USER MOD reduce.3.24.130724 H: found=0, std=0, add=1310, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1313 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 NoAdj : A 60 ASNHD21 : A 60 ASN OD1 : A 502 CACA :(metal ligand) USER MOD NoAdj : A 60 ASNHD22 : A 60 ASN OD1 : A 502 CACA :(metal ligand) USER MOD Set 1.1: A 101 SER OG : rot 180:sc= 0.769 USER MOD Set 1.2: A 135 GLN : amide:sc= 0.831 X(o=1.6,f=1.2) USER MOD Single : A 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 GLN :FLIP amide:sc= 0 F(o=-0.65,f=0) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0.256 USER MOD Single : A 8 GLN : amide:sc= -0.0337 X(o=-0.034,f=-0.023) USER MOD Single : A 13 LYS NZ :NH3+ -161:sc= 0.0288 (180deg=-0.0446) USER MOD Single : A 17 SER OG : rot 76:sc= 1.23 USER MOD Single : A 21 LYS NZ :NH3+ -174:sc= -0.0106 (180deg=-0.0612) USER MOD Single : A 26 THR OG1 : rot -51:sc= 1.28 USER MOD Single : A 28 THR OG1 : rot -61:sc= 0.335 USER MOD Single : A 29 THR OG1 : rot 176:sc= 1.26 USER MOD Single : A 30 LYS NZ :NH3+ 162:sc= -0.0731 (180deg=-0.443) USER MOD Single : A 34 THR OG1 : rot 73:sc= 1.28 USER MOD Single : A 36 MET CE :methyl -115:sc= -0.147 (180deg=-4.17!) USER MOD Single : A 38 SER OG : rot 83:sc= 1.22 USER MOD Single : A 41 GLN : amide:sc= -0.371 K(o=-0.37,f=-3.9!) USER MOD Single : A 42 ASN :FLIP amide:sc= -0.0153 F(o=-3.4!,f=-0.015) USER MOD Single : A 44 THR OG1 : rot -75:sc= 0.475 USER MOD Single : A 49 GLN : amide:sc= -0.36 K(o=-0.36,f=-1.2) USER MOD Single : A 51 MET CE :methyl -134:sc= -0.666 (180deg=-1.27) USER MOD Single : A 53 ASN : amide:sc=-0.00393 X(o=-0.0039,f=0) USER MOD Single : A 62 THR OG1 : rot 180:sc=-0.00159 USER MOD Single : A 70 THR OG1 : rot 85:sc= 1.24 USER MOD Single : A 71 MET CE :methyl 169:sc= -0.0759 (180deg=-0.435) USER MOD Single : A 72 MET CE :methyl 168:sc= -1.1 (180deg=-1.22) USER MOD Single : A 75 LYS NZ :NH3+ -155:sc= 0.0415 (180deg=-0.193) USER MOD Single : A 76 MET CE :methyl -157:sc= -0.624 (180deg=-1.77) USER MOD Single : A 77 LYS NZ :NH3+ 146:sc= 1.09 (180deg=-0.0573) USER MOD Single : A 79 THR OG1 : rot 29:sc= 0.674 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ 174:sc= -0.866 (180deg=-0.925!) USER MOD Single : A 97 ASN : amide:sc= 0.838 K(o=0.84,f=-0.23) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 HIS : no HD1:sc= 0 X(o=0,f=-0.0075) USER MOD Single : A 109 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 110 THR OG1 : rot 78:sc= 0.452 USER MOD Single : A 111 ASN : amide:sc= 0 X(o=0,f=-0.046) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 THR OG1 : rot -170:sc= 0.581 USER MOD Single : A 124 MET CE :methyl 176:sc= -4.11! (180deg=-4.43!) USER MOD Single : A 137 ASN : amide:sc= 0.944 K(o=0.94,f=-5.9!) USER MOD Single : A 138 TYR OH : rot 33:sc= -0.391 USER MOD Single : A 143 GLN : amide:sc= -0.424 X(o=-0.42,f=-0.77) USER MOD Single : A 144 MET CE :methyl -160:sc= -0.14 (180deg=-0.667) USER MOD Single : A 145 MET CE :methyl 158:sc= -0.229 (180deg=-1.1) USER MOD Single : A 146 THR OG1 : rot 72:sc= 1.23 USER MOD Single : A 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 74 SER OG : rot 29:sc= 0.411 USER MOD Single : B 77 ASN : amide:sc= -2.55 K(o=-2.5,f=-6.6!) USER MOD Single : B 78 SER OG : rot 180:sc= 0 USER MOD Single : B 80 HIS : +bothHN:sc= 2.14 K(o=2.1,f=-11!) USER MOD Single : B 82 LYS NZ :NH3+ 177:sc= 1.92 (180deg=1.83) USER MOD Single : B 86 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0739) USER MOD Single : B 87 HIS : no HD1:sc= -0.0286 K(o=-0.029,f=-3.1!) USER MOD Single : B 90 GLN :FLIP amide:sc= 0 F(o=-1.2,f=0) USER MOD Single : B 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 93 LYS NZ :NH3+ -177:sc= 1.24 (180deg=1.15) USER MOD Single : B 94 HIS : no HE2:sc= 1.05 K(o=1.1,f=-4.5!) USER MOD Single : B 95 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -13.598 12.980 1.037 1.00 0.00 N ATOM 2 CA ALA A 1 -13.698 12.702 -0.387 1.00 0.00 C ATOM 3 C ALA A 1 -14.568 11.482 -0.651 1.00 0.00 C ATOM 4 O ALA A 1 -14.183 10.363 -0.313 1.00 0.00 O ATOM 5 CB ALA A 1 -12.314 12.486 -0.994 1.00 0.00 C ATOM 0 H1 ALA A 1 -12.999 13.817 1.186 1.00 0.00 H new ATOM 0 H2 ALA A 1 -14.547 13.160 1.423 1.00 0.00 H new ATOM 0 H3 ALA A 1 -13.177 12.162 1.522 1.00 0.00 H new ATOM 0 HA ALA A 1 -14.163 13.569 -0.857 1.00 0.00 H new ATOM 0 HB1 ALA A 1 -12.412 12.280 -2.060 1.00 0.00 H new ATOM 0 HB2 ALA A 1 -11.711 13.383 -0.852 1.00 0.00 H new ATOM 0 HB3 ALA A 1 -11.830 11.641 -0.504 1.00 0.00 H new ATOM 13 N ASP A 2 -15.755 11.693 -1.212 1.00 0.00 N ATOM 14 CA ASP A 2 -16.612 10.571 -1.639 1.00 0.00 C ATOM 15 C ASP A 2 -17.260 10.879 -2.976 1.00 0.00 C ATOM 16 O ASP A 2 -17.899 10.012 -3.576 1.00 0.00 O ATOM 17 CB ASP A 2 -17.709 10.181 -0.611 1.00 0.00 C ATOM 18 CG ASP A 2 -18.930 11.098 -0.584 1.00 0.00 C ATOM 19 OD1 ASP A 2 -18.967 12.037 0.241 1.00 0.00 O ATOM 20 OD2 ASP A 2 -19.893 10.875 -1.360 1.00 0.00 O ATOM 0 H ASP A 2 -16.150 12.618 -1.384 1.00 0.00 H new ATOM 0 HA ASP A 2 -15.946 9.712 -1.724 1.00 0.00 H new ATOM 0 HB2 ASP A 2 -18.042 9.166 -0.826 1.00 0.00 H new ATOM 0 HB3 ASP A 2 -17.264 10.166 0.384 1.00 0.00 H new ATOM 25 N GLN A 3 -17.088 12.107 -3.446 1.00 0.00 N ATOM 26 CA GLN A 3 -17.657 12.527 -4.708 1.00 0.00 C ATOM 27 C GLN A 3 -16.919 11.892 -5.850 1.00 0.00 C ATOM 28 O GLN A 3 -15.731 12.141 -6.066 1.00 0.00 O ATOM 29 CB GLN A 3 -17.667 14.048 -4.881 1.00 0.00 C ATOM 30 CG GLN A 3 -18.592 14.787 -3.931 1.00 0.00 C ATOM 31 CD GLN A 3 -18.562 16.308 -4.095 1.00 0.00 C ATOM 32 OE1 GLN A 3 -18.305 16.795 -5.289 1.00 0.00 O flip ATOM 33 NE2 GLN A 3 -18.780 17.046 -3.133 1.00 0.00 N flip ATOM 0 H GLN A 3 -16.554 12.830 -2.964 1.00 0.00 H new ATOM 0 HA GLN A 3 -18.695 12.196 -4.706 1.00 0.00 H new ATOM 0 HB2 GLN A 3 -16.653 14.423 -4.744 1.00 0.00 H new ATOM 0 HB3 GLN A 3 -17.958 14.282 -5.905 1.00 0.00 H new ATOM 0 HG2 GLN A 3 -19.612 14.435 -4.085 1.00 0.00 H new ATOM 0 HG3 GLN A 3 -18.320 14.536 -2.906 1.00 0.00 H new ATOM 0 HE21 GLN A 3 -18.977 16.644 -2.216 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -18.763 18.059 -3.253 1.00 0.00 H new ATOM 42 N LEU A 4 -17.606 11.071 -6.542 1.00 0.00 N ATOM 43 CA LEU A 4 -17.085 10.384 -7.663 1.00 0.00 C ATOM 44 C LEU A 4 -18.140 10.564 -8.719 1.00 0.00 C ATOM 45 O LEU A 4 -19.329 10.536 -8.375 1.00 0.00 O ATOM 46 CB LEU A 4 -16.931 8.902 -7.284 1.00 0.00 C ATOM 47 CG LEU A 4 -15.922 8.060 -8.071 1.00 0.00 C ATOM 48 CD1 LEU A 4 -14.539 8.691 -8.004 1.00 0.00 C ATOM 49 CD2 LEU A 4 -15.866 6.659 -7.485 1.00 0.00 C ATOM 0 H LEU A 4 -18.581 10.848 -6.340 1.00 0.00 H new ATOM 0 HA LEU A 4 -16.113 10.743 -8.001 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -16.657 8.854 -6.230 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -17.908 8.429 -7.381 1.00 0.00 H new ATOM 0 HG LEU A 4 -16.239 8.013 -9.113 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -13.833 8.081 -8.568 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -14.575 9.693 -8.431 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -14.217 8.751 -6.965 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -15.148 6.059 -8.044 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -15.558 6.713 -6.441 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -16.852 6.198 -7.549 1.00 0.00 H new ATOM 61 N THR A 5 -17.768 10.801 -9.951 1.00 0.00 N ATOM 62 CA THR A 5 -18.770 11.020 -10.970 1.00 0.00 C ATOM 63 C THR A 5 -19.523 9.727 -11.217 1.00 0.00 C ATOM 64 O THR A 5 -18.953 8.641 -11.083 1.00 0.00 O ATOM 65 CB THR A 5 -18.150 11.525 -12.292 1.00 0.00 C ATOM 66 OG1 THR A 5 -17.215 10.565 -12.788 1.00 0.00 O ATOM 67 CG2 THR A 5 -17.450 12.861 -12.086 1.00 0.00 C ATOM 0 H THR A 5 -16.801 10.847 -10.272 1.00 0.00 H new ATOM 0 HA THR A 5 -19.451 11.792 -10.612 1.00 0.00 H new ATOM 0 HB THR A 5 -18.953 11.661 -13.017 1.00 0.00 H new ATOM 0 HG1 THR A 5 -16.827 10.890 -13.627 1.00 0.00 H new ATOM 0 HG21 THR A 5 -17.021 13.197 -13.030 1.00 0.00 H new ATOM 0 HG22 THR A 5 -18.170 13.598 -11.732 1.00 0.00 H new ATOM 0 HG23 THR A 5 -16.656 12.746 -11.348 1.00 0.00 H new ATOM 75 N GLU A 6 -20.788 9.828 -11.562 1.00 0.00 N ATOM 76 CA GLU A 6 -21.602 8.655 -11.832 1.00 0.00 C ATOM 77 C GLU A 6 -21.039 7.871 -13.019 1.00 0.00 C ATOM 78 O GLU A 6 -21.224 6.655 -13.123 1.00 0.00 O ATOM 79 CB GLU A 6 -23.048 9.052 -12.071 1.00 0.00 C ATOM 80 CG GLU A 6 -23.726 9.683 -10.861 1.00 0.00 C ATOM 81 CD GLU A 6 -23.759 8.759 -9.663 1.00 0.00 C ATOM 82 OE1 GLU A 6 -23.160 9.092 -8.609 1.00 0.00 O ATOM 83 OE2 GLU A 6 -24.384 7.682 -9.760 1.00 0.00 O ATOM 0 H GLU A 6 -21.281 10.715 -11.664 1.00 0.00 H new ATOM 0 HA GLU A 6 -21.574 8.004 -10.958 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -23.088 9.754 -12.904 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -23.612 8.169 -12.371 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -23.202 10.600 -10.593 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -24.745 9.964 -11.126 1.00 0.00 H new ATOM 90 N GLU A 7 -20.328 8.580 -13.886 1.00 0.00 N ATOM 91 CA GLU A 7 -19.634 7.994 -15.009 1.00 0.00 C ATOM 92 C GLU A 7 -18.526 7.075 -14.487 1.00 0.00 C ATOM 93 O GLU A 7 -18.435 5.899 -14.868 1.00 0.00 O ATOM 94 CB GLU A 7 -19.005 9.098 -15.841 1.00 0.00 C ATOM 95 CG GLU A 7 -18.332 8.614 -17.100 1.00 0.00 C ATOM 96 CD GLU A 7 -17.518 9.683 -17.748 1.00 0.00 C ATOM 97 OE1 GLU A 7 -18.076 10.718 -18.140 1.00 0.00 O ATOM 98 OE2 GLU A 7 -16.288 9.498 -17.893 1.00 0.00 O ATOM 0 H GLU A 7 -20.220 9.592 -13.822 1.00 0.00 H new ATOM 0 HA GLU A 7 -20.336 7.425 -15.619 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -19.776 9.820 -16.109 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -18.272 9.626 -15.230 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -17.692 7.764 -16.864 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -19.088 8.259 -17.801 1.00 0.00 H new ATOM 105 N GLN A 8 -17.711 7.623 -13.591 1.00 0.00 N ATOM 106 CA GLN A 8 -16.608 6.906 -12.972 1.00 0.00 C ATOM 107 C GLN A 8 -17.150 5.774 -12.104 1.00 0.00 C ATOM 108 O GLN A 8 -16.554 4.704 -12.015 1.00 0.00 O ATOM 109 CB GLN A 8 -15.778 7.878 -12.124 1.00 0.00 C ATOM 110 CG GLN A 8 -14.553 7.285 -11.454 1.00 0.00 C ATOM 111 CD GLN A 8 -13.523 6.776 -12.434 1.00 0.00 C ATOM 112 OE1 GLN A 8 -12.644 7.519 -12.858 1.00 0.00 O ATOM 113 NE2 GLN A 8 -13.603 5.519 -12.776 1.00 0.00 N ATOM 0 H GLN A 8 -17.801 8.588 -13.273 1.00 0.00 H new ATOM 0 HA GLN A 8 -15.971 6.478 -13.746 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -15.458 8.704 -12.760 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -16.423 8.300 -11.353 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -14.095 8.041 -10.816 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -14.863 6.466 -10.805 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -14.350 4.935 -12.400 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -12.918 5.121 -13.419 1.00 0.00 H new ATOM 122 N ILE A 9 -18.284 6.019 -11.482 1.00 0.00 N ATOM 123 CA ILE A 9 -18.946 5.024 -10.667 1.00 0.00 C ATOM 124 C ILE A 9 -19.468 3.876 -11.519 1.00 0.00 C ATOM 125 O ILE A 9 -19.466 2.752 -11.085 1.00 0.00 O ATOM 126 CB ILE A 9 -20.056 5.644 -9.770 1.00 0.00 C ATOM 127 CG1 ILE A 9 -19.394 6.570 -8.753 1.00 0.00 C ATOM 128 CG2 ILE A 9 -20.896 4.573 -9.069 1.00 0.00 C ATOM 129 CD1 ILE A 9 -20.329 7.204 -7.771 1.00 0.00 C ATOM 0 H ILE A 9 -18.772 6.913 -11.527 1.00 0.00 H new ATOM 0 HA ILE A 9 -18.201 4.611 -9.987 1.00 0.00 H new ATOM 0 HB ILE A 9 -20.744 6.209 -10.399 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -18.643 6.003 -8.203 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -18.867 7.358 -9.291 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -21.658 5.053 -8.454 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -21.377 3.941 -9.816 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -20.252 3.961 -8.437 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -19.765 7.843 -7.092 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -21.066 7.804 -8.305 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -20.838 6.428 -7.200 1.00 0.00 H new ATOM 141 N ALA A 10 -19.866 4.163 -12.747 1.00 0.00 N ATOM 142 CA ALA A 10 -20.287 3.116 -13.666 1.00 0.00 C ATOM 143 C ALA A 10 -19.093 2.240 -14.013 1.00 0.00 C ATOM 144 O ALA A 10 -19.195 1.005 -14.048 1.00 0.00 O ATOM 145 CB ALA A 10 -20.892 3.707 -14.906 1.00 0.00 C ATOM 0 H ALA A 10 -19.907 5.107 -13.131 1.00 0.00 H new ATOM 0 HA ALA A 10 -21.051 2.505 -13.185 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -21.199 2.906 -15.578 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -21.761 4.308 -14.636 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -20.156 4.337 -15.405 1.00 0.00 H new ATOM 151 N GLU A 11 -17.943 2.893 -14.211 1.00 0.00 N ATOM 152 CA GLU A 11 -16.681 2.198 -14.455 1.00 0.00 C ATOM 153 C GLU A 11 -16.362 1.318 -13.263 1.00 0.00 C ATOM 154 O GLU A 11 -15.943 0.157 -13.407 1.00 0.00 O ATOM 155 CB GLU A 11 -15.539 3.188 -14.630 1.00 0.00 C ATOM 156 CG GLU A 11 -15.695 4.157 -15.773 1.00 0.00 C ATOM 157 CD GLU A 11 -14.507 5.075 -15.881 1.00 0.00 C ATOM 158 OE1 GLU A 11 -14.682 6.304 -15.975 1.00 0.00 O ATOM 159 OE2 GLU A 11 -13.368 4.586 -15.849 1.00 0.00 O ATOM 0 H GLU A 11 -17.864 3.910 -14.206 1.00 0.00 H new ATOM 0 HA GLU A 11 -16.787 1.606 -15.364 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -15.428 3.756 -13.706 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -14.614 2.629 -14.773 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -15.817 3.606 -16.705 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -16.601 4.747 -15.631 1.00 0.00 H new ATOM 166 N PHE A 12 -16.572 1.875 -12.084 1.00 0.00 N ATOM 167 CA PHE A 12 -16.352 1.169 -10.856 1.00 0.00 C ATOM 168 C PHE A 12 -17.398 0.133 -10.562 1.00 0.00 C ATOM 169 O PHE A 12 -17.182 -0.667 -9.738 1.00 0.00 O ATOM 170 CB PHE A 12 -16.139 2.085 -9.646 1.00 0.00 C ATOM 171 CG PHE A 12 -14.733 2.595 -9.512 1.00 0.00 C ATOM 172 CD1 PHE A 12 -13.719 1.736 -9.117 1.00 0.00 C ATOM 173 CD2 PHE A 12 -14.425 3.913 -9.758 1.00 0.00 C ATOM 174 CE1 PHE A 12 -12.423 2.186 -8.976 1.00 0.00 C ATOM 175 CE2 PHE A 12 -13.128 4.372 -9.621 1.00 0.00 C ATOM 176 CZ PHE A 12 -12.127 3.508 -9.229 1.00 0.00 C ATOM 0 H PHE A 12 -16.901 2.833 -11.962 1.00 0.00 H new ATOM 0 HA PHE A 12 -15.414 0.641 -11.026 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -16.818 2.934 -9.721 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -16.407 1.542 -8.739 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -13.947 0.700 -8.917 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -15.204 4.596 -10.061 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -11.643 1.505 -8.669 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -12.899 5.408 -9.821 1.00 0.00 H new ATOM 0 HZ PHE A 12 -11.114 3.866 -9.121 1.00 0.00 H new ATOM 186 N LYS A 13 -18.534 0.159 -11.227 1.00 0.00 N ATOM 187 CA LYS A 13 -19.531 -0.896 -11.040 1.00 0.00 C ATOM 188 C LYS A 13 -19.035 -2.151 -11.709 1.00 0.00 C ATOM 189 O LYS A 13 -19.112 -3.252 -11.156 1.00 0.00 O ATOM 190 CB LYS A 13 -20.902 -0.510 -11.604 1.00 0.00 C ATOM 191 CG LYS A 13 -21.631 0.576 -10.837 1.00 0.00 C ATOM 192 CD LYS A 13 -22.984 0.849 -11.446 1.00 0.00 C ATOM 193 CE LYS A 13 -23.727 1.959 -10.723 1.00 0.00 C ATOM 194 NZ LYS A 13 -24.050 1.624 -9.319 1.00 0.00 N ATOM 0 H LYS A 13 -18.796 0.884 -11.895 1.00 0.00 H new ATOM 0 HA LYS A 13 -19.663 -1.055 -9.970 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -20.774 -0.181 -12.635 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -21.531 -1.400 -11.629 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -21.750 0.274 -9.796 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -21.036 1.489 -10.838 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -22.860 1.120 -12.494 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -23.582 -0.062 -11.421 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -23.123 2.866 -10.744 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -24.650 2.179 -11.259 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -24.811 2.247 -8.980 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -24.362 0.634 -9.261 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -23.205 1.756 -8.727 1.00 0.00 H new ATOM 208 N GLU A 14 -18.497 -1.965 -12.891 1.00 0.00 N ATOM 209 CA GLU A 14 -17.886 -3.021 -13.657 1.00 0.00 C ATOM 210 C GLU A 14 -16.685 -3.581 -12.889 1.00 0.00 C ATOM 211 O GLU A 14 -16.568 -4.798 -12.662 1.00 0.00 O ATOM 212 CB GLU A 14 -17.452 -2.441 -14.984 1.00 0.00 C ATOM 213 CG GLU A 14 -16.697 -3.375 -15.899 1.00 0.00 C ATOM 214 CD GLU A 14 -16.287 -2.679 -17.156 1.00 0.00 C ATOM 215 OE1 GLU A 14 -15.397 -1.807 -17.100 1.00 0.00 O ATOM 216 OE2 GLU A 14 -16.850 -2.966 -18.229 1.00 0.00 O ATOM 0 H GLU A 14 -18.472 -1.057 -13.355 1.00 0.00 H new ATOM 0 HA GLU A 14 -18.589 -3.837 -13.826 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -18.338 -2.086 -15.510 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -16.826 -1.570 -14.790 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -15.814 -3.757 -15.386 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -17.321 -4.235 -16.142 1.00 0.00 H new ATOM 223 N ALA A 15 -15.833 -2.679 -12.448 1.00 0.00 N ATOM 224 CA ALA A 15 -14.650 -3.032 -11.696 1.00 0.00 C ATOM 225 C ALA A 15 -15.021 -3.689 -10.353 1.00 0.00 C ATOM 226 O ALA A 15 -14.416 -4.674 -9.947 1.00 0.00 O ATOM 227 CB ALA A 15 -13.788 -1.800 -11.494 1.00 0.00 C ATOM 0 H ALA A 15 -15.943 -1.677 -12.602 1.00 0.00 H new ATOM 0 HA ALA A 15 -14.077 -3.767 -12.262 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -12.897 -2.069 -10.927 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -13.494 -1.399 -12.464 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -14.353 -1.046 -10.946 1.00 0.00 H new ATOM 233 N PHE A 16 -16.045 -3.154 -9.700 1.00 0.00 N ATOM 234 CA PHE A 16 -16.545 -3.673 -8.431 1.00 0.00 C ATOM 235 C PHE A 16 -16.997 -5.081 -8.597 1.00 0.00 C ATOM 236 O PHE A 16 -16.601 -5.933 -7.852 1.00 0.00 O ATOM 237 CB PHE A 16 -17.716 -2.826 -7.921 1.00 0.00 C ATOM 238 CG PHE A 16 -18.328 -3.281 -6.636 1.00 0.00 C ATOM 239 CD1 PHE A 16 -19.523 -3.972 -6.626 1.00 0.00 C ATOM 240 CD2 PHE A 16 -17.716 -3.002 -5.444 1.00 0.00 C ATOM 241 CE1 PHE A 16 -20.084 -4.374 -5.441 1.00 0.00 C ATOM 242 CE2 PHE A 16 -18.264 -3.399 -4.258 1.00 0.00 C ATOM 243 CZ PHE A 16 -19.452 -4.086 -4.249 1.00 0.00 C ATOM 0 H PHE A 16 -16.557 -2.340 -10.039 1.00 0.00 H new ATOM 0 HA PHE A 16 -15.733 -3.631 -7.705 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -17.372 -1.799 -7.796 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -18.491 -2.811 -8.687 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -20.020 -4.198 -7.558 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -16.783 -2.458 -5.441 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -21.019 -4.915 -5.441 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -17.763 -3.173 -3.328 1.00 0.00 H new ATOM 0 HZ PHE A 16 -19.890 -4.400 -3.313 1.00 0.00 H new ATOM 253 N SER A 17 -17.789 -5.323 -9.619 1.00 0.00 N ATOM 254 CA SER A 17 -18.355 -6.637 -9.850 1.00 0.00 C ATOM 255 C SER A 17 -17.275 -7.649 -10.274 1.00 0.00 C ATOM 256 O SER A 17 -17.491 -8.853 -10.216 1.00 0.00 O ATOM 257 CB SER A 17 -19.471 -6.550 -10.891 1.00 0.00 C ATOM 258 OG SER A 17 -20.420 -5.544 -10.536 1.00 0.00 O ATOM 0 H SER A 17 -18.058 -4.622 -10.309 1.00 0.00 H new ATOM 0 HA SER A 17 -18.780 -6.997 -8.913 1.00 0.00 H new ATOM 0 HB2 SER A 17 -19.045 -6.325 -11.869 1.00 0.00 H new ATOM 0 HB3 SER A 17 -19.972 -7.515 -10.975 1.00 0.00 H new ATOM 0 HG SER A 17 -20.043 -4.659 -10.721 1.00 0.00 H new ATOM 264 N LEU A 18 -16.114 -7.154 -10.714 1.00 0.00 N ATOM 265 CA LEU A 18 -14.987 -8.028 -11.027 1.00 0.00 C ATOM 266 C LEU A 18 -14.499 -8.665 -9.707 1.00 0.00 C ATOM 267 O LEU A 18 -14.096 -9.830 -9.665 1.00 0.00 O ATOM 268 CB LEU A 18 -13.864 -7.205 -11.746 1.00 0.00 C ATOM 269 CG LEU A 18 -12.662 -7.930 -12.358 1.00 0.00 C ATOM 270 CD1 LEU A 18 -11.688 -8.292 -11.310 1.00 0.00 C ATOM 271 CD2 LEU A 18 -13.097 -9.155 -13.140 1.00 0.00 C ATOM 0 H LEU A 18 -15.934 -6.161 -10.860 1.00 0.00 H new ATOM 0 HA LEU A 18 -15.279 -8.825 -11.711 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -14.340 -6.634 -12.543 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -13.477 -6.485 -11.025 1.00 0.00 H new ATOM 0 HG LEU A 18 -12.178 -7.248 -13.057 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -10.840 -8.806 -11.763 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -11.339 -7.389 -10.810 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -12.164 -8.949 -10.582 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -12.221 -9.647 -13.562 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -13.616 -9.845 -12.475 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -13.767 -8.854 -13.945 1.00 0.00 H new ATOM 283 N PHE A 19 -14.585 -7.891 -8.643 1.00 0.00 N ATOM 284 CA PHE A 19 -14.212 -8.340 -7.316 1.00 0.00 C ATOM 285 C PHE A 19 -15.396 -8.950 -6.597 1.00 0.00 C ATOM 286 O PHE A 19 -15.296 -10.020 -5.986 1.00 0.00 O ATOM 287 CB PHE A 19 -13.601 -7.193 -6.500 1.00 0.00 C ATOM 288 CG PHE A 19 -12.166 -6.943 -6.838 1.00 0.00 C ATOM 289 CD1 PHE A 19 -11.793 -6.465 -8.078 1.00 0.00 C ATOM 290 CD2 PHE A 19 -11.187 -7.218 -5.914 1.00 0.00 C ATOM 291 CE1 PHE A 19 -10.462 -6.276 -8.388 1.00 0.00 C ATOM 292 CE2 PHE A 19 -9.861 -7.028 -6.212 1.00 0.00 C ATOM 293 CZ PHE A 19 -9.494 -6.559 -7.451 1.00 0.00 C ATOM 0 H PHE A 19 -14.918 -6.927 -8.675 1.00 0.00 H new ATOM 0 HA PHE A 19 -13.453 -9.114 -7.424 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -14.175 -6.283 -6.675 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -13.685 -7.424 -5.438 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -12.551 -6.237 -8.813 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -11.465 -7.589 -4.939 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -10.180 -5.907 -9.363 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -9.105 -7.247 -5.472 1.00 0.00 H new ATOM 0 HZ PHE A 19 -8.451 -6.413 -7.688 1.00 0.00 H new ATOM 303 N ASP A 20 -16.509 -8.281 -6.688 1.00 0.00 N ATOM 304 CA ASP A 20 -17.733 -8.729 -6.087 1.00 0.00 C ATOM 305 C ASP A 20 -18.410 -9.633 -7.074 1.00 0.00 C ATOM 306 O ASP A 20 -19.262 -9.208 -7.858 1.00 0.00 O ATOM 307 CB ASP A 20 -18.643 -7.549 -5.751 1.00 0.00 C ATOM 308 CG ASP A 20 -19.713 -7.933 -4.760 1.00 0.00 C ATOM 309 OD1 ASP A 20 -19.557 -7.647 -3.591 1.00 0.00 O ATOM 310 OD2 ASP A 20 -20.694 -8.614 -5.085 1.00 0.00 O ATOM 0 H ASP A 20 -16.594 -7.396 -7.189 1.00 0.00 H new ATOM 0 HA ASP A 20 -17.522 -9.253 -5.155 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -18.046 -6.733 -5.343 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -19.109 -7.178 -6.664 1.00 0.00 H new ATOM 315 N LYS A 21 -17.997 -10.870 -7.071 1.00 0.00 N ATOM 316 CA LYS A 21 -18.402 -11.809 -8.087 1.00 0.00 C ATOM 317 C LYS A 21 -19.845 -12.248 -7.993 1.00 0.00 C ATOM 318 O LYS A 21 -20.383 -12.819 -8.946 1.00 0.00 O ATOM 319 CB LYS A 21 -17.496 -12.989 -8.122 1.00 0.00 C ATOM 320 CG LYS A 21 -16.023 -12.655 -8.359 1.00 0.00 C ATOM 321 CD LYS A 21 -15.209 -13.900 -8.546 1.00 0.00 C ATOM 322 CE LYS A 21 -15.314 -14.827 -7.347 1.00 0.00 C ATOM 323 NZ LYS A 21 -14.628 -16.113 -7.562 1.00 0.00 N ATOM 0 H LYS A 21 -17.371 -11.258 -6.366 1.00 0.00 H new ATOM 0 HA LYS A 21 -18.320 -11.263 -9.027 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -17.585 -13.527 -7.178 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -17.832 -13.665 -8.908 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -15.928 -12.020 -9.240 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -15.635 -12.087 -7.513 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -15.545 -14.423 -9.441 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -14.165 -13.631 -8.707 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -14.888 -14.334 -6.473 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -16.365 -15.013 -7.127 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -14.815 -16.745 -6.758 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -14.980 -16.552 -8.437 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -13.604 -15.951 -7.644 1.00 0.00 H new ATOM 337 N ASP A 22 -20.488 -12.011 -6.874 1.00 0.00 N ATOM 338 CA ASP A 22 -21.891 -12.376 -6.780 1.00 0.00 C ATOM 339 C ASP A 22 -22.764 -11.162 -7.056 1.00 0.00 C ATOM 340 O ASP A 22 -23.980 -11.285 -7.219 1.00 0.00 O ATOM 341 CB ASP A 22 -22.253 -13.037 -5.441 1.00 0.00 C ATOM 342 CG ASP A 22 -22.354 -12.088 -4.270 1.00 0.00 C ATOM 343 OD1 ASP A 22 -23.483 -11.858 -3.782 1.00 0.00 O ATOM 344 OD2 ASP A 22 -21.310 -11.579 -3.803 1.00 0.00 O ATOM 0 H ASP A 22 -20.085 -11.583 -6.041 1.00 0.00 H new ATOM 0 HA ASP A 22 -22.081 -13.131 -7.542 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -23.206 -13.555 -5.554 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -21.504 -13.795 -5.212 1.00 0.00 H new ATOM 349 N GLY A 23 -22.122 -10.001 -7.119 1.00 0.00 N ATOM 350 CA GLY A 23 -22.774 -8.755 -7.446 1.00 0.00 C ATOM 351 C GLY A 23 -23.857 -8.374 -6.472 1.00 0.00 C ATOM 352 O GLY A 23 -24.973 -8.072 -6.880 1.00 0.00 O ATOM 0 H GLY A 23 -21.122 -9.906 -6.941 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -22.028 -7.961 -7.478 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -23.204 -8.829 -8.445 1.00 0.00 H new ATOM 356 N ASP A 24 -23.556 -8.389 -5.195 1.00 0.00 N ATOM 357 CA ASP A 24 -24.592 -8.053 -4.214 1.00 0.00 C ATOM 358 C ASP A 24 -24.378 -6.656 -3.673 1.00 0.00 C ATOM 359 O ASP A 24 -25.297 -6.045 -3.121 1.00 0.00 O ATOM 360 CB ASP A 24 -24.603 -9.029 -3.039 1.00 0.00 C ATOM 361 CG ASP A 24 -23.582 -8.699 -1.989 1.00 0.00 C ATOM 362 OD1 ASP A 24 -22.374 -8.792 -2.255 1.00 0.00 O ATOM 363 OD2 ASP A 24 -23.977 -8.334 -0.865 1.00 0.00 O ATOM 0 H ASP A 24 -22.641 -8.620 -4.808 1.00 0.00 H new ATOM 0 HA ASP A 24 -25.548 -8.115 -4.734 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -25.594 -9.031 -2.585 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -24.420 -10.037 -3.410 1.00 0.00 H new ATOM 368 N GLY A 25 -23.192 -6.137 -3.861 1.00 0.00 N ATOM 369 CA GLY A 25 -22.903 -4.814 -3.384 1.00 0.00 C ATOM 370 C GLY A 25 -22.086 -4.770 -2.106 1.00 0.00 C ATOM 371 O GLY A 25 -21.859 -3.679 -1.581 1.00 0.00 O ATOM 0 H GLY A 25 -22.420 -6.606 -4.336 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -22.367 -4.270 -4.162 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -23.843 -4.288 -3.217 1.00 0.00 H new ATOM 375 N THR A 26 -21.671 -5.918 -1.575 1.00 0.00 N ATOM 376 CA THR A 26 -20.780 -5.922 -0.415 1.00 0.00 C ATOM 377 C THR A 26 -19.686 -6.986 -0.616 1.00 0.00 C ATOM 378 O THR A 26 -19.988 -8.152 -0.892 1.00 0.00 O ATOM 379 CB THR A 26 -21.541 -6.169 0.939 1.00 0.00 C ATOM 380 OG1 THR A 26 -22.299 -7.389 0.910 1.00 0.00 O ATOM 381 CG2 THR A 26 -22.469 -5.014 1.298 1.00 0.00 C ATOM 0 H THR A 26 -21.931 -6.842 -1.921 1.00 0.00 H new ATOM 0 HA THR A 26 -20.332 -4.931 -0.342 1.00 0.00 H new ATOM 0 HB THR A 26 -20.768 -6.247 1.704 1.00 0.00 H new ATOM 0 HG1 THR A 26 -22.857 -7.409 0.104 1.00 0.00 H new ATOM 0 HG21 THR A 26 -22.972 -5.231 2.240 1.00 0.00 H new ATOM 0 HG22 THR A 26 -21.887 -4.098 1.400 1.00 0.00 H new ATOM 0 HG23 THR A 26 -23.212 -4.886 0.511 1.00 0.00 H new ATOM 389 N ILE A 27 -18.439 -6.611 -0.438 1.00 0.00 N ATOM 390 CA ILE A 27 -17.337 -7.499 -0.711 1.00 0.00 C ATOM 391 C ILE A 27 -16.903 -8.165 0.564 1.00 0.00 C ATOM 392 O ILE A 27 -16.566 -7.488 1.553 1.00 0.00 O ATOM 393 CB ILE A 27 -16.108 -6.771 -1.327 1.00 0.00 C ATOM 394 CG1 ILE A 27 -16.500 -5.929 -2.523 1.00 0.00 C ATOM 395 CG2 ILE A 27 -15.110 -7.794 -1.792 1.00 0.00 C ATOM 396 CD1 ILE A 27 -15.356 -5.095 -3.092 1.00 0.00 C ATOM 0 H ILE A 27 -18.164 -5.688 -0.102 1.00 0.00 H new ATOM 0 HA ILE A 27 -17.694 -8.227 -1.440 1.00 0.00 H new ATOM 0 HB ILE A 27 -15.687 -6.123 -0.558 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -16.884 -6.583 -3.306 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -17.314 -5.264 -2.236 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -14.246 -7.289 -2.225 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -14.789 -8.400 -0.945 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -15.570 -8.435 -2.544 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -15.715 -4.520 -3.946 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -14.986 -4.414 -2.325 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -14.549 -5.754 -3.412 1.00 0.00 H new ATOM 408 N THR A 28 -16.938 -9.451 0.552 1.00 0.00 N ATOM 409 CA THR A 28 -16.537 -10.240 1.670 1.00 0.00 C ATOM 410 C THR A 28 -15.067 -10.665 1.515 1.00 0.00 C ATOM 411 O THR A 28 -14.505 -10.594 0.400 1.00 0.00 O ATOM 412 CB THR A 28 -17.469 -11.462 1.799 1.00 0.00 C ATOM 413 OG1 THR A 28 -17.546 -12.152 0.533 1.00 0.00 O ATOM 414 CG2 THR A 28 -18.866 -11.020 2.217 1.00 0.00 C ATOM 0 H THR A 28 -17.252 -9.998 -0.250 1.00 0.00 H new ATOM 0 HA THR A 28 -16.617 -9.652 2.584 1.00 0.00 H new ATOM 0 HB THR A 28 -17.064 -12.131 2.558 1.00 0.00 H new ATOM 0 HG1 THR A 28 -17.910 -11.548 -0.147 1.00 0.00 H new ATOM 0 HG21 THR A 28 -19.513 -11.893 2.304 1.00 0.00 H new ATOM 0 HG22 THR A 28 -18.814 -10.510 3.179 1.00 0.00 H new ATOM 0 HG23 THR A 28 -19.272 -10.341 1.468 1.00 0.00 H new ATOM 422 N THR A 29 -14.444 -11.107 2.602 1.00 0.00 N ATOM 423 CA THR A 29 -13.042 -11.505 2.576 1.00 0.00 C ATOM 424 C THR A 29 -12.818 -12.711 1.660 1.00 0.00 C ATOM 425 O THR A 29 -11.758 -12.843 1.033 1.00 0.00 O ATOM 426 CB THR A 29 -12.509 -11.799 3.991 1.00 0.00 C ATOM 427 OG1 THR A 29 -13.372 -12.728 4.654 1.00 0.00 O ATOM 428 CG2 THR A 29 -12.408 -10.530 4.815 1.00 0.00 C ATOM 0 H THR A 29 -14.890 -11.199 3.515 1.00 0.00 H new ATOM 0 HA THR A 29 -12.481 -10.662 2.172 1.00 0.00 H new ATOM 0 HB THR A 29 -11.511 -12.227 3.891 1.00 0.00 H new ATOM 0 HG1 THR A 29 -12.990 -12.965 5.525 1.00 0.00 H new ATOM 0 HG21 THR A 29 -12.029 -10.770 5.808 1.00 0.00 H new ATOM 0 HG22 THR A 29 -11.728 -9.832 4.326 1.00 0.00 H new ATOM 0 HG23 THR A 29 -13.394 -10.074 4.904 1.00 0.00 H new ATOM 436 N LYS A 30 -13.838 -13.564 1.565 1.00 0.00 N ATOM 437 CA LYS A 30 -13.806 -14.732 0.689 1.00 0.00 C ATOM 438 C LYS A 30 -13.614 -14.297 -0.758 1.00 0.00 C ATOM 439 O LYS A 30 -12.763 -14.835 -1.465 1.00 0.00 O ATOM 440 CB LYS A 30 -15.098 -15.539 0.824 1.00 0.00 C ATOM 441 CG LYS A 30 -15.344 -16.079 2.219 1.00 0.00 C ATOM 442 CD LYS A 30 -16.699 -16.756 2.323 1.00 0.00 C ATOM 443 CE LYS A 30 -16.998 -17.188 3.753 1.00 0.00 C ATOM 444 NZ LYS A 30 -17.000 -16.044 4.684 1.00 0.00 N ATOM 0 H LYS A 30 -14.706 -13.464 2.091 1.00 0.00 H new ATOM 0 HA LYS A 30 -12.968 -15.363 0.985 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -15.940 -14.909 0.536 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -15.069 -16.373 0.123 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -14.560 -16.790 2.478 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -15.287 -15.264 2.941 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -17.476 -16.073 1.978 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -16.724 -17.626 1.666 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -17.967 -17.685 3.787 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -16.254 -17.917 4.075 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -17.493 -16.310 5.560 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -16.020 -15.776 4.906 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -17.488 -15.238 4.243 1.00 0.00 H new ATOM 458 N GLU A 31 -14.378 -13.295 -1.174 1.00 0.00 N ATOM 459 CA GLU A 31 -14.288 -12.758 -2.529 1.00 0.00 C ATOM 460 C GLU A 31 -12.913 -12.163 -2.751 1.00 0.00 C ATOM 461 O GLU A 31 -12.251 -12.460 -3.753 1.00 0.00 O ATOM 462 CB GLU A 31 -15.367 -11.697 -2.754 1.00 0.00 C ATOM 463 CG GLU A 31 -16.772 -12.244 -2.651 1.00 0.00 C ATOM 464 CD GLU A 31 -17.836 -11.176 -2.691 1.00 0.00 C ATOM 465 OE1 GLU A 31 -18.162 -10.600 -1.630 1.00 0.00 O ATOM 466 OE2 GLU A 31 -18.434 -10.917 -3.746 1.00 0.00 O ATOM 0 H GLU A 31 -15.073 -12.833 -0.588 1.00 0.00 H new ATOM 0 HA GLU A 31 -14.447 -13.567 -3.243 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -15.240 -10.899 -2.022 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -15.229 -11.251 -3.739 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -16.941 -12.946 -3.468 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -16.868 -12.807 -1.722 1.00 0.00 H new ATOM 473 N LEU A 32 -12.477 -11.369 -1.776 1.00 0.00 N ATOM 474 CA LEU A 32 -11.185 -10.707 -1.816 1.00 0.00 C ATOM 475 C LEU A 32 -10.042 -11.688 -2.048 1.00 0.00 C ATOM 476 O LEU A 32 -9.297 -11.550 -2.996 1.00 0.00 O ATOM 477 CB LEU A 32 -10.925 -9.912 -0.532 1.00 0.00 C ATOM 478 CG LEU A 32 -11.806 -8.691 -0.274 1.00 0.00 C ATOM 479 CD1 LEU A 32 -11.471 -8.078 1.075 1.00 0.00 C ATOM 480 CD2 LEU A 32 -11.611 -7.656 -1.367 1.00 0.00 C ATOM 0 H LEU A 32 -13.016 -11.169 -0.934 1.00 0.00 H new ATOM 0 HA LEU A 32 -11.221 -10.019 -2.661 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -11.034 -10.591 0.313 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -9.886 -9.582 -0.544 1.00 0.00 H new ATOM 0 HG LEU A 32 -12.847 -9.013 -0.273 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -12.106 -7.209 1.247 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -11.642 -8.813 1.861 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -10.425 -7.772 1.086 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -12.246 -6.793 -1.168 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -10.567 -7.342 -1.389 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -11.879 -8.089 -2.330 1.00 0.00 H new ATOM 492 N GLY A 33 -9.930 -12.688 -1.217 1.00 0.00 N ATOM 493 CA GLY A 33 -8.820 -13.606 -1.358 1.00 0.00 C ATOM 494 C GLY A 33 -8.895 -14.438 -2.614 1.00 0.00 C ATOM 495 O GLY A 33 -7.868 -14.761 -3.194 1.00 0.00 O ATOM 0 H GLY A 33 -10.573 -12.890 -0.452 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -7.888 -13.042 -1.359 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -8.792 -14.268 -0.492 1.00 0.00 H new ATOM 499 N THR A 34 -10.097 -14.744 -3.059 1.00 0.00 N ATOM 500 CA THR A 34 -10.271 -15.518 -4.267 1.00 0.00 C ATOM 501 C THR A 34 -9.777 -14.731 -5.487 1.00 0.00 C ATOM 502 O THR A 34 -9.011 -15.254 -6.310 1.00 0.00 O ATOM 503 CB THR A 34 -11.738 -15.943 -4.453 1.00 0.00 C ATOM 504 OG1 THR A 34 -12.169 -16.638 -3.281 1.00 0.00 O ATOM 505 CG2 THR A 34 -11.886 -16.871 -5.650 1.00 0.00 C ATOM 0 H THR A 34 -10.966 -14.468 -2.601 1.00 0.00 H new ATOM 0 HA THR A 34 -9.672 -16.424 -4.173 1.00 0.00 H new ATOM 0 HB THR A 34 -12.341 -15.051 -4.621 1.00 0.00 H new ATOM 0 HG1 THR A 34 -12.290 -15.999 -2.548 1.00 0.00 H new ATOM 0 HG21 THR A 34 -12.932 -17.158 -5.761 1.00 0.00 H new ATOM 0 HG22 THR A 34 -11.553 -16.357 -6.552 1.00 0.00 H new ATOM 0 HG23 THR A 34 -11.280 -17.763 -5.496 1.00 0.00 H new ATOM 513 N VAL A 35 -10.166 -13.470 -5.586 1.00 0.00 N ATOM 514 CA VAL A 35 -9.721 -12.651 -6.698 1.00 0.00 C ATOM 515 C VAL A 35 -8.240 -12.348 -6.563 1.00 0.00 C ATOM 516 O VAL A 35 -7.503 -12.380 -7.541 1.00 0.00 O ATOM 517 CB VAL A 35 -10.527 -11.333 -6.857 1.00 0.00 C ATOM 518 CG1 VAL A 35 -11.983 -11.624 -7.112 1.00 0.00 C ATOM 519 CG2 VAL A 35 -10.385 -10.437 -5.646 1.00 0.00 C ATOM 0 H VAL A 35 -10.779 -12.999 -4.921 1.00 0.00 H new ATOM 0 HA VAL A 35 -9.901 -13.232 -7.602 1.00 0.00 H new ATOM 0 HB VAL A 35 -10.113 -10.806 -7.716 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -12.528 -10.686 -7.220 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -12.082 -12.209 -8.026 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -12.394 -12.188 -6.274 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -10.964 -9.526 -5.798 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -10.753 -10.958 -4.762 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -9.335 -10.180 -5.504 1.00 0.00 H new ATOM 529 N MET A 36 -7.802 -12.136 -5.332 1.00 0.00 N ATOM 530 CA MET A 36 -6.422 -11.829 -5.052 1.00 0.00 C ATOM 531 C MET A 36 -5.514 -12.983 -5.408 1.00 0.00 C ATOM 532 O MET A 36 -4.441 -12.779 -5.973 1.00 0.00 O ATOM 533 CB MET A 36 -6.218 -11.402 -3.600 1.00 0.00 C ATOM 534 CG MET A 36 -5.767 -9.944 -3.479 1.00 0.00 C ATOM 535 SD MET A 36 -6.960 -8.724 -4.072 1.00 0.00 S ATOM 536 CE MET A 36 -8.144 -8.713 -2.739 1.00 0.00 C ATOM 0 H MET A 36 -8.398 -12.173 -4.505 1.00 0.00 H new ATOM 0 HA MET A 36 -6.151 -10.983 -5.684 1.00 0.00 H new ATOM 0 HB2 MET A 36 -7.149 -11.538 -3.050 1.00 0.00 H new ATOM 0 HB3 MET A 36 -5.475 -12.049 -3.135 1.00 0.00 H new ATOM 0 HG2 MET A 36 -5.545 -9.734 -2.433 1.00 0.00 H new ATOM 0 HG3 MET A 36 -4.837 -9.820 -4.034 1.00 0.00 H new ATOM 0 HE1 MET A 36 -9.102 -9.088 -3.100 1.00 0.00 H new ATOM 0 HE2 MET A 36 -7.787 -9.349 -1.930 1.00 0.00 H new ATOM 0 HE3 MET A 36 -8.269 -7.694 -2.372 1.00 0.00 H new ATOM 546 N ARG A 37 -5.959 -14.200 -5.121 1.00 0.00 N ATOM 547 CA ARG A 37 -5.191 -15.396 -5.436 1.00 0.00 C ATOM 548 C ARG A 37 -5.083 -15.566 -6.935 1.00 0.00 C ATOM 549 O ARG A 37 -4.050 -15.989 -7.454 1.00 0.00 O ATOM 550 CB ARG A 37 -5.801 -16.633 -4.774 1.00 0.00 C ATOM 551 CG ARG A 37 -5.033 -17.915 -5.037 1.00 0.00 C ATOM 552 CD ARG A 37 -5.570 -19.054 -4.211 1.00 0.00 C ATOM 553 NE ARG A 37 -4.856 -20.303 -4.476 1.00 0.00 N ATOM 554 CZ ARG A 37 -4.363 -21.125 -3.533 1.00 0.00 C ATOM 555 NH1 ARG A 37 -4.449 -20.803 -2.245 1.00 0.00 N ATOM 556 NH2 ARG A 37 -3.783 -22.268 -3.884 1.00 0.00 N ATOM 0 H ARG A 37 -6.854 -14.384 -4.668 1.00 0.00 H new ATOM 0 HA ARG A 37 -4.185 -15.279 -5.033 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -5.854 -16.468 -3.698 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -6.824 -16.755 -5.129 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -5.096 -18.169 -6.095 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -3.978 -17.763 -4.808 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -5.487 -18.806 -3.153 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -6.630 -19.189 -4.425 1.00 0.00 H new ATOM 0 HE ARG A 37 -4.722 -20.571 -5.451 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -4.891 -19.927 -1.967 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -4.073 -21.432 -1.536 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -3.712 -22.522 -4.869 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -3.409 -22.891 -3.168 1.00 0.00 H new ATOM 570 N SER A 38 -6.124 -15.170 -7.625 1.00 0.00 N ATOM 571 CA SER A 38 -6.156 -15.218 -9.066 1.00 0.00 C ATOM 572 C SER A 38 -5.187 -14.167 -9.643 1.00 0.00 C ATOM 573 O SER A 38 -4.655 -14.328 -10.728 1.00 0.00 O ATOM 574 CB SER A 38 -7.583 -14.971 -9.535 1.00 0.00 C ATOM 575 OG SER A 38 -8.477 -15.854 -8.860 1.00 0.00 O ATOM 0 H SER A 38 -6.976 -14.804 -7.201 1.00 0.00 H new ATOM 0 HA SER A 38 -5.836 -16.198 -9.420 1.00 0.00 H new ATOM 0 HB2 SER A 38 -7.865 -13.936 -9.341 1.00 0.00 H new ATOM 0 HB3 SER A 38 -7.652 -15.123 -10.612 1.00 0.00 H new ATOM 0 HG SER A 38 -8.704 -15.481 -7.983 1.00 0.00 H new ATOM 581 N LEU A 39 -4.935 -13.120 -8.866 1.00 0.00 N ATOM 582 CA LEU A 39 -4.005 -12.063 -9.235 1.00 0.00 C ATOM 583 C LEU A 39 -2.572 -12.417 -8.807 1.00 0.00 C ATOM 584 O LEU A 39 -1.634 -11.648 -9.039 1.00 0.00 O ATOM 585 CB LEU A 39 -4.429 -10.727 -8.604 1.00 0.00 C ATOM 586 CG LEU A 39 -5.788 -10.164 -9.044 1.00 0.00 C ATOM 587 CD1 LEU A 39 -6.126 -8.910 -8.254 1.00 0.00 C ATOM 588 CD2 LEU A 39 -5.786 -9.860 -10.534 1.00 0.00 C ATOM 0 H LEU A 39 -5.374 -12.981 -7.956 1.00 0.00 H new ATOM 0 HA LEU A 39 -4.025 -11.962 -10.320 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -4.445 -10.851 -7.521 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -3.663 -9.985 -8.829 1.00 0.00 H new ATOM 0 HG LEU A 39 -6.549 -10.918 -8.845 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -7.092 -8.525 -8.579 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -6.170 -9.150 -7.192 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -5.359 -8.155 -8.424 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -6.758 -9.462 -10.825 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -5.012 -9.125 -10.754 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -5.586 -10.775 -11.092 1.00 0.00 H new ATOM 600 N GLY A 40 -2.410 -13.559 -8.167 1.00 0.00 N ATOM 601 CA GLY A 40 -1.087 -14.020 -7.790 1.00 0.00 C ATOM 602 C GLY A 40 -0.762 -13.807 -6.320 1.00 0.00 C ATOM 603 O GLY A 40 0.228 -14.332 -5.810 1.00 0.00 O ATOM 0 H GLY A 40 -3.172 -14.181 -7.898 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -1.002 -15.082 -8.022 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -0.345 -13.501 -8.396 1.00 0.00 H new ATOM 607 N GLN A 41 -1.594 -13.076 -5.639 1.00 0.00 N ATOM 608 CA GLN A 41 -1.367 -12.756 -4.247 1.00 0.00 C ATOM 609 C GLN A 41 -2.118 -13.733 -3.371 1.00 0.00 C ATOM 610 O GLN A 41 -3.209 -14.124 -3.688 1.00 0.00 O ATOM 611 CB GLN A 41 -1.823 -11.325 -3.973 1.00 0.00 C ATOM 612 CG GLN A 41 -1.713 -10.874 -2.532 1.00 0.00 C ATOM 613 CD GLN A 41 -2.028 -9.408 -2.371 1.00 0.00 C ATOM 614 OE1 GLN A 41 -2.776 -8.829 -3.146 1.00 0.00 O ATOM 615 NE2 GLN A 41 -1.517 -8.816 -1.350 1.00 0.00 N ATOM 0 H GLN A 41 -2.451 -12.681 -6.026 1.00 0.00 H new ATOM 0 HA GLN A 41 -0.304 -12.834 -4.020 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -1.235 -10.649 -4.594 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -2.861 -11.226 -4.289 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -2.395 -11.461 -1.916 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -0.705 -11.070 -2.167 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -0.896 -9.327 -0.722 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -1.732 -7.836 -1.168 1.00 0.00 H new ATOM 624 N ASN A 42 -1.517 -14.178 -2.307 1.00 0.00 N ATOM 625 CA ASN A 42 -2.194 -15.083 -1.377 1.00 0.00 C ATOM 626 C ASN A 42 -2.309 -14.425 -0.007 1.00 0.00 C ATOM 627 O ASN A 42 -1.445 -14.609 0.853 1.00 0.00 O ATOM 628 CB ASN A 42 -1.480 -16.460 -1.263 1.00 0.00 C ATOM 629 CG ASN A 42 -1.638 -17.394 -2.479 1.00 0.00 C ATOM 630 OD1 ASN A 42 -1.923 -16.856 -3.641 1.00 0.00 O flip ATOM 631 ND2 ASN A 42 -1.540 -18.614 -2.346 1.00 0.00 N flip ATOM 0 H ASN A 42 -0.560 -13.939 -2.047 1.00 0.00 H new ATOM 0 HA ASN A 42 -3.191 -15.277 -1.774 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -0.417 -16.285 -1.097 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -1.860 -16.974 -0.380 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -1.318 -19.011 -1.433 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -1.681 -19.227 -3.149 1.00 0.00 H new ATOM 638 N PRO A 43 -3.312 -13.558 0.184 1.00 0.00 N ATOM 639 CA PRO A 43 -3.533 -12.899 1.453 1.00 0.00 C ATOM 640 C PRO A 43 -4.354 -13.757 2.398 1.00 0.00 C ATOM 641 O PRO A 43 -5.199 -14.555 1.967 1.00 0.00 O ATOM 642 CB PRO A 43 -4.312 -11.636 1.095 1.00 0.00 C ATOM 643 CG PRO A 43 -4.739 -11.787 -0.337 1.00 0.00 C ATOM 644 CD PRO A 43 -4.290 -13.134 -0.818 1.00 0.00 C ATOM 0 HA PRO A 43 -2.592 -12.696 1.965 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -5.177 -11.517 1.747 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -3.692 -10.749 1.223 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -5.822 -11.694 -0.423 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -4.301 -10.999 -0.950 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -5.124 -13.833 -0.883 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -3.845 -13.075 -1.811 1.00 0.00 H new ATOM 652 N THR A 44 -4.114 -13.593 3.655 1.00 0.00 N ATOM 653 CA THR A 44 -4.812 -14.335 4.660 1.00 0.00 C ATOM 654 C THR A 44 -6.082 -13.601 5.115 1.00 0.00 C ATOM 655 O THR A 44 -6.295 -12.420 4.762 1.00 0.00 O ATOM 656 CB THR A 44 -3.886 -14.621 5.856 1.00 0.00 C ATOM 657 OG1 THR A 44 -3.273 -13.399 6.308 1.00 0.00 O ATOM 658 CG2 THR A 44 -2.809 -15.620 5.473 1.00 0.00 C ATOM 0 H THR A 44 -3.424 -12.937 4.021 1.00 0.00 H new ATOM 0 HA THR A 44 -5.120 -15.286 4.225 1.00 0.00 H new ATOM 0 HB THR A 44 -4.487 -15.045 6.661 1.00 0.00 H new ATOM 0 HG1 THR A 44 -2.562 -13.140 5.685 1.00 0.00 H new ATOM 0 HG21 THR A 44 -2.165 -15.808 6.332 1.00 0.00 H new ATOM 0 HG22 THR A 44 -3.274 -16.553 5.157 1.00 0.00 H new ATOM 0 HG23 THR A 44 -2.213 -15.216 4.655 1.00 0.00 H new ATOM 666 N GLU A 45 -6.903 -14.297 5.896 1.00 0.00 N ATOM 667 CA GLU A 45 -8.172 -13.788 6.429 1.00 0.00 C ATOM 668 C GLU A 45 -7.933 -12.478 7.202 1.00 0.00 C ATOM 669 O GLU A 45 -8.613 -11.467 6.974 1.00 0.00 O ATOM 670 CB GLU A 45 -8.759 -14.859 7.371 1.00 0.00 C ATOM 671 CG GLU A 45 -10.148 -14.575 7.924 1.00 0.00 C ATOM 672 CD GLU A 45 -11.220 -14.603 6.866 1.00 0.00 C ATOM 673 OE1 GLU A 45 -11.614 -15.712 6.420 1.00 0.00 O ATOM 674 OE2 GLU A 45 -11.721 -13.548 6.489 1.00 0.00 O ATOM 0 H GLU A 45 -6.703 -15.254 6.185 1.00 0.00 H new ATOM 0 HA GLU A 45 -8.867 -13.581 5.615 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -8.790 -15.807 6.835 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -8.076 -14.990 8.210 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -10.384 -15.311 8.693 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -10.148 -13.598 8.407 1.00 0.00 H new ATOM 681 N ALA A 46 -6.918 -12.505 8.068 1.00 0.00 N ATOM 682 CA ALA A 46 -6.555 -11.372 8.914 1.00 0.00 C ATOM 683 C ALA A 46 -6.252 -10.128 8.092 1.00 0.00 C ATOM 684 O ALA A 46 -6.741 -9.044 8.404 1.00 0.00 O ATOM 685 CB ALA A 46 -5.352 -11.722 9.779 1.00 0.00 C ATOM 0 H ALA A 46 -6.322 -13.322 8.201 1.00 0.00 H new ATOM 0 HA ALA A 46 -7.412 -11.154 9.552 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -5.093 -10.868 10.404 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -5.595 -12.575 10.412 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -4.506 -11.974 9.140 1.00 0.00 H new ATOM 691 N GLU A 47 -5.478 -10.307 7.029 1.00 0.00 N ATOM 692 CA GLU A 47 -5.044 -9.209 6.169 1.00 0.00 C ATOM 693 C GLU A 47 -6.213 -8.575 5.443 1.00 0.00 C ATOM 694 O GLU A 47 -6.327 -7.361 5.383 1.00 0.00 O ATOM 695 CB GLU A 47 -4.030 -9.709 5.154 1.00 0.00 C ATOM 696 CG GLU A 47 -2.802 -10.308 5.782 1.00 0.00 C ATOM 697 CD GLU A 47 -1.857 -10.864 4.768 1.00 0.00 C ATOM 698 OE1 GLU A 47 -0.934 -10.137 4.348 1.00 0.00 O ATOM 699 OE2 GLU A 47 -2.018 -12.043 4.371 1.00 0.00 O ATOM 0 H GLU A 47 -5.131 -11.221 6.736 1.00 0.00 H new ATOM 0 HA GLU A 47 -4.586 -8.453 6.807 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -4.503 -10.455 4.516 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -3.733 -8.881 4.510 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -2.291 -9.547 6.372 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -3.099 -11.099 6.471 1.00 0.00 H new ATOM 706 N LEU A 48 -7.080 -9.398 4.921 1.00 0.00 N ATOM 707 CA LEU A 48 -8.223 -8.924 4.158 1.00 0.00 C ATOM 708 C LEU A 48 -9.224 -8.213 5.050 1.00 0.00 C ATOM 709 O LEU A 48 -9.775 -7.180 4.672 1.00 0.00 O ATOM 710 CB LEU A 48 -8.869 -10.091 3.427 1.00 0.00 C ATOM 711 CG LEU A 48 -7.979 -10.787 2.400 1.00 0.00 C ATOM 712 CD1 LEU A 48 -8.643 -12.042 1.884 1.00 0.00 C ATOM 713 CD2 LEU A 48 -7.649 -9.836 1.250 1.00 0.00 C ATOM 0 H LEU A 48 -7.023 -10.413 5.006 1.00 0.00 H new ATOM 0 HA LEU A 48 -7.876 -8.197 3.423 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -9.191 -10.827 4.164 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -9.766 -9.732 2.923 1.00 0.00 H new ATOM 0 HG LEU A 48 -7.047 -11.073 2.887 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -7.993 -12.523 1.153 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -8.825 -12.725 2.714 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -9.591 -11.784 1.412 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -7.014 -10.347 0.526 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -8.572 -9.519 0.763 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -7.126 -8.962 1.639 1.00 0.00 H new ATOM 725 N GLN A 49 -9.426 -8.737 6.239 1.00 0.00 N ATOM 726 CA GLN A 49 -10.340 -8.126 7.178 1.00 0.00 C ATOM 727 C GLN A 49 -9.741 -6.825 7.710 1.00 0.00 C ATOM 728 O GLN A 49 -10.449 -5.852 7.943 1.00 0.00 O ATOM 729 CB GLN A 49 -10.672 -9.103 8.303 1.00 0.00 C ATOM 730 CG GLN A 49 -11.757 -8.629 9.255 1.00 0.00 C ATOM 731 CD GLN A 49 -13.011 -8.163 8.525 1.00 0.00 C ATOM 732 OE1 GLN A 49 -13.177 -6.984 8.238 1.00 0.00 O ATOM 733 NE2 GLN A 49 -13.858 -9.076 8.173 1.00 0.00 N ATOM 0 H GLN A 49 -8.970 -9.584 6.578 1.00 0.00 H new ATOM 0 HA GLN A 49 -11.275 -7.881 6.673 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -10.982 -10.051 7.863 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -9.765 -9.299 8.875 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -12.017 -9.439 9.937 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -11.370 -7.812 9.864 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -13.693 -10.050 8.427 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -14.691 -8.822 7.642 1.00 0.00 H new ATOM 742 N ASP A 50 -8.427 -6.809 7.846 1.00 0.00 N ATOM 743 CA ASP A 50 -7.695 -5.611 8.273 1.00 0.00 C ATOM 744 C ASP A 50 -7.885 -4.506 7.239 1.00 0.00 C ATOM 745 O ASP A 50 -8.034 -3.329 7.576 1.00 0.00 O ATOM 746 CB ASP A 50 -6.206 -5.937 8.431 1.00 0.00 C ATOM 747 CG ASP A 50 -5.384 -4.782 8.942 1.00 0.00 C ATOM 748 OD1 ASP A 50 -5.467 -4.479 10.151 1.00 0.00 O ATOM 749 OD2 ASP A 50 -4.587 -4.209 8.171 1.00 0.00 O ATOM 0 H ASP A 50 -7.832 -7.618 7.667 1.00 0.00 H new ATOM 0 HA ASP A 50 -8.082 -5.273 9.234 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -6.098 -6.779 9.115 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -5.809 -6.256 7.467 1.00 0.00 H new ATOM 754 N MET A 51 -7.921 -4.916 5.980 1.00 0.00 N ATOM 755 CA MET A 51 -8.151 -4.012 4.858 1.00 0.00 C ATOM 756 C MET A 51 -9.552 -3.460 4.881 1.00 0.00 C ATOM 757 O MET A 51 -9.754 -2.264 4.735 1.00 0.00 O ATOM 758 CB MET A 51 -7.909 -4.721 3.536 1.00 0.00 C ATOM 759 CG MET A 51 -6.473 -5.074 3.296 1.00 0.00 C ATOM 760 SD MET A 51 -5.377 -3.639 3.331 1.00 0.00 S ATOM 761 CE MET A 51 -6.060 -2.662 1.995 1.00 0.00 C ATOM 0 H MET A 51 -7.791 -5.889 5.704 1.00 0.00 H new ATOM 0 HA MET A 51 -7.447 -3.186 4.956 1.00 0.00 H new ATOM 0 HB2 MET A 51 -8.507 -5.632 3.507 1.00 0.00 H new ATOM 0 HB3 MET A 51 -8.258 -4.084 2.723 1.00 0.00 H new ATOM 0 HG2 MET A 51 -6.149 -5.790 4.052 1.00 0.00 H new ATOM 0 HG3 MET A 51 -6.383 -5.569 2.329 1.00 0.00 H new ATOM 0 HE1 MET A 51 -5.252 -2.296 1.362 1.00 0.00 H new ATOM 0 HE2 MET A 51 -6.735 -3.279 1.401 1.00 0.00 H new ATOM 0 HE3 MET A 51 -6.610 -1.816 2.407 1.00 0.00 H new ATOM 771 N ILE A 52 -10.520 -4.339 5.072 1.00 0.00 N ATOM 772 CA ILE A 52 -11.917 -3.937 5.141 1.00 0.00 C ATOM 773 C ILE A 52 -12.130 -2.956 6.276 1.00 0.00 C ATOM 774 O ILE A 52 -12.769 -1.917 6.109 1.00 0.00 O ATOM 775 CB ILE A 52 -12.856 -5.164 5.347 1.00 0.00 C ATOM 776 CG1 ILE A 52 -12.828 -6.080 4.111 1.00 0.00 C ATOM 777 CG2 ILE A 52 -14.283 -4.724 5.692 1.00 0.00 C ATOM 778 CD1 ILE A 52 -13.727 -7.295 4.208 1.00 0.00 C ATOM 0 H ILE A 52 -10.365 -5.341 5.183 1.00 0.00 H new ATOM 0 HA ILE A 52 -12.164 -3.463 4.191 1.00 0.00 H new ATOM 0 HB ILE A 52 -12.485 -5.737 6.197 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -13.119 -5.498 3.237 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -11.804 -6.414 3.945 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -14.912 -5.604 5.829 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -14.271 -4.139 6.612 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -14.682 -4.115 4.881 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -13.644 -7.883 3.294 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -13.425 -7.904 5.060 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -14.760 -6.974 4.340 1.00 0.00 H new ATOM 790 N ASN A 53 -11.538 -3.271 7.391 1.00 0.00 N ATOM 791 CA ASN A 53 -11.718 -2.543 8.620 1.00 0.00 C ATOM 792 C ASN A 53 -11.411 -1.033 8.532 1.00 0.00 C ATOM 793 O ASN A 53 -12.027 -0.251 9.248 1.00 0.00 O ATOM 794 CB ASN A 53 -10.949 -3.214 9.762 1.00 0.00 C ATOM 795 CG ASN A 53 -11.135 -2.524 11.092 1.00 0.00 C ATOM 796 OD1 ASN A 53 -12.093 -2.799 11.813 1.00 0.00 O ATOM 797 ND2 ASN A 53 -10.221 -1.657 11.440 1.00 0.00 N ATOM 0 H ASN A 53 -10.899 -4.062 7.476 1.00 0.00 H new ATOM 0 HA ASN A 53 -12.786 -2.588 8.833 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -11.274 -4.251 9.850 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -9.888 -3.232 9.515 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -10.287 -1.180 12.339 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -9.442 -1.458 10.812 1.00 0.00 H new ATOM 804 N GLU A 54 -10.516 -0.609 7.640 1.00 0.00 N ATOM 805 CA GLU A 54 -10.196 0.823 7.571 1.00 0.00 C ATOM 806 C GLU A 54 -11.363 1.663 7.031 1.00 0.00 C ATOM 807 O GLU A 54 -11.494 2.836 7.369 1.00 0.00 O ATOM 808 CB GLU A 54 -8.888 1.135 6.826 1.00 0.00 C ATOM 809 CG GLU A 54 -8.826 0.671 5.392 1.00 0.00 C ATOM 810 CD GLU A 54 -7.601 1.201 4.683 1.00 0.00 C ATOM 811 OE1 GLU A 54 -7.666 2.304 4.107 1.00 0.00 O ATOM 812 OE2 GLU A 54 -6.534 0.552 4.725 1.00 0.00 O ATOM 0 H GLU A 54 -10.016 -1.204 6.980 1.00 0.00 H new ATOM 0 HA GLU A 54 -10.030 1.118 8.607 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -8.727 2.213 6.847 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -8.062 0.679 7.372 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -8.820 -0.419 5.362 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -9.722 0.999 4.865 1.00 0.00 H new ATOM 819 N VAL A 55 -12.213 1.063 6.219 1.00 0.00 N ATOM 820 CA VAL A 55 -13.384 1.777 5.714 1.00 0.00 C ATOM 821 C VAL A 55 -14.613 1.356 6.487 1.00 0.00 C ATOM 822 O VAL A 55 -15.669 2.000 6.427 1.00 0.00 O ATOM 823 CB VAL A 55 -13.629 1.539 4.189 1.00 0.00 C ATOM 824 CG1 VAL A 55 -12.472 2.029 3.374 1.00 0.00 C ATOM 825 CG2 VAL A 55 -13.902 0.075 3.868 1.00 0.00 C ATOM 0 H VAL A 55 -12.123 0.100 5.896 1.00 0.00 H new ATOM 0 HA VAL A 55 -13.189 2.841 5.852 1.00 0.00 H new ATOM 0 HB VAL A 55 -14.519 2.111 3.927 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -12.670 1.851 2.317 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -12.335 3.097 3.542 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -11.568 1.496 3.669 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -14.066 -0.038 2.796 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -13.047 -0.529 4.170 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -14.789 -0.256 4.408 1.00 0.00 H new ATOM 835 N ASP A 56 -14.451 0.302 7.251 1.00 0.00 N ATOM 836 CA ASP A 56 -15.546 -0.313 7.952 1.00 0.00 C ATOM 837 C ASP A 56 -15.762 0.325 9.311 1.00 0.00 C ATOM 838 O ASP A 56 -15.365 -0.214 10.344 1.00 0.00 O ATOM 839 CB ASP A 56 -15.312 -1.813 8.100 1.00 0.00 C ATOM 840 CG ASP A 56 -16.537 -2.554 8.528 1.00 0.00 C ATOM 841 OD1 ASP A 56 -16.460 -3.355 9.447 1.00 0.00 O ATOM 842 OD2 ASP A 56 -17.610 -2.336 7.945 1.00 0.00 O ATOM 0 H ASP A 56 -13.551 -0.153 7.403 1.00 0.00 H new ATOM 0 HA ASP A 56 -16.448 -0.155 7.361 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -14.963 -2.217 7.149 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -14.519 -1.982 8.828 1.00 0.00 H new ATOM 847 N ALA A 57 -16.344 1.500 9.300 1.00 0.00 N ATOM 848 CA ALA A 57 -16.648 2.230 10.521 1.00 0.00 C ATOM 849 C ALA A 57 -17.941 1.706 11.126 1.00 0.00 C ATOM 850 O ALA A 57 -18.208 1.869 12.311 1.00 0.00 O ATOM 851 CB ALA A 57 -16.757 3.721 10.232 1.00 0.00 C ATOM 0 H ALA A 57 -16.623 1.983 8.446 1.00 0.00 H new ATOM 0 HA ALA A 57 -15.840 2.079 11.237 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -16.985 4.255 11.155 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -15.812 4.083 9.827 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -17.552 3.894 9.507 1.00 0.00 H new ATOM 857 N ASP A 58 -18.735 1.057 10.293 1.00 0.00 N ATOM 858 CA ASP A 58 -19.999 0.454 10.728 1.00 0.00 C ATOM 859 C ASP A 58 -19.771 -0.916 11.362 1.00 0.00 C ATOM 860 O ASP A 58 -20.698 -1.528 11.881 1.00 0.00 O ATOM 861 CB ASP A 58 -21.036 0.374 9.588 1.00 0.00 C ATOM 862 CG ASP A 58 -20.576 -0.426 8.395 1.00 0.00 C ATOM 863 OD1 ASP A 58 -20.071 0.152 7.429 1.00 0.00 O ATOM 864 OD2 ASP A 58 -20.695 -1.644 8.368 1.00 0.00 O ATOM 0 H ASP A 58 -18.531 0.929 9.302 1.00 0.00 H new ATOM 0 HA ASP A 58 -20.415 1.114 11.489 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -21.954 -0.067 9.976 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -21.281 1.385 9.262 1.00 0.00 H new ATOM 869 N GLY A 59 -18.534 -1.387 11.286 1.00 0.00 N ATOM 870 CA GLY A 59 -18.111 -2.600 11.964 1.00 0.00 C ATOM 871 C GLY A 59 -18.857 -3.869 11.582 1.00 0.00 C ATOM 872 O GLY A 59 -19.195 -4.675 12.455 1.00 0.00 O ATOM 0 H GLY A 59 -17.794 -0.935 10.749 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -17.050 -2.752 11.767 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -18.217 -2.449 13.038 1.00 0.00 H new ATOM 876 N ASN A 60 -19.102 -4.083 10.310 1.00 0.00 N ATOM 877 CA ASN A 60 -19.786 -5.309 9.912 1.00 0.00 C ATOM 878 C ASN A 60 -18.836 -6.242 9.186 1.00 0.00 C ATOM 879 O ASN A 60 -19.218 -7.339 8.759 1.00 0.00 O ATOM 880 CB ASN A 60 -21.050 -5.052 9.068 1.00 0.00 C ATOM 881 CG ASN A 60 -20.809 -4.690 7.606 1.00 0.00 C ATOM 882 OD1 ASN A 60 -19.791 -4.097 7.227 1.00 0.00 O ATOM 883 ND2 ASN A 60 -21.744 -5.045 6.776 1.00 0.00 N ATOM 0 H ASN A 60 -18.851 -3.452 9.549 1.00 0.00 H new ATOM 0 HA ASN A 60 -20.122 -5.787 10.832 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -21.675 -5.944 9.104 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -21.617 -4.246 9.534 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -21.650 -4.836 5.782 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -22.572 -5.533 7.119 1.00 0.00 H new ATOM 890 N GLY A 61 -17.604 -5.788 9.020 1.00 0.00 N ATOM 891 CA GLY A 61 -16.574 -6.591 8.407 1.00 0.00 C ATOM 892 C GLY A 61 -16.794 -6.825 6.927 1.00 0.00 C ATOM 893 O GLY A 61 -16.304 -7.806 6.378 1.00 0.00 O ATOM 0 H GLY A 61 -17.297 -4.858 9.306 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -15.610 -6.103 8.551 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -16.523 -7.554 8.916 1.00 0.00 H new ATOM 897 N THR A 62 -17.550 -5.953 6.282 1.00 0.00 N ATOM 898 CA THR A 62 -17.809 -6.067 4.872 1.00 0.00 C ATOM 899 C THR A 62 -17.791 -4.639 4.298 1.00 0.00 C ATOM 900 O THR A 62 -18.108 -3.679 5.024 1.00 0.00 O ATOM 901 CB THR A 62 -19.203 -6.698 4.630 1.00 0.00 C ATOM 902 OG1 THR A 62 -19.504 -7.623 5.700 1.00 0.00 O ATOM 903 CG2 THR A 62 -19.211 -7.489 3.336 1.00 0.00 C ATOM 0 H THR A 62 -17.997 -5.151 6.727 1.00 0.00 H new ATOM 0 HA THR A 62 -17.061 -6.701 4.395 1.00 0.00 H new ATOM 0 HB THR A 62 -19.936 -5.893 4.584 1.00 0.00 H new ATOM 0 HG1 THR A 62 -20.386 -8.022 5.549 1.00 0.00 H new ATOM 0 HG21 THR A 62 -20.198 -7.925 3.182 1.00 0.00 H new ATOM 0 HG22 THR A 62 -18.973 -6.827 2.503 1.00 0.00 H new ATOM 0 HG23 THR A 62 -18.468 -8.284 3.391 1.00 0.00 H new ATOM 911 N ILE A 63 -17.403 -4.491 3.058 1.00 0.00 N ATOM 912 CA ILE A 63 -17.323 -3.165 2.430 1.00 0.00 C ATOM 913 C ILE A 63 -18.509 -2.978 1.493 1.00 0.00 C ATOM 914 O ILE A 63 -18.630 -3.702 0.527 1.00 0.00 O ATOM 915 CB ILE A 63 -16.021 -3.006 1.567 1.00 0.00 C ATOM 916 CG1 ILE A 63 -14.771 -3.364 2.367 1.00 0.00 C ATOM 917 CG2 ILE A 63 -15.894 -1.572 1.048 1.00 0.00 C ATOM 918 CD1 ILE A 63 -13.492 -3.361 1.545 1.00 0.00 C ATOM 0 H ILE A 63 -17.134 -5.263 2.449 1.00 0.00 H new ATOM 0 HA ILE A 63 -17.319 -2.427 3.232 1.00 0.00 H new ATOM 0 HB ILE A 63 -16.104 -3.694 0.726 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -14.664 -2.658 3.190 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -14.905 -4.351 2.809 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -14.986 -1.480 0.452 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -16.759 -1.330 0.431 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -15.846 -0.883 1.891 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -12.649 -3.625 2.183 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -13.577 -4.088 0.737 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -13.332 -2.368 1.124 1.00 0.00 H new ATOM 930 N ASP A 64 -19.388 -2.056 1.783 1.00 0.00 N ATOM 931 CA ASP A 64 -20.464 -1.763 0.845 1.00 0.00 C ATOM 932 C ASP A 64 -19.958 -0.904 -0.273 1.00 0.00 C ATOM 933 O ASP A 64 -18.871 -0.319 -0.174 1.00 0.00 O ATOM 934 CB ASP A 64 -21.747 -1.146 1.474 1.00 0.00 C ATOM 935 CG ASP A 64 -21.538 0.010 2.432 1.00 0.00 C ATOM 936 OD1 ASP A 64 -21.276 1.139 1.994 1.00 0.00 O ATOM 937 OD2 ASP A 64 -21.701 -0.194 3.664 1.00 0.00 O ATOM 0 H ASP A 64 -19.391 -1.500 2.638 1.00 0.00 H new ATOM 0 HA ASP A 64 -20.782 -2.734 0.464 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -22.395 -0.807 0.666 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -22.282 -1.935 2.002 1.00 0.00 H new ATOM 942 N PHE A 65 -20.721 -0.856 -1.340 1.00 0.00 N ATOM 943 CA PHE A 65 -20.387 -0.069 -2.508 1.00 0.00 C ATOM 944 C PHE A 65 -20.126 1.400 -2.124 1.00 0.00 C ATOM 945 O PHE A 65 -19.114 1.942 -2.529 1.00 0.00 O ATOM 946 CB PHE A 65 -21.479 -0.200 -3.565 1.00 0.00 C ATOM 947 CG PHE A 65 -21.098 0.323 -4.927 1.00 0.00 C ATOM 948 CD1 PHE A 65 -20.072 -0.262 -5.648 1.00 0.00 C ATOM 949 CD2 PHE A 65 -21.778 1.386 -5.490 1.00 0.00 C ATOM 950 CE1 PHE A 65 -19.731 0.205 -6.903 1.00 0.00 C ATOM 951 CE2 PHE A 65 -21.441 1.857 -6.741 1.00 0.00 C ATOM 952 CZ PHE A 65 -20.416 1.264 -7.448 1.00 0.00 C ATOM 0 H PHE A 65 -21.600 -1.367 -1.424 1.00 0.00 H new ATOM 0 HA PHE A 65 -19.463 -0.454 -2.940 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -21.753 -1.251 -3.657 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -22.366 0.332 -3.221 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -19.530 -1.095 -5.224 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -22.583 1.854 -4.943 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -18.928 -0.261 -7.454 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -21.980 2.690 -7.167 1.00 0.00 H new ATOM 0 HZ PHE A 65 -20.152 1.632 -8.429 1.00 0.00 H new ATOM 962 N PRO A 66 -21.043 2.076 -1.351 1.00 0.00 N ATOM 963 CA PRO A 66 -20.774 3.415 -0.806 1.00 0.00 C ATOM 964 C PRO A 66 -19.366 3.522 -0.132 1.00 0.00 C ATOM 965 O PRO A 66 -18.587 4.435 -0.466 1.00 0.00 O ATOM 966 CB PRO A 66 -21.873 3.613 0.233 1.00 0.00 C ATOM 967 CG PRO A 66 -23.010 2.746 -0.199 1.00 0.00 C ATOM 968 CD PRO A 66 -22.435 1.637 -1.047 1.00 0.00 C ATOM 0 HA PRO A 66 -20.770 4.170 -1.592 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -21.525 3.333 1.227 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -22.177 4.658 0.285 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -23.531 2.337 0.667 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -23.740 3.324 -0.766 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -22.443 0.686 -0.514 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -23.014 1.496 -1.960 1.00 0.00 H new ATOM 976 N GLU A 67 -19.039 2.591 0.797 1.00 0.00 N ATOM 977 CA GLU A 67 -17.701 2.563 1.457 1.00 0.00 C ATOM 978 C GLU A 67 -16.591 2.454 0.411 1.00 0.00 C ATOM 979 O GLU A 67 -15.606 3.213 0.432 1.00 0.00 O ATOM 980 CB GLU A 67 -17.559 1.375 2.430 1.00 0.00 C ATOM 981 CG GLU A 67 -18.457 1.407 3.651 1.00 0.00 C ATOM 982 CD GLU A 67 -18.344 0.152 4.502 1.00 0.00 C ATOM 983 OE1 GLU A 67 -18.863 -0.894 4.122 1.00 0.00 O ATOM 984 OE2 GLU A 67 -17.810 0.176 5.614 1.00 0.00 O ATOM 0 H GLU A 67 -19.673 1.855 1.107 1.00 0.00 H new ATOM 0 HA GLU A 67 -17.612 3.494 2.017 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -17.758 0.455 1.881 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -16.523 1.328 2.766 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -18.204 2.276 4.259 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -19.492 1.531 3.332 1.00 0.00 H new ATOM 991 N PHE A 68 -16.783 1.536 -0.516 1.00 0.00 N ATOM 992 CA PHE A 68 -15.826 1.246 -1.562 1.00 0.00 C ATOM 993 C PHE A 68 -15.586 2.475 -2.457 1.00 0.00 C ATOM 994 O PHE A 68 -14.437 2.798 -2.787 1.00 0.00 O ATOM 995 CB PHE A 68 -16.298 0.023 -2.372 1.00 0.00 C ATOM 996 CG PHE A 68 -15.336 -0.439 -3.419 1.00 0.00 C ATOM 997 CD1 PHE A 68 -14.044 -0.788 -3.078 1.00 0.00 C ATOM 998 CD2 PHE A 68 -15.724 -0.535 -4.740 1.00 0.00 C ATOM 999 CE1 PHE A 68 -13.161 -1.212 -4.028 1.00 0.00 C ATOM 1000 CE2 PHE A 68 -14.837 -0.963 -5.701 1.00 0.00 C ATOM 1001 CZ PHE A 68 -13.553 -1.298 -5.341 1.00 0.00 C ATOM 0 H PHE A 68 -17.624 0.961 -0.563 1.00 0.00 H new ATOM 0 HA PHE A 68 -14.866 1.003 -1.107 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -16.489 -0.800 -1.684 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -17.247 0.265 -2.851 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -13.729 -0.725 -2.047 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -16.733 -0.272 -5.022 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -12.153 -1.480 -3.747 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -15.148 -1.035 -6.733 1.00 0.00 H new ATOM 0 HZ PHE A 68 -12.852 -1.629 -6.092 1.00 0.00 H new ATOM 1011 N LEU A 69 -16.659 3.168 -2.810 1.00 0.00 N ATOM 1012 CA LEU A 69 -16.576 4.385 -3.615 1.00 0.00 C ATOM 1013 C LEU A 69 -15.824 5.457 -2.875 1.00 0.00 C ATOM 1014 O LEU A 69 -14.975 6.122 -3.446 1.00 0.00 O ATOM 1015 CB LEU A 69 -17.957 4.922 -3.969 1.00 0.00 C ATOM 1016 CG LEU A 69 -18.840 4.049 -4.842 1.00 0.00 C ATOM 1017 CD1 LEU A 69 -20.161 4.744 -5.058 1.00 0.00 C ATOM 1018 CD2 LEU A 69 -18.170 3.772 -6.178 1.00 0.00 C ATOM 0 H LEU A 69 -17.610 2.906 -2.549 1.00 0.00 H new ATOM 0 HA LEU A 69 -16.051 4.122 -4.533 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -18.491 5.119 -3.039 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -17.828 5.881 -4.472 1.00 0.00 H new ATOM 0 HG LEU A 69 -19.004 3.094 -4.342 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -20.801 4.123 -5.685 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -20.646 4.910 -4.096 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -19.992 5.702 -5.550 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -18.820 3.145 -6.788 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -17.986 4.714 -6.695 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -17.223 3.259 -6.011 1.00 0.00 H new ATOM 1030 N THR A 70 -16.137 5.604 -1.603 1.00 0.00 N ATOM 1031 CA THR A 70 -15.500 6.588 -0.755 1.00 0.00 C ATOM 1032 C THR A 70 -13.988 6.335 -0.709 1.00 0.00 C ATOM 1033 O THR A 70 -13.186 7.243 -0.931 1.00 0.00 O ATOM 1034 CB THR A 70 -16.092 6.525 0.672 1.00 0.00 C ATOM 1035 OG1 THR A 70 -17.527 6.649 0.597 1.00 0.00 O ATOM 1036 CG2 THR A 70 -15.544 7.649 1.540 1.00 0.00 C ATOM 0 H THR A 70 -16.843 5.042 -1.128 1.00 0.00 H new ATOM 0 HA THR A 70 -15.682 7.581 -1.166 1.00 0.00 H new ATOM 0 HB THR A 70 -15.814 5.570 1.119 1.00 0.00 H new ATOM 0 HG1 THR A 70 -17.923 5.770 0.420 1.00 0.00 H new ATOM 0 HG21 THR A 70 -15.976 7.582 2.538 1.00 0.00 H new ATOM 0 HG22 THR A 70 -14.460 7.561 1.607 1.00 0.00 H new ATOM 0 HG23 THR A 70 -15.803 8.610 1.097 1.00 0.00 H new ATOM 1044 N MET A 71 -13.621 5.083 -0.486 1.00 0.00 N ATOM 1045 CA MET A 71 -12.224 4.676 -0.431 1.00 0.00 C ATOM 1046 C MET A 71 -11.512 4.948 -1.752 1.00 0.00 C ATOM 1047 O MET A 71 -10.381 5.434 -1.767 1.00 0.00 O ATOM 1048 CB MET A 71 -12.116 3.199 -0.031 1.00 0.00 C ATOM 1049 CG MET A 71 -10.703 2.617 -0.087 1.00 0.00 C ATOM 1050 SD MET A 71 -10.582 0.956 0.630 1.00 0.00 S ATOM 1051 CE MET A 71 -11.870 0.074 -0.250 1.00 0.00 C ATOM 0 H MET A 71 -14.282 4.320 -0.338 1.00 0.00 H new ATOM 0 HA MET A 71 -11.724 5.274 0.331 1.00 0.00 H new ATOM 0 HB2 MET A 71 -12.501 3.083 0.982 1.00 0.00 H new ATOM 0 HB3 MET A 71 -12.761 2.613 -0.686 1.00 0.00 H new ATOM 0 HG2 MET A 71 -10.373 2.582 -1.125 1.00 0.00 H new ATOM 0 HG3 MET A 71 -10.022 3.284 0.442 1.00 0.00 H new ATOM 0 HE1 MET A 71 -11.779 -0.994 -0.054 1.00 0.00 H new ATOM 0 HE2 MET A 71 -12.846 0.423 0.088 1.00 0.00 H new ATOM 0 HE3 MET A 71 -11.770 0.256 -1.320 1.00 0.00 H new ATOM 1061 N MET A 72 -12.184 4.671 -2.849 1.00 0.00 N ATOM 1062 CA MET A 72 -11.610 4.912 -4.161 1.00 0.00 C ATOM 1063 C MET A 72 -11.474 6.387 -4.460 1.00 0.00 C ATOM 1064 O MET A 72 -10.444 6.819 -4.944 1.00 0.00 O ATOM 1065 CB MET A 72 -12.360 4.182 -5.270 1.00 0.00 C ATOM 1066 CG MET A 72 -12.121 2.688 -5.256 1.00 0.00 C ATOM 1067 SD MET A 72 -10.361 2.307 -5.391 1.00 0.00 S ATOM 1068 CE MET A 72 -10.392 0.525 -5.383 1.00 0.00 C ATOM 0 H MET A 72 -13.126 4.280 -2.862 1.00 0.00 H new ATOM 0 HA MET A 72 -10.604 4.494 -4.134 1.00 0.00 H new ATOM 0 HB2 MET A 72 -13.428 4.375 -5.168 1.00 0.00 H new ATOM 0 HB3 MET A 72 -12.054 4.585 -6.235 1.00 0.00 H new ATOM 0 HG2 MET A 72 -12.518 2.262 -4.335 1.00 0.00 H new ATOM 0 HG3 MET A 72 -12.661 2.223 -6.081 1.00 0.00 H new ATOM 0 HE1 MET A 72 -9.413 0.143 -5.672 1.00 0.00 H new ATOM 0 HE2 MET A 72 -10.640 0.170 -4.383 1.00 0.00 H new ATOM 0 HE3 MET A 72 -11.143 0.171 -6.090 1.00 0.00 H new ATOM 1078 N ALA A 73 -12.488 7.158 -4.118 1.00 0.00 N ATOM 1079 CA ALA A 73 -12.473 8.598 -4.332 1.00 0.00 C ATOM 1080 C ALA A 73 -11.347 9.241 -3.528 1.00 0.00 C ATOM 1081 O ALA A 73 -10.648 10.126 -4.019 1.00 0.00 O ATOM 1082 CB ALA A 73 -13.820 9.208 -3.983 1.00 0.00 C ATOM 0 H ALA A 73 -13.343 6.809 -3.686 1.00 0.00 H new ATOM 0 HA ALA A 73 -12.287 8.792 -5.388 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -13.786 10.285 -4.150 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -14.593 8.767 -4.612 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -14.048 9.011 -2.936 1.00 0.00 H new ATOM 1088 N ARG A 74 -11.146 8.753 -2.303 1.00 0.00 N ATOM 1089 CA ARG A 74 -10.047 9.197 -1.467 1.00 0.00 C ATOM 1090 C ARG A 74 -8.721 8.872 -2.138 1.00 0.00 C ATOM 1091 O ARG A 74 -7.818 9.697 -2.176 1.00 0.00 O ATOM 1092 CB ARG A 74 -10.093 8.516 -0.096 1.00 0.00 C ATOM 1093 CG ARG A 74 -11.257 8.916 0.788 1.00 0.00 C ATOM 1094 CD ARG A 74 -11.264 8.109 2.079 1.00 0.00 C ATOM 1095 NE ARG A 74 -12.378 8.485 2.949 1.00 0.00 N ATOM 1096 CZ ARG A 74 -12.815 7.785 4.011 1.00 0.00 C ATOM 1097 NH1 ARG A 74 -12.225 6.648 4.363 1.00 0.00 N ATOM 1098 NH2 ARG A 74 -13.850 8.238 4.720 1.00 0.00 N ATOM 0 H ARG A 74 -11.739 8.044 -1.872 1.00 0.00 H new ATOM 0 HA ARG A 74 -10.141 10.274 -1.330 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -10.126 7.437 -0.246 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -9.165 8.736 0.432 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -11.194 9.979 1.020 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -12.194 8.762 0.253 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -11.330 7.047 1.843 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -10.323 8.261 2.608 1.00 0.00 H new ATOM 0 HE ARG A 74 -12.866 9.354 2.731 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -11.432 6.297 3.826 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -12.565 6.126 5.170 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -14.306 9.111 4.456 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -14.186 7.711 5.526 1.00 0.00 H new ATOM 1112 N LYS A 75 -8.666 7.701 -2.754 1.00 0.00 N ATOM 1113 CA LYS A 75 -7.456 7.179 -3.374 1.00 0.00 C ATOM 1114 C LYS A 75 -7.249 7.810 -4.769 1.00 0.00 C ATOM 1115 O LYS A 75 -6.247 7.580 -5.454 1.00 0.00 O ATOM 1116 CB LYS A 75 -7.565 5.638 -3.438 1.00 0.00 C ATOM 1117 CG LYS A 75 -6.311 4.913 -3.897 1.00 0.00 C ATOM 1118 CD LYS A 75 -6.426 3.395 -3.759 1.00 0.00 C ATOM 1119 CE LYS A 75 -6.650 2.989 -2.310 1.00 0.00 C ATOM 1120 NZ LYS A 75 -6.395 1.548 -2.078 1.00 0.00 N ATOM 0 H LYS A 75 -9.470 7.078 -2.839 1.00 0.00 H new ATOM 0 HA LYS A 75 -6.579 7.442 -2.782 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -7.836 5.269 -2.449 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -8.382 5.376 -4.111 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -6.110 5.165 -4.938 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -5.459 5.264 -3.314 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -7.251 3.033 -4.372 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -5.518 2.923 -4.135 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -5.997 3.578 -1.666 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -7.676 3.224 -2.025 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -6.937 1.228 -1.250 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -6.688 1.004 -2.915 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -5.380 1.398 -1.906 1.00 0.00 H new ATOM 1134 N MET A 76 -8.196 8.615 -5.168 1.00 0.00 N ATOM 1135 CA MET A 76 -8.131 9.324 -6.423 1.00 0.00 C ATOM 1136 C MET A 76 -7.743 10.781 -6.150 1.00 0.00 C ATOM 1137 O MET A 76 -7.566 11.585 -7.061 1.00 0.00 O ATOM 1138 CB MET A 76 -9.491 9.236 -7.134 1.00 0.00 C ATOM 1139 CG MET A 76 -9.531 9.843 -8.530 1.00 0.00 C ATOM 1140 SD MET A 76 -11.144 9.669 -9.323 1.00 0.00 S ATOM 1141 CE MET A 76 -11.293 7.881 -9.399 1.00 0.00 C ATOM 0 H MET A 76 -9.042 8.801 -4.629 1.00 0.00 H new ATOM 0 HA MET A 76 -7.379 8.877 -7.073 1.00 0.00 H new ATOM 0 HB2 MET A 76 -9.781 8.187 -7.202 1.00 0.00 H new ATOM 0 HB3 MET A 76 -10.239 9.734 -6.517 1.00 0.00 H new ATOM 0 HG2 MET A 76 -9.273 10.900 -8.469 1.00 0.00 H new ATOM 0 HG3 MET A 76 -8.773 9.366 -9.151 1.00 0.00 H new ATOM 0 HE1 MET A 76 -11.991 7.607 -10.190 1.00 0.00 H new ATOM 0 HE2 MET A 76 -10.317 7.443 -9.609 1.00 0.00 H new ATOM 0 HE3 MET A 76 -11.661 7.506 -8.444 1.00 0.00 H new ATOM 1151 N LYS A 77 -7.580 11.099 -4.886 1.00 0.00 N ATOM 1152 CA LYS A 77 -7.247 12.442 -4.483 1.00 0.00 C ATOM 1153 C LYS A 77 -6.199 12.393 -3.351 1.00 0.00 C ATOM 1154 O LYS A 77 -6.012 13.345 -2.589 1.00 0.00 O ATOM 1155 CB LYS A 77 -8.538 13.137 -4.022 1.00 0.00 C ATOM 1156 CG LYS A 77 -8.408 14.633 -3.795 1.00 0.00 C ATOM 1157 CD LYS A 77 -8.035 15.369 -5.042 1.00 0.00 C ATOM 1158 CE LYS A 77 -7.858 16.853 -4.779 1.00 0.00 C ATOM 1159 NZ LYS A 77 -6.799 17.115 -3.773 1.00 0.00 N ATOM 0 H LYS A 77 -7.674 10.438 -4.115 1.00 0.00 H new ATOM 0 HA LYS A 77 -6.816 13.004 -5.311 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -9.314 12.963 -4.767 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -8.875 12.671 -3.096 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -9.352 15.023 -3.415 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -7.655 14.817 -3.029 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -7.110 14.957 -5.446 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -8.807 15.222 -5.798 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -7.606 17.359 -5.711 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -8.801 17.275 -4.432 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -6.309 18.002 -4.008 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -7.229 17.196 -2.830 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -6.116 16.331 -3.776 1.00 0.00 H new ATOM 1173 N ASP A 78 -5.481 11.294 -3.269 1.00 0.00 N ATOM 1174 CA ASP A 78 -4.526 11.105 -2.167 1.00 0.00 C ATOM 1175 C ASP A 78 -3.114 11.320 -2.632 1.00 0.00 C ATOM 1176 O ASP A 78 -2.200 11.553 -1.848 1.00 0.00 O ATOM 1177 CB ASP A 78 -4.638 9.698 -1.573 1.00 0.00 C ATOM 1178 CG ASP A 78 -3.845 8.666 -2.365 1.00 0.00 C ATOM 1179 OD1 ASP A 78 -4.053 8.542 -3.595 1.00 0.00 O ATOM 1180 OD2 ASP A 78 -2.994 7.986 -1.780 1.00 0.00 O ATOM 0 H ASP A 78 -5.529 10.522 -3.934 1.00 0.00 H new ATOM 0 HA ASP A 78 -4.774 11.842 -1.403 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -4.282 9.713 -0.543 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -5.687 9.402 -1.544 1.00 0.00 H new ATOM 1185 N THR A 79 -2.964 11.308 -3.886 1.00 0.00 N ATOM 1186 CA THR A 79 -1.672 11.290 -4.499 1.00 0.00 C ATOM 1187 C THR A 79 -1.081 12.689 -4.637 1.00 0.00 C ATOM 1188 O THR A 79 0.137 12.859 -4.693 1.00 0.00 O ATOM 1189 CB THR A 79 -1.727 10.521 -5.826 1.00 0.00 C ATOM 1190 OG1 THR A 79 -2.329 9.223 -5.579 1.00 0.00 O ATOM 1191 CG2 THR A 79 -0.337 10.312 -6.416 1.00 0.00 C ATOM 0 H THR A 79 -3.740 11.310 -4.548 1.00 0.00 H new ATOM 0 HA THR A 79 -0.985 10.756 -3.843 1.00 0.00 H new ATOM 0 HB THR A 79 -2.313 11.103 -6.538 1.00 0.00 H new ATOM 0 HG1 THR A 79 -2.945 9.287 -4.820 1.00 0.00 H new ATOM 0 HG21 THR A 79 -0.419 9.764 -7.355 1.00 0.00 H new ATOM 0 HG22 THR A 79 0.129 11.280 -6.600 1.00 0.00 H new ATOM 0 HG23 THR A 79 0.274 9.743 -5.715 1.00 0.00 H new ATOM 1199 N ASP A 80 -1.927 13.688 -4.595 1.00 0.00 N ATOM 1200 CA ASP A 80 -1.430 15.069 -4.627 1.00 0.00 C ATOM 1201 C ASP A 80 -0.994 15.491 -3.234 1.00 0.00 C ATOM 1202 O ASP A 80 -0.340 16.507 -3.050 1.00 0.00 O ATOM 1203 CB ASP A 80 -2.418 16.080 -5.245 1.00 0.00 C ATOM 1204 CG ASP A 80 -3.651 16.364 -4.424 1.00 0.00 C ATOM 1205 OD1 ASP A 80 -3.646 17.320 -3.623 1.00 0.00 O ATOM 1206 OD2 ASP A 80 -4.673 15.688 -4.612 1.00 0.00 O ATOM 0 H ASP A 80 -2.941 13.592 -4.540 1.00 0.00 H new ATOM 0 HA ASP A 80 -0.570 15.079 -5.296 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -1.891 17.019 -5.416 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -2.730 15.708 -6.221 1.00 0.00 H new ATOM 1211 N SER A 81 -1.371 14.695 -2.256 1.00 0.00 N ATOM 1212 CA SER A 81 -0.908 14.867 -0.897 1.00 0.00 C ATOM 1213 C SER A 81 0.124 13.782 -0.607 1.00 0.00 C ATOM 1214 O SER A 81 0.639 13.668 0.496 1.00 0.00 O ATOM 1215 CB SER A 81 -2.081 14.746 0.056 1.00 0.00 C ATOM 1216 OG SER A 81 -3.120 15.628 -0.341 1.00 0.00 O ATOM 0 H SER A 81 -2.009 13.909 -2.382 1.00 0.00 H new ATOM 0 HA SER A 81 -0.457 15.851 -0.766 1.00 0.00 H new ATOM 0 HB2 SER A 81 -2.448 13.720 0.066 1.00 0.00 H new ATOM 0 HB3 SER A 81 -1.761 14.981 1.071 1.00 0.00 H new ATOM 0 HG SER A 81 -3.875 15.543 0.278 1.00 0.00 H new ATOM 1222 N GLU A 82 0.385 12.974 -1.646 1.00 0.00 N ATOM 1223 CA GLU A 82 1.351 11.881 -1.636 1.00 0.00 C ATOM 1224 C GLU A 82 1.124 10.872 -0.506 1.00 0.00 C ATOM 1225 O GLU A 82 2.060 10.188 -0.090 1.00 0.00 O ATOM 1226 CB GLU A 82 2.763 12.437 -1.625 1.00 0.00 C ATOM 1227 CG GLU A 82 3.116 13.186 -2.895 1.00 0.00 C ATOM 1228 CD GLU A 82 4.492 13.776 -2.854 1.00 0.00 C ATOM 1229 OE1 GLU A 82 5.471 13.068 -3.191 1.00 0.00 O ATOM 1230 OE2 GLU A 82 4.618 14.978 -2.506 1.00 0.00 O ATOM 0 H GLU A 82 -0.090 13.073 -2.543 1.00 0.00 H new ATOM 0 HA GLU A 82 1.202 11.313 -2.554 1.00 0.00 H new ATOM 0 HB2 GLU A 82 2.877 13.106 -0.772 1.00 0.00 H new ATOM 0 HB3 GLU A 82 3.469 11.618 -1.485 1.00 0.00 H new ATOM 0 HG2 GLU A 82 3.041 12.508 -3.745 1.00 0.00 H new ATOM 0 HG3 GLU A 82 2.389 13.981 -3.057 1.00 0.00 H new ATOM 1237 N GLU A 83 -0.143 10.715 -0.099 1.00 0.00 N ATOM 1238 CA GLU A 83 -0.524 9.802 0.971 1.00 0.00 C ATOM 1239 C GLU A 83 -0.009 8.409 0.765 1.00 0.00 C ATOM 1240 O GLU A 83 0.789 7.953 1.540 1.00 0.00 O ATOM 1241 CB GLU A 83 -2.003 9.780 1.169 1.00 0.00 C ATOM 1242 CG GLU A 83 -2.538 10.962 1.936 1.00 0.00 C ATOM 1243 CD GLU A 83 -1.941 11.049 3.318 1.00 0.00 C ATOM 1244 OE1 GLU A 83 -2.223 10.179 4.169 1.00 0.00 O ATOM 1245 OE2 GLU A 83 -1.185 11.999 3.601 1.00 0.00 O ATOM 0 H GLU A 83 -0.929 11.221 -0.507 1.00 0.00 H new ATOM 0 HA GLU A 83 -0.052 10.190 1.874 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -2.489 9.743 0.194 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -2.275 8.865 1.696 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -2.322 11.879 1.388 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -3.623 10.885 2.013 1.00 0.00 H new ATOM 1252 N GLU A 84 -0.447 7.770 -0.309 1.00 0.00 N ATOM 1253 CA GLU A 84 -0.031 6.406 -0.691 1.00 0.00 C ATOM 1254 C GLU A 84 1.491 6.249 -0.638 1.00 0.00 C ATOM 1255 O GLU A 84 2.025 5.292 -0.061 1.00 0.00 O ATOM 1256 CB GLU A 84 -0.474 6.170 -2.141 1.00 0.00 C ATOM 1257 CG GLU A 84 -0.275 4.773 -2.694 1.00 0.00 C ATOM 1258 CD GLU A 84 -1.087 3.723 -1.986 1.00 0.00 C ATOM 1259 OE1 GLU A 84 -2.344 3.791 -2.037 1.00 0.00 O ATOM 1260 OE2 GLU A 84 -0.503 2.767 -1.440 1.00 0.00 O ATOM 0 H GLU A 84 -1.115 8.183 -0.960 1.00 0.00 H new ATOM 0 HA GLU A 84 -0.482 5.696 0.002 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -1.532 6.419 -2.218 1.00 0.00 H new ATOM 0 HB3 GLU A 84 0.066 6.869 -2.780 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -0.536 4.770 -3.752 1.00 0.00 H new ATOM 0 HG3 GLU A 84 0.781 4.511 -2.625 1.00 0.00 H new ATOM 1267 N ILE A 85 2.158 7.226 -1.192 1.00 0.00 N ATOM 1268 CA ILE A 85 3.580 7.174 -1.411 1.00 0.00 C ATOM 1269 C ILE A 85 4.313 7.249 -0.084 1.00 0.00 C ATOM 1270 O ILE A 85 5.128 6.387 0.255 1.00 0.00 O ATOM 1271 CB ILE A 85 4.055 8.352 -2.315 1.00 0.00 C ATOM 1272 CG1 ILE A 85 3.022 8.694 -3.437 1.00 0.00 C ATOM 1273 CG2 ILE A 85 5.414 8.036 -2.919 1.00 0.00 C ATOM 1274 CD1 ILE A 85 2.561 7.529 -4.301 1.00 0.00 C ATOM 0 H ILE A 85 1.723 8.093 -1.509 1.00 0.00 H new ATOM 0 HA ILE A 85 3.804 6.232 -1.911 1.00 0.00 H new ATOM 0 HB ILE A 85 4.140 9.234 -1.681 1.00 0.00 H new ATOM 0 HG12 ILE A 85 2.145 9.143 -2.971 1.00 0.00 H new ATOM 0 HG13 ILE A 85 3.460 9.451 -4.087 1.00 0.00 H new ATOM 0 HG21 ILE A 85 5.735 8.866 -3.548 1.00 0.00 H new ATOM 0 HG22 ILE A 85 6.140 7.884 -2.121 1.00 0.00 H new ATOM 0 HG23 ILE A 85 5.343 7.131 -3.522 1.00 0.00 H new ATOM 0 HD11 ILE A 85 1.847 7.886 -5.043 1.00 0.00 H new ATOM 0 HD12 ILE A 85 3.420 7.089 -4.807 1.00 0.00 H new ATOM 0 HD13 ILE A 85 2.085 6.776 -3.673 1.00 0.00 H new ATOM 1286 N ARG A 86 3.979 8.243 0.679 1.00 0.00 N ATOM 1287 CA ARG A 86 4.610 8.476 1.940 1.00 0.00 C ATOM 1288 C ARG A 86 4.109 7.495 3.001 1.00 0.00 C ATOM 1289 O ARG A 86 4.783 7.246 3.982 1.00 0.00 O ATOM 1290 CB ARG A 86 4.460 9.948 2.332 1.00 0.00 C ATOM 1291 CG ARG A 86 5.115 10.351 3.641 1.00 0.00 C ATOM 1292 CD ARG A 86 5.214 11.865 3.751 1.00 0.00 C ATOM 1293 NE ARG A 86 3.951 12.539 3.428 1.00 0.00 N ATOM 1294 CZ ARG A 86 3.861 13.701 2.766 1.00 0.00 C ATOM 1295 NH1 ARG A 86 4.963 14.358 2.424 1.00 0.00 N ATOM 1296 NH2 ARG A 86 2.677 14.205 2.454 1.00 0.00 N ATOM 0 H ARG A 86 3.255 8.921 0.442 1.00 0.00 H new ATOM 0 HA ARG A 86 5.679 8.282 1.857 1.00 0.00 H new ATOM 0 HB2 ARG A 86 4.878 10.562 1.534 1.00 0.00 H new ATOM 0 HB3 ARG A 86 3.397 10.183 2.391 1.00 0.00 H new ATOM 0 HG2 ARG A 86 4.538 9.958 4.478 1.00 0.00 H new ATOM 0 HG3 ARG A 86 6.110 9.911 3.706 1.00 0.00 H new ATOM 0 HD2 ARG A 86 5.516 12.133 4.764 1.00 0.00 H new ATOM 0 HD3 ARG A 86 5.995 12.224 3.080 1.00 0.00 H new ATOM 0 HE ARG A 86 3.084 12.093 3.727 1.00 0.00 H new ATOM 0 HH11 ARG A 86 5.879 13.978 2.665 1.00 0.00 H new ATOM 0 HH12 ARG A 86 4.894 15.242 1.920 1.00 0.00 H new ATOM 0 HH21 ARG A 86 1.826 13.709 2.718 1.00 0.00 H new ATOM 0 HH22 ARG A 86 2.616 15.090 1.950 1.00 0.00 H new ATOM 1310 N GLU A 87 2.932 6.933 2.789 1.00 0.00 N ATOM 1311 CA GLU A 87 2.379 5.917 3.681 1.00 0.00 C ATOM 1312 C GLU A 87 3.268 4.698 3.624 1.00 0.00 C ATOM 1313 O GLU A 87 3.746 4.197 4.648 1.00 0.00 O ATOM 1314 CB GLU A 87 0.977 5.497 3.233 1.00 0.00 C ATOM 1315 CG GLU A 87 0.175 4.846 4.338 1.00 0.00 C ATOM 1316 CD GLU A 87 0.027 5.763 5.521 1.00 0.00 C ATOM 1317 OE1 GLU A 87 -0.941 6.549 5.563 1.00 0.00 O ATOM 1318 OE2 GLU A 87 0.884 5.737 6.423 1.00 0.00 O ATOM 0 H GLU A 87 2.331 7.164 1.998 1.00 0.00 H new ATOM 0 HA GLU A 87 2.324 6.330 4.688 1.00 0.00 H new ATOM 0 HB2 GLU A 87 0.440 6.373 2.869 1.00 0.00 H new ATOM 0 HB3 GLU A 87 1.061 4.804 2.396 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -0.811 4.573 3.962 1.00 0.00 H new ATOM 0 HG3 GLU A 87 0.664 3.923 4.650 1.00 0.00 H new ATOM 1325 N ALA A 88 3.508 4.251 2.402 1.00 0.00 N ATOM 1326 CA ALA A 88 4.346 3.106 2.139 1.00 0.00 C ATOM 1327 C ALA A 88 5.765 3.375 2.608 1.00 0.00 C ATOM 1328 O ALA A 88 6.411 2.509 3.151 1.00 0.00 O ATOM 1329 CB ALA A 88 4.331 2.770 0.661 1.00 0.00 C ATOM 0 H ALA A 88 3.121 4.680 1.562 1.00 0.00 H new ATOM 0 HA ALA A 88 3.954 2.252 2.691 1.00 0.00 H new ATOM 0 HB1 ALA A 88 4.968 1.904 0.478 1.00 0.00 H new ATOM 0 HB2 ALA A 88 3.311 2.543 0.350 1.00 0.00 H new ATOM 0 HB3 ALA A 88 4.703 3.621 0.091 1.00 0.00 H new ATOM 1335 N PHE A 89 6.219 4.592 2.424 1.00 0.00 N ATOM 1336 CA PHE A 89 7.547 4.982 2.853 1.00 0.00 C ATOM 1337 C PHE A 89 7.656 4.922 4.387 1.00 0.00 C ATOM 1338 O PHE A 89 8.596 4.341 4.931 1.00 0.00 O ATOM 1339 CB PHE A 89 7.857 6.400 2.354 1.00 0.00 C ATOM 1340 CG PHE A 89 9.270 6.845 2.592 1.00 0.00 C ATOM 1341 CD1 PHE A 89 10.262 6.497 1.704 1.00 0.00 C ATOM 1342 CD2 PHE A 89 9.605 7.609 3.700 1.00 0.00 C ATOM 1343 CE1 PHE A 89 11.561 6.893 1.904 1.00 0.00 C ATOM 1344 CE2 PHE A 89 10.906 8.009 3.906 1.00 0.00 C ATOM 1345 CZ PHE A 89 11.885 7.646 3.004 1.00 0.00 C ATOM 0 H PHE A 89 5.685 5.337 1.976 1.00 0.00 H new ATOM 0 HA PHE A 89 8.273 4.288 2.430 1.00 0.00 H new ATOM 0 HB2 PHE A 89 7.648 6.450 1.285 1.00 0.00 H new ATOM 0 HB3 PHE A 89 7.181 7.101 2.844 1.00 0.00 H new ATOM 0 HD1 PHE A 89 10.015 5.903 0.836 1.00 0.00 H new ATOM 0 HD2 PHE A 89 8.839 7.892 4.407 1.00 0.00 H new ATOM 0 HE1 PHE A 89 12.327 6.612 1.196 1.00 0.00 H new ATOM 0 HE2 PHE A 89 11.159 8.605 4.770 1.00 0.00 H new ATOM 0 HZ PHE A 89 12.907 7.955 3.164 1.00 0.00 H new ATOM 1355 N ARG A 90 6.656 5.478 5.055 1.00 0.00 N ATOM 1356 CA ARG A 90 6.628 5.609 6.513 1.00 0.00 C ATOM 1357 C ARG A 90 6.462 4.274 7.220 1.00 0.00 C ATOM 1358 O ARG A 90 6.881 4.111 8.364 1.00 0.00 O ATOM 1359 CB ARG A 90 5.502 6.550 6.935 1.00 0.00 C ATOM 1360 CG ARG A 90 5.472 6.860 8.375 1.00 0.00 C ATOM 1361 CD ARG A 90 4.380 7.836 8.744 1.00 0.00 C ATOM 1362 NE ARG A 90 3.035 7.357 8.396 1.00 0.00 N ATOM 1363 CZ ARG A 90 1.899 7.892 8.857 1.00 0.00 C ATOM 1364 NH1 ARG A 90 1.935 8.855 9.769 1.00 0.00 N ATOM 1365 NH2 ARG A 90 0.738 7.457 8.409 1.00 0.00 N ATOM 0 H ARG A 90 5.827 5.858 4.597 1.00 0.00 H new ATOM 0 HA ARG A 90 7.593 6.019 6.810 1.00 0.00 H new ATOM 0 HB2 ARG A 90 5.596 7.482 6.378 1.00 0.00 H new ATOM 0 HB3 ARG A 90 4.548 6.105 6.652 1.00 0.00 H new ATOM 0 HG2 ARG A 90 5.332 5.937 8.937 1.00 0.00 H new ATOM 0 HG3 ARG A 90 6.436 7.272 8.673 1.00 0.00 H new ATOM 0 HD2 ARG A 90 4.423 8.032 9.815 1.00 0.00 H new ATOM 0 HD3 ARG A 90 4.563 8.784 8.239 1.00 0.00 H new ATOM 0 HE ARG A 90 2.963 6.563 7.760 1.00 0.00 H new ATOM 0 HH11 ARG A 90 2.831 9.190 10.121 1.00 0.00 H new ATOM 0 HH12 ARG A 90 1.066 9.260 10.118 1.00 0.00 H new ATOM 0 HH21 ARG A 90 0.707 6.713 7.712 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -0.129 7.864 8.760 1.00 0.00 H new ATOM 1379 N VAL A 91 5.840 3.330 6.577 1.00 0.00 N ATOM 1380 CA VAL A 91 5.664 2.044 7.202 1.00 0.00 C ATOM 1381 C VAL A 91 7.006 1.275 7.243 1.00 0.00 C ATOM 1382 O VAL A 91 7.195 0.360 8.052 1.00 0.00 O ATOM 1383 CB VAL A 91 4.522 1.225 6.552 1.00 0.00 C ATOM 1384 CG1 VAL A 91 4.834 0.866 5.130 1.00 0.00 C ATOM 1385 CG2 VAL A 91 4.187 0.005 7.370 1.00 0.00 C ATOM 0 H VAL A 91 5.451 3.418 5.638 1.00 0.00 H new ATOM 0 HA VAL A 91 5.350 2.210 8.233 1.00 0.00 H new ATOM 0 HB VAL A 91 3.637 1.861 6.534 1.00 0.00 H new ATOM 0 HG11 VAL A 91 4.008 0.292 4.710 1.00 0.00 H new ATOM 0 HG12 VAL A 91 4.976 1.776 4.548 1.00 0.00 H new ATOM 0 HG13 VAL A 91 5.745 0.268 5.097 1.00 0.00 H new ATOM 0 HG21 VAL A 91 3.382 -0.548 6.886 1.00 0.00 H new ATOM 0 HG22 VAL A 91 5.068 -0.632 7.450 1.00 0.00 H new ATOM 0 HG23 VAL A 91 3.869 0.311 8.367 1.00 0.00 H new ATOM 1395 N PHE A 92 7.937 1.680 6.383 1.00 0.00 N ATOM 1396 CA PHE A 92 9.284 1.146 6.418 1.00 0.00 C ATOM 1397 C PHE A 92 10.110 2.053 7.321 1.00 0.00 C ATOM 1398 O PHE A 92 10.616 1.632 8.373 1.00 0.00 O ATOM 1399 CB PHE A 92 9.931 1.104 5.020 1.00 0.00 C ATOM 1400 CG PHE A 92 9.196 0.303 3.981 1.00 0.00 C ATOM 1401 CD1 PHE A 92 8.860 -1.019 4.204 1.00 0.00 C ATOM 1402 CD2 PHE A 92 8.871 0.872 2.762 1.00 0.00 C ATOM 1403 CE1 PHE A 92 8.208 -1.753 3.233 1.00 0.00 C ATOM 1404 CE2 PHE A 92 8.215 0.144 1.792 1.00 0.00 C ATOM 1405 CZ PHE A 92 7.885 -1.170 2.028 1.00 0.00 C ATOM 0 H PHE A 92 7.777 2.377 5.655 1.00 0.00 H new ATOM 0 HA PHE A 92 9.248 0.121 6.788 1.00 0.00 H new ATOM 0 HB2 PHE A 92 10.033 2.127 4.657 1.00 0.00 H new ATOM 0 HB3 PHE A 92 10.938 0.698 5.119 1.00 0.00 H new ATOM 0 HD1 PHE A 92 9.110 -1.482 5.147 1.00 0.00 H new ATOM 0 HD2 PHE A 92 9.135 1.901 2.568 1.00 0.00 H new ATOM 0 HE1 PHE A 92 7.951 -2.785 3.419 1.00 0.00 H new ATOM 0 HE2 PHE A 92 7.961 0.605 0.849 1.00 0.00 H new ATOM 0 HZ PHE A 92 7.373 -1.744 1.269 1.00 0.00 H new ATOM 1415 N ASP A 93 10.196 3.315 6.924 1.00 0.00 N ATOM 1416 CA ASP A 93 10.899 4.326 7.687 1.00 0.00 C ATOM 1417 C ASP A 93 9.954 4.925 8.713 1.00 0.00 C ATOM 1418 O ASP A 93 9.291 5.952 8.495 1.00 0.00 O ATOM 1419 CB ASP A 93 11.524 5.401 6.788 1.00 0.00 C ATOM 1420 CG ASP A 93 12.147 6.528 7.580 1.00 0.00 C ATOM 1421 OD1 ASP A 93 11.995 7.704 7.187 1.00 0.00 O ATOM 1422 OD2 ASP A 93 12.748 6.273 8.638 1.00 0.00 O ATOM 0 H ASP A 93 9.778 3.663 6.061 1.00 0.00 H new ATOM 0 HA ASP A 93 11.732 3.853 8.207 1.00 0.00 H new ATOM 0 HB2 ASP A 93 12.284 4.943 6.154 1.00 0.00 H new ATOM 0 HB3 ASP A 93 10.759 5.806 6.126 1.00 0.00 H new ATOM 1427 N LYS A 94 9.855 4.214 9.796 1.00 0.00 N ATOM 1428 CA LYS A 94 8.939 4.491 10.881 1.00 0.00 C ATOM 1429 C LYS A 94 9.435 5.621 11.769 1.00 0.00 C ATOM 1430 O LYS A 94 8.646 6.358 12.351 1.00 0.00 O ATOM 1431 CB LYS A 94 8.774 3.213 11.707 1.00 0.00 C ATOM 1432 CG LYS A 94 8.189 2.043 10.919 1.00 0.00 C ATOM 1433 CD LYS A 94 8.411 0.684 11.588 1.00 0.00 C ATOM 1434 CE LYS A 94 9.819 0.095 11.318 1.00 0.00 C ATOM 1435 NZ LYS A 94 10.935 0.865 11.909 1.00 0.00 N ATOM 0 H LYS A 94 10.431 3.389 9.962 1.00 0.00 H new ATOM 0 HA LYS A 94 7.984 4.808 10.462 1.00 0.00 H new ATOM 0 HB2 LYS A 94 9.745 2.921 12.106 1.00 0.00 H new ATOM 0 HB3 LYS A 94 8.129 3.423 12.560 1.00 0.00 H new ATOM 0 HG2 LYS A 94 7.119 2.203 10.787 1.00 0.00 H new ATOM 0 HG3 LYS A 94 8.634 2.026 9.924 1.00 0.00 H new ATOM 0 HD2 LYS A 94 8.267 0.788 12.664 1.00 0.00 H new ATOM 0 HD3 LYS A 94 7.656 -0.017 11.232 1.00 0.00 H new ATOM 0 HE2 LYS A 94 9.852 -0.923 11.706 1.00 0.00 H new ATOM 0 HE3 LYS A 94 9.970 0.031 10.240 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 11.827 0.349 11.767 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 10.997 1.795 11.449 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 10.767 0.993 12.927 1.00 0.00 H new ATOM 1449 N ASP A 95 10.731 5.763 11.857 1.00 0.00 N ATOM 1450 CA ASP A 95 11.331 6.735 12.769 1.00 0.00 C ATOM 1451 C ASP A 95 11.411 8.092 12.111 1.00 0.00 C ATOM 1452 O ASP A 95 11.620 9.109 12.767 1.00 0.00 O ATOM 1453 CB ASP A 95 12.728 6.257 13.194 1.00 0.00 C ATOM 1454 CG ASP A 95 13.343 7.063 14.321 1.00 0.00 C ATOM 1455 OD1 ASP A 95 14.165 7.970 14.054 1.00 0.00 O ATOM 1456 OD2 ASP A 95 13.037 6.763 15.497 1.00 0.00 O ATOM 0 H ASP A 95 11.403 5.223 11.312 1.00 0.00 H new ATOM 0 HA ASP A 95 10.705 6.823 13.657 1.00 0.00 H new ATOM 0 HB2 ASP A 95 12.665 5.213 13.501 1.00 0.00 H new ATOM 0 HB3 ASP A 95 13.392 6.296 12.330 1.00 0.00 H new ATOM 1461 N GLY A 96 11.203 8.112 10.821 1.00 0.00 N ATOM 1462 CA GLY A 96 11.243 9.342 10.101 1.00 0.00 C ATOM 1463 C GLY A 96 12.658 9.781 9.884 1.00 0.00 C ATOM 1464 O GLY A 96 13.094 10.800 10.415 1.00 0.00 O ATOM 0 H GLY A 96 11.005 7.288 10.254 1.00 0.00 H new ATOM 0 HA2 GLY A 96 10.742 9.223 9.140 1.00 0.00 H new ATOM 0 HA3 GLY A 96 10.699 10.110 10.651 1.00 0.00 H new ATOM 1468 N ASN A 97 13.388 8.993 9.156 1.00 0.00 N ATOM 1469 CA ASN A 97 14.763 9.292 8.853 1.00 0.00 C ATOM 1470 C ASN A 97 14.831 10.043 7.555 1.00 0.00 C ATOM 1471 O ASN A 97 15.807 10.720 7.269 1.00 0.00 O ATOM 1472 CB ASN A 97 15.581 8.007 8.696 1.00 0.00 C ATOM 1473 CG ASN A 97 15.757 7.234 9.974 1.00 0.00 C ATOM 1474 OD1 ASN A 97 16.725 7.426 10.701 1.00 0.00 O ATOM 1475 ND2 ASN A 97 14.846 6.364 10.265 1.00 0.00 N ATOM 0 H ASN A 97 13.050 8.120 8.751 1.00 0.00 H new ATOM 0 HA ASN A 97 15.170 9.884 9.673 1.00 0.00 H new ATOM 0 HB2 ASN A 97 15.095 7.367 7.960 1.00 0.00 H new ATOM 0 HB3 ASN A 97 16.564 8.260 8.298 1.00 0.00 H new ATOM 0 HD21 ASN A 97 14.921 5.814 11.121 1.00 0.00 H new ATOM 0 HD22 ASN A 97 14.052 6.228 9.639 1.00 0.00 H new ATOM 1482 N GLY A 98 13.773 9.941 6.781 1.00 0.00 N ATOM 1483 CA GLY A 98 13.750 10.563 5.483 1.00 0.00 C ATOM 1484 C GLY A 98 14.464 9.691 4.477 1.00 0.00 C ATOM 1485 O GLY A 98 14.795 10.126 3.364 1.00 0.00 O ATOM 0 H GLY A 98 12.923 9.435 7.029 1.00 0.00 H new ATOM 0 HA2 GLY A 98 12.719 10.726 5.168 1.00 0.00 H new ATOM 0 HA3 GLY A 98 14.228 11.542 5.532 1.00 0.00 H new ATOM 1489 N TYR A 99 14.703 8.455 4.886 1.00 0.00 N ATOM 1490 CA TYR A 99 15.378 7.458 4.101 1.00 0.00 C ATOM 1491 C TYR A 99 15.186 6.101 4.733 1.00 0.00 C ATOM 1492 O TYR A 99 14.953 5.997 5.942 1.00 0.00 O ATOM 1493 CB TYR A 99 16.890 7.773 3.899 1.00 0.00 C ATOM 1494 CG TYR A 99 17.695 8.009 5.170 1.00 0.00 C ATOM 1495 CD1 TYR A 99 18.121 6.955 5.968 1.00 0.00 C ATOM 1496 CD2 TYR A 99 18.041 9.294 5.555 1.00 0.00 C ATOM 1497 CE1 TYR A 99 18.863 7.181 7.108 1.00 0.00 C ATOM 1498 CE2 TYR A 99 18.780 9.527 6.695 1.00 0.00 C ATOM 1499 CZ TYR A 99 19.189 8.468 7.468 1.00 0.00 C ATOM 1500 OH TYR A 99 19.942 8.694 8.609 1.00 0.00 O ATOM 0 H TYR A 99 14.419 8.117 5.805 1.00 0.00 H new ATOM 0 HA TYR A 99 14.933 7.462 3.106 1.00 0.00 H new ATOM 0 HB2 TYR A 99 17.344 6.946 3.353 1.00 0.00 H new ATOM 0 HB3 TYR A 99 16.976 8.657 3.268 1.00 0.00 H new ATOM 0 HD1 TYR A 99 17.867 5.942 5.691 1.00 0.00 H new ATOM 0 HD2 TYR A 99 17.725 10.131 4.949 1.00 0.00 H new ATOM 0 HE1 TYR A 99 19.187 6.350 7.717 1.00 0.00 H new ATOM 0 HE2 TYR A 99 19.036 10.537 6.979 1.00 0.00 H new ATOM 0 HH TYR A 99 20.086 9.657 8.721 1.00 0.00 H new ATOM 1510 N ILE A 100 15.250 5.086 3.924 1.00 0.00 N ATOM 1511 CA ILE A 100 15.114 3.729 4.366 1.00 0.00 C ATOM 1512 C ILE A 100 16.474 3.066 4.212 1.00 0.00 C ATOM 1513 O ILE A 100 17.098 3.161 3.135 1.00 0.00 O ATOM 1514 CB ILE A 100 14.110 2.928 3.487 1.00 0.00 C ATOM 1515 CG1 ILE A 100 12.965 3.833 2.966 1.00 0.00 C ATOM 1516 CG2 ILE A 100 13.548 1.751 4.289 1.00 0.00 C ATOM 1517 CD1 ILE A 100 11.959 3.133 2.074 1.00 0.00 C ATOM 0 H ILE A 100 15.401 5.179 2.920 1.00 0.00 H new ATOM 0 HA ILE A 100 14.751 3.733 5.394 1.00 0.00 H new ATOM 0 HB ILE A 100 14.643 2.546 2.616 1.00 0.00 H new ATOM 0 HG12 ILE A 100 12.438 4.257 3.821 1.00 0.00 H new ATOM 0 HG13 ILE A 100 13.401 4.666 2.415 1.00 0.00 H new ATOM 0 HG21 ILE A 100 12.845 1.192 3.671 1.00 0.00 H new ATOM 0 HG22 ILE A 100 14.364 1.096 4.594 1.00 0.00 H new ATOM 0 HG23 ILE A 100 13.034 2.126 5.174 1.00 0.00 H new ATOM 0 HD11 ILE A 100 11.196 3.844 1.758 1.00 0.00 H new ATOM 0 HD12 ILE A 100 12.467 2.733 1.197 1.00 0.00 H new ATOM 0 HD13 ILE A 100 11.490 2.318 2.625 1.00 0.00 H new ATOM 1529 N SER A 101 16.948 2.449 5.251 1.00 0.00 N ATOM 1530 CA SER A 101 18.209 1.746 5.198 1.00 0.00 C ATOM 1531 C SER A 101 17.945 0.231 5.113 1.00 0.00 C ATOM 1532 O SER A 101 16.844 -0.223 5.460 1.00 0.00 O ATOM 1533 CB SER A 101 19.021 2.088 6.440 1.00 0.00 C ATOM 1534 OG SER A 101 19.144 3.502 6.591 1.00 0.00 O ATOM 0 H SER A 101 16.481 2.414 6.157 1.00 0.00 H new ATOM 0 HA SER A 101 18.774 2.047 4.316 1.00 0.00 H new ATOM 0 HB2 SER A 101 18.541 1.664 7.322 1.00 0.00 H new ATOM 0 HB3 SER A 101 20.011 1.638 6.368 1.00 0.00 H new ATOM 0 HG SER A 101 19.668 3.701 7.395 1.00 0.00 H new ATOM 1540 N ALA A 102 18.932 -0.540 4.661 1.00 0.00 N ATOM 1541 CA ALA A 102 18.786 -1.993 4.513 1.00 0.00 C ATOM 1542 C ALA A 102 18.545 -2.660 5.847 1.00 0.00 C ATOM 1543 O ALA A 102 17.644 -3.489 5.966 1.00 0.00 O ATOM 1544 CB ALA A 102 19.993 -2.606 3.815 1.00 0.00 C ATOM 0 H ALA A 102 19.848 -0.183 4.389 1.00 0.00 H new ATOM 0 HA ALA A 102 17.912 -2.167 3.886 1.00 0.00 H new ATOM 0 HB1 ALA A 102 19.852 -3.683 3.722 1.00 0.00 H new ATOM 0 HB2 ALA A 102 20.101 -2.167 2.823 1.00 0.00 H new ATOM 0 HB3 ALA A 102 20.891 -2.407 4.400 1.00 0.00 H new ATOM 1550 N ALA A 103 19.322 -2.262 6.853 1.00 0.00 N ATOM 1551 CA ALA A 103 19.186 -2.795 8.208 1.00 0.00 C ATOM 1552 C ALA A 103 17.781 -2.545 8.735 1.00 0.00 C ATOM 1553 O ALA A 103 17.153 -3.437 9.307 1.00 0.00 O ATOM 1554 CB ALA A 103 20.220 -2.171 9.132 1.00 0.00 C ATOM 0 H ALA A 103 20.060 -1.565 6.753 1.00 0.00 H new ATOM 0 HA ALA A 103 19.359 -3.871 8.176 1.00 0.00 H new ATOM 0 HB1 ALA A 103 20.104 -2.579 10.136 1.00 0.00 H new ATOM 0 HB2 ALA A 103 21.221 -2.395 8.762 1.00 0.00 H new ATOM 0 HB3 ALA A 103 20.077 -1.091 9.161 1.00 0.00 H new ATOM 1560 N GLU A 104 17.290 -1.333 8.500 1.00 0.00 N ATOM 1561 CA GLU A 104 15.935 -0.938 8.869 1.00 0.00 C ATOM 1562 C GLU A 104 14.929 -1.858 8.214 1.00 0.00 C ATOM 1563 O GLU A 104 14.089 -2.484 8.888 1.00 0.00 O ATOM 1564 CB GLU A 104 15.637 0.459 8.347 1.00 0.00 C ATOM 1565 CG GLU A 104 14.176 0.843 8.498 1.00 0.00 C ATOM 1566 CD GLU A 104 13.881 1.497 9.817 1.00 0.00 C ATOM 1567 OE1 GLU A 104 13.416 0.807 10.756 1.00 0.00 O ATOM 1568 OE2 GLU A 104 14.108 2.715 9.955 1.00 0.00 O ATOM 0 H GLU A 104 17.824 -0.592 8.045 1.00 0.00 H new ATOM 0 HA GLU A 104 15.863 -0.980 9.956 1.00 0.00 H new ATOM 0 HB2 GLU A 104 16.255 1.181 8.881 1.00 0.00 H new ATOM 0 HB3 GLU A 104 15.916 0.516 7.295 1.00 0.00 H new ATOM 0 HG2 GLU A 104 13.898 1.521 7.691 1.00 0.00 H new ATOM 0 HG3 GLU A 104 13.558 -0.049 8.393 1.00 0.00 H new ATOM 1575 N LEU A 105 15.023 -1.917 6.895 1.00 0.00 N ATOM 1576 CA LEU A 105 14.091 -2.625 6.072 1.00 0.00 C ATOM 1577 C LEU A 105 14.072 -4.103 6.495 1.00 0.00 C ATOM 1578 O LEU A 105 13.018 -4.687 6.693 1.00 0.00 O ATOM 1579 CB LEU A 105 14.492 -2.437 4.573 1.00 0.00 C ATOM 1580 CG LEU A 105 13.503 -2.881 3.451 1.00 0.00 C ATOM 1581 CD1 LEU A 105 13.379 -4.388 3.327 1.00 0.00 C ATOM 1582 CD2 LEU A 105 12.138 -2.261 3.664 1.00 0.00 C ATOM 0 H LEU A 105 15.768 -1.461 6.369 1.00 0.00 H new ATOM 0 HA LEU A 105 13.081 -2.234 6.195 1.00 0.00 H new ATOM 0 HB2 LEU A 105 14.703 -1.378 4.422 1.00 0.00 H new ATOM 0 HB3 LEU A 105 15.427 -2.974 4.415 1.00 0.00 H new ATOM 0 HG LEU A 105 13.924 -2.520 2.513 1.00 0.00 H new ATOM 0 HD11 LEU A 105 12.677 -4.631 2.530 1.00 0.00 H new ATOM 0 HD12 LEU A 105 14.354 -4.815 3.094 1.00 0.00 H new ATOM 0 HD13 LEU A 105 13.017 -4.802 4.268 1.00 0.00 H new ATOM 0 HD21 LEU A 105 11.464 -2.584 2.871 1.00 0.00 H new ATOM 0 HD22 LEU A 105 11.741 -2.578 4.628 1.00 0.00 H new ATOM 0 HD23 LEU A 105 12.225 -1.175 3.647 1.00 0.00 H new ATOM 1594 N ARG A 106 15.250 -4.655 6.699 1.00 0.00 N ATOM 1595 CA ARG A 106 15.414 -6.042 7.100 1.00 0.00 C ATOM 1596 C ARG A 106 14.733 -6.278 8.447 1.00 0.00 C ATOM 1597 O ARG A 106 13.944 -7.214 8.611 1.00 0.00 O ATOM 1598 CB ARG A 106 16.889 -6.353 7.256 1.00 0.00 C ATOM 1599 CG ARG A 106 17.220 -7.789 7.239 1.00 0.00 C ATOM 1600 CD ARG A 106 18.590 -8.009 7.827 1.00 0.00 C ATOM 1601 NE ARG A 106 18.668 -7.559 9.234 1.00 0.00 N ATOM 1602 CZ ARG A 106 19.663 -6.827 9.759 1.00 0.00 C ATOM 1603 NH1 ARG A 106 20.616 -6.347 8.990 1.00 0.00 N ATOM 1604 NH2 ARG A 106 19.670 -6.538 11.045 1.00 0.00 N ATOM 0 H ARG A 106 16.130 -4.151 6.591 1.00 0.00 H new ATOM 0 HA ARG A 106 14.968 -6.681 6.338 1.00 0.00 H new ATOM 0 HB2 ARG A 106 17.438 -5.858 6.455 1.00 0.00 H new ATOM 0 HB3 ARG A 106 17.240 -5.924 8.195 1.00 0.00 H new ATOM 0 HG2 ARG A 106 16.477 -8.349 7.807 1.00 0.00 H new ATOM 0 HG3 ARG A 106 17.189 -8.166 6.217 1.00 0.00 H new ATOM 0 HD2 ARG A 106 18.843 -9.068 7.770 1.00 0.00 H new ATOM 0 HD3 ARG A 106 19.330 -7.472 7.233 1.00 0.00 H new ATOM 0 HE ARG A 106 17.904 -7.826 9.855 1.00 0.00 H new ATOM 0 HH11 ARG A 106 20.602 -6.530 7.987 1.00 0.00 H new ATOM 0 HH12 ARG A 106 21.369 -5.792 9.397 1.00 0.00 H new ATOM 0 HH21 ARG A 106 18.917 -6.871 11.647 1.00 0.00 H new ATOM 0 HH22 ARG A 106 20.429 -5.981 11.438 1.00 0.00 H new ATOM 1618 N HIS A 107 15.025 -5.394 9.388 1.00 0.00 N ATOM 1619 CA HIS A 107 14.507 -5.473 10.742 1.00 0.00 C ATOM 1620 C HIS A 107 12.974 -5.416 10.761 1.00 0.00 C ATOM 1621 O HIS A 107 12.328 -6.154 11.526 1.00 0.00 O ATOM 1622 CB HIS A 107 15.118 -4.356 11.609 1.00 0.00 C ATOM 1623 CG HIS A 107 14.676 -4.353 13.042 1.00 0.00 C ATOM 1624 ND1 HIS A 107 13.840 -3.397 13.569 1.00 0.00 N ATOM 1625 CD2 HIS A 107 14.979 -5.180 14.062 1.00 0.00 C ATOM 1626 CE1 HIS A 107 13.653 -3.640 14.842 1.00 0.00 C ATOM 1627 NE2 HIS A 107 14.330 -4.712 15.168 1.00 0.00 N ATOM 0 H HIS A 107 15.636 -4.593 9.230 1.00 0.00 H new ATOM 0 HA HIS A 107 14.797 -6.436 11.163 1.00 0.00 H new ATOM 0 HB2 HIS A 107 16.204 -4.447 11.580 1.00 0.00 H new ATOM 0 HB3 HIS A 107 14.866 -3.393 11.165 1.00 0.00 H new ATOM 0 HD2 HIS A 107 15.616 -6.051 14.013 1.00 0.00 H new ATOM 0 HE1 HIS A 107 13.042 -3.053 15.512 1.00 0.00 H new ATOM 0 HE2 HIS A 107 14.367 -5.130 16.098 1.00 0.00 H new ATOM 1636 N VAL A 108 12.380 -4.578 9.914 1.00 0.00 N ATOM 1637 CA VAL A 108 10.931 -4.489 9.899 1.00 0.00 C ATOM 1638 C VAL A 108 10.354 -5.732 9.246 1.00 0.00 C ATOM 1639 O VAL A 108 9.352 -6.237 9.679 1.00 0.00 O ATOM 1640 CB VAL A 108 10.354 -3.180 9.233 1.00 0.00 C ATOM 1641 CG1 VAL A 108 10.526 -3.161 7.726 1.00 0.00 C ATOM 1642 CG2 VAL A 108 8.887 -2.992 9.593 1.00 0.00 C ATOM 0 H VAL A 108 12.864 -3.972 9.252 1.00 0.00 H new ATOM 0 HA VAL A 108 10.619 -4.426 10.941 1.00 0.00 H new ATOM 0 HB VAL A 108 10.935 -2.349 9.634 1.00 0.00 H new ATOM 0 HG11 VAL A 108 10.110 -2.237 7.324 1.00 0.00 H new ATOM 0 HG12 VAL A 108 11.586 -3.219 7.480 1.00 0.00 H new ATOM 0 HG13 VAL A 108 10.005 -4.013 7.290 1.00 0.00 H new ATOM 0 HG21 VAL A 108 8.511 -2.083 9.123 1.00 0.00 H new ATOM 0 HG22 VAL A 108 8.313 -3.848 9.239 1.00 0.00 H new ATOM 0 HG23 VAL A 108 8.786 -2.909 10.675 1.00 0.00 H new ATOM 1652 N MET A 109 11.054 -6.265 8.259 1.00 0.00 N ATOM 1653 CA MET A 109 10.607 -7.458 7.559 1.00 0.00 C ATOM 1654 C MET A 109 10.554 -8.642 8.475 1.00 0.00 C ATOM 1655 O MET A 109 9.589 -9.399 8.459 1.00 0.00 O ATOM 1656 CB MET A 109 11.466 -7.734 6.348 1.00 0.00 C ATOM 1657 CG MET A 109 11.236 -6.700 5.304 1.00 0.00 C ATOM 1658 SD MET A 109 9.556 -6.744 4.685 1.00 0.00 S ATOM 1659 CE MET A 109 9.543 -5.201 3.831 1.00 0.00 C ATOM 0 H MET A 109 11.940 -5.888 7.922 1.00 0.00 H new ATOM 0 HA MET A 109 9.592 -7.274 7.207 1.00 0.00 H new ATOM 0 HB2 MET A 109 12.518 -7.743 6.634 1.00 0.00 H new ATOM 0 HB3 MET A 109 11.236 -8.722 5.948 1.00 0.00 H new ATOM 0 HG2 MET A 109 11.446 -5.713 5.717 1.00 0.00 H new ATOM 0 HG3 MET A 109 11.932 -6.855 4.479 1.00 0.00 H new ATOM 0 HE1 MET A 109 8.566 -5.047 3.372 1.00 0.00 H new ATOM 0 HE2 MET A 109 9.744 -4.394 4.535 1.00 0.00 H new ATOM 0 HE3 MET A 109 10.310 -5.207 3.057 1.00 0.00 H new ATOM 1669 N THR A 110 11.558 -8.772 9.314 1.00 0.00 N ATOM 1670 CA THR A 110 11.597 -9.824 10.305 1.00 0.00 C ATOM 1671 C THR A 110 10.405 -9.661 11.286 1.00 0.00 C ATOM 1672 O THR A 110 9.779 -10.637 11.692 1.00 0.00 O ATOM 1673 CB THR A 110 12.944 -9.785 11.049 1.00 0.00 C ATOM 1674 OG1 THR A 110 14.009 -9.808 10.068 1.00 0.00 O ATOM 1675 CG2 THR A 110 13.099 -10.986 11.977 1.00 0.00 C ATOM 0 H THR A 110 12.368 -8.153 9.328 1.00 0.00 H new ATOM 0 HA THR A 110 11.506 -10.795 9.818 1.00 0.00 H new ATOM 0 HB THR A 110 12.986 -8.879 11.653 1.00 0.00 H new ATOM 0 HG1 THR A 110 14.106 -8.918 9.669 1.00 0.00 H new ATOM 0 HG21 THR A 110 14.060 -10.929 12.488 1.00 0.00 H new ATOM 0 HG22 THR A 110 12.296 -10.983 12.714 1.00 0.00 H new ATOM 0 HG23 THR A 110 13.052 -11.905 11.393 1.00 0.00 H new ATOM 1683 N ASN A 111 10.059 -8.406 11.578 1.00 0.00 N ATOM 1684 CA ASN A 111 8.909 -8.077 12.441 1.00 0.00 C ATOM 1685 C ASN A 111 7.591 -8.435 11.736 1.00 0.00 C ATOM 1686 O ASN A 111 6.621 -8.862 12.365 1.00 0.00 O ATOM 1687 CB ASN A 111 8.904 -6.568 12.769 1.00 0.00 C ATOM 1688 CG ASN A 111 7.749 -6.153 13.679 1.00 0.00 C ATOM 1689 OD1 ASN A 111 6.654 -5.819 13.212 1.00 0.00 O ATOM 1690 ND2 ASN A 111 7.980 -6.144 14.963 1.00 0.00 N ATOM 0 H ASN A 111 10.561 -7.589 11.229 1.00 0.00 H new ATOM 0 HA ASN A 111 8.999 -8.654 13.361 1.00 0.00 H new ATOM 0 HB2 ASN A 111 9.847 -6.304 13.247 1.00 0.00 H new ATOM 0 HB3 ASN A 111 8.847 -6.001 11.840 1.00 0.00 H new ATOM 0 HD21 ASN A 111 7.247 -5.856 15.611 1.00 0.00 H new ATOM 0 HD22 ASN A 111 8.894 -6.425 15.319 1.00 0.00 H new ATOM 1697 N LEU A 112 7.584 -8.285 10.425 1.00 0.00 N ATOM 1698 CA LEU A 112 6.402 -8.512 9.602 1.00 0.00 C ATOM 1699 C LEU A 112 6.251 -9.991 9.292 1.00 0.00 C ATOM 1700 O LEU A 112 5.181 -10.460 8.882 1.00 0.00 O ATOM 1701 CB LEU A 112 6.529 -7.702 8.306 1.00 0.00 C ATOM 1702 CG LEU A 112 6.654 -6.182 8.490 1.00 0.00 C ATOM 1703 CD1 LEU A 112 7.087 -5.505 7.202 1.00 0.00 C ATOM 1704 CD2 LEU A 112 5.347 -5.585 8.986 1.00 0.00 C ATOM 0 H LEU A 112 8.405 -7.999 9.892 1.00 0.00 H new ATOM 0 HA LEU A 112 5.514 -8.188 10.144 1.00 0.00 H new ATOM 0 HB2 LEU A 112 7.402 -8.058 7.759 1.00 0.00 H new ATOM 0 HB3 LEU A 112 5.658 -7.905 7.683 1.00 0.00 H new ATOM 0 HG LEU A 112 7.423 -6.005 9.242 1.00 0.00 H new ATOM 0 HD11 LEU A 112 7.166 -4.430 7.365 1.00 0.00 H new ATOM 0 HD12 LEU A 112 8.056 -5.898 6.892 1.00 0.00 H new ATOM 0 HD13 LEU A 112 6.350 -5.700 6.423 1.00 0.00 H new ATOM 0 HD21 LEU A 112 5.462 -4.508 9.108 1.00 0.00 H new ATOM 0 HD22 LEU A 112 4.557 -5.786 8.262 1.00 0.00 H new ATOM 0 HD23 LEU A 112 5.083 -6.033 9.944 1.00 0.00 H new ATOM 1716 N GLY A 113 7.326 -10.717 9.494 1.00 0.00 N ATOM 1717 CA GLY A 113 7.329 -12.123 9.250 1.00 0.00 C ATOM 1718 C GLY A 113 7.619 -12.439 7.805 1.00 0.00 C ATOM 1719 O GLY A 113 7.064 -13.397 7.248 1.00 0.00 O ATOM 0 H GLY A 113 8.214 -10.343 9.830 1.00 0.00 H new ATOM 0 HA2 GLY A 113 8.076 -12.600 9.884 1.00 0.00 H new ATOM 0 HA3 GLY A 113 6.362 -12.542 9.527 1.00 0.00 H new ATOM 1723 N GLU A 114 8.465 -11.644 7.173 1.00 0.00 N ATOM 1724 CA GLU A 114 8.787 -11.897 5.815 1.00 0.00 C ATOM 1725 C GLU A 114 10.156 -12.529 5.723 1.00 0.00 C ATOM 1726 O GLU A 114 11.097 -12.138 6.426 1.00 0.00 O ATOM 1727 CB GLU A 114 8.664 -10.653 4.932 1.00 0.00 C ATOM 1728 CG GLU A 114 8.496 -11.005 3.473 1.00 0.00 C ATOM 1729 CD GLU A 114 7.429 -12.048 3.262 1.00 0.00 C ATOM 1730 OE1 GLU A 114 6.265 -11.692 3.033 1.00 0.00 O ATOM 1731 OE2 GLU A 114 7.751 -13.259 3.308 1.00 0.00 O ATOM 0 H GLU A 114 8.926 -10.834 7.587 1.00 0.00 H new ATOM 0 HA GLU A 114 8.052 -12.600 5.423 1.00 0.00 H new ATOM 0 HB2 GLU A 114 7.812 -10.058 5.261 1.00 0.00 H new ATOM 0 HB3 GLU A 114 9.552 -10.033 5.055 1.00 0.00 H new ATOM 0 HG2 GLU A 114 8.241 -10.107 2.911 1.00 0.00 H new ATOM 0 HG3 GLU A 114 9.443 -11.371 3.077 1.00 0.00 H new ATOM 1738 N LYS A 115 10.256 -13.464 4.838 1.00 0.00 N ATOM 1739 CA LYS A 115 11.432 -14.321 4.659 1.00 0.00 C ATOM 1740 C LYS A 115 12.538 -13.656 3.836 1.00 0.00 C ATOM 1741 O LYS A 115 13.407 -14.342 3.293 1.00 0.00 O ATOM 1742 CB LYS A 115 10.996 -15.636 3.986 1.00 0.00 C ATOM 1743 CG LYS A 115 10.322 -15.426 2.628 1.00 0.00 C ATOM 1744 CD LYS A 115 9.852 -16.724 1.997 1.00 0.00 C ATOM 1745 CE LYS A 115 9.132 -16.436 0.689 1.00 0.00 C ATOM 1746 NZ LYS A 115 8.611 -17.654 0.042 1.00 0.00 N ATOM 0 H LYS A 115 9.504 -13.679 4.183 1.00 0.00 H new ATOM 0 HA LYS A 115 11.852 -14.512 5.646 1.00 0.00 H new ATOM 0 HB2 LYS A 115 11.869 -16.276 3.856 1.00 0.00 H new ATOM 0 HB3 LYS A 115 10.309 -16.164 4.647 1.00 0.00 H new ATOM 0 HG2 LYS A 115 9.470 -14.757 2.750 1.00 0.00 H new ATOM 0 HG3 LYS A 115 11.021 -14.932 1.953 1.00 0.00 H new ATOM 0 HD2 LYS A 115 10.704 -17.379 1.816 1.00 0.00 H new ATOM 0 HD3 LYS A 115 9.185 -17.250 2.681 1.00 0.00 H new ATOM 0 HE2 LYS A 115 8.307 -15.749 0.878 1.00 0.00 H new ATOM 0 HE3 LYS A 115 9.816 -15.932 0.006 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 8.131 -17.398 -0.844 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 9.398 -18.301 -0.165 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 7.936 -18.124 0.679 1.00 0.00 H new ATOM 1760 N LEU A 116 12.553 -12.354 3.811 1.00 0.00 N ATOM 1761 CA LEU A 116 13.507 -11.620 2.980 1.00 0.00 C ATOM 1762 C LEU A 116 14.916 -11.784 3.517 1.00 0.00 C ATOM 1763 O LEU A 116 15.151 -11.645 4.728 1.00 0.00 O ATOM 1764 CB LEU A 116 13.184 -10.125 2.881 1.00 0.00 C ATOM 1765 CG LEU A 116 11.760 -9.724 2.489 1.00 0.00 C ATOM 1766 CD1 LEU A 116 11.720 -8.269 2.107 1.00 0.00 C ATOM 1767 CD2 LEU A 116 11.204 -10.581 1.370 1.00 0.00 C ATOM 0 H LEU A 116 11.921 -11.764 4.352 1.00 0.00 H new ATOM 0 HA LEU A 116 13.430 -12.046 1.980 1.00 0.00 H new ATOM 0 HB2 LEU A 116 13.405 -9.670 3.847 1.00 0.00 H new ATOM 0 HB3 LEU A 116 13.867 -9.683 2.156 1.00 0.00 H new ATOM 0 HG LEU A 116 11.125 -9.889 3.360 1.00 0.00 H new ATOM 0 HD11 LEU A 116 10.703 -7.993 1.830 1.00 0.00 H new ATOM 0 HD12 LEU A 116 12.043 -7.662 2.953 1.00 0.00 H new ATOM 0 HD13 LEU A 116 12.386 -8.096 1.261 1.00 0.00 H new ATOM 0 HD21 LEU A 116 10.192 -10.255 1.131 1.00 0.00 H new ATOM 0 HD22 LEU A 116 11.836 -10.482 0.487 1.00 0.00 H new ATOM 0 HD23 LEU A 116 11.184 -11.624 1.686 1.00 0.00 H new ATOM 1779 N THR A 117 15.831 -12.083 2.633 1.00 0.00 N ATOM 1780 CA THR A 117 17.208 -12.283 2.983 1.00 0.00 C ATOM 1781 C THR A 117 17.908 -10.939 3.134 1.00 0.00 C ATOM 1782 O THR A 117 17.371 -9.896 2.716 1.00 0.00 O ATOM 1783 CB THR A 117 17.910 -13.095 1.878 1.00 0.00 C ATOM 1784 OG1 THR A 117 17.721 -12.439 0.606 1.00 0.00 O ATOM 1785 CG2 THR A 117 17.352 -14.499 1.802 1.00 0.00 C ATOM 0 H THR A 117 15.636 -12.195 1.638 1.00 0.00 H new ATOM 0 HA THR A 117 17.257 -12.825 3.927 1.00 0.00 H new ATOM 0 HB THR A 117 18.972 -13.154 2.116 1.00 0.00 H new ATOM 0 HG1 THR A 117 18.027 -13.028 -0.115 1.00 0.00 H new ATOM 0 HG21 THR A 117 17.864 -15.052 1.014 1.00 0.00 H new ATOM 0 HG22 THR A 117 17.504 -15.003 2.757 1.00 0.00 H new ATOM 0 HG23 THR A 117 16.286 -14.455 1.580 1.00 0.00 H new ATOM 1793 N ASP A 118 19.103 -10.951 3.704 1.00 0.00 N ATOM 1794 CA ASP A 118 19.903 -9.731 3.831 1.00 0.00 C ATOM 1795 C ASP A 118 20.276 -9.228 2.441 1.00 0.00 C ATOM 1796 O ASP A 118 20.421 -8.030 2.221 1.00 0.00 O ATOM 1797 CB ASP A 118 21.166 -9.934 4.704 1.00 0.00 C ATOM 1798 CG ASP A 118 22.202 -10.881 4.119 1.00 0.00 C ATOM 1799 OD1 ASP A 118 22.127 -12.104 4.387 1.00 0.00 O ATOM 1800 OD2 ASP A 118 23.117 -10.428 3.414 1.00 0.00 O ATOM 0 H ASP A 118 19.544 -11.787 4.087 1.00 0.00 H new ATOM 0 HA ASP A 118 19.297 -8.984 4.343 1.00 0.00 H new ATOM 0 HB2 ASP A 118 21.635 -8.964 4.871 1.00 0.00 H new ATOM 0 HB3 ASP A 118 20.859 -10.312 5.679 1.00 0.00 H new ATOM 1805 N GLU A 119 20.378 -10.158 1.504 1.00 0.00 N ATOM 1806 CA GLU A 119 20.618 -9.854 0.126 1.00 0.00 C ATOM 1807 C GLU A 119 19.435 -9.090 -0.446 1.00 0.00 C ATOM 1808 O GLU A 119 19.595 -7.988 -0.957 1.00 0.00 O ATOM 1809 CB GLU A 119 20.788 -11.146 -0.638 1.00 0.00 C ATOM 1810 CG GLU A 119 21.004 -10.966 -2.112 1.00 0.00 C ATOM 1811 CD GLU A 119 21.109 -12.272 -2.827 1.00 0.00 C ATOM 1812 OE1 GLU A 119 22.169 -12.911 -2.742 1.00 0.00 O ATOM 1813 OE2 GLU A 119 20.141 -12.679 -3.508 1.00 0.00 O ATOM 0 H GLU A 119 20.293 -11.156 1.696 1.00 0.00 H new ATOM 0 HA GLU A 119 21.517 -9.244 0.039 1.00 0.00 H new ATOM 0 HB2 GLU A 119 21.635 -11.692 -0.222 1.00 0.00 H new ATOM 0 HB3 GLU A 119 19.904 -11.765 -0.485 1.00 0.00 H new ATOM 0 HG2 GLU A 119 20.180 -10.389 -2.531 1.00 0.00 H new ATOM 0 HG3 GLU A 119 21.914 -10.389 -2.277 1.00 0.00 H new ATOM 1820 N GLU A 120 18.246 -9.683 -0.314 1.00 0.00 N ATOM 1821 CA GLU A 120 17.017 -9.119 -0.854 1.00 0.00 C ATOM 1822 C GLU A 120 16.794 -7.699 -0.333 1.00 0.00 C ATOM 1823 O GLU A 120 16.623 -6.774 -1.115 1.00 0.00 O ATOM 1824 CB GLU A 120 15.821 -10.002 -0.480 1.00 0.00 C ATOM 1825 CG GLU A 120 14.506 -9.565 -1.103 1.00 0.00 C ATOM 1826 CD GLU A 120 14.459 -9.785 -2.602 1.00 0.00 C ATOM 1827 OE1 GLU A 120 14.990 -8.969 -3.353 1.00 0.00 O ATOM 1828 OE2 GLU A 120 13.873 -10.793 -3.049 1.00 0.00 O ATOM 0 H GLU A 120 18.113 -10.570 0.172 1.00 0.00 H new ATOM 0 HA GLU A 120 17.110 -9.080 -1.939 1.00 0.00 H new ATOM 0 HB2 GLU A 120 16.031 -11.027 -0.784 1.00 0.00 H new ATOM 0 HB3 GLU A 120 15.712 -10.007 0.605 1.00 0.00 H new ATOM 0 HG2 GLU A 120 13.689 -10.113 -0.635 1.00 0.00 H new ATOM 0 HG3 GLU A 120 14.343 -8.508 -0.891 1.00 0.00 H new ATOM 1835 N VAL A 121 16.863 -7.533 0.990 1.00 0.00 N ATOM 1836 CA VAL A 121 16.614 -6.232 1.618 1.00 0.00 C ATOM 1837 C VAL A 121 17.629 -5.171 1.136 1.00 0.00 C ATOM 1838 O VAL A 121 17.264 -4.025 0.885 1.00 0.00 O ATOM 1839 CB VAL A 121 16.602 -6.317 3.194 1.00 0.00 C ATOM 1840 CG1 VAL A 121 15.622 -7.368 3.694 1.00 0.00 C ATOM 1841 CG2 VAL A 121 17.985 -6.550 3.786 1.00 0.00 C ATOM 0 H VAL A 121 17.089 -8.281 1.646 1.00 0.00 H new ATOM 0 HA VAL A 121 15.617 -5.922 1.304 1.00 0.00 H new ATOM 0 HB VAL A 121 16.266 -5.340 3.541 1.00 0.00 H new ATOM 0 HG11 VAL A 121 15.643 -7.396 4.783 1.00 0.00 H new ATOM 0 HG12 VAL A 121 14.616 -7.117 3.357 1.00 0.00 H new ATOM 0 HG13 VAL A 121 15.904 -8.345 3.300 1.00 0.00 H new ATOM 0 HG21 VAL A 121 17.912 -6.599 4.872 1.00 0.00 H new ATOM 0 HG22 VAL A 121 18.390 -7.488 3.407 1.00 0.00 H new ATOM 0 HG23 VAL A 121 18.645 -5.730 3.503 1.00 0.00 H new ATOM 1851 N ASP A 122 18.879 -5.591 0.942 1.00 0.00 N ATOM 1852 CA ASP A 122 19.956 -4.688 0.527 1.00 0.00 C ATOM 1853 C ASP A 122 19.768 -4.303 -0.918 1.00 0.00 C ATOM 1854 O ASP A 122 19.848 -3.127 -1.285 1.00 0.00 O ATOM 1855 CB ASP A 122 21.317 -5.380 0.689 1.00 0.00 C ATOM 1856 CG ASP A 122 22.509 -4.492 0.373 1.00 0.00 C ATOM 1857 OD1 ASP A 122 22.829 -4.288 -0.812 1.00 0.00 O ATOM 1858 OD2 ASP A 122 23.193 -4.039 1.318 1.00 0.00 O ATOM 0 H ASP A 122 19.174 -6.559 1.067 1.00 0.00 H new ATOM 0 HA ASP A 122 19.927 -3.796 1.153 1.00 0.00 H new ATOM 0 HB2 ASP A 122 21.409 -5.741 1.713 1.00 0.00 H new ATOM 0 HB3 ASP A 122 21.347 -6.254 0.039 1.00 0.00 H new ATOM 1863 N GLU A 123 19.459 -5.300 -1.723 1.00 0.00 N ATOM 1864 CA GLU A 123 19.312 -5.134 -3.142 1.00 0.00 C ATOM 1865 C GLU A 123 18.074 -4.261 -3.426 1.00 0.00 C ATOM 1866 O GLU A 123 18.080 -3.435 -4.349 1.00 0.00 O ATOM 1867 CB GLU A 123 19.186 -6.506 -3.799 1.00 0.00 C ATOM 1868 CG GLU A 123 19.534 -6.527 -5.269 1.00 0.00 C ATOM 1869 CD GLU A 123 21.009 -6.347 -5.539 1.00 0.00 C ATOM 1870 OE1 GLU A 123 21.507 -5.207 -5.520 1.00 0.00 O ATOM 1871 OE2 GLU A 123 21.694 -7.349 -5.815 1.00 0.00 O ATOM 0 H GLU A 123 19.303 -6.255 -1.400 1.00 0.00 H new ATOM 0 HA GLU A 123 20.186 -4.634 -3.559 1.00 0.00 H new ATOM 0 HB2 GLU A 123 19.834 -7.208 -3.274 1.00 0.00 H new ATOM 0 HB3 GLU A 123 18.164 -6.863 -3.675 1.00 0.00 H new ATOM 0 HG2 GLU A 123 19.206 -7.474 -5.699 1.00 0.00 H new ATOM 0 HG3 GLU A 123 18.980 -5.738 -5.777 1.00 0.00 H new ATOM 1878 N MET A 124 17.025 -4.438 -2.604 1.00 0.00 N ATOM 1879 CA MET A 124 15.825 -3.599 -2.667 1.00 0.00 C ATOM 1880 C MET A 124 16.201 -2.149 -2.510 1.00 0.00 C ATOM 1881 O MET A 124 15.872 -1.318 -3.371 1.00 0.00 O ATOM 1882 CB MET A 124 14.820 -3.937 -1.560 1.00 0.00 C ATOM 1883 CG MET A 124 13.983 -5.173 -1.770 1.00 0.00 C ATOM 1884 SD MET A 124 12.842 -5.416 -0.393 1.00 0.00 S ATOM 1885 CE MET A 124 11.876 -6.784 -0.992 1.00 0.00 C ATOM 0 H MET A 124 16.989 -5.161 -1.885 1.00 0.00 H new ATOM 0 HA MET A 124 15.365 -3.788 -3.637 1.00 0.00 H new ATOM 0 HB2 MET A 124 15.367 -4.050 -0.624 1.00 0.00 H new ATOM 0 HB3 MET A 124 14.149 -3.087 -1.436 1.00 0.00 H new ATOM 0 HG2 MET A 124 13.423 -5.085 -2.701 1.00 0.00 H new ATOM 0 HG3 MET A 124 14.631 -6.044 -1.869 1.00 0.00 H new ATOM 0 HE1 MET A 124 11.172 -7.098 -0.221 1.00 0.00 H new ATOM 0 HE2 MET A 124 11.326 -6.479 -1.883 1.00 0.00 H new ATOM 0 HE3 MET A 124 12.537 -7.615 -1.240 1.00 0.00 H new ATOM 1895 N ILE A 125 16.903 -1.857 -1.417 1.00 0.00 N ATOM 1896 CA ILE A 125 17.345 -0.509 -1.096 1.00 0.00 C ATOM 1897 C ILE A 125 18.192 0.044 -2.208 1.00 0.00 C ATOM 1898 O ILE A 125 17.942 1.113 -2.679 1.00 0.00 O ATOM 1899 CB ILE A 125 18.164 -0.468 0.227 1.00 0.00 C ATOM 1900 CG1 ILE A 125 17.312 -0.932 1.420 1.00 0.00 C ATOM 1901 CG2 ILE A 125 18.775 0.920 0.481 1.00 0.00 C ATOM 1902 CD1 ILE A 125 16.072 -0.107 1.698 1.00 0.00 C ATOM 0 H ILE A 125 17.181 -2.556 -0.728 1.00 0.00 H new ATOM 0 HA ILE A 125 16.449 0.098 -0.970 1.00 0.00 H new ATOM 0 HB ILE A 125 18.994 -1.166 0.116 1.00 0.00 H new ATOM 0 HG12 ILE A 125 17.009 -1.965 1.247 1.00 0.00 H new ATOM 0 HG13 ILE A 125 17.937 -0.929 2.313 1.00 0.00 H new ATOM 0 HG21 ILE A 125 19.338 0.904 1.414 1.00 0.00 H new ATOM 0 HG22 ILE A 125 19.442 1.180 -0.341 1.00 0.00 H new ATOM 0 HG23 ILE A 125 17.979 1.661 0.550 1.00 0.00 H new ATOM 0 HD11 ILE A 125 15.545 -0.520 2.558 1.00 0.00 H new ATOM 0 HD12 ILE A 125 16.360 0.923 1.909 1.00 0.00 H new ATOM 0 HD13 ILE A 125 15.417 -0.129 0.827 1.00 0.00 H new ATOM 1914 N ARG A 126 19.143 -0.733 -2.643 1.00 0.00 N ATOM 1915 CA ARG A 126 20.103 -0.342 -3.669 1.00 0.00 C ATOM 1916 C ARG A 126 19.422 0.033 -5.003 1.00 0.00 C ATOM 1917 O ARG A 126 19.853 0.954 -5.683 1.00 0.00 O ATOM 1918 CB ARG A 126 21.085 -1.484 -3.859 1.00 0.00 C ATOM 1919 CG ARG A 126 22.175 -1.262 -4.876 1.00 0.00 C ATOM 1920 CD ARG A 126 23.017 -2.511 -4.979 1.00 0.00 C ATOM 1921 NE ARG A 126 24.078 -2.411 -5.971 1.00 0.00 N ATOM 1922 CZ ARG A 126 24.559 -3.451 -6.659 1.00 0.00 C ATOM 1923 NH1 ARG A 126 23.960 -4.649 -6.586 1.00 0.00 N ATOM 1924 NH2 ARG A 126 25.604 -3.286 -7.464 1.00 0.00 N ATOM 0 H ARG A 126 19.286 -1.681 -2.294 1.00 0.00 H new ATOM 0 HA ARG A 126 20.625 0.556 -3.339 1.00 0.00 H new ATOM 0 HB2 ARG A 126 21.552 -1.698 -2.898 1.00 0.00 H new ATOM 0 HB3 ARG A 126 20.525 -2.374 -4.146 1.00 0.00 H new ATOM 0 HG2 ARG A 126 21.741 -1.020 -5.846 1.00 0.00 H new ATOM 0 HG3 ARG A 126 22.794 -0.414 -4.584 1.00 0.00 H new ATOM 0 HD2 ARG A 126 23.458 -2.724 -4.005 1.00 0.00 H new ATOM 0 HD3 ARG A 126 22.374 -3.355 -5.229 1.00 0.00 H new ATOM 0 HE ARG A 126 24.479 -1.491 -6.152 1.00 0.00 H new ATOM 0 HH11 ARG A 126 23.132 -4.771 -6.003 1.00 0.00 H new ATOM 0 HH12 ARG A 126 24.332 -5.438 -7.114 1.00 0.00 H new ATOM 0 HH21 ARG A 126 26.037 -2.367 -7.556 1.00 0.00 H new ATOM 0 HH22 ARG A 126 25.973 -4.078 -7.990 1.00 0.00 H new ATOM 1938 N GLU A 127 18.375 -0.678 -5.370 1.00 0.00 N ATOM 1939 CA GLU A 127 17.653 -0.363 -6.594 1.00 0.00 C ATOM 1940 C GLU A 127 16.669 0.765 -6.412 1.00 0.00 C ATOM 1941 O GLU A 127 16.328 1.468 -7.378 1.00 0.00 O ATOM 1942 CB GLU A 127 16.996 -1.586 -7.196 1.00 0.00 C ATOM 1943 CG GLU A 127 17.989 -2.505 -7.862 1.00 0.00 C ATOM 1944 CD GLU A 127 18.661 -1.849 -9.043 1.00 0.00 C ATOM 1945 OE1 GLU A 127 18.116 -1.903 -10.163 1.00 0.00 O ATOM 1946 OE2 GLU A 127 19.742 -1.262 -8.890 1.00 0.00 O ATOM 0 H GLU A 127 18.005 -1.471 -4.846 1.00 0.00 H new ATOM 0 HA GLU A 127 18.400 -0.013 -7.307 1.00 0.00 H new ATOM 0 HB2 GLU A 127 16.467 -2.132 -6.415 1.00 0.00 H new ATOM 0 HB3 GLU A 127 16.250 -1.272 -7.926 1.00 0.00 H new ATOM 0 HG2 GLU A 127 18.745 -2.809 -7.137 1.00 0.00 H new ATOM 0 HG3 GLU A 127 17.480 -3.411 -8.191 1.00 0.00 H new ATOM 1953 N ALA A 128 16.219 0.950 -5.190 1.00 0.00 N ATOM 1954 CA ALA A 128 15.333 2.044 -4.872 1.00 0.00 C ATOM 1955 C ALA A 128 16.161 3.306 -4.720 1.00 0.00 C ATOM 1956 O ALA A 128 15.699 4.419 -4.957 1.00 0.00 O ATOM 1957 CB ALA A 128 14.558 1.744 -3.606 1.00 0.00 C ATOM 0 H ALA A 128 16.455 0.352 -4.398 1.00 0.00 H new ATOM 0 HA ALA A 128 14.608 2.183 -5.674 1.00 0.00 H new ATOM 0 HB1 ALA A 128 13.894 2.578 -3.379 1.00 0.00 H new ATOM 0 HB2 ALA A 128 13.968 0.839 -3.747 1.00 0.00 H new ATOM 0 HB3 ALA A 128 15.254 1.599 -2.779 1.00 0.00 H new ATOM 1963 N ASP A 129 17.382 3.102 -4.314 1.00 0.00 N ATOM 1964 CA ASP A 129 18.377 4.123 -4.223 1.00 0.00 C ATOM 1965 C ASP A 129 18.914 4.402 -5.608 1.00 0.00 C ATOM 1966 O ASP A 129 19.885 3.801 -6.068 1.00 0.00 O ATOM 1967 CB ASP A 129 19.501 3.700 -3.273 1.00 0.00 C ATOM 1968 CG ASP A 129 20.678 4.626 -3.315 1.00 0.00 C ATOM 1969 OD1 ASP A 129 20.508 5.856 -3.254 1.00 0.00 O ATOM 1970 OD2 ASP A 129 21.800 4.138 -3.400 1.00 0.00 O ATOM 0 H ASP A 129 17.721 2.184 -4.027 1.00 0.00 H new ATOM 0 HA ASP A 129 17.934 5.033 -3.817 1.00 0.00 H new ATOM 0 HB2 ASP A 129 19.113 3.659 -2.255 1.00 0.00 H new ATOM 0 HB3 ASP A 129 19.828 2.693 -3.531 1.00 0.00 H new ATOM 1975 N ILE A 130 18.227 5.251 -6.296 1.00 0.00 N ATOM 1976 CA ILE A 130 18.558 5.579 -7.653 1.00 0.00 C ATOM 1977 C ILE A 130 19.746 6.537 -7.693 1.00 0.00 C ATOM 1978 O ILE A 130 20.510 6.558 -8.655 1.00 0.00 O ATOM 1979 CB ILE A 130 17.323 6.198 -8.382 1.00 0.00 C ATOM 1980 CG1 ILE A 130 16.109 5.263 -8.232 1.00 0.00 C ATOM 1981 CG2 ILE A 130 17.625 6.429 -9.859 1.00 0.00 C ATOM 1982 CD1 ILE A 130 14.825 5.802 -8.826 1.00 0.00 C ATOM 0 H ILE A 130 17.411 5.745 -5.934 1.00 0.00 H new ATOM 0 HA ILE A 130 18.838 4.664 -8.174 1.00 0.00 H new ATOM 0 HB ILE A 130 17.097 7.161 -7.925 1.00 0.00 H new ATOM 0 HG12 ILE A 130 16.341 4.309 -8.705 1.00 0.00 H new ATOM 0 HG13 ILE A 130 15.949 5.063 -7.172 1.00 0.00 H new ATOM 0 HG21 ILE A 130 16.751 6.861 -10.346 1.00 0.00 H new ATOM 0 HG22 ILE A 130 18.468 7.113 -9.955 1.00 0.00 H new ATOM 0 HG23 ILE A 130 17.872 5.479 -10.333 1.00 0.00 H new ATOM 0 HD11 ILE A 130 14.023 5.079 -8.675 1.00 0.00 H new ATOM 0 HD12 ILE A 130 14.564 6.741 -8.338 1.00 0.00 H new ATOM 0 HD13 ILE A 130 14.962 5.974 -9.894 1.00 0.00 H new ATOM 1994 N ASP A 131 19.950 7.265 -6.616 1.00 0.00 N ATOM 1995 CA ASP A 131 20.996 8.279 -6.596 1.00 0.00 C ATOM 1996 C ASP A 131 22.360 7.698 -6.193 1.00 0.00 C ATOM 1997 O ASP A 131 23.396 8.339 -6.361 1.00 0.00 O ATOM 1998 CB ASP A 131 20.589 9.417 -5.662 1.00 0.00 C ATOM 1999 CG ASP A 131 21.558 10.573 -5.673 1.00 0.00 C ATOM 2000 OD1 ASP A 131 21.748 11.192 -6.737 1.00 0.00 O ATOM 2001 OD2 ASP A 131 22.102 10.917 -4.607 1.00 0.00 O ATOM 0 H ASP A 131 19.416 7.180 -5.751 1.00 0.00 H new ATOM 0 HA ASP A 131 21.110 8.666 -7.608 1.00 0.00 H new ATOM 0 HB2 ASP A 131 19.601 9.777 -5.949 1.00 0.00 H new ATOM 0 HB3 ASP A 131 20.505 9.032 -4.646 1.00 0.00 H new ATOM 2006 N GLY A 132 22.360 6.469 -5.720 1.00 0.00 N ATOM 2007 CA GLY A 132 23.608 5.805 -5.399 1.00 0.00 C ATOM 2008 C GLY A 132 24.196 6.281 -4.089 1.00 0.00 C ATOM 2009 O GLY A 132 25.410 6.462 -3.968 1.00 0.00 O ATOM 0 H GLY A 132 21.521 5.914 -5.550 1.00 0.00 H new ATOM 0 HA2 GLY A 132 23.441 4.729 -5.349 1.00 0.00 H new ATOM 0 HA3 GLY A 132 24.326 5.980 -6.201 1.00 0.00 H new ATOM 2013 N ASP A 133 23.351 6.467 -3.107 1.00 0.00 N ATOM 2014 CA ASP A 133 23.791 6.936 -1.800 1.00 0.00 C ATOM 2015 C ASP A 133 23.862 5.758 -0.829 1.00 0.00 C ATOM 2016 O ASP A 133 24.504 5.823 0.228 1.00 0.00 O ATOM 2017 CB ASP A 133 22.815 7.992 -1.277 1.00 0.00 C ATOM 2018 CG ASP A 133 23.253 8.629 0.018 1.00 0.00 C ATOM 2019 OD1 ASP A 133 24.055 9.583 -0.018 1.00 0.00 O ATOM 2020 OD2 ASP A 133 22.787 8.223 1.089 1.00 0.00 O ATOM 0 H ASP A 133 22.347 6.302 -3.180 1.00 0.00 H new ATOM 0 HA ASP A 133 24.781 7.382 -1.889 1.00 0.00 H new ATOM 0 HB2 ASP A 133 22.694 8.769 -2.032 1.00 0.00 H new ATOM 0 HB3 ASP A 133 21.837 7.532 -1.134 1.00 0.00 H new ATOM 2025 N GLY A 134 23.227 4.672 -1.212 1.00 0.00 N ATOM 2026 CA GLY A 134 23.204 3.474 -0.411 1.00 0.00 C ATOM 2027 C GLY A 134 21.952 3.365 0.430 1.00 0.00 C ATOM 2028 O GLY A 134 21.676 2.311 1.013 1.00 0.00 O ATOM 0 H GLY A 134 22.712 4.598 -2.089 1.00 0.00 H new ATOM 0 HA2 GLY A 134 23.277 2.603 -1.063 1.00 0.00 H new ATOM 0 HA3 GLY A 134 24.078 3.459 0.240 1.00 0.00 H new ATOM 2032 N GLN A 135 21.196 4.443 0.495 1.00 0.00 N ATOM 2033 CA GLN A 135 19.981 4.500 1.295 1.00 0.00 C ATOM 2034 C GLN A 135 18.900 5.182 0.472 1.00 0.00 C ATOM 2035 O GLN A 135 19.137 6.255 -0.100 1.00 0.00 O ATOM 2036 CB GLN A 135 20.227 5.299 2.591 1.00 0.00 C ATOM 2037 CG GLN A 135 21.391 4.780 3.434 1.00 0.00 C ATOM 2038 CD GLN A 135 21.700 5.652 4.631 1.00 0.00 C ATOM 2039 OE1 GLN A 135 22.471 6.602 4.532 1.00 0.00 O ATOM 2040 NE2 GLN A 135 21.145 5.332 5.762 1.00 0.00 N ATOM 0 H GLN A 135 21.404 5.307 -0.005 1.00 0.00 H new ATOM 0 HA GLN A 135 19.673 3.491 1.568 1.00 0.00 H new ATOM 0 HB2 GLN A 135 20.416 6.341 2.332 1.00 0.00 H new ATOM 0 HB3 GLN A 135 19.319 5.280 3.194 1.00 0.00 H new ATOM 0 HG2 GLN A 135 21.160 3.772 3.778 1.00 0.00 H new ATOM 0 HG3 GLN A 135 22.280 4.707 2.807 1.00 0.00 H new ATOM 0 HE21 GLN A 135 20.509 4.536 5.811 1.00 0.00 H new ATOM 0 HE22 GLN A 135 21.346 5.876 6.601 1.00 0.00 H new ATOM 2049 N VAL A 136 17.736 4.588 0.414 1.00 0.00 N ATOM 2050 CA VAL A 136 16.639 5.122 -0.389 1.00 0.00 C ATOM 2051 C VAL A 136 15.908 6.255 0.332 1.00 0.00 C ATOM 2052 O VAL A 136 15.293 6.045 1.357 1.00 0.00 O ATOM 2053 CB VAL A 136 15.634 3.995 -0.862 1.00 0.00 C ATOM 2054 CG1 VAL A 136 15.336 3.040 0.256 1.00 0.00 C ATOM 2055 CG2 VAL A 136 14.314 4.590 -1.340 1.00 0.00 C ATOM 0 H VAL A 136 17.511 3.727 0.913 1.00 0.00 H new ATOM 0 HA VAL A 136 17.090 5.541 -1.288 1.00 0.00 H new ATOM 0 HB VAL A 136 16.118 3.470 -1.686 1.00 0.00 H new ATOM 0 HG11 VAL A 136 14.643 2.275 -0.094 1.00 0.00 H new ATOM 0 HG12 VAL A 136 16.261 2.568 0.587 1.00 0.00 H new ATOM 0 HG13 VAL A 136 14.887 3.583 1.088 1.00 0.00 H new ATOM 0 HG21 VAL A 136 13.647 3.788 -1.658 1.00 0.00 H new ATOM 0 HG22 VAL A 136 13.850 5.147 -0.526 1.00 0.00 H new ATOM 0 HG23 VAL A 136 14.500 5.261 -2.179 1.00 0.00 H new ATOM 2065 N ASN A 137 16.008 7.447 -0.200 1.00 0.00 N ATOM 2066 CA ASN A 137 15.311 8.602 0.370 1.00 0.00 C ATOM 2067 C ASN A 137 13.922 8.698 -0.239 1.00 0.00 C ATOM 2068 O ASN A 137 13.580 7.911 -1.134 1.00 0.00 O ATOM 2069 CB ASN A 137 16.087 9.911 0.141 1.00 0.00 C ATOM 2070 CG ASN A 137 16.234 10.255 -1.322 1.00 0.00 C ATOM 2071 OD1 ASN A 137 15.379 10.899 -1.910 1.00 0.00 O ATOM 2072 ND2 ASN A 137 17.322 9.859 -1.915 1.00 0.00 N ATOM 0 H ASN A 137 16.564 7.656 -1.029 1.00 0.00 H new ATOM 0 HA ASN A 137 15.235 8.458 1.448 1.00 0.00 H new ATOM 0 HB2 ASN A 137 15.574 10.726 0.652 1.00 0.00 H new ATOM 0 HB3 ASN A 137 17.076 9.825 0.591 1.00 0.00 H new ATOM 0 HD21 ASN A 137 17.479 10.085 -2.897 1.00 0.00 H new ATOM 0 HD22 ASN A 137 18.018 9.322 -1.398 1.00 0.00 H new ATOM 2079 N TYR A 138 13.139 9.667 0.195 1.00 0.00 N ATOM 2080 CA TYR A 138 11.765 9.786 -0.252 1.00 0.00 C ATOM 2081 C TYR A 138 11.660 10.136 -1.742 1.00 0.00 C ATOM 2082 O TYR A 138 10.845 9.559 -2.442 1.00 0.00 O ATOM 2083 CB TYR A 138 10.962 10.763 0.627 1.00 0.00 C ATOM 2084 CG TYR A 138 9.515 10.908 0.215 1.00 0.00 C ATOM 2085 CD1 TYR A 138 9.067 12.055 -0.421 1.00 0.00 C ATOM 2086 CD2 TYR A 138 8.605 9.883 0.434 1.00 0.00 C ATOM 2087 CE1 TYR A 138 7.761 12.178 -0.825 1.00 0.00 C ATOM 2088 CE2 TYR A 138 7.296 10.003 0.033 1.00 0.00 C ATOM 2089 CZ TYR A 138 6.880 11.153 -0.595 1.00 0.00 C ATOM 2090 OH TYR A 138 5.590 11.270 -1.009 1.00 0.00 O ATOM 0 H TYR A 138 13.432 10.385 0.858 1.00 0.00 H new ATOM 0 HA TYR A 138 11.313 8.801 -0.136 1.00 0.00 H new ATOM 0 HB2 TYR A 138 11.003 10.423 1.662 1.00 0.00 H new ATOM 0 HB3 TYR A 138 11.439 11.742 0.594 1.00 0.00 H new ATOM 0 HD1 TYR A 138 9.757 12.866 -0.602 1.00 0.00 H new ATOM 0 HD2 TYR A 138 8.930 8.978 0.926 1.00 0.00 H new ATOM 0 HE1 TYR A 138 7.429 13.078 -1.322 1.00 0.00 H new ATOM 0 HE2 TYR A 138 6.598 9.198 0.210 1.00 0.00 H new ATOM 0 HH TYR A 138 5.558 11.798 -1.834 1.00 0.00 H new ATOM 2100 N GLU A 139 12.523 11.014 -2.231 1.00 0.00 N ATOM 2101 CA GLU A 139 12.491 11.418 -3.635 1.00 0.00 C ATOM 2102 C GLU A 139 12.873 10.258 -4.541 1.00 0.00 C ATOM 2103 O GLU A 139 12.439 10.172 -5.680 1.00 0.00 O ATOM 2104 CB GLU A 139 13.421 12.585 -3.881 1.00 0.00 C ATOM 2105 CG GLU A 139 13.082 13.830 -3.098 1.00 0.00 C ATOM 2106 CD GLU A 139 11.720 14.391 -3.411 1.00 0.00 C ATOM 2107 OE1 GLU A 139 10.762 14.127 -2.655 1.00 0.00 O ATOM 2108 OE2 GLU A 139 11.602 15.153 -4.387 1.00 0.00 O ATOM 0 H GLU A 139 13.255 11.462 -1.680 1.00 0.00 H new ATOM 0 HA GLU A 139 11.471 11.725 -3.867 1.00 0.00 H new ATOM 0 HB2 GLU A 139 14.438 12.281 -3.634 1.00 0.00 H new ATOM 0 HB3 GLU A 139 13.409 12.825 -4.944 1.00 0.00 H new ATOM 0 HG2 GLU A 139 13.136 13.604 -2.033 1.00 0.00 H new ATOM 0 HG3 GLU A 139 13.834 14.592 -3.301 1.00 0.00 H new ATOM 2115 N GLU A 140 13.678 9.375 -4.033 1.00 0.00 N ATOM 2116 CA GLU A 140 14.034 8.182 -4.765 1.00 0.00 C ATOM 2117 C GLU A 140 12.912 7.148 -4.675 1.00 0.00 C ATOM 2118 O GLU A 140 12.625 6.423 -5.635 1.00 0.00 O ATOM 2119 CB GLU A 140 15.383 7.629 -4.285 1.00 0.00 C ATOM 2120 CG GLU A 140 16.598 8.150 -5.073 1.00 0.00 C ATOM 2121 CD GLU A 140 16.626 9.657 -5.266 1.00 0.00 C ATOM 2122 OE1 GLU A 140 17.302 10.364 -4.492 1.00 0.00 O ATOM 2123 OE2 GLU A 140 15.994 10.145 -6.216 1.00 0.00 O ATOM 0 H GLU A 140 14.106 9.452 -3.111 1.00 0.00 H new ATOM 0 HA GLU A 140 14.156 8.435 -5.818 1.00 0.00 H new ATOM 0 HB2 GLU A 140 15.512 7.881 -3.233 1.00 0.00 H new ATOM 0 HB3 GLU A 140 15.361 6.541 -4.352 1.00 0.00 H new ATOM 0 HG2 GLU A 140 17.508 7.846 -4.556 1.00 0.00 H new ATOM 0 HG3 GLU A 140 16.613 7.671 -6.052 1.00 0.00 H new ATOM 2130 N PHE A 141 12.230 7.132 -3.550 1.00 0.00 N ATOM 2131 CA PHE A 141 11.144 6.204 -3.344 1.00 0.00 C ATOM 2132 C PHE A 141 9.883 6.620 -4.116 1.00 0.00 C ATOM 2133 O PHE A 141 9.119 5.762 -4.537 1.00 0.00 O ATOM 2134 CB PHE A 141 10.848 5.993 -1.849 1.00 0.00 C ATOM 2135 CG PHE A 141 9.778 4.959 -1.588 1.00 0.00 C ATOM 2136 CD1 PHE A 141 8.495 5.336 -1.218 1.00 0.00 C ATOM 2137 CD2 PHE A 141 10.058 3.607 -1.732 1.00 0.00 C ATOM 2138 CE1 PHE A 141 7.517 4.387 -0.998 1.00 0.00 C ATOM 2139 CE2 PHE A 141 9.082 2.654 -1.511 1.00 0.00 C ATOM 2140 CZ PHE A 141 7.811 3.044 -1.144 1.00 0.00 C ATOM 0 H PHE A 141 12.411 7.754 -2.762 1.00 0.00 H new ATOM 0 HA PHE A 141 11.466 5.244 -3.747 1.00 0.00 H new ATOM 0 HB2 PHE A 141 11.765 5.691 -1.344 1.00 0.00 H new ATOM 0 HB3 PHE A 141 10.540 6.942 -1.410 1.00 0.00 H new ATOM 0 HD1 PHE A 141 8.259 6.383 -1.101 1.00 0.00 H new ATOM 0 HD2 PHE A 141 11.051 3.296 -2.020 1.00 0.00 H new ATOM 0 HE1 PHE A 141 6.522 4.694 -0.712 1.00 0.00 H new ATOM 0 HE2 PHE A 141 9.314 1.605 -1.625 1.00 0.00 H new ATOM 0 HZ PHE A 141 7.046 2.301 -0.971 1.00 0.00 H new ATOM 2150 N VAL A 142 9.677 7.927 -4.334 1.00 0.00 N ATOM 2151 CA VAL A 142 8.505 8.390 -5.105 1.00 0.00 C ATOM 2152 C VAL A 142 8.528 7.809 -6.522 1.00 0.00 C ATOM 2153 O VAL A 142 7.492 7.471 -7.089 1.00 0.00 O ATOM 2154 CB VAL A 142 8.348 9.950 -5.176 1.00 0.00 C ATOM 2155 CG1 VAL A 142 8.216 10.551 -3.808 1.00 0.00 C ATOM 2156 CG2 VAL A 142 9.471 10.621 -5.929 1.00 0.00 C ATOM 0 H VAL A 142 10.289 8.671 -3.998 1.00 0.00 H new ATOM 0 HA VAL A 142 7.638 8.021 -4.556 1.00 0.00 H new ATOM 0 HB VAL A 142 7.429 10.131 -5.733 1.00 0.00 H new ATOM 0 HG11 VAL A 142 8.109 11.632 -3.894 1.00 0.00 H new ATOM 0 HG12 VAL A 142 7.337 10.138 -3.312 1.00 0.00 H new ATOM 0 HG13 VAL A 142 9.105 10.320 -3.222 1.00 0.00 H new ATOM 0 HG21 VAL A 142 9.306 11.698 -5.944 1.00 0.00 H new ATOM 0 HG22 VAL A 142 10.419 10.406 -5.436 1.00 0.00 H new ATOM 0 HG23 VAL A 142 9.500 10.244 -6.951 1.00 0.00 H new ATOM 2166 N GLN A 143 9.728 7.638 -7.052 1.00 0.00 N ATOM 2167 CA GLN A 143 9.920 7.078 -8.355 1.00 0.00 C ATOM 2168 C GLN A 143 9.609 5.589 -8.325 1.00 0.00 C ATOM 2169 O GLN A 143 8.955 5.051 -9.222 1.00 0.00 O ATOM 2170 CB GLN A 143 11.343 7.288 -8.776 1.00 0.00 C ATOM 2171 CG GLN A 143 11.540 7.042 -10.244 1.00 0.00 C ATOM 2172 CD GLN A 143 10.691 7.949 -11.110 1.00 0.00 C ATOM 2173 OE1 GLN A 143 9.563 7.621 -11.454 1.00 0.00 O ATOM 2174 NE2 GLN A 143 11.209 9.094 -11.443 1.00 0.00 N ATOM 0 H GLN A 143 10.595 7.890 -6.577 1.00 0.00 H new ATOM 0 HA GLN A 143 9.252 7.567 -9.065 1.00 0.00 H new ATOM 0 HB2 GLN A 143 11.645 8.308 -8.536 1.00 0.00 H new ATOM 0 HB3 GLN A 143 11.991 6.621 -8.207 1.00 0.00 H new ATOM 0 HG2 GLN A 143 12.591 7.188 -10.494 1.00 0.00 H new ATOM 0 HG3 GLN A 143 11.300 6.003 -10.469 1.00 0.00 H new ATOM 0 HE21 GLN A 143 12.152 9.335 -11.139 1.00 0.00 H new ATOM 0 HE22 GLN A 143 10.672 9.752 -12.008 1.00 0.00 H new ATOM 2183 N MET A 144 10.036 4.951 -7.246 1.00 0.00 N ATOM 2184 CA MET A 144 9.857 3.513 -7.035 1.00 0.00 C ATOM 2185 C MET A 144 8.414 3.148 -6.800 1.00 0.00 C ATOM 2186 O MET A 144 7.940 2.141 -7.293 1.00 0.00 O ATOM 2187 CB MET A 144 10.699 3.039 -5.857 1.00 0.00 C ATOM 2188 CG MET A 144 12.183 3.126 -6.098 1.00 0.00 C ATOM 2189 SD MET A 144 12.720 2.088 -7.474 1.00 0.00 S ATOM 2190 CE MET A 144 12.275 0.454 -6.873 1.00 0.00 C ATOM 0 H MET A 144 10.523 5.418 -6.481 1.00 0.00 H new ATOM 0 HA MET A 144 10.186 3.015 -7.947 1.00 0.00 H new ATOM 0 HB2 MET A 144 10.447 3.634 -4.979 1.00 0.00 H new ATOM 0 HB3 MET A 144 10.437 2.006 -5.627 1.00 0.00 H new ATOM 0 HG2 MET A 144 12.455 4.162 -6.300 1.00 0.00 H new ATOM 0 HG3 MET A 144 12.713 2.828 -5.193 1.00 0.00 H new ATOM 0 HE1 MET A 144 12.842 -0.301 -7.417 1.00 0.00 H new ATOM 0 HE2 MET A 144 12.504 0.383 -5.810 1.00 0.00 H new ATOM 0 HE3 MET A 144 11.209 0.288 -7.027 1.00 0.00 H new ATOM 2200 N MET A 145 7.712 3.980 -6.063 1.00 0.00 N ATOM 2201 CA MET A 145 6.310 3.736 -5.745 1.00 0.00 C ATOM 2202 C MET A 145 5.456 3.833 -7.006 1.00 0.00 C ATOM 2203 O MET A 145 4.380 3.260 -7.097 1.00 0.00 O ATOM 2204 CB MET A 145 5.811 4.747 -4.718 1.00 0.00 C ATOM 2205 CG MET A 145 4.454 4.392 -4.149 1.00 0.00 C ATOM 2206 SD MET A 145 4.525 2.884 -3.185 1.00 0.00 S ATOM 2207 CE MET A 145 2.817 2.676 -2.742 1.00 0.00 C ATOM 0 H MET A 145 8.088 4.841 -5.666 1.00 0.00 H new ATOM 0 HA MET A 145 6.226 2.732 -5.328 1.00 0.00 H new ATOM 0 HB2 MET A 145 6.533 4.817 -3.904 1.00 0.00 H new ATOM 0 HB3 MET A 145 5.758 5.732 -5.182 1.00 0.00 H new ATOM 0 HG2 MET A 145 4.095 5.209 -3.523 1.00 0.00 H new ATOM 0 HG3 MET A 145 3.737 4.273 -4.961 1.00 0.00 H new ATOM 0 HE1 MET A 145 2.630 1.631 -2.495 1.00 0.00 H new ATOM 0 HE2 MET A 145 2.587 3.300 -1.878 1.00 0.00 H new ATOM 0 HE3 MET A 145 2.185 2.969 -3.580 1.00 0.00 H new ATOM 2217 N THR A 146 5.965 4.535 -7.980 1.00 0.00 N ATOM 2218 CA THR A 146 5.270 4.728 -9.216 1.00 0.00 C ATOM 2219 C THR A 146 5.760 3.682 -10.264 1.00 0.00 C ATOM 2220 O THR A 146 5.394 3.719 -11.433 1.00 0.00 O ATOM 2221 CB THR A 146 5.507 6.183 -9.703 1.00 0.00 C ATOM 2222 OG1 THR A 146 5.326 7.078 -8.568 1.00 0.00 O ATOM 2223 CG2 THR A 146 4.495 6.573 -10.772 1.00 0.00 C ATOM 0 H THR A 146 6.877 4.990 -7.936 1.00 0.00 H new ATOM 0 HA THR A 146 4.199 4.580 -9.079 1.00 0.00 H new ATOM 0 HB THR A 146 6.512 6.254 -10.120 1.00 0.00 H new ATOM 0 HG1 THR A 146 6.081 6.981 -7.951 1.00 0.00 H new ATOM 0 HG21 THR A 146 4.684 7.597 -11.095 1.00 0.00 H new ATOM 0 HG22 THR A 146 4.589 5.900 -11.624 1.00 0.00 H new ATOM 0 HG23 THR A 146 3.487 6.502 -10.362 1.00 0.00 H new ATOM 2231 N ALA A 147 6.545 2.717 -9.807 1.00 0.00 N ATOM 2232 CA ALA A 147 7.094 1.685 -10.677 1.00 0.00 C ATOM 2233 C ALA A 147 6.285 0.390 -10.541 1.00 0.00 C ATOM 2234 O ALA A 147 6.839 -0.716 -10.533 1.00 0.00 O ATOM 2235 CB ALA A 147 8.563 1.448 -10.338 1.00 0.00 C ATOM 0 H ALA A 147 6.819 2.627 -8.829 1.00 0.00 H new ATOM 0 HA ALA A 147 7.028 2.018 -11.713 1.00 0.00 H new ATOM 0 HB1 ALA A 147 8.967 0.675 -10.992 1.00 0.00 H new ATOM 0 HB2 ALA A 147 9.123 2.373 -10.479 1.00 0.00 H new ATOM 0 HB3 ALA A 147 8.650 1.127 -9.300 1.00 0.00 H new ATOM 2241 N LYS A 148 4.983 0.536 -10.491 1.00 0.00 N ATOM 2242 CA LYS A 148 4.077 -0.590 -10.352 1.00 0.00 C ATOM 2243 C LYS A 148 3.500 -0.945 -11.720 1.00 0.00 C ATOM 2244 O LYS A 148 4.069 -1.793 -12.429 1.00 0.00 O ATOM 2245 CB LYS A 148 2.944 -0.242 -9.372 1.00 0.00 C ATOM 2246 CG LYS A 148 3.401 0.067 -7.948 1.00 0.00 C ATOM 2247 CD LYS A 148 2.235 0.490 -7.043 1.00 0.00 C ATOM 2248 CE LYS A 148 1.599 1.804 -7.505 1.00 0.00 C ATOM 2249 NZ LYS A 148 0.511 2.248 -6.612 1.00 0.00 N ATOM 2250 OXT LYS A 148 2.497 -0.340 -12.120 1.00 0.00 O ATOM 0 H LYS A 148 4.515 1.441 -10.545 1.00 0.00 H new ATOM 0 HA LYS A 148 4.623 -1.447 -9.957 1.00 0.00 H new ATOM 0 HB2 LYS A 148 2.400 0.620 -9.759 1.00 0.00 H new ATOM 0 HB3 LYS A 148 2.241 -1.075 -9.340 1.00 0.00 H new ATOM 0 HG2 LYS A 148 3.886 -0.813 -7.525 1.00 0.00 H new ATOM 0 HG3 LYS A 148 4.147 0.862 -7.972 1.00 0.00 H new ATOM 0 HD2 LYS A 148 1.479 -0.295 -7.034 1.00 0.00 H new ATOM 0 HD3 LYS A 148 2.592 0.600 -6.019 1.00 0.00 H new ATOM 0 HE2 LYS A 148 2.365 2.578 -7.552 1.00 0.00 H new ATOM 0 HE3 LYS A 148 1.208 1.680 -8.515 1.00 0.00 H new ATOM 0 HZ1 LYS A 148 0.113 3.141 -6.967 1.00 0.00 H new ATOM 0 HZ2 LYS A 148 -0.234 1.523 -6.586 1.00 0.00 H new ATOM 0 HZ3 LYS A 148 0.886 2.393 -5.653 1.00 0.00 H new TER 2264 LYS A 148 ATOM 2265 N SER B 74 2.855 0.170 -14.762 1.00 0.00 N ATOM 2266 CA SER B 74 4.107 0.310 -15.473 1.00 0.00 C ATOM 2267 C SER B 74 4.599 -1.058 -15.990 1.00 0.00 C ATOM 2268 O SER B 74 5.220 -1.831 -15.247 1.00 0.00 O ATOM 2269 CB SER B 74 5.105 0.921 -14.522 1.00 0.00 C ATOM 2270 OG SER B 74 4.530 2.060 -13.907 1.00 0.00 O ATOM 0 HA SER B 74 3.979 0.951 -16.345 1.00 0.00 H new ATOM 0 HB2 SER B 74 5.396 0.193 -13.765 1.00 0.00 H new ATOM 0 HB3 SER B 74 6.011 1.202 -15.059 1.00 0.00 H new ATOM 0 HG SER B 74 3.558 1.946 -13.851 1.00 0.00 H new ATOM 2278 N PRO B 75 4.294 -1.396 -17.263 1.00 0.00 N ATOM 2279 CA PRO B 75 4.648 -2.687 -17.857 1.00 0.00 C ATOM 2280 C PRO B 75 6.101 -2.785 -18.334 1.00 0.00 C ATOM 2281 O PRO B 75 6.609 -3.893 -18.557 1.00 0.00 O ATOM 2282 CB PRO B 75 3.700 -2.807 -19.063 1.00 0.00 C ATOM 2283 CG PRO B 75 2.797 -1.615 -18.997 1.00 0.00 C ATOM 2284 CD PRO B 75 3.537 -0.577 -18.217 1.00 0.00 C ATOM 0 HA PRO B 75 4.551 -3.481 -17.117 1.00 0.00 H new ATOM 0 HB2 PRO B 75 4.259 -2.822 -19.999 1.00 0.00 H new ATOM 0 HB3 PRO B 75 3.127 -3.733 -19.019 1.00 0.00 H new ATOM 0 HG2 PRO B 75 2.556 -1.253 -19.996 1.00 0.00 H new ATOM 0 HG3 PRO B 75 1.853 -1.867 -18.513 1.00 0.00 H new ATOM 0 HD2 PRO B 75 4.192 0.021 -18.851 1.00 0.00 H new ATOM 0 HD3 PRO B 75 2.861 0.115 -17.715 1.00 0.00 H new ATOM 2292 N ALA B 76 6.789 -1.651 -18.436 1.00 0.00 N ATOM 2293 CA ALA B 76 8.161 -1.602 -18.984 1.00 0.00 C ATOM 2294 C ALA B 76 9.232 -2.074 -17.977 1.00 0.00 C ATOM 2295 O ALA B 76 10.408 -1.678 -18.058 1.00 0.00 O ATOM 2296 CB ALA B 76 8.474 -0.194 -19.474 1.00 0.00 C ATOM 0 H ALA B 76 6.425 -0.743 -18.147 1.00 0.00 H new ATOM 0 HA ALA B 76 8.196 -2.300 -19.820 1.00 0.00 H new ATOM 0 HB1 ALA B 76 9.487 -0.166 -19.876 1.00 0.00 H new ATOM 0 HB2 ALA B 76 7.766 0.086 -20.254 1.00 0.00 H new ATOM 0 HB3 ALA B 76 8.394 0.507 -18.643 1.00 0.00 H new ATOM 2302 N ASN B 77 8.844 -2.945 -17.083 1.00 0.00 N ATOM 2303 CA ASN B 77 9.739 -3.495 -16.096 1.00 0.00 C ATOM 2304 C ASN B 77 9.347 -4.912 -15.800 1.00 0.00 C ATOM 2305 O ASN B 77 8.249 -5.171 -15.316 1.00 0.00 O ATOM 2306 CB ASN B 77 9.735 -2.665 -14.817 1.00 0.00 C ATOM 2307 CG ASN B 77 10.609 -3.251 -13.720 1.00 0.00 C ATOM 2308 OD1 ASN B 77 10.156 -4.042 -12.901 1.00 0.00 O ATOM 2309 ND2 ASN B 77 11.849 -2.885 -13.704 1.00 0.00 N ATOM 0 H ASN B 77 7.889 -3.297 -17.018 1.00 0.00 H new ATOM 0 HA ASN B 77 10.752 -3.473 -16.498 1.00 0.00 H new ATOM 0 HB2 ASN B 77 10.078 -1.656 -15.045 1.00 0.00 H new ATOM 0 HB3 ASN B 77 8.712 -2.579 -14.451 1.00 0.00 H new ATOM 0 HD21 ASN B 77 12.481 -3.257 -12.995 1.00 0.00 H new ATOM 0 HD22 ASN B 77 12.195 -2.225 -14.400 1.00 0.00 H new ATOM 2316 N SER B 78 10.192 -5.817 -16.162 1.00 0.00 N ATOM 2317 CA SER B 78 9.972 -7.215 -15.918 1.00 0.00 C ATOM 2318 C SER B 78 10.890 -7.706 -14.782 1.00 0.00 C ATOM 2319 O SER B 78 10.989 -8.901 -14.512 1.00 0.00 O ATOM 2320 CB SER B 78 10.248 -7.972 -17.210 1.00 0.00 C ATOM 2321 OG SER B 78 9.558 -7.348 -18.303 1.00 0.00 O ATOM 0 H SER B 78 11.068 -5.611 -16.642 1.00 0.00 H new ATOM 0 HA SER B 78 8.942 -7.390 -15.607 1.00 0.00 H new ATOM 0 HB2 SER B 78 11.320 -7.990 -17.409 1.00 0.00 H new ATOM 0 HB3 SER B 78 9.925 -9.008 -17.110 1.00 0.00 H new ATOM 0 HG SER B 78 9.742 -7.840 -19.130 1.00 0.00 H new ATOM 2327 N PHE B 79 11.525 -6.766 -14.099 1.00 0.00 N ATOM 2328 CA PHE B 79 12.500 -7.088 -13.072 1.00 0.00 C ATOM 2329 C PHE B 79 11.874 -7.536 -11.762 1.00 0.00 C ATOM 2330 O PHE B 79 10.702 -7.234 -11.456 1.00 0.00 O ATOM 2331 CB PHE B 79 13.471 -5.929 -12.819 1.00 0.00 C ATOM 2332 CG PHE B 79 14.443 -5.657 -13.937 1.00 0.00 C ATOM 2333 CD1 PHE B 79 14.670 -4.367 -14.378 1.00 0.00 C ATOM 2334 CD2 PHE B 79 15.139 -6.693 -14.536 1.00 0.00 C ATOM 2335 CE1 PHE B 79 15.572 -4.114 -15.392 1.00 0.00 C ATOM 2336 CE2 PHE B 79 16.038 -6.447 -15.550 1.00 0.00 C ATOM 2337 CZ PHE B 79 16.258 -5.156 -15.979 1.00 0.00 C ATOM 0 H PHE B 79 11.380 -5.766 -14.240 1.00 0.00 H new ATOM 0 HA PHE B 79 13.058 -7.936 -13.469 1.00 0.00 H new ATOM 0 HB2 PHE B 79 12.892 -5.024 -12.633 1.00 0.00 H new ATOM 0 HB3 PHE B 79 14.035 -6.139 -11.910 1.00 0.00 H new ATOM 0 HD1 PHE B 79 14.135 -3.546 -13.924 1.00 0.00 H new ATOM 0 HD2 PHE B 79 14.975 -7.707 -14.204 1.00 0.00 H new ATOM 0 HE1 PHE B 79 15.740 -3.101 -15.725 1.00 0.00 H new ATOM 0 HE2 PHE B 79 16.571 -7.266 -16.009 1.00 0.00 H new ATOM 0 HZ PHE B 79 16.965 -4.961 -16.772 1.00 0.00 H new ATOM 2347 N HIS B 80 12.684 -8.222 -10.974 1.00 0.00 N ATOM 2348 CA HIS B 80 12.296 -8.765 -9.676 1.00 0.00 C ATOM 2349 C HIS B 80 12.027 -7.665 -8.661 1.00 0.00 C ATOM 2350 O HIS B 80 11.326 -7.877 -7.691 1.00 0.00 O ATOM 2351 CB HIS B 80 13.391 -9.734 -9.155 1.00 0.00 C ATOM 2352 CG HIS B 80 13.185 -10.266 -7.749 1.00 0.00 C ATOM 2353 ND1 HIS B 80 12.123 -11.050 -7.388 1.00 0.00 N ATOM 2354 CD2 HIS B 80 13.917 -10.093 -6.622 1.00 0.00 C ATOM 2355 CE1 HIS B 80 12.206 -11.346 -6.108 1.00 0.00 C ATOM 2356 NE2 HIS B 80 13.286 -10.774 -5.626 1.00 0.00 N ATOM 0 H HIS B 80 13.653 -8.424 -11.221 1.00 0.00 H new ATOM 0 HA HIS B 80 11.366 -9.317 -9.809 1.00 0.00 H new ATOM 0 HB2 HIS B 80 13.455 -10.581 -9.838 1.00 0.00 H new ATOM 0 HB3 HIS B 80 14.352 -9.221 -9.192 1.00 0.00 H new ATOM 0 HD1 HIS B 80 11.380 -11.358 -8.015 1.00 0.00 H new ATOM 0 HD2 HIS B 80 14.829 -9.522 -6.531 1.00 0.00 H new ATOM 0 HE1 HIS B 80 11.508 -11.953 -5.551 1.00 0.00 H new ATOM 0 HE2 HIS B 80 13.602 -10.831 -4.658 1.00 0.00 H new ATOM 2365 N PHE B 81 12.559 -6.493 -8.894 1.00 0.00 N ATOM 2366 CA PHE B 81 12.415 -5.408 -7.938 1.00 0.00 C ATOM 2367 C PHE B 81 11.010 -4.870 -7.877 1.00 0.00 C ATOM 2368 O PHE B 81 10.600 -4.329 -6.852 1.00 0.00 O ATOM 2369 CB PHE B 81 13.447 -4.327 -8.158 1.00 0.00 C ATOM 2370 CG PHE B 81 14.818 -4.872 -7.997 1.00 0.00 C ATOM 2371 CD1 PHE B 81 15.289 -5.198 -6.743 1.00 0.00 C ATOM 2372 CD2 PHE B 81 15.624 -5.096 -9.092 1.00 0.00 C ATOM 2373 CE1 PHE B 81 16.535 -5.737 -6.587 1.00 0.00 C ATOM 2374 CE2 PHE B 81 16.880 -5.633 -8.938 1.00 0.00 C ATOM 2375 CZ PHE B 81 17.334 -5.955 -7.690 1.00 0.00 C ATOM 0 H PHE B 81 13.094 -6.259 -9.730 1.00 0.00 H new ATOM 0 HA PHE B 81 12.610 -5.830 -6.952 1.00 0.00 H new ATOM 0 HB2 PHE B 81 13.333 -3.905 -9.157 1.00 0.00 H new ATOM 0 HB3 PHE B 81 13.287 -3.515 -7.449 1.00 0.00 H new ATOM 0 HD1 PHE B 81 14.668 -5.026 -5.876 1.00 0.00 H new ATOM 0 HD2 PHE B 81 15.266 -4.847 -10.080 1.00 0.00 H new ATOM 0 HE1 PHE B 81 16.894 -5.992 -5.601 1.00 0.00 H new ATOM 0 HE2 PHE B 81 17.507 -5.800 -9.802 1.00 0.00 H new ATOM 0 HZ PHE B 81 18.319 -6.380 -7.567 1.00 0.00 H new ATOM 2385 N LYS B 82 10.257 -5.057 -8.951 1.00 0.00 N ATOM 2386 CA LYS B 82 8.857 -4.693 -8.943 1.00 0.00 C ATOM 2387 C LYS B 82 8.125 -5.640 -8.005 1.00 0.00 C ATOM 2388 O LYS B 82 7.340 -5.215 -7.180 1.00 0.00 O ATOM 2389 CB LYS B 82 8.252 -4.790 -10.345 1.00 0.00 C ATOM 2390 CG LYS B 82 6.776 -4.389 -10.408 1.00 0.00 C ATOM 2391 CD LYS B 82 6.170 -4.628 -11.788 1.00 0.00 C ATOM 2392 CE LYS B 82 6.827 -3.783 -12.867 1.00 0.00 C ATOM 2393 NZ LYS B 82 6.619 -2.344 -12.655 1.00 0.00 N ATOM 0 H LYS B 82 10.592 -5.455 -9.828 1.00 0.00 H new ATOM 0 HA LYS B 82 8.757 -3.661 -8.607 1.00 0.00 H new ATOM 0 HB2 LYS B 82 8.822 -4.153 -11.022 1.00 0.00 H new ATOM 0 HB3 LYS B 82 8.357 -5.813 -10.706 1.00 0.00 H new ATOM 0 HG2 LYS B 82 6.216 -4.956 -9.664 1.00 0.00 H new ATOM 0 HG3 LYS B 82 6.676 -3.335 -10.147 1.00 0.00 H new ATOM 0 HD2 LYS B 82 6.268 -5.682 -12.047 1.00 0.00 H new ATOM 0 HD3 LYS B 82 5.103 -4.406 -11.756 1.00 0.00 H new ATOM 0 HE2 LYS B 82 7.896 -3.994 -12.889 1.00 0.00 H new ATOM 0 HE3 LYS B 82 6.426 -4.066 -13.840 1.00 0.00 H new ATOM 0 HZ1 LYS B 82 7.128 -1.808 -13.387 1.00 0.00 H new ATOM 0 HZ2 LYS B 82 5.603 -2.128 -12.711 1.00 0.00 H new ATOM 0 HZ3 LYS B 82 6.979 -2.076 -11.717 1.00 0.00 H new ATOM 2407 N GLU B 83 8.452 -6.928 -8.124 1.00 0.00 N ATOM 2408 CA GLU B 83 7.859 -7.987 -7.311 1.00 0.00 C ATOM 2409 C GLU B 83 8.243 -7.759 -5.860 1.00 0.00 C ATOM 2410 O GLU B 83 7.404 -7.788 -4.963 1.00 0.00 O ATOM 2411 CB GLU B 83 8.429 -9.344 -7.729 1.00 0.00 C ATOM 2412 CG GLU B 83 8.462 -9.596 -9.223 1.00 0.00 C ATOM 2413 CD GLU B 83 9.060 -10.939 -9.550 1.00 0.00 C ATOM 2414 OE1 GLU B 83 8.349 -11.790 -10.120 1.00 0.00 O ATOM 2415 OE2 GLU B 83 10.236 -11.180 -9.205 1.00 0.00 O ATOM 0 H GLU B 83 9.142 -7.267 -8.794 1.00 0.00 H new ATOM 0 HA GLU B 83 6.777 -7.975 -7.443 1.00 0.00 H new ATOM 0 HB2 GLU B 83 9.443 -9.430 -7.339 1.00 0.00 H new ATOM 0 HB3 GLU B 83 7.839 -10.129 -7.257 1.00 0.00 H new ATOM 0 HG2 GLU B 83 7.450 -9.542 -9.623 1.00 0.00 H new ATOM 0 HG3 GLU B 83 9.040 -8.812 -9.711 1.00 0.00 H new ATOM 2422 N ALA B 84 9.532 -7.510 -5.670 1.00 0.00 N ATOM 2423 CA ALA B 84 10.143 -7.290 -4.378 1.00 0.00 C ATOM 2424 C ALA B 84 9.466 -6.155 -3.620 1.00 0.00 C ATOM 2425 O ALA B 84 8.932 -6.369 -2.534 1.00 0.00 O ATOM 2426 CB ALA B 84 11.634 -7.015 -4.553 1.00 0.00 C ATOM 0 H ALA B 84 10.198 -7.455 -6.441 1.00 0.00 H new ATOM 0 HA ALA B 84 10.014 -8.193 -3.781 1.00 0.00 H new ATOM 0 HB1 ALA B 84 12.091 -6.850 -3.577 1.00 0.00 H new ATOM 0 HB2 ALA B 84 12.108 -7.870 -5.035 1.00 0.00 H new ATOM 0 HB3 ALA B 84 11.770 -6.128 -5.172 1.00 0.00 H new ATOM 2432 N TRP B 85 9.452 -4.963 -4.202 1.00 0.00 N ATOM 2433 CA TRP B 85 8.840 -3.828 -3.552 1.00 0.00 C ATOM 2434 C TRP B 85 7.339 -3.966 -3.436 1.00 0.00 C ATOM 2435 O TRP B 85 6.764 -3.526 -2.447 1.00 0.00 O ATOM 2436 CB TRP B 85 9.263 -2.491 -4.163 1.00 0.00 C ATOM 2437 CG TRP B 85 10.649 -2.079 -3.747 1.00 0.00 C ATOM 2438 CD1 TRP B 85 11.811 -2.227 -4.449 1.00 0.00 C ATOM 2439 CD2 TRP B 85 11.008 -1.468 -2.500 1.00 0.00 C ATOM 2440 NE1 TRP B 85 12.867 -1.726 -3.717 1.00 0.00 N ATOM 2441 CE2 TRP B 85 12.395 -1.261 -2.517 1.00 0.00 C ATOM 2442 CE3 TRP B 85 10.283 -1.072 -1.369 1.00 0.00 C ATOM 2443 CZ2 TRP B 85 13.075 -0.674 -1.448 1.00 0.00 C ATOM 2444 CZ3 TRP B 85 10.960 -0.494 -0.313 1.00 0.00 C ATOM 2445 CH2 TRP B 85 12.342 -0.300 -0.359 1.00 0.00 C ATOM 0 H TRP B 85 9.856 -4.765 -5.117 1.00 0.00 H new ATOM 0 HA TRP B 85 9.226 -3.824 -2.533 1.00 0.00 H new ATOM 0 HB2 TRP B 85 9.220 -2.562 -5.250 1.00 0.00 H new ATOM 0 HB3 TRP B 85 8.553 -1.719 -3.866 1.00 0.00 H new ATOM 0 HD1 TRP B 85 11.891 -2.670 -5.431 1.00 0.00 H new ATOM 0 HE1 TRP B 85 13.841 -1.705 -4.019 1.00 0.00 H new ATOM 0 HE3 TRP B 85 9.214 -1.216 -1.323 1.00 0.00 H new ATOM 0 HZ2 TRP B 85 14.144 -0.521 -1.482 1.00 0.00 H new ATOM 0 HZ3 TRP B 85 10.410 -0.186 0.564 1.00 0.00 H new ATOM 0 HH2 TRP B 85 12.841 0.155 0.484 1.00 0.00 H new ATOM 2456 N LYS B 86 6.711 -4.618 -4.419 1.00 0.00 N ATOM 2457 CA LYS B 86 5.277 -4.907 -4.368 1.00 0.00 C ATOM 2458 C LYS B 86 5.008 -5.670 -3.103 1.00 0.00 C ATOM 2459 O LYS B 86 4.269 -5.226 -2.239 1.00 0.00 O ATOM 2460 CB LYS B 86 4.879 -5.793 -5.545 1.00 0.00 C ATOM 2461 CG LYS B 86 3.382 -6.016 -5.716 1.00 0.00 C ATOM 2462 CD LYS B 86 3.095 -6.870 -6.941 1.00 0.00 C ATOM 2463 CE LYS B 86 1.605 -7.149 -7.115 1.00 0.00 C ATOM 2464 NZ LYS B 86 1.037 -7.961 -6.014 1.00 0.00 N ATOM 0 H LYS B 86 7.176 -4.956 -5.262 1.00 0.00 H new ATOM 0 HA LYS B 86 4.713 -3.975 -4.406 1.00 0.00 H new ATOM 0 HB2 LYS B 86 5.270 -5.350 -6.461 1.00 0.00 H new ATOM 0 HB3 LYS B 86 5.363 -6.763 -5.428 1.00 0.00 H new ATOM 0 HG2 LYS B 86 2.979 -6.502 -4.827 1.00 0.00 H new ATOM 0 HG3 LYS B 86 2.876 -5.055 -5.811 1.00 0.00 H new ATOM 0 HD2 LYS B 86 3.474 -6.366 -7.830 1.00 0.00 H new ATOM 0 HD3 LYS B 86 3.632 -7.815 -6.857 1.00 0.00 H new ATOM 0 HE2 LYS B 86 1.068 -6.202 -7.176 1.00 0.00 H new ATOM 0 HE3 LYS B 86 1.446 -7.667 -8.061 1.00 0.00 H new ATOM 0 HZ1 LYS B 86 0.061 -8.233 -6.251 1.00 0.00 H new ATOM 0 HZ2 LYS B 86 1.612 -8.817 -5.881 1.00 0.00 H new ATOM 0 HZ3 LYS B 86 1.038 -7.404 -5.136 1.00 0.00 H new ATOM 2478 N HIS B 87 5.689 -6.787 -2.998 1.00 0.00 N ATOM 2479 CA HIS B 87 5.597 -7.703 -1.864 1.00 0.00 C ATOM 2480 C HIS B 87 5.966 -6.980 -0.546 1.00 0.00 C ATOM 2481 O HIS B 87 5.322 -7.189 0.471 1.00 0.00 O ATOM 2482 CB HIS B 87 6.524 -8.923 -2.110 1.00 0.00 C ATOM 2483 CG HIS B 87 6.363 -10.088 -1.156 1.00 0.00 C ATOM 2484 ND1 HIS B 87 6.986 -11.296 -1.348 1.00 0.00 N ATOM 2485 CD2 HIS B 87 5.657 -10.223 -0.010 1.00 0.00 C ATOM 2486 CE1 HIS B 87 6.671 -12.115 -0.372 1.00 0.00 C ATOM 2487 NE2 HIS B 87 5.867 -11.485 0.456 1.00 0.00 N ATOM 0 H HIS B 87 6.343 -7.101 -3.715 1.00 0.00 H new ATOM 0 HA HIS B 87 4.570 -8.055 -1.769 1.00 0.00 H new ATOM 0 HB2 HIS B 87 6.353 -9.284 -3.124 1.00 0.00 H new ATOM 0 HB3 HIS B 87 7.558 -8.582 -2.063 1.00 0.00 H new ATOM 0 HD2 HIS B 87 5.039 -9.467 0.451 1.00 0.00 H new ATOM 0 HE1 HIS B 87 7.014 -13.134 -0.267 1.00 0.00 H new ATOM 0 HE2 HIS B 87 5.466 -11.877 1.308 1.00 0.00 H new ATOM 2496 N ALA B 88 6.980 -6.134 -0.589 1.00 0.00 N ATOM 2497 CA ALA B 88 7.421 -5.372 0.584 1.00 0.00 C ATOM 2498 C ALA B 88 6.309 -4.454 1.102 1.00 0.00 C ATOM 2499 O ALA B 88 5.915 -4.535 2.268 1.00 0.00 O ATOM 2500 CB ALA B 88 8.671 -4.564 0.257 1.00 0.00 C ATOM 0 H ALA B 88 7.525 -5.951 -1.432 1.00 0.00 H new ATOM 0 HA ALA B 88 7.662 -6.084 1.374 1.00 0.00 H new ATOM 0 HB1 ALA B 88 8.984 -4.005 1.139 1.00 0.00 H new ATOM 0 HB2 ALA B 88 9.471 -5.239 -0.048 1.00 0.00 H new ATOM 0 HB3 ALA B 88 8.453 -3.870 -0.554 1.00 0.00 H new ATOM 2506 N ILE B 89 5.781 -3.619 0.216 1.00 0.00 N ATOM 2507 CA ILE B 89 4.703 -2.683 0.551 1.00 0.00 C ATOM 2508 C ILE B 89 3.456 -3.468 0.971 1.00 0.00 C ATOM 2509 O ILE B 89 2.763 -3.114 1.925 1.00 0.00 O ATOM 2510 CB ILE B 89 4.382 -1.771 -0.665 1.00 0.00 C ATOM 2511 CG1 ILE B 89 5.642 -0.991 -1.069 1.00 0.00 C ATOM 2512 CG2 ILE B 89 3.237 -0.807 -0.342 1.00 0.00 C ATOM 2513 CD1 ILE B 89 5.521 -0.252 -2.378 1.00 0.00 C ATOM 0 H ILE B 89 6.085 -3.568 -0.756 1.00 0.00 H new ATOM 0 HA ILE B 89 5.023 -2.050 1.379 1.00 0.00 H new ATOM 0 HB ILE B 89 4.064 -2.398 -1.498 1.00 0.00 H new ATOM 0 HG12 ILE B 89 5.880 -0.276 -0.282 1.00 0.00 H new ATOM 0 HG13 ILE B 89 6.480 -1.685 -1.133 1.00 0.00 H new ATOM 0 HG21 ILE B 89 3.033 -0.180 -1.210 1.00 0.00 H new ATOM 0 HG22 ILE B 89 2.343 -1.376 -0.087 1.00 0.00 H new ATOM 0 HG23 ILE B 89 3.519 -0.177 0.502 1.00 0.00 H new ATOM 0 HD11 ILE B 89 6.454 0.272 -2.588 1.00 0.00 H new ATOM 0 HD12 ILE B 89 5.315 -0.962 -3.179 1.00 0.00 H new ATOM 0 HD13 ILE B 89 4.706 0.469 -2.315 1.00 0.00 H new ATOM 2525 N GLN B 90 3.235 -4.555 0.274 1.00 0.00 N ATOM 2526 CA GLN B 90 2.154 -5.495 0.518 1.00 0.00 C ATOM 2527 C GLN B 90 2.211 -6.057 1.928 1.00 0.00 C ATOM 2528 O GLN B 90 1.188 -6.174 2.596 1.00 0.00 O ATOM 2529 CB GLN B 90 2.288 -6.620 -0.489 1.00 0.00 C ATOM 2530 CG GLN B 90 1.396 -7.821 -0.296 1.00 0.00 C ATOM 2531 CD GLN B 90 1.730 -8.917 -1.294 1.00 0.00 C ATOM 2532 OE1 GLN B 90 2.143 -8.538 -2.477 1.00 0.00 O flip ATOM 2533 NE2 GLN B 90 1.590 -10.099 -1.004 1.00 0.00 N flip ATOM 0 H GLN B 90 3.825 -4.826 -0.513 1.00 0.00 H new ATOM 0 HA GLN B 90 1.197 -4.983 0.412 1.00 0.00 H new ATOM 0 HB2 GLN B 90 2.096 -6.211 -1.481 1.00 0.00 H new ATOM 0 HB3 GLN B 90 3.323 -6.962 -0.480 1.00 0.00 H new ATOM 0 HG2 GLN B 90 1.509 -8.202 0.719 1.00 0.00 H new ATOM 0 HG3 GLN B 90 0.353 -7.526 -0.411 1.00 0.00 H new ATOM 0 HE21 GLN B 90 1.266 -10.361 -0.073 1.00 0.00 H new ATOM 0 HE22 GLN B 90 1.797 -10.821 -1.694 1.00 0.00 H new ATOM 2542 N LYS B 91 3.386 -6.397 2.370 1.00 0.00 N ATOM 2543 CA LYS B 91 3.552 -6.996 3.663 1.00 0.00 C ATOM 2544 C LYS B 91 3.549 -5.930 4.761 1.00 0.00 C ATOM 2545 O LYS B 91 2.895 -6.090 5.790 1.00 0.00 O ATOM 2546 CB LYS B 91 4.851 -7.817 3.697 1.00 0.00 C ATOM 2547 CG LYS B 91 4.974 -8.765 4.882 1.00 0.00 C ATOM 2548 CD LYS B 91 3.848 -9.783 4.867 1.00 0.00 C ATOM 2549 CE LYS B 91 4.012 -10.841 5.937 1.00 0.00 C ATOM 2550 NZ LYS B 91 2.865 -11.778 5.949 1.00 0.00 N ATOM 0 H LYS B 91 4.253 -6.268 1.848 1.00 0.00 H new ATOM 0 HA LYS B 91 2.712 -7.665 3.850 1.00 0.00 H new ATOM 0 HB2 LYS B 91 4.923 -8.397 2.777 1.00 0.00 H new ATOM 0 HB3 LYS B 91 5.698 -7.131 3.708 1.00 0.00 H new ATOM 0 HG2 LYS B 91 5.936 -9.277 4.847 1.00 0.00 H new ATOM 0 HG3 LYS B 91 4.948 -8.198 5.813 1.00 0.00 H new ATOM 0 HD2 LYS B 91 2.897 -9.270 5.010 1.00 0.00 H new ATOM 0 HD3 LYS B 91 3.808 -10.262 3.889 1.00 0.00 H new ATOM 0 HE2 LYS B 91 4.935 -11.395 5.765 1.00 0.00 H new ATOM 0 HE3 LYS B 91 4.104 -10.363 6.912 1.00 0.00 H new ATOM 0 HZ1 LYS B 91 3.007 -12.491 6.693 1.00 0.00 H new ATOM 0 HZ2 LYS B 91 1.988 -11.251 6.137 1.00 0.00 H new ATOM 0 HZ3 LYS B 91 2.793 -12.251 5.025 1.00 0.00 H new ATOM 2564 N ALA B 92 4.234 -4.831 4.516 1.00 0.00 N ATOM 2565 CA ALA B 92 4.374 -3.787 5.520 1.00 0.00 C ATOM 2566 C ALA B 92 3.133 -2.920 5.664 1.00 0.00 C ATOM 2567 O ALA B 92 2.595 -2.775 6.765 1.00 0.00 O ATOM 2568 CB ALA B 92 5.577 -2.916 5.210 1.00 0.00 C ATOM 0 H ALA B 92 4.703 -4.635 3.632 1.00 0.00 H new ATOM 0 HA ALA B 92 4.516 -4.296 6.473 1.00 0.00 H new ATOM 0 HB1 ALA B 92 5.669 -2.139 5.969 1.00 0.00 H new ATOM 0 HB2 ALA B 92 6.478 -3.529 5.206 1.00 0.00 H new ATOM 0 HB3 ALA B 92 5.449 -2.453 4.231 1.00 0.00 H new ATOM 2574 N LYS B 93 2.643 -2.382 4.567 1.00 0.00 N ATOM 2575 CA LYS B 93 1.530 -1.441 4.636 1.00 0.00 C ATOM 2576 C LYS B 93 0.216 -2.194 4.506 1.00 0.00 C ATOM 2577 O LYS B 93 -0.847 -1.643 4.767 1.00 0.00 O ATOM 2578 CB LYS B 93 1.610 -0.410 3.490 1.00 0.00 C ATOM 2579 CG LYS B 93 0.814 0.866 3.769 1.00 0.00 C ATOM 2580 CD LYS B 93 0.395 1.613 2.503 1.00 0.00 C ATOM 2581 CE LYS B 93 -0.599 0.786 1.698 1.00 0.00 C ATOM 2582 NZ LYS B 93 -1.366 1.593 0.730 1.00 0.00 N ATOM 0 H LYS B 93 2.988 -2.572 3.626 1.00 0.00 H new ATOM 0 HA LYS B 93 1.585 -0.924 5.594 1.00 0.00 H new ATOM 0 HB2 LYS B 93 2.654 -0.149 3.318 1.00 0.00 H new ATOM 0 HB3 LYS B 93 1.240 -0.867 2.572 1.00 0.00 H new ATOM 0 HG2 LYS B 93 -0.077 0.611 4.342 1.00 0.00 H new ATOM 0 HG3 LYS B 93 1.414 1.530 4.391 1.00 0.00 H new ATOM 0 HD2 LYS B 93 -0.052 2.570 2.770 1.00 0.00 H new ATOM 0 HD3 LYS B 93 1.273 1.830 1.895 1.00 0.00 H new ATOM 0 HE2 LYS B 93 -0.063 0.001 1.165 1.00 0.00 H new ATOM 0 HE3 LYS B 93 -1.291 0.293 2.381 1.00 0.00 H new ATOM 0 HZ1 LYS B 93 -2.061 0.988 0.248 1.00 0.00 H new ATOM 0 HZ2 LYS B 93 -1.861 2.358 1.231 1.00 0.00 H new ATOM 0 HZ3 LYS B 93 -0.717 2.002 0.028 1.00 0.00 H new ATOM 2596 N HIS B 94 0.325 -3.469 4.133 1.00 0.00 N ATOM 2597 CA HIS B 94 -0.815 -4.326 3.802 1.00 0.00 C ATOM 2598 C HIS B 94 -1.418 -3.898 2.495 1.00 0.00 C ATOM 2599 O HIS B 94 -2.151 -2.917 2.427 1.00 0.00 O ATOM 2600 CB HIS B 94 -1.918 -4.422 4.898 1.00 0.00 C ATOM 2601 CG HIS B 94 -1.551 -5.222 6.105 1.00 0.00 C ATOM 2602 ND1 HIS B 94 -2.276 -5.197 7.273 1.00 0.00 N ATOM 2603 CD2 HIS B 94 -0.555 -6.116 6.308 1.00 0.00 C ATOM 2604 CE1 HIS B 94 -1.745 -6.030 8.131 1.00 0.00 C ATOM 2605 NE2 HIS B 94 -0.701 -6.602 7.576 1.00 0.00 N ATOM 0 H HIS B 94 1.224 -3.944 4.051 1.00 0.00 H new ATOM 0 HA HIS B 94 -0.403 -5.333 3.728 1.00 0.00 H new ATOM 0 HB2 HIS B 94 -2.179 -3.413 5.217 1.00 0.00 H new ATOM 0 HB3 HIS B 94 -2.813 -4.857 4.453 1.00 0.00 H new ATOM 0 HD1 HIS B 94 -3.099 -4.619 7.444 1.00 0.00 H new ATOM 0 HD2 HIS B 94 0.212 -6.393 5.600 1.00 0.00 H new ATOM 0 HE1 HIS B 94 -2.106 -6.217 9.132 1.00 0.00 H new ATOM 2614 N MET B 95 -1.092 -4.603 1.438 1.00 0.00 N ATOM 2615 CA MET B 95 -1.692 -4.276 0.165 1.00 0.00 C ATOM 2616 C MET B 95 -2.313 -5.494 -0.561 1.00 0.00 C ATOM 2617 O MET B 95 -1.769 -5.985 -1.547 1.00 0.00 O ATOM 2618 CB MET B 95 -0.753 -3.474 -0.760 1.00 0.00 C ATOM 2619 CG MET B 95 -1.424 -2.980 -2.042 1.00 0.00 C ATOM 2620 SD MET B 95 -0.292 -2.095 -3.128 1.00 0.00 S ATOM 2621 CE MET B 95 -1.373 -1.737 -4.515 1.00 0.00 C ATOM 0 H MET B 95 -0.435 -5.384 1.429 1.00 0.00 H new ATOM 0 HA MET B 95 -2.524 -3.617 0.415 1.00 0.00 H new ATOM 0 HB2 MET B 95 -0.363 -2.617 -0.211 1.00 0.00 H new ATOM 0 HB3 MET B 95 0.101 -4.098 -1.025 1.00 0.00 H new ATOM 0 HG2 MET B 95 -1.843 -3.831 -2.578 1.00 0.00 H new ATOM 0 HG3 MET B 95 -2.256 -2.326 -1.782 1.00 0.00 H new ATOM 0 HE1 MET B 95 -0.818 -1.189 -5.277 1.00 0.00 H new ATOM 0 HE2 MET B 95 -1.744 -2.671 -4.937 1.00 0.00 H new ATOM 0 HE3 MET B 95 -2.214 -1.133 -4.174 1.00 0.00 H new ATOM 2631 N PRO B 96 -3.374 -6.085 0.021 1.00 0.00 N ATOM 2632 CA PRO B 96 -4.264 -7.004 -0.657 1.00 0.00 C ATOM 2633 C PRO B 96 -5.566 -6.238 -0.903 1.00 0.00 C ATOM 2634 O PRO B 96 -6.672 -6.741 -0.712 1.00 0.00 O ATOM 2635 CB PRO B 96 -4.469 -8.086 0.407 1.00 0.00 C ATOM 2636 CG PRO B 96 -4.207 -7.417 1.729 1.00 0.00 C ATOM 2637 CD PRO B 96 -3.751 -6.010 1.426 1.00 0.00 C ATOM 0 HA PRO B 96 -3.914 -7.410 -1.606 1.00 0.00 H new ATOM 0 HB2 PRO B 96 -5.481 -8.488 0.366 1.00 0.00 H new ATOM 0 HB3 PRO B 96 -3.788 -8.922 0.250 1.00 0.00 H new ATOM 0 HG2 PRO B 96 -5.108 -7.407 2.342 1.00 0.00 H new ATOM 0 HG3 PRO B 96 -3.445 -7.957 2.291 1.00 0.00 H new ATOM 0 HD2 PRO B 96 -4.546 -5.283 1.593 1.00 0.00 H new ATOM 0 HD3 PRO B 96 -2.911 -5.713 2.054 1.00 0.00 H new ATOM 2645 N ASP B 97 -5.366 -4.997 -1.294 1.00 0.00 N ATOM 2646 CA ASP B 97 -6.402 -3.999 -1.497 1.00 0.00 C ATOM 2647 C ASP B 97 -7.317 -4.387 -2.634 1.00 0.00 C ATOM 2648 O ASP B 97 -6.848 -4.882 -3.659 1.00 0.00 O ATOM 2649 CB ASP B 97 -5.722 -2.642 -1.790 1.00 0.00 C ATOM 2650 CG ASP B 97 -6.682 -1.486 -2.025 1.00 0.00 C ATOM 2651 OD1 ASP B 97 -7.269 -0.985 -1.054 1.00 0.00 O ATOM 2652 OD2 ASP B 97 -6.777 -0.989 -3.171 1.00 0.00 O ATOM 0 H ASP B 97 -4.432 -4.637 -1.489 1.00 0.00 H new ATOM 0 HA ASP B 97 -7.014 -3.925 -0.598 1.00 0.00 H new ATOM 0 HB2 ASP B 97 -5.070 -2.390 -0.954 1.00 0.00 H new ATOM 0 HB3 ASP B 97 -5.086 -2.752 -2.668 1.00 0.00 H new ATOM 2657 N PRO B 98 -8.645 -4.201 -2.460 1.00 0.00 N ATOM 2658 CA PRO B 98 -9.635 -4.473 -3.510 1.00 0.00 C ATOM 2659 C PRO B 98 -9.537 -3.442 -4.641 1.00 0.00 C ATOM 2660 O PRO B 98 -10.478 -2.683 -4.910 1.00 0.00 O ATOM 2661 CB PRO B 98 -10.980 -4.341 -2.780 1.00 0.00 C ATOM 2662 CG PRO B 98 -10.699 -3.447 -1.623 1.00 0.00 C ATOM 2663 CD PRO B 98 -9.284 -3.728 -1.213 1.00 0.00 C ATOM 0 HA PRO B 98 -9.493 -5.447 -3.978 1.00 0.00 H new ATOM 0 HB2 PRO B 98 -11.744 -3.916 -3.432 1.00 0.00 H new ATOM 0 HB3 PRO B 98 -11.347 -5.312 -2.449 1.00 0.00 H new ATOM 0 HG2 PRO B 98 -10.824 -2.400 -1.900 1.00 0.00 H new ATOM 0 HG3 PRO B 98 -11.389 -3.644 -0.802 1.00 0.00 H new ATOM 0 HD2 PRO B 98 -8.794 -2.834 -0.826 1.00 0.00 H new ATOM 0 HD3 PRO B 98 -9.237 -4.483 -0.428 1.00 0.00 H new ATOM 2671 N TRP B 99 -8.397 -3.429 -5.282 1.00 0.00 N ATOM 2672 CA TRP B 99 -8.088 -2.526 -6.342 1.00 0.00 C ATOM 2673 C TRP B 99 -8.788 -2.967 -7.623 1.00 0.00 C ATOM 2674 O TRP B 99 -8.216 -3.670 -8.471 1.00 0.00 O ATOM 2675 CB TRP B 99 -6.562 -2.423 -6.496 1.00 0.00 C ATOM 2676 CG TRP B 99 -6.089 -1.425 -7.499 1.00 0.00 C ATOM 2677 CD1 TRP B 99 -6.361 -0.092 -7.517 1.00 0.00 C ATOM 2678 CD2 TRP B 99 -5.216 -1.674 -8.602 1.00 0.00 C ATOM 2679 NE1 TRP B 99 -5.737 0.495 -8.582 1.00 0.00 N ATOM 2680 CE2 TRP B 99 -5.024 -0.453 -9.262 1.00 0.00 C ATOM 2681 CE3 TRP B 99 -4.587 -2.819 -9.103 1.00 0.00 C ATOM 2682 CZ2 TRP B 99 -4.226 -0.334 -10.393 1.00 0.00 C ATOM 2683 CZ3 TRP B 99 -3.795 -2.701 -10.225 1.00 0.00 C ATOM 2684 CH2 TRP B 99 -3.621 -1.467 -10.858 1.00 0.00 C ATOM 0 H TRP B 99 -7.636 -4.073 -5.067 1.00 0.00 H new ATOM 0 HA TRP B 99 -8.458 -1.527 -6.112 1.00 0.00 H new ATOM 0 HB2 TRP B 99 -6.132 -2.172 -5.527 1.00 0.00 H new ATOM 0 HB3 TRP B 99 -6.174 -3.403 -6.772 1.00 0.00 H new ATOM 0 HD1 TRP B 99 -6.978 0.425 -6.797 1.00 0.00 H new ATOM 0 HE1 TRP B 99 -5.794 1.483 -8.830 1.00 0.00 H new ATOM 0 HE3 TRP B 99 -4.719 -3.776 -8.620 1.00 0.00 H new ATOM 0 HZ2 TRP B 99 -4.089 0.617 -10.885 1.00 0.00 H new ATOM 0 HZ3 TRP B 99 -3.301 -3.576 -10.621 1.00 0.00 H new ATOM 0 HH2 TRP B 99 -2.994 -1.408 -11.735 1.00 0.00 H new ATOM 2695 N ALA B 100 -10.058 -2.628 -7.672 1.00 0.00 N ATOM 2696 CA ALA B 100 -10.951 -2.943 -8.754 1.00 0.00 C ATOM 2697 C ALA B 100 -10.523 -2.269 -10.044 1.00 0.00 C ATOM 2698 O ALA B 100 -10.087 -2.985 -10.980 1.00 0.00 O ATOM 2699 CB ALA B 100 -12.370 -2.570 -8.365 1.00 0.00 C ATOM 2700 OXT ALA B 100 -10.550 -1.020 -10.116 1.00 0.00 O ATOM 0 H ALA B 100 -10.511 -2.103 -6.924 1.00 0.00 H new ATOM 0 HA ALA B 100 -10.914 -4.016 -8.941 1.00 0.00 H new ATOM 0 HB1 ALA B 100 -13.047 -2.809 -9.185 1.00 0.00 H new ATOM 0 HB2 ALA B 100 -12.663 -3.131 -7.478 1.00 0.00 H new ATOM 0 HB3 ALA B 100 -12.420 -1.502 -8.152 1.00 0.00 H new TER 2706 ALA B 100 HETATM 2707 CA CA A 501 -20.286 -9.751 -2.734 1.00 0.00 CA HETATM 2708 CA CA A 502 -19.172 -1.804 6.320 1.00 0.00 CA