597 13.581 -18.169 1.00 0.00 H new ATOM 0 HG21 THR A 7 -2.374 13.536 -15.711 1.00 0.00 H new ATOM 0 HG22 THR A 7 -3.178 11.948 -15.745 1.00 0.00 H new ATOM 0 HG23 THR A 7 -1.502 12.085 -15.161 1.00 0.00 H new ATOM 128 N LEU A 8 -2.267 10.538 -19.777 1.00 0.00 N ATOM 129 CA LEU A 8 -2.111 10.495 -21.214 1.00 0.00 C ATOM 130 C LEU A 8 -1.235 11.673 -21.695 1.00 0.00 C ATOM 131 O LEU A 8 -0.779 11.587 -22.826 1.00 0.00 O ATOM 132 CB LEU A 8 -3.516 10.498 -21.836 1.00 0.00 C ATOM 133 CG LEU A 8 -4.168 9.225 -22.395 1.00 0.00 C ATOM 134 CD1 LEU A 8 -5.628 9.473 -22.793 1.00 0.00 C ATOM 135 CD2 LEU A 8 -3.514 8.764 -23.688 1.00 0.00 C ATOM 0 H LEU A 8 -3.231 10.649 -19.463 1.00 0.00 H new ATOM 0 HA LEU A 8 -1.592 9.590 -21.530 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -4.193 10.889 -21.077 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -3.496 11.223 -22.650 1.00 0.00 H new ATOM 0 HG LEU A 8 -4.064 8.490 -21.597 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -6.060 8.552 -23.185 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -6.194 9.796 -21.919 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -5.670 10.248 -23.559 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -4.009 7.861 -24.044 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -3.603 9.548 -24.440 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -2.460 8.553 -23.507 1.00 0.00 H new ATOM 147 N THR A 9 -0.966 12.762 -20.942 1.00 0.00 N ATOM 148 CA THR A 9 0.058 13.723 -21.370 1.00 0.00 C ATOM 149 C THR A 9 1.409 13.073 -21.164 1.00 0.00 C ATOM 150 O THR A 9 2.311 13.145 -21.999 1.00 0.00 O ATOM 151 CB THR A 9 0.071 15.018 -20.544 1.00 0.00 C ATOM 152 OG1 THR A 9 -0.758 14.906 -19.409 1.00 0.00 O ATOM 153 CG2 THR A 9 -0.349 16.207 -21.392 1.00 0.00 C ATOM 0 H THR A 9 -1.431 12.988 -20.063 1.00 0.00 H new ATOM 0 HA THR A 9 -0.161 13.982 -22.406 1.00 0.00 H new ATOM 0 HB THR A 9 1.093 15.182 -20.203 1.00 0.00 H new ATOM 0 HG1 THR A 9 -0.610 15.674 -18.819 1.00 0.00 H new ATOM 0 HG21 THR A 9 -0.332 17.112 -20.784 1.00 0.00 H new ATOM 0 HG22 THR A 9 0.340 16.319 -22.229 1.00 0.00 H new ATOM 0 HG23 THR A 9 -1.358 16.045 -21.772 1.00 0.00 H new ATOM 161 N GLY A 10 1.514 12.415 -20.018 1.00 0.00 N ATOM 162 CA GLY A 10 2.698 11.760 -19.543 1.00 0.00 C ATOM 163 C GLY A 10 3.212 12.420 -18.281 1.00 0.00 C ATOM 164 O GLY A 10 4.403 12.340 -17.988 1.00 0.00 O ATOM 0 H GLY A 10 0.730 12.326 -19.371 1.00 0.00 H new ATOM 0 HA2 GLY A 10 2.483 10.709 -19.347 1.00 0.00 H new ATOM 0 HA3 GLY A 10 3.469 11.790 -20.313 1.00 0.00 H new ATOM 168 N LYS A 11 2.319 13.082 -17.535 1.00 0.00 N ATOM 169 CA LYS A 11 2.653 13.567 -16.208 1.00 0.00 C ATOM 170 C LYS A 11 2.361 12.405 -15.304 1.00 0.00 C ATOM 171 O LYS A 11 1.205 12.021 -15.154 1.00 0.00 O ATOM 172 CB LYS A 11 1.830 14.813 -15.868 1.00 0.00 C ATOM 173 CG LYS A 11 2.140 15.309 -14.438 1.00 0.00 C ATOM 174 CD LYS A 11 1.251 14.788 -13.294 1.00 0.00 C ATOM 175 CE LYS A 11 -0.257 14.849 -13.558 1.00 0.00 C ATOM 176 NZ LYS A 11 -0.801 16.230 -13.657 1.00 0.00 N ATOM 0 H LYS A 11 1.366 13.289 -17.834 1.00 0.00 H new ATOM 0 HA LYS A 11 3.691 13.885 -16.111 1.00 0.00 H new ATOM 0 HB2 LYS A 11 2.047 15.604 -16.586 1.00 0.00 H new ATOM 0 HB3 LYS A 11 0.767 14.586 -15.956 1.00 0.00 H new ATOM 0 HG2 LYS A 11 3.172 15.046 -14.208 1.00 0.00 H new ATOM 0 HG3 LYS A 11 2.081 16.397 -14.440 1.00 0.00 H new ATOM 0 HD2 LYS A 11 1.525 13.754 -13.085 1.00 0.00 H new ATOM 0 HD3 LYS A 11 1.470 15.364 -12.395 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -0.475 14.317 -14.484 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -0.777 14.322 -12.758 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -1.836 16.190 -13.751 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -0.552 16.764 -12.800 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -0.396 16.704 -14.490 1.00 0.00 H new ATOM 190 N THR A 12 3.382 11.812 -14.736 1.00 0.00 N ATOM 191 CA THR A 12 3.197 10.705 -13.831 1.00 0.00 C ATOM 192 C THR A 12 2.868 11.277 -12.460 1.00 0.00 C ATOM 193 O THR A 12 3.704 11.908 -11.813 1.00 0.00 O ATOM 194 CB THR A 12 4.440 9.816 -13.884 1.00 0.00 C ATOM 195 OG1 THR A 12 4.932 9.721 -15.213 1.00 0.00 O ATOM 196 CG2 THR A 12 4.043 8.419 -13.443 1.00 0.00 C ATOM 0 H THR A 12 4.355 12.079 -14.886 1.00 0.00 H new ATOM 0 HA THR A 12 2.363 10.058 -14.105 1.00 0.00 H new ATOM 0 HB THR A 12 5.208 10.244 -13.240 1.00 0.00 H new ATOM 0 HG1 THR A 12 5.728 9.150 -15.227 1.00 0.00 H new ATOM 0 HG21 THR A 12 4.915 7.766 -13.473 1.00 0.00 H new ATOM 0 HG22 THR A 12 3.652 8.456 -12.426 1.00 0.00 H new ATOM 0 HG23 THR A 12 3.276 8.030 -14.113 1.00 0.00 H new ATOM 204 N ILE A 13 1.609 11.094 -12.055 1.00 0.00 N ATOM 205 CA ILE A 13 1.134 11.461 -10.739 1.00 0.00 C ATOM 206 C ILE A 13 1.287 10.212 -9.895 1.00 0.00 C ATOM 207 O ILE A 13 0.672 9.185 -10.172 1.00 0.00 O ATOM 208 CB ILE A 13 -0.300 12.049 -10.779 1.00 0.00 C ATOM 209 CG1 ILE A 13 -1.105 11.885 -9.465 1.00 0.00 C ATOM 210 CG2 ILE A 13 -1.187 11.688 -11.978 1.00 0.00 C ATOM 211 CD1 ILE A 13 -2.349 10.984 -9.478 1.00 0.00 C ATOM 0 H ILE A 13 0.889 10.680 -12.648 1.00 0.00 H new ATOM 0 HA ILE A 13 1.711 12.274 -10.298 1.00 0.00 H new ATOM 0 HB ILE A 13 -0.048 13.101 -10.914 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -0.425 11.501 -8.705 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -1.417 12.878 -9.141 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -2.159 12.170 -11.870 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -0.713 12.030 -12.898 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -1.321 10.607 -12.019 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -2.801 10.973 -8.486 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -3.069 11.369 -10.200 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -2.061 9.970 -9.757 1.00 0.00 H new ATOM 223 N THR A 14 2.124 10.298 -8.878 1.00 0.00 N ATOM 224 CA THR A 14 2.323 9.204 -7.946 1.00 0.00 C ATOM 225 C THR A 14 1.306 9.393 -6.823 1.00 0.00 C ATOM 226 O THR A 14 1.024 10.526 -6.424 1.00 0.00 O ATOM 227 CB THR A 14 3.781 9.219 -7.476 1.00 0.00 C ATOM 228 OG1 THR A 14 4.631 9.220 -8.614 1.00 0.00 O ATOM 229 CG2 THR A 14 4.110 7.992 -6.608 1.00 0.00 C ATOM 0 H THR A 14 2.684 11.126 -8.675 1.00 0.00 H new ATOM 0 HA THR A 14 2.159 8.222 -8.389 1.00 0.00 H new ATOM 0 HB THR A 14 3.936 10.114 -6.873 1.00 0.00 H new ATOM 0 HG1 THR A 14 5.567 9.231 -8.323 1.00 0.00 H new ATOM 0 HG21 THR A 14 5.153 8.038 -6.294 1.00 0.00 H new ATOM 0 HG22 THR A 14 3.466 7.985 -5.729 1.00 0.00 H new ATOM 0 HG23 THR A 14 3.945 7.083 -7.186 1.00 0.00 H new ATOM 237 N LEU A 15 0.732 8.295 -6.329 1.00 0.00 N ATOM 238 CA LEU A 15 -0.289 8.325 -5.293 1.00 0.00 C ATOM 239 C LEU A 15 -0.093 7.154 -4.376 1.00 0.00 C ATOM 240 O LEU A 15 0.331 6.106 -4.848 1.00 0.00 O ATOM 241 CB LEU A 15 -1.690 8.347 -5.933 1.00 0.00 C ATOM 242 CG LEU A 15 -2.137 7.103 -6.715 1.00 0.00 C ATOM 243 CD1 LEU A 15 -2.873 6.110 -5.820 1.00 0.00 C ATOM 244 CD2 LEU A 15 -3.161 7.512 -7.764 1.00 0.00 C ATOM 0 H LEU A 15 0.968 7.354 -6.643 1.00 0.00 H new ATOM 0 HA LEU A 15 -0.200 9.233 -4.697 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -2.418 8.525 -5.141 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -1.737 9.202 -6.607 1.00 0.00 H new ATOM 0 HG LEU A 15 -1.237 6.657 -7.138 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -3.174 5.243 -6.409 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -2.214 5.790 -5.013 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -3.758 6.587 -5.398 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -3.482 6.632 -8.322 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -4.023 7.965 -7.274 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -2.713 8.232 -8.448 1.00 0.00 H new ATOM 256 N GLU A 16 -0.444 7.298 -3.101 1.00 0.00 N ATOM 257 CA GLU A 16 -0.241 6.259 -2.108 1.00 0.00 C ATOM 258 C GLU A 16 -1.581 5.635 -1.723 1.00 0.00 C ATOM 259 O GLU A 16 -2.557 6.329 -1.433 1.00 0.00 O ATOM 260 CB GLU A 16 0.555 6.781 -0.900 1.00 0.00 C ATOM 261 CG GLU A 16 2.068 6.725 -1.174 1.00 0.00 C ATOM 262 CD GLU A 16 2.868 7.364 -0.026 1.00 0.00 C ATOM 263 OE1 GLU A 16 3.125 8.591 -0.072 1.00 0.00 O ATOM 264 OE2 GLU A 16 3.252 6.645 0.927 1.00 0.00 O ATOM 0 H GLU A 16 -0.878 8.143 -2.731 1.00 0.00 H new ATOM 0 HA GLU A 16 0.371 5.467 -2.541 1.00 0.00 H new ATOM 0 HB2 GLU A 16 0.259 7.807 -0.680 1.00 0.00 H new ATOM 0 HB3 GLU A 16 0.319 6.185 -0.019 1.00 0.00 H new ATOM 0 HG2 GLU A 16 2.378 5.688 -1.303 1.00 0.00 H new ATOM 0 HG3 GLU A 16 2.290 7.243 -2.107 1.00 0.00 H new ATOM 271 N VAL A 17 -1.604 4.308 -1.803 1.00 0.00 N ATOM 272 CA VAL A 17 -2.749 3.399 -1.704 1.00 0.00 C ATOM 273 C VAL A 17 -2.282 2.067 -1.106 1.00 0.00 C ATOM 274 O VAL A 17 -1.146 1.931 -0.653 1.00 0.00 O ATOM 275 CB VAL A 17 -3.380 3.211 -3.108 1.00 0.00 C ATOM 276 CG1 VAL A 17 -4.302 4.375 -3.451 1.00 0.00 C ATOM 277 CG2 VAL A 17 -2.316 2.987 -4.193 1.00 0.00 C ATOM 0 H VAL A 17 -0.739 3.789 -1.953 1.00 0.00 H new ATOM 0 HA VAL A 17 -3.513 3.815 -1.048 1.00 0.00 H new ATOM 0 HB VAL A 17 -3.986 2.305 -3.076 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -4.732 4.219 -4.440 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -5.102 4.435 -2.713 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -3.732 5.304 -3.445 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -2.803 2.860 -5.160 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -1.650 3.849 -4.233 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -1.739 2.093 -3.958 1.00 0.00 H new ATOM 287 N GLU A 18 -3.141 1.058 -1.171 1.00 0.00 N ATOM 288 CA GLU A 18 -2.893 -0.333 -0.791 1.00 0.00 C ATOM 289 C GLU A 18 -3.138 -1.182 -2.041 1.00 0.00 C ATOM 290 O GLU A 18 -3.877 -0.722 -2.913 1.00 0.00 O ATOM 291 CB GLU A 18 -3.868 -0.774 0.319 1.00 0.00 C ATOM 292 CG GLU A 18 -3.936 0.188 1.506 1.00 0.00 C ATOM 293 CD GLU A 18 -4.719 -0.428 2.678 1.00 0.00 C ATOM 294 OE1 GLU A 18 -5.970 -0.352 2.687 1.00 0.00 O ATOM 295 OE2 GLU A 18 -4.089 -0.979 3.613 1.00 0.00 O ATOM 0 H GLU A 18 -4.092 1.195 -1.512 1.00 0.00 H new ATOM 0 HA GLU A 18 -1.877 -0.449 -0.415 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -4.865 -0.879 -0.108 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -3.571 -1.759 0.679 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -2.927 0.439 1.832 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -4.412 1.118 1.196 1.00 0.00 H new ATOM 302 N PRO A 19 -2.634 -2.423 -2.154 1.00 0.00 N ATOM 303 CA PRO A 19 -3.039 -3.309 -3.248 1.00 0.00 C ATOM 304 C PRO A 19 -4.559 -3.499 -3.296 1.00 0.00 C ATOM 305 O PRO A 19 -5.153 -3.520 -4.364 1.00 0.00 O ATOM 306 CB PRO A 19 -2.317 -4.643 -3.010 1.00 0.00 C ATOM 307 CG PRO A 19 -1.197 -4.313 -2.022 1.00 0.00 C ATOM 308 CD PRO A 19 -1.719 -3.102 -1.248 1.00 0.00 C ATOM 0 HA PRO A 19 -2.768 -2.879 -4.212 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -2.996 -5.392 -2.602 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -1.917 -5.047 -3.940 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -0.993 -5.152 -1.357 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -0.266 -4.083 -2.539 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -2.228 -3.410 -0.335 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -0.902 -2.445 -0.951 1.00 0.00 H new ATOM 316 N SER A 20 -5.218 -3.537 -2.144 1.00 0.00 N ATOM 317 CA SER A 20 -6.634 -3.850 -2.035 1.00 0.00 C ATOM 318 C SER A 20 -7.434 -2.562 -1.937 1.00 0.00 C ATOM 319 O SER A 20 -8.605 -2.592 -1.553 1.00 0.00 O ATOM 320 CB SER A 20 -6.865 -4.798 -0.852 1.00 0.00 C ATOM 321 OG SER A 20 -6.012 -5.931 -0.956 1.00 0.00 O ATOM 0 H SER A 20 -4.774 -3.348 -1.245 1.00 0.00 H new ATOM 0 HA SER A 20 -6.982 -4.371 -2.927 1.00 0.00 H new ATOM 0 HB2 SER A 20 -6.674 -4.275 0.085 1.00 0.00 H new ATOM 0 HB3 SER A 20 -7.907 -5.119 -0.832 1.00 0.00 H new ATOM 0 HG SER A 20 -6.167 -6.528 -0.195 1.00 0.00 H new ATOM 327 N ASP A 21 -6.812 -1.422 -2.263 1.00 0.00 N ATOM 328 CA ASP A 21 -7.548 -0.200 -2.402 1.00 0.00 C ATOM 329 C ASP A 21 -8.215 -0.251 -3.772 1.00 0.00 C ATOM 330 O ASP A 21 -7.652 -0.781 -4.751 1.00 0.00 O ATOM 331 CB ASP A 21 -6.617 1.005 -2.224 1.00 0.00 C ATOM 332 CG ASP A 21 -7.100 2.020 -1.170 1.00 0.00 C ATOM 333 OD1 ASP A 21 -8.288 2.000 -0.767 1.00 0.00 O ATOM 334 OD2 ASP A 21 -6.256 2.854 -0.769 1.00 0.00 O ATOM 0 H ASP A 21 -5.809 -1.340 -2.430 1.00 0.00 H new ATOM 0 HA ASP A 21 -8.313 -0.088 -1.634 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -5.627 0.647 -1.942 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -6.511 1.514 -3.182 1.00 0.00 H new ATOM 339 N THR A 22 -9.449 0.235 -3.833 1.00 0.00 N ATOM 340 CA THR A 22 -10.283 0.114 -5.010 1.00 0.00 C ATOM 341 C THR A 22 -9.948 1.160 -6.046 1.00 0.00 C ATOM 342 O THR A 22 -9.488 2.257 -5.720 1.00 0.00 O ATOM 343 CB THR A 22 -11.771 0.221 -4.649 1.00 0.00 C ATOM 344 OG1 THR A 22 -11.947 1.241 -3.679 1.00 0.00 O ATOM 345 CG2 THR A 22 -12.272 -1.114 -4.119 1.00 0.00 C ATOM 0 H THR A 22 -9.897 0.726 -3.059 1.00 0.00 H new ATOM 0 HA THR A 22 -10.083 -0.871 -5.432 1.00 0.00 H new ATOM 0 HB THR A 22 -12.347 0.476 -5.539 1.00 0.00 H new ATOM 0 HG1 THR A 22 -12.897 1.312 -3.448 1.00 0.00 H new ATOM 0 HG21 THR A 22 -13.329 -1.031 -3.865 1.00 0.00 H new ATOM 0 HG22 THR A 22 -12.142 -1.881 -4.883 1.00 0.00 H new ATOM 0 HG23 THR A 22 -11.705 -1.388 -3.229 1.00 0.00 H new ATOM 353 N ILE A 23 -10.270 0.834 -7.293 1.00 0.00 N ATOM 354 CA ILE A 23 -10.234 1.781 -8.392 1.00 0.00 C ATOM 355 C ILE A 23 -11.115 2.991 -8.078 1.00 0.00 C ATOM 356 O ILE A 23 -10.698 4.094 -8.406 1.00 0.00 O ATOM 357 CB ILE A 23 -10.669 1.080 -9.682 1.00 0.00 C ATOM 358 CG1 ILE A 23 -9.828 -0.165 -10.025 1.00 0.00 C ATOM 359 CG2 ILE A 23 -10.674 2.032 -10.890 1.00 0.00 C ATOM 360 CD1 ILE A 23 -8.359 -0.167 -9.603 1.00 0.00 C ATOM 0 H ILE A 23 -10.565 -0.103 -7.568 1.00 0.00 H new ATOM 0 HA ILE A 23 -9.217 2.148 -8.530 1.00 0.00 H new ATOM 0 HB ILE A 23 -11.687 0.749 -9.478 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -10.309 -1.031 -9.570 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -9.867 -0.309 -11.105 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -10.989 1.488 -11.781 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -11.365 2.854 -10.703 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -9.671 2.430 -11.044 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -7.894 -1.104 -9.909 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -7.843 0.667 -10.078 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -8.291 -0.066 -8.520 1.00 0.00 H new ATOM 372 N GLU A 24 -12.270 2.831 -7.427 1.00 0.00 N ATOM 373 CA GLU A 24 -13.105 3.961 -7.015 1.00 0.00 C ATOM 374 C GLU A 24 -12.270 4.951 -6.201 1.00 0.00 C ATOM 375 O GLU A 24 -12.213 6.140 -6.517 1.00 0.00 O ATOM 376 CB GLU A 24 -14.298 3.429 -6.196 1.00 0.00 C ATOM 377 CG GLU A 24 -15.252 4.543 -5.746 1.00 0.00 C ATOM 378 CD GLU A 24 -16.462 3.967 -4.987 1.00 0.00 C ATOM 379 OE1 GLU A 24 -16.375 3.812 -3.745 1.00 0.00 O ATOM 380 OE2 GLU A 24 -17.508 3.683 -5.618 1.00 0.00 O ATOM 0 H GLU A 24 -12.651 1.920 -7.172 1.00 0.00 H new ATOM 0 HA GLU A 24 -13.488 4.486 -7.890 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -14.850 2.704 -6.794 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -13.924 2.900 -5.319 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -14.719 5.246 -5.106 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -15.597 5.103 -6.615 1.00 0.00 H new ATOM 387 N ASN A 25 -11.557 4.440 -5.192 1.00 0.00 N ATOM 388 CA ASN A 25 -10.724 5.269 -4.332 1.00 0.00 C ATOM 389 C ASN A 25 -9.539 5.849 -5.108 1.00 0.00 C ATOM 390 O ASN A 25 -9.210 7.018 -4.947 1.00 0.00 O ATOM 391 CB ASN A 25 -10.306 4.476 -3.076 1.00 0.00 C ATOM 392 CG ASN A 25 -8.798 4.450 -2.883 1.00 0.00 C ATOM 393 OD1 ASN A 25 -8.215 5.314 -2.239 1.00 0.00 O ATOM 394 ND2 ASN A 25 -8.136 3.496 -3.512 1.00 0.00 N ATOM 0 H ASN A 25 -11.544 3.448 -4.954 1.00 0.00 H new ATOM 0 HA ASN A 25 -11.300 6.127 -3.986 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -10.775 4.919 -2.197 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -10.677 3.454 -3.154 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -7.117 3.468 -3.468 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -8.643 2.787 -4.042 1.00 0.00 H new ATOM 401 N VAL A 26 -8.920 5.071 -5.993 1.00 0.00 N ATOM 402 CA VAL A 26 -7.785 5.519 -6.794 1.00 0.00 C ATOM 403 C VAL A 26 -8.239 6.684 -7.667 1.00 0.00 C ATOM 404 O VAL A 26 -7.634 7.746 -7.630 1.00 0.00 O ATOM 405 CB VAL A 26 -7.283 4.329 -7.620 1.00 0.00 C ATOM 406 CG1 VAL A 26 -6.299 4.746 -8.717 1.00 0.00 C ATOM 407 CG2 VAL A 26 -6.625 3.232 -6.774 1.00 0.00 C ATOM 0 H VAL A 26 -9.194 4.106 -6.175 1.00 0.00 H new ATOM 0 HA VAL A 26 -6.961 5.871 -6.174 1.00 0.00 H new ATOM 0 HB VAL A 26 -8.187 3.924 -8.075 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -5.976 3.864 -9.270 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -6.787 5.443 -9.398 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -5.432 5.228 -8.264 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -6.294 2.421 -7.423 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -5.767 3.646 -6.244 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -7.346 2.847 -6.053 1.00 0.00 H new ATOM 417 N LYS A 27 -9.324 6.527 -8.421 1.00 0.00 N ATOM 418 CA LYS A 27 -9.880 7.612 -9.220 1.00 0.00 C ATOM 419 C LYS A 27 -10.216 8.832 -8.381 1.00 0.00 C ATOM 420 O LYS A 27 -10.034 9.946 -8.867 1.00 0.00 O ATOM 421 CB LYS A 27 -11.167 7.144 -9.896 1.00 0.00 C ATOM 422 CG LYS A 27 -11.045 6.080 -10.987 1.00 0.00 C ATOM 423 CD LYS A 27 -12.483 5.689 -11.363 1.00 0.00 C ATOM 424 CE LYS A 27 -12.579 5.094 -12.768 1.00 0.00 C ATOM 425 NZ LYS A 27 -13.969 5.213 -13.308 1.00 0.00 N ATOM 0 H LYS A 27 -9.839 5.649 -8.494 1.00 0.00 H new ATOM 0 HA LYS A 27 -9.121 7.887 -9.952 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -11.832 6.758 -9.123 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -11.655 8.016 -10.330 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -10.508 6.469 -11.852 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -10.487 5.215 -10.628 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -12.861 4.967 -10.639 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -13.124 6.569 -11.300 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -11.882 5.606 -13.432 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -12.283 4.045 -12.743 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -13.942 5.178 -14.347 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -14.549 4.427 -12.950 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -14.384 6.117 -13.003 1.00 0.00 H new ATOM 439 N ALA A 28 -10.695 8.661 -7.150 1.00 0.00 N ATOM 440 CA ALA A 28 -10.946 9.794 -6.262 1.00 0.00 C ATOM 441 C ALA A 28 -9.627 10.504 -5.933 1.00 0.00 C ATOM 442 O ALA A 28 -9.574 11.733 -5.947 1.00 0.00 O ATOM 443 CB ALA A 28 -11.674 9.337 -4.995 1.00 0.00 C ATOM 0 H ALA A 28 -10.916 7.751 -6.746 1.00 0.00 H new ATOM 0 HA ALA A 28 -11.596 10.507 -6.769 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -11.851 10.196 -4.347 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -12.628 8.884 -5.267 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -11.062 8.605 -4.468 1.00 0.00 H new ATOM 449 N LYS A 29 -8.538 9.752 -5.741 1.00 0.00 N ATOM 450 CA LYS A 29 -7.206 10.344 -5.578 1.00 0.00 C ATOM 451 C LYS A 29 -6.788 11.042 -6.871 1.00 0.00 C ATOM 452 O LYS A 29 -6.219 12.120 -6.824 1.00 0.00 O ATOM 453 CB LYS A 29 -6.177 9.295 -5.121 1.00 0.00 C ATOM 454 CG LYS A 29 -6.494 8.777 -3.708 1.00 0.00 C ATOM 455 CD LYS A 29 -5.592 7.624 -3.240 1.00 0.00 C ATOM 456 CE LYS A 29 -5.867 7.338 -1.751 1.00 0.00 C ATOM 457 NZ LYS A 29 -4.855 7.940 -0.837 1.00 0.00 N ATOM 0 H LYS A 29 -8.553 8.733 -5.695 1.00 0.00 H new ATOM 0 HA LYS A 29 -7.247 11.095 -4.789 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -6.169 8.461 -5.823 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -5.179 9.732 -5.134 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -6.404 9.603 -3.002 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -7.532 8.445 -3.680 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -5.784 6.731 -3.836 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -4.544 7.885 -3.385 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -6.854 7.721 -1.491 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -5.892 6.260 -1.594 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -5.176 7.843 0.148 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -3.946 7.449 -0.955 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -4.737 8.948 -1.065 1.00 0.00 H new ATOM 471 N ILE A 30 -7.132 10.499 -8.038 1.00 0.00 N ATOM 472 CA ILE A 30 -6.813 11.148 -9.315 1.00 0.00 C ATOM 473 C ILE A 30 -7.555 12.467 -9.384 1.00 0.00 C ATOM 474 O ILE A 30 -6.962 13.451 -9.764 1.00 0.00 O ATOM 475 CB ILE A 30 -7.147 10.273 -10.546 1.00 0.00 C ATOM 476 CG1 ILE A 30 -6.502 8.881 -10.585 1.00 0.00 C ATOM 477 CG2 ILE A 30 -6.756 10.995 -11.848 1.00 0.00 C ATOM 478 CD1 ILE A 30 -5.187 8.801 -9.833 1.00 0.00 C ATOM 0 H ILE A 30 -7.630 9.614 -8.129 1.00 0.00 H new ATOM 0 HA ILE A 30 -5.735 11.308 -9.349 1.00 0.00 H new ATOM 0 HB ILE A 30 -8.222 10.119 -10.455 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -7.197 8.155 -10.163 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -6.335 8.596 -11.624 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -6.999 10.363 -12.702 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -7.306 11.933 -11.923 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -5.686 11.201 -11.842 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -4.789 7.789 -9.903 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -4.475 9.502 -10.269 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -5.351 9.055 -8.786 1.00 0.00 H new ATOM 490 N GLN A 31 -8.816 12.528 -8.996 1.00 0.00 N ATOM 491 CA GLN A 31 -9.594 13.749 -8.976 1.00 0.00 C ATOM 492 C GLN A 31 -8.956 14.763 -8.038 1.00 0.00 C ATOM 493 O GLN A 31 -8.939 15.945 -8.369 1.00 0.00 O ATOM 494 CB GLN A 31 -11.040 13.462 -8.565 1.00 0.00 C ATOM 495 CG GLN A 31 -11.953 14.679 -8.813 1.00 0.00 C ATOM 496 CD GLN A 31 -12.560 15.179 -7.513 1.00 0.00 C ATOM 497 OE1 GLN A 31 -11.912 15.820 -6.690 1.00 0.00 O ATOM 498 NE2 GLN A 31 -13.817 14.850 -7.295 1.00 0.00 N ATOM 0 H GLN A 31 -9.337 11.711 -8.679 1.00 0.00 H new ATOM 0 HA GLN A 31 -9.608 14.170 -9.982 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -11.415 12.605 -9.125 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -11.072 13.192 -7.510 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -11.380 15.479 -9.282 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -12.747 14.407 -9.508 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -14.333 14.317 -7.995 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -14.274 15.128 -6.426 1.00 0.00 H new ATOM 507 N ASP A 32 -8.368 14.316 -6.929 1.00 0.00 N ATOM 508 CA ASP A 32 -7.661 15.234 -6.056 1.00 0.00 C ATOM 509 C ASP A 32 -6.445 15.817 -6.789 1.00 0.00 C ATOM 510 O ASP A 32 -6.141 17.000 -6.615 1.00 0.00 O ATOM 511 CB ASP A 32 -7.220 14.544 -4.762 1.00 0.00 C ATOM 512 CG ASP A 32 -6.262 15.441 -3.950 1.00 0.00 C ATOM 513 OD1 ASP A 32 -6.757 16.244 -3.124 1.00 0.00 O ATOM 514 OD2 ASP A 32 -5.022 15.334 -4.124 1.00 0.00 O ATOM 0 H ASP A 32 -8.369 13.343 -6.623 1.00 0.00 H new ATOM 0 HA ASP A 32 -8.342 16.042 -5.787 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -8.095 14.303 -4.159 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -6.727 13.601 -4.999 1.00 0.00 H new ATOM 519 N LYS A 33 -5.760 15.020 -7.633 1.00 0.00 N ATOM 520 CA LYS A 33 -4.478 15.422 -8.195 1.00 0.00 C ATOM 521 C LYS A 33 -4.634 16.118 -9.557 1.00 0.00 C ATOM 522 O LYS A 33 -3.846 16.996 -9.901 1.00 0.00 O ATOM 523 CB LYS A 33 -3.575 14.189 -8.281 1.00 0.00 C ATOM 524 CG LYS A 33 -3.468 13.379 -6.960 1.00 0.00 C ATOM 525 CD LYS A 33 -2.095 13.383 -6.274 1.00 0.00 C ATOM 526 CE LYS A 33 -1.569 14.783 -5.942 1.00 0.00 C ATOM 527 NZ LYS A 33 -2.229 15.379 -4.742 1.00 0.00 N ATOM 0 H LYS A 33 -6.081 14.099 -7.933 1.00 0.00 H new ATOM 0 HA LYS A 33 -4.017 16.162 -7.541 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -3.951 13.533 -9.066 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -2.576 14.505 -8.581 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -4.204 13.770 -6.257 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -3.744 12.345 -7.168 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -2.158 12.802 -5.354 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -1.376 12.880 -6.920 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -0.494 14.731 -5.772 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -1.725 15.438 -6.800 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -2.047 16.403 -4.718 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -3.254 15.211 -4.790 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -1.846 14.939 -3.881 1.00 0.00 H new ATOM 541 N GLU A 34 -5.698 15.775 -10.279 1.00 0.00 N ATOM 542 CA GLU A 34 -5.941 16.120 -11.677 1.00 0.00 C ATOM 543 C GLU A 34 -7.189 16.982 -11.865 1.00 0.00 C ATOM 544 O GLU A 34 -7.212 17.842 -12.744 1.00 0.00 O ATOM 545 CB GLU A 34 -6.107 14.806 -12.466 1.00 0.00 C ATOM 546 CG GLU A 34 -4.866 13.906 -12.424 1.00 0.00 C ATOM 547 CD GLU A 34 -3.571 14.697 -12.642 1.00 0.00 C ATOM 548 OE1 GLU A 34 -3.404 15.325 -13.711 1.00 0.00 O ATOM 549 OE2 GLU A 34 -2.717 14.711 -11.728 1.00 0.00 O ATOM 0 H GLU A 34 -6.455 15.218 -9.882 1.00 0.00 H new ATOM 0 HA GLU A 34 -5.095 16.706 -12.037 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -6.959 14.256 -12.065 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -6.340 15.042 -13.504 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -4.821 13.396 -11.462 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -4.952 13.135 -13.189 1.00 0.00 H new ATOM 556 N GLY A 35 -8.212 16.768 -11.039 1.00 0.00 N ATOM 557 CA GLY A 35 -9.441 17.548 -11.067 1.00 0.00 C ATOM 558 C GLY A 35 -10.467 16.939 -12.016 1.00 0.00 C ATOM 559 O GLY A 35 -11.334 17.659 -12.511 1.00 0.00 O ATOM 0 H GLY A 35 -8.207 16.040 -10.325 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -9.861 17.604 -10.063 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -9.218 18.569 -11.377 1.00 0.00 H new ATOM 563 N ILE A 36 -10.379 15.627 -12.278 1.00 0.00 N ATOM 564 CA ILE A 36 -11.264 14.937 -13.199 1.00 0.00 C ATOM 565 C ILE A 36 -12.161 14.110 -12.304 1.00 0.00 C ATOM 566 O ILE A 36 -11.616 13.339 -11.516 1.00 0.00 O ATOM 567 CB ILE A 36 -10.469 14.007 -14.125 1.00 0.00 C ATOM 568 CG1 ILE A 36 -9.385 14.744 -14.923 1.00 0.00 C ATOM 569 CG2 ILE A 36 -11.448 13.320 -15.093 1.00 0.00 C ATOM 570 CD1 ILE A 36 -8.378 13.727 -15.432 1.00 0.00 C ATOM 0 H ILE A 36 -9.682 15.019 -11.848 1.00 0.00 H new ATOM 0 HA ILE A 36 -11.812 15.631 -13.837 1.00 0.00 H new ATOM 0 HB ILE A 36 -9.956 13.275 -13.501 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -9.832 15.284 -15.758 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -8.890 15.484 -14.294 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -10.896 12.655 -15.758 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -12.176 12.742 -14.524 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -11.966 14.076 -15.684 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -7.601 14.238 -16.001 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -7.926 13.208 -14.587 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -8.883 13.005 -16.074 1.00 0.00 H new ATOM 582 N PRO A 37 -13.489 14.183 -12.421 1.00 0.00 N ATOM 583 CA PRO A 37 -14.380 13.361 -11.624 1.00 0.00 C ATOM 584 C PRO A 37 -14.100 11.876 -11.846 1.00 0.00 C ATOM 585 O PRO A 37 -13.776 11.484 -12.966 1.00 0.00 O ATOM 586 CB PRO A 37 -15.802 13.778 -11.993 1.00 0.00 C ATOM 587 CG PRO A 37 -15.656 14.974 -12.934 1.00 0.00 C ATOM 588 CD PRO A 37 -14.216 14.917 -13.435 1.00 0.00 C ATOM 0 HA PRO A 37 -14.227 13.512 -10.555 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -16.335 12.961 -12.479 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -16.373 14.047 -11.105 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -16.363 14.913 -13.761 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -15.855 15.911 -12.414 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -14.155 14.418 -14.402 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -13.805 15.918 -13.567 1.00 0.00 H new ATOM 596 N PRO A 38 -14.244 11.020 -10.823 1.00 0.00 N ATOM 597 CA PRO A 38 -13.957 9.599 -10.975 1.00 0.00 C ATOM 598 C PRO A 38 -14.866 8.941 -11.987 1.00 0.00 C ATOM 599 O PRO A 38 -14.420 8.089 -12.751 1.00 0.00 O ATOM 600 CB PRO A 38 -14.157 8.993 -9.590 1.00 0.00 C ATOM 601 CG PRO A 38 -15.049 9.981 -8.840 1.00 0.00 C ATOM 602 CD PRO A 38 -14.665 11.322 -9.459 1.00 0.00 C ATOM 0 HA PRO A 38 -12.945 9.444 -11.348 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -14.626 8.011 -9.655 1.00 0.00 H new ATOM 0 HB3 PRO A 38 -13.204 8.858 -9.079 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -16.107 9.759 -8.981 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -14.860 9.962 -7.767 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -15.509 12.012 -9.453 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -13.861 11.797 -8.897 1.00 0.00 H new ATOM 610 N ASP A 39 -16.116 9.392 -12.057 1.00 0.00 N ATOM 611 CA ASP A 39 -17.068 8.810 -12.997 1.00 0.00 C ATOM 612 C ASP A 39 -16.663 9.085 -14.446 1.00 0.00 C ATOM 613 O ASP A 39 -17.021 8.331 -15.347 1.00 0.00 O ATOM 614 CB ASP A 39 -18.470 9.351 -12.714 1.00 0.00 C ATOM 615 CG ASP A 39 -19.493 8.805 -13.726 1.00 0.00 C ATOM 616 OD1 ASP A 39 -19.976 7.664 -13.544 1.00 0.00 O ATOM 617 OD2 ASP A 39 -19.809 9.515 -14.710 1.00 0.00 O ATOM 0 H ASP A 39 -16.489 10.148 -11.483 1.00 0.00 H new ATOM 0 HA ASP A 39 -17.069 7.729 -12.860 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -18.772 9.075 -11.704 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -18.458 10.440 -12.757 1.00 0.00 H new ATOM 622 N GLN A 40 -15.861 10.132 -14.672 1.00 0.00 N ATOM 623 CA GLN A 40 -15.408 10.506 -16.012 1.00 0.00 C ATOM 624 C GLN A 40 -14.123 9.764 -16.387 1.00 0.00 C ATOM 625 O GLN A 40 -13.794 9.681 -17.569 1.00 0.00 O ATOM 626 CB GLN A 40 -15.199 12.032 -16.074 1.00 0.00 C ATOM 627 CG GLN A 40 -15.243 12.589 -17.514 1.00 0.00 C ATOM 628 CD GLN A 40 -16.646 13.006 -17.967 1.00 0.00 C ATOM 629 OE1 GLN A 40 -17.640 12.356 -17.656 1.00 0.00 O ATOM 630 NE2 GLN A 40 -16.753 14.075 -18.739 1.00 0.00 N ATOM 0 H GLN A 40 -15.510 10.740 -13.932 1.00 0.00 H new ATOM 0 HA GLN A 40 -16.171 10.220 -16.735 1.00 0.00 H new ATOM 0 HB2 GLN A 40 -15.967 12.523 -15.477 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -14.238 12.280 -15.623 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -14.577 13.449 -17.582 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -14.859 11.833 -18.199 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -15.920 14.607 -18.991 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -17.668 14.367 -19.082 1.00 0.00 H new ATOM 639 N GLN A 41 -13.366 9.246 -15.414 1.00 0.00 N ATOM 640 CA GLN A 41 -12.099 8.588 -15.685 1.00 0.00 C ATOM 641 C GLN A 41 -12.366 7.195 -16.207 1.00 0.00 C ATOM 642 O GLN A 41 -13.291 6.513 -15.772 1.00 0.00 O ATOM 643 CB GLN A 41 -11.275 8.487 -14.385 1.00 0.00 C ATOM 644 CG GLN A 41 -10.642 9.817 -13.948 1.00 0.00 C ATOM 645 CD GLN A 41 -10.207 9.745 -12.496 1.00 0.00 C ATOM 646 OE1 GLN A 41 -9.539 8.800 -12.119 1.00 0.00 O ATOM 647 NE2 GLN A 41 -10.598 10.672 -11.635 1.00 0.00 N ATOM 0 H GLN A 41 -13.618 9.274 -14.426 1.00 0.00 H new ATOM 0 HA GLN A 41 -11.543 9.165 -16.424 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -11.919 8.121 -13.585 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -10.486 7.747 -14.522 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -9.784 10.043 -14.580 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -11.358 10.628 -14.080 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -11.158 11.462 -11.956 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -10.339 10.596 -10.651 1.00 0.00 H new ATOM 656 N ARG A 42 -11.460 6.735 -17.054 1.00 0.00 N ATOM 657 CA ARG A 42 -11.414 5.384 -17.574 1.00 0.00 C ATOM 658 C ARG A 42 -9.986 4.945 -17.316 1.00 0.00 C ATOM 659 O ARG A 42 -9.074 5.385 -18.001 1.00 0.00 O ATOM 660 CB ARG A 42 -11.851 5.459 -19.043 1.00 0.00 C ATOM 661 CG ARG A 42 -12.119 4.071 -19.637 1.00 0.00 C ATOM 662 CD ARG A 42 -13.174 4.127 -20.751 1.00 0.00 C ATOM 663 NE ARG A 42 -12.663 4.679 -22.027 1.00 0.00 N ATOM 664 CZ ARG A 42 -12.624 4.021 -23.199 1.00 0.00 C ATOM 665 NH1 ARG A 42 -12.767 2.709 -23.261 1.00 0.00 N ATOM 666 NH2 ARG A 42 -12.446 4.686 -24.326 1.00 0.00 N ATOM 0 H ARG A 42 -10.705 7.321 -17.412 1.00 0.00 H new ATOM 0 HA ARG A 42 -12.078 4.649 -17.119 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -12.752 6.067 -19.122 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -11.077 5.959 -19.626 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -11.191 3.659 -20.034 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -12.456 3.397 -18.850 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -13.557 3.122 -20.928 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -14.014 4.734 -20.413 1.00 0.00 H new ATOM 0 HE ARG A 42 -12.312 5.637 -22.016 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -12.911 2.171 -22.407 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -12.733 2.234 -24.163 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -12.338 5.700 -24.308 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -12.417 4.186 -25.214 1.00 0.00 H new ATOM 680 N LEU A 43 -9.761 4.245 -16.214 1.00 0.00 N ATOM 681 CA LEU A 43 -8.414 3.942 -15.753 1.00 0.00 C ATOM 682 C LEU A 43 -7.972 2.746 -16.562 1.00 0.00 C ATOM 683 O LEU A 43 -8.746 1.812 -16.735 1.00 0.00 O ATOM 684 CB LEU A 43 -8.440 3.644 -14.237 1.00 0.00 C ATOM 685 CG LEU A 43 -7.325 4.337 -13.444 1.00 0.00 C ATOM 686 CD1 LEU A 43 -7.395 5.876 -13.530 1.00 0.00 C ATOM 687 CD2 LEU A 43 -7.514 3.941 -11.980 1.00 0.00 C ATOM 0 H LEU A 43 -10.501 3.873 -15.618 1.00 0.00 H new ATOM 0 HA LEU A 43 -7.720 4.771 -15.890 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -9.404 3.953 -13.833 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -8.362 2.567 -14.088 1.00 0.00 H new ATOM 0 HG LEU A 43 -6.364 4.030 -13.857 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -6.581 6.310 -12.949 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -7.304 6.187 -14.571 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -8.349 6.220 -13.131 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -6.741 4.412 -11.373 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -8.495 4.271 -11.638 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -7.441 2.858 -11.884 1.00 0.00 H new ATOM 699 N ILE A 44 -6.747 2.769 -17.058 1.00 0.00 N ATOM 700 CA ILE A 44 -6.184 1.665 -17.823 1.00 0.00 C ATOM 701 C ILE A 44 -4.936 1.224 -17.085 1.00 0.00 C ATOM 702 O ILE A 44 -4.303 2.008 -16.381 1.00 0.00 O ATOM 703 CB ILE A 44 -5.984 2.091 -19.304 1.00 0.00 C ATOM 704 CG1 ILE A 44 -7.369 2.469 -19.889 1.00 0.00 C ATOM 705 CG2 ILE A 44 -5.298 1.003 -20.157 1.00 0.00 C ATOM 706 CD1 ILE A 44 -7.462 2.618 -21.412 1.00 0.00 C ATOM 0 H ILE A 44 -6.110 3.557 -16.942 1.00 0.00 H new ATOM 0 HA ILE A 44 -6.844 0.800 -17.892 1.00 0.00 H new ATOM 0 HB ILE A 44 -5.311 2.948 -19.331 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -8.087 1.710 -19.578 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -7.683 3.410 -19.436 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -5.186 1.360 -21.181 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -4.315 0.780 -19.741 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -5.907 0.099 -20.152 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -8.482 2.884 -21.690 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -6.780 3.401 -21.743 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -7.190 1.675 -21.887 1.00 0.00 H new ATOM 718 N PHE A 45 -4.588 -0.041 -17.252 1.00 0.00 N ATOM 719 CA PHE A 45 -3.378 -0.620 -16.723 1.00 0.00 C ATOM 720 C PHE A 45 -2.888 -1.591 -17.769 1.00 0.00 C ATOM 721 O PHE A 45 -3.616 -2.511 -18.120 1.00 0.00 O ATOM 722 CB PHE A 45 -3.696 -1.356 -15.424 1.00 0.00 C ATOM 723 CG PHE A 45 -2.543 -2.195 -14.928 1.00 0.00 C ATOM 724 CD1 PHE A 45 -1.317 -1.569 -14.664 1.00 0.00 C ATOM 725 CD2 PHE A 45 -2.676 -3.587 -14.781 1.00 0.00 C ATOM 726 CE1 PHE A 45 -0.218 -2.332 -14.226 1.00 0.00 C ATOM 727 CE2 PHE A 45 -1.586 -4.348 -14.326 1.00 0.00 C ATOM 728 CZ PHE A 45 -0.364 -3.719 -14.037 1.00 0.00 C ATOM 0 H PHE A 45 -5.159 -0.706 -17.774 1.00 0.00 H new ATOM 0 HA PHE A 45 -2.624 0.136 -16.505 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -3.967 -0.630 -14.658 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -4.565 -1.996 -15.578 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -1.216 -0.502 -14.797 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -3.613 -4.070 -15.017 1.00 0.00 H new ATOM 0 HE1 PHE A 45 0.732 -1.855 -14.036 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -1.688 -5.416 -14.199 1.00 0.00 H new ATOM 0 HZ PHE A 45 0.467 -4.302 -13.668 1.00 0.00 H new ATOM 738 N ALA A 46 -1.681 -1.379 -18.295 1.00 0.00 N ATOM 739 CA ALA A 46 -0.966 -2.326 -19.155 1.00 0.00 C ATOM 740 C ALA A 46 -1.773 -2.880 -20.340 1.00 0.00 C ATOM 741 O ALA A 46 -1.536 -3.990 -20.820 1.00 0.00 O ATOM 742 CB ALA A 46 -0.380 -3.422 -18.263 1.00 0.00 C ATOM 0 H ALA A 46 -1.158 -0.519 -18.130 1.00 0.00 H new ATOM 0 HA ALA A 46 -0.169 -1.781 -19.660 1.00 0.00 H new ATOM 0 HB1 ALA A 46 0.159 -4.142 -18.878 1.00 0.00 H new ATOM 0 HB2 ALA A 46 0.305 -2.977 -17.542 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -1.186 -3.929 -17.733 1.00 0.00 H new ATOM 748 N GLY A 47 -2.734 -2.088 -20.811 1.00 0.00 N ATOM 749 CA GLY A 47 -3.558 -2.374 -21.978 1.00 0.00 C ATOM 750 C GLY A 47 -4.956 -2.871 -21.645 1.00 0.00 C ATOM 751 O GLY A 47 -5.706 -3.176 -22.573 1.00 0.00 O ATOM 0 H GLY A 47 -2.967 -1.197 -20.372 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -3.640 -1.470 -22.582 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -3.054 -3.122 -22.590 1.00 0.00 H new ATOM 755 N LYS A 48 -5.337 -2.917 -20.363 1.00 0.00 N ATOM 756 CA LYS A 48 -6.695 -3.278 -19.960 1.00 0.00 C ATOM 757 C LYS A 48 -7.280 -2.205 -19.066 1.00 0.00 C ATOM 758 O LYS A 48 -6.595 -1.649 -18.225 1.00 0.00 O ATOM 759 CB LYS A 48 -6.716 -4.693 -19.353 1.00 0.00 C ATOM 760 CG LYS A 48 -6.034 -4.844 -17.978 1.00 0.00 C ATOM 761 CD LYS A 48 -6.075 -6.286 -17.442 1.00 0.00 C ATOM 762 CE LYS A 48 -5.248 -7.253 -18.308 1.00 0.00 C ATOM 763 NZ LYS A 48 -5.241 -8.637 -17.758 1.00 0.00 N ATOM 0 H LYS A 48 -4.715 -2.706 -19.583 1.00 0.00 H new ATOM 0 HA LYS A 48 -7.346 -3.323 -20.833 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -7.754 -5.012 -19.260 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -6.234 -5.375 -20.053 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -4.996 -4.521 -18.056 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -6.521 -4.182 -17.262 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -5.697 -6.303 -16.420 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -7.109 -6.628 -17.405 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -5.653 -7.268 -19.320 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -4.224 -6.888 -18.380 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -4.672 -9.252 -18.374 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -4.831 -8.629 -16.802 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -6.215 -8.998 -17.713 1.00 0.00 H new ATOM 777 N GLN A 49 -8.533 -1.855 -19.289 1.00 0.00 N ATOM 778 CA GLN A 49 -9.285 -0.920 -18.459 1.00 0.00 C ATOM 779 C GLN A 49 -9.540 -1.569 -17.095 1.00 0.00 C ATOM 780 O GLN A 49 -9.640 -2.793 -16.990 1.00 0.00 O ATOM 781 CB GLN A 49 -10.617 -0.591 -19.147 1.00 0.00 C ATOM 782 CG GLN A 49 -10.443 0.151 -20.483 1.00 0.00 C ATOM 783 CD GLN A 49 -11.712 0.091 -21.328 1.00 0.00 C ATOM 784 OE1 GLN A 49 -12.633 0.881 -21.138 1.00 0.00 O ATOM 785 NE2 GLN A 49 -11.790 -0.814 -22.291 1.00 0.00 N ATOM 0 H GLN A 49 -9.074 -2.221 -20.072 1.00 0.00 H new ATOM 0 HA GLN A 49 -8.722 0.003 -18.321 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -11.166 -1.516 -19.322 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -11.224 0.018 -18.477 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -10.182 1.192 -20.291 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -9.614 -0.288 -21.038 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -11.020 -1.466 -22.442 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -12.620 -0.859 -22.882 1.00 0.00 H new ATOM 794 N LEU A 50 -9.712 -0.730 -16.074 1.00 0.00 N ATOM 795 CA LEU A 50 -10.139 -1.135 -14.737 1.00 0.00 C ATOM 796 C LEU A 50 -11.495 -0.483 -14.459 1.00 0.00 C ATOM 797 O LEU A 50 -11.813 0.542 -15.071 1.00 0.00 O ATOM 798 CB LEU A 50 -9.100 -0.737 -13.666 1.00 0.00 C ATOM 799 CG LEU A 50 -7.604 -0.789 -14.036 1.00 0.00 C ATOM 800 CD1 LEU A 50 -6.751 -0.472 -12.800 1.00 0.00 C ATOM 801 CD2 LEU A 50 -7.172 -2.125 -14.645 1.00 0.00 C ATOM 0 H LEU A 50 -9.554 0.274 -16.157 1.00 0.00 H new ATOM 0 HA LEU A 50 -10.228 -2.220 -14.692 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -9.327 0.280 -13.346 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -9.250 -1.384 -12.802 1.00 0.00 H new ATOM 0 HG LEU A 50 -7.446 -0.035 -14.807 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -5.695 -0.510 -13.067 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -6.997 0.525 -12.434 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -6.955 -1.205 -12.020 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -6.108 -2.090 -14.881 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -7.360 -2.928 -13.932 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -7.740 -2.310 -15.557 1.00 0.00 H new ATOM 813 N GLU A 51 -12.261 -1.016 -13.504 1.00 0.00 N ATOM 814 CA GLU A 51 -13.568 -0.475 -13.124 1.00 0.00 C ATOM 815 C GLU A 51 -13.594 -0.229 -11.615 1.00 0.00 C ATOM 816 O GLU A 51 -12.852 -0.857 -10.864 1.00 0.00 O ATOM 817 CB GLU A 51 -14.716 -1.364 -13.644 1.00 0.00 C ATOM 818 CG GLU A 51 -14.765 -2.727 -12.953 1.00 0.00 C ATOM 819 CD GLU A 51 -15.853 -3.697 -13.453 1.00 0.00 C ATOM 820 OE1 GLU A 51 -16.796 -3.289 -14.175 1.00 0.00 O ATOM 821 OE2 GLU A 51 -15.765 -4.898 -13.089 1.00 0.00 O ATOM 0 H GLU A 51 -11.990 -1.841 -12.969 1.00 0.00 H new ATOM 0 HA GLU A 51 -13.729 0.490 -13.604 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -15.665 -0.850 -13.493 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -14.600 -1.509 -14.718 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -13.794 -3.208 -13.072 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -14.912 -2.566 -11.885 1.00 0.00 H new ATOM 828 N ASP A 52 -14.466 0.679 -11.179 1.00 0.00 N ATOM 829 CA ASP A 52 -14.536 1.261 -9.833 1.00 0.00 C ATOM 830 C ASP A 52 -14.587 0.214 -8.733 1.00 0.00 C ATOM 831 O ASP A 52 -13.930 0.369 -7.703 1.00 0.00 O ATOM 832 CB ASP A 52 -15.764 2.183 -9.735 1.00 0.00 C ATOM 833 CG ASP A 52 -15.514 3.542 -10.393 1.00 0.00 C ATOM 834 OD1 ASP A 52 -15.420 3.592 -11.640 1.00 0.00 O ATOM 835 OD2 ASP A 52 -15.377 4.556 -9.673 1.00 0.00 O ATOM 0 H ASP A 52 -15.190 1.054 -11.793 1.00 0.00 H new ATOM 0 HA ASP A 52 -13.619 1.830 -9.682 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -16.618 1.701 -10.211 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -16.024 2.330 -8.687 1.00 0.00 H new ATOM 840 N GLY A 53 -15.324 -0.870 -8.977 1.00 0.00 N ATOM 841 CA GLY A 53 -15.614 -1.894 -7.989 1.00 0.00 C ATOM 842 C GLY A 53 -14.467 -2.872 -7.738 1.00 0.00 C ATOM 843 O GLY A 53 -14.665 -3.861 -7.030 1.00 0.00 O ATOM 0 H GLY A 53 -15.742 -1.059 -9.888 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -15.875 -1.410 -7.048 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -16.490 -2.456 -8.312 1.00 0.00 H new ATOM 847 N ARG A 54 -13.294 -2.652 -8.338 1.00 0.00 N ATOM 848 CA ARG A 54 -12.186 -3.607 -8.351 1.00 0.00 C ATOM 849 C ARG A 54 -11.010 -2.980 -7.638 1.00 0.00 C ATOM 850 O ARG A 54 -11.081 -1.813 -7.272 1.00 0.00 O ATOM 851 CB ARG A 54 -11.870 -3.944 -9.810 1.00 0.00 C ATOM 852 CG ARG A 54 -13.063 -4.499 -10.608 1.00 0.00 C ATOM 853 CD ARG A 54 -13.465 -5.951 -10.352 1.00 0.00 C ATOM 854 NE ARG A 54 -12.619 -6.866 -11.124 1.00 0.00 N ATOM 855 CZ ARG A 54 -12.757 -7.253 -12.398 1.00 0.00 C ATOM 856 NH1 ARG A 54 -13.776 -6.864 -13.165 1.00 0.00 N ATOM 857 NH2 ARG A 54 -11.820 -8.058 -12.882 1.00 0.00 N ATOM 0 H ARG A 54 -13.085 -1.788 -8.838 1.00 0.00 H new ATOM 0 HA ARG A 54 -12.434 -4.534 -7.834 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -11.503 -3.046 -10.306 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -11.061 -4.674 -9.834 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -13.928 -3.869 -10.403 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -12.837 -4.394 -11.669 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -13.377 -6.176 -9.289 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -14.510 -6.098 -10.624 1.00 0.00 H new ATOM 0 HE ARG A 54 -11.821 -7.259 -10.625 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -14.493 -6.245 -12.786 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -13.839 -7.185 -14.131 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -11.044 -8.351 -12.289 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -11.876 -8.383 -13.847 1.00 0.00 H new ATOM 871 N THR A 55 -9.918 -3.699 -7.446 1.00 0.00 N ATOM 872 CA THR A 55 -8.792 -3.232 -6.656 1.00 0.00 C ATOM 873 C THR A 55 -7.523 -3.406 -7.445 1.00 0.00 C ATOM 874 O THR A 55 -7.502 -4.112 -8.453 1.00 0.00 O ATOM 875 CB THR A 55 -8.722 -4.022 -5.342 1.00 0.00 C ATOM 876 OG1 THR A 55 -8.798 -5.410 -5.598 1.00 0.00 O ATOM 877 CG2 THR A 55 -9.847 -3.660 -4.381 1.00 0.00 C ATOM 0 H THR A 55 -9.787 -4.632 -7.837 1.00 0.00 H new ATOM 0 HA THR A 55 -8.919 -2.175 -6.420 1.00 0.00 H new ATOM 0 HB THR A 55 -7.770 -3.761 -4.880 1.00 0.00 H new ATOM 0 HG1 THR A 55 -7.981 -5.847 -5.277 1.00 0.00 H new ATOM 0 HG21 THR A 55 -9.749 -4.248 -3.468 1.00 0.00 H new ATOM 0 HG22 THR A 55 -9.790 -2.599 -4.137 1.00 0.00 H new ATOM 0 HG23 THR A 55 -10.808 -3.873 -4.849 1.00 0.00 H new ATOM 885 N LEU A 56 -6.450 -2.775 -6.983 1.00 0.00 N ATOM 886 CA LEU A 56 -5.164 -2.893 -7.682 1.00 0.00 C ATOM 887 C LEU A 56 -4.726 -4.362 -7.729 1.00 0.00 C ATOM 888 O LEU A 56 -4.313 -4.878 -8.766 1.00 0.00 O ATOM 889 CB LEU A 56 -4.113 -1.974 -7.023 1.00 0.00 C ATOM 890 CG LEU A 56 -4.588 -0.523 -6.867 1.00 0.00 C ATOM 891 CD1 LEU A 56 -3.504 0.341 -6.240 1.00 0.00 C ATOM 892 CD2 LEU A 56 -4.976 0.057 -8.234 1.00 0.00 C ATOM 0 H LEU A 56 -6.436 -2.189 -6.149 1.00 0.00 H new ATOM 0 HA LEU A 56 -5.271 -2.559 -8.714 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -3.856 -2.373 -6.041 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -3.202 -1.988 -7.621 1.00 0.00 H new ATOM 0 HG LEU A 56 -5.458 -0.523 -6.211 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -3.866 1.364 -6.141 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -3.250 -0.051 -5.255 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -2.618 0.330 -6.874 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -5.311 1.087 -8.110 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -4.112 0.034 -8.898 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -5.781 -0.537 -8.666 1.00 0.00 H new ATOM 904 N SER A 57 -4.933 -5.063 -6.625 1.00 0.00 N ATOM 905 CA SER A 57 -4.706 -6.481 -6.456 1.00 0.00 C ATOM 906 C SER A 57 -5.543 -7.336 -7.398 1.00 0.00 C ATOM 907 O SER A 57 -5.039 -8.357 -7.869 1.00 0.00 O ATOM 908 CB SER A 57 -5.024 -6.855 -5.014 1.00 0.00 C ATOM 909 OG SER A 57 -6.257 -6.297 -4.575 1.00 0.00 O ATOM 0 H SER A 57 -5.286 -4.625 -5.774 1.00 0.00 H new ATOM 0 HA SER A 57 -3.662 -6.679 -6.697 1.00 0.00 H new ATOM 0 HB2 SER A 57 -5.065 -7.940 -4.922 1.00 0.00 H new ATOM 0 HB3 SER A 57 -4.219 -6.510 -4.365 1.00 0.00 H new ATOM 0 HG SER A 57 -6.424 -6.562 -3.646 1.00 0.00 H new ATOM 915 N ASP A 58 -6.772 -6.922 -7.738 1.00 0.00 N ATOM 916 CA ASP A 58 -7.609 -7.680 -8.664 1.00 0.00 C ATOM 917 C ASP A 58 -6.962 -7.733 -10.048 1.00 0.00 C ATOM 918 O ASP A 58 -7.122 -8.703 -10.790 1.00 0.00 O ATOM 919 CB ASP A 58 -8.995 -7.055 -8.759 1.00 0.00 C ATOM 920 CG ASP A 58 -9.936 -8.045 -9.458 1.00 0.00 C ATOM 921 OD1 ASP A 58 -10.534 -8.904 -8.770 1.00 0.00 O ATOM 922 OD2 ASP A 58 -10.117 -7.949 -10.692 1.00 0.00 O ATOM 0 H ASP A 58 -7.203 -6.068 -7.384 1.00 0.00 H new ATOM 0 HA ASP A 58 -7.707 -8.697 -8.285 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -9.370 -6.816 -7.764 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -8.950 -6.119 -9.316 1.00 0.00 H new ATOM 927 N TYR A 59 -6.141 -6.719 -10.332 1.00 0.00 N ATOM 928 CA TYR A 59 -5.395 -6.560 -11.575 1.00 0.00 C ATOM 929 C TYR A 59 -3.914 -6.938 -11.392 1.00 0.00 C ATOM 930 O TYR A 59 -3.114 -6.795 -12.314 1.00 0.00 O ATOM 931 CB TYR A 59 -5.621 -5.138 -12.095 1.00 0.00 C ATOM 932 CG TYR A 59 -7.065 -4.892 -12.481 1.00 0.00 C ATOM 933 CD1 TYR A 59 -7.592 -5.517 -13.629 1.00 0.00 C ATOM 934 CD2 TYR A 59 -7.896 -4.084 -11.680 1.00 0.00 C ATOM 935 CE1 TYR A 59 -8.937 -5.333 -13.988 1.00 0.00 C ATOM 936 CE2 TYR A 59 -9.243 -3.916 -12.024 1.00 0.00 C ATOM 937 CZ TYR A 59 -9.778 -4.532 -13.177 1.00 0.00 C ATOM 938 OH TYR A 59 -11.082 -4.314 -13.516 1.00 0.00 O ATOM 0 H TYR A 59 -5.974 -5.958 -9.674 1.00 0.00 H new ATOM 0 HA TYR A 59 -5.760 -7.251 -12.335 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -5.325 -4.422 -11.329 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -4.981 -4.963 -12.960 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -6.956 -6.143 -14.238 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -7.496 -3.596 -10.804 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -9.329 -5.800 -14.879 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -9.881 -3.308 -11.400 1.00 0.00 H new ATOM 0 HH TYR A 59 -11.516 -5.170 -13.716 1.00 0.00 H new ATOM 948 N ASN A 60 -3.570 -7.459 -10.208 1.00 0.00 N ATOM 949 CA ASN A 60 -2.245 -7.918 -9.782 1.00 0.00 C ATOM 950 C ASN A 60 -1.198 -6.795 -9.848 1.00 0.00 C ATOM 951 O ASN A 60 0.003 -7.061 -9.898 1.00 0.00 O ATOM 952 CB ASN A 60 -1.806 -9.210 -10.509 1.00 0.00 C ATOM 953 CG ASN A 60 -2.792 -10.383 -10.486 1.00 0.00 C ATOM 954 OD1 ASN A 60 -2.773 -11.215 -11.389 1.00 0.00 O ATOM 955 ND2 ASN A 60 -3.663 -10.509 -9.486 1.00 0.00 N ATOM 0 H ASN A 60 -4.263 -7.579 -9.469 1.00 0.00 H new ATOM 0 HA ASN A 60 -2.325 -8.191 -8.730 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -1.598 -8.961 -11.550 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -0.867 -9.546 -10.068 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -4.312 -11.295 -9.471 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -3.680 -9.819 -8.735 1.00 0.00 H new ATOM 962 N ILE A 61 -1.651 -5.539 -9.830 1.00 0.00 N ATOM 963 CA ILE A 61 -0.818 -4.356 -9.664 1.00 0.00 C ATOM 964 C ILE A 61 -0.264 -4.449 -8.240 1.00 0.00 C ATOM 965 O ILE A 61 -0.940 -4.936 -7.328 1.00 0.00 O ATOM 966 CB ILE A 61 -1.710 -3.113 -9.858 1.00 0.00 C ATOM 967 CG1 ILE A 61 -2.331 -3.044 -11.268 1.00 0.00 C ATOM 968 CG2 ILE A 61 -0.981 -1.783 -9.574 1.00 0.00 C ATOM 969 CD1 ILE A 61 -3.619 -2.225 -11.300 1.00 0.00 C ATOM 0 H ILE A 61 -2.641 -5.315 -9.934 1.00 0.00 H new ATOM 0 HA ILE A 61 0.000 -4.286 -10.381 1.00 0.00 H new ATOM 0 HB ILE A 61 -2.502 -3.236 -9.119 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -1.609 -2.607 -11.958 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -2.538 -4.055 -11.620 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -1.668 -0.951 -9.730 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -0.629 -1.774 -8.543 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -0.131 -1.683 -10.249 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -4.015 -2.208 -12.316 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -4.353 -2.675 -10.632 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -3.410 -1.206 -10.975 1.00 0.00 H new ATOM 981 N GLN A 62 0.961 -3.978 -8.041 1.00 0.00 N ATOM 982 CA GLN A 62 1.639 -3.952 -6.753 1.00 0.00 C ATOM 983 C GLN A 62 2.128 -2.524 -6.512 1.00 0.00 C ATOM 984 O GLN A 62 1.756 -1.595 -7.228 1.00 0.00 O ATOM 985 CB GLN A 62 2.786 -4.980 -6.774 1.00 0.00 C ATOM 986 CG GLN A 62 2.299 -6.416 -7.014 1.00 0.00 C ATOM 987 CD GLN A 62 1.625 -7.039 -5.788 1.00 0.00 C ATOM 988 OE1 GLN A 62 2.279 -7.669 -4.958 1.00 0.00 O ATOM 989 NE2 GLN A 62 0.317 -6.884 -5.627 1.00 0.00 N ATOM 0 H GLN A 62 1.527 -3.592 -8.796 1.00 0.00 H new ATOM 0 HA GLN A 62 0.976 -4.228 -5.933 1.00 0.00 H new ATOM 0 HB2 GLN A 62 3.496 -4.708 -7.555 1.00 0.00 H new ATOM 0 HB3 GLN A 62 3.322 -4.938 -5.826 1.00 0.00 H new ATOM 0 HG2 GLN A 62 1.597 -6.420 -7.847 1.00 0.00 H new ATOM 0 HG3 GLN A 62 3.146 -7.035 -7.308 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -0.223 -6.361 -6.316 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -0.148 -7.288 -4.814 1.00 0.00 H new ATOM 998 N LYS A 63 2.955 -2.313 -5.494 1.00 0.00 N ATOM 999 CA LYS A 63 3.662 -1.066 -5.286 1.00 0.00 C ATOM 1000 C LYS A 63 4.549 -0.750 -6.477 1.00 0.00 C ATOM 1001 O LYS A 63 4.888 -1.616 -7.279 1.00 0.00 O ATOM 1002 CB LYS A 63 4.499 -1.147 -3.994 1.00 0.00 C ATOM 1003 CG LYS A 63 5.699 -2.104 -4.011 1.00 0.00 C ATOM 1004 CD LYS A 63 6.587 -1.775 -2.802 1.00 0.00 C ATOM 1005 CE LYS A 63 7.682 -2.808 -2.511 1.00 0.00 C ATOM 1006 NZ LYS A 63 8.606 -3.046 -3.654 1.00 0.00 N ATOM 0 H LYS A 63 3.152 -3.017 -4.783 1.00 0.00 H new ATOM 0 HA LYS A 63 2.933 -0.262 -5.183 1.00 0.00 H new ATOM 0 HB2 LYS A 63 4.864 -0.147 -3.762 1.00 0.00 H new ATOM 0 HB3 LYS A 63 3.839 -1.443 -3.179 1.00 0.00 H new ATOM 0 HG2 LYS A 63 5.361 -3.139 -3.965 1.00 0.00 H new ATOM 0 HG3 LYS A 63 6.261 -1.993 -4.938 1.00 0.00 H new ATOM 0 HD2 LYS A 63 7.056 -0.805 -2.966 1.00 0.00 H new ATOM 0 HD3 LYS A 63 5.954 -1.678 -1.920 1.00 0.00 H new ATOM 0 HE2 LYS A 63 8.262 -2.475 -1.651 1.00 0.00 H new ATOM 0 HE3 LYS A 63 7.213 -3.752 -2.233 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 9.385 -3.663 -3.348 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 8.087 -3.504 -4.430 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 8.992 -2.138 -3.983 1.00 0.00 H new ATOM 1020 N GLU A 64 4.956 0.512 -6.496 1.00 0.00 N ATOM 1021 CA GLU A 64 5.847 1.133 -7.465 1.00 0.00 C ATOM 1022 C GLU A 64 5.502 0.646 -8.878 1.00 0.00 C ATOM 1023 O GLU A 64 6.357 0.221 -9.654 1.00 0.00 O ATOM 1024 CB GLU A 64 7.318 1.073 -6.995 1.00 0.00 C ATOM 1025 CG GLU A 64 8.076 -0.248 -7.149 1.00 0.00 C ATOM 1026 CD GLU A 64 9.351 -0.268 -6.289 1.00 0.00 C ATOM 1027 OE1 GLU A 64 10.393 0.281 -6.722 1.00 0.00 O ATOM 1028 OE2 GLU A 64 9.318 -0.850 -5.176 1.00 0.00 O ATOM 0 H GLU A 64 4.650 1.175 -5.784 1.00 0.00 H new ATOM 0 HA GLU A 64 5.689 2.209 -7.532 1.00 0.00 H new ATOM 0 HB2 GLU A 64 7.872 1.839 -7.538 1.00 0.00 H new ATOM 0 HB3 GLU A 64 7.342 1.349 -5.941 1.00 0.00 H new ATOM 0 HG2 GLU A 64 7.428 -1.076 -6.861 1.00 0.00 H new ATOM 0 HG3 GLU A 64 8.339 -0.398 -8.196 1.00 0.00 H new ATOM 1035 N SER A 65 4.196 0.686 -9.169 1.00 0.00 N ATOM 1036 CA SER A 65 3.657 0.164 -10.427 1.00 0.00 C ATOM 1037 C SER A 65 2.914 1.283 -11.133 1.00 0.00 C ATOM 1038 O SER A 65 2.422 2.200 -10.479 1.00 0.00 O ATOM 1039 CB SER A 65 2.767 -1.061 -10.182 1.00 0.00 C ATOM 1040 OG SER A 65 3.507 -2.156 -9.665 1.00 0.00 O ATOM 0 H SER A 65 3.491 1.077 -8.545 1.00 0.00 H new ATOM 0 HA SER A 65 4.470 -0.178 -11.068 1.00 0.00 H new ATOM 0 HB2 SER A 65 1.971 -0.798 -9.485 1.00 0.00 H new ATOM 0 HB3 SER A 65 2.288 -1.355 -11.116 1.00 0.00 H new ATOM 0 HG SER A 65 3.957 -1.885 -8.838 1.00 0.00 H new ATOM 1046 N THR A 66 2.831 1.195 -12.453 1.00 0.00 N ATOM 1047 CA THR A 66 2.354 2.282 -13.301 1.00 0.00 C ATOM 1048 C THR A 66 0.948 1.983 -13.819 1.00 0.00 C ATOM 1049 O THR A 66 0.624 0.851 -14.163 1.00 0.00 O ATOM 1050 CB THR A 66 3.356 2.547 -14.446 1.00 0.00 C ATOM 1051 OG1 THR A 66 4.664 2.652 -13.905 1.00 0.00 O ATOM 1052 CG2 THR A 66 3.049 3.827 -15.244 1.00 0.00 C ATOM 0 H THR A 66 3.096 0.358 -12.973 1.00 0.00 H new ATOM 0 HA THR A 66 2.288 3.195 -12.709 1.00 0.00 H new ATOM 0 HB THR A 66 3.272 1.708 -15.137 1.00 0.00 H new ATOM 0 HG1 THR A 66 5.305 2.819 -14.628 1.00 0.00 H new ATOM 0 HG21 THR A 66 3.792 3.951 -16.032 1.00 0.00 H new ATOM 0 HG22 THR A 66 2.057 3.749 -15.689 1.00 0.00 H new ATOM 0 HG23 THR A 66 3.080 4.688 -14.577 1.00 0.00 H new ATOM 1060 N LEU A 67 0.132 3.030 -13.891 1.00 0.00 N ATOM 1061 CA LEU A 67 -1.257 3.064 -14.331 1.00 0.00 C ATOM 1062 C LEU A 67 -1.435 4.119 -15.425 1.00 0.00 C ATOM 1063 O LEU A 67 -0.537 4.930 -15.632 1.00 0.00 O ATOM 1064 CB LEU A 67 -2.095 3.448 -13.099 1.00 0.00 C ATOM 1065 CG LEU A 67 -3.288 2.546 -12.841 1.00 0.00 C ATOM 1066 CD1 LEU A 67 -2.802 1.183 -12.355 1.00 0.00 C ATOM 1067 CD2 LEU A 67 -4.164 3.171 -11.760 1.00 0.00 C ATOM 0 H LEU A 67 0.456 3.958 -13.618 1.00 0.00 H new ATOM 0 HA LEU A 67 -1.564 2.101 -14.739 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -1.451 3.437 -12.220 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -2.450 4.471 -13.222 1.00 0.00 H new ATOM 0 HG LEU A 67 -3.858 2.426 -13.762 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -3.659 0.536 -12.170 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -2.164 0.732 -13.115 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -2.235 1.307 -11.432 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -5.023 2.527 -11.570 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -3.586 3.284 -10.843 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -4.510 4.149 -12.093 1.00 0.00 H new ATOM 1079 N HIS A 68 -2.617 4.204 -16.044 1.00 0.00 N ATOM 1080 CA HIS A 68 -2.892 5.179 -17.113 1.00 0.00 C ATOM 1081 C HIS A 68 -4.222 5.888 -16.891 1.00 0.00 C ATOM 1082 O HIS A 68 -5.222 5.234 -16.599 1.00 0.00 O ATOM 1083 CB HIS A 68 -2.929 4.472 -18.484 1.00 0.00 C ATOM 1084 CG HIS A 68 -1.605 4.344 -19.190 1.00 0.00 C ATOM 1085 ND1 HIS A 68 -1.150 3.194 -19.837 1.00 0.00 N ATOM 1086 CD2 HIS A 68 -0.741 5.373 -19.445 1.00 0.00 C ATOM 1087 CE1 HIS A 68 -0.009 3.549 -20.449 1.00 0.00 C ATOM 1088 NE2 HIS A 68 0.274 4.840 -20.209 1.00 0.00 N ATOM 0 H HIS A 68 -3.410 3.602 -15.822 1.00 0.00 H new ATOM 0 HA HIS A 68 -2.091 5.918 -17.094 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -3.344 3.474 -18.346 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -3.615 5.015 -19.134 1.00 0.00 H new ATOM 0 HD1 HIS A 68 -1.592 2.275 -19.844 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -0.835 6.397 -19.114 1.00 0.00 H new ATOM 0 HE1 HIS A 68 0.597 2.888 -21.051 1.00 0.00 H new ATOM 1096 N LEU A 69 -4.249 7.216 -17.082 1.00 0.00 N ATOM 1097 CA LEU A 69 -5.494 7.998 -17.140 1.00 0.00 C ATOM 1098 C LEU A 69 -5.922 7.997 -18.596 1.00 0.00 C ATOM 1099 O LEU A 69 -5.181 8.480 -19.441 1.00 0.00 O ATOM 1100 CB LEU A 69 -5.280 9.467 -16.658 1.00 0.00 C ATOM 1101 CG LEU A 69 -6.078 10.621 -17.350 1.00 0.00 C ATOM 1102 CD1 LEU A 69 -7.579 10.485 -17.078 1.00 0.00 C ATOM 1103 CD2 LEU A 69 -5.635 11.991 -16.859 1.00 0.00 C ATOM 0 H LEU A 69 -3.407 7.779 -17.201 1.00 0.00 H new ATOM 0 HA LEU A 69 -6.246 7.559 -16.484 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -5.512 9.500 -15.593 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -4.219 9.695 -16.760 1.00 0.00 H new ATOM 0 HG LEU A 69 -5.876 10.537 -18.418 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -8.113 11.298 -17.569 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -7.934 9.531 -17.467 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -7.760 10.529 -16.004 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -6.214 12.764 -17.365 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -5.797 12.062 -15.783 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -4.576 12.131 -17.077 1.00 0.00 H new ATOM 1115 N VAL A 70 -7.135 7.536 -18.856 1.00 0.00 N ATOM 1116 CA VAL A 70 -7.840 7.643 -20.123 1.00 0.00 C ATOM 1117 C VAL A 70 -9.237 8.137 -19.731 1.00 0.00 C ATOM 1118 O VAL A 70 -9.603 8.142 -18.561 1.00 0.00 O ATOM 1119 CB VAL A 70 -7.722 6.282 -20.841 1.00 0.00 C ATOM 1120 CG1 VAL A 70 -8.590 6.192 -22.085 1.00 0.00 C ATOM 1121 CG2 VAL A 70 -6.258 5.989 -21.222 1.00 0.00 C ATOM 0 H VAL A 70 -7.685 7.049 -18.148 1.00 0.00 H new ATOM 0 HA VAL A 70 -7.451 8.347 -20.859 1.00 0.00 H new ATOM 0 HB VAL A 70 -8.079 5.535 -20.132 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -8.464 5.212 -22.546 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -9.635 6.332 -21.810 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -8.294 6.967 -22.792 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -6.199 5.025 -21.727 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -5.892 6.770 -21.888 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -5.645 5.965 -20.321 1.00 0.00 H new ATOM 1131 N LEU A 71 -10.024 8.609 -20.686 1.00 0.00 N ATOM 1132 CA LEU A 71 -11.308 9.257 -20.427 1.00 0.00 C ATOM 1133 C LEU A 71 -12.436 8.292 -20.774 1.00 0.00 C ATOM 1134 O LEU A 71 -12.275 7.465 -21.662 1.00 0.00 O ATOM 1135 CB LEU A 71 -11.357 10.471 -21.361 1.00 0.00 C ATOM 1136 CG LEU A 71 -12.456 11.492 -21.023 1.00 0.00 C ATOM 1137 CD1 LEU A 71 -11.908 12.608 -20.142 1.00 0.00 C ATOM 1138 CD2 LEU A 71 -13.052 12.064 -22.304 1.00 0.00 C ATOM 0 H LEU A 71 -9.789 8.554 -21.677 1.00 0.00 H new ATOM 0 HA LEU A 71 -11.418 9.550 -19.383 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -10.390 10.974 -21.333 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -11.505 10.122 -22.383 1.00 0.00 H new ATOM 0 HG LEU A 71 -13.243 10.981 -20.468 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -12.704 13.318 -19.917 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -11.526 12.184 -19.213 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -11.101 13.122 -20.665 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -13.829 12.786 -22.053 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -12.270 12.558 -22.880 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -13.484 11.257 -22.896 1.00 0.00 H new ATOM 1150 N ARG A 72 -13.604 8.419 -20.144 1.00 0.00 N ATOM 1151 CA ARG A 72 -14.816 7.662 -20.521 1.00 0.00 C ATOM 1152 C ARG A 72 -15.537 8.237 -21.755 1.00 0.00 C ATOM 1153 O ARG A 72 -16.458 7.607 -22.256 1.00 0.00 O ATOM 1154 CB ARG A 72 -15.710 7.509 -19.260 1.00 0.00 C ATOM 1155 CG ARG A 72 -16.847 6.479 -19.431 1.00 0.00 C ATOM 1156 CD ARG A 72 -17.423 5.980 -18.095 1.00 0.00 C ATOM 1157 NE ARG A 72 -18.299 6.982 -17.455 1.00 0.00 N ATOM 1158 CZ ARG A 72 -19.606 7.172 -17.688 1.00 0.00 C ATOM 1159 NH1 ARG A 72 -20.260 6.501 -18.630 1.00 0.00 N ATOM 1160 NH2 ARG A 72 -20.301 8.054 -16.995 1.00 0.00 N ATOM 0 H ARG A 72 -13.745 9.049 -19.355 1.00 0.00 H new ATOM 0 HA ARG A 72 -14.533 6.665 -20.858 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -15.086 7.213 -18.416 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -16.143 8.478 -19.012 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -17.648 6.927 -20.019 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -16.473 5.627 -19.998 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -17.987 5.063 -18.265 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -16.605 5.731 -17.419 1.00 0.00 H new ATOM 0 HE ARG A 72 -17.865 7.593 -16.764 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -19.768 5.816 -19.203 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -21.255 6.671 -18.780 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -19.845 8.605 -16.268 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -21.294 8.185 -17.186 1.00 0.00 H new ATOM 1174 N LEU A 73 -15.164 9.442 -22.216 1.00 0.00 N ATOM 1175 CA LEU A 73 -15.852 10.212 -23.275 1.00 0.00 C ATOM 1176 C LEU A 73 -17.345 10.340 -22.921 1.00 0.00 C ATOM 1177 O LEU A 73 -18.198 10.344 -23.804 1.00 0.00 O ATOM 1178 CB LEU A 73 -15.597 9.640 -24.696 1.00 0.00 C ATOM 1179 CG LEU A 73 -14.173 9.594 -25.295 1.00 0.00 C ATOM 1180 CD1 LEU A 73 -13.458 10.922 -25.531 1.00 0.00 C ATOM 1181 CD2 LEU A 73 -13.247 8.590 -24.599 1.00 0.00 C ATOM 0 H LEU A 73 -14.345 9.928 -21.850 1.00 0.00 H new ATOM 0 HA LEU A 73 -15.428 11.216 -23.313 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -15.978 8.619 -24.702 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -16.215 10.215 -25.386 1.00 0.00 H new ATOM 0 HG LEU A 73 -14.394 9.236 -26.300 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -12.471 10.734 -25.954 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -14.039 11.530 -26.224 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -13.352 11.452 -24.584 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -12.265 8.612 -25.072 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -13.149 8.855 -23.546 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -13.668 7.588 -24.683 1.00 0.00 H new ATOM 1193 N ARG A 74 -17.645 10.387 -21.607 1.00 0.00 N ATOM 1194 CA ARG A 74 -18.979 10.326 -20.999 1.00 0.00 C ATOM 1195 C ARG A 74 -19.979 9.500 -21.825 1.00 0.00 C ATOM 1196 O ARG A 74 -21.065 9.965 -22.170 1.00 0.00 O ATOM 1197 CB ARG A 74 -19.422 11.769 -20.667 1.00 0.00 C ATOM 1198 CG ARG A 74 -20.703 11.918 -19.823 1.00 0.00 C ATOM 1199 CD ARG A 74 -20.799 10.956 -18.628 1.00 0.00 C ATOM 1200 NE ARG A 74 -22.140 10.984 -18.025 1.00 0.00 N ATOM 1201 CZ ARG A 74 -22.550 11.701 -16.974 1.00 0.00 C ATOM 1202 NH1 ARG A 74 -21.721 12.524 -16.333 1.00 0.00 N ATOM 1203 NH2 ARG A 74 -23.815 11.592 -16.574 1.00 0.00 N ATOM 0 H ARG A 74 -16.912 10.474 -20.903 1.00 0.00 H new ATOM 0 HA ARG A 74 -18.944 9.769 -20.063 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -18.606 12.263 -20.139 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -19.567 12.306 -21.605 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -20.762 12.942 -19.454 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -21.567 11.762 -20.468 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -20.566 9.943 -18.955 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -20.055 11.228 -17.879 1.00 0.00 H new ATOM 0 HE ARG A 74 -22.841 10.385 -18.461 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -20.753 12.616 -16.642 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -22.054 13.062 -15.533 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -24.454 10.969 -17.068 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -24.145 12.132 -15.774 1.00 0.00 H new ATOM 1217 N GLY A 75 -19.618 8.246 -22.114 1.00 0.00 N ATOM 1218 CA GLY A 75 -20.427 7.309 -22.890 1.00 0.00 C ATOM 1219 C GLY A 75 -21.597 6.723 -22.088 1.00 0.00 C ATOM 1220 O GLY A 75 -21.812 5.512 -22.122 1.00 0.00 O ATOM 0 H GLY A 75 -18.732 7.847 -21.805 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -20.816 7.817 -23.772 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -19.793 6.496 -23.244 1.00 0.00 H new ATOM 1224 N GLY A 76 -22.302 7.549 -21.313 1.00 0.00 N ATOM 1225 CA GLY A 76 -23.407 7.167 -20.446 1.00 0.00 C ATOM 1226 C GLY A 76 -23.401 8.115 -19.257 1.00 0.00 C ATOM 1227 O GLY A 76 -22.741 7.766 -18.260 1.00 0.00 O ATOM 1228 OXT GLY A 76 -23.952 9.233 -19.362 1.00 0.00 O ATOM 0 H GLY A 76 -22.105 8.549 -21.274 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -24.354 7.229 -20.982 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -23.295 6.135 -20.114 1.00 0.00 H new TER 1232 GLY A 76 ATOM 1233 N GLY B -3 -9.131 22.154 -42.309 1.00 0.00 N ATOM 1234 CA GLY B -3 -9.036 22.908 -41.034 1.00 0.00 C ATOM 1235 C GLY B -3 -9.635 22.128 -39.867 1.00 0.00 C ATOM 1236 O GLY B -3 -10.606 21.383 -40.038 1.00 0.00 O ATOM 0 H1 GLY B -3 -8.216 21.704 -42.515 1.00 0.00 H new ATOM 0 H2 GLY B -3 -9.865 21.422 -42.226 1.00 0.00 H new ATOM 0 H3 GLY B -3 -9.378 22.806 -43.080 1.00 0.00 H new ATOM 0 HA2 GLY B -3 -7.991 23.133 -40.822 1.00 0.00 H new ATOM 0 HA3 GLY B -3 -9.553 23.862 -41.137 1.00 0.00 H new ATOM 1242 N HIS B -2 -9.078 22.288 -38.664 1.00 0.00 N ATOM 1243 CA HIS B -2 -9.518 21.612 -37.438 1.00 0.00 C ATOM 1244 C HIS B -2 -10.815 22.241 -36.913 1.00 0.00 C ATOM 1245 O HIS B -2 -10.806 22.989 -35.933 1.00 0.00 O ATOM 1246 CB HIS B -2 -8.393 21.611 -36.391 1.00 0.00 C ATOM 1247 CG HIS B -2 -7.157 20.870 -36.851 1.00 0.00 C ATOM 1248 ND1 HIS B -2 -5.912 21.448 -37.124 1.00 0.00 N ATOM 1249 CD2 HIS B -2 -7.088 19.528 -37.099 1.00 0.00 C ATOM 1250 CE1 HIS B -2 -5.121 20.435 -37.524 1.00 0.00 C ATOM 1251 NE2 HIS B -2 -5.801 19.273 -37.513 1.00 0.00 N ATOM 0 H HIS B -2 -8.284 22.910 -38.510 1.00 0.00 H new ATOM 0 HA HIS B -2 -9.741 20.569 -37.663 1.00 0.00 H new ATOM 0 HB2 HIS B -2 -8.125 22.640 -36.153 1.00 0.00 H new ATOM 0 HB3 HIS B -2 -8.761 21.157 -35.471 1.00 0.00 H new ATOM 0 HD2 HIS B -2 -7.887 18.809 -36.991 1.00 0.00 H new ATOM 0 HE1 HIS B -2 -4.086 20.540 -37.813 1.00 0.00 H new ATOM 0 HE2 HIS B -2 -5.426 18.359 -37.768 1.00 0.00 H new ATOM 1259 N MET B -1 -11.925 21.977 -37.606 1.00 0.00 N ATOM 1260 CA MET B -1 -13.274 22.405 -37.242 1.00 0.00 C ATOM 1261 C MET B -1 -14.295 21.351 -37.669 1.00 0.00 C ATOM 1262 O MET B -1 -15.245 21.080 -36.933 1.00 0.00 O ATOM 1263 CB MET B -1 -13.536 23.782 -37.861 1.00 0.00 C ATOM 1264 CG MET B -1 -14.940 24.343 -37.605 1.00 0.00 C ATOM 1265 SD MET B -1 -15.346 24.628 -35.858 1.00 0.00 S ATOM 1266 CE MET B -1 -17.048 25.209 -36.045 1.00 0.00 C ATOM 0 H MET B -1 -11.906 21.437 -38.471 1.00 0.00 H new ATOM 0 HA MET B -1 -13.372 22.502 -36.161 1.00 0.00 H new ATOM 0 HB2 MET B -1 -12.801 24.486 -37.471 1.00 0.00 H new ATOM 0 HB3 MET B -1 -13.376 23.718 -38.937 1.00 0.00 H new ATOM 0 HG2 MET B -1 -15.043 25.285 -38.145 1.00 0.00 H new ATOM 0 HG3 MET B -1 -15.672 23.654 -38.025 1.00 0.00 H new ATOM 0 HE1 MET B -1 -17.465 25.435 -35.064 1.00 0.00 H new ATOM 0 HE2 MET B -1 -17.060 26.108 -36.661 1.00 0.00 H new ATOM 0 HE3 MET B -1 -17.647 24.434 -36.524 1.00 0.00 H new ATOM 1276 N ASP B 674 -14.061 20.699 -38.813 1.00 0.00 N ATOM 1277 CA ASP B 674 -14.826 19.517 -39.227 1.00 0.00 C ATOM 1278 C ASP B 674 -14.483 18.313 -38.337 1.00 0.00 C ATOM 1279 O ASP B 674 -15.250 17.350 -38.249 1.00 0.00 O ATOM 1280 CB ASP B 674 -14.530 19.192 -40.695 1.00 0.00 C ATOM 1281 CG ASP B 674 -15.346 17.986 -41.196 1.00 0.00 C ATOM 1282 OD1 ASP B 674 -16.590 18.104 -41.318 1.00 0.00 O ATOM 1283 OD2 ASP B 674 -14.742 16.942 -41.531 1.00 0.00 O ATOM 0 H ASP B 674 -13.338 20.975 -39.477 1.00 0.00 H new ATOM 0 HA ASP B 674 -15.889 19.733 -39.118 1.00 0.00 H new ATOM 0 HB2 ASP B 674 -14.755 20.063 -41.311 1.00 0.00 H new ATOM 0 HB3 ASP B 674 -13.467 18.984 -40.813 1.00 0.00 H new ATOM 1288 N GLU B 675 -13.351 18.385 -37.629 1.00 0.00 N ATOM 1289 CA GLU B 675 -12.881 17.434 -36.656 1.00 0.00 C ATOM 1290 C GLU B 675 -11.971 18.253 -35.747 1.00 0.00 C ATOM 1291 O GLU B 675 -11.276 19.158 -36.221 1.00 0.00 O ATOM 1292 CB GLU B 675 -12.090 16.339 -37.369 1.00 0.00 C ATOM 1293 CG GLU B 675 -11.586 15.272 -36.402 1.00 0.00 C ATOM 1294 CD GLU B 675 -10.764 14.197 -37.139 1.00 0.00 C ATOM 1295 OE1 GLU B 675 -11.362 13.285 -37.760 1.00 0.00 O ATOM 1296 OE2 GLU B 675 -9.511 14.262 -37.104 1.00 0.00 O ATOM 0 H GLU B 675 -12.706 19.168 -37.739 1.00 0.00 H new ATOM 0 HA GLU B 675 -13.682 16.945 -36.101 1.00 0.00 H new ATOM 0 HB2 GLU B 675 -12.720 15.873 -38.127 1.00 0.00 H new ATOM 0 HB3 GLU B 675 -11.243 16.785 -37.889 1.00 0.00 H new ATOM 0 HG2 GLU B 675 -10.973 15.737 -35.630 1.00 0.00 H new ATOM 0 HG3 GLU B 675 -12.432 14.805 -35.898 1.00 0.00 H new ATOM 1303 N LYS B 676 -11.990 17.969 -34.450 1.00 0.00 N ATOM 1304 CA LYS B 676 -11.351 18.804 -33.441 1.00 0.00 C ATOM 1305 C LYS B 676 -10.799 17.975 -32.281 1.00 0.00 C ATOM 1306 O LYS B 676 -10.932 18.381 -31.122 1.00 0.00 O ATOM 1307 CB LYS B 676 -12.327 19.888 -32.940 1.00 0.00 C ATOM 1308 CG LYS B 676 -13.025 20.733 -34.019 1.00 0.00 C ATOM 1309 CD LYS B 676 -13.729 21.944 -33.392 1.00 0.00 C ATOM 1310 CE LYS B 676 -12.664 22.976 -32.984 1.00 0.00 C ATOM 1311 NZ LYS B 676 -13.256 24.248 -32.485 1.00 0.00 N ATOM 0 H LYS B 676 -12.454 17.145 -34.066 1.00 0.00 H new ATOM 0 HA LYS B 676 -10.500 19.298 -33.910 1.00 0.00 H new ATOM 0 HB2 LYS B 676 -13.094 19.404 -32.336 1.00 0.00 H new ATOM 0 HB3 LYS B 676 -11.780 20.561 -32.280 1.00 0.00 H new ATOM 0 HG2 LYS B 676 -12.293 21.072 -34.752 1.00 0.00 H new ATOM 0 HG3 LYS B 676 -13.751 20.121 -34.553 1.00 0.00 H new ATOM 0 HD2 LYS B 676 -14.429 22.384 -34.102 1.00 0.00 H new ATOM 0 HD3 LYS B 676 -14.309 21.635 -32.522 1.00 0.00 H new ATOM 0 HE2 LYS B 676 -12.028 22.548 -32.209 1.00 0.00 H new ATOM 0 HE3 LYS B 676 -12.024 23.189 -33.840 1.00 0.00 H new ATOM 0 HZ1 LYS B 676 -12.494 24.907 -32.224 1.00 0.00 H new ATOM 0 HZ2 LYS B 676 -13.842 24.674 -33.231 1.00 0.00 H new ATOM 0 HZ3 LYS B 676 -13.845 24.053 -31.651 1.00 0.00 H new ATOM 1325 N ILE B 677 -10.223 16.804 -32.562 1.00 0.00 N ATOM 1326 CA ILE B 677 -9.480 16.089 -31.524 1.00 0.00 C ATOM 1327 C ILE B 677 -8.393 17.048 -31.047 1.00 0.00 C ATOM 1328 O ILE B 677 -7.691 17.645 -31.871 1.00 0.00 O ATOM 1329 CB ILE B 677 -8.853 14.778 -32.033 1.00 0.00 C ATOM 1330 CG1 ILE B 677 -9.968 13.813 -32.489 1.00 0.00 C ATOM 1331 CG2 ILE B 677 -7.965 14.128 -30.942 1.00 0.00 C ATOM 1332 CD1 ILE B 677 -9.422 12.594 -33.235 1.00 0.00 C ATOM 0 H ILE B 677 -10.254 16.342 -33.471 1.00 0.00 H new ATOM 0 HA ILE B 677 -10.156 15.796 -30.721 1.00 0.00 H new ATOM 0 HB ILE B 677 -8.211 15.001 -32.885 1.00 0.00 H new ATOM 0 HG12 ILE B 677 -10.533 13.479 -31.619 1.00 0.00 H new ATOM 0 HG13 ILE B 677 -10.665 14.348 -33.135 1.00 0.00 H new ATOM 0 HG21 ILE B 677 -7.534 13.204 -31.327 1.00 0.00 H new ATOM 0 HG22 ILE B 677 -7.164 14.815 -30.668 1.00 0.00 H new ATOM 0 HG23 ILE B 677 -8.571 13.908 -30.063 1.00 0.00 H new ATOM 0 HD11 ILE B 677 -10.249 11.949 -33.533 1.00 0.00 H new ATOM 0 HD12 ILE B 677 -8.881 12.923 -34.122 1.00 0.00 H new ATOM 0 HD13 ILE B 677 -8.747 12.040 -32.582 1.00 0.00 H new ATOM 1344 N THR B 678 -8.230 17.173 -29.736 1.00 0.00 N ATOM 1345 CA THR B 678 -7.216 18.007 -29.140 1.00 0.00 C ATOM 1346 C THR B 678 -6.499 17.255 -28.019 1.00 0.00 C ATOM 1347 O THR B 678 -7.021 16.316 -27.410 1.00 0.00 O ATOM 1348 CB THR B 678 -7.871 19.345 -28.770 1.00 0.00 C ATOM 1349 OG1 THR B 678 -6.874 20.324 -28.527 1.00 0.00 O ATOM 1350 CG2 THR B 678 -8.839 19.291 -27.591 1.00 0.00 C ATOM 0 H THR B 678 -8.812 16.687 -29.054 1.00 0.00 H new ATOM 0 HA THR B 678 -6.406 18.251 -29.828 1.00 0.00 H new ATOM 0 HB THR B 678 -8.480 19.611 -29.634 1.00 0.00 H new ATOM 0 HG1 THR B 678 -7.301 21.175 -28.293 1.00 0.00 H new ATOM 0 HG21 THR B 678 -9.248 20.285 -27.410 1.00 0.00 H new ATOM 0 HG22 THR B 678 -9.651 18.601 -27.819 1.00 0.00 H new ATOM 0 HG23 THR B 678 -8.310 18.948 -26.702 1.00 0.00 H new ATOM 1358 N PHE B 679 -5.259 17.678 -27.798 1.00 0.00 N ATOM 1359 CA PHE B 679 -4.287 17.067 -26.910 1.00 0.00 C ATOM 1360 C PHE B 679 -3.857 18.149 -25.897 1.00 0.00 C ATOM 1361 O PHE B 679 -2.881 18.868 -26.141 1.00 0.00 O ATOM 1362 CB PHE B 679 -3.127 16.473 -27.723 1.00 0.00 C ATOM 1363 CG PHE B 679 -3.454 15.157 -28.414 1.00 0.00 C ATOM 1364 CD1 PHE B 679 -3.390 13.936 -27.708 1.00 0.00 C ATOM 1365 CD2 PHE B 679 -3.789 15.143 -29.781 1.00 0.00 C ATOM 1366 CE1 PHE B 679 -3.666 12.720 -28.350 1.00 0.00 C ATOM 1367 CE2 PHE B 679 -4.050 13.923 -30.432 1.00 0.00 C ATOM 1368 CZ PHE B 679 -3.974 12.712 -29.722 1.00 0.00 C ATOM 0 H PHE B 679 -4.887 18.506 -28.264 1.00 0.00 H new ATOM 0 HA PHE B 679 -4.703 16.226 -26.356 1.00 0.00 H new ATOM 0 HB2 PHE B 679 -2.818 17.198 -28.476 1.00 0.00 H new ATOM 0 HB3 PHE B 679 -2.276 16.320 -27.060 1.00 0.00 H new ATOM 0 HD1 PHE B 679 -3.125 13.938 -26.661 1.00 0.00 H new ATOM 0 HD2 PHE B 679 -3.846 16.070 -30.331 1.00 0.00 H new ATOM 0 HE1 PHE B 679 -3.642 11.795 -27.794 1.00 0.00 H new ATOM 0 HE2 PHE B 679 -4.310 13.917 -31.480 1.00 0.00 H new ATOM 0 HZ PHE B 679 -4.152 11.776 -30.230 1.00 0.00 H new ATOM 1378 N PRO B 680 -4.648 18.362 -24.825 1.00 0.00 N ATOM 1379 CA PRO B 680 -4.423 19.390 -23.804 1.00 0.00 C ATOM 1380 C PRO B 680 -3.227 19.042 -22.901 1.00 0.00 C ATOM 1381 O PRO B 680 -2.622 17.979 -23.030 1.00 0.00 O ATOM 1382 CB PRO B 680 -5.731 19.402 -22.991 1.00 0.00 C ATOM 1383 CG PRO B 680 -6.115 17.926 -23.025 1.00 0.00 C ATOM 1384 CD PRO B 680 -5.826 17.582 -24.480 1.00 0.00 C ATOM 0 HA PRO B 680 -4.186 20.358 -24.245 1.00 0.00 H new ATOM 0 HB2 PRO B 680 -5.580 19.765 -21.974 1.00 0.00 H new ATOM 0 HB3 PRO B 680 -6.492 20.036 -23.446 1.00 0.00 H new ATOM 0 HG2 PRO B 680 -5.519 17.329 -22.334 1.00 0.00 H new ATOM 0 HG3 PRO B 680 -7.161 17.766 -22.764 1.00 0.00 H new ATOM 0 HD2 PRO B 680 -5.643 16.515 -24.604 1.00 0.00 H new ATOM 0 HD3 PRO B 680 -6.670 17.837 -25.121 1.00 0.00 H new ATOM 1392 N SER B 681 -2.990 19.859 -21.875 1.00 0.00 N ATOM 1393 CA SER B 681 -2.054 19.634 -20.770 1.00 0.00 C ATOM 1394 C SER B 681 -2.408 18.417 -19.880 1.00 0.00 C ATOM 1395 O SER B 681 -1.947 18.337 -18.740 1.00 0.00 O ATOM 1396 CB SER B 681 -1.979 20.927 -19.936 1.00 0.00 C ATOM 1397 OG SER B 681 -1.836 22.074 -20.776 1.00 0.00 O ATOM 0 H SER B 681 -3.476 20.751 -21.786 1.00 0.00 H new ATOM 0 HA SER B 681 -1.083 19.388 -21.200 1.00 0.00 H new ATOM 0 HB2 SER B 681 -2.880 21.026 -19.331 1.00 0.00 H new ATOM 0 HB3 SER B 681 -1.137 20.870 -19.246 1.00 0.00 H new ATOM 0 HG SER B 681 -1.793 22.882 -20.222 1.00 0.00 H new ATOM 1403 N ASP B 682 -3.207 17.469 -20.381 1.00 0.00 N ATOM 1404 CA ASP B 682 -3.580 16.229 -19.701 1.00 0.00 C ATOM 1405 C ASP B 682 -3.516 15.000 -20.609 1.00 0.00 C ATOM 1406 O ASP B 682 -3.412 13.881 -20.099 1.00 0.00 O ATOM 1407 CB ASP B 682 -4.997 16.327 -19.134 1.00 0.00 C ATOM 1408 CG ASP B 682 -5.120 17.334 -17.983 1.00 0.00 C ATOM 1409 OD1 ASP B 682 -4.872 16.952 -16.815 1.00 0.00 O ATOM 1410 OD2 ASP B 682 -5.505 18.499 -18.239 1.00 0.00 O ATOM 0 H ASP B 682 -3.627 17.550 -21.307 1.00 0.00 H new ATOM 0 HA ASP B 682 -2.849 16.103 -18.902 1.00 0.00 H new ATOM 0 HB2 ASP B 682 -5.682 16.613 -19.933 1.00 0.00 H new ATOM 0 HB3 ASP B 682 -5.309 15.344 -18.783 1.00 0.00 H new ATOM 1415 N ILE B 683 -3.580 15.159 -21.938 1.00 0.00 N ATOM 1416 CA ILE B 683 -3.528 14.067 -22.899 1.00 0.00 C ATOM 1417 C ILE B 683 -2.618 14.525 -24.050 1.00 0.00 C ATOM 1418 O ILE B 683 -2.878 15.578 -24.619 1.00 0.00 O ATOM 1419 CB ILE B 683 -4.956 13.690 -23.378 1.00 0.00 C ATOM 1420 CG1 ILE B 683 -5.855 12.996 -22.330 1.00 0.00 C ATOM 1421 CG2 ILE B 683 -4.889 12.760 -24.603 1.00 0.00 C ATOM 1422 CD1 ILE B 683 -6.363 13.802 -21.143 1.00 0.00 C ATOM 0 H ILE B 683 -3.671 16.075 -22.377 1.00 0.00 H new ATOM 0 HA ILE B 683 -3.119 13.161 -22.452 1.00 0.00 H new ATOM 0 HB ILE B 683 -5.410 14.655 -23.605 1.00 0.00 H new ATOM 0 HG12 ILE B 683 -6.724 12.599 -22.854 1.00 0.00 H new ATOM 0 HG13 ILE B 683 -5.303 12.143 -21.936 1.00 0.00 H new ATOM 0 HG21 ILE B 683 -5.900 12.507 -24.924 1.00 0.00 H new ATOM 0 HG22 ILE B 683 -4.366 13.265 -25.415 1.00 0.00 H new ATOM 0 HG23 ILE B 683 -4.353 11.848 -24.339 1.00 0.00 H new ATOM 0 HD11 ILE B 683 -6.978 13.165 -20.507 1.00 0.00 H new ATOM 0 HD12 ILE B 683 -5.516 14.178 -20.569 1.00 0.00 H new ATOM 0 HD13 ILE B 683 -6.960 14.641 -21.501 1.00 0.00 H new ATOM 1434 N ASP B 684 -1.592 13.750 -24.422 1.00 0.00 N ATOM 1435 CA ASP B 684 -0.616 14.061 -25.477 1.00 0.00 C ATOM 1436 C ASP B 684 -0.415 12.814 -26.359 1.00 0.00 C ATOM 1437 O ASP B 684 -0.533 11.698 -25.839 1.00 0.00 O ATOM 1438 CB ASP B 684 0.716 14.456 -24.835 1.00 0.00 C ATOM 1439 CG ASP B 684 1.787 14.812 -25.867 1.00 0.00 C ATOM 1440 OD1 ASP B 684 2.503 13.894 -26.327 1.00 0.00 O ATOM 1441 OD2 ASP B 684 1.910 16.012 -26.207 1.00 0.00 O ATOM 0 H ASP B 684 -1.410 12.850 -23.978 1.00 0.00 H new ATOM 0 HA ASP B 684 -0.981 14.887 -26.088 1.00 0.00 H new ATOM 0 HB2 ASP B 684 0.557 15.308 -24.174 1.00 0.00 H new ATOM 0 HB3 ASP B 684 1.074 13.634 -24.215 1.00 0.00 H new ATOM 1446 N PRO B 685 -0.129 12.939 -27.672 1.00 0.00 N ATOM 1447 CA PRO B 685 0.079 11.791 -28.545 1.00 0.00 C ATOM 1448 C PRO B 685 1.114 10.779 -28.038 1.00 0.00 C ATOM 1449 O PRO B 685 0.966 9.604 -28.350 1.00 0.00 O ATOM 1450 CB PRO B 685 0.473 12.354 -29.911 1.00 0.00 C ATOM 1451 CG PRO B 685 -0.160 13.743 -29.918 1.00 0.00 C ATOM 1452 CD PRO B 685 -0.029 14.168 -28.457 1.00 0.00 C ATOM 0 HA PRO B 685 -0.843 11.212 -28.587 1.00 0.00 H new ATOM 0 HB2 PRO B 685 1.556 12.405 -30.027 1.00 0.00 H new ATOM 0 HB3 PRO B 685 0.094 11.736 -30.725 1.00 0.00 H new ATOM 0 HG2 PRO B 685 0.363 14.425 -30.588 1.00 0.00 H new ATOM 0 HG3 PRO B 685 -1.201 13.714 -30.241 1.00 0.00 H new ATOM 0 HD2 PRO B 685 0.923 14.668 -28.280 1.00 0.00 H new ATOM 0 HD3 PRO B 685 -0.815 14.872 -28.183 1.00 0.00 H new ATOM 1460 N GLN B 686 2.121 11.182 -27.252 1.00 0.00 N ATOM 1461 CA GLN B 686 3.153 10.295 -26.710 1.00 0.00 C ATOM 1462 C GLN B 686 2.519 9.067 -26.052 1.00 0.00 C ATOM 1463 O GLN B 686 2.638 7.947 -26.557 1.00 0.00 O ATOM 1464 CB GLN B 686 3.995 11.109 -25.708 1.00 0.00 C ATOM 1465 CG GLN B 686 4.990 10.284 -24.868 1.00 0.00 C ATOM 1466 CD GLN B 686 5.581 11.101 -23.717 1.00 0.00 C ATOM 1467 OE1 GLN B 686 6.786 11.325 -23.656 1.00 0.00 O ATOM 1468 NE2 GLN B 686 4.763 11.559 -22.770 1.00 0.00 N ATOM 0 H GLN B 686 2.241 12.155 -26.971 1.00 0.00 H new ATOM 0 HA GLN B 686 3.796 9.923 -27.508 1.00 0.00 H new ATOM 0 HB2 GLN B 686 4.550 11.869 -26.257 1.00 0.00 H new ATOM 0 HB3 GLN B 686 3.320 11.633 -25.032 1.00 0.00 H new ATOM 0 HG2 GLN B 686 4.485 9.405 -24.467 1.00 0.00 H new ATOM 0 HG3 GLN B 686 5.795 9.925 -25.509 1.00 0.00 H new ATOM 0 HE21 GLN B 686 3.762 11.370 -22.825 1.00 0.00 H new ATOM 0 HE22 GLN B 686 5.138 12.099 -21.990 1.00 0.00 H new ATOM 1477 N VAL B 687 1.813 9.265 -24.935 1.00 0.00 N ATOM 1478 CA VAL B 687 1.254 8.166 -24.177 1.00 0.00 C ATOM 1479 C VAL B 687 0.213 7.460 -25.032 1.00 0.00 C ATOM 1480 O VAL B 687 0.084 6.251 -24.916 1.00 0.00 O ATOM 1481 CB VAL B 687 0.678 8.709 -22.869 1.00 0.00 C ATOM 1482 CG1 VAL B 687 0.417 7.578 -21.875 1.00 0.00 C ATOM 1483 CG2 VAL B 687 1.641 9.718 -22.220 1.00 0.00 C ATOM 0 H VAL B 687 1.620 10.186 -24.542 1.00 0.00 H new ATOM 0 HA VAL B 687 2.016 7.432 -23.917 1.00 0.00 H new ATOM 0 HB VAL B 687 -0.261 9.205 -23.114 1.00 0.00 H new ATOM 0 HG11 VAL B 687 0.008 7.991 -20.953 1.00 0.00 H new ATOM 0 HG12 VAL B 687 -0.295 6.873 -22.304 1.00 0.00 H new ATOM 0 HG13 VAL B 687 1.352 7.062 -21.657 1.00 0.00 H new ATOM 0 HG21 VAL B 687 1.208 10.089 -21.291 1.00 0.00 H new ATOM 0 HG22 VAL B 687 2.591 9.229 -22.007 1.00 0.00 H new ATOM 0 HG23 VAL B 687 1.807 10.552 -22.901 1.00 0.00 H new ATOM 1493 N PHE B 688 -0.483 8.171 -25.923 1.00 0.00 N ATOM 1494 CA PHE B 688 -1.466 7.568 -26.806 1.00 0.00 C ATOM 1495 C PHE B 688 -0.829 6.560 -27.772 1.00 0.00 C ATOM 1496 O PHE B 688 -1.392 5.492 -28.018 1.00 0.00 O ATOM 1497 CB PHE B 688 -2.204 8.683 -27.557 1.00 0.00 C ATOM 1498 CG PHE B 688 -3.547 8.252 -28.088 1.00 0.00 C ATOM 1499 CD1 PHE B 688 -4.502 7.742 -27.197 1.00 0.00 C ATOM 1500 CD2 PHE B 688 -3.859 8.391 -29.450 1.00 0.00 C ATOM 1501 CE1 PHE B 688 -5.780 7.389 -27.647 1.00 0.00 C ATOM 1502 CE2 PHE B 688 -5.127 8.005 -29.914 1.00 0.00 C ATOM 1503 CZ PHE B 688 -6.079 7.490 -29.015 1.00 0.00 C ATOM 0 H PHE B 688 -0.376 9.178 -26.047 1.00 0.00 H new ATOM 0 HA PHE B 688 -2.180 7.001 -26.209 1.00 0.00 H new ATOM 0 HB2 PHE B 688 -2.340 9.534 -26.889 1.00 0.00 H new ATOM 0 HB3 PHE B 688 -1.585 9.025 -28.387 1.00 0.00 H new ATOM 0 HD1 PHE B 688 -4.249 7.620 -26.154 1.00 0.00 H new ATOM 0 HD2 PHE B 688 -3.128 8.792 -30.137 1.00 0.00 H new ATOM 0 HE1 PHE B 688 -6.528 7.043 -26.949 1.00 0.00 H new ATOM 0 HE2 PHE B 688 -5.372 8.103 -30.961 1.00 0.00 H new ATOM 0 HZ PHE B 688 -7.044 7.171 -29.379 1.00 0.00 H new ATOM 1513 N TYR B 689 0.356 6.870 -28.298 1.00 0.00 N ATOM 1514 CA TYR B 689 1.123 5.984 -29.161 1.00 0.00 C ATOM 1515 C TYR B 689 1.775 4.851 -28.374 1.00 0.00 C ATOM 1516 O TYR B 689 2.128 3.827 -28.958 1.00 0.00 O ATOM 1517 CB TYR B 689 2.195 6.790 -29.905 1.00 0.00 C ATOM 1518 CG TYR B 689 1.701 7.879 -30.848 1.00 0.00 C ATOM 1519 CD1 TYR B 689 0.383 7.879 -31.356 1.00 0.00 C ATOM 1520 CD2 TYR B 689 2.593 8.892 -31.235 1.00 0.00 C ATOM 1521 CE1 TYR B 689 -0.026 8.873 -32.263 1.00 0.00 C ATOM 1522 CE2 TYR B 689 2.192 9.892 -32.142 1.00 0.00 C ATOM 1523 CZ TYR B 689 0.877 9.886 -32.663 1.00 0.00 C ATOM 1524 OH TYR B 689 0.472 10.841 -33.551 1.00 0.00 O ATOM 0 H TYR B 689 0.816 7.765 -28.130 1.00 0.00 H new ATOM 0 HA TYR B 689 0.435 5.534 -29.877 1.00 0.00 H new ATOM 0 HB2 TYR B 689 2.848 7.252 -29.165 1.00 0.00 H new ATOM 0 HB3 TYR B 689 2.806 6.094 -30.480 1.00 0.00 H new ATOM 0 HD1 TYR B 689 -0.313 7.113 -31.047 1.00 0.00 H new ATOM 0 HD2 TYR B 689 3.596 8.904 -30.834 1.00 0.00 H new ATOM 0 HE1 TYR B 689 -1.032 8.863 -32.655 1.00 0.00 H new ATOM 0 HE2 TYR B 689 2.888 10.663 -32.439 1.00 0.00 H new ATOM 0 HH TYR B 689 1.210 11.463 -33.721 1.00 0.00 H new ATOM 1534 N GLU B 690 1.934 5.027 -27.066 1.00 0.00 N ATOM 1535 CA GLU B 690 2.725 4.133 -26.233 1.00 0.00 C ATOM 1536 C GLU B 690 1.841 3.130 -25.484 1.00 0.00 C ATOM 1537 O GLU B 690 2.263 1.991 -25.258 1.00 0.00 O ATOM 1538 CB GLU B 690 3.545 5.036 -25.288 1.00 0.00 C ATOM 1539 CG GLU B 690 3.837 4.459 -23.906 1.00 0.00 C ATOM 1540 CD GLU B 690 4.624 5.452 -23.040 1.00 0.00 C ATOM 1541 OE1 GLU B 690 3.996 6.342 -22.418 1.00 0.00 O ATOM 1542 OE2 GLU B 690 5.869 5.350 -22.944 1.00 0.00 O ATOM 0 H GLU B 690 1.513 5.801 -26.552 1.00 0.00 H new ATOM 0 HA GLU B 690 3.393 3.515 -26.833 1.00 0.00 H new ATOM 0 HB2 GLU B 690 4.494 5.269 -25.771 1.00 0.00 H new ATOM 0 HB3 GLU B 690 3.011 5.978 -25.162 1.00 0.00 H new ATOM 0 HG2 GLU B 690 2.900 4.205 -23.411 1.00 0.00 H new ATOM 0 HG3 GLU B 690 4.404 3.534 -24.009 1.00 0.00 H new ATOM 1549 N LEU B 691 0.628 3.535 -25.100 1.00 0.00 N ATOM 1550 CA LEU B 691 -0.370 2.633 -24.554 1.00 0.00 C ATOM 1551 C LEU B 691 -0.767 1.593 -25.608 1.00 0.00 C ATOM 1552 O LEU B 691 -0.430 1.723 -26.789 1.00 0.00 O ATOM 1553 CB LEU B 691 -1.544 3.423 -23.932 1.00 0.00 C ATOM 1554 CG LEU B 691 -2.468 4.259 -24.839 1.00 0.00 C ATOM 1555 CD1 LEU B 691 -3.263 3.455 -25.854 1.00 0.00 C ATOM 1556 CD2 LEU B 691 -3.460 5.021 -23.951 1.00 0.00 C ATOM 0 H LEU B 691 0.316 4.504 -25.162 1.00 0.00 H new ATOM 0 HA LEU B 691 0.046 2.063 -23.723 1.00 0.00 H new ATOM 0 HB2 LEU B 691 -2.171 2.708 -23.399 1.00 0.00 H new ATOM 0 HB3 LEU B 691 -1.124 4.097 -23.186 1.00 0.00 H new ATOM 0 HG LEU B 691 -1.815 4.918 -25.411 1.00 0.00 H new ATOM 0 HD11 LEU B 691 -3.883 4.128 -26.446 1.00 0.00 H new ATOM 0 HD12 LEU B 691 -2.578 2.920 -26.512 1.00 0.00 H new ATOM 0 HD13 LEU B 691 -3.899 2.739 -25.333 1.00 0.00 H new ATOM 0 HD21 LEU B 691 -4.123 5.619 -24.576 1.00 0.00 H new ATOM 0 HD22 LEU B 691 -4.050 4.311 -23.372 1.00 0.00 H new ATOM 0 HD23 LEU B 691 -2.913 5.676 -23.273 1.00 0.00 H new ATOM 1568 N ALA B 692 -1.483 0.558 -25.157 1.00 0.00 N ATOM 1569 CA ALA B 692 -1.907 -0.558 -25.995 1.00 0.00 C ATOM 1570 C ALA B 692 -2.570 -0.048 -27.270 1.00 0.00 C ATOM 1571 O ALA B 692 -3.536 0.708 -27.196 1.00 0.00 O ATOM 1572 CB ALA B 692 -2.880 -1.431 -25.204 1.00 0.00 C ATOM 0 H ALA B 692 -1.786 0.475 -24.187 1.00 0.00 H new ATOM 0 HA ALA B 692 -1.036 -1.147 -26.281 1.00 0.00 H new ATOM 0 HB1 ALA B 692 -3.203 -2.268 -25.823 1.00 0.00 H new ATOM 0 HB2 ALA B 692 -2.385 -1.810 -24.310 1.00 0.00 H new ATOM 0 HB3 ALA B 692 -3.748 -0.838 -24.914 1.00 0.00 H new ATOM 1578 N GLU B 693 -2.106 -0.506 -28.431 1.00 0.00 N ATOM 1579 CA GLU B 693 -2.634 -0.054 -29.714 1.00 0.00 C ATOM 1580 C GLU B 693 -4.130 -0.271 -29.777 1.00 0.00 C ATOM 1581 O GLU B 693 -4.857 0.600 -30.229 1.00 0.00 O ATOM 1582 CB GLU B 693 -1.973 -0.819 -30.857 1.00 0.00 C ATOM 1583 CG GLU B 693 -0.568 -0.257 -31.127 1.00 0.00 C ATOM 1584 CD GLU B 693 0.161 -1.074 -32.208 1.00 0.00 C ATOM 1585 OE1 GLU B 693 0.856 -2.063 -31.861 1.00 0.00 O ATOM 1586 OE2 GLU B 693 0.047 -0.728 -33.411 1.00 0.00 O ATOM 0 H GLU B 693 -1.359 -1.196 -28.508 1.00 0.00 H new ATOM 0 HA GLU B 693 -2.418 1.010 -29.813 1.00 0.00 H new ATOM 0 HB2 GLU B 693 -1.907 -1.878 -30.606 1.00 0.00 H new ATOM 0 HB3 GLU B 693 -2.583 -0.742 -31.757 1.00 0.00 H new ATOM 0 HG2 GLU B 693 -0.644 0.783 -31.444 1.00 0.00 H new ATOM 0 HG3 GLU B 693 0.014 -0.268 -30.205 1.00 0.00 H new ATOM 1593 N ALA B 694 -4.616 -1.400 -29.264 1.00 0.00 N ATOM 1594 CA ALA B 694 -6.031 -1.696 -29.355 1.00 0.00 C ATOM 1595 C ALA B 694 -6.863 -0.654 -28.580 1.00 0.00 C ATOM 1596 O ALA B 694 -7.930 -0.247 -29.035 1.00 0.00 O ATOM 1597 CB ALA B 694 -6.271 -3.111 -28.838 1.00 0.00 C ATOM 0 H ALA B 694 -4.056 -2.109 -28.790 1.00 0.00 H new ATOM 0 HA ALA B 694 -6.353 -1.641 -30.395 1.00 0.00 H new ATOM 0 HB1 ALA B 694 -7.333 -3.346 -28.901 1.00 0.00 H new ATOM 0 HB2 ALA B 694 -5.706 -3.820 -29.443 1.00 0.00 H new ATOM 0 HB3 ALA B 694 -5.946 -3.179 -27.800 1.00 0.00 H new ATOM 1603 N VAL B 695 -6.346 -0.175 -27.440 1.00 0.00 N ATOM 1604 CA VAL B 695 -6.951 0.912 -26.669 1.00 0.00 C ATOM 1605 C VAL B 695 -6.863 2.202 -27.479 1.00 0.00 C ATOM 1606 O VAL B 695 -7.859 2.913 -27.558 1.00 0.00 O ATOM 1607 CB VAL B 695 -6.265 1.022 -25.289 1.00 0.00 C ATOM 1608 CG1 VAL B 695 -6.413 2.383 -24.590 1.00 0.00 C ATOM 1609 CG2 VAL B 695 -6.819 -0.043 -24.334 1.00 0.00 C ATOM 0 H VAL B 695 -5.487 -0.537 -27.026 1.00 0.00 H new ATOM 0 HA VAL B 695 -8.006 0.712 -26.479 1.00 0.00 H new ATOM 0 HB VAL B 695 -5.206 0.881 -25.505 1.00 0.00 H new ATOM 0 HG11 VAL B 695 -5.897 2.357 -23.630 1.00 0.00 H new ATOM 0 HG12 VAL B 695 -5.977 3.162 -25.215 1.00 0.00 H new ATOM 0 HG13 VAL B 695 -7.470 2.596 -24.428 1.00 0.00 H new ATOM 0 HG21 VAL B 695 -6.327 0.046 -23.365 1.00 0.00 H new ATOM 0 HG22 VAL B 695 -7.892 0.102 -24.211 1.00 0.00 H new ATOM 0 HG23 VAL B 695 -6.632 -1.034 -24.747 1.00 0.00 H new ATOM 1619 N GLN B 696 -5.717 2.510 -28.094 1.00 0.00 N ATOM 1620 CA GLN B 696 -5.559 3.704 -28.917 1.00 0.00 C ATOM 1621 C GLN B 696 -6.582 3.706 -30.048 1.00 0.00 C ATOM 1622 O GLN B 696 -7.226 4.722 -30.256 1.00 0.00 O ATOM 1623 CB GLN B 696 -4.128 3.754 -29.460 1.00 0.00 C ATOM 1624 CG GLN B 696 -3.808 4.953 -30.355 1.00 0.00 C ATOM 1625 CD GLN B 696 -2.612 4.638 -31.242 1.00 0.00 C ATOM 1626 OE1 GLN B 696 -2.704 4.639 -32.464 1.00 0.00 O ATOM 1627 NE2 GLN B 696 -1.481 4.309 -30.638 1.00 0.00 N ATOM 0 H GLN B 696 -4.876 1.936 -28.033 1.00 0.00 H new ATOM 0 HA GLN B 696 -5.735 4.594 -28.313 1.00 0.00 H new ATOM 0 HB2 GLN B 696 -3.437 3.757 -28.617 1.00 0.00 H new ATOM 0 HB3 GLN B 696 -3.939 2.840 -30.024 1.00 0.00 H new ATOM 0 HG2 GLN B 696 -4.673 5.198 -30.971 1.00 0.00 H new ATOM 0 HG3 GLN B 696 -3.595 5.828 -29.741 1.00 0.00 H new ATOM 0 HE21 GLN B 696 -1.426 4.315 -29.619 1.00 0.00 H new ATOM 0 HE22 GLN B 696 -0.664 4.050 -31.191 1.00 0.00 H new ATOM 1636 N LYS B 697 -6.767 2.594 -30.765 1.00 0.00 N ATOM 1637 CA LYS B 697 -7.725 2.515 -31.870 1.00 0.00 C ATOM 1638 C LYS B 697 -9.136 2.750 -31.349 1.00 0.00 C ATOM 1639 O LYS B 697 -9.872 3.552 -31.923 1.00 0.00 O ATOM 1640 CB LYS B 697 -7.648 1.134 -32.545 1.00 0.00 C ATOM 1641 CG LYS B 697 -6.312 0.849 -33.244 1.00 0.00 C ATOM 1642 CD LYS B 697 -5.958 1.783 -34.418 1.00 0.00 C ATOM 1643 CE LYS B 697 -7.039 1.807 -35.514 1.00 0.00 C ATOM 1644 NZ LYS B 697 -6.573 2.499 -36.750 1.00 0.00 N ATOM 0 H LYS B 697 -6.258 1.726 -30.596 1.00 0.00 H new ATOM 0 HA LYS B 697 -7.477 3.283 -32.603 1.00 0.00 H new ATOM 0 HB2 LYS B 697 -7.823 0.364 -31.793 1.00 0.00 H new ATOM 0 HB3 LYS B 697 -8.452 1.054 -33.276 1.00 0.00 H new ATOM 0 HG2 LYS B 697 -5.515 0.910 -32.503 1.00 0.00 H new ATOM 0 HG3 LYS B 697 -6.327 -0.177 -33.612 1.00 0.00 H new ATOM 0 HD2 LYS B 697 -5.810 2.794 -34.039 1.00 0.00 H new ATOM 0 HD3 LYS B 697 -5.012 1.465 -34.856 1.00 0.00 H new ATOM 0 HE2 LYS B 697 -7.328 0.785 -35.759 1.00 0.00 H new ATOM 0 HE3 LYS B 697 -7.929 2.308 -35.133 1.00 0.00 H new ATOM 0 HZ1 LYS B 697 -7.333 2.491 -37.460 1.00 0.00 H new ATOM 0 HZ2 LYS B 697 -6.321 3.482 -36.523 1.00 0.00 H new ATOM 0 HZ3 LYS B 697 -5.739 2.007 -37.130 1.00 0.00 H new ATOM 1658 N GLU B 698 -9.501 2.068 -30.264 1.00 0.00 N ATOM 1659 CA GLU B 698 -10.834 2.175 -29.674 1.00 0.00 C ATOM 1660 C GLU B 698 -11.101 3.623 -29.236 1.00 0.00 C ATOM 1661 O GLU B 698 -12.151 4.185 -29.561 1.00 0.00 O ATOM 1662 CB GLU B 698 -10.952 1.155 -28.528 1.00 0.00 C ATOM 1663 CG GLU B 698 -12.353 1.084 -27.900 1.00 0.00 C ATOM 1664 CD GLU B 698 -12.416 1.780 -26.530 1.00 0.00 C ATOM 1665 OE1 GLU B 698 -12.236 3.016 -26.451 1.00 0.00 O ATOM 1666 OE2 GLU B 698 -12.666 1.102 -25.504 1.00 0.00 O ATOM 0 H GLU B 698 -8.881 1.426 -29.770 1.00 0.00 H new ATOM 0 HA GLU B 698 -11.606 1.934 -30.405 1.00 0.00 H new ATOM 0 HB2 GLU B 698 -10.683 0.168 -28.904 1.00 0.00 H new ATOM 0 HB3 GLU B 698 -10.229 1.409 -27.753 1.00 0.00 H new ATOM 0 HG2 GLU B 698 -13.074 1.547 -28.573 1.00 0.00 H new ATOM 0 HG3 GLU B 698 -12.646 0.040 -27.788 1.00 0.00 H new ATOM 1673 N LEU B 699 -10.119 4.249 -28.583 1.00 0.00 N ATOM 1674 CA LEU B 699 -10.192 5.625 -28.116 1.00 0.00 C ATOM 1675 C LEU B 699 -10.298 6.560 -29.292 1.00 0.00 C ATOM 1676 O LEU B 699 -11.162 7.416 -29.291 1.00 0.00 O ATOM 1677 CB LEU B 699 -8.932 6.004 -27.324 1.00 0.00 C ATOM 1678 CG LEU B 699 -9.017 5.591 -25.858 1.00 0.00 C ATOM 1679 CD1 LEU B 699 -7.615 5.503 -25.243 1.00 0.00 C ATOM 1680 CD2 LEU B 699 -9.853 6.618 -25.074 1.00 0.00 C ATOM 0 H LEU B 699 -9.232 3.797 -28.362 1.00 0.00 H new ATOM 0 HA LEU B 699 -11.069 5.711 -27.474 1.00 0.00 H new ATOM 0 HB2 LEU B 699 -8.063 5.531 -27.782 1.00 0.00 H new ATOM 0 HB3 LEU B 699 -8.778 7.081 -27.386 1.00 0.00 H new ATOM 0 HG LEU B 699 -9.492 4.611 -25.802 1.00 0.00 H new ATOM 0 HD11 LEU B 699 -7.694 5.207 -24.197 1.00 0.00 H new ATOM 0 HD12 LEU B 699 -7.026 4.764 -25.785 1.00 0.00 H new ATOM 0 HD13 LEU B 699 -7.127 6.475 -25.309 1.00 0.00 H new ATOM 0 HD21 LEU B 699 -9.910 6.318 -24.028 1.00 0.00 H new ATOM 0 HD22 LEU B 699 -9.384 7.599 -25.145 1.00 0.00 H new ATOM 0 HD23 LEU B 699 -10.858 6.665 -25.493 1.00 0.00 H new ATOM 1692 N LEU B 700 -9.431 6.414 -30.284 1.00 0.00 N ATOM 1693 CA LEU B 700 -9.355 7.289 -31.436 1.00 0.00 C ATOM 1694 C LEU B 700 -10.669 7.283 -32.194 1.00 0.00 C ATOM 1695 O LEU B 700 -11.120 8.342 -32.625 1.00 0.00 O ATOM 1696 CB LEU B 700 -8.206 6.797 -32.319 1.00 0.00 C ATOM 1697 CG LEU B 700 -8.018 7.576 -33.629 1.00 0.00 C ATOM 1698 CD1 LEU B 700 -7.793 9.070 -33.374 1.00 0.00 C ATOM 1699 CD2 LEU B 700 -6.809 6.983 -34.357 1.00 0.00 C ATOM 0 H LEU B 700 -8.743 5.661 -30.306 1.00 0.00 H new ATOM 0 HA LEU B 700 -9.169 8.317 -31.125 1.00 0.00 H new ATOM 0 HB2 LEU B 700 -7.280 6.848 -31.747 1.00 0.00 H new ATOM 0 HB3 LEU B 700 -8.375 5.747 -32.559 1.00 0.00 H new ATOM 0 HG LEU B 700 -8.921 7.487 -34.232 1.00 0.00 H new ATOM 0 HD11 LEU B 700 -7.664 9.586 -34.325 1.00 0.00 H new ATOM 0 HD12 LEU B 700 -8.655 9.484 -32.850 1.00 0.00 H new ATOM 0 HD13 LEU B 700 -6.899 9.205 -32.764 1.00 0.00 H new ATOM 0 HD21 LEU B 700 -6.650 7.517 -35.294 1.00 0.00 H new ATOM 0 HD22 LEU B 700 -5.923 7.080 -33.729 1.00 0.00 H new ATOM 0 HD23 LEU B 700 -6.992 5.929 -34.567 1.00 0.00 H new ATOM 1711 N ALA B 701 -11.297 6.115 -32.329 1.00 0.00 N ATOM 1712 CA ALA B 701 -12.634 6.020 -32.883 1.00 0.00 C ATOM 1713 C ALA B 701 -13.590 6.866 -32.046 1.00 0.00 C ATOM 1714 O ALA B 701 -14.292 7.695 -32.614 1.00 0.00 O ATOM 1715 CB ALA B 701 -13.073 4.559 -32.971 1.00 0.00 C ATOM 0 H ALA B 701 -10.892 5.219 -32.058 1.00 0.00 H new ATOM 0 HA ALA B 701 -12.644 6.412 -33.900 1.00 0.00 H new ATOM 0 HB1 ALA B 701 -14.078 4.506 -33.389 1.00 0.00 H new ATOM 0 HB2 ALA B 701 -12.384 4.010 -33.613 1.00 0.00 H new ATOM 0 HB3 ALA B 701 -13.070 4.118 -31.974 1.00 0.00 H new ATOM 1721 N GLU B 702 -13.582 6.732 -30.716 1.00 0.00 N ATOM 1722 CA GLU B 702 -14.374 7.573 -29.815 1.00 0.00 C ATOM 1723 C GLU B 702 -14.094 9.050 -30.106 1.00 0.00 C ATOM 1724 O GLU B 702 -15.006 9.825 -30.376 1.00 0.00 O ATOM 1725 CB GLU B 702 -14.051 7.233 -28.342 1.00 0.00 C ATOM 1726 CG GLU B 702 -15.268 7.239 -27.409 1.00 0.00 C ATOM 1727 CD GLU B 702 -16.282 6.128 -27.706 1.00 0.00 C ATOM 1728 OE1 GLU B 702 -16.044 4.954 -27.332 1.00 0.00 O ATOM 1729 OE2 GLU B 702 -17.347 6.434 -28.294 1.00 0.00 O ATOM 0 H GLU B 702 -13.021 6.031 -30.231 1.00 0.00 H new ATOM 0 HA GLU B 702 -15.433 7.379 -29.983 1.00 0.00 H new ATOM 0 HB2 GLU B 702 -13.583 6.249 -28.303 1.00 0.00 H new ATOM 0 HB3 GLU B 702 -13.319 7.949 -27.969 1.00 0.00 H new ATOM 0 HG2 GLU B 702 -14.925 7.139 -26.379 1.00 0.00 H new ATOM 0 HG3 GLU B 702 -15.768 8.204 -27.486 1.00 0.00 H new ATOM 1736 N TRP B 703 -12.824 9.446 -30.119 1.00 0.00 N ATOM 1737 CA TRP B 703 -12.411 10.825 -30.184 1.00 0.00 C ATOM 1738 C TRP B 703 -12.788 11.453 -31.536 1.00 0.00 C ATOM 1739 O TRP B 703 -13.134 12.633 -31.592 1.00 0.00 O ATOM 1740 CB TRP B 703 -10.896 10.880 -29.918 1.00 0.00 C ATOM 1741 CG TRP B 703 -10.317 10.284 -28.647 1.00 0.00 C ATOM 1742 CD1 TRP B 703 -10.958 9.807 -27.555 1.00 0.00 C ATOM 1743 CD2 TRP B 703 -8.911 10.227 -28.270 1.00 0.00 C ATOM 1744 NE1 TRP B 703 -10.073 9.497 -26.542 1.00 0.00 N ATOM 1745 CE2 TRP B 703 -8.799 9.802 -26.919 1.00 0.00 C ATOM 1746 CE3 TRP B 703 -7.724 10.581 -28.919 1.00 0.00 C ATOM 1747 CZ2 TRP B 703 -7.609 9.851 -26.193 1.00 0.00 C ATOM 1748 CZ3 TRP B 703 -6.507 10.621 -28.215 1.00 0.00 C ATOM 1749 CH2 TRP B 703 -6.453 10.308 -26.841 1.00 0.00 C ATOM 0 H TRP B 703 -12.042 8.792 -30.083 1.00 0.00 H new ATOM 0 HA TRP B 703 -12.929 11.413 -29.426 1.00 0.00 H new ATOM 0 HB2 TRP B 703 -10.403 10.389 -30.757 1.00 0.00 H new ATOM 0 HB3 TRP B 703 -10.602 11.929 -29.945 1.00 0.00 H new ATOM 0 HD1 TRP B 703 -12.029 9.684 -27.485 1.00 0.00 H new ATOM 0 HE1 TRP B 703 -10.335 9.097 -25.641 1.00 0.00 H new ATOM 0 HE3 TRP B 703 -7.742 10.826 -29.971 1.00 0.00 H new ATOM 0 HZ2 TRP B 703 -7.579 9.545 -25.158 1.00 0.00 H new ATOM 0 HZ3 TRP B 703 -5.601 10.895 -28.734 1.00 0.00 H new ATOM 0 HH2 TRP B 703 -5.529 10.419 -26.293 1.00 0.00 H new ATOM 1760 N LYS B 704 -12.776 10.670 -32.623 1.00 0.00 N ATOM 1761 CA LYS B 704 -13.055 11.162 -33.973 1.00 0.00 C ATOM 1762 C LYS B 704 -14.531 11.065 -34.334 1.00 0.00 C ATOM 1763 O LYS B 704 -14.995 11.819 -35.188 1.00 0.00 O ATOM 1764 CB LYS B 704 -12.168 10.435 -35.012 1.00 0.00 C ATOM 1765 CG LYS B 704 -12.729 9.115 -35.573 1.00 0.00 C ATOM 1766 CD LYS B 704 -11.681 8.408 -36.451 1.00 0.00 C ATOM 1767 CE LYS B 704 -12.206 7.115 -37.112 1.00 0.00 C ATOM 1768 NZ LYS B 704 -13.168 7.365 -38.221 1.00 0.00 N ATOM 0 H LYS B 704 -12.571 9.672 -32.587 1.00 0.00 H new ATOM 0 HA LYS B 704 -12.804 12.223 -33.990 1.00 0.00 H new ATOM 0 HB2 LYS B 704 -11.989 11.114 -35.846 1.00 0.00 H new ATOM 0 HB3 LYS B 704 -11.200 10.230 -34.554 1.00 0.00 H new ATOM 0 HG2 LYS B 704 -13.024 8.461 -34.752 1.00 0.00 H new ATOM 0 HG3 LYS B 704 -13.626 9.315 -36.159 1.00 0.00 H new ATOM 0 HD2 LYS B 704 -11.347 9.095 -37.229 1.00 0.00 H new ATOM 0 HD3 LYS B 704 -10.810 8.168 -35.842 1.00 0.00 H new ATOM 0 HE2 LYS B 704 -11.361 6.543 -37.496 1.00 0.00 H new ATOM 0 HE3 LYS B 704 -12.689 6.499 -36.354 1.00 0.00 H new ATOM 0 HZ1 LYS B 704 -13.481 6.457 -38.620 1.00 0.00 H new ATOM 0 HZ2 LYS B 704 -13.991 7.885 -37.856 1.00 0.00 H new ATOM 0 HZ3 LYS B 704 -12.704 7.928 -38.962 1.00 0.00 H new ATOM 1782 N ARG B 705 -15.280 10.141 -33.718 1.00 0.00 N ATOM 1783 CA ARG B 705 -16.676 9.901 -34.115 1.00 0.00 C ATOM 1784 C ARG B 705 -17.583 10.899 -33.407 1.00 0.00 C ATOM 1785 O ARG B 705 -18.580 11.342 -33.972 1.00 0.00 O ATOM 1786 CB ARG B 705 -17.079 8.432 -33.886 1.00 0.00 C ATOM 1787 CG ARG B 705 -17.398 8.078 -32.427 1.00 0.00 C ATOM 1788 CD ARG B 705 -17.291 6.570 -32.189 1.00 0.00 C ATOM 1789 NE ARG B 705 -17.988 6.175 -30.957 1.00 0.00 N ATOM 1790 CZ ARG B 705 -19.126 5.488 -30.818 1.00 0.00 C ATOM 1791 NH1 ARG B 705 -19.843 5.093 -31.869 1.00 0.00 N ATOM 1792 NH2 ARG B 705 -19.515 5.216 -29.580 1.00 0.00 N ATOM 0 H ARG B 705 -14.949 9.554 -32.952 1.00 0.00 H new ATOM 0 HA ARG B 705 -16.787 10.065 -35.187 1.00 0.00 H new ATOM 0 HB2 ARG B 705 -17.952 8.208 -34.500 1.00 0.00 H new ATOM 0 HB3 ARG B 705 -16.271 7.789 -34.234 1.00 0.00 H new ATOM 0 HG2 ARG B 705 -16.711 8.603 -31.764 1.00 0.00 H new ATOM 0 HG3 ARG B 705 -18.403 8.418 -32.179 1.00 0.00 H new ATOM 0 HD2 ARG B 705 -17.716 6.034 -33.038 1.00 0.00 H new ATOM 0 HD3 ARG B 705 -16.241 6.283 -32.124 1.00 0.00 H new ATOM 0 HE ARG B 705 -17.541 6.465 -30.087 1.00 0.00 H new ATOM 0 HH11 ARG B 705 -19.527 5.314 -32.814 1.00 0.00 H new ATOM 0 HH12 ARG B 705 -20.707 4.570 -31.729 1.00 0.00 H new ATOM 0 HH21 ARG B 705 -18.953 5.529 -28.788 1.00 0.00 H new ATOM 0 HH22 ARG B 705 -20.377 4.694 -29.419 1.00 0.00 H new ATOM 1806 N THR B 706 -17.204 11.270 -32.181 1.00 0.00 N ATOM 1807 CA THR B 706 -17.815 12.365 -31.450 1.00 0.00 C ATOM 1808 C THR B 706 -17.544 13.665 -32.212 1.00 0.00 C ATOM 1809 O THR B 706 -18.403 14.547 -32.294 1.00 0.00 O ATOM 1810 CB THR B 706 -17.244 12.375 -30.031 1.00 0.00 C ATOM 1811 OG1 THR B 706 -15.831 12.426 -30.069 1.00 0.00 O ATOM 1812 CG2 THR B 706 -17.635 11.091 -29.305 1.00 0.00 C ATOM 0 H THR B 706 -16.454 10.807 -31.668 1.00 0.00 H new ATOM 0 HA THR B 706 -18.896 12.252 -31.368 1.00 0.00 H new ATOM 0 HB THR B 706 -17.642 13.249 -29.516 1.00 0.00 H new ATOM 0 HG1 THR B 706 -15.470 11.516 -30.032 1.00 0.00 H new ATOM 0 HG21 THR B 706 -17.225 11.105 -28.295 1.00 0.00 H new ATOM 0 HG22 THR B 706 -18.721 11.018 -29.255 1.00 0.00 H new ATOM 0 HG23 THR B 706 -17.238 10.232 -29.846 1.00 0.00 H new ATOM 1820 N GLY B 707 -16.351 13.746 -32.813 1.00 0.00 N ATOM 1821 CA GLY B 707 -15.955 14.773 -33.760 1.00 0.00 C ATOM 1822 C GLY B 707 -14.974 15.739 -33.113 1.00 0.00 C ATOM 1823 O GLY B 707 -13.961 16.091 -33.716 1.00 0.00 O ATOM 0 H GLY B 707 -15.611 13.066 -32.640 1.00 0.00 H new ATOM 0 HA2 GLY B 707 -15.498 14.313 -34.636 1.00 0.00 H new ATOM 0 HA3 GLY B 707 -16.834 15.315 -34.107 1.00 0.00 H new ATOM 1827 N SER B 708 -15.228 16.077 -31.852 1.00 0.00 N ATOM 1828 CA SER B 708 -14.470 17.053 -31.079 1.00 0.00 C ATOM 1829 C SER B 708 -14.050 16.460 -29.725 1.00 0.00 C ATOM 1830 O SER B 708 -13.792 17.213 -28.787 1.00 0.00 O ATOM 1831 CB SER B 708 -15.314 18.334 -30.936 1.00 0.00 C ATOM 1832 OG SER B 708 -15.783 18.787 -32.203 1.00 0.00 O ATOM 0 H SER B 708 -15.995 15.663 -31.322 1.00 0.00 H new ATOM 0 HA SER B 708 -13.546 17.314 -31.595 1.00 0.00 H new ATOM 0 HB2 SER B 708 -16.162 18.142 -30.279 1.00 0.00 H new ATOM 0 HB3 SER B 708 -14.717 19.115 -30.466 1.00 0.00 H new ATOM 0 HG SER B 708 -16.317 19.600 -32.083 1.00 0.00 H new ATOM 1838 N ASP B 709 -14.028 15.119 -29.616 1.00 0.00 N ATOM 1839 CA ASP B 709 -13.646 14.319 -28.441 1.00 0.00 C ATOM 1840 C ASP B 709 -14.396 14.638 -27.131 1.00 0.00 C ATOM 1841 O ASP B 709 -14.054 14.118 -26.064 1.00 0.00 O ATOM 1842 CB ASP B 709 -12.117 14.302 -28.261 1.00 0.00 C ATOM 1843 CG ASP B 709 -11.474 15.582 -27.651 1.00 0.00 C ATOM 1844 OD1 ASP B 709 -11.927 16.128 -26.613 1.00 0.00 O ATOM 1845 OD2 ASP B 709 -10.441 16.014 -28.224 1.00 0.00 O ATOM 0 H ASP B 709 -14.295 14.526 -30.402 1.00 0.00 H new ATOM 0 HA ASP B 709 -13.984 13.308 -28.670 1.00 0.00 H new ATOM 0 HB2 ASP B 709 -11.858 13.455 -27.626 1.00 0.00 H new ATOM 0 HB3 ASP B 709 -11.661 14.122 -29.235 1.00 0.00 H new ATOM 1850 N PHE B 710 -15.492 15.397 -27.222 1.00 0.00 N ATOM 1851 CA PHE B 710 -16.259 16.020 -26.159 1.00 0.00 C ATOM 1852 C PHE B 710 -15.417 16.852 -25.171 1.00 0.00 C ATOM 1853 O PHE B 710 -15.486 18.084 -25.217 1.00 0.00 O ATOM 1854 CB PHE B 710 -17.080 14.982 -25.398 1.00 0.00 C ATOM 1855 CG PHE B 710 -18.050 14.111 -26.166 1.00 0.00 C ATOM 1856 CD1 PHE B 710 -19.088 14.659 -26.945 1.00 0.00 C ATOM 1857 CD2 PHE B 710 -17.981 12.721 -25.980 1.00 0.00 C ATOM 1858 CE1 PHE B 710 -20.049 13.811 -27.523 1.00 0.00 C ATOM 1859 CE2 PHE B 710 -18.956 11.879 -26.529 1.00 0.00 C ATOM 1860 CZ PHE B 710 -19.994 12.421 -27.306 1.00 0.00 C ATOM 0 H PHE B 710 -15.897 15.606 -28.135 1.00 0.00 H new ATOM 0 HA PHE B 710 -16.922 16.724 -26.662 1.00 0.00 H new ATOM 0 HB2 PHE B 710 -16.382 14.322 -24.883 1.00 0.00 H new ATOM 0 HB3 PHE B 710 -17.647 15.508 -24.630 1.00 0.00 H new ATOM 0 HD1 PHE B 710 -19.145 15.727 -27.098 1.00 0.00 H new ATOM 0 HD2 PHE B 710 -17.169 12.297 -25.408 1.00 0.00 H new ATOM 0 HE1 PHE B 710 -20.834 14.228 -28.137 1.00 0.00 H new ATOM 0 HE2 PHE B 710 -18.910 10.814 -26.355 1.00 0.00 H new ATOM 0 HZ PHE B 710 -20.746 11.775 -27.734 1.00 0.00 H new ATOM 1870 N HIS B 711 -14.659 16.206 -24.272 1.00 0.00 N ATOM 1871 CA HIS B 711 -14.000 16.850 -23.132 1.00 0.00 C ATOM 1872 C HIS B 711 -12.723 16.110 -22.726 1.00 0.00 C ATOM 1873 O HIS B 711 -12.549 15.787 -21.550 1.00 0.00 O ATOM 1874 CB HIS B 711 -14.953 16.911 -21.917 1.00 0.00 C ATOM 1875 CG HIS B 711 -16.319 17.510 -22.142 1.00 0.00 C ATOM 1876 ND1 HIS B 711 -16.637 18.871 -22.117 1.00 0.00 N ATOM 1877 CD2 HIS B 711 -17.460 16.784 -22.323 1.00 0.00 C ATOM 1878 CE1 HIS B 711 -17.967 18.932 -22.308 1.00 0.00 C ATOM 1879 NE2 HIS B 711 -18.484 17.696 -22.437 1.00 0.00 N ATOM 0 H HIS B 711 -14.485 15.202 -24.320 1.00 0.00 H new ATOM 0 HA HIS B 711 -13.735 17.860 -23.445 1.00 0.00 H new ATOM 0 HB2 HIS B 711 -15.087 15.897 -21.541 1.00 0.00 H new ATOM 0 HB3 HIS B 711 -14.460 17.480 -21.129 1.00 0.00 H new ATOM 0 HD2 HIS B 711 -17.543 15.708 -22.368 1.00 0.00 H new ATOM 0 HE1 HIS B 711 -18.541 19.846 -22.352 1.00 0.00 H new ATOM 0 HE2 HIS B 711 -19.467 17.473 -22.593 1.00 0.00 H new ATOM 1887 N ILE B 712 -11.835 15.760 -23.653 1.00 0.00 N ATOM 1888 CA ILE B 712 -10.546 15.227 -23.242 1.00 0.00 C ATOM 1889 C ILE B 712 -9.828 16.275 -22.374 1.00 0.00 C ATOM 1890 O ILE B 712 -9.852 17.476 -22.652 1.00 0.00 O ATOM 1891 CB ILE B 712 -9.740 14.698 -24.446 1.00 0.00 C ATOM 1892 CG1 ILE B 712 -10.499 13.488 -25.027 1.00 0.00 C ATOM 1893 CG2 ILE B 712 -8.368 14.206 -23.991 1.00 0.00 C ATOM 1894 CD1 ILE B 712 -9.717 12.678 -26.050 1.00 0.00 C ATOM 0 H ILE B 712 -11.979 15.833 -24.660 1.00 0.00 H new ATOM 0 HA ILE B 712 -10.675 14.344 -22.616 1.00 0.00 H new ATOM 0 HB ILE B 712 -9.619 15.496 -25.179 1.00 0.00 H new ATOM 0 HG12 ILE B 712 -10.788 12.830 -24.207 1.00 0.00 H new ATOM 0 HG13 ILE B 712 -11.419 13.843 -25.491 1.00 0.00 H new ATOM 0 HG21 ILE B 712 -7.811 13.836 -24.851 1.00 0.00 H new ATOM 0 HG22 ILE B 712 -7.821 15.029 -23.531 1.00 0.00 H new ATOM 0 HG23 ILE B 712 -8.492 13.402 -23.266 1.00 0.00 H new ATOM 0 HD11 ILE B 712 -10.330 11.849 -26.403 1.00 0.00 H new ATOM 0 HD12 ILE B 712 -9.450 13.316 -26.892 1.00 0.00 H new ATOM 0 HD13 ILE B 712 -8.810 12.288 -25.589 1.00 0.00 H new ATOM 1906 N GLY B 713 -9.205 15.780 -21.298 1.00 0.00 N ATOM 1907 CA GLY B 713 -8.622 16.596 -20.232 1.00 0.00 C ATOM 1908 C GLY B 713 -9.718 17.372 -19.488 1.00 0.00 C ATOM 1909 O GLY B 713 -9.609 18.584 -19.298 1.00 0.00 O ATOM 0 H GLY B 713 -9.091 14.778 -21.143 1.00 0.00 H new ATOM 0 HA2 GLY B 713 -8.081 15.959 -19.533 1.00 0.00 H new ATOM 0 HA3 GLY B 713 -7.898 17.293 -20.654 1.00 0.00 H new ATOM 1913 N HIS B 714 -10.812 16.675 -19.148 1.00 0.00 N ATOM 1914 CA HIS B 714 -11.998 17.239 -18.501 1.00 0.00 C ATOM 1915 C HIS B 714 -11.635 17.956 -17.194 1.00 0.00 C ATOM 1916 O HIS B 714 -10.756 17.500 -16.457 1.00 0.00 O ATOM 1917 CB HIS B 714 -12.995 16.097 -18.238 1.00 0.00 C ATOM 1918 CG HIS B 714 -14.299 16.544 -17.622 1.00 0.00 C ATOM 1919 ND1 HIS B 714 -14.869 15.991 -16.475 1.00 0.00 N ATOM 1920 CD2 HIS B 714 -15.126 17.517 -18.105 1.00 0.00 C ATOM 1921 CE1 HIS B 714 -16.018 16.663 -16.281 1.00 0.00 C ATOM 1922 NE2 HIS B 714 -16.197 17.580 -17.245 1.00 0.00 N ATOM 0 H HIS B 714 -10.895 15.673 -19.322 1.00 0.00 H new ATOM 0 HA HIS B 714 -12.448 17.984 -19.157 1.00 0.00 H new ATOM 0 HB2 HIS B 714 -13.206 15.590 -19.179 1.00 0.00 H new ATOM 0 HB3 HIS B 714 -12.527 15.365 -17.579 1.00 0.00 H new ATOM 0 HD2 HIS B 714 -14.970 18.119 -18.988 1.00 0.00 H new ATOM 0 HE1 HIS B 714 -16.702 16.489 -15.463 1.00 0.00 H new ATOM 0 HE2 HIS B 714 -16.991 18.215 -17.326 1.00 0.00 H new ATOM 1930 N LYS B 715 -12.319 19.062 -16.894 1.00 0.00 N ATOM 1931 CA LYS B 715 -12.185 19.836 -15.665 1.00 0.00 C ATOM 1932 C LYS B 715 -13.476 20.626 -15.461 1.00 0.00 C ATOM 1933 O LYS B 715 -13.771 21.000 -14.303 1.00 0.00 O ATOM 1934 CB LYS B 715 -10.954 20.763 -15.711 1.00 0.00 C ATOM 1935 CG LYS B 715 -10.955 21.794 -16.856 1.00 0.00 C ATOM 1936 CD LYS B 715 -9.661 22.628 -16.836 1.00 0.00 C ATOM 1937 CE LYS B 715 -9.579 23.634 -17.997 1.00 0.00 C ATOM 1938 NZ LYS B 715 -10.563 24.748 -17.885 1.00 0.00 N ATOM 1939 OXT LYS B 715 -14.201 20.866 -16.457 1.00 0.00 O ATOM 0 H LYS B 715 -13.011 19.457 -17.531 1.00 0.00 H new ATOM 0 HA LYS B 715 -12.027 19.165 -14.821 1.00 0.00 H new ATOM 0 HB2 LYS B 715 -10.884 21.296 -14.763 1.00 0.00 H new ATOM 0 HB3 LYS B 715 -10.058 20.148 -15.797 1.00 0.00 H new ATOM 0 HG2 LYS B 715 -11.049 21.282 -17.814 1.00 0.00 H new ATOM 0 HG3 LYS B 715 -11.819 22.451 -16.760 1.00 0.00 H new ATOM 0 HD2 LYS B 715 -9.596 23.166 -15.890 1.00 0.00 H new ATOM 0 HD3 LYS B 715 -8.802 21.958 -16.881 1.00 0.00 H new ATOM 0 HE2 LYS B 715 -8.573 24.051 -18.037 1.00 0.00 H new ATOM 0 HE3 LYS B 715 -9.743 23.107 -18.937 1.00 0.00 H new ATOM 0 HZ1 LYS B 715 -10.455 25.389 -18.697 1.00 0.00 H new ATOM 0 HZ2 LYS B 715 -11.528 24.360 -17.876 1.00 0.00 H new ATOM 0 HZ3 LYS B 715 -10.393 25.274 -17.004 1.00 0.00 H new TER 1953 LYS B 715