USER MOD reduce.3.24.130724 H: found=0, std=0, add=1584, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1581 hydrogens (12 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 136 LYS NZ :NH3+ -150:sc= 0.46 (180deg=0) USER MOD Set 1.2: A 146 GLN : amide:sc= -2.31! C(o=-1.9!,f=-6.8!) USER MOD Set 2.1: A 134 ASN : amide:sc= 0.87 K(o=1.8,f=0.2) USER MOD Set 2.2: A 145 ASN : amide:sc= 0.955 K(o=1.8,f=0.2) USER MOD Set 3.1: A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 3.2: A 46 MET CE :methyl -161:sc= -0.107 (180deg=-0.559) USER MOD Single : A 1 MET N :NH3+ -164:sc= 1.2 (180deg=0.631) USER MOD Single : A 3 THR OG1 : rot 180:sc= 0.0341 USER MOD Single : A 6 GLN : amide:sc= -1.52 K(o=-1.5,f=-0.57) USER MOD Single : A 8 LYS NZ :NH3+ -151:sc= -0.216 (180deg=-1.1) USER MOD Single : A 9 LYS NZ :NH3+ -171:sc= 1.21 (180deg=1.1) USER MOD Single : A 12 ASN : amide:sc= 1.16 K(o=1.2,f=-7.4!) USER MOD Single : A 13 HIS : no HD1:sc= -0.0115 X(o=-0.011,f=0) USER MOD Single : A 16 SER OG : rot 81:sc= 1.23 USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 23 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 25 GLN : amide:sc= 0 X(o=0,f=-0.098) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot 120:sc= -2.19! USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 ASN : amide:sc= -1.82! C(o=-1.8!,f=-7.6!) USER MOD Single : A 39 SER OG : rot 170:sc= 0.199 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 ASN : amide:sc= -0.107 K(o=-0.11,f=-0.95) USER MOD Single : A 59 LYS NZ :NH3+ 166:sc= -0.0496 (180deg=-0.261) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 HIS : no HD1:sc= -2.21 K(o=-2.2,f=-3.3) USER MOD Single : A 68 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 SER OG : rot 94:sc= 1.24 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 79 LYS NZ :NH3+ -156:sc= -0.0349 (180deg=-0.281) USER MOD Single : A 81 CYS SG : rot 180:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ -167:sc= 1.65 (180deg=0.551!) USER MOD Single : A 86 CYS SG : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 TYR OH : rot 44:sc= 0.391 USER MOD Single : A 98 GLN : amide:sc= 0 X(o=0,f=-0.36) USER MOD Single : A 103 THR OG1 : rot 180:sc= 0.0493 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 TYR OH : rot 15:sc= -0.934 USER MOD Single : A 115 HIS : no HE2:sc= -3.99! C(o=-4!,f=-7.1!) USER MOD Single : A 117 THR OG1 : rot -160:sc= 0.924 USER MOD Single : A 121 SER OG : rot 180:sc= -1.09 USER MOD Single : A 122 TYR OH : rot 180:sc= 0 USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 TYR OH : rot -60:sc= -1.93! USER MOD Single : A 138 ASN : amide:sc= -0.0521 X(o=-0.052,f=-0.15) USER MOD Single : A 139 GLN : amide:sc= 1.14 K(o=1.1,f=-0.13) USER MOD Single : A 140 TYR OH : rot 180:sc= 0 USER MOD Single : A 144 LYS NZ :NH3+ 169:sc=-0.00174 (180deg=-0.0953) USER MOD Single : A 147 THR OG1 : rot 180:sc= 0 USER MOD Single : A 152 LYS NZ :NH3+ -122:sc= 0.37 (180deg=0.224) USER MOD Single : A 154 THR OG1 : rot -33:sc= 0.192 USER MOD Single : A 155 THR OG1 : rot 180:sc= 0 USER MOD Single : A 157 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 166 THR OG1 : rot 180:sc= 0 USER MOD Single : A 167 TYR OH : rot 46:sc= 1.25 USER MOD Single : A 171 LYS NZ :NH3+ -179:sc= 1.24 (180deg=1.19) USER MOD Single : A 172 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 201 DGT O3' : rot -80:sc= -2.59! USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -12.303 -15.510 7.752 1.00 1.61 N ATOM 2 CA MET A 1 -11.192 -15.103 6.864 1.00 0.85 C ATOM 3 C MET A 1 -11.641 -15.104 5.414 1.00 0.76 C ATOM 4 O MET A 1 -12.756 -15.519 5.101 1.00 0.95 O ATOM 5 CB MET A 1 -9.991 -16.048 7.028 1.00 1.35 C ATOM 6 CG MET A 1 -10.209 -17.442 6.447 1.00 2.03 C ATOM 7 SD MET A 1 -11.554 -18.338 7.249 1.00 2.69 S ATOM 8 CE MET A 1 -11.622 -19.817 6.241 1.00 3.45 C ATOM 0 H1 MET A 1 -12.077 -15.249 8.733 1.00 1.61 H new ATOM 0 H2 MET A 1 -13.177 -15.028 7.458 1.00 1.61 H new ATOM 0 H3 MET A 1 -12.438 -16.539 7.690 1.00 1.61 H new ATOM 0 HA MET A 1 -10.891 -14.094 7.145 1.00 0.85 H new ATOM 0 HB2 MET A 1 -9.121 -15.599 6.549 1.00 1.35 H new ATOM 0 HB3 MET A 1 -9.758 -16.141 8.089 1.00 1.35 H new ATOM 0 HG2 MET A 1 -10.422 -17.356 5.381 1.00 2.03 H new ATOM 0 HG3 MET A 1 -9.288 -18.018 6.543 1.00 2.03 H new ATOM 0 HE1 MET A 1 -12.408 -20.474 6.612 1.00 3.45 H new ATOM 0 HE2 MET A 1 -11.835 -19.544 5.208 1.00 3.45 H new ATOM 0 HE3 MET A 1 -10.664 -20.334 6.289 1.00 3.45 H new ATOM 20 N LEU A 2 -10.765 -14.643 4.539 1.00 0.61 N ATOM 21 CA LEU A 2 -11.053 -14.590 3.118 1.00 0.57 C ATOM 22 C LEU A 2 -9.973 -15.337 2.338 1.00 0.52 C ATOM 23 O LEU A 2 -8.894 -15.612 2.863 1.00 0.60 O ATOM 24 CB LEU A 2 -11.132 -13.132 2.658 1.00 0.59 C ATOM 25 CG LEU A 2 -9.869 -12.305 2.915 1.00 0.64 C ATOM 26 CD1 LEU A 2 -9.179 -11.964 1.603 1.00 1.05 C ATOM 27 CD2 LEU A 2 -10.205 -11.038 3.685 1.00 0.96 C ATOM 0 H LEU A 2 -9.839 -14.297 4.792 1.00 0.61 H new ATOM 0 HA LEU A 2 -12.013 -15.070 2.929 1.00 0.57 H new ATOM 0 HB2 LEU A 2 -11.349 -13.115 1.590 1.00 0.59 H new ATOM 0 HB3 LEU A 2 -11.971 -12.652 3.162 1.00 0.59 H new ATOM 0 HG LEU A 2 -9.186 -12.902 3.519 1.00 0.64 H new ATOM 0 HD11 LEU A 2 -8.284 -11.376 1.805 1.00 1.05 H new ATOM 0 HD12 LEU A 2 -8.901 -12.884 1.088 1.00 1.05 H new ATOM 0 HD13 LEU A 2 -9.857 -11.387 0.974 1.00 1.05 H new ATOM 0 HD21 LEU A 2 -9.294 -10.465 3.857 1.00 0.96 H new ATOM 0 HD22 LEU A 2 -10.908 -10.437 3.108 1.00 0.96 H new ATOM 0 HD23 LEU A 2 -10.654 -11.302 4.642 1.00 0.96 H new ATOM 39 N THR A 3 -10.268 -15.670 1.095 1.00 0.46 N ATOM 40 CA THR A 3 -9.321 -16.375 0.247 1.00 0.42 C ATOM 41 C THR A 3 -8.731 -15.431 -0.791 1.00 0.39 C ATOM 42 O THR A 3 -9.185 -14.291 -0.922 1.00 0.40 O ATOM 43 CB THR A 3 -10.010 -17.546 -0.475 1.00 0.44 C ATOM 44 OG1 THR A 3 -11.433 -17.369 -0.427 1.00 0.51 O ATOM 45 CG2 THR A 3 -9.636 -18.877 0.158 1.00 0.52 C ATOM 0 H THR A 3 -11.161 -15.463 0.647 1.00 0.46 H new ATOM 0 HA THR A 3 -8.524 -16.760 0.883 1.00 0.42 H new ATOM 0 HB THR A 3 -9.674 -17.556 -1.512 1.00 0.44 H new ATOM 0 HG1 THR A 3 -11.871 -18.114 -0.889 1.00 0.51 H new ATOM 0 HG21 THR A 3 -10.138 -19.686 -0.373 1.00 0.52 H new ATOM 0 HG22 THR A 3 -8.557 -19.018 0.098 1.00 0.52 H new ATOM 0 HG23 THR A 3 -9.945 -18.882 1.203 1.00 0.52 H new ATOM 53 N LEU A 4 -7.709 -15.893 -1.513 1.00 0.39 N ATOM 54 CA LEU A 4 -7.079 -15.092 -2.560 1.00 0.40 C ATOM 55 C LEU A 4 -8.123 -14.570 -3.544 1.00 0.39 C ATOM 56 O LEU A 4 -8.091 -13.403 -3.944 1.00 0.41 O ATOM 57 CB LEU A 4 -6.041 -15.934 -3.306 1.00 0.43 C ATOM 58 CG LEU A 4 -5.300 -15.214 -4.436 1.00 0.63 C ATOM 59 CD1 LEU A 4 -4.351 -14.169 -3.874 1.00 1.14 C ATOM 60 CD2 LEU A 4 -4.548 -16.217 -5.298 1.00 1.69 C ATOM 0 H LEU A 4 -7.300 -16.820 -1.390 1.00 0.39 H new ATOM 0 HA LEU A 4 -6.587 -14.240 -2.092 1.00 0.40 H new ATOM 0 HB2 LEU A 4 -5.307 -16.296 -2.586 1.00 0.43 H new ATOM 0 HB3 LEU A 4 -6.539 -16.810 -3.722 1.00 0.43 H new ATOM 0 HG LEU A 4 -6.033 -14.704 -5.061 1.00 0.63 H new ATOM 0 HD11 LEU A 4 -3.834 -13.669 -4.693 1.00 1.14 H new ATOM 0 HD12 LEU A 4 -4.917 -13.435 -3.300 1.00 1.14 H new ATOM 0 HD13 LEU A 4 -3.620 -14.652 -3.225 1.00 1.14 H new ATOM 0 HD21 LEU A 4 -4.026 -15.691 -6.097 1.00 1.69 H new ATOM 0 HD22 LEU A 4 -3.825 -16.754 -4.684 1.00 1.69 H new ATOM 0 HD23 LEU A 4 -5.254 -16.926 -5.731 1.00 1.69 H new ATOM 72 N ILE A 5 -9.060 -15.440 -3.916 1.00 0.40 N ATOM 73 CA ILE A 5 -10.123 -15.071 -4.841 1.00 0.42 C ATOM 74 C ILE A 5 -10.975 -13.946 -4.257 1.00 0.40 C ATOM 75 O ILE A 5 -11.397 -13.031 -4.972 1.00 0.40 O ATOM 76 CB ILE A 5 -11.024 -16.277 -5.192 1.00 0.48 C ATOM 77 CG1 ILE A 5 -11.499 -16.991 -3.925 1.00 1.32 C ATOM 78 CG2 ILE A 5 -10.282 -17.249 -6.104 1.00 1.22 C ATOM 79 CD1 ILE A 5 -12.976 -17.325 -3.937 1.00 1.94 C ATOM 0 H ILE A 5 -9.102 -16.405 -3.589 1.00 0.40 H new ATOM 0 HA ILE A 5 -9.646 -14.726 -5.758 1.00 0.42 H new ATOM 0 HB ILE A 5 -11.901 -15.903 -5.721 1.00 0.48 H new ATOM 0 HG12 ILE A 5 -10.928 -17.911 -3.800 1.00 1.32 H new ATOM 0 HG13 ILE A 5 -11.284 -16.362 -3.061 1.00 1.32 H new ATOM 0 HG21 ILE A 5 -10.931 -18.092 -6.341 1.00 1.22 H new ATOM 0 HG22 ILE A 5 -9.998 -16.739 -7.025 1.00 1.22 H new ATOM 0 HG23 ILE A 5 -9.387 -17.611 -5.598 1.00 1.22 H new ATOM 0 HD11 ILE A 5 -13.242 -17.830 -3.008 1.00 1.94 H new ATOM 0 HD12 ILE A 5 -13.556 -16.407 -4.030 1.00 1.94 H new ATOM 0 HD13 ILE A 5 -13.194 -17.979 -4.781 1.00 1.94 H new ATOM 91 N GLN A 6 -11.214 -14.012 -2.951 1.00 0.38 N ATOM 92 CA GLN A 6 -11.999 -12.998 -2.270 1.00 0.38 C ATOM 93 C GLN A 6 -11.292 -11.659 -2.319 1.00 0.36 C ATOM 94 O GLN A 6 -11.911 -10.644 -2.617 1.00 0.37 O ATOM 95 CB GLN A 6 -12.256 -13.393 -0.819 1.00 0.40 C ATOM 96 CG GLN A 6 -13.585 -14.094 -0.605 1.00 0.77 C ATOM 97 CD GLN A 6 -14.756 -13.358 -1.235 1.00 0.81 C ATOM 98 OE1 GLN A 6 -15.693 -13.972 -1.741 1.00 1.38 O ATOM 99 NE2 GLN A 6 -14.719 -12.034 -1.200 1.00 0.99 N ATOM 0 H GLN A 6 -10.873 -14.759 -2.346 1.00 0.38 H new ATOM 0 HA GLN A 6 -12.957 -12.914 -2.783 1.00 0.38 H new ATOM 0 HB2 GLN A 6 -11.452 -14.047 -0.482 1.00 0.40 H new ATOM 0 HB3 GLN A 6 -12.222 -12.499 -0.197 1.00 0.40 H new ATOM 0 HG2 GLN A 6 -13.530 -15.100 -1.021 1.00 0.77 H new ATOM 0 HG3 GLN A 6 -13.764 -14.201 0.465 1.00 0.77 H new ATOM 0 HE21 GLN A 6 -13.925 -11.557 -0.772 1.00 0.99 H new ATOM 0 HE22 GLN A 6 -15.484 -11.492 -1.601 1.00 0.99 H new ATOM 108 N GLY A 7 -10.000 -11.666 -2.008 1.00 0.35 N ATOM 109 CA GLY A 7 -9.223 -10.441 -2.051 1.00 0.34 C ATOM 110 C GLY A 7 -9.342 -9.763 -3.403 1.00 0.33 C ATOM 111 O GLY A 7 -9.576 -8.552 -3.494 1.00 0.33 O ATOM 0 H GLY A 7 -9.478 -12.496 -1.728 1.00 0.35 H new ATOM 0 HA2 GLY A 7 -9.565 -9.763 -1.270 1.00 0.34 H new ATOM 0 HA3 GLY A 7 -8.176 -10.664 -1.844 1.00 0.34 H new ATOM 115 N LYS A 8 -9.230 -10.565 -4.453 1.00 0.35 N ATOM 116 CA LYS A 8 -9.332 -10.062 -5.811 1.00 0.38 C ATOM 117 C LYS A 8 -10.731 -9.514 -6.064 1.00 0.38 C ATOM 118 O LYS A 8 -10.891 -8.457 -6.677 1.00 0.38 O ATOM 119 CB LYS A 8 -9.003 -11.171 -6.816 1.00 0.44 C ATOM 120 CG LYS A 8 -9.282 -10.800 -8.270 1.00 0.76 C ATOM 121 CD LYS A 8 -8.577 -9.513 -8.674 1.00 0.74 C ATOM 122 CE LYS A 8 -8.092 -9.571 -10.114 1.00 1.24 C ATOM 123 NZ LYS A 8 -7.179 -10.721 -10.344 1.00 1.81 N ATOM 0 H LYS A 8 -9.068 -11.570 -4.387 1.00 0.35 H new ATOM 0 HA LYS A 8 -8.612 -9.254 -5.940 1.00 0.38 H new ATOM 0 HB2 LYS A 8 -7.951 -11.436 -6.716 1.00 0.44 H new ATOM 0 HB3 LYS A 8 -9.581 -12.059 -6.562 1.00 0.44 H new ATOM 0 HG2 LYS A 8 -8.956 -11.612 -8.920 1.00 0.76 H new ATOM 0 HG3 LYS A 8 -10.356 -10.686 -8.416 1.00 0.76 H new ATOM 0 HD2 LYS A 8 -9.258 -8.670 -8.552 1.00 0.74 H new ATOM 0 HD3 LYS A 8 -7.730 -9.337 -8.011 1.00 0.74 H new ATOM 0 HE2 LYS A 8 -8.949 -9.648 -10.783 1.00 1.24 H new ATOM 0 HE3 LYS A 8 -7.577 -8.643 -10.361 1.00 1.24 H new ATOM 0 HZ1 LYS A 8 -6.510 -10.486 -11.105 1.00 1.81 H new ATOM 0 HZ2 LYS A 8 -6.652 -10.926 -9.471 1.00 1.81 H new ATOM 0 HZ3 LYS A 8 -7.735 -11.556 -10.617 1.00 1.81 H new ATOM 137 N LYS A 9 -11.742 -10.218 -5.564 1.00 0.41 N ATOM 138 CA LYS A 9 -13.123 -9.795 -5.748 1.00 0.46 C ATOM 139 C LYS A 9 -13.401 -8.496 -5.002 1.00 0.43 C ATOM 140 O LYS A 9 -13.913 -7.535 -5.579 1.00 0.44 O ATOM 141 CB LYS A 9 -14.105 -10.871 -5.270 1.00 0.53 C ATOM 142 CG LYS A 9 -15.536 -10.359 -5.147 1.00 0.74 C ATOM 143 CD LYS A 9 -16.441 -11.333 -4.410 1.00 0.87 C ATOM 144 CE LYS A 9 -17.763 -10.672 -4.046 1.00 1.29 C ATOM 145 NZ LYS A 9 -18.792 -11.656 -3.617 1.00 1.69 N ATOM 0 H LYS A 9 -11.630 -11.080 -5.031 1.00 0.41 H new ATOM 0 HA LYS A 9 -13.268 -9.634 -6.816 1.00 0.46 H new ATOM 0 HB2 LYS A 9 -14.084 -11.710 -5.966 1.00 0.53 H new ATOM 0 HB3 LYS A 9 -13.776 -11.251 -4.303 1.00 0.53 H new ATOM 0 HG2 LYS A 9 -15.533 -9.403 -4.623 1.00 0.74 H new ATOM 0 HG3 LYS A 9 -15.940 -10.175 -6.143 1.00 0.74 H new ATOM 0 HD2 LYS A 9 -16.626 -12.208 -5.034 1.00 0.87 H new ATOM 0 HD3 LYS A 9 -15.944 -11.685 -3.506 1.00 0.87 H new ATOM 0 HE2 LYS A 9 -17.597 -9.952 -3.245 1.00 1.29 H new ATOM 0 HE3 LYS A 9 -18.135 -10.113 -4.905 1.00 1.29 H new ATOM 0 HZ1 LYS A 9 -19.712 -11.179 -3.527 1.00 1.69 H new ATOM 0 HZ2 LYS A 9 -18.863 -12.415 -4.324 1.00 1.69 H new ATOM 0 HZ3 LYS A 9 -18.522 -12.063 -2.699 1.00 1.69 H new ATOM 159 N ILE A 10 -13.053 -8.470 -3.721 1.00 0.41 N ATOM 160 CA ILE A 10 -13.301 -7.297 -2.899 1.00 0.42 C ATOM 161 C ILE A 10 -12.532 -6.088 -3.410 1.00 0.35 C ATOM 162 O ILE A 10 -13.089 -5.002 -3.489 1.00 0.38 O ATOM 163 CB ILE A 10 -13.013 -7.535 -1.394 1.00 0.46 C ATOM 164 CG1 ILE A 10 -11.521 -7.699 -1.107 1.00 0.45 C ATOM 165 CG2 ILE A 10 -13.772 -8.754 -0.907 1.00 0.57 C ATOM 166 CD1 ILE A 10 -11.217 -7.906 0.360 1.00 0.58 C ATOM 0 H ILE A 10 -12.601 -9.244 -3.233 1.00 0.41 H new ATOM 0 HA ILE A 10 -14.368 -7.092 -2.985 1.00 0.42 H new ATOM 0 HB ILE A 10 -13.352 -6.650 -0.855 1.00 0.46 H new ATOM 0 HG12 ILE A 10 -11.139 -8.548 -1.674 1.00 0.45 H new ATOM 0 HG13 ILE A 10 -10.990 -6.815 -1.461 1.00 0.45 H new ATOM 0 HG21 ILE A 10 -13.564 -8.914 0.151 1.00 0.57 H new ATOM 0 HG22 ILE A 10 -14.841 -8.596 -1.047 1.00 0.57 H new ATOM 0 HG23 ILE A 10 -13.457 -9.630 -1.475 1.00 0.57 H new ATOM 0 HD11 ILE A 10 -10.141 -8.016 0.497 1.00 0.58 H new ATOM 0 HD12 ILE A 10 -11.569 -7.046 0.929 1.00 0.58 H new ATOM 0 HD13 ILE A 10 -11.721 -8.806 0.713 1.00 0.58 H new ATOM 178 N VAL A 11 -11.273 -6.278 -3.793 1.00 0.31 N ATOM 179 CA VAL A 11 -10.482 -5.170 -4.313 1.00 0.30 C ATOM 180 C VAL A 11 -11.104 -4.644 -5.596 1.00 0.29 C ATOM 181 O VAL A 11 -11.320 -3.442 -5.736 1.00 0.30 O ATOM 182 CB VAL A 11 -9.013 -5.578 -4.573 1.00 0.35 C ATOM 183 CG1 VAL A 11 -8.318 -4.589 -5.499 1.00 0.39 C ATOM 184 CG2 VAL A 11 -8.261 -5.688 -3.260 1.00 0.41 C ATOM 0 H VAL A 11 -10.786 -7.173 -3.754 1.00 0.31 H new ATOM 0 HA VAL A 11 -10.479 -4.386 -3.555 1.00 0.30 H new ATOM 0 HB VAL A 11 -9.016 -6.551 -5.065 1.00 0.35 H new ATOM 0 HG11 VAL A 11 -7.287 -4.905 -5.661 1.00 0.39 H new ATOM 0 HG12 VAL A 11 -8.842 -4.555 -6.454 1.00 0.39 H new ATOM 0 HG13 VAL A 11 -8.327 -3.598 -5.045 1.00 0.39 H new ATOM 0 HG21 VAL A 11 -7.228 -5.976 -3.455 1.00 0.41 H new ATOM 0 HG22 VAL A 11 -8.279 -4.726 -2.749 1.00 0.41 H new ATOM 0 HG23 VAL A 11 -8.735 -6.442 -2.631 1.00 0.41 H new ATOM 194 N ASN A 12 -11.391 -5.552 -6.525 1.00 0.32 N ATOM 195 CA ASN A 12 -12.006 -5.190 -7.800 1.00 0.37 C ATOM 196 C ASN A 12 -13.272 -4.358 -7.578 1.00 0.36 C ATOM 197 O ASN A 12 -13.444 -3.281 -8.165 1.00 0.38 O ATOM 198 CB ASN A 12 -12.338 -6.453 -8.601 1.00 0.44 C ATOM 199 CG ASN A 12 -12.982 -6.143 -9.938 1.00 0.59 C ATOM 200 OD1 ASN A 12 -12.690 -5.122 -10.563 1.00 1.02 O ATOM 201 ND2 ASN A 12 -13.863 -7.024 -10.383 1.00 1.32 N ATOM 0 H ASN A 12 -11.206 -6.549 -6.418 1.00 0.32 H new ATOM 0 HA ASN A 12 -11.295 -4.587 -8.365 1.00 0.37 H new ATOM 0 HB2 ASN A 12 -11.425 -7.025 -8.766 1.00 0.44 H new ATOM 0 HB3 ASN A 12 -13.008 -7.084 -8.017 1.00 0.44 H new ATOM 0 HD21 ASN A 12 -14.330 -6.871 -11.277 1.00 1.32 H new ATOM 0 HD22 ASN A 12 -14.075 -7.856 -9.833 1.00 1.32 H new ATOM 208 N HIS A 13 -14.136 -4.847 -6.703 1.00 0.35 N ATOM 209 CA HIS A 13 -15.382 -4.161 -6.390 1.00 0.38 C ATOM 210 C HIS A 13 -15.103 -2.830 -5.696 1.00 0.33 C ATOM 211 O HIS A 13 -15.637 -1.780 -6.081 1.00 0.35 O ATOM 212 CB HIS A 13 -16.259 -5.042 -5.489 1.00 0.44 C ATOM 213 CG HIS A 13 -16.962 -6.154 -6.210 1.00 0.64 C ATOM 214 ND1 HIS A 13 -18.273 -6.462 -5.941 1.00 1.05 N ATOM 215 CD2 HIS A 13 -16.498 -7.001 -7.163 1.00 1.07 C ATOM 216 CE1 HIS A 13 -18.576 -7.479 -6.729 1.00 1.21 C ATOM 217 NE2 HIS A 13 -17.532 -7.842 -7.486 1.00 1.22 N ATOM 0 H HIS A 13 -13.997 -5.720 -6.194 1.00 0.35 H new ATOM 0 HA HIS A 13 -15.910 -3.965 -7.324 1.00 0.38 H new ATOM 0 HB2 HIS A 13 -15.637 -5.470 -4.703 1.00 0.44 H new ATOM 0 HB3 HIS A 13 -17.003 -4.414 -5.000 1.00 0.44 H new ATOM 0 HD2 HIS A 13 -15.504 -7.011 -7.586 1.00 1.07 H new ATOM 0 HE1 HIS A 13 -19.544 -7.957 -6.759 1.00 1.21 H new ATOM 0 HE2 HIS A 13 -17.510 -8.598 -8.170 1.00 1.22 H new ATOM 225 N LEU A 14 -14.229 -2.889 -4.704 1.00 0.30 N ATOM 226 CA LEU A 14 -13.849 -1.728 -3.911 1.00 0.31 C ATOM 227 C LEU A 14 -13.287 -0.607 -4.771 1.00 0.31 C ATOM 228 O LEU A 14 -13.711 0.533 -4.651 1.00 0.34 O ATOM 229 CB LEU A 14 -12.822 -2.140 -2.847 1.00 0.35 C ATOM 230 CG LEU A 14 -13.398 -2.666 -1.525 1.00 0.49 C ATOM 231 CD1 LEU A 14 -12.700 -2.010 -0.347 1.00 0.89 C ATOM 232 CD2 LEU A 14 -14.902 -2.444 -1.438 1.00 0.54 C ATOM 0 H LEU A 14 -13.759 -3.750 -4.423 1.00 0.30 H new ATOM 0 HA LEU A 14 -14.749 -1.348 -3.428 1.00 0.31 H new ATOM 0 HB2 LEU A 14 -12.177 -2.910 -3.271 1.00 0.35 H new ATOM 0 HB3 LEU A 14 -12.190 -1.280 -2.628 1.00 0.35 H new ATOM 0 HG LEU A 14 -13.220 -3.741 -1.492 1.00 0.49 H new ATOM 0 HD11 LEU A 14 -13.119 -2.393 0.584 1.00 0.89 H new ATOM 0 HD12 LEU A 14 -11.634 -2.235 -0.384 1.00 0.89 H new ATOM 0 HD13 LEU A 14 -12.845 -0.931 -0.393 1.00 0.89 H new ATOM 0 HD21 LEU A 14 -15.272 -2.830 -0.488 1.00 0.54 H new ATOM 0 HD22 LEU A 14 -15.117 -1.378 -1.505 1.00 0.54 H new ATOM 0 HD23 LEU A 14 -15.395 -2.966 -2.258 1.00 0.54 H new ATOM 244 N ARG A 15 -12.362 -0.937 -5.662 1.00 0.32 N ATOM 245 CA ARG A 15 -11.744 0.073 -6.514 1.00 0.37 C ATOM 246 C ARG A 15 -12.751 0.661 -7.497 1.00 0.38 C ATOM 247 O ARG A 15 -12.692 1.844 -7.817 1.00 0.45 O ATOM 248 CB ARG A 15 -10.526 -0.500 -7.255 1.00 0.43 C ATOM 249 CG ARG A 15 -10.829 -1.704 -8.136 1.00 1.21 C ATOM 250 CD ARG A 15 -10.970 -1.313 -9.596 1.00 1.96 C ATOM 251 NE ARG A 15 -11.323 -2.451 -10.446 1.00 2.47 N ATOM 252 CZ ARG A 15 -10.921 -2.588 -11.708 1.00 3.14 C ATOM 253 NH1 ARG A 15 -10.092 -1.700 -12.245 1.00 3.59 N ATOM 254 NH2 ARG A 15 -11.328 -3.628 -12.424 1.00 3.77 N ATOM 0 H ARG A 15 -12.024 -1.887 -5.814 1.00 0.32 H new ATOM 0 HA ARG A 15 -11.398 0.881 -5.869 1.00 0.37 H new ATOM 0 HB2 ARG A 15 -10.091 0.285 -7.873 1.00 0.43 H new ATOM 0 HB3 ARG A 15 -9.771 -0.784 -6.521 1.00 0.43 H new ATOM 0 HG2 ARG A 15 -10.032 -2.440 -8.032 1.00 1.21 H new ATOM 0 HG3 ARG A 15 -11.749 -2.180 -7.797 1.00 1.21 H new ATOM 0 HD2 ARG A 15 -11.734 -0.541 -9.691 1.00 1.96 H new ATOM 0 HD3 ARG A 15 -10.033 -0.879 -9.945 1.00 1.96 H new ATOM 0 HE ARG A 15 -11.912 -3.183 -10.048 1.00 2.47 H new ATOM 0 HH11 ARG A 15 -9.761 -0.910 -11.690 1.00 3.59 H new ATOM 0 HH12 ARG A 15 -9.786 -1.808 -13.212 1.00 3.59 H new ATOM 0 HH21 ARG A 15 -11.949 -4.322 -12.008 1.00 3.77 H new ATOM 0 HH22 ARG A 15 -11.020 -3.733 -13.391 1.00 3.77 H new ATOM 268 N SER A 16 -13.669 -0.162 -7.987 1.00 0.36 N ATOM 269 CA SER A 16 -14.682 0.309 -8.927 1.00 0.41 C ATOM 270 C SER A 16 -15.777 1.115 -8.226 1.00 0.38 C ATOM 271 O SER A 16 -16.560 1.805 -8.876 1.00 0.41 O ATOM 272 CB SER A 16 -15.319 -0.885 -9.643 1.00 0.47 C ATOM 273 OG SER A 16 -14.330 -1.762 -10.163 1.00 1.10 O ATOM 0 H SER A 16 -13.735 -1.152 -7.752 1.00 0.36 H new ATOM 0 HA SER A 16 -14.186 0.961 -9.646 1.00 0.41 H new ATOM 0 HB2 SER A 16 -15.961 -1.428 -8.949 1.00 0.47 H new ATOM 0 HB3 SER A 16 -15.955 -0.529 -10.454 1.00 0.47 H new ATOM 0 HG SER A 16 -13.998 -2.343 -9.447 1.00 1.10 H new ATOM 279 N ARG A 17 -15.833 1.019 -6.905 1.00 0.34 N ATOM 280 CA ARG A 17 -16.869 1.702 -6.134 1.00 0.34 C ATOM 281 C ARG A 17 -16.339 2.703 -5.095 1.00 0.30 C ATOM 282 O ARG A 17 -17.128 3.231 -4.310 1.00 0.32 O ATOM 283 CB ARG A 17 -17.774 0.673 -5.463 1.00 0.40 C ATOM 284 CG ARG A 17 -18.576 -0.138 -6.465 1.00 0.60 C ATOM 285 CD ARG A 17 -19.310 -1.289 -5.806 1.00 1.17 C ATOM 286 NE ARG A 17 -20.056 -2.087 -6.783 1.00 1.61 N ATOM 287 CZ ARG A 17 -19.495 -2.881 -7.694 1.00 2.24 C ATOM 288 NH1 ARG A 17 -18.172 -3.021 -7.749 1.00 2.71 N ATOM 289 NH2 ARG A 17 -20.261 -3.547 -8.547 1.00 2.95 N ATOM 0 H ARG A 17 -15.176 0.477 -6.344 1.00 0.34 H new ATOM 0 HA ARG A 17 -17.431 2.300 -6.851 1.00 0.34 H new ATOM 0 HB2 ARG A 17 -17.167 -0.001 -4.858 1.00 0.40 H new ATOM 0 HB3 ARG A 17 -18.457 1.183 -4.784 1.00 0.40 H new ATOM 0 HG2 ARG A 17 -19.295 0.512 -6.965 1.00 0.60 H new ATOM 0 HG3 ARG A 17 -17.909 -0.527 -7.234 1.00 0.60 H new ATOM 0 HD2 ARG A 17 -18.595 -1.926 -5.286 1.00 1.17 H new ATOM 0 HD3 ARG A 17 -19.996 -0.900 -5.054 1.00 1.17 H new ATOM 0 HE ARG A 17 -21.074 -2.031 -6.764 1.00 1.61 H new ATOM 0 HH11 ARG A 17 -17.578 -2.518 -7.090 1.00 2.71 H new ATOM 0 HH12 ARG A 17 -17.752 -3.631 -8.450 1.00 2.71 H new ATOM 0 HH21 ARG A 17 -21.276 -3.450 -8.504 1.00 2.95 H new ATOM 0 HH22 ARG A 17 -19.836 -4.156 -9.246 1.00 2.95 H new ATOM 303 N LEU A 18 -15.033 2.968 -5.083 1.00 0.27 N ATOM 304 CA LEU A 18 -14.484 3.878 -4.083 1.00 0.26 C ATOM 305 C LEU A 18 -14.804 5.324 -4.430 1.00 0.24 C ATOM 306 O LEU A 18 -14.725 5.730 -5.591 1.00 0.25 O ATOM 307 CB LEU A 18 -12.971 3.712 -3.957 1.00 0.30 C ATOM 308 CG LEU A 18 -12.480 2.749 -2.880 1.00 0.40 C ATOM 309 CD1 LEU A 18 -10.974 2.588 -2.992 1.00 0.63 C ATOM 310 CD2 LEU A 18 -12.859 3.237 -1.485 1.00 0.49 C ATOM 0 H LEU A 18 -14.353 2.577 -5.735 1.00 0.27 H new ATOM 0 HA LEU A 18 -14.948 3.627 -3.129 1.00 0.26 H new ATOM 0 HB2 LEU A 18 -12.583 3.375 -4.918 1.00 0.30 H new ATOM 0 HB3 LEU A 18 -12.535 4.692 -3.763 1.00 0.30 H new ATOM 0 HG LEU A 18 -12.962 1.783 -3.034 1.00 0.40 H new ATOM 0 HD11 LEU A 18 -10.623 1.900 -2.223 1.00 0.63 H new ATOM 0 HD12 LEU A 18 -10.723 2.191 -3.976 1.00 0.63 H new ATOM 0 HD13 LEU A 18 -10.494 3.557 -2.858 1.00 0.63 H new ATOM 0 HD21 LEU A 18 -12.495 2.529 -0.740 1.00 0.49 H new ATOM 0 HD22 LEU A 18 -12.410 4.214 -1.307 1.00 0.49 H new ATOM 0 HD23 LEU A 18 -13.943 3.317 -1.410 1.00 0.49 H new ATOM 322 N ALA A 19 -15.191 6.090 -3.425 1.00 0.25 N ATOM 323 CA ALA A 19 -15.485 7.499 -3.610 1.00 0.27 C ATOM 324 C ALA A 19 -15.351 8.235 -2.291 1.00 0.29 C ATOM 325 O ALA A 19 -15.815 7.762 -1.261 1.00 0.45 O ATOM 326 CB ALA A 19 -16.884 7.690 -4.175 1.00 0.32 C ATOM 0 H ALA A 19 -15.309 5.757 -2.468 1.00 0.25 H new ATOM 0 HA ALA A 19 -14.769 7.909 -4.322 1.00 0.27 H new ATOM 0 HB1 ALA A 19 -17.082 8.754 -4.305 1.00 0.32 H new ATOM 0 HB2 ALA A 19 -16.959 7.187 -5.139 1.00 0.32 H new ATOM 0 HB3 ALA A 19 -17.615 7.267 -3.487 1.00 0.32 H new ATOM 332 N PHE A 20 -14.711 9.380 -2.306 1.00 0.28 N ATOM 333 CA PHE A 20 -14.557 10.153 -1.095 1.00 0.29 C ATOM 334 C PHE A 20 -15.145 11.536 -1.291 1.00 0.33 C ATOM 335 O PHE A 20 -15.374 11.963 -2.420 1.00 0.35 O ATOM 336 CB PHE A 20 -13.081 10.222 -0.682 1.00 0.31 C ATOM 337 CG PHE A 20 -12.232 11.124 -1.531 1.00 0.32 C ATOM 338 CD1 PHE A 20 -12.091 12.463 -1.212 1.00 1.22 C ATOM 339 CD2 PHE A 20 -11.568 10.630 -2.634 1.00 1.20 C ATOM 340 CE1 PHE A 20 -11.304 13.291 -1.979 1.00 1.25 C ATOM 341 CE2 PHE A 20 -10.778 11.455 -3.410 1.00 1.21 C ATOM 342 CZ PHE A 20 -10.646 12.788 -3.082 1.00 0.41 C ATOM 0 H PHE A 20 -14.291 9.796 -3.137 1.00 0.28 H new ATOM 0 HA PHE A 20 -15.099 9.663 -0.286 1.00 0.29 H new ATOM 0 HB2 PHE A 20 -13.023 10.560 0.353 1.00 0.31 H new ATOM 0 HB3 PHE A 20 -12.662 9.216 -0.713 1.00 0.31 H new ATOM 0 HD1 PHE A 20 -12.605 12.863 -0.350 1.00 1.22 H new ATOM 0 HD2 PHE A 20 -11.667 9.586 -2.894 1.00 1.20 H new ATOM 0 HE1 PHE A 20 -11.202 14.334 -1.718 1.00 1.25 H new ATOM 0 HE2 PHE A 20 -10.264 11.057 -4.273 1.00 1.21 H new ATOM 0 HZ PHE A 20 -10.029 13.436 -3.687 1.00 0.41 H new ATOM 352 N GLU A 21 -15.422 12.223 -0.200 1.00 0.37 N ATOM 353 CA GLU A 21 -15.982 13.554 -0.287 1.00 0.43 C ATOM 354 C GLU A 21 -15.012 14.570 0.284 1.00 0.46 C ATOM 355 O GLU A 21 -14.401 14.356 1.345 1.00 0.44 O ATOM 356 CB GLU A 21 -17.329 13.641 0.433 1.00 0.48 C ATOM 357 CG GLU A 21 -18.188 12.398 0.265 1.00 1.11 C ATOM 358 CD GLU A 21 -19.546 12.534 0.913 1.00 1.40 C ATOM 359 OE1 GLU A 21 -20.269 13.505 0.601 1.00 1.92 O ATOM 360 OE2 GLU A 21 -19.906 11.667 1.732 1.00 1.89 O ATOM 0 H GLU A 21 -15.269 11.883 0.750 1.00 0.37 H new ATOM 0 HA GLU A 21 -16.152 13.778 -1.340 1.00 0.43 H new ATOM 0 HB2 GLU A 21 -17.154 13.811 1.495 1.00 0.48 H new ATOM 0 HB3 GLU A 21 -17.877 14.505 0.058 1.00 0.48 H new ATOM 0 HG2 GLU A 21 -18.316 12.191 -0.797 1.00 1.11 H new ATOM 0 HG3 GLU A 21 -17.669 11.542 0.696 1.00 1.11 H new ATOM 367 N TYR A 22 -14.891 15.671 -0.431 1.00 0.52 N ATOM 368 CA TYR A 22 -14.012 16.754 -0.049 1.00 0.59 C ATOM 369 C TYR A 22 -14.743 18.084 -0.197 1.00 0.65 C ATOM 370 O TYR A 22 -15.192 18.431 -1.291 1.00 0.65 O ATOM 371 CB TYR A 22 -12.740 16.750 -0.906 1.00 0.60 C ATOM 372 CG TYR A 22 -12.075 18.105 -1.008 1.00 0.74 C ATOM 373 CD1 TYR A 22 -11.542 18.733 0.113 1.00 1.53 C ATOM 374 CD2 TYR A 22 -12.001 18.768 -2.226 1.00 1.38 C ATOM 375 CE1 TYR A 22 -10.957 19.983 0.018 1.00 1.69 C ATOM 376 CE2 TYR A 22 -11.414 20.014 -2.327 1.00 1.48 C ATOM 377 CZ TYR A 22 -10.897 20.618 -1.205 1.00 1.16 C ATOM 378 OH TYR A 22 -10.316 21.862 -1.308 1.00 1.40 O ATOM 0 H TYR A 22 -15.403 15.839 -1.297 1.00 0.52 H new ATOM 0 HA TYR A 22 -13.720 16.617 0.992 1.00 0.59 H new ATOM 0 HB2 TYR A 22 -12.031 16.037 -0.486 1.00 0.60 H new ATOM 0 HB3 TYR A 22 -12.988 16.400 -1.908 1.00 0.60 H new ATOM 0 HD1 TYR A 22 -11.586 18.237 1.072 1.00 1.53 H new ATOM 0 HD2 TYR A 22 -12.410 18.301 -3.110 1.00 1.38 H new ATOM 0 HE1 TYR A 22 -10.549 20.459 0.897 1.00 1.69 H new ATOM 0 HE2 TYR A 22 -11.361 20.512 -3.284 1.00 1.48 H new ATOM 0 HH TYR A 22 -10.356 22.166 -2.239 1.00 1.40 H new ATOM 388 N ASN A 23 -14.880 18.803 0.911 1.00 0.72 N ATOM 389 CA ASN A 23 -15.542 20.107 0.924 1.00 0.80 C ATOM 390 C ASN A 23 -16.958 20.016 0.362 1.00 0.78 C ATOM 391 O ASN A 23 -17.475 20.974 -0.216 1.00 0.83 O ATOM 392 CB ASN A 23 -14.720 21.111 0.118 1.00 0.87 C ATOM 393 CG ASN A 23 -14.611 22.449 0.808 1.00 1.09 C ATOM 394 OD1 ASN A 23 -15.328 23.390 0.480 1.00 1.72 O ATOM 395 ND2 ASN A 23 -13.722 22.538 1.785 1.00 1.37 N ATOM 0 H ASN A 23 -14.538 18.502 1.824 1.00 0.72 H new ATOM 0 HA ASN A 23 -15.614 20.443 1.958 1.00 0.80 H new ATOM 0 HB2 ASN A 23 -13.721 20.708 -0.048 1.00 0.87 H new ATOM 0 HB3 ASN A 23 -15.176 21.247 -0.862 1.00 0.87 H new ATOM 0 HD21 ASN A 23 -13.613 23.413 2.297 1.00 1.37 H new ATOM 0 HD22 ASN A 23 -13.146 21.731 2.025 1.00 1.37 H new ATOM 402 N GLY A 24 -17.579 18.861 0.544 1.00 0.73 N ATOM 403 CA GLY A 24 -18.923 18.657 0.056 1.00 0.73 C ATOM 404 C GLY A 24 -18.956 18.109 -1.358 1.00 0.68 C ATOM 405 O GLY A 24 -19.992 17.624 -1.815 1.00 0.70 O ATOM 0 H GLY A 24 -17.172 18.058 1.024 1.00 0.73 H new ATOM 0 HA2 GLY A 24 -19.446 17.969 0.720 1.00 0.73 H new ATOM 0 HA3 GLY A 24 -19.464 19.603 0.087 1.00 0.73 H new ATOM 409 N GLN A 25 -17.825 18.168 -2.052 1.00 0.64 N ATOM 410 CA GLN A 25 -17.752 17.684 -3.418 1.00 0.60 C ATOM 411 C GLN A 25 -17.372 16.212 -3.435 1.00 0.54 C ATOM 412 O GLN A 25 -16.439 15.801 -2.746 1.00 0.53 O ATOM 413 CB GLN A 25 -16.719 18.486 -4.211 1.00 0.63 C ATOM 414 CG GLN A 25 -16.716 19.978 -3.905 1.00 0.76 C ATOM 415 CD GLN A 25 -18.039 20.645 -4.229 1.00 1.16 C ATOM 416 OE1 GLN A 25 -18.905 20.798 -3.368 1.00 1.91 O ATOM 417 NE2 GLN A 25 -18.200 21.038 -5.477 1.00 1.56 N ATOM 0 H GLN A 25 -16.950 18.546 -1.689 1.00 0.64 H new ATOM 0 HA GLN A 25 -18.732 17.807 -3.879 1.00 0.60 H new ATOM 0 HB2 GLN A 25 -15.727 18.083 -4.006 1.00 0.63 H new ATOM 0 HB3 GLN A 25 -16.906 18.345 -5.276 1.00 0.63 H new ATOM 0 HG2 GLN A 25 -16.487 20.128 -2.850 1.00 0.76 H new ATOM 0 HG3 GLN A 25 -15.922 20.460 -4.475 1.00 0.76 H new ATOM 0 HE21 GLN A 25 -17.455 20.891 -6.158 1.00 1.56 H new ATOM 0 HE22 GLN A 25 -19.069 21.489 -5.761 1.00 1.56 H new ATOM 426 N LEU A 26 -18.105 15.421 -4.203 1.00 0.50 N ATOM 427 CA LEU A 26 -17.830 13.999 -4.302 1.00 0.46 C ATOM 428 C LEU A 26 -16.711 13.721 -5.298 1.00 0.43 C ATOM 429 O LEU A 26 -16.714 14.231 -6.419 1.00 0.47 O ATOM 430 CB LEU A 26 -19.090 13.239 -4.699 1.00 0.49 C ATOM 431 CG LEU A 26 -19.718 12.416 -3.573 1.00 0.54 C ATOM 432 CD1 LEU A 26 -21.009 11.779 -4.041 1.00 0.59 C ATOM 433 CD2 LEU A 26 -18.753 11.344 -3.085 1.00 0.61 C ATOM 0 H LEU A 26 -18.894 15.741 -4.766 1.00 0.50 H new ATOM 0 HA LEU A 26 -17.503 13.653 -3.321 1.00 0.46 H new ATOM 0 HB2 LEU A 26 -19.828 13.952 -5.065 1.00 0.49 H new ATOM 0 HB3 LEU A 26 -18.851 12.573 -5.528 1.00 0.49 H new ATOM 0 HG LEU A 26 -19.937 13.088 -2.743 1.00 0.54 H new ATOM 0 HD11 LEU A 26 -21.443 11.197 -3.228 1.00 0.59 H new ATOM 0 HD12 LEU A 26 -21.709 12.557 -4.345 1.00 0.59 H new ATOM 0 HD13 LEU A 26 -20.805 11.124 -4.888 1.00 0.59 H new ATOM 0 HD21 LEU A 26 -19.220 10.771 -2.284 1.00 0.61 H new ATOM 0 HD22 LEU A 26 -18.502 10.677 -3.910 1.00 0.61 H new ATOM 0 HD23 LEU A 26 -17.844 11.816 -2.711 1.00 0.61 H new ATOM 445 N ILE A 27 -15.757 12.911 -4.868 1.00 0.39 N ATOM 446 CA ILE A 27 -14.606 12.554 -5.689 1.00 0.39 C ATOM 447 C ILE A 27 -14.406 11.029 -5.700 1.00 0.36 C ATOM 448 O ILE A 27 -14.002 10.444 -4.698 1.00 0.42 O ATOM 449 CB ILE A 27 -13.310 13.228 -5.165 1.00 0.41 C ATOM 450 CG1 ILE A 27 -13.579 14.648 -4.631 1.00 0.46 C ATOM 451 CG2 ILE A 27 -12.248 13.261 -6.259 1.00 0.48 C ATOM 452 CD1 ILE A 27 -13.835 15.689 -5.703 1.00 0.78 C ATOM 0 H ILE A 27 -15.756 12.482 -3.943 1.00 0.39 H new ATOM 0 HA ILE A 27 -14.805 12.908 -6.701 1.00 0.39 H new ATOM 0 HB ILE A 27 -12.942 12.629 -4.332 1.00 0.41 H new ATOM 0 HG12 ILE A 27 -14.440 14.614 -3.964 1.00 0.46 H new ATOM 0 HG13 ILE A 27 -12.725 14.965 -4.033 1.00 0.46 H new ATOM 0 HG21 ILE A 27 -11.345 13.737 -5.876 1.00 0.48 H new ATOM 0 HG22 ILE A 27 -12.017 12.243 -6.572 1.00 0.48 H new ATOM 0 HG23 ILE A 27 -12.622 13.827 -7.112 1.00 0.48 H new ATOM 0 HD11 ILE A 27 -14.014 16.657 -5.235 1.00 0.78 H new ATOM 0 HD12 ILE A 27 -12.966 15.758 -6.358 1.00 0.78 H new ATOM 0 HD13 ILE A 27 -14.709 15.402 -6.288 1.00 0.78 H new ATOM 464 N LYS A 28 -14.709 10.388 -6.829 1.00 0.31 N ATOM 465 CA LYS A 28 -14.566 8.939 -6.959 1.00 0.30 C ATOM 466 C LYS A 28 -13.090 8.518 -7.031 1.00 0.30 C ATOM 467 O LYS A 28 -12.252 9.250 -7.564 1.00 0.35 O ATOM 468 CB LYS A 28 -15.324 8.443 -8.197 1.00 0.32 C ATOM 469 CG LYS A 28 -14.694 8.858 -9.519 1.00 0.66 C ATOM 470 CD LYS A 28 -14.954 7.829 -10.609 1.00 1.05 C ATOM 471 CE LYS A 28 -16.389 7.886 -11.111 1.00 1.84 C ATOM 472 NZ LYS A 28 -16.568 8.919 -12.170 1.00 2.41 N ATOM 0 H LYS A 28 -15.056 10.852 -7.669 1.00 0.31 H new ATOM 0 HA LYS A 28 -14.995 8.480 -6.068 1.00 0.30 H new ATOM 0 HB2 LYS A 28 -15.384 7.355 -8.161 1.00 0.32 H new ATOM 0 HB3 LYS A 28 -16.346 8.820 -8.159 1.00 0.32 H new ATOM 0 HG2 LYS A 28 -15.094 9.824 -9.826 1.00 0.66 H new ATOM 0 HG3 LYS A 28 -13.620 8.986 -9.387 1.00 0.66 H new ATOM 0 HD2 LYS A 28 -14.271 8.001 -11.441 1.00 1.05 H new ATOM 0 HD3 LYS A 28 -14.743 6.831 -10.224 1.00 1.05 H new ATOM 0 HE2 LYS A 28 -16.675 6.910 -11.504 1.00 1.84 H new ATOM 0 HE3 LYS A 28 -17.057 8.102 -10.277 1.00 1.84 H new ATOM 0 HZ1 LYS A 28 -17.559 8.925 -12.485 1.00 2.41 H new ATOM 0 HZ2 LYS A 28 -16.320 9.854 -11.788 1.00 2.41 H new ATOM 0 HZ3 LYS A 28 -15.950 8.699 -12.977 1.00 2.41 H new ATOM 486 N ILE A 29 -12.781 7.344 -6.482 1.00 0.28 N ATOM 487 CA ILE A 29 -11.410 6.824 -6.471 1.00 0.31 C ATOM 488 C ILE A 29 -11.336 5.373 -6.980 1.00 0.29 C ATOM 489 O ILE A 29 -12.038 4.476 -6.488 1.00 0.31 O ATOM 490 CB ILE A 29 -10.778 6.922 -5.058 1.00 0.34 C ATOM 491 CG1 ILE A 29 -11.849 7.202 -4.000 1.00 0.31 C ATOM 492 CG2 ILE A 29 -9.720 8.018 -5.035 1.00 0.43 C ATOM 493 CD1 ILE A 29 -11.392 6.956 -2.575 1.00 0.36 C ATOM 0 H ILE A 29 -13.464 6.731 -6.036 1.00 0.28 H new ATOM 0 HA ILE A 29 -10.838 7.451 -7.155 1.00 0.31 H new ATOM 0 HB ILE A 29 -10.308 5.966 -4.825 1.00 0.34 H new ATOM 0 HG12 ILE A 29 -12.173 8.239 -4.092 1.00 0.31 H new ATOM 0 HG13 ILE A 29 -12.718 6.577 -4.204 1.00 0.31 H new ATOM 0 HG21 ILE A 29 -9.282 8.080 -4.039 1.00 0.43 H new ATOM 0 HG22 ILE A 29 -8.940 7.787 -5.761 1.00 0.43 H new ATOM 0 HG23 ILE A 29 -10.180 8.973 -5.289 1.00 0.43 H new ATOM 0 HD11 ILE A 29 -12.208 7.178 -1.888 1.00 0.36 H new ATOM 0 HD12 ILE A 29 -11.096 5.913 -2.463 1.00 0.36 H new ATOM 0 HD13 ILE A 29 -10.543 7.600 -2.349 1.00 0.36 H new ATOM 505 N LEU A 30 -10.558 5.187 -8.046 1.00 0.30 N ATOM 506 CA LEU A 30 -10.353 3.866 -8.664 1.00 0.31 C ATOM 507 C LEU A 30 -8.960 3.294 -8.406 1.00 0.29 C ATOM 508 O LEU A 30 -8.118 3.919 -7.765 1.00 0.28 O ATOM 509 CB LEU A 30 -10.657 3.873 -10.166 1.00 0.36 C ATOM 510 CG LEU A 30 -10.065 5.022 -10.971 1.00 1.41 C ATOM 511 CD1 LEU A 30 -9.668 4.537 -12.358 1.00 1.97 C ATOM 512 CD2 LEU A 30 -11.078 6.150 -11.072 1.00 2.00 C ATOM 0 H LEU A 30 -10.051 5.942 -8.508 1.00 0.30 H new ATOM 0 HA LEU A 30 -11.070 3.207 -8.175 1.00 0.31 H new ATOM 0 HB2 LEU A 30 -10.297 2.936 -10.592 1.00 0.36 H new ATOM 0 HB3 LEU A 30 -11.739 3.887 -10.296 1.00 0.36 H new ATOM 0 HG LEU A 30 -9.173 5.393 -10.467 1.00 1.41 H new ATOM 0 HD11 LEU A 30 -9.246 5.366 -12.926 1.00 1.97 H new ATOM 0 HD12 LEU A 30 -8.926 3.744 -12.267 1.00 1.97 H new ATOM 0 HD13 LEU A 30 -10.548 4.154 -12.875 1.00 1.97 H new ATOM 0 HD21 LEU A 30 -10.652 6.971 -11.649 1.00 2.00 H new ATOM 0 HD22 LEU A 30 -11.978 5.787 -11.568 1.00 2.00 H new ATOM 0 HD23 LEU A 30 -11.331 6.502 -10.072 1.00 2.00 H new ATOM 524 N SER A 31 -8.729 2.096 -8.946 1.00 0.31 N ATOM 525 CA SER A 31 -7.450 1.394 -8.839 1.00 0.33 C ATOM 526 C SER A 31 -6.282 2.199 -9.430 1.00 0.33 C ATOM 527 O SER A 31 -5.121 1.866 -9.217 1.00 0.36 O ATOM 528 CB SER A 31 -7.569 0.060 -9.576 1.00 0.41 C ATOM 529 OG SER A 31 -8.508 0.168 -10.638 1.00 1.16 O ATOM 0 H SER A 31 -9.433 1.581 -9.475 1.00 0.31 H new ATOM 0 HA SER A 31 -7.234 1.246 -7.781 1.00 0.33 H new ATOM 0 HB2 SER A 31 -6.596 -0.234 -9.970 1.00 0.41 H new ATOM 0 HB3 SER A 31 -7.882 -0.720 -8.882 1.00 0.41 H new ATOM 0 HG SER A 31 -8.063 -0.026 -11.489 1.00 1.16 H new ATOM 535 N LYS A 32 -6.587 3.239 -10.199 1.00 0.34 N ATOM 536 CA LYS A 32 -5.551 4.065 -10.802 1.00 0.38 C ATOM 537 C LYS A 32 -4.803 4.857 -9.733 1.00 0.36 C ATOM 538 O LYS A 32 -3.642 5.234 -9.903 1.00 0.40 O ATOM 539 CB LYS A 32 -6.182 5.023 -11.804 1.00 0.45 C ATOM 540 CG LYS A 32 -5.310 5.336 -12.999 1.00 1.10 C ATOM 541 CD LYS A 32 -5.299 4.179 -13.977 1.00 1.55 C ATOM 542 CE LYS A 32 -4.034 3.351 -13.839 1.00 1.94 C ATOM 543 NZ LYS A 32 -3.859 2.412 -14.974 1.00 2.47 N ATOM 0 H LYS A 32 -7.540 3.528 -10.418 1.00 0.34 H new ATOM 0 HA LYS A 32 -4.840 3.416 -11.313 1.00 0.38 H new ATOM 0 HB2 LYS A 32 -7.121 4.596 -12.156 1.00 0.45 H new ATOM 0 HB3 LYS A 32 -6.427 5.954 -11.294 1.00 0.45 H new ATOM 0 HG2 LYS A 32 -5.676 6.234 -13.496 1.00 1.10 H new ATOM 0 HG3 LYS A 32 -4.293 5.547 -12.667 1.00 1.10 H new ATOM 0 HD2 LYS A 32 -6.170 3.547 -13.805 1.00 1.55 H new ATOM 0 HD3 LYS A 32 -5.377 4.560 -14.995 1.00 1.55 H new ATOM 0 HE2 LYS A 32 -3.171 4.014 -13.781 1.00 1.94 H new ATOM 0 HE3 LYS A 32 -4.068 2.789 -12.905 1.00 1.94 H new ATOM 0 HZ1 LYS A 32 -2.984 1.866 -14.841 1.00 2.47 H new ATOM 0 HZ2 LYS A 32 -4.670 1.762 -15.015 1.00 2.47 H new ATOM 0 HZ3 LYS A 32 -3.800 2.949 -15.863 1.00 2.47 H new ATOM 557 N ASN A 33 -5.493 5.098 -8.633 1.00 0.31 N ATOM 558 CA ASN A 33 -4.936 5.826 -7.507 1.00 0.33 C ATOM 559 C ASN A 33 -4.740 4.886 -6.322 1.00 0.30 C ATOM 560 O ASN A 33 -3.981 5.177 -5.402 1.00 0.38 O ATOM 561 CB ASN A 33 -5.866 6.990 -7.116 1.00 0.36 C ATOM 562 CG ASN A 33 -7.166 7.031 -7.899 1.00 0.75 C ATOM 563 OD1 ASN A 33 -8.215 6.636 -7.407 1.00 1.28 O ATOM 564 ND2 ASN A 33 -7.106 7.505 -9.131 1.00 1.12 N ATOM 0 H ASN A 33 -6.457 4.794 -8.495 1.00 0.31 H new ATOM 0 HA ASN A 33 -3.967 6.234 -7.795 1.00 0.33 H new ATOM 0 HB2 ASN A 33 -6.096 6.916 -6.053 1.00 0.36 H new ATOM 0 HB3 ASN A 33 -5.335 7.931 -7.263 1.00 0.36 H new ATOM 0 HD21 ASN A 33 -7.950 7.550 -9.702 1.00 1.12 H new ATOM 0 HD22 ASN A 33 -6.216 7.826 -9.511 1.00 1.12 H new ATOM 571 N ILE A 34 -5.410 3.745 -6.368 1.00 0.33 N ATOM 572 CA ILE A 34 -5.344 2.767 -5.291 1.00 0.33 C ATOM 573 C ILE A 34 -4.801 1.423 -5.792 1.00 0.29 C ATOM 574 O ILE A 34 -5.367 0.815 -6.697 1.00 0.30 O ATOM 575 CB ILE A 34 -6.748 2.573 -4.662 1.00 0.35 C ATOM 576 CG1 ILE A 34 -7.089 3.739 -3.735 1.00 0.53 C ATOM 577 CG2 ILE A 34 -6.837 1.265 -3.905 1.00 0.58 C ATOM 578 CD1 ILE A 34 -7.744 4.907 -4.433 1.00 0.59 C ATOM 0 H ILE A 34 -6.010 3.471 -7.146 1.00 0.33 H new ATOM 0 HA ILE A 34 -4.659 3.146 -4.533 1.00 0.33 H new ATOM 0 HB ILE A 34 -7.472 2.545 -5.476 1.00 0.35 H new ATOM 0 HG12 ILE A 34 -7.752 3.382 -2.947 1.00 0.53 H new ATOM 0 HG13 ILE A 34 -6.175 4.084 -3.251 1.00 0.53 H new ATOM 0 HG21 ILE A 34 -7.834 1.160 -3.476 1.00 0.58 H new ATOM 0 HG22 ILE A 34 -6.646 0.436 -4.587 1.00 0.58 H new ATOM 0 HG23 ILE A 34 -6.096 1.256 -3.106 1.00 0.58 H new ATOM 0 HD11 ILE A 34 -7.954 5.693 -3.708 1.00 0.59 H new ATOM 0 HD12 ILE A 34 -7.075 5.293 -5.202 1.00 0.59 H new ATOM 0 HD13 ILE A 34 -8.676 4.579 -4.894 1.00 0.59 H new ATOM 590 N VAL A 35 -3.718 0.952 -5.180 1.00 0.27 N ATOM 591 CA VAL A 35 -3.102 -0.314 -5.579 1.00 0.26 C ATOM 592 C VAL A 35 -3.156 -1.329 -4.441 1.00 0.25 C ATOM 593 O VAL A 35 -2.746 -1.041 -3.317 1.00 0.26 O ATOM 594 CB VAL A 35 -1.631 -0.116 -6.013 1.00 0.30 C ATOM 595 CG1 VAL A 35 -0.946 -1.455 -6.266 1.00 0.45 C ATOM 596 CG2 VAL A 35 -1.559 0.757 -7.256 1.00 0.51 C ATOM 0 H VAL A 35 -3.248 1.425 -4.408 1.00 0.27 H new ATOM 0 HA VAL A 35 -3.672 -0.691 -6.428 1.00 0.26 H new ATOM 0 HB VAL A 35 -1.105 0.384 -5.200 1.00 0.30 H new ATOM 0 HG11 VAL A 35 0.087 -1.284 -6.570 1.00 0.45 H new ATOM 0 HG12 VAL A 35 -0.962 -2.050 -5.353 1.00 0.45 H new ATOM 0 HG13 VAL A 35 -1.473 -1.989 -7.057 1.00 0.45 H new ATOM 0 HG21 VAL A 35 -0.517 0.887 -7.549 1.00 0.51 H new ATOM 0 HG22 VAL A 35 -2.108 0.280 -8.068 1.00 0.51 H new ATOM 0 HG23 VAL A 35 -2.000 1.731 -7.043 1.00 0.51 H new ATOM 606 N ALA A 36 -3.659 -2.522 -4.740 1.00 0.25 N ATOM 607 CA ALA A 36 -3.767 -3.574 -3.739 1.00 0.25 C ATOM 608 C ALA A 36 -2.432 -4.272 -3.514 1.00 0.24 C ATOM 609 O ALA A 36 -1.721 -4.590 -4.466 1.00 0.27 O ATOM 610 CB ALA A 36 -4.832 -4.584 -4.141 1.00 0.30 C ATOM 0 H ALA A 36 -3.997 -2.783 -5.666 1.00 0.25 H new ATOM 0 HA ALA A 36 -4.060 -3.107 -2.799 1.00 0.25 H new ATOM 0 HB1 ALA A 36 -4.899 -5.363 -3.382 1.00 0.30 H new ATOM 0 HB2 ALA A 36 -5.795 -4.081 -4.231 1.00 0.30 H new ATOM 0 HB3 ALA A 36 -4.566 -5.032 -5.098 1.00 0.30 H new ATOM 616 N VAL A 37 -2.118 -4.513 -2.251 1.00 0.23 N ATOM 617 CA VAL A 37 -0.882 -5.165 -1.862 1.00 0.24 C ATOM 618 C VAL A 37 -1.108 -6.086 -0.671 1.00 0.25 C ATOM 619 O VAL A 37 -2.086 -5.943 0.090 1.00 0.25 O ATOM 620 CB VAL A 37 0.222 -4.153 -1.497 1.00 0.27 C ATOM 621 CG1 VAL A 37 0.922 -3.627 -2.744 1.00 0.29 C ATOM 622 CG2 VAL A 37 -0.355 -3.012 -0.680 1.00 0.30 C ATOM 0 H VAL A 37 -2.717 -4.260 -1.465 1.00 0.23 H new ATOM 0 HA VAL A 37 -0.555 -5.742 -2.727 1.00 0.24 H new ATOM 0 HB VAL A 37 0.968 -4.669 -0.892 1.00 0.27 H new ATOM 0 HG11 VAL A 37 1.695 -2.915 -2.454 1.00 0.29 H new ATOM 0 HG12 VAL A 37 1.377 -4.458 -3.284 1.00 0.29 H new ATOM 0 HG13 VAL A 37 0.195 -3.131 -3.387 1.00 0.29 H new ATOM 0 HG21 VAL A 37 0.437 -2.306 -0.430 1.00 0.30 H new ATOM 0 HG22 VAL A 37 -1.125 -2.503 -1.259 1.00 0.30 H new ATOM 0 HG23 VAL A 37 -0.792 -3.406 0.237 1.00 0.30 H new ATOM 632 N GLY A 38 -0.258 -7.092 -0.582 1.00 0.27 N ATOM 633 CA GLY A 38 -0.330 -8.031 0.500 1.00 0.30 C ATOM 634 C GLY A 38 0.155 -9.396 0.080 1.00 0.32 C ATOM 635 O GLY A 38 0.819 -9.560 -0.956 1.00 0.32 O ATOM 0 H GLY A 38 0.489 -7.272 -1.253 1.00 0.27 H new ATOM 0 HA2 GLY A 38 0.270 -7.672 1.336 1.00 0.30 H new ATOM 0 HA3 GLY A 38 -1.359 -8.102 0.854 1.00 0.30 H new ATOM 639 N SER A 39 -0.213 -10.395 0.859 1.00 0.38 N ATOM 640 CA SER A 39 0.118 -11.763 0.528 1.00 0.43 C ATOM 641 C SER A 39 -0.651 -12.140 -0.736 1.00 0.43 C ATOM 642 O SER A 39 -0.291 -13.080 -1.447 1.00 0.44 O ATOM 643 CB SER A 39 -0.172 -12.700 1.699 1.00 0.57 C ATOM 644 OG SER A 39 0.763 -12.494 2.748 1.00 1.40 O ATOM 0 H SER A 39 -0.741 -10.283 1.724 1.00 0.38 H new ATOM 0 HA SER A 39 1.186 -11.862 0.334 1.00 0.43 H new ATOM 0 HB2 SER A 39 -1.183 -12.528 2.067 1.00 0.57 H new ATOM 0 HB3 SER A 39 -0.127 -13.736 1.363 1.00 0.57 H new ATOM 0 HG SER A 39 0.471 -12.981 3.547 1.00 1.40 H new ATOM 650 N LEU A 40 -1.733 -11.393 -1.004 1.00 0.45 N ATOM 651 CA LEU A 40 -2.527 -11.570 -2.211 1.00 0.51 C ATOM 652 C LEU A 40 -1.605 -11.412 -3.421 1.00 0.47 C ATOM 653 O LEU A 40 -1.711 -12.140 -4.407 1.00 0.52 O ATOM 654 CB LEU A 40 -3.662 -10.526 -2.228 1.00 0.63 C ATOM 655 CG LEU A 40 -3.914 -9.803 -3.557 1.00 0.97 C ATOM 656 CD1 LEU A 40 -5.404 -9.724 -3.841 1.00 1.24 C ATOM 657 CD2 LEU A 40 -3.314 -8.401 -3.531 1.00 2.02 C ATOM 0 H LEU A 40 -2.074 -10.655 -0.388 1.00 0.45 H new ATOM 0 HA LEU A 40 -2.980 -12.561 -2.241 1.00 0.51 H new ATOM 0 HB2 LEU A 40 -4.586 -11.023 -1.931 1.00 0.63 H new ATOM 0 HB3 LEU A 40 -3.445 -9.775 -1.468 1.00 0.63 H new ATOM 0 HG LEU A 40 -3.431 -10.373 -4.351 1.00 0.97 H new ATOM 0 HD11 LEU A 40 -5.567 -9.208 -4.787 1.00 1.24 H new ATOM 0 HD12 LEU A 40 -5.817 -10.731 -3.901 1.00 1.24 H new ATOM 0 HD13 LEU A 40 -5.899 -9.176 -3.039 1.00 1.24 H new ATOM 0 HD21 LEU A 40 -3.504 -7.906 -4.483 1.00 2.02 H new ATOM 0 HD22 LEU A 40 -3.770 -7.825 -2.725 1.00 2.02 H new ATOM 0 HD23 LEU A 40 -2.239 -8.468 -3.366 1.00 2.02 H new ATOM 669 N ARG A 41 -0.676 -10.465 -3.305 1.00 0.43 N ATOM 670 CA ARG A 41 0.304 -10.214 -4.346 1.00 0.47 C ATOM 671 C ARG A 41 1.366 -11.303 -4.298 1.00 0.47 C ATOM 672 O ARG A 41 1.893 -11.722 -5.324 1.00 0.54 O ATOM 673 CB ARG A 41 0.947 -8.835 -4.171 1.00 0.50 C ATOM 674 CG ARG A 41 2.234 -8.664 -4.962 1.00 0.92 C ATOM 675 CD ARG A 41 2.421 -7.230 -5.411 1.00 1.30 C ATOM 676 NE ARG A 41 1.515 -6.876 -6.504 1.00 1.82 N ATOM 677 CZ ARG A 41 1.454 -5.667 -7.062 1.00 2.29 C ATOM 678 NH1 ARG A 41 2.254 -4.690 -6.646 1.00 2.67 N ATOM 679 NH2 ARG A 41 0.593 -5.437 -8.045 1.00 2.98 N ATOM 0 H ARG A 41 -0.586 -9.857 -2.491 1.00 0.43 H new ATOM 0 HA ARG A 41 -0.193 -10.227 -5.316 1.00 0.47 H new ATOM 0 HB2 ARG A 41 0.235 -8.069 -4.479 1.00 0.50 H new ATOM 0 HB3 ARG A 41 1.155 -8.671 -3.114 1.00 0.50 H new ATOM 0 HG2 ARG A 41 3.082 -8.968 -4.349 1.00 0.92 H new ATOM 0 HG3 ARG A 41 2.218 -9.320 -5.832 1.00 0.92 H new ATOM 0 HD2 ARG A 41 2.251 -6.561 -4.568 1.00 1.30 H new ATOM 0 HD3 ARG A 41 3.452 -7.082 -5.732 1.00 1.30 H new ATOM 0 HE ARG A 41 0.891 -7.600 -6.861 1.00 1.82 H new ATOM 0 HH11 ARG A 41 2.921 -4.863 -5.894 1.00 2.67 H new ATOM 0 HH12 ARG A 41 2.200 -3.768 -7.079 1.00 2.67 H new ATOM 0 HH21 ARG A 41 -0.020 -6.184 -8.372 1.00 2.98 H new ATOM 0 HH22 ARG A 41 0.544 -4.513 -8.474 1.00 2.98 H new ATOM 693 N ARG A 42 1.666 -11.762 -3.084 1.00 0.43 N ATOM 694 CA ARG A 42 2.652 -12.818 -2.871 1.00 0.48 C ATOM 695 C ARG A 42 2.093 -14.204 -3.249 1.00 0.47 C ATOM 696 O ARG A 42 2.798 -15.213 -3.157 1.00 0.52 O ATOM 697 CB ARG A 42 3.075 -12.786 -1.395 1.00 0.52 C ATOM 698 CG ARG A 42 4.284 -13.640 -1.051 1.00 1.06 C ATOM 699 CD ARG A 42 3.877 -14.948 -0.397 1.00 1.93 C ATOM 700 NE ARG A 42 3.090 -14.741 0.819 1.00 2.68 N ATOM 701 CZ ARG A 42 2.323 -15.682 1.374 1.00 3.60 C ATOM 702 NH1 ARG A 42 2.285 -16.906 0.861 1.00 3.96 N ATOM 703 NH2 ARG A 42 1.593 -15.401 2.444 1.00 4.52 N ATOM 0 H ARG A 42 1.236 -11.415 -2.227 1.00 0.43 H new ATOM 0 HA ARG A 42 3.514 -12.643 -3.515 1.00 0.48 H new ATOM 0 HB2 ARG A 42 3.288 -11.754 -1.117 1.00 0.52 H new ATOM 0 HB3 ARG A 42 2.233 -13.113 -0.785 1.00 0.52 H new ATOM 0 HG2 ARG A 42 4.853 -13.847 -1.957 1.00 1.06 H new ATOM 0 HG3 ARG A 42 4.942 -13.087 -0.381 1.00 1.06 H new ATOM 0 HD2 ARG A 42 3.298 -15.541 -1.105 1.00 1.93 H new ATOM 0 HD3 ARG A 42 4.770 -15.524 -0.155 1.00 1.93 H new ATOM 0 HE ARG A 42 3.130 -13.826 1.268 1.00 2.68 H new ATOM 0 HH11 ARG A 42 2.844 -17.132 0.038 1.00 3.96 H new ATOM 0 HH12 ARG A 42 1.697 -17.621 1.290 1.00 3.96 H new ATOM 0 HH21 ARG A 42 1.616 -14.464 2.845 1.00 4.52 H new ATOM 0 HH22 ARG A 42 1.008 -16.122 2.866 1.00 4.52 H new ATOM 717 N GLU A 43 0.824 -14.235 -3.656 1.00 0.46 N ATOM 718 CA GLU A 43 0.146 -15.459 -4.095 1.00 0.50 C ATOM 719 C GLU A 43 -0.186 -16.391 -2.927 1.00 0.47 C ATOM 720 O GLU A 43 0.133 -17.583 -2.951 1.00 0.52 O ATOM 721 CB GLU A 43 0.980 -16.190 -5.150 1.00 0.59 C ATOM 722 CG GLU A 43 1.334 -15.307 -6.333 1.00 0.67 C ATOM 723 CD GLU A 43 2.089 -16.049 -7.412 1.00 0.95 C ATOM 724 OE1 GLU A 43 3.200 -16.544 -7.137 1.00 1.60 O ATOM 725 OE2 GLU A 43 1.572 -16.149 -8.546 1.00 1.53 O ATOM 0 H GLU A 43 0.231 -13.406 -3.691 1.00 0.46 H new ATOM 0 HA GLU A 43 -0.801 -15.157 -4.542 1.00 0.50 H new ATOM 0 HB2 GLU A 43 1.897 -16.559 -4.690 1.00 0.59 H new ATOM 0 HB3 GLU A 43 0.428 -17.061 -5.504 1.00 0.59 H new ATOM 0 HG2 GLU A 43 0.420 -14.891 -6.756 1.00 0.67 H new ATOM 0 HG3 GLU A 43 1.936 -14.467 -5.986 1.00 0.67 H new ATOM 732 N GLU A 44 -0.839 -15.844 -1.912 1.00 0.43 N ATOM 733 CA GLU A 44 -1.241 -16.611 -0.761 1.00 0.43 C ATOM 734 C GLU A 44 -2.651 -17.162 -0.994 1.00 0.43 C ATOM 735 O GLU A 44 -3.450 -16.548 -1.694 1.00 0.52 O ATOM 736 CB GLU A 44 -1.177 -15.716 0.470 1.00 0.48 C ATOM 737 CG GLU A 44 -1.863 -16.282 1.683 1.00 1.24 C ATOM 738 CD GLU A 44 -1.234 -17.574 2.168 1.00 1.94 C ATOM 739 OE1 GLU A 44 -0.038 -17.556 2.531 1.00 2.57 O ATOM 740 OE2 GLU A 44 -1.927 -18.612 2.167 1.00 2.47 O ATOM 0 H GLU A 44 -1.100 -14.859 -1.871 1.00 0.43 H new ATOM 0 HA GLU A 44 -0.573 -17.458 -0.602 1.00 0.43 H new ATOM 0 HB2 GLU A 44 -0.131 -15.527 0.713 1.00 0.48 H new ATOM 0 HB3 GLU A 44 -1.627 -14.753 0.229 1.00 0.48 H new ATOM 0 HG2 GLU A 44 -1.835 -15.546 2.487 1.00 1.24 H new ATOM 0 HG3 GLU A 44 -2.913 -16.460 1.450 1.00 1.24 H new ATOM 747 N LYS A 45 -2.941 -18.314 -0.408 1.00 0.46 N ATOM 748 CA LYS A 45 -4.238 -18.951 -0.586 1.00 0.50 C ATOM 749 C LYS A 45 -5.279 -18.381 0.371 1.00 0.49 C ATOM 750 O LYS A 45 -6.437 -18.210 -0.007 1.00 0.56 O ATOM 751 CB LYS A 45 -4.149 -20.482 -0.421 1.00 0.59 C ATOM 752 CG LYS A 45 -2.815 -21.004 0.105 1.00 1.14 C ATOM 753 CD LYS A 45 -1.950 -21.593 -1.005 1.00 1.28 C ATOM 754 CE LYS A 45 -1.398 -20.524 -1.937 1.00 1.42 C ATOM 755 NZ LYS A 45 -0.635 -21.110 -3.075 1.00 2.10 N ATOM 0 H LYS A 45 -2.297 -18.827 0.194 1.00 0.46 H new ATOM 0 HA LYS A 45 -4.554 -18.735 -1.606 1.00 0.50 H new ATOM 0 HB2 LYS A 45 -4.939 -20.805 0.257 1.00 0.59 H new ATOM 0 HB3 LYS A 45 -4.347 -20.947 -1.387 1.00 0.59 H new ATOM 0 HG2 LYS A 45 -2.275 -20.192 0.592 1.00 1.14 H new ATOM 0 HG3 LYS A 45 -2.998 -21.765 0.864 1.00 1.14 H new ATOM 0 HD2 LYS A 45 -1.123 -22.148 -0.562 1.00 1.28 H new ATOM 0 HD3 LYS A 45 -2.539 -22.306 -1.582 1.00 1.28 H new ATOM 0 HE2 LYS A 45 -2.220 -19.922 -2.324 1.00 1.42 H new ATOM 0 HE3 LYS A 45 -0.749 -19.853 -1.374 1.00 1.42 H new ATOM 0 HZ1 LYS A 45 -0.278 -20.346 -3.683 1.00 2.10 H new ATOM 0 HZ2 LYS A 45 0.165 -21.663 -2.708 1.00 2.10 H new ATOM 0 HZ3 LYS A 45 -1.260 -21.730 -3.629 1.00 2.10 H new ATOM 769 N MET A 46 -4.867 -18.064 1.591 1.00 0.46 N ATOM 770 CA MET A 46 -5.800 -17.526 2.576 1.00 0.48 C ATOM 771 C MET A 46 -5.287 -16.224 3.180 1.00 0.46 C ATOM 772 O MET A 46 -4.132 -16.124 3.583 1.00 0.67 O ATOM 773 CB MET A 46 -6.019 -18.562 3.678 1.00 0.60 C ATOM 774 CG MET A 46 -7.007 -18.134 4.748 1.00 0.67 C ATOM 775 SD MET A 46 -7.196 -19.375 6.046 1.00 1.15 S ATOM 776 CE MET A 46 -7.914 -20.737 5.124 1.00 2.00 C ATOM 0 H MET A 46 -3.907 -18.167 1.921 1.00 0.46 H new ATOM 0 HA MET A 46 -6.743 -17.308 2.075 1.00 0.48 H new ATOM 0 HB2 MET A 46 -6.370 -19.489 3.225 1.00 0.60 H new ATOM 0 HB3 MET A 46 -5.061 -18.781 4.150 1.00 0.60 H new ATOM 0 HG2 MET A 46 -6.674 -17.196 5.192 1.00 0.67 H new ATOM 0 HG3 MET A 46 -7.976 -17.943 4.288 1.00 0.67 H new ATOM 0 HE1 MET A 46 -8.393 -21.431 5.814 1.00 2.00 H new ATOM 0 HE2 MET A 46 -8.656 -20.352 4.424 1.00 2.00 H new ATOM 0 HE3 MET A 46 -7.130 -21.256 4.573 1.00 2.00 H new ATOM 786 N LEU A 47 -6.167 -15.234 3.270 1.00 0.49 N ATOM 787 CA LEU A 47 -5.802 -13.948 3.828 1.00 0.56 C ATOM 788 C LEU A 47 -6.729 -13.522 4.947 1.00 0.55 C ATOM 789 O LEU A 47 -7.864 -13.989 5.063 1.00 0.59 O ATOM 790 CB LEU A 47 -5.846 -12.868 2.751 1.00 0.82 C ATOM 791 CG LEU A 47 -4.539 -12.119 2.525 1.00 0.43 C ATOM 792 CD1 LEU A 47 -3.616 -12.933 1.659 1.00 1.09 C ATOM 793 CD2 LEU A 47 -4.789 -10.761 1.893 1.00 1.09 C ATOM 0 H LEU A 47 -7.137 -15.302 2.962 1.00 0.49 H new ATOM 0 HA LEU A 47 -4.794 -14.062 4.226 1.00 0.56 H new ATOM 0 HB2 LEU A 47 -6.149 -13.328 1.811 1.00 0.82 H new ATOM 0 HB3 LEU A 47 -6.618 -12.146 3.016 1.00 0.82 H new ATOM 0 HG LEU A 47 -4.068 -11.960 3.495 1.00 0.43 H new ATOM 0 HD11 LEU A 47 -2.685 -12.387 1.505 1.00 1.09 H new ATOM 0 HD12 LEU A 47 -3.402 -13.883 2.148 1.00 1.09 H new ATOM 0 HD13 LEU A 47 -4.091 -13.119 0.696 1.00 1.09 H new ATOM 0 HD21 LEU A 47 -3.839 -10.249 1.743 1.00 1.09 H new ATOM 0 HD22 LEU A 47 -5.285 -10.893 0.932 1.00 1.09 H new ATOM 0 HD23 LEU A 47 -5.423 -10.165 2.550 1.00 1.09 H new ATOM 805 N ASN A 48 -6.220 -12.621 5.762 1.00 0.61 N ATOM 806 CA ASN A 48 -6.981 -12.050 6.860 1.00 0.64 C ATOM 807 C ASN A 48 -7.487 -10.685 6.445 1.00 0.52 C ATOM 808 O ASN A 48 -8.665 -10.373 6.585 1.00 0.54 O ATOM 809 CB ASN A 48 -6.122 -11.909 8.114 1.00 0.77 C ATOM 810 CG ASN A 48 -6.223 -13.100 9.042 1.00 1.47 C ATOM 811 OD1 ASN A 48 -7.296 -13.685 9.210 1.00 2.03 O ATOM 812 ND2 ASN A 48 -5.108 -13.467 9.649 1.00 2.14 N ATOM 0 H ASN A 48 -5.268 -12.263 5.684 1.00 0.61 H new ATOM 0 HA ASN A 48 -7.813 -12.715 7.091 1.00 0.64 H new ATOM 0 HB2 ASN A 48 -5.081 -11.773 7.820 1.00 0.77 H new ATOM 0 HB3 ASN A 48 -6.422 -11.010 8.653 1.00 0.77 H new ATOM 0 HD21 ASN A 48 -5.113 -14.263 10.286 1.00 2.14 H new ATOM 0 HD22 ASN A 48 -4.243 -12.954 9.480 1.00 2.14 H new ATOM 819 N ASP A 49 -6.581 -9.874 5.908 1.00 0.49 N ATOM 820 CA ASP A 49 -6.935 -8.534 5.471 1.00 0.39 C ATOM 821 C ASP A 49 -6.193 -8.188 4.200 1.00 0.34 C ATOM 822 O ASP A 49 -5.005 -8.542 4.067 1.00 0.42 O ATOM 823 CB ASP A 49 -6.652 -7.473 6.562 1.00 0.43 C ATOM 824 CG ASP A 49 -5.168 -7.161 6.792 1.00 0.52 C ATOM 825 OD1 ASP A 49 -4.521 -6.502 5.950 1.00 1.02 O ATOM 826 OD2 ASP A 49 -4.626 -7.554 7.820 1.00 1.05 O ATOM 0 H ASP A 49 -5.602 -10.122 5.767 1.00 0.49 H new ATOM 0 HA ASP A 49 -8.008 -8.525 5.278 1.00 0.39 H new ATOM 0 HB2 ASP A 49 -7.164 -6.550 6.292 1.00 0.43 H new ATOM 0 HB3 ASP A 49 -7.086 -7.815 7.502 1.00 0.43 H new ATOM 831 N VAL A 50 -6.873 -7.480 3.301 1.00 0.28 N ATOM 832 CA VAL A 50 -6.277 -7.053 2.035 1.00 0.27 C ATOM 833 C VAL A 50 -5.854 -5.619 2.205 1.00 0.24 C ATOM 834 O VAL A 50 -6.575 -4.828 2.818 1.00 0.26 O ATOM 835 CB VAL A 50 -7.232 -7.162 0.829 1.00 0.36 C ATOM 836 CG1 VAL A 50 -6.552 -6.648 -0.435 1.00 0.88 C ATOM 837 CG2 VAL A 50 -7.687 -8.595 0.640 1.00 0.90 C ATOM 0 H VAL A 50 -7.842 -7.188 3.426 1.00 0.28 H new ATOM 0 HA VAL A 50 -5.440 -7.716 1.815 1.00 0.27 H new ATOM 0 HB VAL A 50 -8.109 -6.545 1.026 1.00 0.36 H new ATOM 0 HG11 VAL A 50 -7.239 -6.732 -1.277 1.00 0.88 H new ATOM 0 HG12 VAL A 50 -6.271 -5.604 -0.298 1.00 0.88 H new ATOM 0 HG13 VAL A 50 -5.659 -7.241 -0.635 1.00 0.88 H new ATOM 0 HG21 VAL A 50 -8.360 -8.653 -0.215 1.00 0.90 H new ATOM 0 HG22 VAL A 50 -6.820 -9.232 0.463 1.00 0.90 H new ATOM 0 HG23 VAL A 50 -8.208 -8.932 1.536 1.00 0.90 H new ATOM 847 N ASP A 51 -4.690 -5.277 1.710 1.00 0.24 N ATOM 848 CA ASP A 51 -4.195 -3.948 1.898 1.00 0.24 C ATOM 849 C ASP A 51 -4.101 -3.204 0.591 1.00 0.24 C ATOM 850 O ASP A 51 -3.909 -3.805 -0.461 1.00 0.26 O ATOM 851 CB ASP A 51 -2.870 -4.089 2.609 1.00 0.27 C ATOM 852 CG ASP A 51 -3.013 -5.070 3.761 1.00 0.31 C ATOM 853 OD1 ASP A 51 -3.121 -6.308 3.531 1.00 0.40 O ATOM 854 OD2 ASP A 51 -3.075 -4.627 4.917 1.00 0.38 O ATOM 0 H ASP A 51 -4.078 -5.897 1.180 1.00 0.24 H new ATOM 0 HA ASP A 51 -4.873 -3.344 2.501 1.00 0.24 H new ATOM 0 HB2 ASP A 51 -2.107 -4.438 1.913 1.00 0.27 H new ATOM 0 HB3 ASP A 51 -2.541 -3.119 2.982 1.00 0.27 H new ATOM 859 N LEU A 52 -4.285 -1.895 0.650 1.00 0.26 N ATOM 860 CA LEU A 52 -4.276 -1.082 -0.551 1.00 0.31 C ATOM 861 C LEU A 52 -3.592 0.263 -0.328 1.00 0.25 C ATOM 862 O LEU A 52 -4.005 1.060 0.522 1.00 0.32 O ATOM 863 CB LEU A 52 -5.719 -0.869 -1.038 1.00 0.41 C ATOM 864 CG LEU A 52 -6.429 -2.117 -1.587 1.00 0.64 C ATOM 865 CD1 LEU A 52 -7.053 -2.933 -0.472 1.00 1.28 C ATOM 866 CD2 LEU A 52 -7.489 -1.733 -2.599 1.00 1.07 C ATOM 0 H LEU A 52 -4.442 -1.376 1.514 1.00 0.26 H new ATOM 0 HA LEU A 52 -3.703 -1.613 -1.311 1.00 0.31 H new ATOM 0 HB2 LEU A 52 -6.308 -0.474 -0.210 1.00 0.41 H new ATOM 0 HB3 LEU A 52 -5.711 -0.106 -1.817 1.00 0.41 H new ATOM 0 HG LEU A 52 -5.674 -2.730 -2.080 1.00 0.64 H new ATOM 0 HD11 LEU A 52 -7.547 -3.808 -0.894 1.00 1.28 H new ATOM 0 HD12 LEU A 52 -6.276 -3.254 0.222 1.00 1.28 H new ATOM 0 HD13 LEU A 52 -7.785 -2.324 0.059 1.00 1.28 H new ATOM 0 HD21 LEU A 52 -7.978 -2.633 -2.973 1.00 1.07 H new ATOM 0 HD22 LEU A 52 -8.229 -1.089 -2.124 1.00 1.07 H new ATOM 0 HD23 LEU A 52 -7.024 -1.201 -3.429 1.00 1.07 H new ATOM 878 N LEU A 53 -2.518 0.490 -1.070 1.00 0.27 N ATOM 879 CA LEU A 53 -1.786 1.746 -1.004 1.00 0.31 C ATOM 880 C LEU A 53 -2.430 2.753 -1.939 1.00 0.26 C ATOM 881 O LEU A 53 -2.716 2.443 -3.094 1.00 0.26 O ATOM 882 CB LEU A 53 -0.328 1.552 -1.415 1.00 0.48 C ATOM 883 CG LEU A 53 0.528 0.734 -0.458 1.00 0.79 C ATOM 884 CD1 LEU A 53 1.577 -0.031 -1.236 1.00 1.59 C ATOM 885 CD2 LEU A 53 1.187 1.631 0.573 1.00 1.06 C ATOM 0 H LEU A 53 -2.132 -0.185 -1.730 1.00 0.27 H new ATOM 0 HA LEU A 53 -1.816 2.107 0.024 1.00 0.31 H new ATOM 0 HB2 LEU A 53 -0.307 1.071 -2.393 1.00 0.48 H new ATOM 0 HB3 LEU A 53 0.130 2.534 -1.533 1.00 0.48 H new ATOM 0 HG LEU A 53 -0.114 0.027 0.068 1.00 0.79 H new ATOM 0 HD11 LEU A 53 2.187 -0.615 -0.547 1.00 1.59 H new ATOM 0 HD12 LEU A 53 1.089 -0.700 -1.944 1.00 1.59 H new ATOM 0 HD13 LEU A 53 2.212 0.670 -1.778 1.00 1.59 H new ATOM 0 HD21 LEU A 53 1.794 1.026 1.247 1.00 1.06 H new ATOM 0 HD22 LEU A 53 1.821 2.360 0.069 1.00 1.06 H new ATOM 0 HD23 LEU A 53 0.420 2.152 1.145 1.00 1.06 H new ATOM 897 N ILE A 54 -2.666 3.943 -1.441 1.00 0.26 N ATOM 898 CA ILE A 54 -3.273 4.989 -2.241 1.00 0.25 C ATOM 899 C ILE A 54 -2.216 6.003 -2.650 1.00 0.25 C ATOM 900 O ILE A 54 -1.726 6.762 -1.819 1.00 0.27 O ATOM 901 CB ILE A 54 -4.396 5.713 -1.469 1.00 0.29 C ATOM 902 CG1 ILE A 54 -5.279 4.698 -0.731 1.00 0.52 C ATOM 903 CG2 ILE A 54 -5.219 6.577 -2.414 1.00 0.41 C ATOM 904 CD1 ILE A 54 -6.456 5.318 -0.011 1.00 0.58 C ATOM 0 H ILE A 54 -2.447 4.215 -0.483 1.00 0.26 H new ATOM 0 HA ILE A 54 -3.708 4.521 -3.124 1.00 0.25 H new ATOM 0 HB ILE A 54 -3.944 6.368 -0.724 1.00 0.29 H new ATOM 0 HG12 ILE A 54 -5.649 3.965 -1.448 1.00 0.52 H new ATOM 0 HG13 ILE A 54 -4.668 4.157 -0.009 1.00 0.52 H new ATOM 0 HG21 ILE A 54 -6.007 7.081 -1.854 1.00 0.41 H new ATOM 0 HG22 ILE A 54 -4.574 7.321 -2.882 1.00 0.41 H new ATOM 0 HG23 ILE A 54 -5.667 5.949 -3.184 1.00 0.41 H new ATOM 0 HD11 ILE A 54 -7.031 4.537 0.486 1.00 0.58 H new ATOM 0 HD12 ILE A 54 -6.095 6.030 0.731 1.00 0.58 H new ATOM 0 HD13 ILE A 54 -7.091 5.835 -0.730 1.00 0.58 H new ATOM 916 N ILE A 55 -1.858 6.002 -3.926 1.00 0.25 N ATOM 917 CA ILE A 55 -0.856 6.917 -4.446 1.00 0.26 C ATOM 918 C ILE A 55 -1.525 8.156 -5.016 1.00 0.25 C ATOM 919 O ILE A 55 -2.222 8.093 -6.031 1.00 0.29 O ATOM 920 CB ILE A 55 -0.003 6.265 -5.553 1.00 0.30 C ATOM 921 CG1 ILE A 55 0.340 4.820 -5.198 1.00 0.35 C ATOM 922 CG2 ILE A 55 1.260 7.066 -5.791 1.00 0.48 C ATOM 923 CD1 ILE A 55 -0.566 3.818 -5.872 1.00 0.44 C ATOM 0 H ILE A 55 -2.251 5.371 -4.624 1.00 0.25 H new ATOM 0 HA ILE A 55 -0.204 7.185 -3.615 1.00 0.26 H new ATOM 0 HB ILE A 55 -0.589 6.259 -6.472 1.00 0.30 H new ATOM 0 HG12 ILE A 55 1.373 4.617 -5.482 1.00 0.35 H new ATOM 0 HG13 ILE A 55 0.275 4.692 -4.118 1.00 0.35 H new ATOM 0 HG21 ILE A 55 1.850 6.591 -6.575 1.00 0.48 H new ATOM 0 HG22 ILE A 55 0.997 8.078 -6.098 1.00 0.48 H new ATOM 0 HG23 ILE A 55 1.844 7.106 -4.872 1.00 0.48 H new ATOM 0 HD11 ILE A 55 -0.273 2.809 -5.581 1.00 0.44 H new ATOM 0 HD12 ILE A 55 -1.597 3.998 -5.568 1.00 0.44 H new ATOM 0 HD13 ILE A 55 -0.483 3.922 -6.954 1.00 0.44 H new ATOM 935 N VAL A 56 -1.309 9.280 -4.363 1.00 0.24 N ATOM 936 CA VAL A 56 -1.910 10.529 -4.788 1.00 0.26 C ATOM 937 C VAL A 56 -0.850 11.515 -5.278 1.00 0.27 C ATOM 938 O VAL A 56 0.164 11.734 -4.612 1.00 0.25 O ATOM 939 CB VAL A 56 -2.726 11.165 -3.646 1.00 0.28 C ATOM 940 CG1 VAL A 56 -3.678 12.217 -4.187 1.00 0.34 C ATOM 941 CG2 VAL A 56 -3.494 10.095 -2.877 1.00 0.33 C ATOM 0 H VAL A 56 -0.720 9.355 -3.534 1.00 0.24 H new ATOM 0 HA VAL A 56 -2.581 10.301 -5.616 1.00 0.26 H new ATOM 0 HB VAL A 56 -2.032 11.652 -2.961 1.00 0.28 H new ATOM 0 HG11 VAL A 56 -4.244 12.653 -3.364 1.00 0.34 H new ATOM 0 HG12 VAL A 56 -3.109 12.999 -4.690 1.00 0.34 H new ATOM 0 HG13 VAL A 56 -4.366 11.755 -4.896 1.00 0.34 H new ATOM 0 HG21 VAL A 56 -4.064 10.563 -2.074 1.00 0.33 H new ATOM 0 HG22 VAL A 56 -4.175 9.579 -3.554 1.00 0.33 H new ATOM 0 HG23 VAL A 56 -2.792 9.377 -2.453 1.00 0.33 H new ATOM 951 N PRO A 57 -1.070 12.110 -6.464 1.00 0.31 N ATOM 952 CA PRO A 57 -0.136 13.075 -7.058 1.00 0.34 C ATOM 953 C PRO A 57 -0.064 14.402 -6.304 1.00 0.34 C ATOM 954 O PRO A 57 0.798 15.237 -6.590 1.00 0.37 O ATOM 955 CB PRO A 57 -0.697 13.298 -8.465 1.00 0.39 C ATOM 956 CG PRO A 57 -2.134 12.920 -8.389 1.00 0.41 C ATOM 957 CD PRO A 57 -2.233 11.852 -7.338 1.00 0.37 C ATOM 0 HA PRO A 57 0.885 12.694 -7.036 1.00 0.34 H new ATOM 0 HB2 PRO A 57 -0.581 14.337 -8.773 1.00 0.39 H new ATOM 0 HB3 PRO A 57 -0.170 12.688 -9.198 1.00 0.39 H new ATOM 0 HG2 PRO A 57 -2.749 13.781 -8.128 1.00 0.41 H new ATOM 0 HG3 PRO A 57 -2.491 12.553 -9.351 1.00 0.41 H new ATOM 0 HD2 PRO A 57 -3.171 11.919 -6.786 1.00 0.37 H new ATOM 0 HD3 PRO A 57 -2.191 10.855 -7.776 1.00 0.37 H new ATOM 965 N GLU A 58 -0.948 14.594 -5.337 1.00 0.33 N ATOM 966 CA GLU A 58 -0.959 15.827 -4.570 1.00 0.36 C ATOM 967 C GLU A 58 -1.121 15.561 -3.088 1.00 0.35 C ATOM 968 O GLU A 58 -1.880 14.682 -2.679 1.00 0.34 O ATOM 969 CB GLU A 58 -2.078 16.759 -5.030 1.00 0.40 C ATOM 970 CG GLU A 58 -1.599 17.860 -5.956 1.00 0.64 C ATOM 971 CD GLU A 58 -0.782 18.918 -5.235 1.00 1.32 C ATOM 972 OE1 GLU A 58 -0.358 18.679 -4.085 1.00 1.99 O ATOM 973 OE2 GLU A 58 -0.554 19.995 -5.823 1.00 2.00 O ATOM 0 H GLU A 58 -1.661 13.917 -5.067 1.00 0.33 H new ATOM 0 HA GLU A 58 0.004 16.307 -4.743 1.00 0.36 H new ATOM 0 HB2 GLU A 58 -2.843 16.173 -5.539 1.00 0.40 H new ATOM 0 HB3 GLU A 58 -2.549 17.208 -4.156 1.00 0.40 H new ATOM 0 HG2 GLU A 58 -0.997 17.423 -6.753 1.00 0.64 H new ATOM 0 HG3 GLU A 58 -2.460 18.332 -6.429 1.00 0.64 H new ATOM 980 N LYS A 59 -0.414 16.349 -2.294 1.00 0.36 N ATOM 981 CA LYS A 59 -0.470 16.244 -0.845 1.00 0.37 C ATOM 982 C LYS A 59 -1.861 16.635 -0.379 1.00 0.37 C ATOM 983 O LYS A 59 -2.406 16.080 0.579 1.00 0.37 O ATOM 984 CB LYS A 59 0.574 17.168 -0.212 1.00 0.42 C ATOM 985 CG LYS A 59 1.533 16.463 0.739 1.00 1.10 C ATOM 986 CD LYS A 59 0.878 16.151 2.080 1.00 1.46 C ATOM 987 CE LYS A 59 1.862 15.527 3.058 1.00 2.16 C ATOM 988 NZ LYS A 59 2.996 16.442 3.368 1.00 2.64 N ATOM 0 H LYS A 59 0.213 17.078 -2.635 1.00 0.36 H new ATOM 0 HA LYS A 59 -0.255 15.219 -0.542 1.00 0.37 H new ATOM 0 HB2 LYS A 59 1.150 17.645 -1.005 1.00 0.42 H new ATOM 0 HB3 LYS A 59 0.060 17.962 0.330 1.00 0.42 H new ATOM 0 HG2 LYS A 59 1.882 15.537 0.282 1.00 1.10 H new ATOM 0 HG3 LYS A 59 2.410 17.090 0.901 1.00 1.10 H new ATOM 0 HD2 LYS A 59 0.472 17.067 2.508 1.00 1.46 H new ATOM 0 HD3 LYS A 59 0.039 15.472 1.926 1.00 1.46 H new ATOM 0 HE2 LYS A 59 1.342 15.269 3.980 1.00 2.16 H new ATOM 0 HE3 LYS A 59 2.249 14.598 2.640 1.00 2.16 H new ATOM 0 HZ1 LYS A 59 3.509 16.089 4.201 1.00 2.64 H new ATOM 0 HZ2 LYS A 59 3.643 16.481 2.555 1.00 2.64 H new ATOM 0 HZ3 LYS A 59 2.629 17.395 3.565 1.00 2.64 H new ATOM 1002 N LYS A 60 -2.439 17.582 -1.103 1.00 0.40 N ATOM 1003 CA LYS A 60 -3.763 18.075 -0.793 1.00 0.42 C ATOM 1004 C LYS A 60 -4.787 16.996 -1.084 1.00 0.40 C ATOM 1005 O LYS A 60 -5.459 16.526 -0.176 1.00 0.41 O ATOM 1006 CB LYS A 60 -4.069 19.341 -1.598 1.00 0.48 C ATOM 1007 CG LYS A 60 -3.207 20.534 -1.207 1.00 0.69 C ATOM 1008 CD LYS A 60 -1.850 20.508 -1.895 1.00 0.79 C ATOM 1009 CE LYS A 60 -0.784 21.202 -1.067 1.00 0.94 C ATOM 1010 NZ LYS A 60 0.443 21.471 -1.864 1.00 1.50 N ATOM 0 H LYS A 60 -2.005 18.024 -1.913 1.00 0.40 H new ATOM 0 HA LYS A 60 -3.808 18.331 0.265 1.00 0.42 H new ATOM 0 HB2 LYS A 60 -3.925 19.131 -2.658 1.00 0.48 H new ATOM 0 HB3 LYS A 60 -5.119 19.602 -1.464 1.00 0.48 H new ATOM 0 HG2 LYS A 60 -3.727 21.457 -1.465 1.00 0.69 H new ATOM 0 HG3 LYS A 60 -3.065 20.540 -0.126 1.00 0.69 H new ATOM 0 HD2 LYS A 60 -1.554 19.475 -2.076 1.00 0.79 H new ATOM 0 HD3 LYS A 60 -1.927 20.993 -2.868 1.00 0.79 H new ATOM 0 HE2 LYS A 60 -1.179 22.141 -0.679 1.00 0.94 H new ATOM 0 HE3 LYS A 60 -0.531 20.582 -0.207 1.00 0.94 H new ATOM 0 HZ1 LYS A 60 1.149 21.946 -1.265 1.00 1.50 H new ATOM 0 HZ2 LYS A 60 0.834 20.573 -2.214 1.00 1.50 H new ATOM 0 HZ3 LYS A 60 0.206 22.083 -2.671 1.00 1.50 H new ATOM 1024 N LEU A 61 -4.870 16.566 -2.344 1.00 0.40 N ATOM 1025 CA LEU A 61 -5.810 15.527 -2.737 1.00 0.40 C ATOM 1026 C LEU A 61 -5.657 14.290 -1.865 1.00 0.37 C ATOM 1027 O LEU A 61 -6.619 13.558 -1.641 1.00 0.42 O ATOM 1028 CB LEU A 61 -5.611 15.160 -4.207 1.00 0.42 C ATOM 1029 CG LEU A 61 -5.750 16.319 -5.195 1.00 0.45 C ATOM 1030 CD1 LEU A 61 -5.492 15.843 -6.616 1.00 0.57 C ATOM 1031 CD2 LEU A 61 -7.131 16.943 -5.084 1.00 0.52 C ATOM 0 H LEU A 61 -4.295 16.924 -3.107 1.00 0.40 H new ATOM 0 HA LEU A 61 -6.819 15.917 -2.601 1.00 0.40 H new ATOM 0 HB2 LEU A 61 -4.620 14.722 -4.324 1.00 0.42 H new ATOM 0 HB3 LEU A 61 -6.334 14.389 -4.473 1.00 0.42 H new ATOM 0 HG LEU A 61 -5.006 17.076 -4.948 1.00 0.45 H new ATOM 0 HD11 LEU A 61 -5.595 16.681 -7.305 1.00 0.57 H new ATOM 0 HD12 LEU A 61 -4.483 15.438 -6.686 1.00 0.57 H new ATOM 0 HD13 LEU A 61 -6.213 15.068 -6.877 1.00 0.57 H new ATOM 0 HD21 LEU A 61 -7.216 17.767 -5.793 1.00 0.52 H new ATOM 0 HD22 LEU A 61 -7.889 16.192 -5.308 1.00 0.52 H new ATOM 0 HD23 LEU A 61 -7.280 17.319 -4.072 1.00 0.52 H new ATOM 1043 N LEU A 62 -4.448 14.067 -1.361 1.00 0.32 N ATOM 1044 CA LEU A 62 -4.173 12.930 -0.501 1.00 0.31 C ATOM 1045 C LEU A 62 -4.902 13.085 0.818 1.00 0.34 C ATOM 1046 O LEU A 62 -5.562 12.164 1.289 1.00 0.36 O ATOM 1047 CB LEU A 62 -2.667 12.816 -0.261 1.00 0.31 C ATOM 1048 CG LEU A 62 -2.244 12.001 0.963 1.00 0.40 C ATOM 1049 CD1 LEU A 62 -1.176 10.993 0.576 1.00 0.65 C ATOM 1050 CD2 LEU A 62 -1.727 12.917 2.063 1.00 0.58 C ATOM 0 H LEU A 62 -3.641 14.665 -1.537 1.00 0.32 H new ATOM 0 HA LEU A 62 -4.525 12.021 -0.989 1.00 0.31 H new ATOM 0 HB2 LEU A 62 -2.211 12.371 -1.145 1.00 0.31 H new ATOM 0 HB3 LEU A 62 -2.257 13.821 -0.163 1.00 0.31 H new ATOM 0 HG LEU A 62 -3.115 11.466 1.340 1.00 0.40 H new ATOM 0 HD11 LEU A 62 -0.882 10.419 1.455 1.00 0.65 H new ATOM 0 HD12 LEU A 62 -1.571 10.318 -0.183 1.00 0.65 H new ATOM 0 HD13 LEU A 62 -0.307 11.518 0.179 1.00 0.65 H new ATOM 0 HD21 LEU A 62 -1.431 12.319 2.925 1.00 0.58 H new ATOM 0 HD22 LEU A 62 -0.866 13.476 1.696 1.00 0.58 H new ATOM 0 HD23 LEU A 62 -2.513 13.613 2.357 1.00 0.58 H new ATOM 1062 N LYS A 63 -4.784 14.258 1.414 1.00 0.37 N ATOM 1063 CA LYS A 63 -5.441 14.517 2.680 1.00 0.43 C ATOM 1064 C LYS A 63 -6.919 14.849 2.479 1.00 0.46 C ATOM 1065 O LYS A 63 -7.656 14.997 3.452 1.00 0.52 O ATOM 1066 CB LYS A 63 -4.741 15.641 3.450 1.00 0.47 C ATOM 1067 CG LYS A 63 -4.713 16.972 2.717 1.00 1.14 C ATOM 1068 CD LYS A 63 -4.844 18.145 3.673 1.00 1.36 C ATOM 1069 CE LYS A 63 -6.237 18.214 4.270 1.00 1.86 C ATOM 1070 NZ LYS A 63 -6.434 19.440 5.084 1.00 2.13 N ATOM 0 H LYS A 63 -4.244 15.040 1.044 1.00 0.37 H new ATOM 0 HA LYS A 63 -5.374 13.605 3.273 1.00 0.43 H new ATOM 0 HB2 LYS A 63 -5.242 15.777 4.408 1.00 0.47 H new ATOM 0 HB3 LYS A 63 -3.717 15.336 3.666 1.00 0.47 H new ATOM 0 HG2 LYS A 63 -3.781 17.060 2.159 1.00 1.14 H new ATOM 0 HG3 LYS A 63 -5.524 17.004 1.990 1.00 1.14 H new ATOM 0 HD2 LYS A 63 -4.108 18.051 4.471 1.00 1.36 H new ATOM 0 HD3 LYS A 63 -4.625 19.073 3.146 1.00 1.36 H new ATOM 0 HE2 LYS A 63 -6.976 18.188 3.469 1.00 1.86 H new ATOM 0 HE3 LYS A 63 -6.409 17.335 4.891 1.00 1.86 H new ATOM 0 HZ1 LYS A 63 -7.398 19.447 5.473 1.00 2.13 H new ATOM 0 HZ2 LYS A 63 -5.746 19.453 5.864 1.00 2.13 H new ATOM 0 HZ3 LYS A 63 -6.296 20.280 4.486 1.00 2.13 H new ATOM 1084 N HIS A 64 -7.354 14.971 1.223 1.00 0.45 N ATOM 1085 CA HIS A 64 -8.755 15.274 0.916 1.00 0.51 C ATOM 1086 C HIS A 64 -9.638 14.046 1.105 1.00 0.38 C ATOM 1087 O HIS A 64 -10.844 14.164 1.311 1.00 0.37 O ATOM 1088 CB HIS A 64 -8.904 15.767 -0.530 1.00 0.69 C ATOM 1089 CG HIS A 64 -8.414 17.163 -0.770 1.00 0.96 C ATOM 1090 ND1 HIS A 64 -8.539 17.763 -2.001 1.00 1.60 N ATOM 1091 CD2 HIS A 64 -7.799 18.021 0.077 1.00 0.76 C ATOM 1092 CE1 HIS A 64 -8.006 18.962 -1.875 1.00 1.71 C ATOM 1093 NE2 HIS A 64 -7.545 19.164 -0.636 1.00 1.18 N ATOM 0 H HIS A 64 -6.758 14.865 0.402 1.00 0.45 H new ATOM 0 HA HIS A 64 -9.071 16.057 1.605 1.00 0.51 H new ATOM 0 HB2 HIS A 64 -8.362 15.088 -1.188 1.00 0.69 H new ATOM 0 HB3 HIS A 64 -9.956 15.712 -0.811 1.00 0.69 H new ATOM 0 HD2 HIS A 64 -7.556 17.840 1.114 1.00 0.76 H new ATOM 0 HE1 HIS A 64 -7.949 19.689 -2.671 1.00 1.71 H new ATOM 0 HE2 HIS A 64 -7.091 20.008 -0.288 1.00 1.18 H new ATOM 1101 N VAL A 65 -9.027 12.872 1.025 1.00 0.36 N ATOM 1102 CA VAL A 65 -9.755 11.614 1.177 1.00 0.35 C ATOM 1103 C VAL A 65 -10.172 11.379 2.631 1.00 0.37 C ATOM 1104 O VAL A 65 -11.153 10.686 2.904 1.00 0.43 O ATOM 1105 CB VAL A 65 -8.939 10.401 0.662 1.00 0.41 C ATOM 1106 CG1 VAL A 65 -8.474 10.631 -0.768 1.00 1.04 C ATOM 1107 CG2 VAL A 65 -7.750 10.100 1.562 1.00 1.09 C ATOM 0 H VAL A 65 -8.027 12.762 0.855 1.00 0.36 H new ATOM 0 HA VAL A 65 -10.652 11.704 0.564 1.00 0.35 H new ATOM 0 HB VAL A 65 -9.600 9.534 0.681 1.00 0.41 H new ATOM 0 HG11 VAL A 65 -7.903 9.767 -1.108 1.00 1.04 H new ATOM 0 HG12 VAL A 65 -9.340 10.771 -1.414 1.00 1.04 H new ATOM 0 HG13 VAL A 65 -7.844 11.520 -0.807 1.00 1.04 H new ATOM 0 HG21 VAL A 65 -7.203 9.243 1.168 1.00 1.09 H new ATOM 0 HG22 VAL A 65 -7.091 10.967 1.596 1.00 1.09 H new ATOM 0 HG23 VAL A 65 -8.103 9.873 2.568 1.00 1.09 H new ATOM 1117 N LEU A 66 -9.413 11.957 3.555 1.00 0.41 N ATOM 1118 CA LEU A 66 -9.664 11.801 4.989 1.00 0.52 C ATOM 1119 C LEU A 66 -11.007 12.400 5.464 1.00 0.51 C ATOM 1120 O LEU A 66 -11.732 11.726 6.194 1.00 0.56 O ATOM 1121 CB LEU A 66 -8.496 12.388 5.792 1.00 0.67 C ATOM 1122 CG LEU A 66 -7.174 11.626 5.658 1.00 0.86 C ATOM 1123 CD1 LEU A 66 -6.088 12.277 6.498 1.00 1.65 C ATOM 1124 CD2 LEU A 66 -7.355 10.169 6.056 1.00 0.83 C ATOM 0 H LEU A 66 -8.609 12.545 3.336 1.00 0.41 H new ATOM 0 HA LEU A 66 -9.742 10.729 5.171 1.00 0.52 H new ATOM 0 HB2 LEU A 66 -8.338 13.419 5.475 1.00 0.67 H new ATOM 0 HB3 LEU A 66 -8.776 12.418 6.845 1.00 0.67 H new ATOM 0 HG LEU A 66 -6.864 11.663 4.614 1.00 0.86 H new ATOM 0 HD11 LEU A 66 -5.158 11.719 6.387 1.00 1.65 H new ATOM 0 HD12 LEU A 66 -5.937 13.304 6.165 1.00 1.65 H new ATOM 0 HD13 LEU A 66 -6.389 12.276 7.546 1.00 1.65 H new ATOM 0 HD21 LEU A 66 -6.405 9.643 5.954 1.00 0.83 H new ATOM 0 HD22 LEU A 66 -7.691 10.114 7.091 1.00 0.83 H new ATOM 0 HD23 LEU A 66 -8.098 9.704 5.408 1.00 0.83 H new ATOM 1136 N PRO A 67 -11.352 13.671 5.108 1.00 0.50 N ATOM 1137 CA PRO A 67 -12.620 14.303 5.524 1.00 0.53 C ATOM 1138 C PRO A 67 -13.837 13.387 5.392 1.00 0.46 C ATOM 1139 O PRO A 67 -14.608 13.231 6.344 1.00 0.54 O ATOM 1140 CB PRO A 67 -12.741 15.492 4.577 1.00 0.58 C ATOM 1141 CG PRO A 67 -11.341 15.876 4.268 1.00 0.68 C ATOM 1142 CD PRO A 67 -10.533 14.606 4.308 1.00 0.55 C ATOM 0 HA PRO A 67 -12.602 14.567 6.581 1.00 0.53 H new ATOM 0 HB2 PRO A 67 -13.286 15.223 3.672 1.00 0.58 H new ATOM 0 HB3 PRO A 67 -13.283 16.315 5.043 1.00 0.58 H new ATOM 0 HG2 PRO A 67 -11.275 16.347 3.287 1.00 0.68 H new ATOM 0 HG3 PRO A 67 -10.967 16.597 4.994 1.00 0.68 H new ATOM 0 HD2 PRO A 67 -10.353 14.218 3.305 1.00 0.55 H new ATOM 0 HD3 PRO A 67 -9.557 14.770 4.766 1.00 0.55 H new ATOM 1150 N ASN A 68 -14.019 12.795 4.216 1.00 0.38 N ATOM 1151 CA ASN A 68 -15.131 11.883 4.010 1.00 0.43 C ATOM 1152 C ASN A 68 -14.786 10.842 2.965 1.00 0.40 C ATOM 1153 O ASN A 68 -14.225 11.160 1.926 1.00 0.35 O ATOM 1154 CB ASN A 68 -16.403 12.627 3.614 1.00 0.53 C ATOM 1155 CG ASN A 68 -17.594 12.193 4.445 1.00 0.99 C ATOM 1156 OD1 ASN A 68 -18.128 11.096 4.265 1.00 1.73 O ATOM 1157 ND2 ASN A 68 -18.025 13.048 5.359 1.00 1.40 N ATOM 0 H ASN A 68 -13.418 12.930 3.403 1.00 0.38 H new ATOM 0 HA ASN A 68 -15.318 11.380 4.959 1.00 0.43 H new ATOM 0 HB2 ASN A 68 -16.248 13.699 3.734 1.00 0.53 H new ATOM 0 HB3 ASN A 68 -16.613 12.451 2.559 1.00 0.53 H new ATOM 0 HD21 ASN A 68 -18.825 12.809 5.944 1.00 1.40 H new ATOM 0 HD22 ASN A 68 -17.557 13.946 5.478 1.00 1.40 H new ATOM 1164 N ILE A 69 -15.124 9.599 3.257 1.00 0.46 N ATOM 1165 CA ILE A 69 -14.863 8.486 2.359 1.00 0.48 C ATOM 1166 C ILE A 69 -16.050 7.528 2.389 1.00 0.58 C ATOM 1167 O ILE A 69 -16.599 7.250 3.456 1.00 0.79 O ATOM 1168 CB ILE A 69 -13.551 7.753 2.736 1.00 0.56 C ATOM 1169 CG1 ILE A 69 -13.344 6.518 1.853 1.00 0.60 C ATOM 1170 CG2 ILE A 69 -13.549 7.368 4.210 1.00 0.70 C ATOM 1171 CD1 ILE A 69 -11.899 6.069 1.775 1.00 0.71 C ATOM 0 H ILE A 69 -15.588 9.331 4.125 1.00 0.46 H new ATOM 0 HA ILE A 69 -14.736 8.871 1.347 1.00 0.48 H new ATOM 0 HB ILE A 69 -12.721 8.438 2.563 1.00 0.56 H new ATOM 0 HG12 ILE A 69 -13.951 5.699 2.239 1.00 0.60 H new ATOM 0 HG13 ILE A 69 -13.704 6.735 0.847 1.00 0.60 H new ATOM 0 HG21 ILE A 69 -12.618 6.855 4.451 1.00 0.70 H new ATOM 0 HG22 ILE A 69 -13.637 8.266 4.821 1.00 0.70 H new ATOM 0 HG23 ILE A 69 -14.391 6.707 4.414 1.00 0.70 H new ATOM 0 HD11 ILE A 69 -11.825 5.191 1.134 1.00 0.71 H new ATOM 0 HD12 ILE A 69 -11.290 6.873 1.361 1.00 0.71 H new ATOM 0 HD13 ILE A 69 -11.541 5.820 2.774 1.00 0.71 H new ATOM 1183 N ARG A 70 -16.473 7.050 1.228 1.00 0.48 N ATOM 1184 CA ARG A 70 -17.598 6.136 1.164 1.00 0.61 C ATOM 1185 C ARG A 70 -17.470 5.162 -0.002 1.00 0.41 C ATOM 1186 O ARG A 70 -16.560 5.259 -0.829 1.00 0.34 O ATOM 1187 CB ARG A 70 -18.921 6.907 1.065 1.00 0.82 C ATOM 1188 CG ARG A 70 -19.115 7.671 -0.239 1.00 1.23 C ATOM 1189 CD ARG A 70 -20.508 8.273 -0.324 1.00 1.41 C ATOM 1190 NE ARG A 70 -20.773 9.214 0.766 1.00 1.74 N ATOM 1191 CZ ARG A 70 -21.817 9.142 1.593 1.00 2.19 C ATOM 1192 NH1 ARG A 70 -22.748 8.205 1.438 1.00 2.55 N ATOM 1193 NH2 ARG A 70 -21.937 10.030 2.569 1.00 2.92 N ATOM 0 H ARG A 70 -16.057 7.279 0.325 1.00 0.48 H new ATOM 0 HA ARG A 70 -17.595 5.556 2.087 1.00 0.61 H new ATOM 0 HB2 ARG A 70 -19.746 6.204 1.185 1.00 0.82 H new ATOM 0 HB3 ARG A 70 -18.979 7.611 1.895 1.00 0.82 H new ATOM 0 HG2 ARG A 70 -18.369 8.462 -0.314 1.00 1.23 H new ATOM 0 HG3 ARG A 70 -18.954 7.001 -1.083 1.00 1.23 H new ATOM 0 HD2 ARG A 70 -20.623 8.785 -1.279 1.00 1.41 H new ATOM 0 HD3 ARG A 70 -21.249 7.474 -0.300 1.00 1.41 H new ATOM 0 HE ARG A 70 -20.112 9.979 0.903 1.00 1.74 H new ATOM 0 HH11 ARG A 70 -22.669 7.529 0.679 1.00 2.55 H new ATOM 0 HH12 ARG A 70 -23.541 8.163 2.079 1.00 2.55 H new ATOM 0 HH21 ARG A 70 -21.234 10.761 2.683 1.00 2.92 H new ATOM 0 HH22 ARG A 70 -22.732 9.983 3.206 1.00 2.92 H new ATOM 1207 N ILE A 71 -18.383 4.205 -0.038 1.00 0.62 N ATOM 1208 CA ILE A 71 -18.418 3.205 -1.088 1.00 0.48 C ATOM 1209 C ILE A 71 -19.842 3.100 -1.616 1.00 0.45 C ATOM 1210 O ILE A 71 -20.799 3.295 -0.865 1.00 0.58 O ATOM 1211 CB ILE A 71 -17.938 1.821 -0.594 1.00 0.56 C ATOM 1212 CG1 ILE A 71 -16.685 1.959 0.271 1.00 0.96 C ATOM 1213 CG2 ILE A 71 -17.652 0.916 -1.781 1.00 0.76 C ATOM 1214 CD1 ILE A 71 -16.220 0.653 0.881 1.00 1.09 C ATOM 0 H ILE A 71 -19.119 4.101 0.660 1.00 0.62 H new ATOM 0 HA ILE A 71 -17.736 3.517 -1.879 1.00 0.48 H new ATOM 0 HB ILE A 71 -18.729 1.379 0.012 1.00 0.56 H new ATOM 0 HG12 ILE A 71 -15.880 2.374 -0.335 1.00 0.96 H new ATOM 0 HG13 ILE A 71 -16.883 2.673 1.070 1.00 0.96 H new ATOM 0 HG21 ILE A 71 -17.314 -0.057 -1.424 1.00 0.76 H new ATOM 0 HG22 ILE A 71 -18.560 0.791 -2.370 1.00 0.76 H new ATOM 0 HG23 ILE A 71 -16.876 1.364 -2.401 1.00 0.76 H new ATOM 0 HD11 ILE A 71 -15.327 0.829 1.481 1.00 1.09 H new ATOM 0 HD12 ILE A 71 -17.008 0.246 1.514 1.00 1.09 H new ATOM 0 HD13 ILE A 71 -15.990 -0.058 0.087 1.00 1.09 H new ATOM 1226 N LYS A 72 -19.984 2.802 -2.896 1.00 0.38 N ATOM 1227 CA LYS A 72 -21.301 2.714 -3.517 1.00 0.47 C ATOM 1228 C LYS A 72 -22.090 1.475 -3.074 1.00 0.43 C ATOM 1229 O LYS A 72 -21.784 0.353 -3.486 1.00 0.49 O ATOM 1230 CB LYS A 72 -21.168 2.711 -5.041 1.00 0.64 C ATOM 1231 CG LYS A 72 -20.557 3.983 -5.611 1.00 0.87 C ATOM 1232 CD LYS A 72 -20.848 4.122 -7.098 1.00 1.57 C ATOM 1233 CE LYS A 72 -22.319 4.427 -7.355 1.00 1.96 C ATOM 1234 NZ LYS A 72 -22.669 4.325 -8.795 1.00 2.63 N ATOM 0 H LYS A 72 -19.205 2.616 -3.528 1.00 0.38 H new ATOM 0 HA LYS A 72 -21.858 3.591 -3.187 1.00 0.47 H new ATOM 0 HB2 LYS A 72 -20.556 1.860 -5.340 1.00 0.64 H new ATOM 0 HB3 LYS A 72 -22.154 2.565 -5.481 1.00 0.64 H new ATOM 0 HG2 LYS A 72 -20.953 4.848 -5.079 1.00 0.87 H new ATOM 0 HG3 LYS A 72 -19.479 3.975 -5.449 1.00 0.87 H new ATOM 0 HD2 LYS A 72 -20.232 4.918 -7.517 1.00 1.57 H new ATOM 0 HD3 LYS A 72 -20.572 3.201 -7.611 1.00 1.57 H new ATOM 0 HE2 LYS A 72 -22.937 3.736 -6.783 1.00 1.96 H new ATOM 0 HE3 LYS A 72 -22.548 5.431 -6.997 1.00 1.96 H new ATOM 0 HZ1 LYS A 72 -23.678 4.540 -8.923 1.00 2.63 H new ATOM 0 HZ2 LYS A 72 -22.099 5.003 -9.340 1.00 2.63 H new ATOM 0 HZ3 LYS A 72 -22.475 3.360 -9.132 1.00 2.63 H new ATOM 1248 N GLY A 73 -23.111 1.687 -2.238 1.00 0.46 N ATOM 1249 CA GLY A 73 -23.965 0.595 -1.791 1.00 0.53 C ATOM 1250 C GLY A 73 -23.272 -0.447 -0.928 1.00 0.47 C ATOM 1251 O GLY A 73 -23.628 -1.627 -0.979 1.00 0.52 O ATOM 0 H GLY A 73 -23.361 2.601 -1.862 1.00 0.46 H new ATOM 0 HA2 GLY A 73 -24.801 1.013 -1.230 1.00 0.53 H new ATOM 0 HA3 GLY A 73 -24.385 0.100 -2.666 1.00 0.53 H new ATOM 1255 N LEU A 74 -22.284 -0.035 -0.146 1.00 0.40 N ATOM 1256 CA LEU A 74 -21.550 -0.973 0.701 1.00 0.36 C ATOM 1257 C LEU A 74 -21.555 -0.545 2.169 1.00 0.34 C ATOM 1258 O LEU A 74 -21.815 0.617 2.484 1.00 0.35 O ATOM 1259 CB LEU A 74 -20.106 -1.066 0.223 1.00 0.38 C ATOM 1260 CG LEU A 74 -19.759 -2.284 -0.624 1.00 0.47 C ATOM 1261 CD1 LEU A 74 -20.147 -2.062 -2.075 1.00 0.70 C ATOM 1262 CD2 LEU A 74 -18.281 -2.578 -0.505 1.00 0.56 C ATOM 0 H LEU A 74 -21.972 0.934 -0.078 1.00 0.40 H new ATOM 0 HA LEU A 74 -22.047 -1.940 0.626 1.00 0.36 H new ATOM 0 HB2 LEU A 74 -19.877 -0.170 -0.354 1.00 0.38 H new ATOM 0 HB3 LEU A 74 -19.454 -1.058 1.096 1.00 0.38 H new ATOM 0 HG LEU A 74 -20.323 -3.141 -0.258 1.00 0.47 H new ATOM 0 HD11 LEU A 74 -19.889 -2.945 -2.660 1.00 0.70 H new ATOM 0 HD12 LEU A 74 -21.220 -1.883 -2.141 1.00 0.70 H new ATOM 0 HD13 LEU A 74 -19.610 -1.198 -2.467 1.00 0.70 H new ATOM 0 HD21 LEU A 74 -18.033 -3.449 -1.111 1.00 0.56 H new ATOM 0 HD22 LEU A 74 -17.710 -1.718 -0.855 1.00 0.56 H new ATOM 0 HD23 LEU A 74 -18.033 -2.779 0.537 1.00 0.56 H new ATOM 1274 N SER A 75 -21.267 -1.493 3.069 1.00 0.33 N ATOM 1275 CA SER A 75 -21.187 -1.183 4.492 1.00 0.33 C ATOM 1276 C SER A 75 -19.715 -1.090 4.871 1.00 0.31 C ATOM 1277 O SER A 75 -18.947 -1.997 4.555 1.00 0.35 O ATOM 1278 CB SER A 75 -21.885 -2.262 5.328 1.00 0.37 C ATOM 1279 OG SER A 75 -22.893 -2.918 4.577 1.00 0.99 O ATOM 0 H SER A 75 -21.088 -2.470 2.836 1.00 0.33 H new ATOM 0 HA SER A 75 -21.691 -0.238 4.693 1.00 0.33 H new ATOM 0 HB2 SER A 75 -21.151 -2.991 5.672 1.00 0.37 H new ATOM 0 HB3 SER A 75 -22.326 -1.810 6.216 1.00 0.37 H new ATOM 0 HG SER A 75 -22.523 -3.730 4.172 1.00 0.99 H new ATOM 1285 N PHE A 76 -19.309 -0.008 5.519 1.00 0.32 N ATOM 1286 CA PHE A 76 -17.907 0.159 5.873 1.00 0.31 C ATOM 1287 C PHE A 76 -17.732 0.885 7.203 1.00 0.32 C ATOM 1288 O PHE A 76 -18.616 1.614 7.654 1.00 0.38 O ATOM 1289 CB PHE A 76 -17.170 0.917 4.763 1.00 0.32 C ATOM 1290 CG PHE A 76 -17.931 2.107 4.252 1.00 0.35 C ATOM 1291 CD1 PHE A 76 -18.867 1.957 3.245 1.00 1.24 C ATOM 1292 CD2 PHE A 76 -17.724 3.364 4.790 1.00 1.26 C ATOM 1293 CE1 PHE A 76 -19.584 3.040 2.782 1.00 1.28 C ATOM 1294 CE2 PHE A 76 -18.439 4.451 4.332 1.00 1.29 C ATOM 1295 CZ PHE A 76 -19.371 4.289 3.327 1.00 0.53 C ATOM 0 H PHE A 76 -19.919 0.757 5.807 1.00 0.32 H new ATOM 0 HA PHE A 76 -17.479 -0.837 5.984 1.00 0.31 H new ATOM 0 HB2 PHE A 76 -16.202 1.247 5.139 1.00 0.32 H new ATOM 0 HB3 PHE A 76 -16.975 0.236 3.935 1.00 0.32 H new ATOM 0 HD1 PHE A 76 -19.038 0.981 2.816 1.00 1.24 H new ATOM 0 HD2 PHE A 76 -16.996 3.496 5.576 1.00 1.26 H new ATOM 0 HE1 PHE A 76 -20.311 2.910 1.994 1.00 1.28 H new ATOM 0 HE2 PHE A 76 -18.270 5.428 4.760 1.00 1.29 H new ATOM 0 HZ PHE A 76 -19.933 5.139 2.968 1.00 0.53 H new ATOM 1305 N SER A 77 -16.582 0.665 7.820 1.00 0.30 N ATOM 1306 CA SER A 77 -16.242 1.289 9.091 1.00 0.32 C ATOM 1307 C SER A 77 -14.892 1.983 8.944 1.00 0.30 C ATOM 1308 O SER A 77 -13.992 1.437 8.307 1.00 0.29 O ATOM 1309 CB SER A 77 -16.194 0.230 10.187 1.00 0.36 C ATOM 1310 OG SER A 77 -17.192 -0.756 9.967 1.00 1.18 O ATOM 0 H SER A 77 -15.857 0.048 7.454 1.00 0.30 H new ATOM 0 HA SER A 77 -16.996 2.026 9.367 1.00 0.32 H new ATOM 0 HB2 SER A 77 -15.210 -0.238 10.207 1.00 0.36 H new ATOM 0 HB3 SER A 77 -16.344 0.698 11.160 1.00 0.36 H new ATOM 0 HG SER A 77 -17.148 -1.430 10.677 1.00 1.18 H new ATOM 1316 N VAL A 78 -14.742 3.161 9.548 1.00 0.32 N ATOM 1317 CA VAL A 78 -13.511 3.936 9.414 1.00 0.33 C ATOM 1318 C VAL A 78 -12.675 3.915 10.701 1.00 0.34 C ATOM 1319 O VAL A 78 -13.075 4.484 11.719 1.00 0.38 O ATOM 1320 CB VAL A 78 -13.814 5.406 9.050 1.00 0.38 C ATOM 1321 CG1 VAL A 78 -12.530 6.157 8.736 1.00 0.41 C ATOM 1322 CG2 VAL A 78 -14.786 5.482 7.880 1.00 0.40 C ATOM 0 H VAL A 78 -15.455 3.598 10.132 1.00 0.32 H new ATOM 0 HA VAL A 78 -12.941 3.466 8.613 1.00 0.33 H new ATOM 0 HB VAL A 78 -14.283 5.881 9.911 1.00 0.38 H new ATOM 0 HG11 VAL A 78 -12.766 7.190 8.482 1.00 0.41 H new ATOM 0 HG12 VAL A 78 -11.875 6.138 9.607 1.00 0.41 H new ATOM 0 HG13 VAL A 78 -12.027 5.682 7.893 1.00 0.41 H new ATOM 0 HG21 VAL A 78 -14.986 6.526 7.640 1.00 0.40 H new ATOM 0 HG22 VAL A 78 -14.350 4.987 7.012 1.00 0.40 H new ATOM 0 HG23 VAL A 78 -15.719 4.987 8.149 1.00 0.40 H new ATOM 1332 N LYS A 79 -11.524 3.267 10.645 1.00 0.32 N ATOM 1333 CA LYS A 79 -10.617 3.186 11.783 1.00 0.34 C ATOM 1334 C LYS A 79 -9.258 3.742 11.384 1.00 0.34 C ATOM 1335 O LYS A 79 -8.950 3.837 10.196 1.00 0.33 O ATOM 1336 CB LYS A 79 -10.479 1.742 12.277 1.00 0.35 C ATOM 1337 CG LYS A 79 -11.136 1.490 13.627 1.00 0.48 C ATOM 1338 CD LYS A 79 -12.651 1.586 13.550 1.00 0.69 C ATOM 1339 CE LYS A 79 -13.181 2.680 14.460 1.00 0.89 C ATOM 1340 NZ LYS A 79 -12.859 2.429 15.890 1.00 1.48 N ATOM 0 H LYS A 79 -11.190 2.782 9.812 1.00 0.32 H new ATOM 0 HA LYS A 79 -11.027 3.778 12.601 1.00 0.34 H new ATOM 0 HB2 LYS A 79 -10.918 1.071 11.539 1.00 0.35 H new ATOM 0 HB3 LYS A 79 -9.421 1.491 12.346 1.00 0.35 H new ATOM 0 HG2 LYS A 79 -10.853 0.501 13.989 1.00 0.48 H new ATOM 0 HG3 LYS A 79 -10.763 2.213 14.352 1.00 0.48 H new ATOM 0 HD2 LYS A 79 -12.953 1.787 12.522 1.00 0.69 H new ATOM 0 HD3 LYS A 79 -13.093 0.630 13.831 1.00 0.69 H new ATOM 0 HE2 LYS A 79 -12.758 3.638 14.157 1.00 0.89 H new ATOM 0 HE3 LYS A 79 -14.262 2.757 14.341 1.00 0.89 H new ATOM 0 HZ1 LYS A 79 -13.543 2.929 16.493 1.00 1.48 H new ATOM 0 HZ2 LYS A 79 -12.909 1.408 16.083 1.00 1.48 H new ATOM 0 HZ3 LYS A 79 -11.900 2.774 16.096 1.00 1.48 H new ATOM 1354 N VAL A 80 -8.444 4.115 12.357 1.00 0.38 N ATOM 1355 CA VAL A 80 -7.130 4.656 12.058 1.00 0.40 C ATOM 1356 C VAL A 80 -6.040 3.663 12.454 1.00 0.41 C ATOM 1357 O VAL A 80 -6.275 2.779 13.276 1.00 0.43 O ATOM 1358 CB VAL A 80 -6.885 6.012 12.753 1.00 0.48 C ATOM 1359 CG1 VAL A 80 -6.206 6.970 11.793 1.00 1.43 C ATOM 1360 CG2 VAL A 80 -8.185 6.612 13.273 1.00 1.30 C ATOM 0 H VAL A 80 -8.667 4.054 13.351 1.00 0.38 H new ATOM 0 HA VAL A 80 -7.092 4.826 10.982 1.00 0.40 H new ATOM 0 HB VAL A 80 -6.233 5.842 13.610 1.00 0.48 H new ATOM 0 HG11 VAL A 80 -6.036 7.925 12.291 1.00 1.43 H new ATOM 0 HG12 VAL A 80 -5.251 6.551 11.476 1.00 1.43 H new ATOM 0 HG13 VAL A 80 -6.842 7.123 10.921 1.00 1.43 H new ATOM 0 HG21 VAL A 80 -7.977 7.566 13.757 1.00 1.30 H new ATOM 0 HG22 VAL A 80 -8.872 6.769 12.441 1.00 1.30 H new ATOM 0 HG23 VAL A 80 -8.638 5.931 13.994 1.00 1.30 H new ATOM 1370 N CYS A 81 -4.861 3.801 11.860 1.00 0.42 N ATOM 1371 CA CYS A 81 -3.754 2.900 12.144 1.00 0.46 C ATOM 1372 C CYS A 81 -2.420 3.645 12.183 1.00 0.49 C ATOM 1373 O CYS A 81 -2.057 4.348 11.242 1.00 0.45 O ATOM 1374 CB CYS A 81 -3.687 1.807 11.073 1.00 0.47 C ATOM 1375 SG CYS A 81 -2.891 0.276 11.613 1.00 0.89 S ATOM 0 H CYS A 81 -4.648 4.529 11.178 1.00 0.42 H new ATOM 0 HA CYS A 81 -3.930 2.457 13.124 1.00 0.46 H new ATOM 0 HB2 CYS A 81 -4.700 1.578 10.742 1.00 0.47 H new ATOM 0 HB3 CYS A 81 -3.149 2.196 10.208 1.00 0.47 H new ATOM 0 HG CYS A 81 -2.889 -0.580 10.635 1.00 0.89 H new ATOM 1381 N GLY A 82 -1.698 3.501 13.274 1.00 0.67 N ATOM 1382 CA GLY A 82 -0.407 4.138 13.382 1.00 0.76 C ATOM 1383 C GLY A 82 -0.476 5.644 13.367 1.00 0.76 C ATOM 1384 O GLY A 82 -1.332 6.250 14.016 1.00 0.88 O ATOM 0 H GLY A 82 -1.980 2.955 14.088 1.00 0.67 H new ATOM 0 HA2 GLY A 82 0.073 3.813 14.305 1.00 0.76 H new ATOM 0 HA3 GLY A 82 0.225 3.803 12.559 1.00 0.76 H new ATOM 1388 N GLU A 83 0.440 6.236 12.629 1.00 0.76 N ATOM 1389 CA GLU A 83 0.540 7.672 12.521 1.00 0.82 C ATOM 1390 C GLU A 83 -0.243 8.221 11.323 1.00 0.69 C ATOM 1391 O GLU A 83 -0.964 9.211 11.444 1.00 0.89 O ATOM 1392 CB GLU A 83 2.020 8.053 12.400 1.00 1.01 C ATOM 1393 CG GLU A 83 2.935 7.235 13.302 1.00 1.35 C ATOM 1394 CD GLU A 83 3.612 6.086 12.568 1.00 1.90 C ATOM 1395 OE1 GLU A 83 2.909 5.121 12.177 1.00 2.50 O ATOM 1396 OE2 GLU A 83 4.840 6.137 12.380 1.00 2.46 O ATOM 0 H GLU A 83 1.139 5.729 12.085 1.00 0.76 H new ATOM 0 HA GLU A 83 0.101 8.114 13.416 1.00 0.82 H new ATOM 0 HB2 GLU A 83 2.336 7.926 11.365 1.00 1.01 H new ATOM 0 HB3 GLU A 83 2.136 9.110 12.641 1.00 1.01 H new ATOM 0 HG2 GLU A 83 3.697 7.888 13.727 1.00 1.35 H new ATOM 0 HG3 GLU A 83 2.356 6.837 14.135 1.00 1.35 H new ATOM 1403 N ARG A 84 -0.095 7.587 10.165 1.00 0.58 N ATOM 1404 CA ARG A 84 -0.762 8.052 8.947 1.00 0.72 C ATOM 1405 C ARG A 84 -1.535 6.943 8.222 1.00 0.64 C ATOM 1406 O ARG A 84 -2.066 7.162 7.134 1.00 0.81 O ATOM 1407 CB ARG A 84 0.290 8.624 8.005 1.00 0.98 C ATOM 1408 CG ARG A 84 1.196 9.653 8.657 1.00 1.09 C ATOM 1409 CD ARG A 84 0.623 11.060 8.554 1.00 1.37 C ATOM 1410 NE ARG A 84 -0.663 11.197 9.239 1.00 1.46 N ATOM 1411 CZ ARG A 84 -1.612 12.066 8.879 1.00 2.05 C ATOM 1412 NH1 ARG A 84 -1.412 12.891 7.856 1.00 2.51 N ATOM 1413 NH2 ARG A 84 -2.759 12.120 9.548 1.00 2.36 N ATOM 0 H ARG A 84 0.478 6.752 10.041 1.00 0.58 H new ATOM 0 HA ARG A 84 -1.491 8.807 9.241 1.00 0.72 H new ATOM 0 HB2 ARG A 84 0.901 7.808 7.618 1.00 0.98 H new ATOM 0 HB3 ARG A 84 -0.210 9.081 7.151 1.00 0.98 H new ATOM 0 HG2 ARG A 84 1.341 9.396 9.706 1.00 1.09 H new ATOM 0 HG3 ARG A 84 2.177 9.625 8.183 1.00 1.09 H new ATOM 0 HD2 ARG A 84 1.334 11.769 8.978 1.00 1.37 H new ATOM 0 HD3 ARG A 84 0.500 11.322 7.503 1.00 1.37 H new ATOM 0 HE ARG A 84 -0.846 10.592 10.040 1.00 1.46 H new ATOM 0 HH11 ARG A 84 -0.531 12.862 7.342 1.00 2.51 H new ATOM 0 HH12 ARG A 84 -2.139 13.553 7.585 1.00 2.51 H new ATOM 0 HH21 ARG A 84 -2.918 11.497 10.340 1.00 2.36 H new ATOM 0 HH22 ARG A 84 -3.481 12.785 9.270 1.00 2.36 H new ATOM 1427 N LYS A 85 -1.600 5.769 8.818 1.00 0.46 N ATOM 1428 CA LYS A 85 -2.296 4.628 8.212 1.00 0.41 C ATOM 1429 C LYS A 85 -3.755 4.565 8.663 1.00 0.38 C ATOM 1430 O LYS A 85 -4.112 5.108 9.705 1.00 0.39 O ATOM 1431 CB LYS A 85 -1.569 3.313 8.530 1.00 0.42 C ATOM 1432 CG LYS A 85 -0.131 3.267 8.043 1.00 0.55 C ATOM 1433 CD LYS A 85 0.719 2.365 8.920 1.00 0.88 C ATOM 1434 CE LYS A 85 1.430 1.296 8.112 1.00 1.17 C ATOM 1435 NZ LYS A 85 2.235 0.402 8.983 1.00 1.22 N ATOM 0 H LYS A 85 -1.180 5.570 9.726 1.00 0.46 H new ATOM 0 HA LYS A 85 -2.288 4.770 7.131 1.00 0.41 H new ATOM 0 HB2 LYS A 85 -1.582 3.155 9.608 1.00 0.42 H new ATOM 0 HB3 LYS A 85 -2.120 2.487 8.080 1.00 0.42 H new ATOM 0 HG2 LYS A 85 -0.104 2.908 7.014 1.00 0.55 H new ATOM 0 HG3 LYS A 85 0.287 4.274 8.040 1.00 0.55 H new ATOM 0 HD2 LYS A 85 1.455 2.966 9.453 1.00 0.88 H new ATOM 0 HD3 LYS A 85 0.088 1.892 9.673 1.00 0.88 H new ATOM 0 HE2 LYS A 85 0.697 0.706 7.562 1.00 1.17 H new ATOM 0 HE3 LYS A 85 2.079 1.767 7.374 1.00 1.17 H new ATOM 0 HZ1 LYS A 85 2.875 -0.171 8.396 1.00 1.22 H new ATOM 0 HZ2 LYS A 85 2.794 0.975 9.647 1.00 1.22 H new ATOM 0 HZ3 LYS A 85 1.601 -0.226 9.517 1.00 1.22 H new ATOM 1449 N CYS A 86 -4.604 3.958 7.845 1.00 0.36 N ATOM 1450 CA CYS A 86 -6.022 3.831 8.177 1.00 0.34 C ATOM 1451 C CYS A 86 -6.492 2.385 8.000 1.00 0.32 C ATOM 1452 O CYS A 86 -5.921 1.632 7.213 1.00 0.32 O ATOM 1453 CB CYS A 86 -6.876 4.774 7.333 1.00 0.38 C ATOM 1454 SG CYS A 86 -6.678 6.525 7.748 1.00 1.14 S ATOM 0 H CYS A 86 -4.340 3.546 6.950 1.00 0.36 H new ATOM 0 HA CYS A 86 -6.143 4.112 9.223 1.00 0.34 H new ATOM 0 HB2 CYS A 86 -6.625 4.631 6.282 1.00 0.38 H new ATOM 0 HB3 CYS A 86 -7.924 4.500 7.451 1.00 0.38 H new ATOM 0 HG CYS A 86 -7.440 7.243 6.977 1.00 1.14 H new ATOM 1460 N VAL A 87 -7.538 2.015 8.734 1.00 0.32 N ATOM 1461 CA VAL A 87 -8.099 0.667 8.664 1.00 0.34 C ATOM 1462 C VAL A 87 -9.592 0.760 8.417 1.00 0.32 C ATOM 1463 O VAL A 87 -10.299 1.456 9.137 1.00 0.36 O ATOM 1464 CB VAL A 87 -7.895 -0.144 9.963 1.00 0.40 C ATOM 1465 CG1 VAL A 87 -8.358 -1.584 9.781 1.00 0.80 C ATOM 1466 CG2 VAL A 87 -6.452 -0.113 10.422 1.00 0.95 C ATOM 0 H VAL A 87 -8.017 2.634 9.388 1.00 0.32 H new ATOM 0 HA VAL A 87 -7.577 0.156 7.855 1.00 0.34 H new ATOM 0 HB VAL A 87 -8.503 0.326 10.736 1.00 0.40 H new ATOM 0 HG11 VAL A 87 -8.205 -2.136 10.709 1.00 0.80 H new ATOM 0 HG12 VAL A 87 -9.417 -1.596 9.523 1.00 0.80 H new ATOM 0 HG13 VAL A 87 -7.784 -2.052 8.981 1.00 0.80 H new ATOM 0 HG21 VAL A 87 -6.349 -0.694 11.338 1.00 0.95 H new ATOM 0 HG22 VAL A 87 -5.815 -0.540 9.648 1.00 0.95 H new ATOM 0 HG23 VAL A 87 -6.152 0.918 10.611 1.00 0.95 H new ATOM 1476 N LEU A 88 -10.077 0.073 7.414 1.00 0.30 N ATOM 1477 CA LEU A 88 -11.495 0.099 7.127 1.00 0.31 C ATOM 1478 C LEU A 88 -12.058 -1.306 7.115 1.00 0.30 C ATOM 1479 O LEU A 88 -11.357 -2.271 6.823 1.00 0.33 O ATOM 1480 CB LEU A 88 -11.783 0.822 5.809 1.00 0.33 C ATOM 1481 CG LEU A 88 -12.367 2.230 5.976 1.00 0.43 C ATOM 1482 CD1 LEU A 88 -11.319 3.196 6.506 1.00 0.89 C ATOM 1483 CD2 LEU A 88 -12.942 2.739 4.671 1.00 0.48 C ATOM 0 H LEU A 88 -9.520 -0.507 6.786 1.00 0.30 H new ATOM 0 HA LEU A 88 -11.991 0.659 7.920 1.00 0.31 H new ATOM 0 HB2 LEU A 88 -10.858 0.891 5.236 1.00 0.33 H new ATOM 0 HB3 LEU A 88 -12.477 0.221 5.222 1.00 0.33 H new ATOM 0 HG LEU A 88 -13.175 2.168 6.705 1.00 0.43 H new ATOM 0 HD11 LEU A 88 -11.760 4.187 6.615 1.00 0.89 H new ATOM 0 HD12 LEU A 88 -10.962 2.849 7.476 1.00 0.89 H new ATOM 0 HD13 LEU A 88 -10.483 3.245 5.808 1.00 0.89 H new ATOM 0 HD21 LEU A 88 -13.349 3.739 4.818 1.00 0.48 H new ATOM 0 HD22 LEU A 88 -12.156 2.775 3.917 1.00 0.48 H new ATOM 0 HD23 LEU A 88 -13.735 2.070 4.337 1.00 0.48 H new ATOM 1495 N PHE A 89 -13.318 -1.422 7.459 1.00 0.30 N ATOM 1496 CA PHE A 89 -13.982 -2.705 7.483 1.00 0.31 C ATOM 1497 C PHE A 89 -15.103 -2.673 6.472 1.00 0.30 C ATOM 1498 O PHE A 89 -15.797 -1.668 6.372 1.00 0.30 O ATOM 1499 CB PHE A 89 -14.533 -2.983 8.880 1.00 0.34 C ATOM 1500 CG PHE A 89 -13.467 -3.129 9.928 1.00 0.89 C ATOM 1501 CD1 PHE A 89 -12.520 -4.134 9.833 1.00 1.75 C ATOM 1502 CD2 PHE A 89 -13.412 -2.261 11.008 1.00 1.75 C ATOM 1503 CE1 PHE A 89 -11.537 -4.272 10.792 1.00 2.42 C ATOM 1504 CE2 PHE A 89 -12.431 -2.394 11.971 1.00 2.40 C ATOM 1505 CZ PHE A 89 -11.493 -3.402 11.863 1.00 2.50 C ATOM 0 H PHE A 89 -13.910 -0.636 7.729 1.00 0.30 H new ATOM 0 HA PHE A 89 -13.279 -3.499 7.233 1.00 0.31 H new ATOM 0 HB2 PHE A 89 -15.203 -2.172 9.165 1.00 0.34 H new ATOM 0 HB3 PHE A 89 -15.130 -3.894 8.851 1.00 0.34 H new ATOM 0 HD1 PHE A 89 -12.551 -4.819 8.998 1.00 1.75 H new ATOM 0 HD2 PHE A 89 -14.144 -1.472 11.097 1.00 1.75 H new ATOM 0 HE1 PHE A 89 -10.803 -5.060 10.705 1.00 2.42 H new ATOM 0 HE2 PHE A 89 -12.397 -1.711 12.807 1.00 2.40 H new ATOM 0 HZ PHE A 89 -10.726 -3.509 12.616 1.00 2.50 H new ATOM 1515 N ILE A 90 -15.285 -3.741 5.721 1.00 0.30 N ATOM 1516 CA ILE A 90 -16.343 -3.760 4.722 1.00 0.31 C ATOM 1517 C ILE A 90 -17.266 -4.936 4.944 1.00 0.31 C ATOM 1518 O ILE A 90 -16.815 -6.045 5.212 1.00 0.33 O ATOM 1519 CB ILE A 90 -15.797 -3.806 3.282 1.00 0.32 C ATOM 1520 CG1 ILE A 90 -14.530 -4.661 3.211 1.00 0.39 C ATOM 1521 CG2 ILE A 90 -15.534 -2.394 2.776 1.00 0.37 C ATOM 1522 CD1 ILE A 90 -14.077 -4.976 1.804 1.00 0.48 C ATOM 0 H ILE A 90 -14.728 -4.593 5.778 1.00 0.30 H new ATOM 0 HA ILE A 90 -16.895 -2.828 4.841 1.00 0.31 H new ATOM 0 HB ILE A 90 -16.546 -4.267 2.638 1.00 0.32 H new ATOM 0 HG12 ILE A 90 -13.725 -4.143 3.733 1.00 0.39 H new ATOM 0 HG13 ILE A 90 -14.705 -5.596 3.743 1.00 0.39 H new ATOM 0 HG21 ILE A 90 -15.148 -2.438 1.757 1.00 0.37 H new ATOM 0 HG22 ILE A 90 -16.463 -1.824 2.788 1.00 0.37 H new ATOM 0 HG23 ILE A 90 -14.802 -1.907 3.420 1.00 0.37 H new ATOM 0 HD11 ILE A 90 -13.174 -5.585 1.840 1.00 0.48 H new ATOM 0 HD12 ILE A 90 -14.863 -5.523 1.283 1.00 0.48 H new ATOM 0 HD13 ILE A 90 -13.868 -4.048 1.273 1.00 0.48 H new ATOM 1534 N GLU A 91 -18.559 -4.684 4.850 1.00 0.31 N ATOM 1535 CA GLU A 91 -19.554 -5.721 5.056 1.00 0.34 C ATOM 1536 C GLU A 91 -20.598 -5.705 3.947 1.00 0.38 C ATOM 1537 O GLU A 91 -21.136 -4.639 3.585 1.00 0.41 O ATOM 1538 CB GLU A 91 -20.238 -5.540 6.417 1.00 0.39 C ATOM 1539 CG GLU A 91 -19.344 -4.896 7.470 1.00 1.34 C ATOM 1540 CD GLU A 91 -20.068 -4.606 8.770 1.00 1.32 C ATOM 1541 OE1 GLU A 91 -20.905 -5.430 9.193 1.00 1.74 O ATOM 1542 OE2 GLU A 91 -19.802 -3.547 9.380 1.00 1.72 O ATOM 0 H GLU A 91 -18.946 -3.766 4.631 1.00 0.31 H new ATOM 0 HA GLU A 91 -19.044 -6.684 5.036 1.00 0.34 H new ATOM 0 HB2 GLU A 91 -21.130 -4.928 6.287 1.00 0.39 H new ATOM 0 HB3 GLU A 91 -20.569 -6.513 6.780 1.00 0.39 H new ATOM 0 HG2 GLU A 91 -18.498 -5.554 7.671 1.00 1.34 H new ATOM 0 HG3 GLU A 91 -18.937 -3.966 7.073 1.00 1.34 H new ATOM 1549 N TRP A 92 -20.819 -6.884 3.368 1.00 0.41 N ATOM 1550 CA TRP A 92 -21.808 -7.072 2.308 1.00 0.51 C ATOM 1551 C TRP A 92 -22.033 -8.562 2.076 1.00 0.52 C ATOM 1552 O TRP A 92 -21.142 -9.364 2.358 1.00 0.50 O ATOM 1553 CB TRP A 92 -21.432 -6.346 1.012 1.00 0.66 C ATOM 1554 CG TRP A 92 -19.974 -6.337 0.715 1.00 0.82 C ATOM 1555 CD1 TRP A 92 -19.111 -5.302 0.891 1.00 1.79 C ATOM 1556 CD2 TRP A 92 -19.210 -7.412 0.184 1.00 0.89 C ATOM 1557 NE1 TRP A 92 -17.854 -5.665 0.482 1.00 1.87 N ATOM 1558 CE2 TRP A 92 -17.890 -6.959 0.047 1.00 1.04 C ATOM 1559 CE3 TRP A 92 -19.519 -8.714 -0.188 1.00 1.87 C ATOM 1560 CZ2 TRP A 92 -16.879 -7.764 -0.454 1.00 1.14 C ATOM 1561 CZ3 TRP A 92 -18.522 -9.515 -0.681 1.00 2.35 C ATOM 1562 CH2 TRP A 92 -17.212 -9.043 -0.814 1.00 1.76 C ATOM 0 H TRP A 92 -20.318 -7.736 3.620 1.00 0.41 H new ATOM 0 HA TRP A 92 -22.743 -6.619 2.638 1.00 0.51 H new ATOM 0 HB2 TRP A 92 -21.957 -6.816 0.181 1.00 0.66 H new ATOM 0 HB3 TRP A 92 -21.785 -5.316 1.071 1.00 0.66 H new ATOM 0 HD1 TRP A 92 -19.376 -4.336 1.294 1.00 1.79 H new ATOM 0 HE1 TRP A 92 -17.028 -5.067 0.500 1.00 1.87 H new ATOM 0 HE3 TRP A 92 -20.527 -9.089 -0.091 1.00 1.87 H new ATOM 0 HZ2 TRP A 92 -15.868 -7.397 -0.557 1.00 1.14 H new ATOM 0 HZ3 TRP A 92 -18.752 -10.529 -0.972 1.00 2.35 H new ATOM 0 HH2 TRP A 92 -16.449 -9.699 -1.208 1.00 1.76 H new ATOM 1573 N GLU A 93 -23.237 -8.935 1.632 1.00 0.61 N ATOM 1574 CA GLU A 93 -23.581 -10.335 1.397 1.00 0.67 C ATOM 1575 C GLU A 93 -23.533 -11.097 2.711 1.00 0.61 C ATOM 1576 O GLU A 93 -23.163 -12.274 2.753 1.00 0.64 O ATOM 1577 CB GLU A 93 -22.623 -10.975 0.387 1.00 0.74 C ATOM 1578 CG GLU A 93 -22.650 -10.345 -0.992 1.00 0.88 C ATOM 1579 CD GLU A 93 -21.695 -11.032 -1.957 1.00 1.08 C ATOM 1580 OE1 GLU A 93 -21.467 -12.250 -1.807 1.00 1.58 O ATOM 1581 OE2 GLU A 93 -21.164 -10.359 -2.870 1.00 1.63 O ATOM 0 H GLU A 93 -23.992 -8.280 1.428 1.00 0.61 H new ATOM 0 HA GLU A 93 -24.589 -10.379 0.983 1.00 0.67 H new ATOM 0 HB2 GLU A 93 -21.608 -10.915 0.780 1.00 0.74 H new ATOM 0 HB3 GLU A 93 -22.867 -12.033 0.294 1.00 0.74 H new ATOM 0 HG2 GLU A 93 -23.663 -10.392 -1.391 1.00 0.88 H new ATOM 0 HG3 GLU A 93 -22.387 -9.290 -0.913 1.00 0.88 H new ATOM 1588 N LYS A 94 -23.922 -10.401 3.777 1.00 0.59 N ATOM 1589 CA LYS A 94 -23.918 -10.949 5.126 1.00 0.61 C ATOM 1590 C LYS A 94 -22.507 -11.370 5.523 1.00 0.55 C ATOM 1591 O LYS A 94 -22.318 -12.260 6.352 1.00 0.63 O ATOM 1592 CB LYS A 94 -24.892 -12.123 5.249 1.00 0.71 C ATOM 1593 CG LYS A 94 -26.359 -11.732 5.065 1.00 0.85 C ATOM 1594 CD LYS A 94 -26.776 -10.601 6.000 1.00 0.93 C ATOM 1595 CE LYS A 94 -26.361 -10.871 7.438 1.00 1.23 C ATOM 1596 NZ LYS A 94 -26.959 -9.897 8.391 1.00 1.79 N ATOM 0 H LYS A 94 -24.250 -9.437 3.726 1.00 0.59 H new ATOM 0 HA LYS A 94 -24.252 -10.170 5.811 1.00 0.61 H new ATOM 0 HB2 LYS A 94 -24.631 -12.878 4.507 1.00 0.71 H new ATOM 0 HB3 LYS A 94 -24.769 -12.583 6.229 1.00 0.71 H new ATOM 0 HG2 LYS A 94 -26.525 -11.427 4.032 1.00 0.85 H new ATOM 0 HG3 LYS A 94 -26.990 -12.602 5.246 1.00 0.85 H new ATOM 0 HD2 LYS A 94 -26.327 -9.667 5.662 1.00 0.93 H new ATOM 0 HD3 LYS A 94 -27.857 -10.471 5.953 1.00 0.93 H new ATOM 0 HE2 LYS A 94 -26.662 -11.881 7.717 1.00 1.23 H new ATOM 0 HE3 LYS A 94 -25.274 -10.830 7.514 1.00 1.23 H new ATOM 0 HZ1 LYS A 94 -26.648 -10.121 9.358 1.00 1.79 H new ATOM 0 HZ2 LYS A 94 -26.652 -8.935 8.143 1.00 1.79 H new ATOM 0 HZ3 LYS A 94 -27.996 -9.953 8.340 1.00 1.79 H new ATOM 1610 N LYS A 95 -21.518 -10.715 4.927 1.00 0.47 N ATOM 1611 CA LYS A 95 -20.126 -11.012 5.206 1.00 0.46 C ATOM 1612 C LYS A 95 -19.359 -9.752 5.565 1.00 0.42 C ATOM 1613 O LYS A 95 -19.761 -8.648 5.219 1.00 0.42 O ATOM 1614 CB LYS A 95 -19.471 -11.693 4.013 1.00 0.52 C ATOM 1615 CG LYS A 95 -18.925 -13.071 4.339 1.00 0.63 C ATOM 1616 CD LYS A 95 -20.042 -14.098 4.467 1.00 0.77 C ATOM 1617 CE LYS A 95 -20.795 -14.268 3.154 1.00 0.94 C ATOM 1618 NZ LYS A 95 -21.783 -15.372 3.217 1.00 1.29 N ATOM 0 H LYS A 95 -21.660 -9.971 4.244 1.00 0.47 H new ATOM 0 HA LYS A 95 -20.098 -11.689 6.059 1.00 0.46 H new ATOM 0 HB2 LYS A 95 -20.199 -11.779 3.207 1.00 0.52 H new ATOM 0 HB3 LYS A 95 -18.660 -11.065 3.644 1.00 0.52 H new ATOM 0 HG2 LYS A 95 -18.231 -13.382 3.559 1.00 0.63 H new ATOM 0 HG3 LYS A 95 -18.360 -13.029 5.270 1.00 0.63 H new ATOM 0 HD2 LYS A 95 -19.623 -15.056 4.775 1.00 0.77 H new ATOM 0 HD3 LYS A 95 -20.736 -13.788 5.248 1.00 0.77 H new ATOM 0 HE2 LYS A 95 -21.307 -13.338 2.907 1.00 0.94 H new ATOM 0 HE3 LYS A 95 -20.084 -14.464 2.351 1.00 0.94 H new ATOM 0 HZ1 LYS A 95 -22.272 -15.452 2.303 1.00 1.29 H new ATOM 0 HZ2 LYS A 95 -21.293 -16.265 3.427 1.00 1.29 H new ATOM 0 HZ3 LYS A 95 -22.478 -15.174 3.965 1.00 1.29 H new ATOM 1632 N THR A 96 -18.245 -9.941 6.242 1.00 0.43 N ATOM 1633 CA THR A 96 -17.399 -8.841 6.684 1.00 0.41 C ATOM 1634 C THR A 96 -15.933 -9.117 6.351 1.00 0.40 C ATOM 1635 O THR A 96 -15.452 -10.236 6.533 1.00 0.45 O ATOM 1636 CB THR A 96 -17.517 -8.623 8.205 1.00 0.45 C ATOM 1637 OG1 THR A 96 -17.077 -9.799 8.899 1.00 0.73 O ATOM 1638 CG2 THR A 96 -18.945 -8.305 8.615 1.00 0.55 C ATOM 0 H THR A 96 -17.896 -10.863 6.504 1.00 0.43 H new ATOM 0 HA THR A 96 -17.738 -7.947 6.160 1.00 0.41 H new ATOM 0 HB THR A 96 -16.888 -7.773 8.469 1.00 0.45 H new ATOM 0 HG1 THR A 96 -17.152 -9.656 9.866 1.00 0.73 H new ATOM 0 HG21 THR A 96 -18.989 -8.158 9.694 1.00 0.55 H new ATOM 0 HG22 THR A 96 -19.275 -7.397 8.111 1.00 0.55 H new ATOM 0 HG23 THR A 96 -19.597 -9.132 8.335 1.00 0.55 H new ATOM 1646 N TYR A 97 -15.236 -8.100 5.863 1.00 0.38 N ATOM 1647 CA TYR A 97 -13.824 -8.228 5.512 1.00 0.40 C ATOM 1648 C TYR A 97 -13.038 -7.029 6.024 1.00 0.35 C ATOM 1649 O TYR A 97 -13.614 -5.973 6.320 1.00 0.33 O ATOM 1650 CB TYR A 97 -13.640 -8.360 3.994 1.00 0.47 C ATOM 1651 CG TYR A 97 -14.642 -9.280 3.330 1.00 0.56 C ATOM 1652 CD1 TYR A 97 -15.927 -8.840 3.036 1.00 1.37 C ATOM 1653 CD2 TYR A 97 -14.309 -10.587 3.004 1.00 1.37 C ATOM 1654 CE1 TYR A 97 -16.850 -9.672 2.443 1.00 1.54 C ATOM 1655 CE2 TYR A 97 -15.228 -11.429 2.403 1.00 1.54 C ATOM 1656 CZ TYR A 97 -16.496 -10.965 2.126 1.00 1.13 C ATOM 1657 OH TYR A 97 -17.417 -11.797 1.528 1.00 1.45 O ATOM 0 H TYR A 97 -15.626 -7.172 5.700 1.00 0.38 H new ATOM 0 HA TYR A 97 -13.445 -9.134 5.985 1.00 0.40 H new ATOM 0 HB2 TYR A 97 -13.715 -7.371 3.542 1.00 0.47 H new ATOM 0 HB3 TYR A 97 -12.634 -8.728 3.791 1.00 0.47 H new ATOM 0 HD1 TYR A 97 -16.207 -7.825 3.277 1.00 1.37 H new ATOM 0 HD2 TYR A 97 -13.317 -10.953 3.223 1.00 1.37 H new ATOM 0 HE1 TYR A 97 -17.846 -9.313 2.228 1.00 1.54 H new ATOM 0 HE2 TYR A 97 -14.954 -12.443 2.153 1.00 1.54 H new ATOM 0 HH TYR A 97 -17.882 -11.311 0.815 1.00 1.45 H new ATOM 1667 N GLN A 98 -11.726 -7.202 6.126 1.00 0.37 N ATOM 1668 CA GLN A 98 -10.838 -6.154 6.611 1.00 0.34 C ATOM 1669 C GLN A 98 -10.046 -5.536 5.464 1.00 0.31 C ATOM 1670 O GLN A 98 -9.404 -6.240 4.670 1.00 0.31 O ATOM 1671 CB GLN A 98 -9.881 -6.700 7.674 1.00 0.40 C ATOM 1672 CG GLN A 98 -10.583 -7.235 8.910 1.00 0.80 C ATOM 1673 CD GLN A 98 -10.809 -8.731 8.854 1.00 1.21 C ATOM 1674 OE1 GLN A 98 -11.842 -9.198 8.371 1.00 1.83 O ATOM 1675 NE2 GLN A 98 -9.850 -9.490 9.357 1.00 1.84 N ATOM 0 H GLN A 98 -11.250 -8.069 5.876 1.00 0.37 H new ATOM 0 HA GLN A 98 -11.456 -5.379 7.063 1.00 0.34 H new ATOM 0 HB2 GLN A 98 -9.280 -7.496 7.235 1.00 0.40 H new ATOM 0 HB3 GLN A 98 -9.193 -5.909 7.972 1.00 0.40 H new ATOM 0 HG2 GLN A 98 -9.990 -6.994 9.792 1.00 0.80 H new ATOM 0 HG3 GLN A 98 -11.543 -6.731 9.024 1.00 0.80 H new ATOM 0 HE21 GLN A 98 -9.011 -9.060 9.747 1.00 1.84 H new ATOM 0 HE22 GLN A 98 -9.949 -10.505 9.355 1.00 1.84 H new ATOM 1684 N LEU A 99 -10.083 -4.215 5.408 1.00 0.29 N ATOM 1685 CA LEU A 99 -9.416 -3.456 4.368 1.00 0.28 C ATOM 1686 C LEU A 99 -8.420 -2.467 4.973 1.00 0.26 C ATOM 1687 O LEU A 99 -8.805 -1.546 5.687 1.00 0.28 O ATOM 1688 CB LEU A 99 -10.479 -2.690 3.570 1.00 0.31 C ATOM 1689 CG LEU A 99 -10.155 -2.407 2.101 1.00 0.37 C ATOM 1690 CD1 LEU A 99 -8.970 -1.459 1.974 1.00 0.46 C ATOM 1691 CD2 LEU A 99 -9.899 -3.711 1.357 1.00 0.48 C ATOM 0 H LEU A 99 -10.580 -3.638 6.087 1.00 0.29 H new ATOM 0 HA LEU A 99 -8.867 -4.138 3.719 1.00 0.28 H new ATOM 0 HB2 LEU A 99 -11.410 -3.255 3.612 1.00 0.31 H new ATOM 0 HB3 LEU A 99 -10.661 -1.738 4.069 1.00 0.31 H new ATOM 0 HG LEU A 99 -11.016 -1.916 1.647 1.00 0.37 H new ATOM 0 HD11 LEU A 99 -8.762 -1.276 0.920 1.00 0.46 H new ATOM 0 HD12 LEU A 99 -9.204 -0.516 2.467 1.00 0.46 H new ATOM 0 HD13 LEU A 99 -8.094 -1.906 2.444 1.00 0.46 H new ATOM 0 HD21 LEU A 99 -9.670 -3.496 0.313 1.00 0.48 H new ATOM 0 HD22 LEU A 99 -9.057 -4.231 1.814 1.00 0.48 H new ATOM 0 HD23 LEU A 99 -10.787 -4.341 1.411 1.00 0.48 H new ATOM 1703 N ASP A 100 -7.145 -2.658 4.687 1.00 0.25 N ATOM 1704 CA ASP A 100 -6.120 -1.749 5.184 1.00 0.26 C ATOM 1705 C ASP A 100 -5.772 -0.761 4.084 1.00 0.25 C ATOM 1706 O ASP A 100 -5.468 -1.166 2.965 1.00 0.26 O ATOM 1707 CB ASP A 100 -4.850 -2.495 5.580 1.00 0.32 C ATOM 1708 CG ASP A 100 -4.876 -3.100 6.969 1.00 0.41 C ATOM 1709 OD1 ASP A 100 -5.434 -2.491 7.894 1.00 0.74 O ATOM 1710 OD2 ASP A 100 -4.297 -4.212 7.135 1.00 0.43 O ATOM 0 H ASP A 100 -6.793 -3.428 4.118 1.00 0.25 H new ATOM 0 HA ASP A 100 -6.512 -1.243 6.066 1.00 0.26 H new ATOM 0 HB2 ASP A 100 -4.672 -3.290 4.856 1.00 0.32 H new ATOM 0 HB3 ASP A 100 -4.006 -1.808 5.514 1.00 0.32 H new ATOM 1715 N LEU A 101 -5.801 0.522 4.387 1.00 0.25 N ATOM 1716 CA LEU A 101 -5.481 1.523 3.384 1.00 0.25 C ATOM 1717 C LEU A 101 -4.420 2.482 3.896 1.00 0.25 C ATOM 1718 O LEU A 101 -4.467 2.943 5.042 1.00 0.27 O ATOM 1719 CB LEU A 101 -6.737 2.281 2.936 1.00 0.28 C ATOM 1720 CG LEU A 101 -7.334 3.251 3.958 1.00 0.34 C ATOM 1721 CD1 LEU A 101 -6.945 4.687 3.632 1.00 0.33 C ATOM 1722 CD2 LEU A 101 -8.843 3.104 3.998 1.00 0.51 C ATOM 0 H LEU A 101 -6.039 0.894 5.306 1.00 0.25 H new ATOM 0 HA LEU A 101 -5.078 1.006 2.513 1.00 0.25 H new ATOM 0 HB2 LEU A 101 -6.497 2.840 2.031 1.00 0.28 H new ATOM 0 HB3 LEU A 101 -7.501 1.552 2.667 1.00 0.28 H new ATOM 0 HG LEU A 101 -6.932 3.007 4.942 1.00 0.34 H new ATOM 0 HD11 LEU A 101 -7.381 5.359 4.372 1.00 0.33 H new ATOM 0 HD12 LEU A 101 -5.859 4.783 3.650 1.00 0.33 H new ATOM 0 HD13 LEU A 101 -7.316 4.949 2.641 1.00 0.33 H new ATOM 0 HD21 LEU A 101 -9.257 3.799 4.729 1.00 0.51 H new ATOM 0 HD22 LEU A 101 -9.256 3.324 3.014 1.00 0.51 H new ATOM 0 HD23 LEU A 101 -9.102 2.084 4.281 1.00 0.51 H new ATOM 1734 N PHE A 102 -3.445 2.751 3.052 1.00 0.24 N ATOM 1735 CA PHE A 102 -2.364 3.647 3.396 1.00 0.25 C ATOM 1736 C PHE A 102 -2.269 4.751 2.359 1.00 0.24 C ATOM 1737 O PHE A 102 -2.360 4.488 1.161 1.00 0.24 O ATOM 1738 CB PHE A 102 -1.051 2.875 3.455 1.00 0.28 C ATOM 1739 CG PHE A 102 -1.210 1.438 3.869 1.00 0.39 C ATOM 1740 CD1 PHE A 102 -1.396 1.100 5.199 1.00 1.27 C ATOM 1741 CD2 PHE A 102 -1.180 0.426 2.923 1.00 1.29 C ATOM 1742 CE1 PHE A 102 -1.550 -0.220 5.579 1.00 1.36 C ATOM 1743 CE2 PHE A 102 -1.334 -0.893 3.296 1.00 1.40 C ATOM 1744 CZ PHE A 102 -1.517 -1.218 4.626 1.00 0.81 C ATOM 0 H PHE A 102 -3.381 2.356 2.114 1.00 0.24 H new ATOM 0 HA PHE A 102 -2.559 4.089 4.373 1.00 0.25 H new ATOM 0 HB2 PHE A 102 -0.575 2.911 2.475 1.00 0.28 H new ATOM 0 HB3 PHE A 102 -0.379 3.373 4.154 1.00 0.28 H new ATOM 0 HD1 PHE A 102 -1.421 1.877 5.948 1.00 1.27 H new ATOM 0 HD2 PHE A 102 -1.034 0.673 1.882 1.00 1.29 H new ATOM 0 HE1 PHE A 102 -1.696 -0.470 6.619 1.00 1.36 H new ATOM 0 HE2 PHE A 102 -1.311 -1.672 2.548 1.00 1.40 H new ATOM 0 HZ PHE A 102 -1.634 -2.251 4.920 1.00 0.81 H new ATOM 1754 N THR A 103 -2.091 5.976 2.809 1.00 0.25 N ATOM 1755 CA THR A 103 -1.993 7.101 1.903 1.00 0.25 C ATOM 1756 C THR A 103 -0.536 7.415 1.577 1.00 0.25 C ATOM 1757 O THR A 103 0.282 7.615 2.476 1.00 0.28 O ATOM 1758 CB THR A 103 -2.671 8.338 2.510 1.00 0.29 C ATOM 1759 OG1 THR A 103 -2.630 8.250 3.942 1.00 0.37 O ATOM 1760 CG2 THR A 103 -4.114 8.447 2.041 1.00 0.38 C ATOM 0 H THR A 103 -2.011 6.218 3.797 1.00 0.25 H new ATOM 0 HA THR A 103 -2.504 6.833 0.978 1.00 0.25 H new ATOM 0 HB THR A 103 -2.135 9.228 2.181 1.00 0.29 H new ATOM 0 HG1 THR A 103 -3.061 9.040 4.331 1.00 0.37 H new ATOM 0 HG21 THR A 103 -4.575 9.330 2.483 1.00 0.38 H new ATOM 0 HG22 THR A 103 -4.138 8.531 0.954 1.00 0.38 H new ATOM 0 HG23 THR A 103 -4.665 7.558 2.349 1.00 0.38 H new ATOM 1768 N ALA A 104 -0.217 7.442 0.291 1.00 0.26 N ATOM 1769 CA ALA A 104 1.133 7.722 -0.165 1.00 0.28 C ATOM 1770 C ALA A 104 1.122 8.748 -1.293 1.00 0.26 C ATOM 1771 O ALA A 104 0.086 8.994 -1.914 1.00 0.25 O ATOM 1772 CB ALA A 104 1.812 6.440 -0.623 1.00 0.34 C ATOM 0 H ALA A 104 -0.885 7.271 -0.461 1.00 0.26 H new ATOM 0 HA ALA A 104 1.696 8.139 0.670 1.00 0.28 H new ATOM 0 HB1 ALA A 104 2.823 6.665 -0.962 1.00 0.34 H new ATOM 0 HB2 ALA A 104 1.856 5.735 0.207 1.00 0.34 H new ATOM 0 HB3 ALA A 104 1.244 6.000 -1.443 1.00 0.34 H new ATOM 1778 N LEU A 105 2.273 9.341 -1.553 1.00 0.27 N ATOM 1779 CA LEU A 105 2.405 10.339 -2.595 1.00 0.27 C ATOM 1780 C LEU A 105 2.808 9.691 -3.904 1.00 0.26 C ATOM 1781 O LEU A 105 3.262 8.550 -3.924 1.00 0.27 O ATOM 1782 CB LEU A 105 3.443 11.370 -2.177 1.00 0.32 C ATOM 1783 CG LEU A 105 3.168 12.027 -0.830 1.00 0.39 C ATOM 1784 CD1 LEU A 105 4.387 12.791 -0.354 1.00 0.57 C ATOM 1785 CD2 LEU A 105 1.960 12.944 -0.927 1.00 0.49 C ATOM 0 H LEU A 105 3.138 9.145 -1.050 1.00 0.27 H new ATOM 0 HA LEU A 105 1.444 10.831 -2.741 1.00 0.27 H new ATOM 0 HB2 LEU A 105 4.421 10.890 -2.141 1.00 0.32 H new ATOM 0 HB3 LEU A 105 3.497 12.145 -2.942 1.00 0.32 H new ATOM 0 HG LEU A 105 2.949 11.248 -0.100 1.00 0.39 H new ATOM 0 HD11 LEU A 105 4.173 13.254 0.609 1.00 0.57 H new ATOM 0 HD12 LEU A 105 5.228 12.105 -0.248 1.00 0.57 H new ATOM 0 HD13 LEU A 105 4.638 13.564 -1.080 1.00 0.57 H new ATOM 0 HD21 LEU A 105 1.775 13.406 0.043 1.00 0.49 H new ATOM 0 HD22 LEU A 105 2.151 13.720 -1.669 1.00 0.49 H new ATOM 0 HD23 LEU A 105 1.086 12.364 -1.225 1.00 0.49 H new ATOM 1797 N ALA A 106 2.643 10.430 -4.994 1.00 0.27 N ATOM 1798 CA ALA A 106 2.994 9.940 -6.325 1.00 0.30 C ATOM 1799 C ALA A 106 4.464 9.564 -6.399 1.00 0.31 C ATOM 1800 O ALA A 106 4.856 8.673 -7.151 1.00 0.36 O ATOM 1801 CB ALA A 106 2.666 10.982 -7.379 1.00 0.34 C ATOM 0 H ALA A 106 2.266 11.378 -4.984 1.00 0.27 H new ATOM 0 HA ALA A 106 2.403 9.045 -6.519 1.00 0.30 H new ATOM 0 HB1 ALA A 106 2.934 10.600 -8.364 1.00 0.34 H new ATOM 0 HB2 ALA A 106 1.599 11.202 -7.353 1.00 0.34 H new ATOM 0 HB3 ALA A 106 3.229 11.893 -7.178 1.00 0.34 H new ATOM 1807 N GLU A 107 5.268 10.245 -5.601 1.00 0.31 N ATOM 1808 CA GLU A 107 6.701 9.988 -5.561 1.00 0.35 C ATOM 1809 C GLU A 107 6.990 8.754 -4.712 1.00 0.36 C ATOM 1810 O GLU A 107 7.989 8.081 -4.902 1.00 0.43 O ATOM 1811 CB GLU A 107 7.475 11.201 -5.016 1.00 0.40 C ATOM 1812 CG GLU A 107 6.642 12.155 -4.168 1.00 0.44 C ATOM 1813 CD GLU A 107 5.843 13.132 -5.010 1.00 0.67 C ATOM 1814 OE1 GLU A 107 6.459 13.965 -5.706 1.00 1.35 O ATOM 1815 OE2 GLU A 107 4.599 13.062 -4.988 1.00 1.38 O ATOM 0 H GLU A 107 4.954 10.982 -4.970 1.00 0.31 H new ATOM 0 HA GLU A 107 7.038 9.808 -6.582 1.00 0.35 H new ATOM 0 HB2 GLU A 107 8.313 10.842 -4.419 1.00 0.40 H new ATOM 0 HB3 GLU A 107 7.895 11.755 -5.856 1.00 0.40 H new ATOM 0 HG2 GLU A 107 5.961 11.579 -3.541 1.00 0.44 H new ATOM 0 HG3 GLU A 107 7.299 12.710 -3.499 1.00 0.44 H new ATOM 1822 N GLU A 108 6.064 8.437 -3.823 1.00 0.33 N ATOM 1823 CA GLU A 108 6.184 7.301 -2.913 1.00 0.36 C ATOM 1824 C GLU A 108 5.555 6.051 -3.516 1.00 0.39 C ATOM 1825 O GLU A 108 5.168 5.134 -2.804 1.00 0.59 O ATOM 1826 CB GLU A 108 5.504 7.632 -1.591 1.00 0.39 C ATOM 1827 CG GLU A 108 6.464 7.744 -0.431 1.00 0.75 C ATOM 1828 CD GLU A 108 6.830 6.393 0.148 1.00 1.62 C ATOM 1829 OE1 GLU A 108 5.937 5.729 0.718 1.00 2.35 O ATOM 1830 OE2 GLU A 108 8.005 5.995 0.035 1.00 2.31 O ATOM 0 H GLU A 108 5.198 8.963 -3.708 1.00 0.33 H new ATOM 0 HA GLU A 108 7.243 7.104 -2.743 1.00 0.36 H new ATOM 0 HB2 GLU A 108 4.962 8.572 -1.696 1.00 0.39 H new ATOM 0 HB3 GLU A 108 4.766 6.861 -1.368 1.00 0.39 H new ATOM 0 HG2 GLU A 108 7.370 8.253 -0.761 1.00 0.75 H new ATOM 0 HG3 GLU A 108 6.017 8.361 0.348 1.00 0.75 H new ATOM 1837 N LYS A 109 5.481 6.011 -4.831 1.00 0.37 N ATOM 1838 CA LYS A 109 4.848 4.897 -5.513 1.00 0.38 C ATOM 1839 C LYS A 109 5.728 3.638 -5.474 1.00 0.34 C ATOM 1840 O LYS A 109 5.306 2.620 -4.930 1.00 0.35 O ATOM 1841 CB LYS A 109 4.481 5.288 -6.950 1.00 0.44 C ATOM 1842 CG LYS A 109 3.757 4.191 -7.703 1.00 0.74 C ATOM 1843 CD LYS A 109 3.333 4.644 -9.094 1.00 1.00 C ATOM 1844 CE LYS A 109 2.163 5.615 -9.035 1.00 1.73 C ATOM 1845 NZ LYS A 109 1.763 6.086 -10.384 1.00 2.18 N ATOM 0 H LYS A 109 5.850 6.734 -5.449 1.00 0.37 H new ATOM 0 HA LYS A 109 3.926 4.654 -4.984 1.00 0.38 H new ATOM 0 HB2 LYS A 109 3.854 6.179 -6.928 1.00 0.44 H new ATOM 0 HB3 LYS A 109 5.390 5.552 -7.491 1.00 0.44 H new ATOM 0 HG2 LYS A 109 4.405 3.319 -7.787 1.00 0.74 H new ATOM 0 HG3 LYS A 109 2.878 3.882 -7.138 1.00 0.74 H new ATOM 0 HD2 LYS A 109 4.176 5.120 -9.595 1.00 1.00 H new ATOM 0 HD3 LYS A 109 3.056 3.775 -9.691 1.00 1.00 H new ATOM 0 HE2 LYS A 109 1.314 5.130 -8.554 1.00 1.73 H new ATOM 0 HE3 LYS A 109 2.433 6.471 -8.417 1.00 1.73 H new ATOM 0 HZ1 LYS A 109 0.963 6.745 -10.299 1.00 2.18 H new ATOM 0 HZ2 LYS A 109 2.565 6.571 -10.834 1.00 2.18 H new ATOM 0 HZ3 LYS A 109 1.480 5.272 -10.966 1.00 2.18 H new ATOM 1859 N PRO A 110 6.964 3.674 -6.023 1.00 0.34 N ATOM 1860 CA PRO A 110 7.848 2.503 -6.027 1.00 0.35 C ATOM 1861 C PRO A 110 8.216 2.019 -4.623 1.00 0.30 C ATOM 1862 O PRO A 110 8.132 0.827 -4.335 1.00 0.31 O ATOM 1863 CB PRO A 110 9.099 2.998 -6.759 1.00 0.42 C ATOM 1864 CG PRO A 110 9.053 4.478 -6.636 1.00 0.41 C ATOM 1865 CD PRO A 110 7.601 4.835 -6.677 1.00 0.37 C ATOM 0 HA PRO A 110 7.364 1.647 -6.498 1.00 0.35 H new ATOM 0 HB2 PRO A 110 10.006 2.592 -6.310 1.00 0.42 H new ATOM 0 HB3 PRO A 110 9.094 2.688 -7.804 1.00 0.42 H new ATOM 0 HG2 PRO A 110 9.513 4.809 -5.705 1.00 0.41 H new ATOM 0 HG3 PRO A 110 9.598 4.957 -7.449 1.00 0.41 H new ATOM 0 HD2 PRO A 110 7.397 5.763 -6.143 1.00 0.37 H new ATOM 0 HD3 PRO A 110 7.246 4.970 -7.699 1.00 0.37 H new ATOM 1873 N TYR A 111 8.633 2.946 -3.762 1.00 0.29 N ATOM 1874 CA TYR A 111 9.030 2.610 -2.391 1.00 0.27 C ATOM 1875 C TYR A 111 7.934 1.883 -1.626 1.00 0.26 C ATOM 1876 O TYR A 111 8.143 0.767 -1.137 1.00 0.26 O ATOM 1877 CB TYR A 111 9.411 3.876 -1.624 1.00 0.31 C ATOM 1878 CG TYR A 111 10.795 4.386 -1.936 1.00 0.27 C ATOM 1879 CD1 TYR A 111 11.355 4.183 -3.182 1.00 1.20 C ATOM 1880 CD2 TYR A 111 11.536 5.069 -0.984 1.00 1.24 C ATOM 1881 CE1 TYR A 111 12.619 4.643 -3.478 1.00 1.21 C ATOM 1882 CE2 TYR A 111 12.803 5.536 -1.273 1.00 1.27 C ATOM 1883 CZ TYR A 111 13.340 5.316 -2.524 1.00 0.41 C ATOM 1884 OH TYR A 111 14.596 5.778 -2.827 1.00 0.53 O ATOM 0 H TYR A 111 8.706 3.938 -3.988 1.00 0.29 H new ATOM 0 HA TYR A 111 9.887 1.941 -2.471 1.00 0.27 H new ATOM 0 HB2 TYR A 111 8.687 4.658 -1.851 1.00 0.31 H new ATOM 0 HB3 TYR A 111 9.340 3.676 -0.555 1.00 0.31 H new ATOM 0 HD1 TYR A 111 10.792 3.655 -3.937 1.00 1.20 H new ATOM 0 HD2 TYR A 111 11.117 5.238 -0.003 1.00 1.24 H new ATOM 0 HE1 TYR A 111 13.041 4.475 -4.458 1.00 1.21 H new ATOM 0 HE2 TYR A 111 13.370 6.070 -0.524 1.00 1.27 H new ATOM 0 HH TYR A 111 14.725 5.761 -3.798 1.00 0.53 H new ATOM 1894 N ALA A 112 6.775 2.518 -1.530 1.00 0.26 N ATOM 1895 CA ALA A 112 5.649 1.943 -0.811 1.00 0.27 C ATOM 1896 C ALA A 112 5.307 0.557 -1.352 1.00 0.26 C ATOM 1897 O ALA A 112 5.091 -0.391 -0.587 1.00 0.26 O ATOM 1898 CB ALA A 112 4.440 2.859 -0.903 1.00 0.30 C ATOM 0 H ALA A 112 6.590 3.433 -1.942 1.00 0.26 H new ATOM 0 HA ALA A 112 5.932 1.839 0.237 1.00 0.27 H new ATOM 0 HB1 ALA A 112 3.605 2.415 -0.360 1.00 0.30 H new ATOM 0 HB2 ALA A 112 4.683 3.828 -0.466 1.00 0.30 H new ATOM 0 HB3 ALA A 112 4.163 2.992 -1.949 1.00 0.30 H new ATOM 1904 N ILE A 113 5.268 0.444 -2.678 1.00 0.27 N ATOM 1905 CA ILE A 113 4.959 -0.822 -3.323 1.00 0.29 C ATOM 1906 C ILE A 113 6.004 -1.878 -2.983 1.00 0.29 C ATOM 1907 O ILE A 113 5.655 -3.009 -2.673 1.00 0.31 O ATOM 1908 CB ILE A 113 4.850 -0.670 -4.862 1.00 0.33 C ATOM 1909 CG1 ILE A 113 3.621 0.164 -5.242 1.00 0.35 C ATOM 1910 CG2 ILE A 113 4.782 -2.033 -5.529 1.00 0.37 C ATOM 1911 CD1 ILE A 113 2.313 -0.424 -4.758 1.00 0.39 C ATOM 0 H ILE A 113 5.447 1.214 -3.322 1.00 0.27 H new ATOM 0 HA ILE A 113 3.990 -1.145 -2.942 1.00 0.29 H new ATOM 0 HB ILE A 113 5.742 -0.151 -5.213 1.00 0.33 H new ATOM 0 HG12 ILE A 113 3.732 1.167 -4.831 1.00 0.35 H new ATOM 0 HG13 ILE A 113 3.584 0.267 -6.327 1.00 0.35 H new ATOM 0 HG21 ILE A 113 4.706 -1.906 -6.609 1.00 0.37 H new ATOM 0 HG22 ILE A 113 5.683 -2.599 -5.293 1.00 0.37 H new ATOM 0 HG23 ILE A 113 3.908 -2.573 -5.165 1.00 0.37 H new ATOM 0 HD11 ILE A 113 1.489 0.220 -5.064 1.00 0.39 H new ATOM 0 HD12 ILE A 113 2.178 -1.416 -5.190 1.00 0.39 H new ATOM 0 HD13 ILE A 113 2.329 -0.501 -3.671 1.00 0.39 H new ATOM 1923 N PHE A 114 7.280 -1.499 -3.002 1.00 0.28 N ATOM 1924 CA PHE A 114 8.358 -2.428 -2.698 1.00 0.31 C ATOM 1925 C PHE A 114 8.145 -3.069 -1.338 1.00 0.31 C ATOM 1926 O PHE A 114 8.258 -4.287 -1.189 1.00 0.33 O ATOM 1927 CB PHE A 114 9.692 -1.692 -2.728 1.00 0.34 C ATOM 1928 CG PHE A 114 10.858 -2.517 -2.269 1.00 0.36 C ATOM 1929 CD1 PHE A 114 11.419 -3.467 -3.100 1.00 1.24 C ATOM 1930 CD2 PHE A 114 11.391 -2.336 -1.007 1.00 1.27 C ATOM 1931 CE1 PHE A 114 12.495 -4.226 -2.679 1.00 1.26 C ATOM 1932 CE2 PHE A 114 12.465 -3.089 -0.578 1.00 1.33 C ATOM 1933 CZ PHE A 114 13.019 -4.035 -1.415 1.00 0.55 C ATOM 0 H PHE A 114 7.590 -0.553 -3.225 1.00 0.28 H new ATOM 0 HA PHE A 114 8.364 -3.217 -3.450 1.00 0.31 H new ATOM 0 HB2 PHE A 114 9.882 -1.348 -3.745 1.00 0.34 H new ATOM 0 HB3 PHE A 114 9.619 -0.804 -2.100 1.00 0.34 H new ATOM 0 HD1 PHE A 114 11.013 -3.618 -4.089 1.00 1.24 H new ATOM 0 HD2 PHE A 114 10.962 -1.596 -0.348 1.00 1.27 H new ATOM 0 HE1 PHE A 114 12.925 -4.967 -3.337 1.00 1.26 H new ATOM 0 HE2 PHE A 114 12.871 -2.938 0.411 1.00 1.33 H new ATOM 0 HZ PHE A 114 13.860 -4.625 -1.083 1.00 0.55 H new ATOM 1943 N HIS A 115 7.822 -2.233 -0.360 1.00 0.30 N ATOM 1944 CA HIS A 115 7.580 -2.682 0.999 1.00 0.33 C ATOM 1945 C HIS A 115 6.445 -3.706 1.040 1.00 0.32 C ATOM 1946 O HIS A 115 6.634 -4.844 1.468 1.00 0.34 O ATOM 1947 CB HIS A 115 7.255 -1.464 1.882 1.00 0.38 C ATOM 1948 CG HIS A 115 7.201 -1.779 3.343 1.00 0.42 C ATOM 1949 ND1 HIS A 115 8.110 -1.268 4.236 1.00 0.45 N ATOM 1950 CD2 HIS A 115 6.350 -2.588 4.002 1.00 0.47 C ATOM 1951 CE1 HIS A 115 7.801 -1.784 5.405 1.00 0.49 C ATOM 1952 NE2 HIS A 115 6.745 -2.593 5.310 1.00 0.51 N ATOM 0 H HIS A 115 7.721 -1.226 -0.489 1.00 0.30 H new ATOM 0 HA HIS A 115 8.475 -3.173 1.381 1.00 0.33 H new ATOM 0 HB2 HIS A 115 8.006 -0.693 1.713 1.00 0.38 H new ATOM 0 HB3 HIS A 115 6.296 -1.048 1.573 1.00 0.38 H new ATOM 0 HD1 HIS A 115 8.871 -0.619 4.034 1.00 0.45 H new ATOM 0 HD2 HIS A 115 5.516 -3.128 3.579 1.00 0.47 H new ATOM 0 HE1 HIS A 115 8.333 -1.579 6.322 1.00 0.49 H new ATOM 1960 N PHE A 116 5.280 -3.301 0.573 1.00 0.32 N ATOM 1961 CA PHE A 116 4.100 -4.161 0.594 1.00 0.33 C ATOM 1962 C PHE A 116 4.059 -5.231 -0.509 1.00 0.33 C ATOM 1963 O PHE A 116 3.103 -6.002 -0.571 1.00 0.36 O ATOM 1964 CB PHE A 116 2.847 -3.307 0.539 1.00 0.35 C ATOM 1965 CG PHE A 116 2.666 -2.462 1.767 1.00 0.37 C ATOM 1966 CD1 PHE A 116 3.289 -1.230 1.878 1.00 1.21 C ATOM 1967 CD2 PHE A 116 1.878 -2.906 2.814 1.00 1.29 C ATOM 1968 CE1 PHE A 116 3.129 -0.457 3.012 1.00 1.25 C ATOM 1969 CE2 PHE A 116 1.714 -2.139 3.953 1.00 1.31 C ATOM 1970 CZ PHE A 116 2.341 -0.909 4.050 1.00 0.50 C ATOM 0 H PHE A 116 5.119 -2.377 0.171 1.00 0.32 H new ATOM 0 HA PHE A 116 4.154 -4.716 1.530 1.00 0.33 H new ATOM 0 HB2 PHE A 116 2.891 -2.661 -0.338 1.00 0.35 H new ATOM 0 HB3 PHE A 116 1.977 -3.953 0.416 1.00 0.35 H new ATOM 0 HD1 PHE A 116 3.907 -0.869 1.069 1.00 1.21 H new ATOM 0 HD2 PHE A 116 1.385 -3.864 2.741 1.00 1.29 H new ATOM 0 HE1 PHE A 116 3.621 0.502 3.086 1.00 1.25 H new ATOM 0 HE2 PHE A 116 1.099 -2.499 4.764 1.00 1.31 H new ATOM 0 HZ PHE A 116 2.214 -0.305 4.936 1.00 0.50 H new ATOM 1980 N THR A 117 5.053 -5.279 -1.388 1.00 0.33 N ATOM 1981 CA THR A 117 5.033 -6.254 -2.471 1.00 0.37 C ATOM 1982 C THR A 117 5.472 -7.664 -2.046 1.00 0.36 C ATOM 1983 O THR A 117 4.856 -8.644 -2.492 1.00 0.47 O ATOM 1984 CB THR A 117 5.829 -5.755 -3.710 1.00 0.63 C ATOM 1985 OG1 THR A 117 4.947 -5.045 -4.595 1.00 1.18 O ATOM 1986 CG2 THR A 117 6.481 -6.891 -4.486 1.00 0.92 C ATOM 0 H THR A 117 5.869 -4.667 -1.374 1.00 0.33 H new ATOM 0 HA THR A 117 3.986 -6.347 -2.759 1.00 0.37 H new ATOM 0 HB THR A 117 6.620 -5.105 -3.337 1.00 0.63 H new ATOM 0 HG1 THR A 117 5.339 -5.014 -5.493 1.00 1.18 H new ATOM 0 HG21 THR A 117 7.023 -6.484 -5.340 1.00 0.92 H new ATOM 0 HG22 THR A 117 7.175 -7.424 -3.836 1.00 0.92 H new ATOM 0 HG23 THR A 117 5.712 -7.579 -4.838 1.00 0.92 H new ATOM 1994 N GLY A 118 6.503 -7.822 -1.197 1.00 0.43 N ATOM 1995 CA GLY A 118 6.868 -9.181 -0.841 1.00 0.59 C ATOM 1996 C GLY A 118 6.800 -9.522 0.639 1.00 0.49 C ATOM 1997 O GLY A 118 5.706 -9.619 1.190 1.00 0.54 O ATOM 0 H GLY A 118 7.057 -7.076 -0.776 1.00 0.43 H new ATOM 0 HA2 GLY A 118 6.214 -9.865 -1.382 1.00 0.59 H new ATOM 0 HA3 GLY A 118 7.884 -9.367 -1.190 1.00 0.59 H new ATOM 2001 N PRO A 119 7.935 -9.767 1.321 1.00 0.51 N ATOM 2002 CA PRO A 119 7.943 -10.076 2.735 1.00 0.52 C ATOM 2003 C PRO A 119 8.691 -9.058 3.607 1.00 0.43 C ATOM 2004 O PRO A 119 9.730 -8.512 3.221 1.00 0.42 O ATOM 2005 CB PRO A 119 8.706 -11.403 2.722 1.00 0.65 C ATOM 2006 CG PRO A 119 9.525 -11.385 1.449 1.00 0.72 C ATOM 2007 CD PRO A 119 9.263 -10.043 0.789 1.00 0.70 C ATOM 0 HA PRO A 119 6.940 -10.086 3.162 1.00 0.52 H new ATOM 0 HB2 PRO A 119 9.346 -11.496 3.599 1.00 0.65 H new ATOM 0 HB3 PRO A 119 8.020 -12.250 2.736 1.00 0.65 H new ATOM 0 HG2 PRO A 119 10.586 -11.510 1.668 1.00 0.72 H new ATOM 0 HG3 PRO A 119 9.237 -12.204 0.790 1.00 0.72 H new ATOM 0 HD2 PRO A 119 9.994 -9.286 1.074 1.00 0.70 H new ATOM 0 HD3 PRO A 119 9.274 -10.102 -0.299 1.00 0.70 H new ATOM 2015 N VAL A 120 8.153 -8.833 4.793 1.00 0.43 N ATOM 2016 CA VAL A 120 8.756 -7.926 5.772 1.00 0.42 C ATOM 2017 C VAL A 120 10.193 -8.355 6.076 1.00 0.38 C ATOM 2018 O VAL A 120 11.075 -7.519 6.265 1.00 0.37 O ATOM 2019 CB VAL A 120 7.917 -7.859 7.076 1.00 0.49 C ATOM 2020 CG1 VAL A 120 7.614 -9.251 7.607 1.00 0.58 C ATOM 2021 CG2 VAL A 120 8.602 -7.010 8.140 1.00 0.53 C ATOM 0 H VAL A 120 7.288 -9.270 5.110 1.00 0.43 H new ATOM 0 HA VAL A 120 8.771 -6.926 5.339 1.00 0.42 H new ATOM 0 HB VAL A 120 6.971 -7.378 6.828 1.00 0.49 H new ATOM 0 HG11 VAL A 120 7.025 -9.172 8.521 1.00 0.58 H new ATOM 0 HG12 VAL A 120 7.051 -9.811 6.860 1.00 0.58 H new ATOM 0 HG13 VAL A 120 8.548 -9.770 7.821 1.00 0.58 H new ATOM 0 HG21 VAL A 120 7.986 -6.986 9.039 1.00 0.53 H new ATOM 0 HG22 VAL A 120 9.575 -7.440 8.378 1.00 0.53 H new ATOM 0 HG23 VAL A 120 8.736 -5.995 7.765 1.00 0.53 H new ATOM 2031 N SER A 121 10.408 -9.668 6.108 1.00 0.40 N ATOM 2032 CA SER A 121 11.717 -10.252 6.377 1.00 0.40 C ATOM 2033 C SER A 121 12.789 -9.695 5.441 1.00 0.36 C ATOM 2034 O SER A 121 13.869 -9.299 5.882 1.00 0.37 O ATOM 2035 CB SER A 121 11.621 -11.766 6.225 1.00 0.46 C ATOM 2036 OG SER A 121 10.602 -12.112 5.297 1.00 1.24 O ATOM 0 H SER A 121 9.675 -10.359 5.947 1.00 0.40 H new ATOM 0 HA SER A 121 12.011 -9.993 7.394 1.00 0.40 H new ATOM 0 HB2 SER A 121 12.578 -12.164 5.888 1.00 0.46 H new ATOM 0 HB3 SER A 121 11.409 -12.221 7.192 1.00 0.46 H new ATOM 0 HG SER A 121 10.556 -13.087 5.211 1.00 1.24 H new ATOM 2042 N TYR A 122 12.487 -9.668 4.151 1.00 0.36 N ATOM 2043 CA TYR A 122 13.421 -9.150 3.162 1.00 0.35 C ATOM 2044 C TYR A 122 13.707 -7.672 3.410 1.00 0.33 C ATOM 2045 O TYR A 122 14.849 -7.220 3.310 1.00 0.34 O ATOM 2046 CB TYR A 122 12.857 -9.323 1.760 1.00 0.38 C ATOM 2047 CG TYR A 122 13.879 -9.094 0.671 1.00 0.44 C ATOM 2048 CD1 TYR A 122 14.929 -9.980 0.496 1.00 1.29 C ATOM 2049 CD2 TYR A 122 13.798 -7.994 -0.170 1.00 1.29 C ATOM 2050 CE1 TYR A 122 15.874 -9.781 -0.489 1.00 1.35 C ATOM 2051 CE2 TYR A 122 14.740 -7.784 -1.161 1.00 1.36 C ATOM 2052 CZ TYR A 122 15.777 -8.682 -1.317 1.00 0.73 C ATOM 2053 OH TYR A 122 16.723 -8.475 -2.297 1.00 0.91 O ATOM 0 H TYR A 122 11.603 -9.999 3.765 1.00 0.36 H new ATOM 0 HA TYR A 122 14.350 -9.712 3.252 1.00 0.35 H new ATOM 0 HB2 TYR A 122 12.451 -10.330 1.661 1.00 0.38 H new ATOM 0 HB3 TYR A 122 12.028 -8.629 1.622 1.00 0.38 H new ATOM 0 HD1 TYR A 122 15.009 -10.842 1.142 1.00 1.29 H new ATOM 0 HD2 TYR A 122 12.987 -7.291 -0.049 1.00 1.29 H new ATOM 0 HE1 TYR A 122 16.686 -10.482 -0.611 1.00 1.35 H new ATOM 0 HE2 TYR A 122 14.665 -6.923 -1.809 1.00 1.36 H new ATOM 0 HH TYR A 122 16.507 -7.657 -2.792 1.00 0.91 H new ATOM 2063 N LEU A 123 12.657 -6.938 3.758 1.00 0.31 N ATOM 2064 CA LEU A 123 12.752 -5.506 4.008 1.00 0.31 C ATOM 2065 C LEU A 123 13.665 -5.204 5.190 1.00 0.31 C ATOM 2066 O LEU A 123 14.625 -4.448 5.059 1.00 0.31 O ATOM 2067 CB LEU A 123 11.362 -4.918 4.270 1.00 0.32 C ATOM 2068 CG LEU A 123 10.241 -5.460 3.382 1.00 0.34 C ATOM 2069 CD1 LEU A 123 8.906 -4.871 3.796 1.00 0.43 C ATOM 2070 CD2 LEU A 123 10.516 -5.166 1.915 1.00 0.34 C ATOM 0 H LEU A 123 11.718 -7.318 3.875 1.00 0.31 H new ATOM 0 HA LEU A 123 13.181 -5.046 3.118 1.00 0.31 H new ATOM 0 HB2 LEU A 123 11.099 -5.103 5.311 1.00 0.32 H new ATOM 0 HB3 LEU A 123 11.414 -3.837 4.141 1.00 0.32 H new ATOM 0 HG LEU A 123 10.202 -6.542 3.510 1.00 0.34 H new ATOM 0 HD11 LEU A 123 8.119 -5.267 3.154 1.00 0.43 H new ATOM 0 HD12 LEU A 123 8.697 -5.136 4.832 1.00 0.43 H new ATOM 0 HD13 LEU A 123 8.941 -3.786 3.699 1.00 0.43 H new ATOM 0 HD21 LEU A 123 9.703 -5.562 1.306 1.00 0.34 H new ATOM 0 HD22 LEU A 123 10.588 -4.088 1.767 1.00 0.34 H new ATOM 0 HD23 LEU A 123 11.454 -5.636 1.619 1.00 0.34 H new ATOM 2082 N ILE A 124 13.356 -5.793 6.340 1.00 0.36 N ATOM 2083 CA ILE A 124 14.145 -5.579 7.549 1.00 0.41 C ATOM 2084 C ILE A 124 15.602 -6.012 7.361 1.00 0.38 C ATOM 2085 O ILE A 124 16.521 -5.358 7.862 1.00 0.38 O ATOM 2086 CB ILE A 124 13.533 -6.305 8.766 1.00 0.52 C ATOM 2087 CG1 ILE A 124 13.390 -7.799 8.500 1.00 0.76 C ATOM 2088 CG2 ILE A 124 12.181 -5.705 9.112 1.00 1.01 C ATOM 2089 CD1 ILE A 124 13.528 -8.658 9.738 1.00 1.08 C ATOM 0 H ILE A 124 12.563 -6.424 6.461 1.00 0.36 H new ATOM 0 HA ILE A 124 14.128 -4.507 7.743 1.00 0.41 H new ATOM 0 HB ILE A 124 14.208 -6.173 9.611 1.00 0.52 H new ATOM 0 HG12 ILE A 124 12.416 -7.986 8.047 1.00 0.76 H new ATOM 0 HG13 ILE A 124 14.144 -8.102 7.773 1.00 0.76 H new ATOM 0 HG21 ILE A 124 11.761 -6.227 9.972 1.00 1.01 H new ATOM 0 HG22 ILE A 124 12.302 -4.649 9.352 1.00 1.01 H new ATOM 0 HG23 ILE A 124 11.508 -5.809 8.261 1.00 1.01 H new ATOM 0 HD11 ILE A 124 13.414 -9.708 9.467 1.00 1.08 H new ATOM 0 HD12 ILE A 124 14.512 -8.502 10.181 1.00 1.08 H new ATOM 0 HD13 ILE A 124 12.758 -8.384 10.459 1.00 1.08 H new ATOM 2101 N ARG A 125 15.811 -7.099 6.629 1.00 0.38 N ATOM 2102 CA ARG A 125 17.156 -7.601 6.371 1.00 0.41 C ATOM 2103 C ARG A 125 17.952 -6.579 5.574 1.00 0.36 C ATOM 2104 O ARG A 125 19.064 -6.198 5.953 1.00 0.38 O ATOM 2105 CB ARG A 125 17.095 -8.922 5.609 1.00 0.46 C ATOM 2106 CG ARG A 125 17.295 -10.150 6.486 1.00 1.30 C ATOM 2107 CD ARG A 125 18.722 -10.246 7.001 1.00 1.31 C ATOM 2108 NE ARG A 125 18.877 -9.633 8.319 1.00 2.16 N ATOM 2109 CZ ARG A 125 19.986 -9.020 8.731 1.00 2.81 C ATOM 2110 NH1 ARG A 125 21.029 -8.901 7.917 1.00 2.83 N ATOM 2111 NH2 ARG A 125 20.044 -8.516 9.959 1.00 3.80 N ATOM 0 H ARG A 125 15.066 -7.651 6.203 1.00 0.38 H new ATOM 0 HA ARG A 125 17.651 -7.771 7.327 1.00 0.41 H new ATOM 0 HB2 ARG A 125 16.129 -8.998 5.110 1.00 0.46 H new ATOM 0 HB3 ARG A 125 17.857 -8.916 4.830 1.00 0.46 H new ATOM 0 HG2 ARG A 125 16.605 -10.111 7.329 1.00 1.30 H new ATOM 0 HG3 ARG A 125 17.052 -11.047 5.917 1.00 1.30 H new ATOM 0 HD2 ARG A 125 19.018 -11.294 7.053 1.00 1.31 H new ATOM 0 HD3 ARG A 125 19.395 -9.759 6.295 1.00 1.31 H new ATOM 0 HE ARG A 125 18.087 -9.677 8.963 1.00 2.16 H new ATOM 0 HH11 ARG A 125 20.984 -9.280 6.971 1.00 2.83 H new ATOM 0 HH12 ARG A 125 21.875 -8.431 8.238 1.00 2.83 H new ATOM 0 HH21 ARG A 125 19.241 -8.599 10.583 1.00 3.80 H new ATOM 0 HH22 ARG A 125 20.891 -8.046 10.278 1.00 3.80 H new ATOM 2125 N ILE A 126 17.351 -6.122 4.482 1.00 0.34 N ATOM 2126 CA ILE A 126 17.973 -5.141 3.609 1.00 0.33 C ATOM 2127 C ILE A 126 18.191 -3.822 4.355 1.00 0.31 C ATOM 2128 O ILE A 126 19.183 -3.123 4.134 1.00 0.31 O ATOM 2129 CB ILE A 126 17.114 -4.936 2.326 1.00 0.34 C ATOM 2130 CG1 ILE A 126 17.932 -5.284 1.082 1.00 0.39 C ATOM 2131 CG2 ILE A 126 16.560 -3.518 2.213 1.00 0.38 C ATOM 2132 CD1 ILE A 126 18.277 -6.754 0.969 1.00 0.46 C ATOM 0 H ILE A 126 16.424 -6.421 4.180 1.00 0.34 H new ATOM 0 HA ILE A 126 18.950 -5.512 3.300 1.00 0.33 H new ATOM 0 HB ILE A 126 16.260 -5.609 2.401 1.00 0.34 H new ATOM 0 HG12 ILE A 126 17.374 -4.982 0.196 1.00 0.39 H new ATOM 0 HG13 ILE A 126 18.855 -4.703 1.091 1.00 0.39 H new ATOM 0 HG21 ILE A 126 15.969 -3.430 1.301 1.00 0.38 H new ATOM 0 HG22 ILE A 126 15.930 -3.304 3.076 1.00 0.38 H new ATOM 0 HG23 ILE A 126 17.385 -2.806 2.181 1.00 0.38 H new ATOM 0 HD11 ILE A 126 18.857 -6.923 0.062 1.00 0.46 H new ATOM 0 HD12 ILE A 126 18.863 -7.058 1.837 1.00 0.46 H new ATOM 0 HD13 ILE A 126 17.359 -7.341 0.927 1.00 0.46 H new ATOM 2144 N ARG A 127 17.276 -3.520 5.266 1.00 0.31 N ATOM 2145 CA ARG A 127 17.334 -2.303 6.060 1.00 0.33 C ATOM 2146 C ARG A 127 18.593 -2.252 6.922 1.00 0.33 C ATOM 2147 O ARG A 127 19.306 -1.249 6.927 1.00 0.34 O ATOM 2148 CB ARG A 127 16.100 -2.205 6.956 1.00 0.38 C ATOM 2149 CG ARG A 127 15.177 -1.052 6.611 1.00 1.09 C ATOM 2150 CD ARG A 127 15.813 0.283 6.947 1.00 1.30 C ATOM 2151 NE ARG A 127 14.814 1.326 7.151 1.00 1.79 N ATOM 2152 CZ ARG A 127 14.826 2.185 8.169 1.00 2.32 C ATOM 2153 NH1 ARG A 127 15.789 2.135 9.083 1.00 2.76 N ATOM 2154 NH2 ARG A 127 13.867 3.092 8.270 1.00 2.94 N ATOM 0 H ARG A 127 16.473 -4.113 5.475 1.00 0.31 H new ATOM 0 HA ARG A 127 17.360 -1.460 5.370 1.00 0.33 H new ATOM 0 HB2 ARG A 127 15.540 -3.138 6.889 1.00 0.38 H new ATOM 0 HB3 ARG A 127 16.423 -2.101 7.992 1.00 0.38 H new ATOM 0 HG2 ARG A 127 14.933 -1.084 5.549 1.00 1.09 H new ATOM 0 HG3 ARG A 127 14.239 -1.158 7.157 1.00 1.09 H new ATOM 0 HD2 ARG A 127 16.419 0.180 7.847 1.00 1.30 H new ATOM 0 HD3 ARG A 127 16.486 0.577 6.142 1.00 1.30 H new ATOM 0 HE ARG A 127 14.058 1.402 6.471 1.00 1.79 H new ATOM 0 HH11 ARG A 127 16.527 1.435 9.008 1.00 2.76 H new ATOM 0 HH12 ARG A 127 15.790 2.797 9.859 1.00 2.76 H new ATOM 0 HH21 ARG A 127 13.125 3.130 7.571 1.00 2.94 H new ATOM 0 HH22 ARG A 127 13.870 3.753 9.047 1.00 2.94 H new ATOM 2168 N ALA A 128 18.863 -3.336 7.641 1.00 0.35 N ATOM 2169 CA ALA A 128 20.033 -3.407 8.513 1.00 0.38 C ATOM 2170 C ALA A 128 21.322 -3.454 7.708 1.00 0.37 C ATOM 2171 O ALA A 128 22.321 -2.833 8.081 1.00 0.39 O ATOM 2172 CB ALA A 128 19.932 -4.615 9.435 1.00 0.42 C ATOM 0 H ALA A 128 18.288 -4.179 7.638 1.00 0.35 H new ATOM 0 HA ALA A 128 20.056 -2.502 9.121 1.00 0.38 H new ATOM 0 HB1 ALA A 128 20.810 -4.656 10.079 1.00 0.42 H new ATOM 0 HB2 ALA A 128 19.035 -4.530 10.049 1.00 0.42 H new ATOM 0 HB3 ALA A 128 19.878 -5.525 8.838 1.00 0.42 H new ATOM 2178 N ALA A 129 21.289 -4.170 6.593 1.00 0.36 N ATOM 2179 CA ALA A 129 22.459 -4.299 5.734 1.00 0.38 C ATOM 2180 C ALA A 129 22.901 -2.936 5.222 1.00 0.36 C ATOM 2181 O ALA A 129 24.051 -2.525 5.410 1.00 0.40 O ATOM 2182 CB ALA A 129 22.161 -5.234 4.571 1.00 0.40 C ATOM 0 H ALA A 129 20.465 -4.671 6.261 1.00 0.36 H new ATOM 0 HA ALA A 129 23.273 -4.724 6.321 1.00 0.38 H new ATOM 0 HB1 ALA A 129 23.044 -5.320 3.938 1.00 0.40 H new ATOM 0 HB2 ALA A 129 21.892 -6.218 4.955 1.00 0.40 H new ATOM 0 HB3 ALA A 129 21.333 -4.834 3.986 1.00 0.40 H new ATOM 2188 N LEU A 130 21.977 -2.217 4.609 1.00 0.33 N ATOM 2189 CA LEU A 130 22.286 -0.908 4.068 1.00 0.32 C ATOM 2190 C LEU A 130 22.573 0.090 5.187 1.00 0.33 C ATOM 2191 O LEU A 130 23.347 1.037 5.008 1.00 0.35 O ATOM 2192 CB LEU A 130 21.155 -0.429 3.179 1.00 0.32 C ATOM 2193 CG LEU A 130 20.950 -1.235 1.901 1.00 0.36 C ATOM 2194 CD1 LEU A 130 19.474 -1.286 1.557 1.00 0.38 C ATOM 2195 CD2 LEU A 130 21.752 -0.633 0.755 1.00 0.41 C ATOM 0 H LEU A 130 21.011 -2.517 4.475 1.00 0.33 H new ATOM 0 HA LEU A 130 23.187 -0.986 3.460 1.00 0.32 H new ATOM 0 HB2 LEU A 130 20.229 -0.447 3.754 1.00 0.32 H new ATOM 0 HB3 LEU A 130 21.342 0.610 2.908 1.00 0.32 H new ATOM 0 HG LEU A 130 21.307 -2.252 2.062 1.00 0.36 H new ATOM 0 HD11 LEU A 130 19.333 -1.863 0.643 1.00 0.38 H new ATOM 0 HD12 LEU A 130 18.926 -1.759 2.373 1.00 0.38 H new ATOM 0 HD13 LEU A 130 19.100 -0.273 1.408 1.00 0.38 H new ATOM 0 HD21 LEU A 130 21.593 -1.221 -0.149 1.00 0.41 H new ATOM 0 HD22 LEU A 130 21.426 0.393 0.582 1.00 0.41 H new ATOM 0 HD23 LEU A 130 22.812 -0.639 1.010 1.00 0.41 H new ATOM 2207 N LYS A 131 21.957 -0.114 6.347 1.00 0.33 N ATOM 2208 CA LYS A 131 22.217 0.755 7.485 1.00 0.37 C ATOM 2209 C LYS A 131 23.714 0.716 7.772 1.00 0.39 C ATOM 2210 O LYS A 131 24.347 1.746 8.018 1.00 0.43 O ATOM 2211 CB LYS A 131 21.420 0.311 8.713 1.00 0.40 C ATOM 2212 CG LYS A 131 20.952 1.466 9.592 1.00 0.53 C ATOM 2213 CD LYS A 131 22.111 2.132 10.319 1.00 0.69 C ATOM 2214 CE LYS A 131 22.321 3.569 9.860 1.00 0.82 C ATOM 2215 NZ LYS A 131 23.568 4.155 10.416 1.00 1.09 N ATOM 0 H LYS A 131 21.285 -0.861 6.521 1.00 0.33 H new ATOM 0 HA LYS A 131 21.903 1.772 7.252 1.00 0.37 H new ATOM 0 HB2 LYS A 131 20.551 -0.259 8.384 1.00 0.40 H new ATOM 0 HB3 LYS A 131 22.035 -0.362 9.310 1.00 0.40 H new ATOM 0 HG2 LYS A 131 20.437 2.204 8.977 1.00 0.53 H new ATOM 0 HG3 LYS A 131 20.230 1.098 10.321 1.00 0.53 H new ATOM 0 HD2 LYS A 131 21.922 2.118 11.392 1.00 0.69 H new ATOM 0 HD3 LYS A 131 23.023 1.560 10.149 1.00 0.69 H new ATOM 0 HE2 LYS A 131 22.360 3.600 8.771 1.00 0.82 H new ATOM 0 HE3 LYS A 131 21.468 4.175 10.165 1.00 0.82 H new ATOM 0 HZ1 LYS A 131 23.672 5.133 10.079 1.00 1.09 H new ATOM 0 HZ2 LYS A 131 23.521 4.150 11.455 1.00 1.09 H new ATOM 0 HZ3 LYS A 131 24.385 3.592 10.104 1.00 1.09 H new ATOM 2229 N LYS A 132 24.269 -0.490 7.706 1.00 0.40 N ATOM 2230 CA LYS A 132 25.697 -0.687 7.898 1.00 0.45 C ATOM 2231 C LYS A 132 26.448 -0.081 6.711 1.00 0.44 C ATOM 2232 O LYS A 132 27.597 0.339 6.837 1.00 0.47 O ATOM 2233 CB LYS A 132 26.038 -2.176 8.048 1.00 0.49 C ATOM 2234 CG LYS A 132 25.257 -2.898 9.142 1.00 0.53 C ATOM 2235 CD LYS A 132 25.323 -2.175 10.484 1.00 0.59 C ATOM 2236 CE LYS A 132 26.755 -2.051 10.992 1.00 0.92 C ATOM 2237 NZ LYS A 132 26.838 -1.267 12.255 1.00 1.39 N ATOM 0 H LYS A 132 23.747 -1.347 7.520 1.00 0.40 H new ATOM 0 HA LYS A 132 26.002 -0.189 8.818 1.00 0.45 H new ATOM 0 HB2 LYS A 132 25.853 -2.676 7.097 1.00 0.49 H new ATOM 0 HB3 LYS A 132 27.104 -2.272 8.256 1.00 0.49 H new ATOM 0 HG2 LYS A 132 24.215 -2.995 8.836 1.00 0.53 H new ATOM 0 HG3 LYS A 132 25.650 -3.908 9.258 1.00 0.53 H new ATOM 0 HD2 LYS A 132 24.886 -1.182 10.383 1.00 0.59 H new ATOM 0 HD3 LYS A 132 24.723 -2.714 11.217 1.00 0.59 H new ATOM 0 HE2 LYS A 132 27.168 -3.046 11.156 1.00 0.92 H new ATOM 0 HE3 LYS A 132 27.369 -1.573 10.229 1.00 0.92 H new ATOM 0 HZ1 LYS A 132 27.830 -1.209 12.563 1.00 1.39 H new ATOM 0 HZ2 LYS A 132 26.469 -0.308 12.093 1.00 1.39 H new ATOM 0 HZ3 LYS A 132 26.274 -1.736 12.992 1.00 1.39 H new ATOM 2251 N LYS A 133 25.769 -0.023 5.559 1.00 0.42 N ATOM 2252 CA LYS A 133 26.336 0.559 4.338 1.00 0.44 C ATOM 2253 C LYS A 133 26.214 2.078 4.369 1.00 0.42 C ATOM 2254 O LYS A 133 26.565 2.756 3.401 1.00 0.45 O ATOM 2255 CB LYS A 133 25.625 0.032 3.092 1.00 0.49 C ATOM 2256 CG LYS A 133 25.635 -1.473 2.977 1.00 1.05 C ATOM 2257 CD LYS A 133 26.985 -1.981 2.513 1.00 1.48 C ATOM 2258 CE LYS A 133 26.935 -3.456 2.169 1.00 2.08 C ATOM 2259 NZ LYS A 133 28.270 -3.971 1.774 1.00 2.52 N ATOM 0 H LYS A 133 24.818 -0.375 5.448 1.00 0.42 H new ATOM 0 HA LYS A 133 27.387 0.272 4.296 1.00 0.44 H new ATOM 0 HB2 LYS A 133 24.592 0.380 3.100 1.00 0.49 H new ATOM 0 HB3 LYS A 133 26.098 0.458 2.207 1.00 0.49 H new ATOM 0 HG2 LYS A 133 25.390 -1.915 3.943 1.00 1.05 H new ATOM 0 HG3 LYS A 133 24.864 -1.791 2.276 1.00 1.05 H new ATOM 0 HD2 LYS A 133 27.308 -1.414 1.640 1.00 1.48 H new ATOM 0 HD3 LYS A 133 27.726 -1.813 3.294 1.00 1.48 H new ATOM 0 HE2 LYS A 133 26.567 -4.018 3.027 1.00 2.08 H new ATOM 0 HE3 LYS A 133 26.227 -3.617 1.356 1.00 2.08 H new ATOM 0 HZ1 LYS A 133 28.198 -4.983 1.546 1.00 2.52 H new ATOM 0 HZ2 LYS A 133 28.610 -3.451 0.940 1.00 2.52 H new ATOM 0 HZ3 LYS A 133 28.939 -3.840 2.560 1.00 2.52 H new ATOM 2273 N ASN A 134 25.670 2.578 5.478 1.00 0.41 N ATOM 2274 CA ASN A 134 25.503 4.017 5.714 1.00 0.42 C ATOM 2275 C ASN A 134 24.344 4.582 4.897 1.00 0.40 C ATOM 2276 O ASN A 134 24.372 5.728 4.437 1.00 0.44 O ATOM 2277 CB ASN A 134 26.809 4.749 5.384 1.00 0.48 C ATOM 2278 CG ASN A 134 26.881 6.156 5.931 1.00 0.78 C ATOM 2279 OD1 ASN A 134 26.165 6.524 6.863 1.00 1.08 O ATOM 2280 ND2 ASN A 134 27.767 6.948 5.355 1.00 1.06 N ATOM 0 H ASN A 134 25.330 1.996 6.243 1.00 0.41 H new ATOM 0 HA ASN A 134 25.265 4.170 6.767 1.00 0.42 H new ATOM 0 HB2 ASN A 134 27.646 4.173 5.779 1.00 0.48 H new ATOM 0 HB3 ASN A 134 26.930 4.785 4.301 1.00 0.48 H new ATOM 0 HD21 ASN A 134 27.880 7.908 5.680 1.00 1.06 H new ATOM 0 HD22 ASN A 134 28.339 6.599 4.586 1.00 1.06 H new ATOM 2287 N TYR A 135 23.317 3.765 4.741 1.00 0.36 N ATOM 2288 CA TYR A 135 22.121 4.151 4.020 1.00 0.35 C ATOM 2289 C TYR A 135 20.902 3.806 4.858 1.00 0.34 C ATOM 2290 O TYR A 135 20.882 2.794 5.555 1.00 0.35 O ATOM 2291 CB TYR A 135 22.100 3.438 2.651 1.00 0.37 C ATOM 2292 CG TYR A 135 20.730 3.160 2.039 1.00 0.55 C ATOM 2293 CD1 TYR A 135 19.833 2.281 2.641 1.00 1.44 C ATOM 2294 CD2 TYR A 135 20.351 3.736 0.833 1.00 1.30 C ATOM 2295 CE1 TYR A 135 18.618 1.989 2.072 1.00 1.66 C ATOM 2296 CE2 TYR A 135 19.128 3.449 0.262 1.00 1.46 C ATOM 2297 CZ TYR A 135 18.268 2.572 0.884 1.00 1.17 C ATOM 2298 OH TYR A 135 17.055 2.277 0.314 1.00 1.51 O ATOM 0 H TYR A 135 23.291 2.815 5.112 1.00 0.36 H new ATOM 0 HA TYR A 135 22.110 5.226 3.837 1.00 0.35 H new ATOM 0 HB2 TYR A 135 22.671 4.042 1.945 1.00 0.37 H new ATOM 0 HB3 TYR A 135 22.624 2.488 2.755 1.00 0.37 H new ATOM 0 HD1 TYR A 135 20.100 1.817 3.579 1.00 1.44 H new ATOM 0 HD2 TYR A 135 21.024 4.419 0.335 1.00 1.30 H new ATOM 0 HE1 TYR A 135 17.942 1.303 2.559 1.00 1.66 H new ATOM 0 HE2 TYR A 135 18.846 3.912 -0.672 1.00 1.46 H new ATOM 0 HH TYR A 135 17.004 1.315 0.132 1.00 1.51 H new ATOM 2308 N LYS A 136 19.898 4.661 4.815 1.00 0.34 N ATOM 2309 CA LYS A 136 18.673 4.423 5.555 1.00 0.35 C ATOM 2310 C LYS A 136 17.482 4.708 4.653 1.00 0.34 C ATOM 2311 O LYS A 136 17.337 5.815 4.140 1.00 0.36 O ATOM 2312 CB LYS A 136 18.598 5.288 6.819 1.00 0.39 C ATOM 2313 CG LYS A 136 19.945 5.738 7.364 1.00 1.36 C ATOM 2314 CD LYS A 136 19.868 6.054 8.853 1.00 1.43 C ATOM 2315 CE LYS A 136 18.932 7.220 9.146 1.00 1.18 C ATOM 2316 NZ LYS A 136 18.822 7.490 10.606 1.00 1.36 N ATOM 0 H LYS A 136 19.906 5.527 4.276 1.00 0.34 H new ATOM 0 HA LYS A 136 18.659 3.380 5.873 1.00 0.35 H new ATOM 0 HB2 LYS A 136 17.996 6.171 6.603 1.00 0.39 H new ATOM 0 HB3 LYS A 136 18.076 4.728 7.595 1.00 0.39 H new ATOM 0 HG2 LYS A 136 20.686 4.957 7.195 1.00 1.36 H new ATOM 0 HG3 LYS A 136 20.282 6.621 6.821 1.00 1.36 H new ATOM 0 HD2 LYS A 136 19.526 5.171 9.393 1.00 1.43 H new ATOM 0 HD3 LYS A 136 20.865 6.288 9.225 1.00 1.43 H new ATOM 0 HE2 LYS A 136 19.295 8.113 8.638 1.00 1.18 H new ATOM 0 HE3 LYS A 136 17.943 7.003 8.741 1.00 1.18 H new ATOM 0 HZ1 LYS A 136 17.881 7.880 10.817 1.00 1.36 H new ATOM 0 HZ2 LYS A 136 18.955 6.604 11.134 1.00 1.36 H new ATOM 0 HZ3 LYS A 136 19.552 8.174 10.888 1.00 1.36 H new ATOM 2330 N LEU A 137 16.651 3.704 4.441 1.00 0.34 N ATOM 2331 CA LEU A 137 15.481 3.838 3.594 1.00 0.36 C ATOM 2332 C LEU A 137 14.298 4.310 4.425 1.00 0.35 C ATOM 2333 O LEU A 137 14.187 3.968 5.598 1.00 0.36 O ATOM 2334 CB LEU A 137 15.182 2.488 2.927 1.00 0.43 C ATOM 2335 CG LEU A 137 13.725 2.228 2.536 1.00 0.40 C ATOM 2336 CD1 LEU A 137 13.429 2.772 1.149 1.00 0.66 C ATOM 2337 CD2 LEU A 137 13.418 0.734 2.609 1.00 0.64 C ATOM 0 H LEU A 137 16.768 2.777 4.849 1.00 0.34 H new ATOM 0 HA LEU A 137 15.667 4.578 2.816 1.00 0.36 H new ATOM 0 HB2 LEU A 137 15.796 2.407 2.030 1.00 0.43 H new ATOM 0 HB3 LEU A 137 15.501 1.695 3.604 1.00 0.43 H new ATOM 0 HG LEU A 137 13.081 2.750 3.243 1.00 0.40 H new ATOM 0 HD11 LEU A 137 12.388 2.574 0.895 1.00 0.66 H new ATOM 0 HD12 LEU A 137 13.608 3.847 1.134 1.00 0.66 H new ATOM 0 HD13 LEU A 137 14.078 2.285 0.421 1.00 0.66 H new ATOM 0 HD21 LEU A 137 12.379 0.562 2.329 1.00 0.64 H new ATOM 0 HD22 LEU A 137 14.073 0.194 1.925 1.00 0.64 H new ATOM 0 HD23 LEU A 137 13.583 0.378 3.626 1.00 0.64 H new ATOM 2349 N ASN A 138 13.420 5.094 3.823 1.00 0.35 N ATOM 2350 CA ASN A 138 12.254 5.608 4.522 1.00 0.37 C ATOM 2351 C ASN A 138 11.152 5.914 3.526 1.00 0.40 C ATOM 2352 O ASN A 138 11.429 6.120 2.347 1.00 0.40 O ATOM 2353 CB ASN A 138 12.607 6.873 5.297 1.00 0.40 C ATOM 2354 CG ASN A 138 12.653 6.657 6.796 1.00 0.52 C ATOM 2355 OD1 ASN A 138 11.657 6.843 7.493 1.00 0.68 O ATOM 2356 ND2 ASN A 138 13.807 6.257 7.302 1.00 0.81 N ATOM 0 H ASN A 138 13.493 5.389 2.849 1.00 0.35 H new ATOM 0 HA ASN A 138 11.911 4.850 5.226 1.00 0.37 H new ATOM 0 HB2 ASN A 138 13.576 7.241 4.959 1.00 0.40 H new ATOM 0 HB3 ASN A 138 11.875 7.648 5.070 1.00 0.40 H new ATOM 0 HD21 ASN A 138 13.894 6.091 8.305 1.00 0.81 H new ATOM 0 HD22 ASN A 138 14.610 6.114 6.690 1.00 0.81 H new ATOM 2363 N GLN A 139 9.916 5.993 4.010 1.00 0.45 N ATOM 2364 CA GLN A 139 8.753 6.279 3.161 1.00 0.53 C ATOM 2365 C GLN A 139 8.737 7.742 2.697 1.00 0.60 C ATOM 2366 O GLN A 139 7.688 8.301 2.385 1.00 0.92 O ATOM 2367 CB GLN A 139 7.463 5.963 3.917 1.00 0.63 C ATOM 2368 CG GLN A 139 6.995 4.528 3.742 1.00 1.09 C ATOM 2369 CD GLN A 139 5.498 4.382 3.925 1.00 1.95 C ATOM 2370 OE1 GLN A 139 5.020 4.045 5.009 1.00 2.36 O ATOM 2371 NE2 GLN A 139 4.747 4.655 2.870 1.00 2.87 N ATOM 0 H GLN A 139 9.688 5.862 4.996 1.00 0.45 H new ATOM 0 HA GLN A 139 8.825 5.646 2.277 1.00 0.53 H new ATOM 0 HB2 GLN A 139 7.615 6.160 4.978 1.00 0.63 H new ATOM 0 HB3 GLN A 139 6.677 6.637 3.577 1.00 0.63 H new ATOM 0 HG2 GLN A 139 7.273 4.177 2.748 1.00 1.09 H new ATOM 0 HG3 GLN A 139 7.510 3.891 4.461 1.00 1.09 H new ATOM 0 HE21 GLN A 139 5.184 4.931 1.991 1.00 2.87 H new ATOM 0 HE22 GLN A 139 3.731 4.590 2.936 1.00 2.87 H new ATOM 2380 N TYR A 140 9.899 8.374 2.719 1.00 0.47 N ATOM 2381 CA TYR A 140 10.043 9.752 2.275 1.00 0.53 C ATOM 2382 C TYR A 140 11.197 9.838 1.290 1.00 0.49 C ATOM 2383 O TYR A 140 11.248 10.729 0.443 1.00 0.54 O ATOM 2384 CB TYR A 140 10.283 10.694 3.459 1.00 0.60 C ATOM 2385 CG TYR A 140 9.466 10.340 4.675 1.00 0.63 C ATOM 2386 CD1 TYR A 140 8.189 10.851 4.863 1.00 1.37 C ATOM 2387 CD2 TYR A 140 9.970 9.470 5.620 1.00 1.33 C ATOM 2388 CE1 TYR A 140 7.440 10.497 5.968 1.00 1.42 C ATOM 2389 CE2 TYR A 140 9.238 9.112 6.725 1.00 1.38 C ATOM 2390 CZ TYR A 140 7.969 9.625 6.898 1.00 0.80 C ATOM 2391 OH TYR A 140 7.232 9.264 8.001 1.00 0.92 O ATOM 0 H TYR A 140 10.767 7.948 3.044 1.00 0.47 H new ATOM 0 HA TYR A 140 9.119 10.064 1.789 1.00 0.53 H new ATOM 0 HB2 TYR A 140 11.341 10.675 3.722 1.00 0.60 H new ATOM 0 HB3 TYR A 140 10.048 11.715 3.156 1.00 0.60 H new ATOM 0 HD1 TYR A 140 7.776 11.534 4.136 1.00 1.37 H new ATOM 0 HD2 TYR A 140 10.961 9.062 5.488 1.00 1.33 H new ATOM 0 HE1 TYR A 140 6.447 10.900 6.104 1.00 1.42 H new ATOM 0 HE2 TYR A 140 9.653 8.433 7.455 1.00 1.38 H new ATOM 0 HH TYR A 140 7.752 8.643 8.553 1.00 0.92 H new ATOM 2401 N GLY A 141 12.132 8.900 1.414 1.00 0.43 N ATOM 2402 CA GLY A 141 13.277 8.884 0.536 1.00 0.42 C ATOM 2403 C GLY A 141 14.420 8.081 1.110 1.00 0.38 C ATOM 2404 O GLY A 141 14.211 7.194 1.948 1.00 0.37 O ATOM 0 H GLY A 141 12.112 8.153 2.108 1.00 0.43 H new ATOM 0 HA2 GLY A 141 12.988 8.466 -0.428 1.00 0.42 H new ATOM 0 HA3 GLY A 141 13.608 9.906 0.354 1.00 0.42 H new ATOM 2408 N LEU A 142 15.630 8.394 0.669 1.00 0.38 N ATOM 2409 CA LEU A 142 16.812 7.702 1.128 1.00 0.37 C ATOM 2410 C LEU A 142 17.674 8.611 1.972 1.00 0.38 C ATOM 2411 O LEU A 142 17.749 9.808 1.725 1.00 0.54 O ATOM 2412 CB LEU A 142 17.626 7.224 -0.063 1.00 0.40 C ATOM 2413 CG LEU A 142 16.916 6.239 -0.970 1.00 0.47 C ATOM 2414 CD1 LEU A 142 17.893 5.642 -1.959 1.00 0.85 C ATOM 2415 CD2 LEU A 142 16.225 5.155 -0.157 1.00 0.50 C ATOM 0 H LEU A 142 15.813 9.131 -0.012 1.00 0.38 H new ATOM 0 HA LEU A 142 16.492 6.852 1.730 1.00 0.37 H new ATOM 0 HB2 LEU A 142 17.921 8.091 -0.654 1.00 0.40 H new ATOM 0 HB3 LEU A 142 18.542 6.762 0.304 1.00 0.40 H new ATOM 0 HG LEU A 142 16.147 6.772 -1.529 1.00 0.47 H new ATOM 0 HD11 LEU A 142 17.371 4.936 -2.605 1.00 0.85 H new ATOM 0 HD12 LEU A 142 18.328 6.436 -2.566 1.00 0.85 H new ATOM 0 HD13 LEU A 142 18.685 5.123 -1.420 1.00 0.85 H new ATOM 0 HD21 LEU A 142 15.722 4.460 -0.830 1.00 0.50 H new ATOM 0 HD22 LEU A 142 16.965 4.616 0.434 1.00 0.50 H new ATOM 0 HD23 LEU A 142 15.491 5.611 0.508 1.00 0.50 H new ATOM 2427 N PHE A 143 18.306 8.051 2.976 1.00 0.37 N ATOM 2428 CA PHE A 143 19.196 8.817 3.820 1.00 0.39 C ATOM 2429 C PHE A 143 20.609 8.285 3.679 1.00 0.40 C ATOM 2430 O PHE A 143 20.969 7.277 4.288 1.00 0.40 O ATOM 2431 CB PHE A 143 18.762 8.747 5.282 1.00 0.41 C ATOM 2432 CG PHE A 143 17.510 9.513 5.588 1.00 0.44 C ATOM 2433 CD1 PHE A 143 17.518 10.897 5.604 1.00 1.30 C ATOM 2434 CD2 PHE A 143 16.328 8.850 5.880 1.00 1.26 C ATOM 2435 CE1 PHE A 143 16.371 11.607 5.907 1.00 1.34 C ATOM 2436 CE2 PHE A 143 15.178 9.552 6.180 1.00 1.28 C ATOM 2437 CZ PHE A 143 15.200 10.933 6.196 1.00 0.58 C ATOM 0 H PHE A 143 18.221 7.067 3.230 1.00 0.37 H new ATOM 0 HA PHE A 143 19.160 9.859 3.504 1.00 0.39 H new ATOM 0 HB2 PHE A 143 18.612 7.703 5.555 1.00 0.41 H new ATOM 0 HB3 PHE A 143 19.569 9.127 5.908 1.00 0.41 H new ATOM 0 HD1 PHE A 143 18.431 11.428 5.377 1.00 1.30 H new ATOM 0 HD2 PHE A 143 16.307 7.770 5.873 1.00 1.26 H new ATOM 0 HE1 PHE A 143 16.390 12.687 5.918 1.00 1.34 H new ATOM 0 HE2 PHE A 143 14.263 9.023 6.402 1.00 1.28 H new ATOM 0 HZ PHE A 143 14.303 11.485 6.434 1.00 0.58 H new ATOM 2447 N LYS A 144 21.399 8.951 2.864 1.00 0.42 N ATOM 2448 CA LYS A 144 22.778 8.558 2.651 1.00 0.45 C ATOM 2449 C LYS A 144 23.664 9.429 3.521 1.00 0.56 C ATOM 2450 O LYS A 144 23.806 10.623 3.266 1.00 0.64 O ATOM 2451 CB LYS A 144 23.154 8.692 1.172 1.00 0.55 C ATOM 2452 CG LYS A 144 24.598 8.323 0.863 1.00 0.80 C ATOM 2453 CD LYS A 144 24.879 6.851 1.121 1.00 0.97 C ATOM 2454 CE LYS A 144 24.343 5.966 0.004 1.00 1.96 C ATOM 2455 NZ LYS A 144 25.143 6.089 -1.245 1.00 2.30 N ATOM 0 H LYS A 144 21.108 9.773 2.334 1.00 0.42 H new ATOM 0 HA LYS A 144 22.914 7.512 2.926 1.00 0.45 H new ATOM 0 HB2 LYS A 144 22.493 8.057 0.581 1.00 0.55 H new ATOM 0 HB3 LYS A 144 22.977 9.720 0.855 1.00 0.55 H new ATOM 0 HG2 LYS A 144 24.816 8.556 -0.179 1.00 0.80 H new ATOM 0 HG3 LYS A 144 25.266 8.932 1.473 1.00 0.80 H new ATOM 0 HD2 LYS A 144 25.954 6.699 1.221 1.00 0.97 H new ATOM 0 HD3 LYS A 144 24.426 6.555 2.067 1.00 0.97 H new ATOM 0 HE2 LYS A 144 24.345 4.927 0.334 1.00 1.96 H new ATOM 0 HE3 LYS A 144 23.307 6.233 -0.203 1.00 1.96 H new ATOM 0 HZ1 LYS A 144 24.863 5.341 -1.912 1.00 2.30 H new ATOM 0 HZ2 LYS A 144 24.972 7.020 -1.677 1.00 2.30 H new ATOM 0 HZ3 LYS A 144 26.154 5.992 -1.021 1.00 2.30 H new ATOM 2469 N ASN A 145 24.235 8.830 4.562 1.00 0.62 N ATOM 2470 CA ASN A 145 25.078 9.558 5.509 1.00 0.81 C ATOM 2471 C ASN A 145 24.267 10.692 6.137 1.00 0.99 C ATOM 2472 O ASN A 145 24.751 11.814 6.297 1.00 1.97 O ATOM 2473 CB ASN A 145 26.342 10.106 4.827 1.00 0.92 C ATOM 2474 CG ASN A 145 27.473 10.359 5.814 1.00 1.20 C ATOM 2475 OD1 ASN A 145 28.248 9.460 6.132 1.00 1.57 O ATOM 2476 ND2 ASN A 145 27.583 11.580 6.305 1.00 1.70 N ATOM 0 H ASN A 145 24.129 7.838 4.773 1.00 0.62 H new ATOM 0 HA ASN A 145 25.404 8.870 6.289 1.00 0.81 H new ATOM 0 HB2 ASN A 145 26.677 9.399 4.068 1.00 0.92 H new ATOM 0 HB3 ASN A 145 26.099 11.035 4.311 1.00 0.92 H new ATOM 0 HD21 ASN A 145 28.327 11.798 6.968 1.00 1.70 H new ATOM 0 HD22 ASN A 145 26.924 12.305 6.021 1.00 1.70 H new ATOM 2483 N GLN A 146 23.008 10.375 6.461 1.00 0.56 N ATOM 2484 CA GLN A 146 22.063 11.311 7.069 1.00 0.58 C ATOM 2485 C GLN A 146 21.573 12.370 6.084 1.00 0.55 C ATOM 2486 O GLN A 146 20.723 13.191 6.426 1.00 0.60 O ATOM 2487 CB GLN A 146 22.641 11.967 8.327 1.00 0.66 C ATOM 2488 CG GLN A 146 22.583 11.071 9.556 1.00 1.54 C ATOM 2489 CD GLN A 146 21.223 10.416 9.757 1.00 2.42 C ATOM 2490 OE1 GLN A 146 21.124 9.333 10.337 1.00 2.97 O ATOM 2491 NE2 GLN A 146 20.173 11.049 9.258 1.00 3.02 N ATOM 0 H GLN A 146 22.614 9.447 6.305 1.00 0.56 H new ATOM 0 HA GLN A 146 21.198 10.718 7.364 1.00 0.58 H new ATOM 0 HB2 GLN A 146 23.678 12.246 8.139 1.00 0.66 H new ATOM 0 HB3 GLN A 146 22.095 12.888 8.531 1.00 0.66 H new ATOM 0 HG2 GLN A 146 23.343 10.295 9.468 1.00 1.54 H new ATOM 0 HG3 GLN A 146 22.829 11.660 10.439 1.00 1.54 H new ATOM 0 HE21 GLN A 146 20.295 11.944 8.784 1.00 3.02 H new ATOM 0 HE22 GLN A 146 19.242 10.642 9.347 1.00 3.02 H new ATOM 2500 N THR A 147 22.092 12.348 4.869 1.00 0.51 N ATOM 2501 CA THR A 147 21.672 13.289 3.852 1.00 0.52 C ATOM 2502 C THR A 147 20.522 12.692 3.050 1.00 0.47 C ATOM 2503 O THR A 147 20.658 11.617 2.460 1.00 0.46 O ATOM 2504 CB THR A 147 22.841 13.647 2.919 1.00 0.56 C ATOM 2505 OG1 THR A 147 23.970 14.058 3.704 1.00 0.64 O ATOM 2506 CG2 THR A 147 22.454 14.762 1.958 1.00 0.62 C ATOM 0 H THR A 147 22.806 11.686 4.565 1.00 0.51 H new ATOM 0 HA THR A 147 21.337 14.205 4.339 1.00 0.52 H new ATOM 0 HB THR A 147 23.097 12.764 2.333 1.00 0.56 H new ATOM 0 HG1 THR A 147 24.716 14.285 3.110 1.00 0.64 H new ATOM 0 HG21 THR A 147 23.300 14.994 1.311 1.00 0.62 H new ATOM 0 HG22 THR A 147 21.609 14.441 1.349 1.00 0.62 H new ATOM 0 HG23 THR A 147 22.176 15.651 2.525 1.00 0.62 H new ATOM 2514 N LEU A 148 19.384 13.376 3.054 1.00 0.47 N ATOM 2515 CA LEU A 148 18.211 12.900 2.340 1.00 0.44 C ATOM 2516 C LEU A 148 18.415 12.969 0.833 1.00 0.44 C ATOM 2517 O LEU A 148 18.850 13.988 0.290 1.00 0.50 O ATOM 2518 CB LEU A 148 16.968 13.701 2.728 1.00 0.47 C ATOM 2519 CG LEU A 148 15.668 13.247 2.061 1.00 0.49 C ATOM 2520 CD1 LEU A 148 15.284 11.861 2.538 1.00 0.58 C ATOM 2521 CD2 LEU A 148 14.548 14.238 2.334 1.00 0.78 C ATOM 0 H LEU A 148 19.251 14.261 3.544 1.00 0.47 H new ATOM 0 HA LEU A 148 18.062 11.858 2.624 1.00 0.44 H new ATOM 0 HB2 LEU A 148 16.842 13.645 3.809 1.00 0.47 H new ATOM 0 HB3 LEU A 148 17.138 14.749 2.481 1.00 0.47 H new ATOM 0 HG LEU A 148 15.831 13.208 0.984 1.00 0.49 H new ATOM 0 HD11 LEU A 148 14.357 11.553 2.054 1.00 0.58 H new ATOM 0 HD12 LEU A 148 16.077 11.157 2.285 1.00 0.58 H new ATOM 0 HD13 LEU A 148 15.142 11.875 3.619 1.00 0.58 H new ATOM 0 HD21 LEU A 148 13.633 13.895 1.850 1.00 0.78 H new ATOM 0 HD22 LEU A 148 14.384 14.314 3.409 1.00 0.78 H new ATOM 0 HD23 LEU A 148 14.823 15.216 1.939 1.00 0.78 H new ATOM 2533 N VAL A 149 18.094 11.874 0.181 1.00 0.40 N ATOM 2534 CA VAL A 149 18.207 11.746 -1.258 1.00 0.41 C ATOM 2535 C VAL A 149 16.893 11.199 -1.820 1.00 0.39 C ATOM 2536 O VAL A 149 16.427 10.136 -1.399 1.00 0.43 O ATOM 2537 CB VAL A 149 19.370 10.804 -1.651 1.00 0.44 C ATOM 2538 CG1 VAL A 149 19.628 10.857 -3.150 1.00 0.52 C ATOM 2539 CG2 VAL A 149 20.636 11.149 -0.874 1.00 0.48 C ATOM 0 H VAL A 149 17.742 11.034 0.640 1.00 0.40 H new ATOM 0 HA VAL A 149 18.415 12.731 -1.675 1.00 0.41 H new ATOM 0 HB VAL A 149 19.080 9.786 -1.392 1.00 0.44 H new ATOM 0 HG11 VAL A 149 20.450 10.187 -3.402 1.00 0.52 H new ATOM 0 HG12 VAL A 149 18.730 10.547 -3.685 1.00 0.52 H new ATOM 0 HG13 VAL A 149 19.889 11.875 -3.438 1.00 0.52 H new ATOM 0 HG21 VAL A 149 21.439 10.473 -1.168 1.00 0.48 H new ATOM 0 HG22 VAL A 149 20.928 12.176 -1.092 1.00 0.48 H new ATOM 0 HG23 VAL A 149 20.447 11.045 0.194 1.00 0.48 H new ATOM 2549 N PRO A 150 16.258 11.937 -2.743 1.00 0.40 N ATOM 2550 CA PRO A 150 14.994 11.520 -3.352 1.00 0.42 C ATOM 2551 C PRO A 150 15.167 10.371 -4.343 1.00 0.35 C ATOM 2552 O PRO A 150 16.269 10.101 -4.825 1.00 0.42 O ATOM 2553 CB PRO A 150 14.502 12.781 -4.065 1.00 0.53 C ATOM 2554 CG PRO A 150 15.720 13.595 -4.322 1.00 0.68 C ATOM 2555 CD PRO A 150 16.717 13.245 -3.250 1.00 0.48 C ATOM 0 HA PRO A 150 14.295 11.140 -2.607 1.00 0.42 H new ATOM 0 HB2 PRO A 150 13.993 12.532 -4.996 1.00 0.53 H new ATOM 0 HB3 PRO A 150 13.788 13.327 -3.448 1.00 0.53 H new ATOM 0 HG2 PRO A 150 16.126 13.381 -5.311 1.00 0.68 H new ATOM 0 HG3 PRO A 150 15.485 14.659 -4.298 1.00 0.68 H new ATOM 0 HD2 PRO A 150 17.729 13.184 -3.651 1.00 0.48 H new ATOM 0 HD3 PRO A 150 16.732 13.996 -2.460 1.00 0.48 H new ATOM 2563 N LEU A 151 14.058 9.714 -4.642 1.00 0.43 N ATOM 2564 CA LEU A 151 14.023 8.576 -5.550 1.00 0.40 C ATOM 2565 C LEU A 151 13.783 9.018 -6.988 1.00 0.39 C ATOM 2566 O LEU A 151 13.116 10.023 -7.236 1.00 0.56 O ATOM 2567 CB LEU A 151 12.953 7.571 -5.088 1.00 0.62 C ATOM 2568 CG LEU A 151 11.468 7.946 -5.276 1.00 0.87 C ATOM 2569 CD1 LEU A 151 10.609 7.034 -4.432 1.00 1.11 C ATOM 2570 CD2 LEU A 151 11.177 9.395 -4.906 1.00 1.31 C ATOM 0 H LEU A 151 13.145 9.958 -4.257 1.00 0.43 H new ATOM 0 HA LEU A 151 14.996 8.085 -5.526 1.00 0.40 H new ATOM 0 HB2 LEU A 151 13.128 6.633 -5.615 1.00 0.62 H new ATOM 0 HB3 LEU A 151 13.115 7.376 -4.028 1.00 0.62 H new ATOM 0 HG LEU A 151 11.236 7.826 -6.334 1.00 0.87 H new ATOM 0 HD11 LEU A 151 9.560 7.298 -4.564 1.00 1.11 H new ATOM 0 HD12 LEU A 151 10.765 6.000 -4.740 1.00 1.11 H new ATOM 0 HD13 LEU A 151 10.882 7.145 -3.383 1.00 1.11 H new ATOM 0 HD21 LEU A 151 10.118 9.604 -5.058 1.00 1.31 H new ATOM 0 HD22 LEU A 151 11.434 9.562 -3.860 1.00 1.31 H new ATOM 0 HD23 LEU A 151 11.771 10.058 -5.536 1.00 1.31 H new ATOM 2582 N LYS A 152 14.352 8.275 -7.932 1.00 0.40 N ATOM 2583 CA LYS A 152 14.216 8.601 -9.345 1.00 0.53 C ATOM 2584 C LYS A 152 13.714 7.410 -10.152 1.00 0.50 C ATOM 2585 O LYS A 152 14.190 7.158 -11.262 1.00 0.58 O ATOM 2586 CB LYS A 152 15.560 9.057 -9.903 1.00 0.72 C ATOM 2587 CG LYS A 152 16.318 10.007 -8.989 1.00 0.84 C ATOM 2588 CD LYS A 152 17.648 9.414 -8.575 1.00 1.45 C ATOM 2589 CE LYS A 152 17.562 8.696 -7.235 1.00 1.66 C ATOM 2590 NZ LYS A 152 18.845 8.034 -6.875 1.00 2.55 N ATOM 0 H LYS A 152 14.911 7.443 -7.743 1.00 0.40 H new ATOM 0 HA LYS A 152 13.483 9.403 -9.430 1.00 0.53 H new ATOM 0 HB2 LYS A 152 16.179 8.180 -10.093 1.00 0.72 H new ATOM 0 HB3 LYS A 152 15.396 9.546 -10.863 1.00 0.72 H new ATOM 0 HG2 LYS A 152 16.482 10.956 -9.500 1.00 0.84 H new ATOM 0 HG3 LYS A 152 15.719 10.221 -8.104 1.00 0.84 H new ATOM 0 HD2 LYS A 152 17.986 8.715 -9.340 1.00 1.45 H new ATOM 0 HD3 LYS A 152 18.395 10.206 -8.514 1.00 1.45 H new ATOM 0 HE2 LYS A 152 17.292 9.410 -6.457 1.00 1.66 H new ATOM 0 HE3 LYS A 152 16.768 7.951 -7.273 1.00 1.66 H new ATOM 0 HZ1 LYS A 152 18.683 7.016 -6.736 1.00 2.55 H new ATOM 0 HZ2 LYS A 152 19.535 8.174 -7.641 1.00 2.55 H new ATOM 0 HZ3 LYS A 152 19.215 8.449 -5.996 1.00 2.55 H new ATOM 2604 N ILE A 153 12.749 6.682 -9.608 1.00 0.43 N ATOM 2605 CA ILE A 153 12.196 5.512 -10.291 1.00 0.43 C ATOM 2606 C ILE A 153 10.700 5.396 -10.047 1.00 0.45 C ATOM 2607 O ILE A 153 10.117 6.200 -9.318 1.00 0.48 O ATOM 2608 CB ILE A 153 12.846 4.183 -9.840 1.00 0.39 C ATOM 2609 CG1 ILE A 153 12.660 3.959 -8.334 1.00 0.38 C ATOM 2610 CG2 ILE A 153 14.319 4.133 -10.225 1.00 0.42 C ATOM 2611 CD1 ILE A 153 13.736 4.582 -7.479 1.00 0.40 C ATOM 0 H ILE A 153 12.331 6.877 -8.698 1.00 0.43 H new ATOM 0 HA ILE A 153 12.410 5.668 -11.348 1.00 0.43 H new ATOM 0 HB ILE A 153 12.339 3.372 -10.362 1.00 0.39 H new ATOM 0 HG12 ILE A 153 11.693 4.364 -8.034 1.00 0.38 H new ATOM 0 HG13 ILE A 153 12.631 2.887 -8.138 1.00 0.38 H new ATOM 0 HG21 ILE A 153 14.749 3.187 -9.895 1.00 0.42 H new ATOM 0 HG22 ILE A 153 14.415 4.218 -11.307 1.00 0.42 H new ATOM 0 HG23 ILE A 153 14.848 4.958 -9.748 1.00 0.42 H new ATOM 0 HD11 ILE A 153 13.530 4.377 -6.428 1.00 0.40 H new ATOM 0 HD12 ILE A 153 14.704 4.160 -7.748 1.00 0.40 H new ATOM 0 HD13 ILE A 153 13.752 5.660 -7.642 1.00 0.40 H new ATOM 2623 N THR A 154 10.087 4.394 -10.660 1.00 0.47 N ATOM 2624 CA THR A 154 8.663 4.165 -10.486 1.00 0.52 C ATOM 2625 C THR A 154 8.313 2.670 -10.533 1.00 0.53 C ATOM 2626 O THR A 154 7.195 2.280 -10.193 1.00 0.74 O ATOM 2627 CB THR A 154 7.843 4.943 -11.540 1.00 0.61 C ATOM 2628 OG1 THR A 154 6.450 4.926 -11.198 1.00 0.70 O ATOM 2629 CG2 THR A 154 8.038 4.364 -12.934 1.00 0.71 C ATOM 0 H THR A 154 10.552 3.730 -11.279 1.00 0.47 H new ATOM 0 HA THR A 154 8.399 4.536 -9.496 1.00 0.52 H new ATOM 0 HB THR A 154 8.202 5.972 -11.545 1.00 0.61 H new ATOM 0 HG1 THR A 154 6.233 4.081 -10.751 1.00 0.70 H new ATOM 0 HG21 THR A 154 7.447 4.934 -13.651 1.00 0.71 H new ATOM 0 HG22 THR A 154 9.092 4.419 -13.207 1.00 0.71 H new ATOM 0 HG23 THR A 154 7.715 3.323 -12.944 1.00 0.71 H new ATOM 2637 N THR A 155 9.254 1.830 -10.945 1.00 0.45 N ATOM 2638 CA THR A 155 8.992 0.393 -11.012 1.00 0.46 C ATOM 2639 C THR A 155 9.817 -0.381 -9.983 1.00 0.42 C ATOM 2640 O THR A 155 10.884 0.070 -9.574 1.00 0.40 O ATOM 2641 CB THR A 155 9.289 -0.150 -12.422 1.00 0.51 C ATOM 2642 OG1 THR A 155 8.940 0.838 -13.399 1.00 0.62 O ATOM 2643 CG2 THR A 155 8.507 -1.429 -12.688 1.00 0.56 C ATOM 0 H THR A 155 10.191 2.110 -11.234 1.00 0.45 H new ATOM 0 HA THR A 155 7.936 0.249 -10.784 1.00 0.46 H new ATOM 0 HB THR A 155 10.353 -0.376 -12.488 1.00 0.51 H new ATOM 0 HG1 THR A 155 9.131 0.493 -14.296 1.00 0.62 H new ATOM 0 HG21 THR A 155 8.734 -1.793 -13.690 1.00 0.56 H new ATOM 0 HG22 THR A 155 8.787 -2.186 -11.955 1.00 0.56 H new ATOM 0 HG23 THR A 155 7.439 -1.226 -12.609 1.00 0.56 H new ATOM 2651 N GLU A 156 9.305 -1.542 -9.567 1.00 0.44 N ATOM 2652 CA GLU A 156 9.993 -2.394 -8.594 1.00 0.43 C ATOM 2653 C GLU A 156 11.403 -2.723 -9.065 1.00 0.41 C ATOM 2654 O GLU A 156 12.369 -2.539 -8.328 1.00 0.39 O ATOM 2655 CB GLU A 156 9.224 -3.698 -8.372 1.00 0.50 C ATOM 2656 CG GLU A 156 7.829 -3.520 -7.800 1.00 0.53 C ATOM 2657 CD GLU A 156 7.007 -4.792 -7.891 1.00 1.06 C ATOM 2658 OE1 GLU A 156 7.425 -5.724 -8.609 1.00 1.72 O ATOM 2659 OE2 GLU A 156 5.930 -4.862 -7.257 1.00 1.75 O ATOM 0 H GLU A 156 8.412 -1.915 -9.891 1.00 0.44 H new ATOM 0 HA GLU A 156 10.045 -1.842 -7.655 1.00 0.43 H new ATOM 0 HB2 GLU A 156 9.148 -4.226 -9.323 1.00 0.50 H new ATOM 0 HB3 GLU A 156 9.800 -4.334 -7.699 1.00 0.50 H new ATOM 0 HG2 GLU A 156 7.902 -3.210 -6.757 1.00 0.53 H new ATOM 0 HG3 GLU A 156 7.318 -2.720 -8.335 1.00 0.53 H new ATOM 2666 N LYS A 157 11.510 -3.207 -10.300 1.00 0.44 N ATOM 2667 CA LYS A 157 12.801 -3.555 -10.882 1.00 0.44 C ATOM 2668 C LYS A 157 13.703 -2.332 -10.918 1.00 0.40 C ATOM 2669 O LYS A 157 14.868 -2.384 -10.520 1.00 0.39 O ATOM 2670 CB LYS A 157 12.612 -4.107 -12.290 1.00 0.49 C ATOM 2671 CG LYS A 157 11.825 -5.407 -12.330 1.00 0.69 C ATOM 2672 CD LYS A 157 12.711 -6.600 -12.023 1.00 1.05 C ATOM 2673 CE LYS A 157 13.511 -7.017 -13.245 1.00 1.58 C ATOM 2674 NZ LYS A 157 12.727 -7.900 -14.147 1.00 2.00 N ATOM 0 H LYS A 157 10.714 -3.367 -10.918 1.00 0.44 H new ATOM 0 HA LYS A 157 13.269 -4.322 -10.265 1.00 0.44 H new ATOM 0 HB2 LYS A 157 12.099 -3.362 -12.898 1.00 0.49 H new ATOM 0 HB3 LYS A 157 13.590 -4.269 -12.743 1.00 0.49 H new ATOM 0 HG2 LYS A 157 11.009 -5.363 -11.609 1.00 0.69 H new ATOM 0 HG3 LYS A 157 11.374 -5.531 -13.314 1.00 0.69 H new ATOM 0 HD2 LYS A 157 13.390 -6.352 -11.207 1.00 1.05 H new ATOM 0 HD3 LYS A 157 12.097 -7.435 -11.684 1.00 1.05 H new ATOM 0 HE2 LYS A 157 13.827 -6.129 -13.792 1.00 1.58 H new ATOM 0 HE3 LYS A 157 14.416 -7.535 -12.927 1.00 1.58 H new ATOM 0 HZ1 LYS A 157 13.309 -8.162 -14.968 1.00 2.00 H new ATOM 0 HZ2 LYS A 157 12.446 -8.760 -13.633 1.00 2.00 H new ATOM 0 HZ3 LYS A 157 11.876 -7.397 -14.472 1.00 2.00 H new ATOM 2688 N GLU A 158 13.136 -1.233 -11.383 1.00 0.41 N ATOM 2689 CA GLU A 158 13.837 0.033 -11.466 1.00 0.39 C ATOM 2690 C GLU A 158 14.411 0.392 -10.099 1.00 0.35 C ATOM 2691 O GLU A 158 15.582 0.757 -9.971 1.00 0.34 O ATOM 2692 CB GLU A 158 12.836 1.097 -11.904 1.00 0.43 C ATOM 2693 CG GLU A 158 13.359 2.113 -12.895 1.00 0.53 C ATOM 2694 CD GLU A 158 12.232 2.925 -13.493 1.00 1.06 C ATOM 2695 OE1 GLU A 158 11.259 3.206 -12.763 1.00 1.71 O ATOM 2696 OE2 GLU A 158 12.303 3.267 -14.694 1.00 1.71 O ATOM 0 H GLU A 158 12.172 -1.195 -11.715 1.00 0.41 H new ATOM 0 HA GLU A 158 14.657 -0.031 -12.181 1.00 0.39 H new ATOM 0 HB2 GLU A 158 11.971 0.599 -12.343 1.00 0.43 H new ATOM 0 HB3 GLU A 158 12.484 1.626 -11.019 1.00 0.43 H new ATOM 0 HG2 GLU A 158 14.066 2.778 -12.399 1.00 0.53 H new ATOM 0 HG3 GLU A 158 13.904 1.603 -13.689 1.00 0.53 H new ATOM 2703 N LEU A 159 13.571 0.238 -9.085 1.00 0.35 N ATOM 2704 CA LEU A 159 13.931 0.537 -7.713 1.00 0.32 C ATOM 2705 C LEU A 159 15.030 -0.386 -7.187 1.00 0.31 C ATOM 2706 O LEU A 159 16.050 0.093 -6.705 1.00 0.30 O ATOM 2707 CB LEU A 159 12.694 0.424 -6.825 1.00 0.34 C ATOM 2708 CG LEU A 159 12.955 0.563 -5.332 1.00 0.36 C ATOM 2709 CD1 LEU A 159 13.419 1.966 -5.001 1.00 0.55 C ATOM 2710 CD2 LEU A 159 11.710 0.218 -4.546 1.00 0.41 C ATOM 0 H LEU A 159 12.615 -0.100 -9.196 1.00 0.35 H new ATOM 0 HA LEU A 159 14.322 1.554 -7.689 1.00 0.32 H new ATOM 0 HB2 LEU A 159 11.979 1.190 -7.126 1.00 0.34 H new ATOM 0 HB3 LEU A 159 12.222 -0.542 -7.007 1.00 0.34 H new ATOM 0 HG LEU A 159 13.745 -0.134 -5.053 1.00 0.36 H new ATOM 0 HD11 LEU A 159 13.600 2.046 -3.929 1.00 0.55 H new ATOM 0 HD12 LEU A 159 14.340 2.182 -5.542 1.00 0.55 H new ATOM 0 HD13 LEU A 159 12.651 2.682 -5.293 1.00 0.55 H new ATOM 0 HD21 LEU A 159 11.912 0.322 -3.480 1.00 0.41 H new ATOM 0 HD22 LEU A 159 10.902 0.893 -4.830 1.00 0.41 H new ATOM 0 HD23 LEU A 159 11.417 -0.810 -4.761 1.00 0.41 H new ATOM 2722 N ILE A 160 14.827 -1.699 -7.278 1.00 0.33 N ATOM 2723 CA ILE A 160 15.823 -2.651 -6.784 1.00 0.34 C ATOM 2724 C ILE A 160 17.160 -2.442 -7.489 1.00 0.33 C ATOM 2725 O ILE A 160 18.218 -2.469 -6.851 1.00 0.33 O ATOM 2726 CB ILE A 160 15.368 -4.128 -6.909 1.00 0.38 C ATOM 2727 CG1 ILE A 160 14.877 -4.451 -8.321 1.00 0.40 C ATOM 2728 CG2 ILE A 160 14.281 -4.430 -5.893 1.00 0.43 C ATOM 2729 CD1 ILE A 160 15.841 -5.297 -9.121 1.00 0.42 C ATOM 0 H ILE A 160 13.994 -2.125 -7.683 1.00 0.33 H new ATOM 0 HA ILE A 160 15.941 -2.451 -5.719 1.00 0.34 H new ATOM 0 HB ILE A 160 16.233 -4.759 -6.707 1.00 0.38 H new ATOM 0 HG12 ILE A 160 13.921 -4.970 -8.254 1.00 0.40 H new ATOM 0 HG13 ILE A 160 14.696 -3.518 -8.855 1.00 0.40 H new ATOM 0 HG21 ILE A 160 13.970 -5.470 -5.991 1.00 0.43 H new ATOM 0 HG22 ILE A 160 14.665 -4.259 -4.887 1.00 0.43 H new ATOM 0 HG23 ILE A 160 13.426 -3.778 -6.070 1.00 0.43 H new ATOM 0 HD11 ILE A 160 15.425 -5.485 -10.111 1.00 0.42 H new ATOM 0 HD12 ILE A 160 16.791 -4.771 -9.220 1.00 0.42 H new ATOM 0 HD13 ILE A 160 16.004 -6.246 -8.609 1.00 0.42 H new ATOM 2741 N LYS A 161 17.116 -2.202 -8.797 1.00 0.34 N ATOM 2742 CA LYS A 161 18.331 -1.965 -9.558 1.00 0.35 C ATOM 2743 C LYS A 161 18.965 -0.648 -9.117 1.00 0.34 C ATOM 2744 O LYS A 161 20.189 -0.543 -9.016 1.00 0.37 O ATOM 2745 CB LYS A 161 18.042 -1.941 -11.061 1.00 0.41 C ATOM 2746 CG LYS A 161 17.588 -3.277 -11.622 1.00 0.78 C ATOM 2747 CD LYS A 161 18.659 -4.346 -11.470 1.00 1.43 C ATOM 2748 CE LYS A 161 19.051 -4.934 -12.815 1.00 1.61 C ATOM 2749 NZ LYS A 161 20.036 -6.035 -12.676 1.00 2.63 N ATOM 0 H LYS A 161 16.257 -2.167 -9.345 1.00 0.34 H new ATOM 0 HA LYS A 161 19.027 -2.781 -9.365 1.00 0.35 H new ATOM 0 HB2 LYS A 161 17.274 -1.194 -11.261 1.00 0.41 H new ATOM 0 HB3 LYS A 161 18.941 -1.623 -11.589 1.00 0.41 H new ATOM 0 HG2 LYS A 161 16.680 -3.597 -11.110 1.00 0.78 H new ATOM 0 HG3 LYS A 161 17.336 -3.162 -12.676 1.00 0.78 H new ATOM 0 HD2 LYS A 161 19.538 -3.917 -10.989 1.00 1.43 H new ATOM 0 HD3 LYS A 161 18.294 -5.139 -10.817 1.00 1.43 H new ATOM 0 HE2 LYS A 161 18.160 -5.307 -13.321 1.00 1.61 H new ATOM 0 HE3 LYS A 161 19.471 -4.150 -13.445 1.00 1.61 H new ATOM 0 HZ1 LYS A 161 20.276 -6.407 -13.617 1.00 2.63 H new ATOM 0 HZ2 LYS A 161 20.897 -5.675 -12.217 1.00 2.63 H new ATOM 0 HZ3 LYS A 161 19.627 -6.796 -12.097 1.00 2.63 H new ATOM 2763 N GLU A 162 18.126 0.349 -8.848 1.00 0.33 N ATOM 2764 CA GLU A 162 18.603 1.651 -8.396 1.00 0.35 C ATOM 2765 C GLU A 162 19.220 1.541 -7.000 1.00 0.34 C ATOM 2766 O GLU A 162 20.217 2.198 -6.701 1.00 0.37 O ATOM 2767 CB GLU A 162 17.457 2.661 -8.398 1.00 0.36 C ATOM 2768 CG GLU A 162 17.856 4.045 -8.902 1.00 0.66 C ATOM 2769 CD GLU A 162 17.973 5.075 -7.796 1.00 0.92 C ATOM 2770 OE1 GLU A 162 16.935 5.607 -7.357 1.00 1.73 O ATOM 2771 OE2 GLU A 162 19.109 5.369 -7.364 1.00 1.62 O ATOM 0 H GLU A 162 17.112 0.279 -8.936 1.00 0.33 H new ATOM 0 HA GLU A 162 19.374 1.998 -9.084 1.00 0.35 H new ATOM 0 HB2 GLU A 162 16.648 2.277 -9.020 1.00 0.36 H new ATOM 0 HB3 GLU A 162 17.064 2.753 -7.385 1.00 0.36 H new ATOM 0 HG2 GLU A 162 18.810 3.973 -9.424 1.00 0.66 H new ATOM 0 HG3 GLU A 162 17.119 4.385 -9.630 1.00 0.66 H new ATOM 2778 N LEU A 163 18.630 0.692 -6.156 1.00 0.32 N ATOM 2779 CA LEU A 163 19.121 0.493 -4.794 1.00 0.33 C ATOM 2780 C LEU A 163 20.418 -0.307 -4.783 1.00 0.34 C ATOM 2781 O LEU A 163 21.237 -0.166 -3.872 1.00 0.36 O ATOM 2782 CB LEU A 163 18.079 -0.245 -3.952 1.00 0.33 C ATOM 2783 CG LEU A 163 16.740 0.467 -3.782 1.00 0.35 C ATOM 2784 CD1 LEU A 163 15.745 -0.451 -3.093 1.00 0.35 C ATOM 2785 CD2 LEU A 163 16.915 1.760 -3.001 1.00 0.46 C ATOM 0 H LEU A 163 17.811 0.132 -6.393 1.00 0.32 H new ATOM 0 HA LEU A 163 19.309 1.479 -4.370 1.00 0.33 H new ATOM 0 HB2 LEU A 163 17.896 -1.219 -4.405 1.00 0.33 H new ATOM 0 HB3 LEU A 163 18.501 -0.427 -2.964 1.00 0.33 H new ATOM 0 HG LEU A 163 16.351 0.721 -4.768 1.00 0.35 H new ATOM 0 HD11 LEU A 163 14.793 0.067 -2.976 1.00 0.35 H new ATOM 0 HD12 LEU A 163 15.599 -1.348 -3.696 1.00 0.35 H new ATOM 0 HD13 LEU A 163 16.128 -0.732 -2.112 1.00 0.35 H new ATOM 0 HD21 LEU A 163 15.949 2.252 -2.891 1.00 0.46 H new ATOM 0 HD22 LEU A 163 17.323 1.537 -2.015 1.00 0.46 H new ATOM 0 HD23 LEU A 163 17.599 2.419 -3.536 1.00 0.46 H new ATOM 2797 N GLY A 164 20.606 -1.140 -5.798 1.00 0.33 N ATOM 2798 CA GLY A 164 21.810 -1.942 -5.876 1.00 0.35 C ATOM 2799 C GLY A 164 21.587 -3.390 -5.487 1.00 0.37 C ATOM 2800 O GLY A 164 22.507 -4.051 -4.998 1.00 0.43 O ATOM 0 H GLY A 164 19.948 -1.274 -6.566 1.00 0.33 H new ATOM 0 HA2 GLY A 164 22.201 -1.901 -6.893 1.00 0.35 H new ATOM 0 HA3 GLY A 164 22.570 -1.510 -5.225 1.00 0.35 H new ATOM 2804 N PHE A 165 20.380 -3.902 -5.707 1.00 0.35 N ATOM 2805 CA PHE A 165 20.074 -5.285 -5.356 1.00 0.38 C ATOM 2806 C PHE A 165 19.453 -6.032 -6.528 1.00 0.41 C ATOM 2807 O PHE A 165 19.189 -5.451 -7.581 1.00 0.45 O ATOM 2808 CB PHE A 165 19.140 -5.338 -4.145 1.00 0.38 C ATOM 2809 CG PHE A 165 19.787 -4.849 -2.882 1.00 0.37 C ATOM 2810 CD1 PHE A 165 20.575 -5.695 -2.119 1.00 1.23 C ATOM 2811 CD2 PHE A 165 19.619 -3.540 -2.467 1.00 1.23 C ATOM 2812 CE1 PHE A 165 21.183 -5.242 -0.966 1.00 1.25 C ATOM 2813 CE2 PHE A 165 20.223 -3.084 -1.318 1.00 1.25 C ATOM 2814 CZ PHE A 165 21.007 -3.935 -0.565 1.00 0.48 C ATOM 0 H PHE A 165 19.604 -3.386 -6.123 1.00 0.35 H new ATOM 0 HA PHE A 165 21.013 -5.776 -5.101 1.00 0.38 H new ATOM 0 HB2 PHE A 165 18.255 -4.736 -4.350 1.00 0.38 H new ATOM 0 HB3 PHE A 165 18.801 -6.364 -3.999 1.00 0.38 H new ATOM 0 HD1 PHE A 165 20.715 -6.720 -2.430 1.00 1.23 H new ATOM 0 HD2 PHE A 165 19.007 -2.869 -3.051 1.00 1.23 H new ATOM 0 HE1 PHE A 165 21.796 -5.910 -0.379 1.00 1.25 H new ATOM 0 HE2 PHE A 165 20.084 -2.060 -1.005 1.00 1.25 H new ATOM 0 HZ PHE A 165 21.482 -3.577 0.337 1.00 0.48 H new ATOM 2824 N THR A 166 19.241 -7.325 -6.335 1.00 0.47 N ATOM 2825 CA THR A 166 18.651 -8.172 -7.360 1.00 0.52 C ATOM 2826 C THR A 166 17.173 -8.415 -7.052 1.00 0.51 C ATOM 2827 O THR A 166 16.767 -8.410 -5.885 1.00 0.51 O ATOM 2828 CB THR A 166 19.411 -9.515 -7.473 1.00 0.61 C ATOM 2829 OG1 THR A 166 19.037 -10.203 -8.673 1.00 1.46 O ATOM 2830 CG2 THR A 166 19.144 -10.409 -6.267 1.00 1.43 C ATOM 0 H THR A 166 19.471 -7.814 -5.470 1.00 0.47 H new ATOM 0 HA THR A 166 18.731 -7.660 -8.319 1.00 0.52 H new ATOM 0 HB THR A 166 20.476 -9.287 -7.503 1.00 0.61 H new ATOM 0 HG1 THR A 166 19.527 -11.050 -8.731 1.00 1.46 H new ATOM 0 HG21 THR A 166 19.693 -11.344 -6.379 1.00 1.43 H new ATOM 0 HG22 THR A 166 19.471 -9.902 -5.359 1.00 1.43 H new ATOM 0 HG23 THR A 166 18.077 -10.621 -6.200 1.00 1.43 H new ATOM 2838 N TYR A 167 16.370 -8.615 -8.091 1.00 0.55 N ATOM 2839 CA TYR A 167 14.945 -8.835 -7.907 1.00 0.57 C ATOM 2840 C TYR A 167 14.672 -10.230 -7.354 1.00 0.57 C ATOM 2841 O TYR A 167 14.928 -11.240 -8.011 1.00 0.67 O ATOM 2842 CB TYR A 167 14.184 -8.627 -9.219 1.00 0.68 C ATOM 2843 CG TYR A 167 12.693 -8.485 -9.020 1.00 0.74 C ATOM 2844 CD1 TYR A 167 12.171 -7.461 -8.238 1.00 1.41 C ATOM 2845 CD2 TYR A 167 11.808 -9.380 -9.606 1.00 1.43 C ATOM 2846 CE1 TYR A 167 10.806 -7.333 -8.050 1.00 1.49 C ATOM 2847 CE2 TYR A 167 10.444 -9.259 -9.421 1.00 1.49 C ATOM 2848 CZ TYR A 167 9.947 -8.234 -8.642 1.00 0.95 C ATOM 2849 OH TYR A 167 8.587 -8.116 -8.456 1.00 1.08 O ATOM 0 H TYR A 167 16.681 -8.629 -9.062 1.00 0.55 H new ATOM 0 HA TYR A 167 14.590 -8.103 -7.182 1.00 0.57 H new ATOM 0 HB2 TYR A 167 14.565 -7.735 -9.716 1.00 0.68 H new ATOM 0 HB3 TYR A 167 14.378 -9.470 -9.883 1.00 0.68 H new ATOM 0 HD1 TYR A 167 12.841 -6.755 -7.770 1.00 1.41 H new ATOM 0 HD2 TYR A 167 12.192 -10.184 -10.216 1.00 1.43 H new ATOM 0 HE1 TYR A 167 10.415 -6.530 -7.442 1.00 1.49 H new ATOM 0 HE2 TYR A 167 9.769 -9.964 -9.884 1.00 1.49 H new ATOM 0 HH TYR A 167 8.320 -7.181 -8.576 1.00 1.08 H new ATOM 2859 N ARG A 168 14.162 -10.262 -6.138 1.00 0.58 N ATOM 2860 CA ARG A 168 13.840 -11.506 -5.460 1.00 0.64 C ATOM 2861 C ARG A 168 12.343 -11.759 -5.507 1.00 0.61 C ATOM 2862 O ARG A 168 11.557 -10.829 -5.704 1.00 0.65 O ATOM 2863 CB ARG A 168 14.302 -11.430 -4.011 1.00 0.78 C ATOM 2864 CG ARG A 168 15.808 -11.447 -3.846 1.00 1.05 C ATOM 2865 CD ARG A 168 16.371 -12.834 -4.093 1.00 1.59 C ATOM 2866 NE ARG A 168 17.768 -12.944 -3.672 1.00 2.25 N ATOM 2867 CZ ARG A 168 18.155 -13.156 -2.411 1.00 3.01 C ATOM 2868 NH1 ARG A 168 17.259 -13.256 -1.435 1.00 3.43 N ATOM 2869 NH2 ARG A 168 19.444 -13.271 -2.126 1.00 3.74 N ATOM 0 H ARG A 168 13.958 -9.426 -5.590 1.00 0.58 H new ATOM 0 HA ARG A 168 14.351 -12.327 -5.964 1.00 0.64 H new ATOM 0 HB2 ARG A 168 13.907 -10.519 -3.561 1.00 0.78 H new ATOM 0 HB3 ARG A 168 13.876 -12.268 -3.460 1.00 0.78 H new ATOM 0 HG2 ARG A 168 16.261 -10.739 -4.540 1.00 1.05 H new ATOM 0 HG3 ARG A 168 16.070 -11.119 -2.840 1.00 1.05 H new ATOM 0 HD2 ARG A 168 15.772 -13.569 -3.555 1.00 1.59 H new ATOM 0 HD3 ARG A 168 16.293 -13.073 -5.154 1.00 1.59 H new ATOM 0 HE ARG A 168 18.491 -12.853 -4.386 1.00 2.25 H new ATOM 0 HH11 ARG A 168 16.264 -13.171 -1.645 1.00 3.43 H new ATOM 0 HH12 ARG A 168 17.566 -13.418 -0.476 1.00 3.43 H new ATOM 0 HH21 ARG A 168 20.139 -13.198 -2.869 1.00 3.74 H new ATOM 0 HH22 ARG A 168 19.741 -13.433 -1.164 1.00 3.74 H new ATOM 2883 N ILE A 169 11.945 -13.011 -5.337 1.00 0.63 N ATOM 2884 CA ILE A 169 10.539 -13.354 -5.346 1.00 0.61 C ATOM 2885 C ILE A 169 10.089 -13.722 -3.929 1.00 0.59 C ATOM 2886 O ILE A 169 10.618 -14.650 -3.313 1.00 0.56 O ATOM 2887 CB ILE A 169 10.211 -14.500 -6.340 1.00 0.63 C ATOM 2888 CG1 ILE A 169 10.829 -15.826 -5.887 1.00 0.61 C ATOM 2889 CG2 ILE A 169 10.706 -14.141 -7.735 1.00 0.71 C ATOM 2890 CD1 ILE A 169 10.452 -17.006 -6.757 1.00 0.67 C ATOM 0 H ILE A 169 12.575 -13.800 -5.192 1.00 0.63 H new ATOM 0 HA ILE A 169 9.988 -12.478 -5.690 1.00 0.61 H new ATOM 0 HB ILE A 169 9.128 -14.625 -6.363 1.00 0.63 H new ATOM 0 HG12 ILE A 169 11.914 -15.726 -5.878 1.00 0.61 H new ATOM 0 HG13 ILE A 169 10.519 -16.029 -4.862 1.00 0.61 H new ATOM 0 HG21 ILE A 169 10.471 -14.952 -8.424 1.00 0.71 H new ATOM 0 HG22 ILE A 169 10.217 -13.226 -8.070 1.00 0.71 H new ATOM 0 HG23 ILE A 169 11.785 -13.988 -7.710 1.00 0.71 H new ATOM 0 HD11 ILE A 169 10.928 -17.908 -6.373 1.00 0.67 H new ATOM 0 HD12 ILE A 169 9.370 -17.134 -6.747 1.00 0.67 H new ATOM 0 HD13 ILE A 169 10.787 -16.826 -7.779 1.00 0.67 H new ATOM 2902 N PRO A 170 9.107 -12.993 -3.385 1.00 0.65 N ATOM 2903 CA PRO A 170 8.597 -13.233 -2.028 1.00 0.69 C ATOM 2904 C PRO A 170 8.059 -14.648 -1.829 1.00 0.63 C ATOM 2905 O PRO A 170 7.954 -15.133 -0.699 1.00 0.66 O ATOM 2906 CB PRO A 170 7.459 -12.224 -1.882 1.00 0.83 C ATOM 2907 CG PRO A 170 7.154 -11.738 -3.257 1.00 0.83 C ATOM 2908 CD PRO A 170 8.428 -11.860 -4.037 1.00 0.76 C ATOM 0 HA PRO A 170 9.391 -13.124 -1.289 1.00 0.69 H new ATOM 0 HB2 PRO A 170 6.583 -12.689 -1.430 1.00 0.83 H new ATOM 0 HB3 PRO A 170 7.752 -11.398 -1.234 1.00 0.83 H new ATOM 0 HG2 PRO A 170 6.361 -12.331 -3.712 1.00 0.83 H new ATOM 0 HG3 PRO A 170 6.808 -10.705 -3.237 1.00 0.83 H new ATOM 0 HD2 PRO A 170 8.238 -12.056 -5.092 1.00 0.76 H new ATOM 0 HD3 PRO A 170 9.023 -10.948 -3.984 1.00 0.76 H new ATOM 2916 N LYS A 171 7.730 -15.301 -2.935 1.00 0.62 N ATOM 2917 CA LYS A 171 7.186 -16.649 -2.923 1.00 0.63 C ATOM 2918 C LYS A 171 8.134 -17.643 -2.258 1.00 0.63 C ATOM 2919 O LYS A 171 7.707 -18.486 -1.476 1.00 0.73 O ATOM 2920 CB LYS A 171 6.886 -17.087 -4.359 1.00 0.65 C ATOM 2921 CG LYS A 171 5.683 -16.376 -4.961 1.00 0.76 C ATOM 2922 CD LYS A 171 6.107 -15.314 -5.968 1.00 0.79 C ATOM 2923 CE LYS A 171 6.578 -15.943 -7.268 1.00 0.81 C ATOM 2924 NZ LYS A 171 5.499 -15.987 -8.290 1.00 1.03 N ATOM 0 H LYS A 171 7.834 -14.907 -3.870 1.00 0.62 H new ATOM 0 HA LYS A 171 6.267 -16.637 -2.336 1.00 0.63 H new ATOM 0 HB2 LYS A 171 7.761 -16.897 -4.981 1.00 0.65 H new ATOM 0 HB3 LYS A 171 6.710 -18.163 -4.375 1.00 0.65 H new ATOM 0 HG2 LYS A 171 5.036 -17.104 -5.450 1.00 0.76 H new ATOM 0 HG3 LYS A 171 5.098 -15.912 -4.167 1.00 0.76 H new ATOM 0 HD2 LYS A 171 5.270 -14.644 -6.168 1.00 0.79 H new ATOM 0 HD3 LYS A 171 6.907 -14.707 -5.544 1.00 0.79 H new ATOM 0 HE2 LYS A 171 7.424 -15.377 -7.658 1.00 0.81 H new ATOM 0 HE3 LYS A 171 6.934 -16.955 -7.073 1.00 0.81 H new ATOM 0 HZ1 LYS A 171 5.858 -16.439 -9.155 1.00 1.03 H new ATOM 0 HZ2 LYS A 171 4.695 -16.534 -7.922 1.00 1.03 H new ATOM 0 HZ3 LYS A 171 5.188 -15.019 -8.509 1.00 1.03 H new ATOM 2938 N LYS A 172 9.419 -17.517 -2.543 1.00 0.59 N ATOM 2939 CA LYS A 172 10.414 -18.425 -1.984 1.00 0.66 C ATOM 2940 C LYS A 172 11.112 -17.792 -0.783 1.00 0.70 C ATOM 2941 O LYS A 172 12.160 -18.272 -0.341 1.00 0.80 O ATOM 2942 CB LYS A 172 11.431 -18.813 -3.063 1.00 0.70 C ATOM 2943 CG LYS A 172 11.054 -20.062 -3.849 1.00 0.77 C ATOM 2944 CD LYS A 172 9.664 -19.953 -4.462 1.00 0.71 C ATOM 2945 CE LYS A 172 9.379 -21.106 -5.407 1.00 0.82 C ATOM 2946 NZ LYS A 172 9.168 -22.384 -4.679 1.00 1.16 N ATOM 0 H LYS A 172 9.800 -16.797 -3.157 1.00 0.59 H new ATOM 0 HA LYS A 172 9.909 -19.327 -1.638 1.00 0.66 H new ATOM 0 HB2 LYS A 172 11.545 -17.980 -3.757 1.00 0.70 H new ATOM 0 HB3 LYS A 172 12.402 -18.971 -2.593 1.00 0.70 H new ATOM 0 HG2 LYS A 172 11.786 -20.228 -4.639 1.00 0.77 H new ATOM 0 HG3 LYS A 172 11.093 -20.930 -3.191 1.00 0.77 H new ATOM 0 HD2 LYS A 172 8.916 -19.938 -3.669 1.00 0.71 H new ATOM 0 HD3 LYS A 172 9.576 -19.010 -5.001 1.00 0.71 H new ATOM 0 HE2 LYS A 172 8.494 -20.877 -6.001 1.00 0.82 H new ATOM 0 HE3 LYS A 172 10.210 -21.218 -6.103 1.00 0.82 H new ATOM 0 HZ1 LYS A 172 8.976 -23.145 -5.362 1.00 1.16 H new ATOM 0 HZ2 LYS A 172 10.021 -22.617 -4.132 1.00 1.16 H new ATOM 0 HZ3 LYS A 172 8.358 -22.286 -4.033 1.00 1.16 H new ATOM 2960 N ARG A 173 10.500 -16.717 -0.265 1.00 0.68 N ATOM 2961 CA ARG A 173 11.014 -15.967 0.888 1.00 0.76 C ATOM 2962 C ARG A 173 12.257 -15.169 0.511 1.00 0.61 C ATOM 2963 O ARG A 173 13.160 -15.685 -0.151 1.00 0.97 O ATOM 2964 CB ARG A 173 11.305 -16.887 2.081 1.00 1.36 C ATOM 2965 CG ARG A 173 10.078 -17.590 2.653 1.00 1.98 C ATOM 2966 CD ARG A 173 9.119 -16.615 3.324 1.00 2.47 C ATOM 2967 NE ARG A 173 8.359 -15.842 2.346 1.00 2.99 N ATOM 2968 CZ ARG A 173 7.316 -15.066 2.643 1.00 3.79 C ATOM 2969 NH1 ARG A 173 6.875 -14.966 3.892 1.00 4.07 N ATOM 2970 NH2 ARG A 173 6.708 -14.394 1.673 1.00 4.60 N ATOM 0 H ARG A 173 9.628 -16.342 -0.638 1.00 0.68 H new ATOM 0 HA ARG A 173 10.234 -15.268 1.192 1.00 0.76 H new ATOM 0 HB2 ARG A 173 12.030 -17.641 1.774 1.00 1.36 H new ATOM 0 HB3 ARG A 173 11.772 -16.299 2.871 1.00 1.36 H new ATOM 0 HG2 ARG A 173 9.557 -18.117 1.854 1.00 1.98 H new ATOM 0 HG3 ARG A 173 10.395 -18.341 3.376 1.00 1.98 H new ATOM 0 HD2 ARG A 173 8.431 -17.165 3.966 1.00 2.47 H new ATOM 0 HD3 ARG A 173 9.681 -15.937 3.966 1.00 2.47 H new ATOM 0 HE ARG A 173 8.645 -15.899 1.369 1.00 2.99 H new ATOM 0 HH11 ARG A 173 7.335 -15.487 4.639 1.00 4.07 H new ATOM 0 HH12 ARG A 173 6.076 -14.369 4.104 1.00 4.07 H new ATOM 0 HH21 ARG A 173 7.040 -14.474 0.712 1.00 4.60 H new ATOM 0 HH22 ARG A 173 5.909 -13.798 1.889 1.00 4.60 H new ATOM 2984 N LEU A 174 12.298 -13.912 0.957 1.00 0.60 N ATOM 2985 CA LEU A 174 13.403 -13.017 0.660 1.00 1.13 C ATOM 2986 C LEU A 174 13.584 -12.868 -0.848 1.00 1.70 C ATOM 2987 O LEU A 174 14.650 -13.263 -1.373 1.00 2.14 O ATOM 2988 CB LEU A 174 14.691 -13.514 1.314 1.00 1.32 C ATOM 2989 CG LEU A 174 14.921 -13.037 2.750 1.00 1.64 C ATOM 2990 CD1 LEU A 174 14.204 -13.940 3.742 1.00 1.79 C ATOM 2991 CD2 LEU A 174 16.409 -12.978 3.060 1.00 2.09 C ATOM 2992 OXT LEU A 174 12.648 -12.365 -1.496 1.00 2.37 O ATOM 0 H LEU A 174 11.566 -13.493 1.531 1.00 0.60 H new ATOM 0 HA LEU A 174 13.169 -12.036 1.073 1.00 1.13 H new ATOM 0 HB2 LEU A 174 14.686 -14.604 1.307 1.00 1.32 H new ATOM 0 HB3 LEU A 174 15.536 -13.196 0.703 1.00 1.32 H new ATOM 0 HG LEU A 174 14.508 -12.033 2.845 1.00 1.64 H new ATOM 0 HD11 LEU A 174 14.382 -13.581 4.756 1.00 1.79 H new ATOM 0 HD12 LEU A 174 13.134 -13.929 3.536 1.00 1.79 H new ATOM 0 HD13 LEU A 174 14.582 -14.958 3.646 1.00 1.79 H new ATOM 0 HD21 LEU A 174 16.554 -12.637 4.085 1.00 2.09 H new ATOM 0 HD22 LEU A 174 16.845 -13.970 2.943 1.00 2.09 H new ATOM 0 HD23 LEU A 174 16.896 -12.285 2.375 1.00 2.09 H new TER 3004 LEU A 174 HETATM 3005 PG DGT A 201 -1.708 -10.579 5.993 1.00 0.85 P HETATM 3006 O1G DGT A 201 -1.593 -10.748 7.461 1.00 1.15 O HETATM 3007 O2G DGT A 201 -2.004 -11.755 5.145 1.00 0.98 O HETATM 3008 O3G DGT A 201 -2.915 -9.543 5.701 1.00 0.86 O HETATM 3009 O3B DGT A 201 -0.446 -9.761 5.405 1.00 0.69 O HETATM 3010 PB DGT A 201 -0.885 -8.823 4.173 1.00 0.61 P HETATM 3011 O1B DGT A 201 0.266 -8.746 3.242 1.00 0.78 O HETATM 3012 O2B DGT A 201 -2.197 -9.287 3.665 1.00 0.74 O HETATM 3013 O3A DGT A 201 -1.105 -7.422 4.939 1.00 0.74 O HETATM 3014 PA DGT A 201 -0.382 -6.025 4.583 1.00 0.89 P HETATM 3015 O1A DGT A 201 -0.947 -5.069 5.563 1.00 1.28 O HETATM 3016 O2A DGT A 201 -0.660 -5.789 3.149 1.00 1.02 O HETATM 3017 O5' DGT A 201 1.215 -5.997 4.787 1.00 0.79 O HETATM 3018 C5' DGT A 201 2.114 -6.887 4.122 1.00 0.62 C HETATM 3019 C4' DGT A 201 3.525 -6.415 4.475 1.00 0.68 C HETATM 3020 O4' DGT A 201 3.358 -5.013 4.728 1.00 0.83 O HETATM 3021 C3' DGT A 201 4.180 -7.003 5.714 1.00 0.97 C HETATM 3022 O3' DGT A 201 5.551 -7.303 5.410 1.00 1.76 O HETATM 3023 C2' DGT A 201 4.099 -5.899 6.757 1.00 0.89 C HETATM 3024 C1' DGT A 201 4.170 -4.676 5.859 1.00 0.56 C HETATM 3025 N9 DGT A 201 3.584 -3.500 6.539 1.00 0.59 N HETATM 3026 C8 DGT A 201 4.234 -2.389 6.876 1.00 0.56 C HETATM 3027 N7 DGT A 201 3.632 -1.893 7.953 1.00 0.55 N HETATM 3028 C5 DGT A 201 2.601 -2.673 8.262 1.00 0.57 C HETATM 3029 C6 DGT A 201 1.768 -2.656 9.300 1.00 0.67 C HETATM 3030 O6 DGT A 201 1.816 -1.759 10.136 1.00 0.79 O HETATM 3031 N1 DGT A 201 0.804 -3.660 9.418 1.00 0.80 N HETATM 3032 C2 DGT A 201 0.742 -4.650 8.432 1.00 0.79 C HETATM 3033 N2 DGT A 201 -0.071 -5.686 8.592 1.00 0.98 N HETATM 3034 N3 DGT A 201 1.603 -4.591 7.406 1.00 0.76 N HETATM 3035 C4 DGT A 201 2.535 -3.634 7.346 1.00 0.64 C HETATM 0 HO3' DGT A 201 5.600 -8.153 4.925 1.00 1.76 H new HETATM 0 HN2A DGT A 201 -0.120 -6.411 7.876 1.00 0.98 H new HETATM 0 H5'A DGT A 201 1.955 -7.915 4.448 1.00 0.62 H new HETATM 0 H2'A DGT A 201 3.175 -5.939 7.334 1.00 0.89 H new HETATM 0 HN2 DGT A 201 -0.647 -5.758 9.431 1.00 0.98 H new HETATM 0 H8 DGT A 201 5.098 -1.965 6.365 1.00 0.56 H new HETATM 0 H5' DGT A 201 1.955 -6.866 3.044 1.00 0.62 H new HETATM 0 H4' DGT A 201 4.179 -6.718 3.657 1.00 0.68 H new HETATM 0 H3' DGT A 201 3.703 -7.920 6.060 1.00 0.97 H new HETATM 0 H2' DGT A 201 4.922 -5.940 7.471 1.00 0.89 H new HETATM 0 H16 DGT A 201 0.158 -3.671 10.207 1.00 0.80 H new HETATM 0 H1' DGT A 201 5.197 -4.426 5.593 1.00 0.56 H new HETATM 3048 MG MG A 202 -3.602 -5.248 6.203 1.00 0.47 MG HETATM 3049 MG MG A 203 -3.510 -8.753 4.857 1.00 0.82 MG