USER MOD reduce.3.24.130724 H: found=0, std=0, add=979, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 981 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 72 SER OG : rot 134:sc= 0.817 USER MOD Set 1.2: A 132 SER OG : rot 71:sc= 0.719 USER MOD Set 2.1: A 18 HIS : no HE2:sc= 0.909 K(o=1.4,f=-0.79) USER MOD Set 2.2: A 24 ASN : amide:sc= 0.388 K(o=1.4,f=-0.11!) USER MOD Set 2.3: A 70 MET CE :methyl -123:sc= -0.966 (180deg=-1.82) USER MOD Set 2.4: A 74 SER OG : rot -166:sc= 1.1 USER MOD Set 3.1: A 38 ASN : amide:sc= -4.42! K(o=0.0053!,f=-1.6) USER MOD Set 3.2: A 41 CYS SG : rot -35:sc= 0.084 USER MOD Set 3.3: A 66 CYS SG : rot -80:sc= 2.99 USER MOD Set 3.4: A 69 SER OG : rot -95:sc= 1.3 USER MOD Set 3.5: A 128 CYS SG : rot -143:sc= 0.0445 USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 GLN : amide:sc= -0.0502 K(o=-0.05,f=-0.67) USER MOD Single : A 16 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 19 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 ASN : amide:sc= 1.16 K(o=1.2,f=-0.12) USER MOD Single : A 25 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0397) USER MOD Single : A 29 ASN : amide:sc= -0.312 X(o=-0.31,f=-0.65) USER MOD Single : A 31 SER OG : rot 90:sc= -0.453 USER MOD Single : A 36 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 37 ASN : amide:sc= 0 X(o=0,f=-0.015) USER MOD Single : A 40 THR OG1 : rot -34:sc= 0.4 USER MOD Single : A 48 THR OG1 : rot -100:sc= -2.14! USER MOD Single : A 49 MET CE :methyl 150:sc= -4.04! (180deg=-5.55!) USER MOD Single : A 50 LYS NZ :NH3+ -176:sc= 0.421 (180deg=0.372) USER MOD Single : A 60 LYS NZ :NH3+ 179:sc= 0.999 (180deg=0.973) USER MOD Single : A 67 SER OG : rot 180:sc= 0.0234 USER MOD Single : A 75 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 76 MET CE :methyl -104:sc= -0.172 (180deg=-2.7!) USER MOD Single : A 77 THR OG1 : rot 80:sc= 1.27 USER MOD Single : A 78 GLN : amide:sc= -1.01 K(o=-1,f=0) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 LYS NZ :NH3+ 148:sc= -0.594 (180deg=-0.895) USER MOD Single : A 87 THR OG1 : rot 180:sc= -0.0543 USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 91 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 92 SER OG : rot 45:sc= 0.0357 USER MOD Single : A 93 LYS NZ :NH3+ -174:sc= 1.3 (180deg=1.08) USER MOD Single : A 96 SER OG : rot 180:sc= 0.0495 USER MOD Single : A 117 GLN : amide:sc= 0.747 K(o=0.75,f=-0.87) USER MOD Single : A 120 SER OG : rot -23:sc= 0.0781 USER MOD Single : A 121 LYS NZ :NH3+ 170:sc= -0.0158 (180deg=-0.251) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 THR OG1 : rot 180:sc= -0.307 USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 LYS NZ :NH3+ -169:sc= -0.0276 (180deg=-0.218) USER MOD Single : A 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 89 N LEU A 7 -10.159 -7.756 11.222 1.00 0.00 N ATOM 90 CA LEU A 7 -10.265 -7.785 9.771 1.00 0.00 C ATOM 91 C LEU A 7 -11.710 -7.966 9.358 1.00 0.00 C ATOM 92 O LEU A 7 -12.175 -7.330 8.423 1.00 0.00 O ATOM 93 CB LEU A 7 -9.410 -8.911 9.186 1.00 0.00 C ATOM 94 CG LEU A 7 -7.899 -8.752 9.371 1.00 0.00 C ATOM 95 CD1 LEU A 7 -7.170 -9.960 8.805 1.00 0.00 C ATOM 96 CD2 LEU A 7 -7.406 -7.475 8.701 1.00 0.00 C ATOM 0 HA LEU A 7 -9.898 -6.835 9.382 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -9.718 -9.852 9.642 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -9.622 -8.989 8.120 1.00 0.00 H new ATOM 0 HG LEU A 7 -7.688 -8.683 10.438 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -6.096 -9.834 8.943 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -7.500 -10.860 9.324 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -7.391 -10.053 7.742 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -6.330 -7.381 8.844 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -7.628 -7.515 7.635 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -7.907 -6.615 9.144 1.00 0.00 H new ATOM 108 N ASP A 8 -12.418 -8.801 10.104 1.00 0.00 N ATOM 109 CA ASP A 8 -13.825 -9.076 9.846 1.00 0.00 C ATOM 110 C ASP A 8 -14.623 -7.783 9.797 1.00 0.00 C ATOM 111 O ASP A 8 -15.427 -7.564 8.886 1.00 0.00 O ATOM 112 CB ASP A 8 -14.387 -9.992 10.933 1.00 0.00 C ATOM 113 CG ASP A 8 -15.887 -10.177 10.828 1.00 0.00 C ATOM 114 OD1 ASP A 8 -16.335 -10.946 9.954 1.00 0.00 O ATOM 115 OD2 ASP A 8 -16.624 -9.560 11.626 1.00 0.00 O ATOM 0 H ASP A 8 -12.035 -9.306 10.903 1.00 0.00 H new ATOM 0 HA ASP A 8 -13.908 -9.573 8.879 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -13.900 -10.965 10.869 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -14.144 -9.578 11.912 1.00 0.00 H new ATOM 120 N THR A 9 -14.365 -6.913 10.760 1.00 0.00 N ATOM 121 CA THR A 9 -15.079 -5.651 10.855 1.00 0.00 C ATOM 122 C THR A 9 -14.585 -4.691 9.776 1.00 0.00 C ATOM 123 O THR A 9 -15.368 -3.998 9.117 1.00 0.00 O ATOM 124 CB THR A 9 -14.878 -5.005 12.240 1.00 0.00 C ATOM 125 OG1 THR A 9 -14.957 -6.003 13.267 1.00 0.00 O ATOM 126 CG2 THR A 9 -15.927 -3.931 12.501 1.00 0.00 C ATOM 0 H THR A 9 -13.665 -7.058 11.488 1.00 0.00 H new ATOM 0 HA THR A 9 -16.141 -5.853 10.713 1.00 0.00 H new ATOM 0 HB THR A 9 -13.891 -4.542 12.253 1.00 0.00 H new ATOM 0 HG1 THR A 9 -14.826 -5.583 14.143 1.00 0.00 H new ATOM 0 HG21 THR A 9 -15.761 -3.492 13.485 1.00 0.00 H new ATOM 0 HG22 THR A 9 -15.850 -3.155 11.740 1.00 0.00 H new ATOM 0 HG23 THR A 9 -16.921 -4.377 12.465 1.00 0.00 H new ATOM 134 N LEU A 10 -13.274 -4.701 9.577 1.00 0.00 N ATOM 135 CA LEU A 10 -12.620 -3.783 8.663 1.00 0.00 C ATOM 136 C LEU A 10 -12.976 -4.092 7.218 1.00 0.00 C ATOM 137 O LEU A 10 -13.503 -3.238 6.516 1.00 0.00 O ATOM 138 CB LEU A 10 -11.103 -3.841 8.852 1.00 0.00 C ATOM 139 CG LEU A 10 -10.604 -3.433 10.240 1.00 0.00 C ATOM 140 CD1 LEU A 10 -9.100 -3.629 10.343 1.00 0.00 C ATOM 141 CD2 LEU A 10 -10.974 -1.989 10.539 1.00 0.00 C ATOM 0 H LEU A 10 -12.637 -5.346 10.045 1.00 0.00 H new ATOM 0 HA LEU A 10 -12.973 -2.777 8.890 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -10.766 -4.857 8.646 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -10.635 -3.193 8.110 1.00 0.00 H new ATOM 0 HG LEU A 10 -11.087 -4.071 10.980 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -8.762 -3.334 11.336 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -8.857 -4.678 10.174 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -8.601 -3.016 9.593 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -10.610 -1.718 11.530 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -10.519 -1.335 9.795 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -12.058 -1.877 10.507 1.00 0.00 H new ATOM 153 N TYR A 11 -12.719 -5.322 6.785 1.00 0.00 N ATOM 154 CA TYR A 11 -12.881 -5.681 5.387 1.00 0.00 C ATOM 155 C TYR A 11 -14.347 -5.647 4.998 1.00 0.00 C ATOM 156 O TYR A 11 -14.664 -5.414 3.842 1.00 0.00 O ATOM 157 CB TYR A 11 -12.246 -7.051 5.054 1.00 0.00 C ATOM 158 CG TYR A 11 -13.129 -8.278 5.265 1.00 0.00 C ATOM 159 CD1 TYR A 11 -14.126 -8.616 4.352 1.00 0.00 C ATOM 160 CD2 TYR A 11 -12.948 -9.109 6.362 1.00 0.00 C ATOM 161 CE1 TYR A 11 -14.910 -9.738 4.533 1.00 0.00 C ATOM 162 CE2 TYR A 11 -13.732 -10.230 6.551 1.00 0.00 C ATOM 163 CZ TYR A 11 -14.712 -10.540 5.636 1.00 0.00 C ATOM 164 OH TYR A 11 -15.492 -11.660 5.819 1.00 0.00 O ATOM 0 H TYR A 11 -12.398 -6.083 7.383 1.00 0.00 H new ATOM 0 HA TYR A 11 -12.346 -4.938 4.796 1.00 0.00 H new ATOM 0 HB2 TYR A 11 -11.927 -7.035 4.012 1.00 0.00 H new ATOM 0 HB3 TYR A 11 -11.348 -7.168 5.661 1.00 0.00 H new ATOM 0 HD1 TYR A 11 -14.288 -7.989 3.488 1.00 0.00 H new ATOM 0 HD2 TYR A 11 -12.178 -8.874 7.082 1.00 0.00 H new ATOM 0 HE1 TYR A 11 -15.676 -9.986 3.813 1.00 0.00 H new ATOM 0 HE2 TYR A 11 -13.577 -10.861 7.414 1.00 0.00 H new ATOM 0 HH TYR A 11 -15.223 -12.115 6.644 1.00 0.00 H new ATOM 174 N ARG A 12 -15.242 -5.865 5.959 1.00 0.00 N ATOM 175 CA ARG A 12 -16.665 -5.754 5.678 1.00 0.00 C ATOM 176 C ARG A 12 -16.989 -4.335 5.222 1.00 0.00 C ATOM 177 O ARG A 12 -17.748 -4.135 4.269 1.00 0.00 O ATOM 178 CB ARG A 12 -17.505 -6.134 6.903 1.00 0.00 C ATOM 179 CG ARG A 12 -19.005 -6.075 6.653 1.00 0.00 C ATOM 180 CD ARG A 12 -19.386 -6.844 5.396 1.00 0.00 C ATOM 181 NE ARG A 12 -20.818 -6.786 5.117 1.00 0.00 N ATOM 182 CZ ARG A 12 -21.380 -5.970 4.223 1.00 0.00 C ATOM 183 NH1 ARG A 12 -20.642 -5.079 3.570 1.00 0.00 N ATOM 184 NH2 ARG A 12 -22.682 -6.047 3.995 1.00 0.00 N ATOM 0 H ARG A 12 -15.010 -6.115 6.920 1.00 0.00 H new ATOM 0 HA ARG A 12 -16.916 -6.452 4.880 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -17.237 -7.142 7.219 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -17.255 -5.465 7.726 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -19.535 -6.489 7.510 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -19.319 -5.036 6.556 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -18.837 -6.439 4.546 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -19.082 -7.885 5.505 1.00 0.00 H new ATOM 0 HE ARG A 12 -21.430 -7.411 5.641 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -19.640 -5.016 3.751 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -21.077 -4.458 2.888 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -23.249 -6.727 4.501 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -23.118 -5.426 3.313 1.00 0.00 H new ATOM 198 N GLN A 13 -16.387 -3.357 5.886 1.00 0.00 N ATOM 199 CA GLN A 13 -16.551 -1.966 5.493 1.00 0.00 C ATOM 200 C GLN A 13 -15.685 -1.655 4.272 1.00 0.00 C ATOM 201 O GLN A 13 -16.132 -0.980 3.345 1.00 0.00 O ATOM 202 CB GLN A 13 -16.191 -1.033 6.653 1.00 0.00 C ATOM 203 CG GLN A 13 -16.402 0.445 6.349 1.00 0.00 C ATOM 204 CD GLN A 13 -17.840 0.777 5.997 1.00 0.00 C ATOM 205 OE1 GLN A 13 -18.776 0.125 6.459 1.00 0.00 O ATOM 206 NE2 GLN A 13 -18.026 1.803 5.182 1.00 0.00 N ATOM 0 H GLN A 13 -15.784 -3.501 6.696 1.00 0.00 H new ATOM 0 HA GLN A 13 -17.596 -1.802 5.231 1.00 0.00 H new ATOM 0 HB2 GLN A 13 -16.790 -1.304 7.522 1.00 0.00 H new ATOM 0 HB3 GLN A 13 -15.147 -1.192 6.923 1.00 0.00 H new ATOM 0 HG2 GLN A 13 -16.100 1.035 7.214 1.00 0.00 H new ATOM 0 HG3 GLN A 13 -15.754 0.737 5.522 1.00 0.00 H new ATOM 0 HE21 GLN A 13 -17.224 2.319 4.820 1.00 0.00 H new ATOM 0 HE22 GLN A 13 -18.971 2.078 4.916 1.00 0.00 H new ATOM 215 N VAL A 14 -14.455 -2.174 4.268 1.00 0.00 N ATOM 216 CA VAL A 14 -13.516 -1.910 3.178 1.00 0.00 C ATOM 217 C VAL A 14 -14.055 -2.434 1.845 1.00 0.00 C ATOM 218 O VAL A 14 -14.046 -1.722 0.842 1.00 0.00 O ATOM 219 CB VAL A 14 -12.117 -2.522 3.457 1.00 0.00 C ATOM 220 CG1 VAL A 14 -11.194 -2.351 2.257 1.00 0.00 C ATOM 221 CG2 VAL A 14 -11.491 -1.882 4.690 1.00 0.00 C ATOM 0 H VAL A 14 -14.088 -2.777 5.004 1.00 0.00 H new ATOM 0 HA VAL A 14 -13.406 -0.827 3.114 1.00 0.00 H new ATOM 0 HB VAL A 14 -12.250 -3.588 3.639 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -10.221 -2.789 2.481 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -11.627 -2.852 1.391 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -11.073 -1.290 2.040 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -10.511 -2.323 4.871 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -11.382 -0.810 4.528 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -12.132 -2.055 5.555 1.00 0.00 H new ATOM 231 N ILE A 15 -14.557 -3.666 1.845 1.00 0.00 N ATOM 232 CA ILE A 15 -15.058 -4.280 0.621 1.00 0.00 C ATOM 233 C ILE A 15 -16.370 -3.626 0.189 1.00 0.00 C ATOM 234 O ILE A 15 -16.663 -3.537 -1.002 1.00 0.00 O ATOM 235 CB ILE A 15 -15.256 -5.816 0.772 1.00 0.00 C ATOM 236 CG1 ILE A 15 -15.319 -6.485 -0.604 1.00 0.00 C ATOM 237 CG2 ILE A 15 -16.515 -6.147 1.569 1.00 0.00 C ATOM 238 CD1 ILE A 15 -14.041 -6.351 -1.402 1.00 0.00 C ATOM 0 H ILE A 15 -14.627 -4.255 2.675 1.00 0.00 H new ATOM 0 HA ILE A 15 -14.303 -4.118 -0.148 1.00 0.00 H new ATOM 0 HB ILE A 15 -14.398 -6.203 1.322 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -15.547 -7.543 -0.474 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -16.140 -6.049 -1.173 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -16.619 -7.229 1.653 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -16.440 -5.711 2.565 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -17.387 -5.737 1.059 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -14.159 -6.849 -2.365 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -13.822 -5.296 -1.564 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -13.220 -6.812 -0.854 1.00 0.00 H new ATOM 250 N MET A 16 -17.144 -3.148 1.161 1.00 0.00 N ATOM 251 CA MET A 16 -18.416 -2.500 0.873 1.00 0.00 C ATOM 252 C MET A 16 -18.178 -1.153 0.209 1.00 0.00 C ATOM 253 O MET A 16 -18.794 -0.826 -0.808 1.00 0.00 O ATOM 254 CB MET A 16 -19.231 -2.314 2.151 1.00 0.00 C ATOM 255 CG MET A 16 -20.651 -1.861 1.885 1.00 0.00 C ATOM 256 SD MET A 16 -21.588 -3.084 0.951 1.00 0.00 S ATOM 257 CE MET A 16 -23.099 -2.175 0.646 1.00 0.00 C ATOM 0 H MET A 16 -16.911 -3.198 2.153 1.00 0.00 H new ATOM 0 HA MET A 16 -18.980 -3.139 0.194 1.00 0.00 H new ATOM 0 HB2 MET A 16 -19.252 -3.254 2.702 1.00 0.00 H new ATOM 0 HB3 MET A 16 -18.735 -1.582 2.789 1.00 0.00 H new ATOM 0 HG2 MET A 16 -21.153 -1.667 2.833 1.00 0.00 H new ATOM 0 HG3 MET A 16 -20.634 -0.920 1.335 1.00 0.00 H new ATOM 0 HE1 MET A 16 -23.789 -2.797 0.075 1.00 0.00 H new ATOM 0 HE2 MET A 16 -23.558 -1.903 1.596 1.00 0.00 H new ATOM 0 HE3 MET A 16 -22.872 -1.271 0.081 1.00 0.00 H new ATOM 267 N ASP A 17 -17.267 -0.381 0.787 1.00 0.00 N ATOM 268 CA ASP A 17 -16.914 0.921 0.241 1.00 0.00 C ATOM 269 C ASP A 17 -16.249 0.758 -1.119 1.00 0.00 C ATOM 270 O ASP A 17 -16.499 1.533 -2.040 1.00 0.00 O ATOM 271 CB ASP A 17 -15.985 1.680 1.194 1.00 0.00 C ATOM 272 CG ASP A 17 -15.704 3.097 0.725 1.00 0.00 C ATOM 273 OD1 ASP A 17 -16.485 4.010 1.077 1.00 0.00 O ATOM 274 OD2 ASP A 17 -14.707 3.307 0.004 1.00 0.00 O ATOM 0 H ASP A 17 -16.759 -0.635 1.634 1.00 0.00 H new ATOM 0 HA ASP A 17 -17.830 1.500 0.122 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -16.435 1.711 2.186 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -15.044 1.138 1.287 1.00 0.00 H new ATOM 279 N HIS A 18 -15.422 -0.272 -1.251 1.00 0.00 N ATOM 280 CA HIS A 18 -14.734 -0.531 -2.508 1.00 0.00 C ATOM 281 C HIS A 18 -15.716 -0.978 -3.585 1.00 0.00 C ATOM 282 O HIS A 18 -15.484 -0.763 -4.766 1.00 0.00 O ATOM 283 CB HIS A 18 -13.636 -1.584 -2.335 1.00 0.00 C ATOM 284 CG HIS A 18 -12.770 -1.726 -3.549 1.00 0.00 C ATOM 285 ND1 HIS A 18 -12.718 -2.871 -4.319 1.00 0.00 N ATOM 286 CD2 HIS A 18 -11.918 -0.849 -4.131 1.00 0.00 C ATOM 287 CE1 HIS A 18 -11.874 -2.687 -5.315 1.00 0.00 C ATOM 288 NE2 HIS A 18 -11.377 -1.473 -5.223 1.00 0.00 N ATOM 0 H HIS A 18 -15.213 -0.938 -0.507 1.00 0.00 H new ATOM 0 HA HIS A 18 -14.269 0.404 -2.822 1.00 0.00 H new ATOM 0 HB2 HIS A 18 -13.014 -1.317 -1.480 1.00 0.00 H new ATOM 0 HB3 HIS A 18 -14.095 -2.546 -2.107 1.00 0.00 H new ATOM 0 HD1 HIS A 18 -13.249 -3.724 -4.145 1.00 0.00 H new ATOM 0 HD2 HIS A 18 -11.705 0.155 -3.796 1.00 0.00 H new ATOM 0 HE1 HIS A 18 -11.632 -3.412 -6.078 1.00 0.00 H new ATOM 297 N TYR A 19 -16.816 -1.596 -3.173 1.00 0.00 N ATOM 298 CA TYR A 19 -17.840 -2.029 -4.118 1.00 0.00 C ATOM 299 C TYR A 19 -18.639 -0.824 -4.612 1.00 0.00 C ATOM 300 O TYR A 19 -19.289 -0.868 -5.657 1.00 0.00 O ATOM 301 CB TYR A 19 -18.762 -3.052 -3.460 1.00 0.00 C ATOM 302 CG TYR A 19 -19.651 -3.794 -4.432 1.00 0.00 C ATOM 303 CD1 TYR A 19 -19.104 -4.652 -5.379 1.00 0.00 C ATOM 304 CD2 TYR A 19 -21.029 -3.635 -4.407 1.00 0.00 C ATOM 305 CE1 TYR A 19 -19.907 -5.332 -6.274 1.00 0.00 C ATOM 306 CE2 TYR A 19 -21.838 -4.313 -5.298 1.00 0.00 C ATOM 307 CZ TYR A 19 -21.273 -5.158 -6.228 1.00 0.00 C ATOM 308 OH TYR A 19 -22.081 -5.832 -7.118 1.00 0.00 O ATOM 0 H TYR A 19 -17.022 -1.808 -2.197 1.00 0.00 H new ATOM 0 HA TYR A 19 -17.358 -2.500 -4.975 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -18.155 -3.775 -2.914 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -19.388 -2.543 -2.727 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -18.033 -4.789 -5.416 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -21.475 -2.972 -3.681 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -19.467 -5.995 -7.004 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -22.909 -4.181 -5.266 1.00 0.00 H new ATOM 0 HH TYR A 19 -23.018 -5.599 -6.950 1.00 0.00 H new ATOM 318 N LYS A 20 -18.581 0.247 -3.835 1.00 0.00 N ATOM 319 CA LYS A 20 -19.179 1.522 -4.205 1.00 0.00 C ATOM 320 C LYS A 20 -18.252 2.244 -5.184 1.00 0.00 C ATOM 321 O LYS A 20 -18.671 3.107 -5.958 1.00 0.00 O ATOM 322 CB LYS A 20 -19.384 2.356 -2.935 1.00 0.00 C ATOM 323 CG LYS A 20 -20.010 3.723 -3.149 1.00 0.00 C ATOM 324 CD LYS A 20 -19.964 4.531 -1.862 1.00 0.00 C ATOM 325 CE LYS A 20 -20.612 5.897 -2.013 1.00 0.00 C ATOM 326 NZ LYS A 20 -22.094 5.814 -2.093 1.00 0.00 N ATOM 0 H LYS A 20 -18.116 0.257 -2.927 1.00 0.00 H new ATOM 0 HA LYS A 20 -20.144 1.369 -4.688 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -20.012 1.791 -2.247 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -18.418 2.489 -2.448 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -19.479 4.254 -3.939 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -21.043 3.610 -3.479 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -20.469 3.978 -1.070 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -18.927 4.656 -1.551 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -20.331 6.525 -1.168 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -20.229 6.381 -2.911 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -22.490 6.770 -2.195 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -22.366 5.237 -2.914 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -22.465 5.377 -1.225 1.00 0.00 H new ATOM 340 N ASN A 21 -16.991 1.848 -5.151 1.00 0.00 N ATOM 341 CA ASN A 21 -15.956 2.448 -5.983 1.00 0.00 C ATOM 342 C ASN A 21 -15.558 1.479 -7.103 1.00 0.00 C ATOM 343 O ASN A 21 -16.107 0.380 -7.187 1.00 0.00 O ATOM 344 CB ASN A 21 -14.744 2.810 -5.110 1.00 0.00 C ATOM 345 CG ASN A 21 -14.993 4.031 -4.240 1.00 0.00 C ATOM 346 OD1 ASN A 21 -14.738 5.163 -4.653 1.00 0.00 O ATOM 347 ND2 ASN A 21 -15.477 3.818 -3.028 1.00 0.00 N ATOM 0 H ASN A 21 -16.653 1.100 -4.546 1.00 0.00 H new ATOM 0 HA ASN A 21 -16.337 3.359 -6.444 1.00 0.00 H new ATOM 0 HB2 ASN A 21 -14.492 1.961 -4.474 1.00 0.00 H new ATOM 0 HB3 ASN A 21 -13.882 2.995 -5.751 1.00 0.00 H new ATOM 0 HD21 ASN A 21 -15.651 4.605 -2.403 1.00 0.00 H new ATOM 0 HD22 ASN A 21 -15.677 2.867 -2.719 1.00 0.00 H new ATOM 354 N PRO A 22 -14.641 1.873 -8.010 1.00 0.00 N ATOM 355 CA PRO A 22 -14.135 0.970 -9.057 1.00 0.00 C ATOM 356 C PRO A 22 -13.322 -0.199 -8.489 1.00 0.00 C ATOM 357 O PRO A 22 -13.068 -0.271 -7.284 1.00 0.00 O ATOM 358 CB PRO A 22 -13.239 1.871 -9.920 1.00 0.00 C ATOM 359 CG PRO A 22 -13.625 3.268 -9.564 1.00 0.00 C ATOM 360 CD PRO A 22 -14.059 3.220 -8.130 1.00 0.00 C ATOM 0 HA PRO A 22 -14.952 0.506 -9.609 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -12.184 1.690 -9.714 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -13.394 1.679 -10.982 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -12.786 3.951 -9.696 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -14.431 3.626 -10.205 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -13.220 3.360 -7.449 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -14.788 3.997 -7.902 1.00 0.00 H new ATOM 368 N ARG A 23 -12.914 -1.111 -9.368 1.00 0.00 N ATOM 369 CA ARG A 23 -12.122 -2.272 -8.976 1.00 0.00 C ATOM 370 C ARG A 23 -10.656 -1.881 -8.810 1.00 0.00 C ATOM 371 O ARG A 23 -10.334 -0.802 -8.315 1.00 0.00 O ATOM 372 CB ARG A 23 -12.211 -3.377 -10.037 1.00 0.00 C ATOM 373 CG ARG A 23 -13.611 -3.888 -10.324 1.00 0.00 C ATOM 374 CD ARG A 23 -13.568 -5.038 -11.323 1.00 0.00 C ATOM 375 NE ARG A 23 -12.961 -6.243 -10.749 1.00 0.00 N ATOM 376 CZ ARG A 23 -11.764 -6.733 -11.094 1.00 0.00 C ATOM 377 NH1 ARG A 23 -11.024 -6.129 -12.012 1.00 0.00 N ATOM 378 NH2 ARG A 23 -11.311 -7.836 -10.517 1.00 0.00 N ATOM 0 H ARG A 23 -13.122 -1.066 -10.366 1.00 0.00 H new ATOM 0 HA ARG A 23 -12.521 -2.640 -8.031 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -11.781 -3.002 -10.966 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -11.594 -4.216 -9.717 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -14.079 -4.221 -9.398 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -14.225 -3.079 -10.719 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -14.580 -5.266 -11.657 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -13.003 -4.732 -12.204 1.00 0.00 H new ATOM 0 HE ARG A 23 -13.489 -6.744 -10.035 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -11.365 -5.281 -12.465 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -10.114 -6.512 -12.266 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -11.874 -8.310 -9.811 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -10.399 -8.211 -10.779 1.00 0.00 H new ATOM 392 N ASN A 24 -9.774 -2.782 -9.214 1.00 0.00 N ATOM 393 CA ASN A 24 -8.349 -2.505 -9.245 1.00 0.00 C ATOM 394 C ASN A 24 -7.834 -2.652 -10.668 1.00 0.00 C ATOM 395 O ASN A 24 -7.340 -3.711 -11.053 1.00 0.00 O ATOM 396 CB ASN A 24 -7.570 -3.446 -8.320 1.00 0.00 C ATOM 397 CG ASN A 24 -7.762 -3.145 -6.849 1.00 0.00 C ATOM 398 OD1 ASN A 24 -7.018 -2.362 -6.262 1.00 0.00 O ATOM 399 ND2 ASN A 24 -8.753 -3.772 -6.237 1.00 0.00 N ATOM 0 H ASN A 24 -10.025 -3.720 -9.527 1.00 0.00 H new ATOM 0 HA ASN A 24 -8.197 -1.485 -8.893 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -7.879 -4.473 -8.516 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -6.509 -3.382 -8.560 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -8.921 -3.613 -5.244 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -9.349 -4.415 -6.758 1.00 0.00 H new ATOM 406 N LYS A 25 -7.982 -1.601 -11.458 1.00 0.00 N ATOM 407 CA LYS A 25 -7.500 -1.615 -12.829 1.00 0.00 C ATOM 408 C LYS A 25 -6.971 -0.245 -13.222 1.00 0.00 C ATOM 409 O LYS A 25 -7.735 0.711 -13.362 1.00 0.00 O ATOM 410 CB LYS A 25 -8.605 -2.055 -13.798 1.00 0.00 C ATOM 411 CG LYS A 25 -8.144 -2.145 -15.246 1.00 0.00 C ATOM 412 CD LYS A 25 -9.217 -2.738 -16.147 1.00 0.00 C ATOM 413 CE LYS A 25 -10.449 -1.850 -16.241 1.00 0.00 C ATOM 414 NZ LYS A 25 -10.177 -0.586 -16.974 1.00 0.00 N ATOM 0 H LYS A 25 -8.431 -0.730 -11.174 1.00 0.00 H new ATOM 0 HA LYS A 25 -6.686 -2.337 -12.891 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -8.985 -3.027 -13.485 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -9.435 -1.352 -13.733 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -7.878 -1.151 -15.605 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -7.243 -2.756 -15.303 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -8.806 -2.892 -17.145 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -9.506 -3.718 -15.767 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -11.249 -2.394 -16.743 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -10.804 -1.616 -15.237 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -11.068 -0.069 -17.117 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -9.520 0.001 -16.421 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -9.752 -0.805 -17.898 1.00 0.00 H new ATOM 428 N GLY A 26 -5.662 -0.151 -13.371 1.00 0.00 N ATOM 429 CA GLY A 26 -5.054 1.077 -13.823 1.00 0.00 C ATOM 430 C GLY A 26 -3.601 0.883 -14.186 1.00 0.00 C ATOM 431 O GLY A 26 -2.822 0.370 -13.383 1.00 0.00 O ATOM 0 H GLY A 26 -5.006 -0.910 -13.185 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -5.598 1.454 -14.689 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -5.136 1.832 -13.041 1.00 0.00 H new ATOM 435 N VAL A 27 -3.240 1.269 -15.398 1.00 0.00 N ATOM 436 CA VAL A 27 -1.857 1.213 -15.839 1.00 0.00 C ATOM 437 C VAL A 27 -1.427 2.559 -16.426 1.00 0.00 C ATOM 438 O VAL A 27 -1.802 2.923 -17.539 1.00 0.00 O ATOM 439 CB VAL A 27 -1.626 0.065 -16.857 1.00 0.00 C ATOM 440 CG1 VAL A 27 -2.634 0.118 -17.997 1.00 0.00 C ATOM 441 CG2 VAL A 27 -0.202 0.097 -17.396 1.00 0.00 C ATOM 0 H VAL A 27 -3.890 1.627 -16.098 1.00 0.00 H new ATOM 0 HA VAL A 27 -1.238 1.002 -14.967 1.00 0.00 H new ATOM 0 HB VAL A 27 -1.773 -0.877 -16.328 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -2.442 -0.701 -18.691 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -3.643 0.024 -17.595 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -2.540 1.068 -18.522 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -0.064 -0.717 -18.108 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -0.023 1.049 -17.895 1.00 0.00 H new ATOM 0 HG23 VAL A 27 0.502 -0.018 -16.572 1.00 0.00 H new ATOM 451 N LEU A 28 -0.670 3.311 -15.648 1.00 0.00 N ATOM 452 CA LEU A 28 -0.190 4.615 -16.077 1.00 0.00 C ATOM 453 C LEU A 28 1.332 4.673 -15.951 1.00 0.00 C ATOM 454 O LEU A 28 1.866 5.135 -14.941 1.00 0.00 O ATOM 455 CB LEU A 28 -0.843 5.711 -15.223 1.00 0.00 C ATOM 456 CG LEU A 28 -0.872 7.125 -15.820 1.00 0.00 C ATOM 457 CD1 LEU A 28 -1.697 8.040 -14.936 1.00 0.00 C ATOM 458 CD2 LEU A 28 0.529 7.691 -15.982 1.00 0.00 C ATOM 0 H LEU A 28 -0.372 3.041 -14.711 1.00 0.00 H new ATOM 0 HA LEU A 28 -0.459 4.777 -17.121 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -1.869 5.410 -15.010 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -0.319 5.756 -14.268 1.00 0.00 H new ATOM 0 HG LEU A 28 -1.326 7.062 -16.809 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -1.714 9.042 -15.365 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -2.715 7.658 -14.867 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -1.256 8.079 -13.940 1.00 0.00 H new ATOM 0 HD21 LEU A 28 0.470 8.693 -16.407 1.00 0.00 H new ATOM 0 HD22 LEU A 28 1.017 7.738 -15.009 1.00 0.00 H new ATOM 0 HD23 LEU A 28 1.106 7.048 -16.647 1.00 0.00 H new ATOM 470 N ASN A 29 2.028 4.173 -16.958 1.00 0.00 N ATOM 471 CA ASN A 29 3.482 4.208 -16.954 1.00 0.00 C ATOM 472 C ASN A 29 3.973 5.601 -17.342 1.00 0.00 C ATOM 473 O ASN A 29 3.978 5.978 -18.515 1.00 0.00 O ATOM 474 CB ASN A 29 4.063 3.114 -17.870 1.00 0.00 C ATOM 475 CG ASN A 29 3.436 3.075 -19.256 1.00 0.00 C ATOM 476 OD1 ASN A 29 2.398 2.443 -19.460 1.00 0.00 O ATOM 477 ND2 ASN A 29 4.074 3.717 -20.220 1.00 0.00 N ATOM 0 H ASN A 29 1.614 3.741 -17.784 1.00 0.00 H new ATOM 0 HA ASN A 29 3.839 3.997 -15.946 1.00 0.00 H new ATOM 0 HB2 ASN A 29 5.137 3.271 -17.972 1.00 0.00 H new ATOM 0 HB3 ASN A 29 3.927 2.144 -17.393 1.00 0.00 H new ATOM 0 HD21 ASN A 29 3.709 3.700 -21.172 1.00 0.00 H new ATOM 0 HD22 ASN A 29 4.931 4.229 -20.011 1.00 0.00 H new ATOM 484 N ASP A 30 4.330 6.384 -16.334 1.00 0.00 N ATOM 485 CA ASP A 30 4.803 7.747 -16.545 1.00 0.00 C ATOM 486 C ASP A 30 6.134 7.961 -15.844 1.00 0.00 C ATOM 487 O ASP A 30 7.189 7.962 -16.479 1.00 0.00 O ATOM 488 CB ASP A 30 3.773 8.757 -16.029 1.00 0.00 C ATOM 489 CG ASP A 30 4.170 10.195 -16.298 1.00 0.00 C ATOM 490 OD1 ASP A 30 4.164 10.605 -17.479 1.00 0.00 O ATOM 491 OD2 ASP A 30 4.468 10.931 -15.332 1.00 0.00 O ATOM 0 H ASP A 30 4.301 6.097 -15.356 1.00 0.00 H new ATOM 0 HA ASP A 30 4.940 7.900 -17.615 1.00 0.00 H new ATOM 0 HB2 ASP A 30 2.810 8.558 -16.498 1.00 0.00 H new ATOM 0 HB3 ASP A 30 3.640 8.617 -14.956 1.00 0.00 H new ATOM 496 N SER A 31 6.085 8.104 -14.531 1.00 0.00 N ATOM 497 CA SER A 31 7.285 8.321 -13.747 1.00 0.00 C ATOM 498 C SER A 31 7.721 7.027 -13.068 1.00 0.00 C ATOM 499 O SER A 31 8.841 6.552 -13.271 1.00 0.00 O ATOM 500 CB SER A 31 7.040 9.431 -12.723 1.00 0.00 C ATOM 501 OG SER A 31 5.714 9.368 -12.219 1.00 0.00 O ATOM 0 H SER A 31 5.224 8.073 -13.985 1.00 0.00 H new ATOM 0 HA SER A 31 8.093 8.635 -14.408 1.00 0.00 H new ATOM 0 HB2 SER A 31 7.751 9.338 -11.902 1.00 0.00 H new ATOM 0 HB3 SER A 31 7.212 10.403 -13.185 1.00 0.00 H new ATOM 0 HG SER A 31 5.692 8.791 -11.427 1.00 0.00 H new ATOM 507 N ILE A 32 6.827 6.445 -12.281 1.00 0.00 N ATOM 508 CA ILE A 32 7.107 5.173 -11.637 1.00 0.00 C ATOM 509 C ILE A 32 6.058 4.135 -12.014 1.00 0.00 C ATOM 510 O ILE A 32 4.865 4.435 -12.104 1.00 0.00 O ATOM 511 CB ILE A 32 7.173 5.295 -10.098 1.00 0.00 C ATOM 512 CG1 ILE A 32 5.862 5.860 -9.540 1.00 0.00 C ATOM 513 CG2 ILE A 32 8.354 6.161 -9.683 1.00 0.00 C ATOM 514 CD1 ILE A 32 5.785 5.839 -8.031 1.00 0.00 C ATOM 0 H ILE A 32 5.906 6.832 -12.075 1.00 0.00 H new ATOM 0 HA ILE A 32 8.087 4.854 -11.993 1.00 0.00 H new ATOM 0 HB ILE A 32 7.315 4.298 -9.681 1.00 0.00 H new ATOM 0 HG12 ILE A 32 5.742 6.886 -9.887 1.00 0.00 H new ATOM 0 HG13 ILE A 32 5.028 5.287 -9.946 1.00 0.00 H new ATOM 0 HG21 ILE A 32 8.386 6.236 -8.596 1.00 0.00 H new ATOM 0 HG22 ILE A 32 9.279 5.711 -10.043 1.00 0.00 H new ATOM 0 HG23 ILE A 32 8.244 7.157 -10.113 1.00 0.00 H new ATOM 0 HD11 ILE A 32 4.830 6.254 -7.710 1.00 0.00 H new ATOM 0 HD12 ILE A 32 5.872 4.812 -7.676 1.00 0.00 H new ATOM 0 HD13 ILE A 32 6.598 6.436 -7.617 1.00 0.00 H new ATOM 526 N VAL A 33 6.520 2.921 -12.254 1.00 0.00 N ATOM 527 CA VAL A 33 5.644 1.806 -12.559 1.00 0.00 C ATOM 528 C VAL A 33 6.096 0.570 -11.784 1.00 0.00 C ATOM 529 O VAL A 33 7.148 -0.007 -12.063 1.00 0.00 O ATOM 530 CB VAL A 33 5.591 1.524 -14.083 1.00 0.00 C ATOM 531 CG1 VAL A 33 6.985 1.492 -14.691 1.00 0.00 C ATOM 532 CG2 VAL A 33 4.854 0.224 -14.374 1.00 0.00 C ATOM 0 H VAL A 33 7.511 2.681 -12.243 1.00 0.00 H new ATOM 0 HA VAL A 33 4.632 2.066 -12.249 1.00 0.00 H new ATOM 0 HB VAL A 33 5.040 2.343 -14.546 1.00 0.00 H new ATOM 0 HG11 VAL A 33 6.911 1.292 -15.760 1.00 0.00 H new ATOM 0 HG12 VAL A 33 7.472 2.454 -14.535 1.00 0.00 H new ATOM 0 HG13 VAL A 33 7.572 0.707 -14.215 1.00 0.00 H new ATOM 0 HG21 VAL A 33 4.832 0.051 -15.450 1.00 0.00 H new ATOM 0 HG22 VAL A 33 5.368 -0.603 -13.884 1.00 0.00 H new ATOM 0 HG23 VAL A 33 3.834 0.292 -13.996 1.00 0.00 H new ATOM 542 N VAL A 34 5.316 0.194 -10.784 1.00 0.00 N ATOM 543 CA VAL A 34 5.681 -0.900 -9.895 1.00 0.00 C ATOM 544 C VAL A 34 4.789 -2.116 -10.133 1.00 0.00 C ATOM 545 O VAL A 34 3.599 -1.979 -10.407 1.00 0.00 O ATOM 546 CB VAL A 34 5.569 -0.466 -8.417 1.00 0.00 C ATOM 547 CG1 VAL A 34 6.109 -1.540 -7.484 1.00 0.00 C ATOM 548 CG2 VAL A 34 6.296 0.851 -8.192 1.00 0.00 C ATOM 0 H VAL A 34 4.421 0.632 -10.566 1.00 0.00 H new ATOM 0 HA VAL A 34 6.715 -1.169 -10.112 1.00 0.00 H new ATOM 0 HB VAL A 34 4.513 -0.325 -8.188 1.00 0.00 H new ATOM 0 HG11 VAL A 34 6.016 -1.205 -6.451 1.00 0.00 H new ATOM 0 HG12 VAL A 34 5.540 -2.460 -7.620 1.00 0.00 H new ATOM 0 HG13 VAL A 34 7.158 -1.726 -7.712 1.00 0.00 H new ATOM 0 HG21 VAL A 34 6.207 1.142 -7.145 1.00 0.00 H new ATOM 0 HG22 VAL A 34 7.349 0.734 -8.447 1.00 0.00 H new ATOM 0 HG23 VAL A 34 5.854 1.623 -8.822 1.00 0.00 H new ATOM 558 N ASP A 35 5.380 -3.300 -10.036 1.00 0.00 N ATOM 559 CA ASP A 35 4.647 -4.550 -10.206 1.00 0.00 C ATOM 560 C ASP A 35 5.033 -5.543 -9.117 1.00 0.00 C ATOM 561 O ASP A 35 6.215 -5.699 -8.797 1.00 0.00 O ATOM 562 CB ASP A 35 4.924 -5.154 -11.587 1.00 0.00 C ATOM 563 CG ASP A 35 4.517 -6.614 -11.681 1.00 0.00 C ATOM 564 OD1 ASP A 35 3.308 -6.907 -11.626 1.00 0.00 O ATOM 565 OD2 ASP A 35 5.416 -7.474 -11.831 1.00 0.00 O ATOM 0 H ASP A 35 6.373 -3.422 -9.839 1.00 0.00 H new ATOM 0 HA ASP A 35 3.581 -4.335 -10.127 1.00 0.00 H new ATOM 0 HB2 ASP A 35 4.387 -4.582 -12.343 1.00 0.00 H new ATOM 0 HB3 ASP A 35 5.986 -5.062 -11.813 1.00 0.00 H new ATOM 570 N MET A 36 4.037 -6.206 -8.550 1.00 0.00 N ATOM 571 CA MET A 36 4.243 -7.180 -7.513 1.00 0.00 C ATOM 572 C MET A 36 3.092 -8.160 -7.603 1.00 0.00 C ATOM 573 O MET A 36 2.000 -7.788 -8.025 1.00 0.00 O ATOM 574 CB MET A 36 4.287 -6.502 -6.139 1.00 0.00 C ATOM 575 CG MET A 36 4.726 -7.421 -5.012 1.00 0.00 C ATOM 576 SD MET A 36 6.393 -8.067 -5.252 1.00 0.00 S ATOM 577 CE MET A 36 6.585 -9.056 -3.768 1.00 0.00 C ATOM 0 H MET A 36 3.058 -6.075 -8.806 1.00 0.00 H new ATOM 0 HA MET A 36 5.195 -7.695 -7.639 1.00 0.00 H new ATOM 0 HB2 MET A 36 4.967 -5.651 -6.186 1.00 0.00 H new ATOM 0 HB3 MET A 36 3.298 -6.107 -5.908 1.00 0.00 H new ATOM 0 HG2 MET A 36 4.683 -6.878 -4.068 1.00 0.00 H new ATOM 0 HG3 MET A 36 4.026 -8.253 -4.933 1.00 0.00 H new ATOM 0 HE1 MET A 36 7.570 -9.524 -3.767 1.00 0.00 H new ATOM 0 HE2 MET A 36 6.486 -8.418 -2.890 1.00 0.00 H new ATOM 0 HE3 MET A 36 5.816 -9.828 -3.744 1.00 0.00 H new ATOM 587 N ASN A 37 3.335 -9.402 -7.273 1.00 0.00 N ATOM 588 CA ASN A 37 2.298 -10.419 -7.406 1.00 0.00 C ATOM 589 C ASN A 37 2.581 -11.681 -6.607 1.00 0.00 C ATOM 590 O ASN A 37 3.711 -11.941 -6.195 1.00 0.00 O ATOM 591 CB ASN A 37 2.120 -10.799 -8.879 1.00 0.00 C ATOM 592 CG ASN A 37 3.398 -11.292 -9.534 1.00 0.00 C ATOM 593 OD1 ASN A 37 3.734 -12.477 -9.471 1.00 0.00 O ATOM 594 ND2 ASN A 37 4.104 -10.389 -10.195 1.00 0.00 N ATOM 0 H ASN A 37 4.227 -9.741 -6.913 1.00 0.00 H new ATOM 0 HA ASN A 37 1.387 -9.975 -7.004 1.00 0.00 H new ATOM 0 HB2 ASN A 37 1.358 -11.575 -8.957 1.00 0.00 H new ATOM 0 HB3 ASN A 37 1.750 -9.933 -9.428 1.00 0.00 H new ATOM 0 HD21 ASN A 37 4.960 -10.664 -10.676 1.00 0.00 H new ATOM 0 HD22 ASN A 37 3.792 -9.418 -10.223 1.00 0.00 H new ATOM 601 N ASN A 38 1.515 -12.444 -6.386 1.00 0.00 N ATOM 602 CA ASN A 38 1.608 -13.824 -5.930 1.00 0.00 C ATOM 603 C ASN A 38 1.254 -14.699 -7.120 1.00 0.00 C ATOM 604 O ASN A 38 0.217 -14.475 -7.743 1.00 0.00 O ATOM 605 CB ASN A 38 0.614 -14.130 -4.796 1.00 0.00 C ATOM 606 CG ASN A 38 0.789 -13.278 -3.554 1.00 0.00 C ATOM 607 OD1 ASN A 38 0.321 -12.146 -3.504 1.00 0.00 O ATOM 608 ND2 ASN A 38 1.364 -13.844 -2.504 1.00 0.00 N ATOM 0 H ASN A 38 0.557 -12.119 -6.519 1.00 0.00 H new ATOM 0 HA ASN A 38 2.612 -14.008 -5.547 1.00 0.00 H new ATOM 0 HB2 ASN A 38 -0.400 -13.995 -5.173 1.00 0.00 H new ATOM 0 HB3 ASN A 38 0.713 -15.179 -4.517 1.00 0.00 H new ATOM 0 HD21 ASN A 38 1.427 -13.336 -1.622 1.00 0.00 H new ATOM 0 HD22 ASN A 38 1.744 -14.788 -2.578 1.00 0.00 H new ATOM 615 N PRO A 39 2.075 -15.703 -7.447 1.00 0.00 N ATOM 616 CA PRO A 39 1.902 -16.516 -8.668 1.00 0.00 C ATOM 617 C PRO A 39 0.684 -17.455 -8.633 1.00 0.00 C ATOM 618 O PRO A 39 0.767 -18.597 -9.097 1.00 0.00 O ATOM 619 CB PRO A 39 3.198 -17.326 -8.722 1.00 0.00 C ATOM 620 CG PRO A 39 3.641 -17.429 -7.304 1.00 0.00 C ATOM 621 CD PRO A 39 3.248 -16.130 -6.660 1.00 0.00 C ATOM 0 HA PRO A 39 1.717 -15.886 -9.538 1.00 0.00 H new ATOM 0 HB2 PRO A 39 3.031 -18.311 -9.157 1.00 0.00 H new ATOM 0 HB3 PRO A 39 3.949 -16.830 -9.336 1.00 0.00 H new ATOM 0 HG2 PRO A 39 3.165 -18.273 -6.805 1.00 0.00 H new ATOM 0 HG3 PRO A 39 4.718 -17.587 -7.241 1.00 0.00 H new ATOM 0 HD2 PRO A 39 3.000 -16.262 -5.607 1.00 0.00 H new ATOM 0 HD3 PRO A 39 4.053 -15.397 -6.708 1.00 0.00 H new ATOM 629 N THR A 40 -0.442 -16.948 -8.111 1.00 0.00 N ATOM 630 CA THR A 40 -1.711 -17.683 -8.037 1.00 0.00 C ATOM 631 C THR A 40 -2.625 -17.097 -6.954 1.00 0.00 C ATOM 632 O THR A 40 -3.801 -17.456 -6.863 1.00 0.00 O ATOM 633 CB THR A 40 -1.513 -19.194 -7.741 1.00 0.00 C ATOM 634 OG1 THR A 40 -2.759 -19.892 -7.884 1.00 0.00 O ATOM 635 CG2 THR A 40 -0.963 -19.419 -6.336 1.00 0.00 C ATOM 0 H THR A 40 -0.497 -16.006 -7.724 1.00 0.00 H new ATOM 0 HA THR A 40 -2.170 -17.578 -9.020 1.00 0.00 H new ATOM 0 HB THR A 40 -0.790 -19.581 -8.459 1.00 0.00 H new ATOM 0 HG1 THR A 40 -3.494 -19.313 -7.592 1.00 0.00 H new ATOM 0 HG21 THR A 40 -0.836 -20.487 -6.162 1.00 0.00 H new ATOM 0 HG22 THR A 40 0.000 -18.919 -6.238 1.00 0.00 H new ATOM 0 HG23 THR A 40 -1.660 -19.012 -5.603 1.00 0.00 H new ATOM 643 N CYS A 41 -2.084 -16.199 -6.134 1.00 0.00 N ATOM 644 CA CYS A 41 -2.791 -15.721 -4.945 1.00 0.00 C ATOM 645 C CYS A 41 -2.737 -14.198 -4.846 1.00 0.00 C ATOM 646 O CYS A 41 -2.923 -13.617 -3.759 1.00 0.00 O ATOM 647 CB CYS A 41 -2.189 -16.353 -3.690 1.00 0.00 C ATOM 648 SG CYS A 41 -3.057 -15.920 -2.164 1.00 0.00 S ATOM 0 H CYS A 41 -1.161 -15.788 -6.269 1.00 0.00 H new ATOM 0 HA CYS A 41 -3.837 -16.016 -5.029 1.00 0.00 H new ATOM 0 HB2 CYS A 41 -2.193 -17.437 -3.803 1.00 0.00 H new ATOM 0 HB3 CYS A 41 -1.147 -16.045 -3.604 1.00 0.00 H new ATOM 0 HG CYS A 41 -3.484 -14.695 -2.241 1.00 0.00 H new ATOM 654 N GLY A 42 -2.453 -13.569 -5.970 1.00 0.00 N ATOM 655 CA GLY A 42 -2.281 -12.130 -6.031 1.00 0.00 C ATOM 656 C GLY A 42 -1.599 -11.761 -7.321 1.00 0.00 C ATOM 657 O GLY A 42 -0.629 -11.016 -7.331 1.00 0.00 O ATOM 0 H GLY A 42 -2.335 -14.041 -6.867 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -3.249 -11.634 -5.964 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -1.688 -11.787 -5.183 1.00 0.00 H new ATOM 661 N ASP A 43 -2.135 -12.321 -8.394 1.00 0.00 N ATOM 662 CA ASP A 43 -1.528 -12.321 -9.727 1.00 0.00 C ATOM 663 C ASP A 43 -0.953 -10.986 -10.195 1.00 0.00 C ATOM 664 O ASP A 43 0.000 -10.995 -10.975 1.00 0.00 O ATOM 665 CB ASP A 43 -2.533 -12.835 -10.751 1.00 0.00 C ATOM 666 CG ASP A 43 -2.706 -14.335 -10.662 1.00 0.00 C ATOM 667 OD1 ASP A 43 -3.311 -14.811 -9.678 1.00 0.00 O ATOM 668 OD2 ASP A 43 -2.229 -15.040 -11.577 1.00 0.00 O ATOM 0 H ASP A 43 -3.033 -12.805 -8.366 1.00 0.00 H new ATOM 0 HA ASP A 43 -0.667 -12.984 -9.643 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -3.495 -12.348 -10.593 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -2.201 -12.566 -11.754 1.00 0.00 H new ATOM 673 N ARG A 44 -1.511 -9.848 -9.786 1.00 0.00 N ATOM 674 CA ARG A 44 -0.883 -8.580 -10.146 1.00 0.00 C ATOM 675 C ARG A 44 -1.305 -7.444 -9.228 1.00 0.00 C ATOM 676 O ARG A 44 -2.464 -7.352 -8.836 1.00 0.00 O ATOM 677 CB ARG A 44 -1.200 -8.223 -11.609 1.00 0.00 C ATOM 678 CG ARG A 44 -2.679 -7.995 -11.879 1.00 0.00 C ATOM 679 CD ARG A 44 -3.099 -8.556 -13.228 1.00 0.00 C ATOM 680 NE ARG A 44 -2.482 -7.858 -14.358 1.00 0.00 N ATOM 681 CZ ARG A 44 -1.834 -8.477 -15.346 1.00 0.00 C ATOM 682 NH1 ARG A 44 -1.594 -9.782 -15.269 1.00 0.00 N ATOM 683 NH2 ARG A 44 -1.421 -7.795 -16.407 1.00 0.00 N ATOM 0 H ARG A 44 -2.362 -9.776 -9.228 1.00 0.00 H new ATOM 0 HA ARG A 44 0.193 -8.710 -10.028 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -0.648 -7.324 -11.882 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -0.842 -9.025 -12.255 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -3.269 -8.463 -11.091 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -2.894 -6.927 -11.846 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -2.835 -9.613 -13.273 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -4.183 -8.494 -13.319 1.00 0.00 H new ATOM 0 HE ARG A 44 -2.552 -6.841 -14.391 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -1.905 -10.311 -14.454 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -1.098 -10.255 -16.025 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -1.599 -6.793 -16.470 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -0.926 -8.273 -17.160 1.00 0.00 H new ATOM 697 N ILE A 45 -0.339 -6.619 -8.851 1.00 0.00 N ATOM 698 CA ILE A 45 -0.621 -5.306 -8.307 1.00 0.00 C ATOM 699 C ILE A 45 0.293 -4.297 -8.995 1.00 0.00 C ATOM 700 O ILE A 45 1.471 -4.148 -8.663 1.00 0.00 O ATOM 701 CB ILE A 45 -0.495 -5.222 -6.761 1.00 0.00 C ATOM 702 CG1 ILE A 45 -0.815 -3.799 -6.280 1.00 0.00 C ATOM 703 CG2 ILE A 45 0.884 -5.646 -6.281 1.00 0.00 C ATOM 704 CD1 ILE A 45 -0.744 -3.628 -4.778 1.00 0.00 C ATOM 0 H ILE A 45 0.654 -6.842 -8.914 1.00 0.00 H new ATOM 0 HA ILE A 45 -1.668 -5.078 -8.509 1.00 0.00 H new ATOM 0 HB ILE A 45 -1.217 -5.917 -6.332 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -0.119 -3.103 -6.748 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -1.814 -3.527 -6.620 1.00 0.00 H new ATOM 0 HG21 ILE A 45 0.930 -5.572 -5.194 1.00 0.00 H new ATOM 0 HG22 ILE A 45 1.074 -6.676 -6.583 1.00 0.00 H new ATOM 0 HG23 ILE A 45 1.639 -4.994 -6.721 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -0.983 -2.597 -4.518 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -1.460 -4.298 -4.301 1.00 0.00 H new ATOM 0 HD13 ILE A 45 0.262 -3.866 -4.432 1.00 0.00 H new ATOM 716 N ARG A 46 -0.245 -3.676 -10.024 1.00 0.00 N ATOM 717 CA ARG A 46 0.503 -2.730 -10.823 1.00 0.00 C ATOM 718 C ARG A 46 0.234 -1.318 -10.339 1.00 0.00 C ATOM 719 O ARG A 46 -0.852 -0.780 -10.544 1.00 0.00 O ATOM 720 CB ARG A 46 0.117 -2.870 -12.295 1.00 0.00 C ATOM 721 CG ARG A 46 1.044 -2.132 -13.244 1.00 0.00 C ATOM 722 CD ARG A 46 0.584 -2.274 -14.683 1.00 0.00 C ATOM 723 NE ARG A 46 0.304 -3.667 -15.037 1.00 0.00 N ATOM 724 CZ ARG A 46 1.140 -4.451 -15.714 1.00 0.00 C ATOM 725 NH1 ARG A 46 2.331 -4.002 -16.091 1.00 0.00 N ATOM 726 NH2 ARG A 46 0.777 -5.691 -16.005 1.00 0.00 N ATOM 0 H ARG A 46 -1.209 -3.812 -10.329 1.00 0.00 H new ATOM 0 HA ARG A 46 1.568 -2.939 -10.720 1.00 0.00 H new ATOM 0 HB2 ARG A 46 0.108 -3.927 -12.560 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -0.899 -2.498 -12.432 1.00 0.00 H new ATOM 0 HG2 ARG A 46 1.080 -1.077 -12.974 1.00 0.00 H new ATOM 0 HG3 ARG A 46 2.057 -2.522 -13.143 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -0.313 -1.674 -14.837 1.00 0.00 H new ATOM 0 HD3 ARG A 46 1.351 -1.878 -15.349 1.00 0.00 H new ATOM 0 HE ARG A 46 -0.590 -4.062 -14.746 1.00 0.00 H new ATOM 0 HH11 ARG A 46 2.612 -3.049 -15.862 1.00 0.00 H new ATOM 0 HH12 ARG A 46 2.965 -4.610 -16.609 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -0.136 -6.037 -15.711 1.00 0.00 H new ATOM 0 HH22 ARG A 46 1.411 -6.300 -16.523 1.00 0.00 H new ATOM 740 N LEU A 47 1.222 -0.733 -9.691 1.00 0.00 N ATOM 741 CA LEU A 47 1.096 0.594 -9.138 1.00 0.00 C ATOM 742 C LEU A 47 1.848 1.578 -10.009 1.00 0.00 C ATOM 743 O LEU A 47 3.079 1.630 -9.999 1.00 0.00 O ATOM 744 CB LEU A 47 1.633 0.643 -7.710 1.00 0.00 C ATOM 745 CG LEU A 47 1.515 2.009 -7.034 1.00 0.00 C ATOM 746 CD1 LEU A 47 0.060 2.418 -6.911 1.00 0.00 C ATOM 747 CD2 LEU A 47 2.182 1.991 -5.672 1.00 0.00 C ATOM 0 H LEU A 47 2.132 -1.166 -9.535 1.00 0.00 H new ATOM 0 HA LEU A 47 0.040 0.862 -9.112 1.00 0.00 H new ATOM 0 HB2 LEU A 47 1.099 -0.093 -7.109 1.00 0.00 H new ATOM 0 HB3 LEU A 47 2.682 0.346 -7.719 1.00 0.00 H new ATOM 0 HG LEU A 47 2.027 2.744 -7.655 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -0.004 3.393 -6.427 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -0.387 2.475 -7.903 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -0.476 1.681 -6.313 1.00 0.00 H new ATOM 0 HD21 LEU A 47 2.087 2.972 -5.207 1.00 0.00 H new ATOM 0 HD22 LEU A 47 1.702 1.243 -5.041 1.00 0.00 H new ATOM 0 HD23 LEU A 47 3.238 1.745 -5.787 1.00 0.00 H new ATOM 759 N THR A 48 1.109 2.326 -10.790 1.00 0.00 N ATOM 760 CA THR A 48 1.692 3.284 -11.684 1.00 0.00 C ATOM 761 C THR A 48 1.295 4.688 -11.265 1.00 0.00 C ATOM 762 O THR A 48 0.144 5.090 -11.431 1.00 0.00 O ATOM 763 CB THR A 48 1.228 3.000 -13.112 1.00 0.00 C ATOM 764 OG1 THR A 48 -0.189 2.806 -13.119 1.00 0.00 O ATOM 765 CG2 THR A 48 1.906 1.763 -13.672 1.00 0.00 C ATOM 0 H THR A 48 0.090 2.285 -10.821 1.00 0.00 H new ATOM 0 HA THR A 48 2.778 3.205 -11.645 1.00 0.00 H new ATOM 0 HB THR A 48 1.496 3.852 -13.737 1.00 0.00 H new ATOM 0 HG1 THR A 48 -0.388 1.847 -13.143 1.00 0.00 H new ATOM 0 HG21 THR A 48 1.557 1.586 -14.689 1.00 0.00 H new ATOM 0 HG22 THR A 48 2.986 1.912 -13.680 1.00 0.00 H new ATOM 0 HG23 THR A 48 1.663 0.902 -13.050 1.00 0.00 H new ATOM 773 N MET A 49 2.233 5.415 -10.689 1.00 0.00 N ATOM 774 CA MET A 49 1.943 6.735 -10.163 1.00 0.00 C ATOM 775 C MET A 49 2.501 7.815 -11.064 1.00 0.00 C ATOM 776 O MET A 49 3.311 7.549 -11.954 1.00 0.00 O ATOM 777 CB MET A 49 2.528 6.910 -8.762 1.00 0.00 C ATOM 778 CG MET A 49 1.836 6.094 -7.685 1.00 0.00 C ATOM 779 SD MET A 49 2.542 6.386 -6.054 1.00 0.00 S ATOM 780 CE MET A 49 1.434 5.431 -5.027 1.00 0.00 C ATOM 0 H MET A 49 3.201 5.115 -10.573 1.00 0.00 H new ATOM 0 HA MET A 49 0.858 6.828 -10.116 1.00 0.00 H new ATOM 0 HB2 MET A 49 3.583 6.637 -8.786 1.00 0.00 H new ATOM 0 HB3 MET A 49 2.478 7.964 -8.490 1.00 0.00 H new ATOM 0 HG2 MET A 49 0.775 6.341 -7.669 1.00 0.00 H new ATOM 0 HG3 MET A 49 1.913 5.034 -7.928 1.00 0.00 H new ATOM 0 HE1 MET A 49 1.973 5.064 -4.153 1.00 0.00 H new ATOM 0 HE2 MET A 49 0.604 6.060 -4.704 1.00 0.00 H new ATOM 0 HE3 MET A 49 1.048 4.586 -5.596 1.00 0.00 H new ATOM 790 N LYS A 50 2.070 9.036 -10.818 1.00 0.00 N ATOM 791 CA LYS A 50 2.598 10.177 -11.520 1.00 0.00 C ATOM 792 C LYS A 50 3.063 11.213 -10.513 1.00 0.00 C ATOM 793 O LYS A 50 2.301 12.082 -10.095 1.00 0.00 O ATOM 794 CB LYS A 50 1.558 10.777 -12.471 1.00 0.00 C ATOM 795 CG LYS A 50 2.111 11.901 -13.334 1.00 0.00 C ATOM 796 CD LYS A 50 1.060 12.470 -14.272 1.00 0.00 C ATOM 797 CE LYS A 50 1.650 13.542 -15.175 1.00 0.00 C ATOM 798 NZ LYS A 50 2.682 12.988 -16.092 1.00 0.00 N ATOM 0 H LYS A 50 1.350 9.259 -10.131 1.00 0.00 H new ATOM 0 HA LYS A 50 3.444 9.854 -12.127 1.00 0.00 H new ATOM 0 HB2 LYS A 50 1.169 9.990 -13.117 1.00 0.00 H new ATOM 0 HB3 LYS A 50 0.718 11.155 -11.888 1.00 0.00 H new ATOM 0 HG2 LYS A 50 2.493 12.696 -12.693 1.00 0.00 H new ATOM 0 HG3 LYS A 50 2.954 11.529 -13.917 1.00 0.00 H new ATOM 0 HD2 LYS A 50 0.640 11.669 -14.881 1.00 0.00 H new ATOM 0 HD3 LYS A 50 0.240 12.892 -13.691 1.00 0.00 H new ATOM 0 HE2 LYS A 50 0.854 14.002 -15.760 1.00 0.00 H new ATOM 0 HE3 LYS A 50 2.092 14.329 -14.564 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 3.108 13.761 -16.643 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 3.421 12.511 -15.536 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 2.240 12.304 -16.739 1.00 0.00 H new ATOM 812 N LEU A 51 4.300 11.069 -10.075 1.00 0.00 N ATOM 813 CA LEU A 51 4.912 12.043 -9.198 1.00 0.00 C ATOM 814 C LEU A 51 5.722 13.026 -10.023 1.00 0.00 C ATOM 815 O LEU A 51 6.936 12.904 -10.169 1.00 0.00 O ATOM 816 CB LEU A 51 5.761 11.362 -8.108 1.00 0.00 C ATOM 817 CG LEU A 51 6.402 10.016 -8.474 1.00 0.00 C ATOM 818 CD1 LEU A 51 7.690 10.204 -9.260 1.00 0.00 C ATOM 819 CD2 LEU A 51 6.662 9.205 -7.217 1.00 0.00 C ATOM 0 H LEU A 51 4.902 10.281 -10.315 1.00 0.00 H new ATOM 0 HA LEU A 51 4.131 12.595 -8.676 1.00 0.00 H new ATOM 0 HB2 LEU A 51 6.555 12.049 -7.817 1.00 0.00 H new ATOM 0 HB3 LEU A 51 5.132 11.212 -7.231 1.00 0.00 H new ATOM 0 HG LEU A 51 5.704 9.474 -9.112 1.00 0.00 H new ATOM 0 HD11 LEU A 51 8.115 9.230 -9.501 1.00 0.00 H new ATOM 0 HD12 LEU A 51 7.478 10.745 -10.182 1.00 0.00 H new ATOM 0 HD13 LEU A 51 8.402 10.772 -8.661 1.00 0.00 H new ATOM 0 HD21 LEU A 51 7.117 8.252 -7.487 1.00 0.00 H new ATOM 0 HD22 LEU A 51 7.336 9.756 -6.561 1.00 0.00 H new ATOM 0 HD23 LEU A 51 5.720 9.024 -6.699 1.00 0.00 H new ATOM 831 N ASP A 52 5.032 14.004 -10.575 1.00 0.00 N ATOM 832 CA ASP A 52 5.661 14.916 -11.514 1.00 0.00 C ATOM 833 C ASP A 52 6.077 16.175 -10.785 1.00 0.00 C ATOM 834 O ASP A 52 5.483 17.241 -10.940 1.00 0.00 O ATOM 835 CB ASP A 52 4.729 15.241 -12.681 1.00 0.00 C ATOM 836 CG ASP A 52 5.473 15.831 -13.861 1.00 0.00 C ATOM 837 OD1 ASP A 52 6.017 15.051 -14.673 1.00 0.00 O ATOM 838 OD2 ASP A 52 5.517 17.072 -13.993 1.00 0.00 O ATOM 0 H ASP A 52 4.045 14.188 -10.393 1.00 0.00 H new ATOM 0 HA ASP A 52 6.545 14.436 -11.934 1.00 0.00 H new ATOM 0 HB2 ASP A 52 4.214 14.334 -12.996 1.00 0.00 H new ATOM 0 HB3 ASP A 52 3.964 15.943 -12.348 1.00 0.00 H new ATOM 843 N GLY A 53 7.064 16.011 -9.930 1.00 0.00 N ATOM 844 CA GLY A 53 7.510 17.091 -9.095 1.00 0.00 C ATOM 845 C GLY A 53 7.966 16.577 -7.755 1.00 0.00 C ATOM 846 O GLY A 53 9.082 16.074 -7.616 1.00 0.00 O ATOM 0 H GLY A 53 7.570 15.135 -9.799 1.00 0.00 H new ATOM 0 HA2 GLY A 53 8.328 17.621 -9.584 1.00 0.00 H new ATOM 0 HA3 GLY A 53 6.701 17.809 -8.958 1.00 0.00 H new ATOM 850 N ASP A 54 7.093 16.700 -6.771 1.00 0.00 N ATOM 851 CA ASP A 54 7.384 16.257 -5.415 1.00 0.00 C ATOM 852 C ASP A 54 6.104 15.720 -4.770 1.00 0.00 C ATOM 853 O ASP A 54 6.008 15.584 -3.552 1.00 0.00 O ATOM 854 CB ASP A 54 7.956 17.441 -4.625 1.00 0.00 C ATOM 855 CG ASP A 54 8.472 17.075 -3.249 1.00 0.00 C ATOM 856 OD1 ASP A 54 9.430 16.276 -3.153 1.00 0.00 O ATOM 857 OD2 ASP A 54 7.945 17.614 -2.254 1.00 0.00 O ATOM 0 H ASP A 54 6.165 17.108 -6.886 1.00 0.00 H new ATOM 0 HA ASP A 54 8.120 15.453 -5.421 1.00 0.00 H new ATOM 0 HB2 ASP A 54 8.768 17.888 -5.199 1.00 0.00 H new ATOM 0 HB3 ASP A 54 7.183 18.202 -4.521 1.00 0.00 H new ATOM 862 N ILE A 55 5.144 15.341 -5.615 1.00 0.00 N ATOM 863 CA ILE A 55 3.809 15.043 -5.180 1.00 0.00 C ATOM 864 C ILE A 55 3.339 13.754 -5.815 1.00 0.00 C ATOM 865 O ILE A 55 3.791 13.379 -6.890 1.00 0.00 O ATOM 866 CB ILE A 55 2.824 16.183 -5.554 1.00 0.00 C ATOM 867 CG1 ILE A 55 3.148 16.795 -6.931 1.00 0.00 C ATOM 868 CG2 ILE A 55 2.838 17.265 -4.491 1.00 0.00 C ATOM 869 CD1 ILE A 55 2.883 15.885 -8.116 1.00 0.00 C ATOM 0 H ILE A 55 5.287 15.237 -6.620 1.00 0.00 H new ATOM 0 HA ILE A 55 3.826 14.942 -4.095 1.00 0.00 H new ATOM 0 HB ILE A 55 1.828 15.744 -5.610 1.00 0.00 H new ATOM 0 HG12 ILE A 55 2.562 17.706 -7.054 1.00 0.00 H new ATOM 0 HG13 ILE A 55 4.198 17.087 -6.944 1.00 0.00 H new ATOM 0 HG21 ILE A 55 2.142 18.057 -4.768 1.00 0.00 H new ATOM 0 HG22 ILE A 55 2.539 16.838 -3.534 1.00 0.00 H new ATOM 0 HG23 ILE A 55 3.843 17.679 -4.406 1.00 0.00 H new ATOM 0 HD11 ILE A 55 3.142 16.405 -9.039 1.00 0.00 H new ATOM 0 HD12 ILE A 55 3.489 14.984 -8.025 1.00 0.00 H new ATOM 0 HD13 ILE A 55 1.828 15.612 -8.137 1.00 0.00 H new ATOM 881 N VAL A 56 2.468 13.071 -5.134 1.00 0.00 N ATOM 882 CA VAL A 56 1.762 11.953 -5.725 1.00 0.00 C ATOM 883 C VAL A 56 0.502 12.474 -6.409 1.00 0.00 C ATOM 884 O VAL A 56 -0.552 12.597 -5.790 1.00 0.00 O ATOM 885 CB VAL A 56 1.393 10.879 -4.677 1.00 0.00 C ATOM 886 CG1 VAL A 56 0.738 9.675 -5.340 1.00 0.00 C ATOM 887 CG2 VAL A 56 2.626 10.455 -3.890 1.00 0.00 C ATOM 0 H VAL A 56 2.222 13.263 -4.163 1.00 0.00 H new ATOM 0 HA VAL A 56 2.420 11.476 -6.452 1.00 0.00 H new ATOM 0 HB VAL A 56 0.674 11.314 -3.983 1.00 0.00 H new ATOM 0 HG11 VAL A 56 0.488 8.933 -4.581 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -0.171 9.991 -5.852 1.00 0.00 H new ATOM 0 HG13 VAL A 56 1.428 9.237 -6.062 1.00 0.00 H new ATOM 0 HG21 VAL A 56 2.347 9.698 -3.157 1.00 0.00 H new ATOM 0 HG22 VAL A 56 3.369 10.043 -4.572 1.00 0.00 H new ATOM 0 HG23 VAL A 56 3.045 11.320 -3.377 1.00 0.00 H new ATOM 897 N GLU A 57 0.634 12.829 -7.682 1.00 0.00 N ATOM 898 CA GLU A 57 -0.471 13.421 -8.423 1.00 0.00 C ATOM 899 C GLU A 57 -1.483 12.353 -8.788 1.00 0.00 C ATOM 900 O GLU A 57 -2.660 12.434 -8.432 1.00 0.00 O ATOM 901 CB GLU A 57 0.044 14.114 -9.687 1.00 0.00 C ATOM 902 CG GLU A 57 -1.051 14.717 -10.553 1.00 0.00 C ATOM 903 CD GLU A 57 -1.836 15.797 -9.839 1.00 0.00 C ATOM 904 OE1 GLU A 57 -1.284 16.899 -9.634 1.00 0.00 O ATOM 905 OE2 GLU A 57 -3.007 15.551 -9.483 1.00 0.00 O ATOM 0 H GLU A 57 1.493 12.717 -8.220 1.00 0.00 H new ATOM 0 HA GLU A 57 -0.955 14.166 -7.792 1.00 0.00 H new ATOM 0 HB2 GLU A 57 0.740 14.902 -9.399 1.00 0.00 H new ATOM 0 HB3 GLU A 57 0.606 13.393 -10.280 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -0.605 15.135 -11.456 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -1.733 13.928 -10.870 1.00 0.00 H new ATOM 912 N ASP A 58 -1.021 11.342 -9.496 1.00 0.00 N ATOM 913 CA ASP A 58 -1.899 10.259 -9.890 1.00 0.00 C ATOM 914 C ASP A 58 -1.333 8.929 -9.428 1.00 0.00 C ATOM 915 O ASP A 58 -0.142 8.827 -9.134 1.00 0.00 O ATOM 916 CB ASP A 58 -2.110 10.254 -11.402 1.00 0.00 C ATOM 917 CG ASP A 58 -3.309 9.422 -11.802 1.00 0.00 C ATOM 918 OD1 ASP A 58 -4.435 9.965 -11.798 1.00 0.00 O ATOM 919 OD2 ASP A 58 -3.144 8.224 -12.097 1.00 0.00 O ATOM 0 H ASP A 58 -0.054 11.248 -9.807 1.00 0.00 H new ATOM 0 HA ASP A 58 -2.867 10.411 -9.413 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -2.245 11.277 -11.753 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -1.218 9.864 -11.892 1.00 0.00 H new ATOM 924 N ALA A 59 -2.191 7.925 -9.358 1.00 0.00 N ATOM 925 CA ALA A 59 -1.798 6.596 -8.931 1.00 0.00 C ATOM 926 C ALA A 59 -2.780 5.575 -9.478 1.00 0.00 C ATOM 927 O ALA A 59 -3.975 5.634 -9.183 1.00 0.00 O ATOM 928 CB ALA A 59 -1.745 6.518 -7.414 1.00 0.00 C ATOM 0 H ALA A 59 -3.179 8.010 -9.596 1.00 0.00 H new ATOM 0 HA ALA A 59 -0.803 6.379 -9.318 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -1.448 5.514 -7.111 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -1.020 7.239 -7.038 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -2.729 6.745 -7.003 1.00 0.00 H new ATOM 934 N LYS A 60 -2.286 4.652 -10.285 1.00 0.00 N ATOM 935 CA LYS A 60 -3.133 3.639 -10.871 1.00 0.00 C ATOM 936 C LYS A 60 -2.765 2.289 -10.298 1.00 0.00 C ATOM 937 O LYS A 60 -1.586 1.987 -10.121 1.00 0.00 O ATOM 938 CB LYS A 60 -2.995 3.631 -12.394 1.00 0.00 C ATOM 939 CG LYS A 60 -3.597 4.845 -13.077 1.00 0.00 C ATOM 940 CD LYS A 60 -5.111 4.839 -12.975 1.00 0.00 C ATOM 941 CE LYS A 60 -5.724 6.017 -13.713 1.00 0.00 C ATOM 942 NZ LYS A 60 -5.378 7.310 -13.077 1.00 0.00 N ATOM 0 H LYS A 60 -1.302 4.587 -10.547 1.00 0.00 H new ATOM 0 HA LYS A 60 -4.173 3.862 -10.632 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -1.938 3.569 -12.652 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -3.472 2.733 -12.787 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -3.203 5.754 -12.622 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -3.301 4.859 -14.126 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -5.501 3.908 -13.387 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -5.406 4.872 -11.926 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -5.378 6.017 -14.747 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -6.808 5.904 -13.739 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -5.802 8.089 -13.621 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -5.745 7.327 -12.104 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -4.344 7.423 -13.059 1.00 0.00 H new ATOM 956 N PHE A 61 -3.772 1.493 -9.992 1.00 0.00 N ATOM 957 CA PHE A 61 -3.560 0.216 -9.345 1.00 0.00 C ATOM 958 C PHE A 61 -4.277 -0.902 -10.087 1.00 0.00 C ATOM 959 O PHE A 61 -5.485 -1.064 -9.970 1.00 0.00 O ATOM 960 CB PHE A 61 -4.008 0.280 -7.874 1.00 0.00 C ATOM 961 CG PHE A 61 -5.292 1.041 -7.641 1.00 0.00 C ATOM 962 CD1 PHE A 61 -5.274 2.416 -7.458 1.00 0.00 C ATOM 963 CD2 PHE A 61 -6.511 0.384 -7.595 1.00 0.00 C ATOM 964 CE1 PHE A 61 -6.442 3.118 -7.236 1.00 0.00 C ATOM 965 CE2 PHE A 61 -7.683 1.082 -7.375 1.00 0.00 C ATOM 966 CZ PHE A 61 -7.649 2.450 -7.196 1.00 0.00 C ATOM 0 H PHE A 61 -4.750 1.712 -10.183 1.00 0.00 H new ATOM 0 HA PHE A 61 -2.493 -0.006 -9.370 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -4.131 -0.737 -7.500 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -3.215 0.742 -7.286 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -4.333 2.945 -7.490 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -6.546 -0.687 -7.733 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -6.411 4.188 -7.094 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -8.626 0.557 -7.343 1.00 0.00 H new ATOM 0 HZ PHE A 61 -8.565 2.996 -7.025 1.00 0.00 H new ATOM 976 N GLU A 62 -3.528 -1.643 -10.885 1.00 0.00 N ATOM 977 CA GLU A 62 -4.060 -2.825 -11.543 1.00 0.00 C ATOM 978 C GLU A 62 -3.823 -4.034 -10.651 1.00 0.00 C ATOM 979 O GLU A 62 -2.719 -4.572 -10.603 1.00 0.00 O ATOM 980 CB GLU A 62 -3.401 -3.038 -12.909 1.00 0.00 C ATOM 981 CG GLU A 62 -3.914 -4.267 -13.641 1.00 0.00 C ATOM 982 CD GLU A 62 -3.134 -4.567 -14.901 1.00 0.00 C ATOM 983 OE1 GLU A 62 -2.041 -5.167 -14.803 1.00 0.00 O ATOM 984 OE2 GLU A 62 -3.615 -4.223 -16.000 1.00 0.00 O ATOM 0 H GLU A 62 -2.549 -1.447 -11.093 1.00 0.00 H new ATOM 0 HA GLU A 62 -5.129 -2.689 -11.708 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -3.572 -2.157 -13.528 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -2.323 -3.128 -12.774 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -3.864 -5.128 -12.975 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -4.964 -4.121 -13.895 1.00 0.00 H new ATOM 991 N GLY A 63 -4.852 -4.440 -9.930 1.00 0.00 N ATOM 992 CA GLY A 63 -4.693 -5.488 -8.950 1.00 0.00 C ATOM 993 C GLY A 63 -5.671 -6.620 -9.142 1.00 0.00 C ATOM 994 O GLY A 63 -6.879 -6.437 -8.996 1.00 0.00 O ATOM 0 H GLY A 63 -5.796 -4.062 -10.006 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -3.677 -5.879 -9.004 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -4.821 -5.069 -7.952 1.00 0.00 H new ATOM 998 N GLU A 64 -5.148 -7.796 -9.456 1.00 0.00 N ATOM 999 CA GLU A 64 -5.973 -8.977 -9.615 1.00 0.00 C ATOM 1000 C GLU A 64 -5.407 -10.080 -8.742 1.00 0.00 C ATOM 1001 O GLU A 64 -4.215 -10.387 -8.810 1.00 0.00 O ATOM 1002 CB GLU A 64 -6.027 -9.420 -11.079 1.00 0.00 C ATOM 1003 CG GLU A 64 -6.643 -8.386 -12.013 1.00 0.00 C ATOM 1004 CD GLU A 64 -8.133 -8.177 -11.795 1.00 0.00 C ATOM 1005 OE1 GLU A 64 -8.700 -8.739 -10.832 1.00 0.00 O ATOM 1006 OE2 GLU A 64 -8.751 -7.455 -12.605 1.00 0.00 O ATOM 0 H GLU A 64 -4.152 -7.955 -9.606 1.00 0.00 H new ATOM 0 HA GLU A 64 -6.994 -8.750 -9.310 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -5.016 -9.645 -11.418 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -6.600 -10.345 -11.148 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -6.128 -7.435 -11.878 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -6.476 -8.696 -13.045 1.00 0.00 H new ATOM 1013 N GLY A 65 -6.255 -10.646 -7.909 1.00 0.00 N ATOM 1014 CA GLY A 65 -5.805 -11.610 -6.936 1.00 0.00 C ATOM 1015 C GLY A 65 -6.887 -11.938 -5.936 1.00 0.00 C ATOM 1016 O GLY A 65 -8.025 -12.224 -6.311 1.00 0.00 O ATOM 0 H GLY A 65 -7.257 -10.454 -7.889 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -5.491 -12.521 -7.445 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -4.932 -11.219 -6.413 1.00 0.00 H new ATOM 1020 N CYS A 66 -6.536 -11.887 -4.661 1.00 0.00 N ATOM 1021 CA CYS A 66 -7.453 -12.256 -3.604 1.00 0.00 C ATOM 1022 C CYS A 66 -8.134 -11.019 -3.034 1.00 0.00 C ATOM 1023 O CYS A 66 -7.654 -9.898 -3.216 1.00 0.00 O ATOM 1024 CB CYS A 66 -6.706 -13.020 -2.512 1.00 0.00 C ATOM 1025 SG CYS A 66 -5.002 -12.463 -2.249 1.00 0.00 S ATOM 0 H CYS A 66 -5.616 -11.591 -4.336 1.00 0.00 H new ATOM 0 HA CYS A 66 -8.226 -12.905 -4.015 1.00 0.00 H new ATOM 0 HB2 CYS A 66 -7.256 -12.924 -1.576 1.00 0.00 H new ATOM 0 HB3 CYS A 66 -6.695 -14.079 -2.768 1.00 0.00 H new ATOM 0 HG CYS A 66 -4.232 -12.974 -3.163 1.00 0.00 H new ATOM 1031 N SER A 67 -9.235 -11.238 -2.330 1.00 0.00 N ATOM 1032 CA SER A 67 -10.074 -10.157 -1.831 1.00 0.00 C ATOM 1033 C SER A 67 -9.289 -9.203 -0.936 1.00 0.00 C ATOM 1034 O SER A 67 -9.485 -7.992 -0.989 1.00 0.00 O ATOM 1035 CB SER A 67 -11.250 -10.739 -1.050 1.00 0.00 C ATOM 1036 OG SER A 67 -11.792 -11.870 -1.715 1.00 0.00 O ATOM 0 H SER A 67 -9.572 -12.170 -2.088 1.00 0.00 H new ATOM 0 HA SER A 67 -10.438 -9.592 -2.689 1.00 0.00 H new ATOM 0 HB2 SER A 67 -10.922 -11.023 -0.050 1.00 0.00 H new ATOM 0 HB3 SER A 67 -12.022 -9.979 -0.929 1.00 0.00 H new ATOM 0 HG SER A 67 -12.543 -12.226 -1.195 1.00 0.00 H new ATOM 1042 N ILE A 68 -8.386 -9.753 -0.135 1.00 0.00 N ATOM 1043 CA ILE A 68 -7.640 -8.950 0.827 1.00 0.00 C ATOM 1044 C ILE A 68 -6.576 -8.086 0.152 1.00 0.00 C ATOM 1045 O ILE A 68 -6.342 -6.954 0.561 1.00 0.00 O ATOM 1046 CB ILE A 68 -7.009 -9.823 1.943 1.00 0.00 C ATOM 1047 CG1 ILE A 68 -6.248 -11.029 1.370 1.00 0.00 C ATOM 1048 CG2 ILE A 68 -8.083 -10.294 2.909 1.00 0.00 C ATOM 1049 CD1 ILE A 68 -4.824 -10.725 0.958 1.00 0.00 C ATOM 0 H ILE A 68 -8.153 -10.746 -0.131 1.00 0.00 H new ATOM 0 HA ILE A 68 -8.363 -8.281 1.294 1.00 0.00 H new ATOM 0 HB ILE A 68 -6.288 -9.203 2.475 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -6.237 -11.825 2.115 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -6.791 -11.410 0.505 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -7.629 -10.906 3.688 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -8.568 -9.430 3.363 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -8.824 -10.884 2.370 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -4.358 -11.629 0.565 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -4.825 -9.953 0.189 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -4.262 -10.374 1.823 1.00 0.00 H new ATOM 1061 N SER A 69 -5.961 -8.604 -0.904 1.00 0.00 N ATOM 1062 CA SER A 69 -4.890 -7.886 -1.582 1.00 0.00 C ATOM 1063 C SER A 69 -5.472 -6.819 -2.496 1.00 0.00 C ATOM 1064 O SER A 69 -4.893 -5.749 -2.680 1.00 0.00 O ATOM 1065 CB SER A 69 -4.015 -8.862 -2.375 1.00 0.00 C ATOM 1066 OG SER A 69 -4.804 -9.694 -3.214 1.00 0.00 O ATOM 0 H SER A 69 -6.184 -9.514 -1.308 1.00 0.00 H new ATOM 0 HA SER A 69 -4.265 -7.396 -0.835 1.00 0.00 H new ATOM 0 HB2 SER A 69 -3.300 -8.304 -2.980 1.00 0.00 H new ATOM 0 HB3 SER A 69 -3.437 -9.479 -1.686 1.00 0.00 H new ATOM 0 HG SER A 69 -4.992 -10.539 -2.754 1.00 0.00 H new ATOM 1072 N MET A 70 -6.631 -7.123 -3.060 1.00 0.00 N ATOM 1073 CA MET A 70 -7.351 -6.163 -3.881 1.00 0.00 C ATOM 1074 C MET A 70 -7.999 -5.090 -3.003 1.00 0.00 C ATOM 1075 O MET A 70 -8.413 -4.041 -3.493 1.00 0.00 O ATOM 1076 CB MET A 70 -8.410 -6.875 -4.727 1.00 0.00 C ATOM 1077 CG MET A 70 -7.830 -7.901 -5.690 1.00 0.00 C ATOM 1078 SD MET A 70 -9.099 -8.777 -6.628 1.00 0.00 S ATOM 1079 CE MET A 70 -9.801 -7.436 -7.585 1.00 0.00 C ATOM 0 H MET A 70 -7.093 -8.027 -2.964 1.00 0.00 H new ATOM 0 HA MET A 70 -6.642 -5.678 -4.551 1.00 0.00 H new ATOM 0 HB2 MET A 70 -9.119 -7.371 -4.064 1.00 0.00 H new ATOM 0 HB3 MET A 70 -8.970 -6.132 -5.295 1.00 0.00 H new ATOM 0 HG2 MET A 70 -7.154 -7.400 -6.383 1.00 0.00 H new ATOM 0 HG3 MET A 70 -7.236 -8.623 -5.130 1.00 0.00 H new ATOM 0 HE1 MET A 70 -10.871 -7.370 -7.389 1.00 0.00 H new ATOM 0 HE2 MET A 70 -9.322 -6.498 -7.303 1.00 0.00 H new ATOM 0 HE3 MET A 70 -9.638 -7.622 -8.646 1.00 0.00 H new ATOM 1089 N ALA A 71 -8.090 -5.364 -1.706 1.00 0.00 N ATOM 1090 CA ALA A 71 -8.644 -4.405 -0.761 1.00 0.00 C ATOM 1091 C ALA A 71 -7.573 -3.441 -0.271 1.00 0.00 C ATOM 1092 O ALA A 71 -7.753 -2.224 -0.324 1.00 0.00 O ATOM 1093 CB ALA A 71 -9.282 -5.125 0.414 1.00 0.00 C ATOM 0 H ALA A 71 -7.787 -6.243 -1.286 1.00 0.00 H new ATOM 0 HA ALA A 71 -9.411 -3.828 -1.277 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -9.691 -4.393 1.111 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -10.083 -5.770 0.054 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -8.530 -5.729 0.922 1.00 0.00 H new ATOM 1099 N SER A 72 -6.458 -3.996 0.199 1.00 0.00 N ATOM 1100 CA SER A 72 -5.371 -3.192 0.746 1.00 0.00 C ATOM 1101 C SER A 72 -4.837 -2.209 -0.293 1.00 0.00 C ATOM 1102 O SER A 72 -4.617 -1.035 0.004 1.00 0.00 O ATOM 1103 CB SER A 72 -4.246 -4.104 1.238 1.00 0.00 C ATOM 1104 OG SER A 72 -3.877 -5.043 0.237 1.00 0.00 O ATOM 0 H SER A 72 -6.285 -5.001 0.211 1.00 0.00 H new ATOM 0 HA SER A 72 -5.760 -2.616 1.586 1.00 0.00 H new ATOM 0 HB2 SER A 72 -3.380 -3.503 1.514 1.00 0.00 H new ATOM 0 HB3 SER A 72 -4.567 -4.632 2.136 1.00 0.00 H new ATOM 0 HG SER A 72 -2.900 -5.080 0.167 1.00 0.00 H new ATOM 1110 N ALA A 73 -4.642 -2.711 -1.507 1.00 0.00 N ATOM 1111 CA ALA A 73 -4.157 -1.917 -2.626 1.00 0.00 C ATOM 1112 C ALA A 73 -4.960 -0.636 -2.791 1.00 0.00 C ATOM 1113 O ALA A 73 -4.418 0.455 -2.647 1.00 0.00 O ATOM 1114 CB ALA A 73 -4.205 -2.737 -3.906 1.00 0.00 C ATOM 0 H ALA A 73 -4.818 -3.688 -1.742 1.00 0.00 H new ATOM 0 HA ALA A 73 -3.125 -1.637 -2.417 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -3.840 -2.135 -4.738 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -3.577 -3.621 -3.795 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -5.232 -3.044 -4.103 1.00 0.00 H new ATOM 1120 N SER A 74 -6.255 -0.771 -3.067 1.00 0.00 N ATOM 1121 CA SER A 74 -7.114 0.386 -3.296 1.00 0.00 C ATOM 1122 C SER A 74 -7.066 1.356 -2.118 1.00 0.00 C ATOM 1123 O SER A 74 -6.956 2.565 -2.302 1.00 0.00 O ATOM 1124 CB SER A 74 -8.555 -0.064 -3.530 1.00 0.00 C ATOM 1125 OG SER A 74 -8.633 -1.020 -4.573 1.00 0.00 O ATOM 0 H SER A 74 -6.732 -1.670 -3.137 1.00 0.00 H new ATOM 0 HA SER A 74 -6.745 0.903 -4.182 1.00 0.00 H new ATOM 0 HB2 SER A 74 -8.959 -0.491 -2.612 1.00 0.00 H new ATOM 0 HB3 SER A 74 -9.172 0.799 -3.778 1.00 0.00 H new ATOM 0 HG SER A 74 -9.566 -1.122 -4.854 1.00 0.00 H new ATOM 1131 N MET A 75 -7.102 0.812 -0.910 1.00 0.00 N ATOM 1132 CA MET A 75 -7.192 1.630 0.290 1.00 0.00 C ATOM 1133 C MET A 75 -5.900 2.402 0.500 1.00 0.00 C ATOM 1134 O MET A 75 -5.909 3.625 0.644 1.00 0.00 O ATOM 1135 CB MET A 75 -7.486 0.753 1.512 1.00 0.00 C ATOM 1136 CG MET A 75 -7.671 1.539 2.803 1.00 0.00 C ATOM 1137 SD MET A 75 -9.089 2.651 2.737 1.00 0.00 S ATOM 1138 CE MET A 75 -9.042 3.353 4.384 1.00 0.00 C ATOM 0 H MET A 75 -7.070 -0.192 -0.735 1.00 0.00 H new ATOM 0 HA MET A 75 -8.009 2.341 0.164 1.00 0.00 H new ATOM 0 HB2 MET A 75 -8.387 0.170 1.321 1.00 0.00 H new ATOM 0 HB3 MET A 75 -6.669 0.044 1.643 1.00 0.00 H new ATOM 0 HG2 MET A 75 -7.797 0.844 3.633 1.00 0.00 H new ATOM 0 HG3 MET A 75 -6.769 2.117 3.005 1.00 0.00 H new ATOM 0 HE1 MET A 75 -9.860 4.064 4.500 1.00 0.00 H new ATOM 0 HE2 MET A 75 -9.145 2.557 5.122 1.00 0.00 H new ATOM 0 HE3 MET A 75 -8.092 3.866 4.534 1.00 0.00 H new ATOM 1148 N MET A 76 -4.787 1.684 0.467 1.00 0.00 N ATOM 1149 CA MET A 76 -3.493 2.284 0.751 1.00 0.00 C ATOM 1150 C MET A 76 -3.041 3.190 -0.391 1.00 0.00 C ATOM 1151 O MET A 76 -2.476 4.257 -0.156 1.00 0.00 O ATOM 1152 CB MET A 76 -2.456 1.196 1.016 1.00 0.00 C ATOM 1153 CG MET A 76 -2.721 0.396 2.281 1.00 0.00 C ATOM 1154 SD MET A 76 -1.497 -0.899 2.551 1.00 0.00 S ATOM 1155 CE MET A 76 -0.007 0.081 2.753 1.00 0.00 C ATOM 0 H MET A 76 -4.754 0.689 0.247 1.00 0.00 H new ATOM 0 HA MET A 76 -3.593 2.901 1.644 1.00 0.00 H new ATOM 0 HB2 MET A 76 -2.430 0.516 0.165 1.00 0.00 H new ATOM 0 HB3 MET A 76 -1.470 1.655 1.087 1.00 0.00 H new ATOM 0 HG2 MET A 76 -2.727 1.070 3.138 1.00 0.00 H new ATOM 0 HG3 MET A 76 -3.712 -0.053 2.222 1.00 0.00 H new ATOM 0 HE1 MET A 76 0.592 0.023 1.844 1.00 0.00 H new ATOM 0 HE2 MET A 76 -0.278 1.120 2.944 1.00 0.00 H new ATOM 0 HE3 MET A 76 0.570 -0.304 3.594 1.00 0.00 H new ATOM 1165 N THR A 77 -3.318 2.779 -1.624 1.00 0.00 N ATOM 1166 CA THR A 77 -2.920 3.556 -2.797 1.00 0.00 C ATOM 1167 C THR A 77 -3.600 4.921 -2.813 1.00 0.00 C ATOM 1168 O THR A 77 -3.044 5.892 -3.316 1.00 0.00 O ATOM 1169 CB THR A 77 -3.251 2.813 -4.110 1.00 0.00 C ATOM 1170 OG1 THR A 77 -2.604 1.536 -4.126 1.00 0.00 O ATOM 1171 CG2 THR A 77 -2.814 3.614 -5.328 1.00 0.00 C ATOM 0 H THR A 77 -3.815 1.915 -1.839 1.00 0.00 H new ATOM 0 HA THR A 77 -1.841 3.692 -2.729 1.00 0.00 H new ATOM 0 HB THR A 77 -4.332 2.682 -4.154 1.00 0.00 H new ATOM 0 HG1 THR A 77 -3.118 0.902 -3.584 1.00 0.00 H new ATOM 0 HG21 THR A 77 -3.062 3.062 -6.235 1.00 0.00 H new ATOM 0 HG22 THR A 77 -3.329 4.575 -5.336 1.00 0.00 H new ATOM 0 HG23 THR A 77 -1.737 3.780 -5.287 1.00 0.00 H new ATOM 1179 N GLN A 78 -4.785 4.998 -2.234 1.00 0.00 N ATOM 1180 CA GLN A 78 -5.552 6.231 -2.250 1.00 0.00 C ATOM 1181 C GLN A 78 -5.140 7.123 -1.094 1.00 0.00 C ATOM 1182 O GLN A 78 -5.051 8.341 -1.239 1.00 0.00 O ATOM 1183 CB GLN A 78 -7.050 5.939 -2.214 1.00 0.00 C ATOM 1184 CG GLN A 78 -7.569 5.352 -3.519 1.00 0.00 C ATOM 1185 CD GLN A 78 -9.046 5.023 -3.474 1.00 0.00 C ATOM 1186 OE1 GLN A 78 -9.513 4.111 -4.157 1.00 0.00 O ATOM 1187 NE2 GLN A 78 -9.797 5.765 -2.677 1.00 0.00 N ATOM 0 H GLN A 78 -5.236 4.223 -1.748 1.00 0.00 H new ATOM 0 HA GLN A 78 -5.340 6.759 -3.180 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -7.261 5.245 -1.400 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -7.590 6.860 -1.995 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -7.384 6.059 -4.328 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -7.008 4.447 -3.752 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -9.373 6.512 -2.127 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -10.800 5.590 -2.613 1.00 0.00 H new ATOM 1196 N ALA A 79 -4.862 6.510 0.046 1.00 0.00 N ATOM 1197 CA ALA A 79 -4.347 7.242 1.187 1.00 0.00 C ATOM 1198 C ALA A 79 -2.971 7.809 0.866 1.00 0.00 C ATOM 1199 O ALA A 79 -2.641 8.931 1.248 1.00 0.00 O ATOM 1200 CB ALA A 79 -4.274 6.343 2.407 1.00 0.00 C ATOM 0 H ALA A 79 -4.985 5.510 0.203 1.00 0.00 H new ATOM 0 HA ALA A 79 -5.026 8.066 1.407 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -3.885 6.909 3.253 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -5.271 5.972 2.646 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -3.613 5.501 2.200 1.00 0.00 H new ATOM 1206 N ILE A 80 -2.178 7.035 0.136 1.00 0.00 N ATOM 1207 CA ILE A 80 -0.833 7.468 -0.232 1.00 0.00 C ATOM 1208 C ILE A 80 -0.916 8.433 -1.419 1.00 0.00 C ATOM 1209 O ILE A 80 -0.041 9.271 -1.627 1.00 0.00 O ATOM 1210 CB ILE A 80 0.083 6.246 -0.540 1.00 0.00 C ATOM 1211 CG1 ILE A 80 1.578 6.577 -0.341 1.00 0.00 C ATOM 1212 CG2 ILE A 80 -0.162 5.717 -1.945 1.00 0.00 C ATOM 1213 CD1 ILE A 80 2.215 7.373 -1.461 1.00 0.00 C ATOM 0 H ILE A 80 -2.438 6.112 -0.211 1.00 0.00 H new ATOM 0 HA ILE A 80 -0.381 7.994 0.609 1.00 0.00 H new ATOM 0 HB ILE A 80 -0.180 5.466 0.175 1.00 0.00 H new ATOM 0 HG12 ILE A 80 1.690 7.134 0.589 1.00 0.00 H new ATOM 0 HG13 ILE A 80 2.128 5.644 -0.221 1.00 0.00 H new ATOM 0 HG21 ILE A 80 0.491 4.865 -2.132 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -1.202 5.405 -2.040 1.00 0.00 H new ATOM 0 HG23 ILE A 80 0.049 6.502 -2.671 1.00 0.00 H new ATOM 0 HD11 ILE A 80 3.264 7.554 -1.227 1.00 0.00 H new ATOM 0 HD12 ILE A 80 2.142 6.812 -2.393 1.00 0.00 H new ATOM 0 HD13 ILE A 80 1.698 8.326 -1.570 1.00 0.00 H new ATOM 1225 N LYS A 81 -2.019 8.343 -2.151 1.00 0.00 N ATOM 1226 CA LYS A 81 -2.270 9.203 -3.300 1.00 0.00 C ATOM 1227 C LYS A 81 -2.407 10.660 -2.862 1.00 0.00 C ATOM 1228 O LYS A 81 -2.222 11.582 -3.655 1.00 0.00 O ATOM 1229 CB LYS A 81 -3.546 8.747 -4.007 1.00 0.00 C ATOM 1230 CG LYS A 81 -3.771 9.360 -5.376 1.00 0.00 C ATOM 1231 CD LYS A 81 -5.115 8.932 -5.935 1.00 0.00 C ATOM 1232 CE LYS A 81 -5.319 9.404 -7.361 1.00 0.00 C ATOM 1233 NZ LYS A 81 -6.685 9.086 -7.848 1.00 0.00 N ATOM 0 H LYS A 81 -2.764 7.672 -1.965 1.00 0.00 H new ATOM 0 HA LYS A 81 -1.427 9.130 -3.987 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -3.519 7.662 -4.111 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -4.400 8.985 -3.373 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -3.729 10.447 -5.306 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -2.974 9.053 -6.054 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -5.192 7.845 -5.899 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -5.911 9.329 -5.305 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -5.153 10.480 -7.417 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -4.581 8.933 -8.011 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -6.792 9.422 -8.826 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -6.834 8.057 -7.817 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -7.388 9.556 -7.242 1.00 0.00 H new ATOM 1247 N GLY A 82 -2.727 10.860 -1.592 1.00 0.00 N ATOM 1248 CA GLY A 82 -2.855 12.201 -1.072 1.00 0.00 C ATOM 1249 C GLY A 82 -1.659 12.600 -0.238 1.00 0.00 C ATOM 1250 O GLY A 82 -1.808 13.245 0.801 1.00 0.00 O ATOM 0 H GLY A 82 -2.900 10.117 -0.915 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -2.970 12.901 -1.899 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -3.759 12.271 -0.467 1.00 0.00 H new ATOM 1254 N LYS A 83 -0.469 12.216 -0.689 1.00 0.00 N ATOM 1255 CA LYS A 83 0.756 12.489 0.044 1.00 0.00 C ATOM 1256 C LYS A 83 1.814 13.027 -0.910 1.00 0.00 C ATOM 1257 O LYS A 83 1.528 13.300 -2.078 1.00 0.00 O ATOM 1258 CB LYS A 83 1.270 11.216 0.736 1.00 0.00 C ATOM 1259 CG LYS A 83 0.314 10.652 1.782 1.00 0.00 C ATOM 1260 CD LYS A 83 0.836 9.352 2.387 1.00 0.00 C ATOM 1261 CE LYS A 83 -0.163 8.756 3.372 1.00 0.00 C ATOM 1262 NZ LYS A 83 0.282 7.434 3.897 1.00 0.00 N ATOM 0 H LYS A 83 -0.330 11.712 -1.565 1.00 0.00 H new ATOM 0 HA LYS A 83 0.546 13.235 0.810 1.00 0.00 H new ATOM 0 HB2 LYS A 83 1.457 10.453 -0.020 1.00 0.00 H new ATOM 0 HB3 LYS A 83 2.226 11.434 1.212 1.00 0.00 H new ATOM 0 HG2 LYS A 83 0.167 11.387 2.573 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -0.660 10.475 1.326 1.00 0.00 H new ATOM 0 HD2 LYS A 83 1.038 8.634 1.592 1.00 0.00 H new ATOM 0 HD3 LYS A 83 1.782 9.539 2.895 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -0.306 9.446 4.204 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -1.130 8.643 2.882 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -0.060 7.315 4.872 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -0.104 6.675 3.299 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 1.321 7.388 3.887 1.00 0.00 H new ATOM 1276 N ASP A 84 3.029 13.183 -0.416 1.00 0.00 N ATOM 1277 CA ASP A 84 4.137 13.572 -1.231 1.00 0.00 C ATOM 1278 C ASP A 84 5.121 12.427 -1.222 1.00 0.00 C ATOM 1279 O ASP A 84 4.824 11.339 -0.724 1.00 0.00 O ATOM 1280 CB ASP A 84 4.805 14.840 -0.684 1.00 0.00 C ATOM 1281 CG ASP A 84 3.852 16.011 -0.550 1.00 0.00 C ATOM 1282 OD1 ASP A 84 3.582 16.691 -1.560 1.00 0.00 O ATOM 1283 OD2 ASP A 84 3.383 16.274 0.577 1.00 0.00 O ATOM 0 H ASP A 84 3.263 13.040 0.566 1.00 0.00 H new ATOM 0 HA ASP A 84 3.798 13.793 -2.243 1.00 0.00 H new ATOM 0 HB2 ASP A 84 5.240 14.621 0.291 1.00 0.00 H new ATOM 0 HB3 ASP A 84 5.626 15.123 -1.343 1.00 0.00 H new ATOM 1288 N ILE A 85 6.290 12.682 -1.726 1.00 0.00 N ATOM 1289 CA ILE A 85 7.320 11.656 -1.799 1.00 0.00 C ATOM 1290 C ILE A 85 8.003 11.526 -0.446 1.00 0.00 C ATOM 1291 O ILE A 85 8.174 10.426 0.078 1.00 0.00 O ATOM 1292 CB ILE A 85 8.354 11.956 -2.915 1.00 0.00 C ATOM 1293 CG1 ILE A 85 7.789 11.583 -4.293 1.00 0.00 C ATOM 1294 CG2 ILE A 85 9.661 11.209 -2.673 1.00 0.00 C ATOM 1295 CD1 ILE A 85 6.487 12.269 -4.642 1.00 0.00 C ATOM 0 H ILE A 85 6.568 13.590 -2.097 1.00 0.00 H new ATOM 0 HA ILE A 85 6.845 10.709 -2.055 1.00 0.00 H new ATOM 0 HB ILE A 85 8.559 13.026 -2.893 1.00 0.00 H new ATOM 0 HG12 ILE A 85 8.530 11.828 -5.054 1.00 0.00 H new ATOM 0 HG13 ILE A 85 7.638 10.504 -4.330 1.00 0.00 H new ATOM 0 HG21 ILE A 85 10.365 11.440 -3.472 1.00 0.00 H new ATOM 0 HG22 ILE A 85 10.084 11.516 -1.717 1.00 0.00 H new ATOM 0 HG23 ILE A 85 9.469 10.136 -2.657 1.00 0.00 H new ATOM 0 HD11 ILE A 85 6.160 11.948 -5.631 1.00 0.00 H new ATOM 0 HD12 ILE A 85 5.728 12.005 -3.906 1.00 0.00 H new ATOM 0 HD13 ILE A 85 6.633 13.349 -4.641 1.00 0.00 H new ATOM 1307 N GLU A 86 8.335 12.667 0.131 1.00 0.00 N ATOM 1308 CA GLU A 86 8.965 12.738 1.440 1.00 0.00 C ATOM 1309 C GLU A 86 8.048 12.128 2.500 1.00 0.00 C ATOM 1310 O GLU A 86 8.500 11.410 3.393 1.00 0.00 O ATOM 1311 CB GLU A 86 9.266 14.201 1.763 1.00 0.00 C ATOM 1312 CG GLU A 86 10.074 14.422 3.027 1.00 0.00 C ATOM 1313 CD GLU A 86 10.347 15.891 3.263 1.00 0.00 C ATOM 1314 OE1 GLU A 86 9.428 16.603 3.715 1.00 0.00 O ATOM 1315 OE2 GLU A 86 11.470 16.348 2.970 1.00 0.00 O ATOM 0 H GLU A 86 8.174 13.578 -0.298 1.00 0.00 H new ATOM 0 HA GLU A 86 9.896 12.171 1.435 1.00 0.00 H new ATOM 0 HB2 GLU A 86 9.805 14.640 0.923 1.00 0.00 H new ATOM 0 HB3 GLU A 86 8.323 14.740 1.853 1.00 0.00 H new ATOM 0 HG2 GLU A 86 9.536 14.010 3.880 1.00 0.00 H new ATOM 0 HG3 GLU A 86 11.018 13.883 2.955 1.00 0.00 H new ATOM 1322 N THR A 87 6.753 12.404 2.370 1.00 0.00 N ATOM 1323 CA THR A 87 5.747 11.865 3.276 1.00 0.00 C ATOM 1324 C THR A 87 5.700 10.340 3.191 1.00 0.00 C ATOM 1325 O THR A 87 5.503 9.649 4.193 1.00 0.00 O ATOM 1326 CB THR A 87 4.355 12.425 2.934 1.00 0.00 C ATOM 1327 OG1 THR A 87 4.473 13.785 2.501 1.00 0.00 O ATOM 1328 CG2 THR A 87 3.427 12.350 4.136 1.00 0.00 C ATOM 0 H THR A 87 6.375 13.004 1.637 1.00 0.00 H new ATOM 0 HA THR A 87 6.022 12.162 4.288 1.00 0.00 H new ATOM 0 HB THR A 87 3.930 11.820 2.133 1.00 0.00 H new ATOM 0 HG1 THR A 87 3.585 14.137 2.283 1.00 0.00 H new ATOM 0 HG21 THR A 87 2.450 12.752 3.867 1.00 0.00 H new ATOM 0 HG22 THR A 87 3.319 11.311 4.448 1.00 0.00 H new ATOM 0 HG23 THR A 87 3.846 12.933 4.956 1.00 0.00 H new ATOM 1336 N ALA A 88 5.903 9.822 1.984 1.00 0.00 N ATOM 1337 CA ALA A 88 5.850 8.388 1.745 1.00 0.00 C ATOM 1338 C ALA A 88 7.104 7.713 2.280 1.00 0.00 C ATOM 1339 O ALA A 88 7.039 6.632 2.866 1.00 0.00 O ATOM 1340 CB ALA A 88 5.678 8.103 0.261 1.00 0.00 C ATOM 0 H ALA A 88 6.107 10.379 1.154 1.00 0.00 H new ATOM 0 HA ALA A 88 4.989 7.980 2.274 1.00 0.00 H new ATOM 0 HB1 ALA A 88 5.640 7.026 0.099 1.00 0.00 H new ATOM 0 HB2 ALA A 88 4.751 8.556 -0.091 1.00 0.00 H new ATOM 0 HB3 ALA A 88 6.519 8.523 -0.290 1.00 0.00 H new ATOM 1346 N LEU A 89 8.246 8.372 2.099 1.00 0.00 N ATOM 1347 CA LEU A 89 9.511 7.855 2.596 1.00 0.00 C ATOM 1348 C LEU A 89 9.451 7.724 4.110 1.00 0.00 C ATOM 1349 O LEU A 89 9.870 6.721 4.678 1.00 0.00 O ATOM 1350 CB LEU A 89 10.671 8.779 2.204 1.00 0.00 C ATOM 1351 CG LEU A 89 10.781 9.100 0.712 1.00 0.00 C ATOM 1352 CD1 LEU A 89 12.032 9.917 0.428 1.00 0.00 C ATOM 1353 CD2 LEU A 89 10.770 7.826 -0.111 1.00 0.00 C ATOM 0 H LEU A 89 8.318 9.265 1.611 1.00 0.00 H new ATOM 0 HA LEU A 89 9.683 6.876 2.149 1.00 0.00 H new ATOM 0 HB2 LEU A 89 10.568 9.715 2.753 1.00 0.00 H new ATOM 0 HB3 LEU A 89 11.605 8.320 2.529 1.00 0.00 H new ATOM 0 HG LEU A 89 9.915 9.697 0.426 1.00 0.00 H new ATOM 0 HD11 LEU A 89 12.090 10.134 -0.639 1.00 0.00 H new ATOM 0 HD12 LEU A 89 11.991 10.852 0.987 1.00 0.00 H new ATOM 0 HD13 LEU A 89 12.913 9.351 0.732 1.00 0.00 H new ATOM 0 HD21 LEU A 89 10.849 8.076 -1.169 1.00 0.00 H new ATOM 0 HD22 LEU A 89 11.613 7.199 0.178 1.00 0.00 H new ATOM 0 HD23 LEU A 89 9.840 7.287 0.066 1.00 0.00 H new ATOM 1365 N SER A 90 8.878 8.737 4.742 1.00 0.00 N ATOM 1366 CA SER A 90 8.779 8.793 6.191 1.00 0.00 C ATOM 1367 C SER A 90 7.905 7.653 6.707 1.00 0.00 C ATOM 1368 O SER A 90 8.189 7.071 7.749 1.00 0.00 O ATOM 1369 CB SER A 90 8.209 10.151 6.626 1.00 0.00 C ATOM 1370 OG SER A 90 8.353 10.355 8.023 1.00 0.00 O ATOM 0 H SER A 90 8.470 9.541 4.266 1.00 0.00 H new ATOM 0 HA SER A 90 9.775 8.680 6.618 1.00 0.00 H new ATOM 0 HB2 SER A 90 8.718 10.950 6.087 1.00 0.00 H new ATOM 0 HB3 SER A 90 7.154 10.207 6.356 1.00 0.00 H new ATOM 0 HG SER A 90 7.982 11.229 8.266 1.00 0.00 H new ATOM 1376 N MET A 91 6.867 7.317 5.950 1.00 0.00 N ATOM 1377 CA MET A 91 5.957 6.237 6.322 1.00 0.00 C ATOM 1378 C MET A 91 6.660 4.882 6.243 1.00 0.00 C ATOM 1379 O MET A 91 6.333 3.955 6.979 1.00 0.00 O ATOM 1380 CB MET A 91 4.725 6.257 5.412 1.00 0.00 C ATOM 1381 CG MET A 91 3.726 5.147 5.698 1.00 0.00 C ATOM 1382 SD MET A 91 2.233 5.288 4.697 1.00 0.00 S ATOM 1383 CE MET A 91 1.356 3.810 5.212 1.00 0.00 C ATOM 0 H MET A 91 6.633 7.778 5.071 1.00 0.00 H new ATOM 0 HA MET A 91 5.638 6.390 7.353 1.00 0.00 H new ATOM 0 HB2 MET A 91 4.224 7.219 5.518 1.00 0.00 H new ATOM 0 HB3 MET A 91 5.051 6.180 4.375 1.00 0.00 H new ATOM 0 HG2 MET A 91 4.196 4.182 5.510 1.00 0.00 H new ATOM 0 HG3 MET A 91 3.455 5.169 6.754 1.00 0.00 H new ATOM 0 HE1 MET A 91 0.405 3.748 4.682 1.00 0.00 H new ATOM 0 HE2 MET A 91 1.958 2.931 4.982 1.00 0.00 H new ATOM 0 HE3 MET A 91 1.171 3.852 6.285 1.00 0.00 H new ATOM 1393 N SER A 92 7.649 4.788 5.370 1.00 0.00 N ATOM 1394 CA SER A 92 8.405 3.573 5.184 1.00 0.00 C ATOM 1395 C SER A 92 9.535 3.554 6.200 1.00 0.00 C ATOM 1396 O SER A 92 9.898 2.504 6.727 1.00 0.00 O ATOM 1397 CB SER A 92 8.944 3.513 3.750 1.00 0.00 C ATOM 1398 OG SER A 92 9.604 2.287 3.486 1.00 0.00 O ATOM 0 H SER A 92 7.947 5.558 4.771 1.00 0.00 H new ATOM 0 HA SER A 92 7.773 2.698 5.337 1.00 0.00 H new ATOM 0 HB2 SER A 92 8.121 3.641 3.047 1.00 0.00 H new ATOM 0 HB3 SER A 92 9.635 4.340 3.587 1.00 0.00 H new ATOM 0 HG SER A 92 9.067 1.545 3.835 1.00 0.00 H new ATOM 1404 N LYS A 93 10.068 4.741 6.481 1.00 0.00 N ATOM 1405 CA LYS A 93 11.081 4.904 7.508 1.00 0.00 C ATOM 1406 C LYS A 93 10.506 4.526 8.864 1.00 0.00 C ATOM 1407 O LYS A 93 11.086 3.727 9.594 1.00 0.00 O ATOM 1408 CB LYS A 93 11.576 6.352 7.536 1.00 0.00 C ATOM 1409 CG LYS A 93 12.574 6.639 8.646 1.00 0.00 C ATOM 1410 CD LYS A 93 12.895 8.121 8.739 1.00 0.00 C ATOM 1411 CE LYS A 93 13.650 8.621 7.515 1.00 0.00 C ATOM 1412 NZ LYS A 93 13.919 10.081 7.590 1.00 0.00 N ATOM 0 H LYS A 93 9.810 5.606 6.006 1.00 0.00 H new ATOM 0 HA LYS A 93 11.923 4.249 7.281 1.00 0.00 H new ATOM 0 HB2 LYS A 93 12.037 6.587 6.577 1.00 0.00 H new ATOM 0 HB3 LYS A 93 10.720 7.017 7.650 1.00 0.00 H new ATOM 0 HG2 LYS A 93 12.170 6.293 9.598 1.00 0.00 H new ATOM 0 HG3 LYS A 93 13.491 6.078 8.466 1.00 0.00 H new ATOM 0 HD2 LYS A 93 11.969 8.686 8.849 1.00 0.00 H new ATOM 0 HD3 LYS A 93 13.490 8.307 9.633 1.00 0.00 H new ATOM 0 HE2 LYS A 93 14.593 8.082 7.425 1.00 0.00 H new ATOM 0 HE3 LYS A 93 13.071 8.404 6.617 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 14.343 10.402 6.696 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 13.027 10.590 7.753 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 14.576 10.273 8.373 1.00 0.00 H new ATOM 1426 N ILE A 94 9.341 5.085 9.177 1.00 0.00 N ATOM 1427 CA ILE A 94 8.695 4.826 10.451 1.00 0.00 C ATOM 1428 C ILE A 94 8.120 3.413 10.472 1.00 0.00 C ATOM 1429 O ILE A 94 7.920 2.837 11.542 1.00 0.00 O ATOM 1430 CB ILE A 94 7.579 5.860 10.762 1.00 0.00 C ATOM 1431 CG1 ILE A 94 7.159 5.766 12.232 1.00 0.00 C ATOM 1432 CG2 ILE A 94 6.374 5.654 9.850 1.00 0.00 C ATOM 1433 CD1 ILE A 94 6.115 6.786 12.630 1.00 0.00 C ATOM 0 H ILE A 94 8.829 5.719 8.564 1.00 0.00 H new ATOM 0 HA ILE A 94 9.455 4.922 11.226 1.00 0.00 H new ATOM 0 HB ILE A 94 7.978 6.857 10.575 1.00 0.00 H new ATOM 0 HG12 ILE A 94 6.771 4.766 12.427 1.00 0.00 H new ATOM 0 HG13 ILE A 94 8.039 5.895 12.862 1.00 0.00 H new ATOM 0 HG21 ILE A 94 5.607 6.391 10.089 1.00 0.00 H new ATOM 0 HG22 ILE A 94 6.680 5.772 8.811 1.00 0.00 H new ATOM 0 HG23 ILE A 94 5.973 4.652 9.998 1.00 0.00 H new ATOM 0 HD11 ILE A 94 5.866 6.660 13.684 1.00 0.00 H new ATOM 0 HD12 ILE A 94 6.507 7.790 12.467 1.00 0.00 H new ATOM 0 HD13 ILE A 94 5.219 6.644 12.026 1.00 0.00 H new ATOM 1445 N PHE A 95 7.866 2.849 9.284 1.00 0.00 N ATOM 1446 CA PHE A 95 7.386 1.471 9.205 1.00 0.00 C ATOM 1447 C PHE A 95 8.391 0.515 9.849 1.00 0.00 C ATOM 1448 O PHE A 95 8.015 -0.367 10.611 1.00 0.00 O ATOM 1449 CB PHE A 95 7.124 1.056 7.753 1.00 0.00 C ATOM 1450 CG PHE A 95 6.405 -0.257 7.631 1.00 0.00 C ATOM 1451 CD1 PHE A 95 5.021 -0.302 7.633 1.00 0.00 C ATOM 1452 CD2 PHE A 95 7.110 -1.444 7.518 1.00 0.00 C ATOM 1453 CE1 PHE A 95 4.353 -1.505 7.523 1.00 0.00 C ATOM 1454 CE2 PHE A 95 6.448 -2.651 7.407 1.00 0.00 C ATOM 1455 CZ PHE A 95 5.066 -2.682 7.411 1.00 0.00 C ATOM 0 H PHE A 95 7.983 3.316 8.385 1.00 0.00 H new ATOM 0 HA PHE A 95 6.444 1.417 9.751 1.00 0.00 H new ATOM 0 HB2 PHE A 95 6.536 1.831 7.261 1.00 0.00 H new ATOM 0 HB3 PHE A 95 8.075 0.992 7.223 1.00 0.00 H new ATOM 0 HD1 PHE A 95 4.457 0.615 7.722 1.00 0.00 H new ATOM 0 HD2 PHE A 95 8.190 -1.425 7.517 1.00 0.00 H new ATOM 0 HE1 PHE A 95 3.273 -1.526 7.525 1.00 0.00 H new ATOM 0 HE2 PHE A 95 7.009 -3.569 7.317 1.00 0.00 H new ATOM 0 HZ PHE A 95 4.545 -3.624 7.327 1.00 0.00 H new ATOM 1465 N SER A 96 9.669 0.697 9.541 1.00 0.00 N ATOM 1466 CA SER A 96 10.715 -0.141 10.112 1.00 0.00 C ATOM 1467 C SER A 96 11.179 0.393 11.469 1.00 0.00 C ATOM 1468 O SER A 96 11.608 -0.368 12.340 1.00 0.00 O ATOM 1469 CB SER A 96 11.884 -0.239 9.131 1.00 0.00 C ATOM 1470 OG SER A 96 12.099 1.002 8.476 1.00 0.00 O ATOM 0 H SER A 96 10.005 1.416 8.900 1.00 0.00 H new ATOM 0 HA SER A 96 10.310 -1.138 10.282 1.00 0.00 H new ATOM 0 HB2 SER A 96 12.788 -0.535 9.664 1.00 0.00 H new ATOM 0 HB3 SER A 96 11.681 -1.014 8.393 1.00 0.00 H new ATOM 0 HG SER A 96 12.852 0.918 7.854 1.00 0.00 H new ATOM 1476 N ASP A 97 11.065 1.703 11.646 1.00 0.00 N ATOM 1477 CA ASP A 97 11.515 2.374 12.864 1.00 0.00 C ATOM 1478 C ASP A 97 10.611 2.048 14.052 1.00 0.00 C ATOM 1479 O ASP A 97 11.017 2.190 15.203 1.00 0.00 O ATOM 1480 CB ASP A 97 11.550 3.888 12.633 1.00 0.00 C ATOM 1481 CG ASP A 97 12.073 4.665 13.825 1.00 0.00 C ATOM 1482 OD1 ASP A 97 13.297 4.626 14.073 1.00 0.00 O ATOM 1483 OD2 ASP A 97 11.269 5.344 14.497 1.00 0.00 O ATOM 0 H ASP A 97 10.659 2.331 10.952 1.00 0.00 H new ATOM 0 HA ASP A 97 12.516 2.013 13.100 1.00 0.00 H new ATOM 0 HB2 ASP A 97 12.175 4.102 11.766 1.00 0.00 H new ATOM 0 HB3 ASP A 97 10.545 4.235 12.394 1.00 0.00 H new ATOM 1670 N LEU A 110 -3.987 4.925 11.822 1.00 0.00 N ATOM 1671 CA LEU A 110 -3.439 3.625 11.473 1.00 0.00 C ATOM 1672 C LEU A 110 -4.460 2.765 10.740 1.00 0.00 C ATOM 1673 O LEU A 110 -4.501 1.549 10.905 1.00 0.00 O ATOM 1674 CB LEU A 110 -2.960 2.934 12.748 1.00 0.00 C ATOM 1675 CG LEU A 110 -2.207 3.851 13.717 1.00 0.00 C ATOM 1676 CD1 LEU A 110 -3.142 4.398 14.788 1.00 0.00 C ATOM 1677 CD2 LEU A 110 -1.037 3.126 14.345 1.00 0.00 C ATOM 0 HA LEU A 110 -2.599 3.765 10.793 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -3.822 2.510 13.263 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -2.311 2.102 12.475 1.00 0.00 H new ATOM 0 HG LEU A 110 -1.817 4.694 13.147 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -2.583 5.046 15.463 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -3.941 4.969 14.316 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -3.572 3.571 15.353 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -0.518 3.797 15.029 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -1.400 2.257 14.895 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -0.349 2.800 13.564 1.00 0.00 H new ATOM 1689 N GLY A 111 -5.270 3.407 9.916 1.00 0.00 N ATOM 1690 CA GLY A 111 -6.274 2.693 9.150 1.00 0.00 C ATOM 1691 C GLY A 111 -5.671 1.824 8.060 1.00 0.00 C ATOM 1692 O GLY A 111 -6.251 0.810 7.675 1.00 0.00 O ATOM 0 H GLY A 111 -5.252 4.415 9.761 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -6.862 2.069 9.823 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -6.960 3.411 8.699 1.00 0.00 H new ATOM 1696 N ASP A 112 -4.495 2.212 7.577 1.00 0.00 N ATOM 1697 CA ASP A 112 -3.845 1.508 6.475 1.00 0.00 C ATOM 1698 C ASP A 112 -3.139 0.248 6.960 1.00 0.00 C ATOM 1699 O ASP A 112 -3.302 -0.827 6.382 1.00 0.00 O ATOM 1700 CB ASP A 112 -2.842 2.422 5.762 1.00 0.00 C ATOM 1701 CG ASP A 112 -3.510 3.578 5.044 1.00 0.00 C ATOM 1702 OD1 ASP A 112 -3.891 3.413 3.870 1.00 0.00 O ATOM 1703 OD2 ASP A 112 -3.664 4.660 5.661 1.00 0.00 O ATOM 0 H ASP A 112 -3.971 3.012 7.932 1.00 0.00 H new ATOM 0 HA ASP A 112 -4.624 1.217 5.771 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -2.132 2.814 6.491 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -2.270 1.835 5.043 1.00 0.00 H new ATOM 1708 N ILE A 113 -2.364 0.379 8.028 1.00 0.00 N ATOM 1709 CA ILE A 113 -1.589 -0.738 8.549 1.00 0.00 C ATOM 1710 C ILE A 113 -2.497 -1.865 9.039 1.00 0.00 C ATOM 1711 O ILE A 113 -2.143 -3.035 8.936 1.00 0.00 O ATOM 1712 CB ILE A 113 -0.631 -0.293 9.684 1.00 0.00 C ATOM 1713 CG1 ILE A 113 0.294 -1.447 10.088 1.00 0.00 C ATOM 1714 CG2 ILE A 113 -1.413 0.209 10.890 1.00 0.00 C ATOM 1715 CD1 ILE A 113 1.333 -1.064 11.124 1.00 0.00 C ATOM 0 H ILE A 113 -2.255 1.248 8.551 1.00 0.00 H new ATOM 0 HA ILE A 113 -0.985 -1.114 7.724 1.00 0.00 H new ATOM 0 HB ILE A 113 -0.020 0.528 9.310 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -0.311 -2.265 10.479 1.00 0.00 H new ATOM 0 HG13 ILE A 113 0.802 -1.822 9.199 1.00 0.00 H new ATOM 0 HG21 ILE A 113 -0.718 0.515 11.672 1.00 0.00 H new ATOM 0 HG22 ILE A 113 -2.027 1.060 10.597 1.00 0.00 H new ATOM 0 HG23 ILE A 113 -2.054 -0.589 11.266 1.00 0.00 H new ATOM 0 HD11 ILE A 113 1.949 -1.932 11.359 1.00 0.00 H new ATOM 0 HD12 ILE A 113 1.963 -0.267 10.730 1.00 0.00 H new ATOM 0 HD13 ILE A 113 0.834 -0.718 12.029 1.00 0.00 H new ATOM 1727 N GLU A 114 -3.682 -1.515 9.532 1.00 0.00 N ATOM 1728 CA GLU A 114 -4.623 -2.515 10.026 1.00 0.00 C ATOM 1729 C GLU A 114 -5.123 -3.404 8.890 1.00 0.00 C ATOM 1730 O GLU A 114 -5.466 -4.566 9.107 1.00 0.00 O ATOM 1731 CB GLU A 114 -5.801 -1.850 10.743 1.00 0.00 C ATOM 1732 CG GLU A 114 -5.409 -1.166 12.044 1.00 0.00 C ATOM 1733 CD GLU A 114 -4.772 -2.117 13.042 1.00 0.00 C ATOM 1734 OE1 GLU A 114 -3.567 -2.401 12.905 1.00 0.00 O ATOM 1735 OE2 GLU A 114 -5.475 -2.572 13.970 1.00 0.00 O ATOM 0 H GLU A 114 -4.012 -0.552 9.600 1.00 0.00 H new ATOM 0 HA GLU A 114 -4.095 -3.143 10.744 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -6.254 -1.115 10.077 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -6.561 -2.603 10.952 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -4.714 -0.355 11.827 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -6.294 -0.715 12.493 1.00 0.00 H new ATOM 1742 N ALA A 115 -5.151 -2.861 7.675 1.00 0.00 N ATOM 1743 CA ALA A 115 -5.519 -3.641 6.502 1.00 0.00 C ATOM 1744 C ALA A 115 -4.463 -4.706 6.212 1.00 0.00 C ATOM 1745 O ALA A 115 -4.778 -5.788 5.716 1.00 0.00 O ATOM 1746 CB ALA A 115 -5.712 -2.735 5.292 1.00 0.00 C ATOM 0 H ALA A 115 -4.923 -1.886 7.480 1.00 0.00 H new ATOM 0 HA ALA A 115 -6.465 -4.142 6.708 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -5.987 -3.338 4.426 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -6.504 -2.015 5.499 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -4.784 -2.203 5.084 1.00 0.00 H new ATOM 1752 N LEU A 116 -3.207 -4.410 6.546 1.00 0.00 N ATOM 1753 CA LEU A 116 -2.118 -5.356 6.302 1.00 0.00 C ATOM 1754 C LEU A 116 -1.861 -6.203 7.539 1.00 0.00 C ATOM 1755 O LEU A 116 -1.208 -7.238 7.467 1.00 0.00 O ATOM 1756 CB LEU A 116 -0.828 -4.625 5.919 1.00 0.00 C ATOM 1757 CG LEU A 116 -0.857 -3.867 4.590 1.00 0.00 C ATOM 1758 CD1 LEU A 116 0.468 -3.154 4.370 1.00 0.00 C ATOM 1759 CD2 LEU A 116 -1.136 -4.811 3.432 1.00 0.00 C ATOM 0 H LEU A 116 -2.920 -3.533 6.981 1.00 0.00 H new ATOM 0 HA LEU A 116 -2.420 -5.998 5.475 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -0.585 -3.918 6.713 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -0.018 -5.354 5.882 1.00 0.00 H new ATOM 0 HG LEU A 116 -1.660 -3.131 4.633 1.00 0.00 H new ATOM 0 HD11 LEU A 116 0.439 -2.617 3.422 1.00 0.00 H new ATOM 0 HD12 LEU A 116 0.640 -2.448 5.182 1.00 0.00 H new ATOM 0 HD13 LEU A 116 1.276 -3.886 4.348 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -1.151 -4.248 2.499 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -0.355 -5.570 3.385 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -2.102 -5.293 3.581 1.00 0.00 H new ATOM 1771 N GLN A 117 -2.402 -5.753 8.661 1.00 0.00 N ATOM 1772 CA GLN A 117 -2.148 -6.347 9.974 1.00 0.00 C ATOM 1773 C GLN A 117 -2.315 -7.868 9.975 1.00 0.00 C ATOM 1774 O GLN A 117 -1.489 -8.588 10.537 1.00 0.00 O ATOM 1775 CB GLN A 117 -3.094 -5.728 11.001 1.00 0.00 C ATOM 1776 CG GLN A 117 -2.560 -5.756 12.421 1.00 0.00 C ATOM 1777 CD GLN A 117 -1.230 -5.047 12.536 1.00 0.00 C ATOM 1778 OE1 GLN A 117 -0.169 -5.667 12.437 1.00 0.00 O ATOM 1779 NE2 GLN A 117 -1.275 -3.740 12.715 1.00 0.00 N ATOM 0 H GLN A 117 -3.038 -4.956 8.691 1.00 0.00 H new ATOM 0 HA GLN A 117 -1.110 -6.137 10.232 1.00 0.00 H new ATOM 0 HB2 GLN A 117 -3.296 -4.695 10.719 1.00 0.00 H new ATOM 0 HB3 GLN A 117 -4.046 -6.258 10.970 1.00 0.00 H new ATOM 0 HG2 GLN A 117 -3.281 -5.286 13.090 1.00 0.00 H new ATOM 0 HG3 GLN A 117 -2.450 -6.790 12.747 1.00 0.00 H new ATOM 0 HE21 GLN A 117 -2.175 -3.266 12.792 1.00 0.00 H new ATOM 0 HE22 GLN A 117 -0.410 -3.204 12.776 1.00 0.00 H new ATOM 1788 N GLY A 118 -3.371 -8.353 9.339 1.00 0.00 N ATOM 1789 CA GLY A 118 -3.663 -9.776 9.371 1.00 0.00 C ATOM 1790 C GLY A 118 -2.807 -10.593 8.418 1.00 0.00 C ATOM 1791 O GLY A 118 -2.483 -11.746 8.697 1.00 0.00 O ATOM 0 H GLY A 118 -4.031 -7.791 8.802 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -3.517 -10.146 10.386 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -4.714 -9.929 9.124 1.00 0.00 H new ATOM 1795 N VAL A 119 -2.465 -10.011 7.278 1.00 0.00 N ATOM 1796 CA VAL A 119 -1.688 -10.713 6.261 1.00 0.00 C ATOM 1797 C VAL A 119 -0.180 -10.576 6.491 1.00 0.00 C ATOM 1798 O VAL A 119 0.606 -11.362 5.968 1.00 0.00 O ATOM 1799 CB VAL A 119 -2.044 -10.229 4.837 1.00 0.00 C ATOM 1800 CG1 VAL A 119 -3.498 -10.541 4.514 1.00 0.00 C ATOM 1801 CG2 VAL A 119 -1.771 -8.740 4.675 1.00 0.00 C ATOM 0 H VAL A 119 -2.713 -9.053 7.032 1.00 0.00 H new ATOM 0 HA VAL A 119 -1.953 -11.767 6.350 1.00 0.00 H new ATOM 0 HB VAL A 119 -1.407 -10.766 4.134 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -3.730 -10.193 3.507 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -3.661 -11.617 4.572 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -4.146 -10.037 5.231 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -2.032 -8.430 3.663 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -2.372 -8.180 5.392 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -0.714 -8.542 4.854 1.00 0.00 H new ATOM 1811 N SER A 120 0.192 -9.592 7.296 1.00 0.00 N ATOM 1812 CA SER A 120 1.570 -9.104 7.416 1.00 0.00 C ATOM 1813 C SER A 120 2.637 -10.185 7.658 1.00 0.00 C ATOM 1814 O SER A 120 3.819 -9.928 7.408 1.00 0.00 O ATOM 1815 CB SER A 120 1.644 -8.059 8.536 1.00 0.00 C ATOM 1816 OG SER A 120 2.929 -7.465 8.604 1.00 0.00 O ATOM 0 H SER A 120 -0.464 -9.096 7.899 1.00 0.00 H new ATOM 0 HA SER A 120 1.809 -8.676 6.442 1.00 0.00 H new ATOM 0 HB2 SER A 120 0.893 -7.287 8.366 1.00 0.00 H new ATOM 0 HB3 SER A 120 1.408 -8.529 9.491 1.00 0.00 H new ATOM 0 HG SER A 120 3.588 -8.064 8.196 1.00 0.00 H new ATOM 1822 N LYS A 121 2.267 -11.378 8.114 1.00 0.00 N ATOM 1823 CA LYS A 121 3.279 -12.309 8.603 1.00 0.00 C ATOM 1824 C LYS A 121 2.688 -13.693 8.830 1.00 0.00 C ATOM 1825 O LYS A 121 3.169 -14.472 9.652 1.00 0.00 O ATOM 1826 CB LYS A 121 3.904 -11.759 9.894 1.00 0.00 C ATOM 1827 CG LYS A 121 5.224 -12.413 10.275 1.00 0.00 C ATOM 1828 CD LYS A 121 5.935 -11.640 11.374 1.00 0.00 C ATOM 1829 CE LYS A 121 7.212 -12.341 11.810 1.00 0.00 C ATOM 1830 NZ LYS A 121 8.124 -12.615 10.666 1.00 0.00 N ATOM 0 H LYS A 121 1.306 -11.716 8.156 1.00 0.00 H new ATOM 0 HA LYS A 121 4.058 -12.409 7.847 1.00 0.00 H new ATOM 0 HB2 LYS A 121 4.062 -10.687 9.780 1.00 0.00 H new ATOM 0 HB3 LYS A 121 3.196 -11.891 10.712 1.00 0.00 H new ATOM 0 HG2 LYS A 121 5.042 -13.435 10.608 1.00 0.00 H new ATOM 0 HG3 LYS A 121 5.867 -12.474 9.397 1.00 0.00 H new ATOM 0 HD2 LYS A 121 6.172 -10.637 11.020 1.00 0.00 H new ATOM 0 HD3 LYS A 121 5.270 -11.527 12.230 1.00 0.00 H new ATOM 0 HE2 LYS A 121 7.730 -11.725 12.545 1.00 0.00 H new ATOM 0 HE3 LYS A 121 6.959 -13.280 12.303 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 9.045 -12.936 11.026 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 7.711 -13.355 10.062 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 8.253 -11.746 10.109 1.00 0.00 H new ATOM 1844 N PHE A 122 1.650 -13.999 8.078 1.00 0.00 N ATOM 1845 CA PHE A 122 1.079 -15.327 8.088 1.00 0.00 C ATOM 1846 C PHE A 122 1.711 -16.134 6.973 1.00 0.00 C ATOM 1847 O PHE A 122 1.908 -15.610 5.878 1.00 0.00 O ATOM 1848 CB PHE A 122 -0.435 -15.266 7.907 1.00 0.00 C ATOM 1849 CG PHE A 122 -1.206 -15.554 9.157 1.00 0.00 C ATOM 1850 CD1 PHE A 122 -1.386 -14.577 10.118 1.00 0.00 C ATOM 1851 CD2 PHE A 122 -1.756 -16.806 9.366 1.00 0.00 C ATOM 1852 CE1 PHE A 122 -2.103 -14.843 11.268 1.00 0.00 C ATOM 1853 CE2 PHE A 122 -2.474 -17.080 10.510 1.00 0.00 C ATOM 1854 CZ PHE A 122 -2.649 -16.097 11.463 1.00 0.00 C ATOM 0 H PHE A 122 1.185 -13.343 7.451 1.00 0.00 H new ATOM 0 HA PHE A 122 1.279 -15.802 9.049 1.00 0.00 H new ATOM 0 HB2 PHE A 122 -0.708 -14.276 7.543 1.00 0.00 H new ATOM 0 HB3 PHE A 122 -0.728 -15.980 7.138 1.00 0.00 H new ATOM 0 HD1 PHE A 122 -0.962 -13.595 9.968 1.00 0.00 H new ATOM 0 HD2 PHE A 122 -1.621 -17.578 8.623 1.00 0.00 H new ATOM 0 HE1 PHE A 122 -2.237 -14.073 12.013 1.00 0.00 H new ATOM 0 HE2 PHE A 122 -2.899 -18.062 10.660 1.00 0.00 H new ATOM 0 HZ PHE A 122 -3.212 -16.308 12.360 1.00 0.00 H new ATOM 1864 N PRO A 123 2.041 -17.408 7.237 1.00 0.00 N ATOM 1865 CA PRO A 123 2.694 -18.289 6.259 1.00 0.00 C ATOM 1866 C PRO A 123 2.086 -18.194 4.858 1.00 0.00 C ATOM 1867 O PRO A 123 2.796 -18.287 3.852 1.00 0.00 O ATOM 1868 CB PRO A 123 2.463 -19.678 6.849 1.00 0.00 C ATOM 1869 CG PRO A 123 2.427 -19.458 8.320 1.00 0.00 C ATOM 1870 CD PRO A 123 1.818 -18.095 8.528 1.00 0.00 C ATOM 0 HA PRO A 123 3.742 -18.027 6.115 1.00 0.00 H new ATOM 0 HB2 PRO A 123 1.530 -20.111 6.490 1.00 0.00 H new ATOM 0 HB3 PRO A 123 3.262 -20.365 6.570 1.00 0.00 H new ATOM 0 HG2 PRO A 123 1.835 -20.228 8.814 1.00 0.00 H new ATOM 0 HG3 PRO A 123 3.430 -19.505 8.745 1.00 0.00 H new ATOM 0 HD2 PRO A 123 0.757 -18.163 8.767 1.00 0.00 H new ATOM 0 HD3 PRO A 123 2.296 -17.565 9.351 1.00 0.00 H new ATOM 1878 N ALA A 124 0.775 -17.992 4.792 1.00 0.00 N ATOM 1879 CA ALA A 124 0.089 -17.921 3.514 1.00 0.00 C ATOM 1880 C ALA A 124 -0.431 -16.514 3.193 1.00 0.00 C ATOM 1881 O ALA A 124 -1.117 -16.330 2.187 1.00 0.00 O ATOM 1882 CB ALA A 124 -1.058 -18.922 3.481 1.00 0.00 C ATOM 0 H ALA A 124 0.171 -17.875 5.606 1.00 0.00 H new ATOM 0 HA ALA A 124 0.822 -18.170 2.747 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -1.566 -18.861 2.519 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -0.666 -19.929 3.621 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -1.764 -18.693 4.279 1.00 0.00 H new ATOM 1888 N ARG A 125 -0.113 -15.507 4.014 1.00 0.00 N ATOM 1889 CA ARG A 125 -0.641 -14.175 3.765 1.00 0.00 C ATOM 1890 C ARG A 125 0.495 -13.179 3.592 1.00 0.00 C ATOM 1891 O ARG A 125 0.285 -12.047 3.162 1.00 0.00 O ATOM 1892 CB ARG A 125 -1.538 -13.729 4.920 1.00 0.00 C ATOM 1893 CG ARG A 125 -2.623 -14.725 5.299 1.00 0.00 C ATOM 1894 CD ARG A 125 -3.466 -14.193 6.446 1.00 0.00 C ATOM 1895 NE ARG A 125 -4.354 -15.208 7.012 1.00 0.00 N ATOM 1896 CZ ARG A 125 -5.350 -14.927 7.851 1.00 0.00 C ATOM 1897 NH1 ARG A 125 -5.600 -13.670 8.186 1.00 0.00 N ATOM 1898 NH2 ARG A 125 -6.094 -15.895 8.363 1.00 0.00 N ATOM 0 H ARG A 125 0.490 -15.590 4.832 1.00 0.00 H new ATOM 0 HA ARG A 125 -1.231 -14.210 2.849 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -0.915 -13.540 5.794 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -2.009 -12.783 4.653 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -3.259 -14.923 4.436 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -2.169 -15.674 5.585 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -2.809 -13.814 7.229 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -4.062 -13.351 6.094 1.00 0.00 H new ATOM 0 HE ARG A 125 -4.203 -16.182 6.751 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -5.030 -12.917 7.802 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -6.363 -13.455 8.828 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -5.907 -16.867 8.116 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -6.854 -15.669 9.004 1.00 0.00 H new ATOM 1912 N ILE A 126 1.708 -13.632 3.876 1.00 0.00 N ATOM 1913 CA ILE A 126 2.846 -12.736 4.021 1.00 0.00 C ATOM 1914 C ILE A 126 3.350 -12.290 2.661 1.00 0.00 C ATOM 1915 O ILE A 126 3.860 -11.181 2.504 1.00 0.00 O ATOM 1916 CB ILE A 126 3.988 -13.395 4.831 1.00 0.00 C ATOM 1917 CG1 ILE A 126 5.143 -12.408 5.043 1.00 0.00 C ATOM 1918 CG2 ILE A 126 4.479 -14.663 4.144 1.00 0.00 C ATOM 1919 CD1 ILE A 126 6.253 -12.944 5.924 1.00 0.00 C ATOM 0 H ILE A 126 1.929 -14.618 4.011 1.00 0.00 H new ATOM 0 HA ILE A 126 2.508 -11.860 4.575 1.00 0.00 H new ATOM 0 HB ILE A 126 3.594 -13.672 5.809 1.00 0.00 H new ATOM 0 HG12 ILE A 126 5.560 -12.138 4.073 1.00 0.00 H new ATOM 0 HG13 ILE A 126 4.750 -11.493 5.486 1.00 0.00 H new ATOM 0 HG21 ILE A 126 5.282 -15.108 4.732 1.00 0.00 H new ATOM 0 HG22 ILE A 126 3.656 -15.372 4.058 1.00 0.00 H new ATOM 0 HG23 ILE A 126 4.851 -14.417 3.150 1.00 0.00 H new ATOM 0 HD11 ILE A 126 7.033 -12.189 6.027 1.00 0.00 H new ATOM 0 HD12 ILE A 126 5.851 -13.187 6.908 1.00 0.00 H new ATOM 0 HD13 ILE A 126 6.675 -13.842 5.472 1.00 0.00 H new ATOM 1931 N LYS A 127 3.168 -13.143 1.668 1.00 0.00 N ATOM 1932 CA LYS A 127 3.554 -12.801 0.309 1.00 0.00 C ATOM 1933 C LYS A 127 2.555 -11.811 -0.285 1.00 0.00 C ATOM 1934 O LYS A 127 2.869 -11.083 -1.220 1.00 0.00 O ATOM 1935 CB LYS A 127 3.661 -14.053 -0.570 1.00 0.00 C ATOM 1936 CG LYS A 127 5.051 -14.675 -0.613 1.00 0.00 C ATOM 1937 CD LYS A 127 5.417 -15.372 0.688 1.00 0.00 C ATOM 1938 CE LYS A 127 6.802 -15.999 0.601 1.00 0.00 C ATOM 1939 NZ LYS A 127 7.137 -16.798 1.811 1.00 0.00 N ATOM 0 H LYS A 127 2.758 -14.071 1.775 1.00 0.00 H new ATOM 0 HA LYS A 127 4.538 -12.334 0.341 1.00 0.00 H new ATOM 0 HB2 LYS A 127 2.954 -14.799 -0.207 1.00 0.00 H new ATOM 0 HB3 LYS A 127 3.360 -13.796 -1.586 1.00 0.00 H new ATOM 0 HG2 LYS A 127 5.099 -15.393 -1.432 1.00 0.00 H new ATOM 0 HG3 LYS A 127 5.786 -13.899 -0.825 1.00 0.00 H new ATOM 0 HD2 LYS A 127 5.389 -14.655 1.509 1.00 0.00 H new ATOM 0 HD3 LYS A 127 4.679 -16.142 0.912 1.00 0.00 H new ATOM 0 HE2 LYS A 127 6.854 -16.639 -0.280 1.00 0.00 H new ATOM 0 HE3 LYS A 127 7.546 -15.214 0.469 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 8.088 -17.205 1.706 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 7.114 -16.184 2.650 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 6.443 -17.565 1.924 1.00 0.00 H new ATOM 1953 N CYS A 128 1.345 -11.798 0.262 1.00 0.00 N ATOM 1954 CA CYS A 128 0.343 -10.814 -0.130 1.00 0.00 C ATOM 1955 C CYS A 128 0.521 -9.536 0.682 1.00 0.00 C ATOM 1956 O CYS A 128 0.092 -8.456 0.273 1.00 0.00 O ATOM 1957 CB CYS A 128 -1.074 -11.371 0.043 1.00 0.00 C ATOM 1958 SG CYS A 128 -1.526 -12.628 -1.185 1.00 0.00 S ATOM 0 H CYS A 128 1.034 -12.456 0.977 1.00 0.00 H new ATOM 0 HA CYS A 128 0.482 -10.583 -1.186 1.00 0.00 H new ATOM 0 HB2 CYS A 128 -1.165 -11.802 1.040 1.00 0.00 H new ATOM 0 HB3 CYS A 128 -1.787 -10.548 -0.015 1.00 0.00 H new ATOM 0 HG CYS A 128 -2.779 -12.493 -1.503 1.00 0.00 H new ATOM 1964 N ALA A 129 1.157 -9.670 1.838 1.00 0.00 N ATOM 1965 CA ALA A 129 1.497 -8.519 2.655 1.00 0.00 C ATOM 1966 C ALA A 129 2.634 -7.756 2.007 1.00 0.00 C ATOM 1967 O ALA A 129 2.573 -6.535 1.850 1.00 0.00 O ATOM 1968 CB ALA A 129 1.885 -8.952 4.056 1.00 0.00 C ATOM 0 H ALA A 129 1.447 -10.566 2.229 1.00 0.00 H new ATOM 0 HA ALA A 129 0.625 -7.870 2.731 1.00 0.00 H new ATOM 0 HB1 ALA A 129 2.136 -8.074 4.652 1.00 0.00 H new ATOM 0 HB2 ALA A 129 1.050 -9.478 4.519 1.00 0.00 H new ATOM 0 HB3 ALA A 129 2.748 -9.615 4.006 1.00 0.00 H new ATOM 1974 N THR A 130 3.666 -8.490 1.606 1.00 0.00 N ATOM 1975 CA THR A 130 4.783 -7.897 0.901 1.00 0.00 C ATOM 1976 C THR A 130 4.327 -7.372 -0.451 1.00 0.00 C ATOM 1977 O THR A 130 4.857 -6.391 -0.950 1.00 0.00 O ATOM 1978 CB THR A 130 5.940 -8.897 0.717 1.00 0.00 C ATOM 1979 OG1 THR A 130 5.448 -10.134 0.187 1.00 0.00 O ATOM 1980 CG2 THR A 130 6.646 -9.151 2.040 1.00 0.00 C ATOM 0 H THR A 130 3.747 -9.495 1.760 1.00 0.00 H new ATOM 0 HA THR A 130 5.154 -7.070 1.506 1.00 0.00 H new ATOM 0 HB THR A 130 6.654 -8.465 0.015 1.00 0.00 H new ATOM 0 HG1 THR A 130 6.193 -10.760 0.073 1.00 0.00 H new ATOM 0 HG21 THR A 130 7.460 -9.860 1.888 1.00 0.00 H new ATOM 0 HG22 THR A 130 7.048 -8.213 2.423 1.00 0.00 H new ATOM 0 HG23 THR A 130 5.936 -9.562 2.758 1.00 0.00 H new ATOM 1988 N LEU A 131 3.324 -8.031 -1.022 1.00 0.00 N ATOM 1989 CA LEU A 131 2.696 -7.570 -2.253 1.00 0.00 C ATOM 1990 C LEU A 131 2.324 -6.094 -2.139 1.00 0.00 C ATOM 1991 O LEU A 131 2.742 -5.279 -2.956 1.00 0.00 O ATOM 1992 CB LEU A 131 1.458 -8.434 -2.559 1.00 0.00 C ATOM 1993 CG LEU A 131 0.571 -7.976 -3.726 1.00 0.00 C ATOM 1994 CD1 LEU A 131 -0.053 -9.177 -4.416 1.00 0.00 C ATOM 1995 CD2 LEU A 131 -0.533 -7.047 -3.238 1.00 0.00 C ATOM 0 H LEU A 131 2.927 -8.893 -0.647 1.00 0.00 H new ATOM 0 HA LEU A 131 3.401 -7.673 -3.078 1.00 0.00 H new ATOM 0 HB2 LEU A 131 1.794 -9.450 -2.765 1.00 0.00 H new ATOM 0 HB3 LEU A 131 0.843 -8.478 -1.660 1.00 0.00 H new ATOM 0 HG LEU A 131 1.201 -7.436 -4.433 1.00 0.00 H new ATOM 0 HD11 LEU A 131 -0.679 -8.838 -5.241 1.00 0.00 H new ATOM 0 HD12 LEU A 131 0.734 -9.825 -4.801 1.00 0.00 H new ATOM 0 HD13 LEU A 131 -0.662 -9.731 -3.702 1.00 0.00 H new ATOM 0 HD21 LEU A 131 -1.147 -6.737 -4.083 1.00 0.00 H new ATOM 0 HD22 LEU A 131 -1.154 -7.570 -2.511 1.00 0.00 H new ATOM 0 HD23 LEU A 131 -0.089 -6.168 -2.770 1.00 0.00 H new ATOM 2007 N SER A 132 1.583 -5.752 -1.095 1.00 0.00 N ATOM 2008 CA SER A 132 1.099 -4.391 -0.923 1.00 0.00 C ATOM 2009 C SER A 132 2.234 -3.435 -0.549 1.00 0.00 C ATOM 2010 O SER A 132 2.419 -2.406 -1.195 1.00 0.00 O ATOM 2011 CB SER A 132 -0.002 -4.356 0.140 1.00 0.00 C ATOM 2012 OG SER A 132 -1.037 -5.281 -0.166 1.00 0.00 O ATOM 0 H SER A 132 1.304 -6.397 -0.356 1.00 0.00 H new ATOM 0 HA SER A 132 0.687 -4.057 -1.875 1.00 0.00 H new ATOM 0 HB2 SER A 132 0.423 -4.590 1.116 1.00 0.00 H new ATOM 0 HB3 SER A 132 -0.417 -3.350 0.206 1.00 0.00 H new ATOM 0 HG SER A 132 -0.707 -6.195 -0.040 1.00 0.00 H new ATOM 2018 N TRP A 133 3.014 -3.794 0.471 1.00 0.00 N ATOM 2019 CA TRP A 133 4.042 -2.896 0.999 1.00 0.00 C ATOM 2020 C TRP A 133 5.173 -2.678 -0.009 1.00 0.00 C ATOM 2021 O TRP A 133 5.659 -1.561 -0.183 1.00 0.00 O ATOM 2022 CB TRP A 133 4.606 -3.445 2.313 1.00 0.00 C ATOM 2023 CG TRP A 133 5.461 -2.454 3.045 1.00 0.00 C ATOM 2024 CD1 TRP A 133 5.028 -1.361 3.736 1.00 0.00 C ATOM 2025 CD2 TRP A 133 6.889 -2.460 3.162 1.00 0.00 C ATOM 2026 NE1 TRP A 133 6.096 -0.682 4.268 1.00 0.00 N ATOM 2027 CE2 TRP A 133 7.249 -1.338 3.931 1.00 0.00 C ATOM 2028 CE3 TRP A 133 7.897 -3.304 2.689 1.00 0.00 C ATOM 2029 CZ2 TRP A 133 8.575 -1.040 4.241 1.00 0.00 C ATOM 2030 CZ3 TRP A 133 9.212 -3.005 2.997 1.00 0.00 C ATOM 2031 CH2 TRP A 133 9.540 -1.884 3.765 1.00 0.00 C ATOM 0 H TRP A 133 2.955 -4.695 0.946 1.00 0.00 H new ATOM 0 HA TRP A 133 3.571 -1.931 1.187 1.00 0.00 H new ATOM 0 HB2 TRP A 133 3.781 -3.749 2.957 1.00 0.00 H new ATOM 0 HB3 TRP A 133 5.194 -4.339 2.104 1.00 0.00 H new ATOM 0 HD1 TRP A 133 3.994 -1.071 3.849 1.00 0.00 H new ATOM 0 HE1 TRP A 133 6.039 0.172 4.823 1.00 0.00 H new ATOM 0 HE3 TRP A 133 7.654 -4.173 2.095 1.00 0.00 H new ATOM 0 HZ2 TRP A 133 8.831 -0.175 4.835 1.00 0.00 H new ATOM 0 HZ3 TRP A 133 10.000 -3.650 2.637 1.00 0.00 H new ATOM 0 HH2 TRP A 133 10.577 -1.680 3.987 1.00 0.00 H new ATOM 2042 N LYS A 134 5.589 -3.747 -0.678 1.00 0.00 N ATOM 2043 CA LYS A 134 6.662 -3.658 -1.663 1.00 0.00 C ATOM 2044 C LYS A 134 6.176 -2.974 -2.935 1.00 0.00 C ATOM 2045 O LYS A 134 6.976 -2.534 -3.757 1.00 0.00 O ATOM 2046 CB LYS A 134 7.235 -5.042 -1.983 1.00 0.00 C ATOM 2047 CG LYS A 134 7.962 -5.687 -0.812 1.00 0.00 C ATOM 2048 CD LYS A 134 9.274 -4.983 -0.510 1.00 0.00 C ATOM 2049 CE LYS A 134 9.950 -5.563 0.722 1.00 0.00 C ATOM 2050 NZ LYS A 134 11.323 -5.028 0.907 1.00 0.00 N ATOM 0 H LYS A 134 5.202 -4.683 -0.558 1.00 0.00 H new ATOM 0 HA LYS A 134 7.459 -3.053 -1.231 1.00 0.00 H new ATOM 0 HB2 LYS A 134 6.424 -5.697 -2.301 1.00 0.00 H new ATOM 0 HB3 LYS A 134 7.923 -4.955 -2.824 1.00 0.00 H new ATOM 0 HG2 LYS A 134 7.324 -5.662 0.071 1.00 0.00 H new ATOM 0 HG3 LYS A 134 8.155 -6.736 -1.036 1.00 0.00 H new ATOM 0 HD2 LYS A 134 9.941 -5.072 -1.367 1.00 0.00 H new ATOM 0 HD3 LYS A 134 9.090 -3.919 -0.358 1.00 0.00 H new ATOM 0 HE2 LYS A 134 9.351 -5.337 1.604 1.00 0.00 H new ATOM 0 HE3 LYS A 134 9.993 -6.649 0.635 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 11.748 -5.449 1.758 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 11.903 -5.265 0.077 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 11.281 -3.995 1.016 1.00 0.00 H new ATOM 2064 N ALA A 135 4.868 -2.905 -3.110 1.00 0.00 N ATOM 2065 CA ALA A 135 4.311 -2.216 -4.258 1.00 0.00 C ATOM 2066 C ALA A 135 4.158 -0.737 -3.957 1.00 0.00 C ATOM 2067 O ALA A 135 4.525 0.112 -4.767 1.00 0.00 O ATOM 2068 CB ALA A 135 2.975 -2.814 -4.660 1.00 0.00 C ATOM 0 H ALA A 135 4.179 -3.313 -2.479 1.00 0.00 H new ATOM 0 HA ALA A 135 4.999 -2.338 -5.094 1.00 0.00 H new ATOM 0 HB1 ALA A 135 2.581 -2.277 -5.523 1.00 0.00 H new ATOM 0 HB2 ALA A 135 3.109 -3.865 -4.916 1.00 0.00 H new ATOM 0 HB3 ALA A 135 2.274 -2.730 -3.830 1.00 0.00 H new ATOM 2074 N LEU A 136 3.641 -0.436 -2.770 1.00 0.00 N ATOM 2075 CA LEU A 136 3.298 0.929 -2.416 1.00 0.00 C ATOM 2076 C LEU A 136 4.515 1.680 -1.894 1.00 0.00 C ATOM 2077 O LEU A 136 4.987 2.635 -2.516 1.00 0.00 O ATOM 2078 CB LEU A 136 2.197 0.930 -1.356 1.00 0.00 C ATOM 2079 CG LEU A 136 1.153 2.037 -1.504 1.00 0.00 C ATOM 2080 CD1 LEU A 136 0.188 1.703 -2.632 1.00 0.00 C ATOM 2081 CD2 LEU A 136 0.402 2.238 -0.203 1.00 0.00 C ATOM 0 H LEU A 136 3.452 -1.122 -2.039 1.00 0.00 H new ATOM 0 HA LEU A 136 2.941 1.435 -3.313 1.00 0.00 H new ATOM 0 HB2 LEU A 136 1.688 -0.034 -1.383 1.00 0.00 H new ATOM 0 HB3 LEU A 136 2.661 1.019 -0.373 1.00 0.00 H new ATOM 0 HG LEU A 136 1.666 2.967 -1.749 1.00 0.00 H new ATOM 0 HD11 LEU A 136 -0.550 2.499 -2.727 1.00 0.00 H new ATOM 0 HD12 LEU A 136 0.740 1.607 -3.567 1.00 0.00 H new ATOM 0 HD13 LEU A 136 -0.318 0.763 -2.411 1.00 0.00 H new ATOM 0 HD21 LEU A 136 -0.337 3.030 -0.328 1.00 0.00 H new ATOM 0 HD22 LEU A 136 -0.102 1.312 0.073 1.00 0.00 H new ATOM 0 HD23 LEU A 136 1.104 2.517 0.583 1.00 0.00 H new ATOM 2093 N GLU A 137 5.046 1.210 -0.774 1.00 0.00 N ATOM 2094 CA GLU A 137 6.116 1.920 -0.080 1.00 0.00 C ATOM 2095 C GLU A 137 7.443 1.750 -0.803 1.00 0.00 C ATOM 2096 O GLU A 137 8.289 2.640 -0.787 1.00 0.00 O ATOM 2097 CB GLU A 137 6.238 1.445 1.373 1.00 0.00 C ATOM 2098 CG GLU A 137 5.234 2.085 2.327 1.00 0.00 C ATOM 2099 CD GLU A 137 3.793 1.881 1.900 1.00 0.00 C ATOM 2100 OE1 GLU A 137 3.317 0.730 1.955 1.00 0.00 O ATOM 2101 OE2 GLU A 137 3.146 2.869 1.499 1.00 0.00 O ATOM 0 H GLU A 137 4.755 0.341 -0.325 1.00 0.00 H new ATOM 0 HA GLU A 137 5.860 2.980 -0.076 1.00 0.00 H new ATOM 0 HB2 GLU A 137 6.110 0.363 1.402 1.00 0.00 H new ATOM 0 HB3 GLU A 137 7.246 1.657 1.729 1.00 0.00 H new ATOM 0 HG2 GLU A 137 5.373 1.668 3.325 1.00 0.00 H new ATOM 0 HG3 GLU A 137 5.438 3.153 2.396 1.00 0.00 H new ATOM 2108 N LYS A 138 7.616 0.613 -1.457 1.00 0.00 N ATOM 2109 CA LYS A 138 8.842 0.357 -2.200 1.00 0.00 C ATOM 2110 C LYS A 138 8.729 0.959 -3.599 1.00 0.00 C ATOM 2111 O LYS A 138 9.685 0.956 -4.378 1.00 0.00 O ATOM 2112 CB LYS A 138 9.113 -1.148 -2.279 1.00 0.00 C ATOM 2113 CG LYS A 138 10.453 -1.511 -2.900 1.00 0.00 C ATOM 2114 CD LYS A 138 10.529 -2.993 -3.232 1.00 0.00 C ATOM 2115 CE LYS A 138 11.902 -3.384 -3.761 1.00 0.00 C ATOM 2116 NZ LYS A 138 12.312 -2.556 -4.928 1.00 0.00 N ATOM 0 H LYS A 138 6.931 -0.142 -1.490 1.00 0.00 H new ATOM 0 HA LYS A 138 9.679 0.825 -1.682 1.00 0.00 H new ATOM 0 HB2 LYS A 138 9.066 -1.567 -1.274 1.00 0.00 H new ATOM 0 HB3 LYS A 138 8.318 -1.619 -2.858 1.00 0.00 H new ATOM 0 HG2 LYS A 138 10.606 -0.925 -3.807 1.00 0.00 H new ATOM 0 HG3 LYS A 138 11.257 -1.249 -2.212 1.00 0.00 H new ATOM 0 HD2 LYS A 138 10.303 -3.577 -2.340 1.00 0.00 H new ATOM 0 HD3 LYS A 138 9.770 -3.239 -3.975 1.00 0.00 H new ATOM 0 HE2 LYS A 138 12.640 -3.278 -2.965 1.00 0.00 H new ATOM 0 HE3 LYS A 138 11.893 -4.435 -4.049 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 13.157 -2.972 -5.369 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 11.538 -2.527 -5.622 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 12.528 -1.590 -4.609 1.00 0.00 H new ATOM 2130 N GLY A 139 7.555 1.498 -3.899 1.00 0.00 N ATOM 2131 CA GLY A 139 7.314 2.080 -5.198 1.00 0.00 C ATOM 2132 C GLY A 139 8.023 3.403 -5.350 1.00 0.00 C ATOM 2133 O GLY A 139 8.741 3.628 -6.327 1.00 0.00 O ATOM 0 H GLY A 139 6.762 1.541 -3.259 1.00 0.00 H new ATOM 0 HA2 GLY A 139 7.652 1.393 -5.974 1.00 0.00 H new ATOM 0 HA3 GLY A 139 6.243 2.221 -5.342 1.00 0.00 H new ATOM 2137 N VAL A 140 7.829 4.276 -4.374 1.00 0.00 N ATOM 2138 CA VAL A 140 8.507 5.557 -4.362 1.00 0.00 C ATOM 2139 C VAL A 140 9.968 5.386 -3.942 1.00 0.00 C ATOM 2140 O VAL A 140 10.875 5.730 -4.701 1.00 0.00 O ATOM 2141 CB VAL A 140 7.789 6.578 -3.442 1.00 0.00 C ATOM 2142 CG1 VAL A 140 6.489 7.048 -4.082 1.00 0.00 C ATOM 2143 CG2 VAL A 140 7.501 5.981 -2.068 1.00 0.00 C ATOM 0 H VAL A 140 7.207 4.118 -3.581 1.00 0.00 H new ATOM 0 HA VAL A 140 8.478 5.955 -5.376 1.00 0.00 H new ATOM 0 HB VAL A 140 8.455 7.431 -3.312 1.00 0.00 H new ATOM 0 HG11 VAL A 140 5.997 7.764 -3.424 1.00 0.00 H new ATOM 0 HG12 VAL A 140 6.706 7.524 -5.038 1.00 0.00 H new ATOM 0 HG13 VAL A 140 5.833 6.193 -4.243 1.00 0.00 H new ATOM 0 HG21 VAL A 140 6.997 6.722 -1.448 1.00 0.00 H new ATOM 0 HG22 VAL A 140 6.861 5.105 -2.179 1.00 0.00 H new ATOM 0 HG23 VAL A 140 8.438 5.688 -1.595 1.00 0.00 H new ATOM 2153 N ALA A 141 10.171 4.807 -2.757 1.00 0.00 N ATOM 2154 CA ALA A 141 11.498 4.578 -2.181 1.00 0.00 C ATOM 2155 C ALA A 141 11.342 4.143 -0.732 1.00 0.00 C ATOM 2156 O ALA A 141 10.364 4.501 -0.078 1.00 0.00 O ATOM 2157 CB ALA A 141 12.380 5.822 -2.261 1.00 0.00 C ATOM 0 H ALA A 141 9.409 4.480 -2.163 1.00 0.00 H new ATOM 0 HA ALA A 141 11.990 3.796 -2.760 1.00 0.00 H new ATOM 0 HB1 ALA A 141 13.354 5.606 -1.822 1.00 0.00 H new ATOM 0 HB2 ALA A 141 12.508 6.111 -3.304 1.00 0.00 H new ATOM 0 HB3 ALA A 141 11.908 6.638 -1.714 1.00 0.00 H new ATOM 2163 N LYS A 142 12.296 3.378 -0.230 1.00 0.00 N ATOM 2164 CA LYS A 142 12.195 2.836 1.118 1.00 0.00 C ATOM 2165 C LYS A 142 12.945 3.710 2.121 1.00 0.00 C ATOM 2166 O LYS A 142 14.113 4.045 1.904 1.00 0.00 O ATOM 2167 CB LYS A 142 12.742 1.404 1.163 1.00 0.00 C ATOM 2168 CG LYS A 142 14.230 1.302 0.848 1.00 0.00 C ATOM 2169 CD LYS A 142 14.757 -0.102 1.071 1.00 0.00 C ATOM 2170 CE LYS A 142 16.277 -0.140 1.047 1.00 0.00 C ATOM 2171 NZ LYS A 142 16.842 0.195 -0.286 1.00 0.00 N ATOM 0 H LYS A 142 13.146 3.118 -0.731 1.00 0.00 H new ATOM 0 HA LYS A 142 11.140 2.824 1.393 1.00 0.00 H new ATOM 0 HB2 LYS A 142 12.561 0.987 2.154 1.00 0.00 H new ATOM 0 HB3 LYS A 142 12.187 0.791 0.453 1.00 0.00 H new ATOM 0 HG2 LYS A 142 14.403 1.595 -0.187 1.00 0.00 H new ATOM 0 HG3 LYS A 142 14.783 2.002 1.474 1.00 0.00 H new ATOM 0 HD2 LYS A 142 14.398 -0.478 2.029 1.00 0.00 H new ATOM 0 HD3 LYS A 142 14.364 -0.765 0.301 1.00 0.00 H new ATOM 0 HE2 LYS A 142 16.665 0.560 1.787 1.00 0.00 H new ATOM 0 HE3 LYS A 142 16.615 -1.134 1.340 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 17.880 0.153 -0.243 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 16.497 -0.487 -0.991 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 16.545 1.154 -0.558 1.00 0.00 H new ATOM 2185 N GLU A 143 12.253 4.098 3.200 1.00 0.00 N ATOM 2186 CA GLU A 143 12.872 4.793 4.334 1.00 0.00 C ATOM 2187 C GLU A 143 13.346 6.195 3.945 1.00 0.00 C ATOM 2188 O GLU A 143 12.712 7.191 4.292 1.00 0.00 O ATOM 2189 CB GLU A 143 14.039 3.963 4.889 1.00 0.00 C ATOM 2190 CG GLU A 143 14.652 4.521 6.162 1.00 0.00 C ATOM 2191 CD GLU A 143 15.859 3.725 6.616 1.00 0.00 C ATOM 2192 OE1 GLU A 143 15.677 2.725 7.340 1.00 0.00 O ATOM 2193 OE2 GLU A 143 16.993 4.096 6.249 1.00 0.00 O ATOM 0 H GLU A 143 11.252 3.939 3.311 1.00 0.00 H new ATOM 0 HA GLU A 143 12.116 4.907 5.111 1.00 0.00 H new ATOM 0 HB2 GLU A 143 13.689 2.949 5.082 1.00 0.00 H new ATOM 0 HB3 GLU A 143 14.815 3.893 4.126 1.00 0.00 H new ATOM 0 HG2 GLU A 143 14.944 5.558 5.998 1.00 0.00 H new ATOM 0 HG3 GLU A 143 13.902 4.523 6.953 1.00 0.00 H new ATOM 2200 N GLU A 144 14.461 6.261 3.233 1.00 0.00 N ATOM 2201 CA GLU A 144 15.000 7.512 2.732 1.00 0.00 C ATOM 2202 C GLU A 144 16.167 7.205 1.808 1.00 0.00 C ATOM 2203 O GLU A 144 17.294 6.990 2.262 1.00 0.00 O ATOM 2204 CB GLU A 144 15.459 8.420 3.875 1.00 0.00 C ATOM 2205 CG GLU A 144 15.631 9.872 3.458 1.00 0.00 C ATOM 2206 CD GLU A 144 16.158 10.746 4.578 1.00 0.00 C ATOM 2207 OE1 GLU A 144 15.619 10.683 5.699 1.00 0.00 O ATOM 2208 OE2 GLU A 144 17.131 11.494 4.342 1.00 0.00 O ATOM 0 H GLU A 144 15.018 5.443 2.986 1.00 0.00 H new ATOM 0 HA GLU A 144 14.217 8.041 2.188 1.00 0.00 H new ATOM 0 HB2 GLU A 144 14.733 8.366 4.686 1.00 0.00 H new ATOM 0 HB3 GLU A 144 16.405 8.048 4.268 1.00 0.00 H new ATOM 0 HG2 GLU A 144 16.315 9.923 2.611 1.00 0.00 H new ATOM 0 HG3 GLU A 144 14.672 10.264 3.118 1.00 0.00 H new