USER MOD reduce.3.24.130724 H: found=0, std=0, add=1021, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 1024 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 Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 MET CE :methyl 170:sc= -0.0243 (180deg=-0.249) USER MOD Single : A 10 SER OG : rot 180:sc= 0.0167 USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 ASN : amide:sc= -0.589 K(o=-0.59,f=-4.9!) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 TYR OH : rot 163:sc= -2.1 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 33 THR OG1 : rot -7:sc= 0.363 USER MOD Single : A 35 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 36 LYS NZ :NH3+ 151:sc= 0 (180deg=-0.728) USER MOD Single : A 39 TYR OH : rot 15:sc= 0.909 USER MOD Single : A 40 LYS NZ :NH3+ -131:sc= -0.253 (180deg=-1.06) USER MOD Single : A 42 TYR OH : rot -72:sc= 0.659 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0437) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 SER OG : rot 104:sc= -0.555 USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 TYR OH : rot 180:sc= -2.6 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 GLN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 79 TYR OH : rot -87:sc= 1.21 USER MOD Single : A 84 MET CE :methyl -147:sc= -1.32 (180deg=-3.62!) USER MOD Single : A 97 ASN : amide:sc= -6.22! C(o=-6.2!,f=-9.5!) USER MOD Single : A 100 TYR OH : rot -132:sc= 0.387 USER MOD Single : A 101 ASN : amide:sc= -1.62 K(o=-1.6,f=-3.6!) USER MOD Single : A 106 SER OG : rot 180:sc= 0.0319 USER MOD Single : A 111 THR OG1 : rot 88:sc= 1.12 USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 GLN : amide:sc= 0.261 X(o=0.26,f=-0.11) USER MOD Single : A 119 GLN : amide:sc= -0.044 X(o=-0.044,f=-0.076) USER MOD Single : A 121 SER OG : rot 27:sc= 0.929 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 ASN : amide:sc=-0.00396 X(o=-0.004,f=-0.23) USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 8 7.786 -10.058 -25.164 1.00 0.00 N ATOM 2 CA LYS A 8 7.657 -9.866 -23.696 1.00 0.00 C ATOM 3 C LYS A 8 6.399 -9.075 -23.351 1.00 0.00 C ATOM 4 O LYS A 8 6.377 -7.849 -23.458 1.00 0.00 O ATOM 5 CB LYS A 8 8.902 -9.132 -23.189 1.00 0.00 C ATOM 6 CG LYS A 8 9.830 -10.007 -22.363 1.00 0.00 C ATOM 7 CD LYS A 8 11.223 -9.407 -22.269 1.00 0.00 C ATOM 8 CE LYS A 8 11.242 -8.178 -21.374 1.00 0.00 C ATOM 9 NZ LYS A 8 12.478 -8.113 -20.545 1.00 0.00 N ATOM 0 HA LYS A 8 7.573 -10.840 -23.213 1.00 0.00 H new ATOM 0 HB2 LYS A 8 9.453 -8.737 -24.042 1.00 0.00 H new ATOM 0 HB3 LYS A 8 8.590 -8.278 -22.587 1.00 0.00 H new ATOM 0 HG2 LYS A 8 9.418 -10.132 -21.362 1.00 0.00 H new ATOM 0 HG3 LYS A 8 9.889 -11.000 -22.810 1.00 0.00 H new ATOM 0 HD2 LYS A 8 11.916 -10.153 -21.879 1.00 0.00 H new ATOM 0 HD3 LYS A 8 11.572 -9.138 -23.266 1.00 0.00 H new ATOM 0 HE2 LYS A 8 11.169 -7.281 -21.988 1.00 0.00 H new ATOM 0 HE3 LYS A 8 10.368 -8.190 -20.723 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 12.452 -7.261 -19.949 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 12.535 -8.957 -19.940 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 13.311 -8.076 -21.166 1.00 0.00 H new ATOM 25 N MET A 9 5.354 -9.785 -22.939 1.00 0.00 N ATOM 26 CA MET A 9 4.093 -9.149 -22.579 1.00 0.00 C ATOM 27 C MET A 9 4.051 -8.828 -21.088 1.00 0.00 C ATOM 28 O MET A 9 4.013 -9.729 -20.250 1.00 0.00 O ATOM 29 CB MET A 9 2.917 -10.055 -22.951 1.00 0.00 C ATOM 30 CG MET A 9 2.978 -10.576 -24.377 1.00 0.00 C ATOM 31 SD MET A 9 1.882 -11.981 -24.651 1.00 0.00 S ATOM 32 CE MET A 9 0.305 -11.278 -24.175 1.00 0.00 C ATOM 0 H MET A 9 5.356 -10.801 -22.846 1.00 0.00 H new ATOM 0 HA MET A 9 4.014 -8.215 -23.135 1.00 0.00 H new ATOM 0 HB2 MET A 9 2.890 -10.901 -22.265 1.00 0.00 H new ATOM 0 HB3 MET A 9 1.987 -9.504 -22.814 1.00 0.00 H new ATOM 0 HG2 MET A 9 2.712 -9.773 -25.065 1.00 0.00 H new ATOM 0 HG3 MET A 9 4.002 -10.868 -24.609 1.00 0.00 H new ATOM 0 HE1 MET A 9 -0.497 -11.961 -24.455 1.00 0.00 H new ATOM 0 HE2 MET A 9 0.288 -11.120 -23.097 1.00 0.00 H new ATOM 0 HE3 MET A 9 0.163 -10.324 -24.684 1.00 0.00 H new ATOM 42 N SER A 10 4.059 -7.539 -20.765 1.00 0.00 N ATOM 43 CA SER A 10 4.023 -7.099 -19.376 1.00 0.00 C ATOM 44 C SER A 10 2.629 -7.280 -18.783 1.00 0.00 C ATOM 45 O SER A 10 1.632 -7.275 -19.504 1.00 0.00 O ATOM 46 CB SER A 10 4.449 -5.633 -19.271 1.00 0.00 C ATOM 47 OG SER A 10 5.368 -5.295 -20.296 1.00 0.00 O ATOM 0 H SER A 10 4.090 -6.781 -21.447 1.00 0.00 H new ATOM 0 HA SER A 10 4.722 -7.714 -18.809 1.00 0.00 H new ATOM 0 HB2 SER A 10 3.571 -4.990 -19.338 1.00 0.00 H new ATOM 0 HB3 SER A 10 4.903 -5.452 -18.297 1.00 0.00 H new ATOM 0 HG SER A 10 5.624 -4.353 -20.208 1.00 0.00 H new ATOM 53 N GLU A 11 2.568 -7.440 -17.465 1.00 0.00 N ATOM 54 CA GLU A 11 1.297 -7.622 -16.776 1.00 0.00 C ATOM 55 C GLU A 11 1.232 -6.764 -15.515 1.00 0.00 C ATOM 56 O GLU A 11 2.258 -6.304 -15.013 1.00 0.00 O ATOM 57 CB GLU A 11 1.093 -9.095 -16.416 1.00 0.00 C ATOM 58 CG GLU A 11 0.719 -9.965 -17.605 1.00 0.00 C ATOM 59 CD GLU A 11 -0.614 -9.576 -18.214 1.00 0.00 C ATOM 60 OE1 GLU A 11 -0.634 -8.657 -19.060 1.00 0.00 O ATOM 61 OE2 GLU A 11 -1.637 -10.189 -17.844 1.00 0.00 O ATOM 0 H GLU A 11 3.384 -7.447 -16.853 1.00 0.00 H new ATOM 0 HA GLU A 11 0.500 -7.306 -17.449 1.00 0.00 H new ATOM 0 HB2 GLU A 11 2.008 -9.481 -15.967 1.00 0.00 H new ATOM 0 HB3 GLU A 11 0.311 -9.171 -15.660 1.00 0.00 H new ATOM 0 HG2 GLU A 11 1.497 -9.890 -18.365 1.00 0.00 H new ATOM 0 HG3 GLU A 11 0.680 -11.008 -17.290 1.00 0.00 H new ATOM 68 N LYS A 12 0.021 -6.553 -15.011 1.00 0.00 N ATOM 69 CA LYS A 12 -0.178 -5.750 -13.810 1.00 0.00 C ATOM 70 C LYS A 12 -1.313 -6.312 -12.960 1.00 0.00 C ATOM 71 O LYS A 12 -2.286 -6.852 -13.486 1.00 0.00 O ATOM 72 CB LYS A 12 -0.478 -4.298 -14.187 1.00 0.00 C ATOM 73 CG LYS A 12 0.756 -3.505 -14.584 1.00 0.00 C ATOM 74 CD LYS A 12 1.302 -2.702 -13.415 1.00 0.00 C ATOM 75 CE LYS A 12 2.202 -1.571 -13.887 1.00 0.00 C ATOM 76 NZ LYS A 12 2.816 -0.837 -12.747 1.00 0.00 N ATOM 0 H LYS A 12 -0.838 -6.927 -15.415 1.00 0.00 H new ATOM 0 HA LYS A 12 0.741 -5.784 -13.224 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -1.189 -4.285 -15.013 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -0.961 -3.805 -13.343 1.00 0.00 H new ATOM 0 HG2 LYS A 12 1.525 -4.185 -14.950 1.00 0.00 H new ATOM 0 HG3 LYS A 12 0.509 -2.832 -15.405 1.00 0.00 H new ATOM 0 HD2 LYS A 12 0.475 -2.292 -12.836 1.00 0.00 H new ATOM 0 HD3 LYS A 12 1.861 -3.360 -12.750 1.00 0.00 H new ATOM 0 HE2 LYS A 12 2.989 -1.975 -14.524 1.00 0.00 H new ATOM 0 HE3 LYS A 12 1.623 -0.877 -14.496 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 3.422 -0.074 -13.111 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 2.066 -0.430 -12.152 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 3.389 -1.494 -12.180 1.00 0.00 H new ATOM 90 N LEU A 13 -1.184 -6.180 -11.643 1.00 0.00 N ATOM 91 CA LEU A 13 -2.201 -6.674 -10.723 1.00 0.00 C ATOM 92 C LEU A 13 -3.408 -5.742 -10.699 1.00 0.00 C ATOM 93 O LEU A 13 -3.265 -4.524 -10.804 1.00 0.00 O ATOM 94 CB LEU A 13 -1.619 -6.816 -9.315 1.00 0.00 C ATOM 95 CG LEU A 13 -2.529 -7.514 -8.304 1.00 0.00 C ATOM 96 CD1 LEU A 13 -2.602 -9.006 -8.593 1.00 0.00 C ATOM 97 CD2 LEU A 13 -2.039 -7.266 -6.883 1.00 0.00 C ATOM 0 H LEU A 13 -0.386 -5.735 -11.190 1.00 0.00 H new ATOM 0 HA LEU A 13 -2.529 -7.654 -11.071 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -0.682 -7.370 -9.380 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -1.377 -5.823 -8.937 1.00 0.00 H new ATOM 0 HG LEU A 13 -3.532 -7.097 -8.398 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -3.254 -9.486 -7.864 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -3.001 -9.163 -9.595 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -1.604 -9.439 -8.528 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -2.699 -7.770 -6.177 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -1.026 -7.655 -6.774 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -2.040 -6.195 -6.679 1.00 0.00 H new ATOM 109 N ARG A 14 -4.597 -6.320 -10.564 1.00 0.00 N ATOM 110 CA ARG A 14 -5.826 -5.537 -10.530 1.00 0.00 C ATOM 111 C ARG A 14 -5.999 -4.848 -9.180 1.00 0.00 C ATOM 112 O ARG A 14 -6.379 -5.478 -8.194 1.00 0.00 O ATOM 113 CB ARG A 14 -7.036 -6.428 -10.816 1.00 0.00 C ATOM 114 CG ARG A 14 -6.852 -7.340 -12.017 1.00 0.00 C ATOM 115 CD ARG A 14 -8.101 -8.167 -12.280 1.00 0.00 C ATOM 116 NE ARG A 14 -9.189 -7.355 -12.822 1.00 0.00 N ATOM 117 CZ ARG A 14 -10.478 -7.676 -12.724 1.00 0.00 C ATOM 118 NH1 ARG A 14 -10.847 -8.794 -12.108 1.00 0.00 N ATOM 119 NH2 ARG A 14 -11.400 -6.879 -13.242 1.00 0.00 N ATOM 0 H ARG A 14 -4.735 -7.327 -10.476 1.00 0.00 H new ATOM 0 HA ARG A 14 -5.756 -4.772 -11.303 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -7.243 -7.037 -9.936 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -7.910 -5.797 -10.980 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -6.617 -6.742 -12.898 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -6.004 -8.003 -11.846 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -7.864 -8.970 -12.979 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -8.427 -8.638 -11.352 1.00 0.00 H new ATOM 0 HE ARG A 14 -8.946 -6.490 -13.305 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -10.142 -9.412 -11.707 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -11.836 -9.034 -12.036 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -11.123 -6.019 -13.716 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -12.387 -7.125 -13.167 1.00 0.00 H new ATOM 133 N ILE A 15 -5.718 -3.551 -9.145 1.00 0.00 N ATOM 134 CA ILE A 15 -5.844 -2.775 -7.921 1.00 0.00 C ATOM 135 C ILE A 15 -6.479 -1.417 -8.201 1.00 0.00 C ATOM 136 O ILE A 15 -5.883 -0.565 -8.861 1.00 0.00 O ATOM 137 CB ILE A 15 -4.471 -2.566 -7.257 1.00 0.00 C ATOM 138 CG1 ILE A 15 -3.754 -3.907 -7.091 1.00 0.00 C ATOM 139 CG2 ILE A 15 -4.627 -1.871 -5.912 1.00 0.00 C ATOM 140 CD1 ILE A 15 -2.369 -3.784 -6.497 1.00 0.00 C ATOM 0 H ILE A 15 -5.401 -3.015 -9.953 1.00 0.00 H new ATOM 0 HA ILE A 15 -6.486 -3.338 -7.243 1.00 0.00 H new ATOM 0 HB ILE A 15 -3.867 -1.927 -7.902 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -4.357 -4.555 -6.455 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -3.681 -4.393 -8.064 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -3.646 -1.732 -5.458 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -5.100 -0.900 -6.057 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -5.247 -2.482 -5.256 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -1.922 -4.774 -6.409 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -1.750 -3.162 -7.144 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -2.436 -3.327 -5.510 1.00 0.00 H new ATOM 152 N LYS A 16 -7.691 -1.220 -7.694 1.00 0.00 N ATOM 153 CA LYS A 16 -8.408 0.034 -7.890 1.00 0.00 C ATOM 154 C LYS A 16 -8.984 0.537 -6.573 1.00 0.00 C ATOM 155 O LYS A 16 -9.927 -0.043 -6.034 1.00 0.00 O ATOM 156 CB LYS A 16 -9.529 -0.146 -8.916 1.00 0.00 C ATOM 157 CG LYS A 16 -9.030 -0.508 -10.306 1.00 0.00 C ATOM 158 CD LYS A 16 -10.164 -0.990 -11.196 1.00 0.00 C ATOM 159 CE LYS A 16 -9.794 -0.899 -12.667 1.00 0.00 C ATOM 160 NZ LYS A 16 -10.011 0.469 -13.211 1.00 0.00 N ATOM 0 H LYS A 16 -8.198 -1.913 -7.144 1.00 0.00 H new ATOM 0 HA LYS A 16 -7.701 0.774 -8.266 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -10.207 -0.925 -8.568 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -10.107 0.776 -8.975 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -8.553 0.361 -10.760 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -8.270 -1.286 -10.230 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -10.412 -2.021 -10.945 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -11.056 -0.393 -11.006 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -8.749 -1.179 -12.796 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -10.388 -1.614 -13.236 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -9.747 0.489 -14.217 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -11.013 0.727 -13.111 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -9.425 1.149 -12.686 1.00 0.00 H new ATOM 174 N VAL A 17 -8.408 1.616 -6.056 1.00 0.00 N ATOM 175 CA VAL A 17 -8.864 2.193 -4.795 1.00 0.00 C ATOM 176 C VAL A 17 -9.818 3.356 -5.037 1.00 0.00 C ATOM 177 O VAL A 17 -9.408 4.426 -5.490 1.00 0.00 O ATOM 178 CB VAL A 17 -7.685 2.682 -3.928 1.00 0.00 C ATOM 179 CG1 VAL A 17 -8.024 2.542 -2.454 1.00 0.00 C ATOM 180 CG2 VAL A 17 -6.409 1.918 -4.257 1.00 0.00 C ATOM 0 H VAL A 17 -7.626 2.109 -6.488 1.00 0.00 H new ATOM 0 HA VAL A 17 -9.386 1.399 -4.261 1.00 0.00 H new ATOM 0 HB VAL A 17 -7.512 3.735 -4.151 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -7.184 2.890 -1.853 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -8.906 3.140 -2.225 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -8.225 1.496 -2.225 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -5.595 2.283 -3.631 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -6.562 0.855 -4.069 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -6.155 2.068 -5.306 1.00 0.00 H new ATOM 190 N ASP A 18 -11.093 3.142 -4.729 1.00 0.00 N ATOM 191 CA ASP A 18 -12.108 4.173 -4.910 1.00 0.00 C ATOM 192 C ASP A 18 -13.020 4.262 -3.688 1.00 0.00 C ATOM 193 O ASP A 18 -14.166 4.699 -3.790 1.00 0.00 O ATOM 194 CB ASP A 18 -12.939 3.885 -6.162 1.00 0.00 C ATOM 195 CG ASP A 18 -12.426 4.628 -7.381 1.00 0.00 C ATOM 196 OD1 ASP A 18 -11.990 5.789 -7.227 1.00 0.00 O ATOM 197 OD2 ASP A 18 -12.460 4.050 -8.487 1.00 0.00 O ATOM 0 H ASP A 18 -11.448 2.263 -4.353 1.00 0.00 H new ATOM 0 HA ASP A 18 -11.600 5.130 -5.031 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -12.929 2.814 -6.362 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -13.976 4.166 -5.979 1.00 0.00 H new ATOM 202 N ASP A 19 -12.504 3.845 -2.535 1.00 0.00 N ATOM 203 CA ASP A 19 -13.275 3.882 -1.297 1.00 0.00 C ATOM 204 C ASP A 19 -12.459 4.505 -0.170 1.00 0.00 C ATOM 205 O ASP A 19 -11.291 4.167 0.023 1.00 0.00 O ATOM 206 CB ASP A 19 -13.718 2.471 -0.906 1.00 0.00 C ATOM 207 CG ASP A 19 -15.081 2.116 -1.467 1.00 0.00 C ATOM 208 OD1 ASP A 19 -15.445 2.661 -2.530 1.00 0.00 O ATOM 209 OD2 ASP A 19 -15.784 1.294 -0.844 1.00 0.00 O ATOM 0 H ASP A 19 -11.558 3.479 -2.433 1.00 0.00 H new ATOM 0 HA ASP A 19 -14.159 4.498 -1.464 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -12.982 1.750 -1.263 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -13.743 2.389 0.181 1.00 0.00 H new ATOM 214 N VAL A 20 -13.079 5.419 0.568 1.00 0.00 N ATOM 215 CA VAL A 20 -12.407 6.090 1.674 1.00 0.00 C ATOM 216 C VAL A 20 -13.390 6.444 2.785 1.00 0.00 C ATOM 217 O VAL A 20 -14.348 7.186 2.568 1.00 0.00 O ATOM 218 CB VAL A 20 -11.700 7.375 1.201 1.00 0.00 C ATOM 219 CG1 VAL A 20 -10.854 7.961 2.321 1.00 0.00 C ATOM 220 CG2 VAL A 20 -10.851 7.094 -0.028 1.00 0.00 C ATOM 0 H VAL A 20 -14.045 5.712 0.420 1.00 0.00 H new ATOM 0 HA VAL A 20 -11.663 5.394 2.062 1.00 0.00 H new ATOM 0 HB VAL A 20 -12.459 8.108 0.929 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -10.362 8.868 1.969 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -11.492 8.201 3.172 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -10.101 7.235 2.626 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -10.359 8.013 -0.348 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -10.098 6.344 0.214 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -11.487 6.723 -0.832 1.00 0.00 H new ATOM 230 N LYS A 21 -13.144 5.908 3.976 1.00 0.00 N ATOM 231 CA LYS A 21 -14.004 6.168 5.124 1.00 0.00 C ATOM 232 C LYS A 21 -13.335 7.140 6.090 1.00 0.00 C ATOM 233 O LYS A 21 -12.325 6.816 6.714 1.00 0.00 O ATOM 234 CB LYS A 21 -14.338 4.861 5.845 1.00 0.00 C ATOM 235 CG LYS A 21 -15.054 3.849 4.966 1.00 0.00 C ATOM 236 CD LYS A 21 -15.527 2.649 5.771 1.00 0.00 C ATOM 237 CE LYS A 21 -16.676 3.017 6.697 1.00 0.00 C ATOM 238 NZ LYS A 21 -17.730 1.966 6.718 1.00 0.00 N ATOM 0 H LYS A 21 -12.356 5.291 4.171 1.00 0.00 H new ATOM 0 HA LYS A 21 -14.928 6.619 4.762 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -13.416 4.417 6.220 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -14.961 5.082 6.712 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -15.908 4.324 4.483 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -14.384 3.516 4.173 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -15.844 1.857 5.093 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -14.698 2.253 6.358 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -16.294 3.169 7.707 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -17.113 3.963 6.376 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -18.495 2.254 7.361 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -18.112 1.839 5.759 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -17.320 1.069 7.049 1.00 0.00 H new ATOM 252 N ILE A 22 -13.904 8.336 6.207 1.00 0.00 N ATOM 253 CA ILE A 22 -13.363 9.356 7.092 1.00 0.00 C ATOM 254 C ILE A 22 -13.755 9.093 8.543 1.00 0.00 C ATOM 255 O ILE A 22 -14.856 9.440 8.970 1.00 0.00 O ATOM 256 CB ILE A 22 -13.846 10.764 6.691 1.00 0.00 C ATOM 257 CG1 ILE A 22 -13.767 10.950 5.174 1.00 0.00 C ATOM 258 CG2 ILE A 22 -13.024 11.823 7.402 1.00 0.00 C ATOM 259 CD1 ILE A 22 -12.356 10.890 4.631 1.00 0.00 C ATOM 0 H ILE A 22 -14.741 8.621 5.698 1.00 0.00 H new ATOM 0 HA ILE A 22 -12.278 9.310 6.997 1.00 0.00 H new ATOM 0 HB ILE A 22 -14.888 10.872 6.993 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -14.367 10.180 4.690 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -14.209 11.911 4.910 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -13.375 12.813 7.110 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -13.131 11.703 8.480 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -11.975 11.715 7.127 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -12.376 11.029 3.550 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -11.757 11.678 5.088 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -11.918 9.920 4.864 1.00 0.00 H new ATOM 271 N ASN A 23 -12.847 8.482 9.296 1.00 0.00 N ATOM 272 CA ASN A 23 -13.100 8.176 10.700 1.00 0.00 C ATOM 273 C ASN A 23 -12.475 9.238 11.604 1.00 0.00 C ATOM 274 O ASN A 23 -11.432 9.803 11.279 1.00 0.00 O ATOM 275 CB ASN A 23 -12.546 6.795 11.057 1.00 0.00 C ATOM 276 CG ASN A 23 -12.867 5.751 10.004 1.00 0.00 C ATOM 277 OD1 ASN A 23 -13.611 6.013 9.060 1.00 0.00 O ATOM 278 ND2 ASN A 23 -12.305 4.558 10.164 1.00 0.00 N ATOM 0 H ASN A 23 -11.930 8.189 8.959 1.00 0.00 H new ATOM 0 HA ASN A 23 -14.179 8.174 10.857 1.00 0.00 H new ATOM 0 HB2 ASN A 23 -11.465 6.861 11.181 1.00 0.00 H new ATOM 0 HB3 ASN A 23 -12.958 6.478 12.015 1.00 0.00 H new ATOM 0 HD21 ASN A 23 -12.484 3.815 9.488 1.00 0.00 H new ATOM 0 HD22 ASN A 23 -11.694 4.385 10.962 1.00 0.00 H new ATOM 285 N PRO A 24 -13.108 9.521 12.756 1.00 0.00 N ATOM 286 CA PRO A 24 -12.610 10.519 13.707 1.00 0.00 C ATOM 287 C PRO A 24 -11.174 10.247 14.142 1.00 0.00 C ATOM 288 O PRO A 24 -10.477 11.148 14.610 1.00 0.00 O ATOM 289 CB PRO A 24 -13.565 10.398 14.906 1.00 0.00 C ATOM 290 CG PRO A 24 -14.289 9.107 14.707 1.00 0.00 C ATOM 291 CD PRO A 24 -14.351 8.894 13.224 1.00 0.00 C ATOM 0 HA PRO A 24 -12.590 11.515 13.265 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -13.016 10.399 15.848 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -14.260 11.237 14.941 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -13.766 8.286 15.198 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -15.289 9.150 15.137 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -14.392 7.835 12.968 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -15.231 9.362 12.784 1.00 0.00 H new ATOM 299 N LYS A 25 -10.735 9.001 13.988 1.00 0.00 N ATOM 300 CA LYS A 25 -9.382 8.617 14.368 1.00 0.00 C ATOM 301 C LYS A 25 -8.423 8.745 13.188 1.00 0.00 C ATOM 302 O LYS A 25 -7.284 9.186 13.347 1.00 0.00 O ATOM 303 CB LYS A 25 -9.366 7.181 14.896 1.00 0.00 C ATOM 304 CG LYS A 25 -9.881 7.053 16.322 1.00 0.00 C ATOM 305 CD LYS A 25 -8.791 6.580 17.271 1.00 0.00 C ATOM 306 CE LYS A 25 -8.562 5.082 17.154 1.00 0.00 C ATOM 307 NZ LYS A 25 -7.578 4.590 18.158 1.00 0.00 N ATOM 0 H LYS A 25 -11.297 8.242 13.603 1.00 0.00 H new ATOM 0 HA LYS A 25 -9.051 9.293 15.156 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -9.972 6.555 14.242 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -8.347 6.797 14.850 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -10.264 8.016 16.659 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -10.715 6.352 16.347 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -7.863 7.109 17.054 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -9.067 6.828 18.296 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -9.509 4.559 17.287 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -8.206 4.847 16.151 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -7.450 3.564 18.045 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -6.667 5.070 18.015 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -7.929 4.791 19.116 1.00 0.00 H new ATOM 321 N TYR A 26 -8.888 8.353 12.006 1.00 0.00 N ATOM 322 CA TYR A 26 -8.066 8.423 10.802 1.00 0.00 C ATOM 323 C TYR A 26 -8.879 8.061 9.563 1.00 0.00 C ATOM 324 O TYR A 26 -9.941 7.448 9.662 1.00 0.00 O ATOM 325 CB TYR A 26 -6.860 7.488 10.925 1.00 0.00 C ATOM 326 CG TYR A 26 -7.177 6.166 11.589 1.00 0.00 C ATOM 327 CD1 TYR A 26 -8.173 5.336 11.089 1.00 0.00 C ATOM 328 CD2 TYR A 26 -6.482 5.750 12.717 1.00 0.00 C ATOM 329 CE1 TYR A 26 -8.466 4.129 11.693 1.00 0.00 C ATOM 330 CE2 TYR A 26 -6.769 4.544 13.328 1.00 0.00 C ATOM 331 CZ TYR A 26 -7.762 3.738 12.812 1.00 0.00 C ATOM 332 OH TYR A 26 -8.051 2.537 13.418 1.00 0.00 O ATOM 0 H TYR A 26 -9.827 7.984 11.856 1.00 0.00 H new ATOM 0 HA TYR A 26 -7.713 9.449 10.695 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -6.457 7.297 9.930 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -6.078 7.991 11.494 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -8.727 5.640 10.213 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -5.704 6.379 13.124 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -9.242 3.495 11.291 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -6.219 4.235 14.204 1.00 0.00 H new ATOM 0 HH TYR A 26 -7.464 2.412 14.192 1.00 0.00 H new ATOM 342 N VAL A 27 -8.372 8.445 8.395 1.00 0.00 N ATOM 343 CA VAL A 27 -9.051 8.160 7.137 1.00 0.00 C ATOM 344 C VAL A 27 -8.543 6.861 6.520 1.00 0.00 C ATOM 345 O VAL A 27 -7.368 6.744 6.174 1.00 0.00 O ATOM 346 CB VAL A 27 -8.861 9.306 6.125 1.00 0.00 C ATOM 347 CG1 VAL A 27 -9.773 9.114 4.923 1.00 0.00 C ATOM 348 CG2 VAL A 27 -9.117 10.652 6.785 1.00 0.00 C ATOM 0 H VAL A 27 -7.494 8.954 8.295 1.00 0.00 H new ATOM 0 HA VAL A 27 -10.112 8.059 7.365 1.00 0.00 H new ATOM 0 HB VAL A 27 -7.828 9.289 5.777 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -9.625 9.933 4.219 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -9.537 8.169 4.435 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -10.812 9.103 5.253 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -8.978 11.448 6.054 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -10.138 10.683 7.165 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -8.419 10.791 7.610 1.00 0.00 H new ATOM 358 N LEU A 28 -9.437 5.886 6.388 1.00 0.00 N ATOM 359 CA LEU A 28 -9.082 4.591 5.814 1.00 0.00 C ATOM 360 C LEU A 28 -9.281 4.590 4.302 1.00 0.00 C ATOM 361 O LEU A 28 -10.017 5.415 3.761 1.00 0.00 O ATOM 362 CB LEU A 28 -9.919 3.480 6.450 1.00 0.00 C ATOM 363 CG LEU A 28 -9.762 3.335 7.965 1.00 0.00 C ATOM 364 CD1 LEU A 28 -10.543 2.132 8.470 1.00 0.00 C ATOM 365 CD2 LEU A 28 -8.293 3.216 8.338 1.00 0.00 C ATOM 0 H LEU A 28 -10.414 5.967 6.671 1.00 0.00 H new ATOM 0 HA LEU A 28 -8.028 4.408 6.023 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -10.970 3.664 6.225 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -9.654 2.533 5.981 1.00 0.00 H new ATOM 0 HG LEU A 28 -10.166 4.229 8.441 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -10.419 2.045 9.549 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -11.600 2.259 8.235 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -10.171 1.228 7.988 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -8.199 3.114 9.419 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -7.864 2.340 7.852 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -7.761 4.109 8.011 1.00 0.00 H new ATOM 377 N TYR A 29 -8.620 3.657 3.625 1.00 0.00 N ATOM 378 CA TYR A 29 -8.723 3.546 2.174 1.00 0.00 C ATOM 379 C TYR A 29 -9.107 2.129 1.764 1.00 0.00 C ATOM 380 O TYR A 29 -8.407 1.169 2.084 1.00 0.00 O ATOM 381 CB TYR A 29 -7.397 3.936 1.518 1.00 0.00 C ATOM 382 CG TYR A 29 -7.199 5.430 1.394 1.00 0.00 C ATOM 383 CD1 TYR A 29 -6.581 6.154 2.407 1.00 0.00 C ATOM 384 CD2 TYR A 29 -7.628 6.116 0.266 1.00 0.00 C ATOM 385 CE1 TYR A 29 -6.397 7.519 2.297 1.00 0.00 C ATOM 386 CE2 TYR A 29 -7.449 7.481 0.149 1.00 0.00 C ATOM 387 CZ TYR A 29 -6.832 8.178 1.167 1.00 0.00 C ATOM 388 OH TYR A 29 -6.651 9.536 1.054 1.00 0.00 O ATOM 0 H TYR A 29 -8.007 2.966 4.058 1.00 0.00 H new ATOM 0 HA TYR A 29 -9.503 4.228 1.836 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -6.576 3.516 2.100 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -7.346 3.488 0.526 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -6.239 5.641 3.294 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -8.110 5.573 -0.534 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -5.915 8.067 3.093 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -7.790 8.000 -0.735 1.00 0.00 H new ATOM 0 HH TYR A 29 -6.756 9.803 0.117 1.00 0.00 H new ATOM 398 N GLY A 30 -10.221 2.004 1.049 1.00 0.00 N ATOM 399 CA GLY A 30 -10.674 0.700 0.605 1.00 0.00 C ATOM 400 C GLY A 30 -10.018 0.272 -0.692 1.00 0.00 C ATOM 401 O GLY A 30 -10.440 0.680 -1.773 1.00 0.00 O ATOM 0 H GLY A 30 -10.817 2.783 0.770 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -10.461 -0.038 1.378 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -11.756 0.720 0.473 1.00 0.00 H new ATOM 405 N VAL A 31 -8.980 -0.552 -0.584 1.00 0.00 N ATOM 406 CA VAL A 31 -8.259 -1.033 -1.756 1.00 0.00 C ATOM 407 C VAL A 31 -8.905 -2.291 -2.321 1.00 0.00 C ATOM 408 O VAL A 31 -8.901 -3.345 -1.685 1.00 0.00 O ATOM 409 CB VAL A 31 -6.785 -1.330 -1.426 1.00 0.00 C ATOM 410 CG1 VAL A 31 -6.003 -1.634 -2.695 1.00 0.00 C ATOM 411 CG2 VAL A 31 -6.161 -0.165 -0.672 1.00 0.00 C ATOM 0 H VAL A 31 -8.620 -0.900 0.304 1.00 0.00 H new ATOM 0 HA VAL A 31 -8.304 -0.239 -2.502 1.00 0.00 H new ATOM 0 HB VAL A 31 -6.746 -2.210 -0.784 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -4.963 -1.841 -2.441 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -6.436 -2.503 -3.190 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -6.048 -0.775 -3.365 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -5.119 -0.393 -0.447 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -6.211 0.734 -1.286 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -6.705 -0.000 0.258 1.00 0.00 H new ATOM 421 N SER A 32 -9.461 -2.171 -3.522 1.00 0.00 N ATOM 422 CA SER A 32 -10.117 -3.298 -4.178 1.00 0.00 C ATOM 423 C SER A 32 -9.104 -4.167 -4.919 1.00 0.00 C ATOM 424 O SER A 32 -8.176 -3.658 -5.547 1.00 0.00 O ATOM 425 CB SER A 32 -11.184 -2.797 -5.153 1.00 0.00 C ATOM 426 OG SER A 32 -12.088 -3.833 -5.496 1.00 0.00 O ATOM 0 H SER A 32 -9.471 -1.305 -4.061 1.00 0.00 H new ATOM 0 HA SER A 32 -10.592 -3.905 -3.407 1.00 0.00 H new ATOM 0 HB2 SER A 32 -11.730 -1.967 -4.704 1.00 0.00 H new ATOM 0 HB3 SER A 32 -10.706 -2.414 -6.055 1.00 0.00 H new ATOM 0 HG SER A 32 -12.761 -3.487 -6.119 1.00 0.00 H new ATOM 432 N THR A 33 -9.291 -5.481 -4.839 1.00 0.00 N ATOM 433 CA THR A 33 -8.394 -6.422 -5.501 1.00 0.00 C ATOM 434 C THR A 33 -9.111 -7.738 -5.798 1.00 0.00 C ATOM 435 O THR A 33 -10.168 -8.014 -5.232 1.00 0.00 O ATOM 436 CB THR A 33 -7.165 -6.675 -4.627 1.00 0.00 C ATOM 437 OG1 THR A 33 -7.549 -6.948 -3.290 1.00 0.00 O ATOM 438 CG2 THR A 33 -6.206 -5.506 -4.600 1.00 0.00 C ATOM 0 H THR A 33 -10.055 -5.918 -4.323 1.00 0.00 H new ATOM 0 HA THR A 33 -8.074 -5.987 -6.448 1.00 0.00 H new ATOM 0 HB THR A 33 -6.660 -7.531 -5.074 1.00 0.00 H new ATOM 0 HG1 THR A 33 -8.514 -6.810 -3.192 1.00 0.00 H new ATOM 0 HG21 THR A 33 -5.355 -5.748 -3.963 1.00 0.00 H new ATOM 0 HG22 THR A 33 -5.855 -5.300 -5.611 1.00 0.00 H new ATOM 0 HG23 THR A 33 -6.715 -4.626 -4.206 1.00 0.00 H new ATOM 446 N PRO A 34 -8.544 -8.570 -6.694 1.00 0.00 N ATOM 447 CA PRO A 34 -9.136 -9.859 -7.061 1.00 0.00 C ATOM 448 C PRO A 34 -9.681 -10.615 -5.854 1.00 0.00 C ATOM 449 O PRO A 34 -10.653 -11.361 -5.962 1.00 0.00 O ATOM 450 CB PRO A 34 -7.962 -10.607 -7.684 1.00 0.00 C ATOM 451 CG PRO A 34 -7.126 -9.538 -8.298 1.00 0.00 C ATOM 452 CD PRO A 34 -7.283 -8.320 -7.421 1.00 0.00 C ATOM 0 HA PRO A 34 -9.993 -9.747 -7.726 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -7.404 -11.166 -6.933 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -8.300 -11.326 -8.431 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -6.082 -9.845 -8.353 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -7.451 -9.328 -9.317 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -6.442 -8.209 -6.737 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -7.336 -7.406 -8.012 1.00 0.00 H new ATOM 460 N ASN A 35 -9.053 -10.405 -4.704 1.00 0.00 N ATOM 461 CA ASN A 35 -9.480 -11.055 -3.474 1.00 0.00 C ATOM 462 C ASN A 35 -10.690 -10.336 -2.890 1.00 0.00 C ATOM 463 O ASN A 35 -11.726 -10.949 -2.634 1.00 0.00 O ATOM 464 CB ASN A 35 -8.338 -11.071 -2.455 1.00 0.00 C ATOM 465 CG ASN A 35 -7.358 -12.201 -2.702 1.00 0.00 C ATOM 466 OD1 ASN A 35 -6.299 -12.001 -3.296 1.00 0.00 O ATOM 467 ND2 ASN A 35 -7.709 -13.399 -2.246 1.00 0.00 N ATOM 0 H ASN A 35 -8.246 -9.790 -4.599 1.00 0.00 H new ATOM 0 HA ASN A 35 -9.758 -12.083 -3.705 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -7.808 -10.119 -2.493 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -8.752 -11.166 -1.451 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -7.090 -14.198 -2.383 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -8.597 -13.519 -1.759 1.00 0.00 H new ATOM 474 N LYS A 36 -10.550 -9.026 -2.689 1.00 0.00 N ATOM 475 CA LYS A 36 -11.628 -8.203 -2.142 1.00 0.00 C ATOM 476 C LYS A 36 -11.109 -6.826 -1.741 1.00 0.00 C ATOM 477 O LYS A 36 -9.929 -6.521 -1.916 1.00 0.00 O ATOM 478 CB LYS A 36 -12.275 -8.884 -0.931 1.00 0.00 C ATOM 479 CG LYS A 36 -11.270 -9.455 0.057 1.00 0.00 C ATOM 480 CD LYS A 36 -11.843 -10.648 0.806 1.00 0.00 C ATOM 481 CE LYS A 36 -10.746 -11.489 1.437 1.00 0.00 C ATOM 482 NZ LYS A 36 -10.271 -12.563 0.521 1.00 0.00 N ATOM 0 H LYS A 36 -9.696 -8.510 -2.898 1.00 0.00 H new ATOM 0 HA LYS A 36 -12.380 -8.083 -2.922 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -12.909 -8.163 -0.415 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -12.924 -9.687 -1.280 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -10.367 -9.757 -0.474 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -10.978 -8.683 0.769 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -12.526 -10.299 1.580 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -12.426 -11.263 0.121 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -9.908 -10.847 1.709 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -11.117 -11.936 2.359 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -9.275 -12.780 0.728 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -10.848 -13.417 0.659 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -10.358 -12.242 -0.465 1.00 0.00 H new ATOM 496 N ARG A 37 -11.998 -6.001 -1.198 1.00 0.00 N ATOM 497 CA ARG A 37 -11.633 -4.658 -0.767 1.00 0.00 C ATOM 498 C ARG A 37 -11.018 -4.687 0.629 1.00 0.00 C ATOM 499 O ARG A 37 -11.527 -5.358 1.527 1.00 0.00 O ATOM 500 CB ARG A 37 -12.861 -3.745 -0.778 1.00 0.00 C ATOM 501 CG ARG A 37 -12.544 -2.302 -1.138 1.00 0.00 C ATOM 502 CD ARG A 37 -13.798 -1.534 -1.524 1.00 0.00 C ATOM 503 NE ARG A 37 -14.525 -1.044 -0.353 1.00 0.00 N ATOM 504 CZ ARG A 37 -15.453 -1.746 0.296 1.00 0.00 C ATOM 505 NH1 ARG A 37 -15.772 -2.972 -0.101 1.00 0.00 N ATOM 506 NH2 ARG A 37 -16.066 -1.218 1.347 1.00 0.00 N ATOM 0 H ARG A 37 -12.978 -6.240 -1.046 1.00 0.00 H new ATOM 0 HA ARG A 37 -10.893 -4.266 -1.464 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -13.588 -4.137 -1.489 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -13.331 -3.771 0.205 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -12.063 -1.812 -0.291 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -11.834 -2.280 -1.965 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -13.525 -0.692 -2.160 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -14.451 -2.179 -2.112 1.00 0.00 H new ATOM 0 HE ARG A 37 -14.308 -0.107 -0.012 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -15.305 -3.384 -0.909 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -16.484 -3.502 0.402 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -15.827 -0.276 1.657 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -16.777 -1.754 1.845 1.00 0.00 H new ATOM 520 N LEU A 38 -9.920 -3.959 0.803 1.00 0.00 N ATOM 521 CA LEU A 38 -9.237 -3.906 2.091 1.00 0.00 C ATOM 522 C LEU A 38 -9.069 -2.463 2.561 1.00 0.00 C ATOM 523 O LEU A 38 -8.599 -1.606 1.812 1.00 0.00 O ATOM 524 CB LEU A 38 -7.871 -4.591 1.991 1.00 0.00 C ATOM 525 CG LEU A 38 -7.652 -5.739 2.976 1.00 0.00 C ATOM 526 CD1 LEU A 38 -6.782 -6.823 2.355 1.00 0.00 C ATOM 527 CD2 LEU A 38 -7.028 -5.219 4.261 1.00 0.00 C ATOM 0 H LEU A 38 -9.485 -3.399 0.070 1.00 0.00 H new ATOM 0 HA LEU A 38 -9.848 -4.434 2.824 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -7.746 -4.972 0.978 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -7.094 -3.843 2.149 1.00 0.00 H new ATOM 0 HG LEU A 38 -8.620 -6.179 3.215 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -6.639 -7.630 3.073 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -7.270 -7.214 1.462 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -5.814 -6.402 2.085 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -6.878 -6.047 4.954 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -6.068 -4.754 4.037 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -7.691 -4.482 4.715 1.00 0.00 H new ATOM 539 N TYR A 39 -9.457 -2.204 3.805 1.00 0.00 N ATOM 540 CA TYR A 39 -9.350 -0.866 4.377 1.00 0.00 C ATOM 541 C TYR A 39 -8.013 -0.682 5.084 1.00 0.00 C ATOM 542 O TYR A 39 -7.758 -1.294 6.122 1.00 0.00 O ATOM 543 CB TYR A 39 -10.498 -0.615 5.356 1.00 0.00 C ATOM 544 CG TYR A 39 -11.788 -0.203 4.683 1.00 0.00 C ATOM 545 CD1 TYR A 39 -11.843 0.924 3.873 1.00 0.00 C ATOM 546 CD2 TYR A 39 -12.951 -0.942 4.858 1.00 0.00 C ATOM 547 CE1 TYR A 39 -13.020 1.303 3.256 1.00 0.00 C ATOM 548 CE2 TYR A 39 -14.132 -0.570 4.244 1.00 0.00 C ATOM 549 CZ TYR A 39 -14.161 0.553 3.445 1.00 0.00 C ATOM 550 OH TYR A 39 -15.335 0.926 2.832 1.00 0.00 O ATOM 0 H TYR A 39 -9.848 -2.903 4.437 1.00 0.00 H new ATOM 0 HA TYR A 39 -9.411 -0.144 3.563 1.00 0.00 H new ATOM 0 HB2 TYR A 39 -10.674 -1.521 5.937 1.00 0.00 H new ATOM 0 HB3 TYR A 39 -10.201 0.162 6.060 1.00 0.00 H new ATOM 0 HD1 TYR A 39 -10.951 1.514 3.723 1.00 0.00 H new ATOM 0 HD2 TYR A 39 -12.932 -1.822 5.484 1.00 0.00 H new ATOM 0 HE1 TYR A 39 -13.046 2.182 2.629 1.00 0.00 H new ATOM 0 HE2 TYR A 39 -15.027 -1.156 4.389 1.00 0.00 H new ATOM 0 HH TYR A 39 -15.143 1.580 2.128 1.00 0.00 H new ATOM 560 N LYS A 40 -7.161 0.166 4.517 1.00 0.00 N ATOM 561 CA LYS A 40 -5.847 0.431 5.094 1.00 0.00 C ATOM 562 C LYS A 40 -5.629 1.928 5.279 1.00 0.00 C ATOM 563 O LYS A 40 -6.182 2.744 4.541 1.00 0.00 O ATOM 564 CB LYS A 40 -4.748 -0.149 4.201 1.00 0.00 C ATOM 565 CG LYS A 40 -4.973 0.100 2.718 1.00 0.00 C ATOM 566 CD LYS A 40 -3.714 0.617 2.036 1.00 0.00 C ATOM 567 CE LYS A 40 -3.891 2.043 1.540 1.00 0.00 C ATOM 568 NZ LYS A 40 -3.440 3.045 2.547 1.00 0.00 N ATOM 0 H LYS A 40 -7.356 0.682 3.659 1.00 0.00 H new ATOM 0 HA LYS A 40 -5.802 -0.050 6.071 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -3.790 0.282 4.492 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -4.680 -1.223 4.374 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -5.293 -0.825 2.238 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -5.779 0.822 2.589 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -2.878 0.575 2.734 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -3.461 -0.032 1.197 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -3.328 2.178 0.617 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -4.940 2.216 1.301 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -4.175 3.770 2.668 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -3.268 2.570 3.456 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -2.561 3.495 2.220 1.00 0.00 H new ATOM 582 N ARG A 41 -4.817 2.284 6.269 1.00 0.00 N ATOM 583 CA ARG A 41 -4.522 3.685 6.551 1.00 0.00 C ATOM 584 C ARG A 41 -3.196 4.098 5.922 1.00 0.00 C ATOM 585 O ARG A 41 -2.359 3.254 5.601 1.00 0.00 O ATOM 586 CB ARG A 41 -4.482 3.927 8.062 1.00 0.00 C ATOM 587 CG ARG A 41 -3.575 2.965 8.809 1.00 0.00 C ATOM 588 CD ARG A 41 -3.473 3.326 10.283 1.00 0.00 C ATOM 589 NE ARG A 41 -3.183 2.159 11.113 1.00 0.00 N ATOM 590 CZ ARG A 41 -2.867 2.227 12.405 1.00 0.00 C ATOM 591 NH1 ARG A 41 -2.801 3.402 13.017 1.00 0.00 N ATOM 592 NH2 ARG A 41 -2.617 1.117 13.085 1.00 0.00 N ATOM 0 H ARG A 41 -4.351 1.622 6.890 1.00 0.00 H new ATOM 0 HA ARG A 41 -5.315 4.292 6.115 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -4.148 4.947 8.249 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -5.493 3.844 8.461 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -3.958 1.949 8.708 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -2.582 2.977 8.361 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -2.690 4.072 10.420 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -4.408 3.781 10.611 1.00 0.00 H new ATOM 0 HE ARG A 41 -3.225 1.238 10.677 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -2.993 4.259 12.498 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -2.559 3.449 14.007 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -2.667 0.211 12.619 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -2.375 1.169 14.075 1.00 0.00 H new ATOM 606 N TYR A 42 -3.011 5.403 5.748 1.00 0.00 N ATOM 607 CA TYR A 42 -1.786 5.929 5.156 1.00 0.00 C ATOM 608 C TYR A 42 -0.564 5.509 5.967 1.00 0.00 C ATOM 609 O TYR A 42 0.444 5.073 5.409 1.00 0.00 O ATOM 610 CB TYR A 42 -1.852 7.454 5.066 1.00 0.00 C ATOM 611 CG TYR A 42 -0.839 8.050 4.115 1.00 0.00 C ATOM 612 CD1 TYR A 42 -0.611 7.483 2.867 1.00 0.00 C ATOM 613 CD2 TYR A 42 -0.110 9.179 4.465 1.00 0.00 C ATOM 614 CE1 TYR A 42 0.314 8.025 1.996 1.00 0.00 C ATOM 615 CE2 TYR A 42 0.818 9.727 3.599 1.00 0.00 C ATOM 616 CZ TYR A 42 1.026 9.146 2.366 1.00 0.00 C ATOM 617 OH TYR A 42 1.949 9.689 1.501 1.00 0.00 O ATOM 0 H TYR A 42 -3.693 6.115 6.008 1.00 0.00 H new ATOM 0 HA TYR A 42 -1.692 5.516 4.152 1.00 0.00 H new ATOM 0 HB2 TYR A 42 -2.852 7.748 4.748 1.00 0.00 H new ATOM 0 HB3 TYR A 42 -1.697 7.875 6.059 1.00 0.00 H new ATOM 0 HD1 TYR A 42 -1.166 6.604 2.573 1.00 0.00 H new ATOM 0 HD2 TYR A 42 -0.271 9.637 5.430 1.00 0.00 H new ATOM 0 HE1 TYR A 42 0.479 7.573 1.029 1.00 0.00 H new ATOM 0 HE2 TYR A 42 1.377 10.605 3.887 1.00 0.00 H new ATOM 0 HH TYR A 42 2.736 9.106 1.454 1.00 0.00 H new ATOM 627 N SER A 43 -0.661 5.641 7.286 1.00 0.00 N ATOM 628 CA SER A 43 0.436 5.273 8.174 1.00 0.00 C ATOM 629 C SER A 43 0.819 3.806 7.993 1.00 0.00 C ATOM 630 O SER A 43 1.939 3.404 8.311 1.00 0.00 O ATOM 631 CB SER A 43 0.049 5.535 9.629 1.00 0.00 C ATOM 632 OG SER A 43 -0.186 6.914 9.855 1.00 0.00 O ATOM 0 H SER A 43 -1.488 6.000 7.763 1.00 0.00 H new ATOM 0 HA SER A 43 1.299 5.887 7.917 1.00 0.00 H new ATOM 0 HB2 SER A 43 -0.846 4.965 9.879 1.00 0.00 H new ATOM 0 HB3 SER A 43 0.844 5.186 10.288 1.00 0.00 H new ATOM 0 HG SER A 43 -0.434 7.054 10.793 1.00 0.00 H new ATOM 638 N GLU A 44 -0.116 3.009 7.483 1.00 0.00 N ATOM 639 CA GLU A 44 0.129 1.589 7.262 1.00 0.00 C ATOM 640 C GLU A 44 1.054 1.376 6.068 1.00 0.00 C ATOM 641 O GLU A 44 2.008 0.601 6.139 1.00 0.00 O ATOM 642 CB GLU A 44 -1.194 0.849 7.042 1.00 0.00 C ATOM 643 CG GLU A 44 -1.434 -0.276 8.034 1.00 0.00 C ATOM 644 CD GLU A 44 -2.499 -1.249 7.566 1.00 0.00 C ATOM 645 OE1 GLU A 44 -3.605 -0.791 7.210 1.00 0.00 O ATOM 646 OE2 GLU A 44 -2.226 -2.467 7.554 1.00 0.00 O ATOM 0 H GLU A 44 -1.049 3.323 7.216 1.00 0.00 H new ATOM 0 HA GLU A 44 0.616 1.186 8.150 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -2.015 1.563 7.109 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -1.208 0.440 6.032 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -0.501 -0.816 8.198 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -1.731 0.148 8.993 1.00 0.00 H new ATOM 653 N PHE A 45 0.765 2.070 4.971 1.00 0.00 N ATOM 654 CA PHE A 45 1.573 1.955 3.762 1.00 0.00 C ATOM 655 C PHE A 45 3.024 2.332 4.042 1.00 0.00 C ATOM 656 O PHE A 45 3.939 1.553 3.776 1.00 0.00 O ATOM 657 CB PHE A 45 1.000 2.844 2.655 1.00 0.00 C ATOM 658 CG PHE A 45 0.612 2.085 1.419 1.00 0.00 C ATOM 659 CD1 PHE A 45 1.556 1.787 0.449 1.00 0.00 C ATOM 660 CD2 PHE A 45 -0.695 1.668 1.228 1.00 0.00 C ATOM 661 CE1 PHE A 45 1.202 1.086 -0.688 1.00 0.00 C ATOM 662 CE2 PHE A 45 -1.054 0.968 0.093 1.00 0.00 C ATOM 663 CZ PHE A 45 -0.104 0.677 -0.867 1.00 0.00 C ATOM 0 H PHE A 45 -0.021 2.716 4.895 1.00 0.00 H new ATOM 0 HA PHE A 45 1.546 0.917 3.431 1.00 0.00 H new ATOM 0 HB2 PHE A 45 0.126 3.370 3.038 1.00 0.00 H new ATOM 0 HB3 PHE A 45 1.737 3.602 2.390 1.00 0.00 H new ATOM 0 HD1 PHE A 45 2.579 2.106 0.583 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -1.442 1.893 1.975 1.00 0.00 H new ATOM 0 HE1 PHE A 45 1.947 0.858 -1.436 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -2.076 0.648 -0.044 1.00 0.00 H new ATOM 0 HZ PHE A 45 -0.383 0.131 -1.756 1.00 0.00 H new ATOM 673 N TRP A 46 3.226 3.528 4.588 1.00 0.00 N ATOM 674 CA TRP A 46 4.567 3.999 4.911 1.00 0.00 C ATOM 675 C TRP A 46 5.252 3.039 5.880 1.00 0.00 C ATOM 676 O TRP A 46 6.473 2.884 5.860 1.00 0.00 O ATOM 677 CB TRP A 46 4.506 5.405 5.516 1.00 0.00 C ATOM 678 CG TRP A 46 5.827 5.899 6.026 1.00 0.00 C ATOM 679 CD1 TRP A 46 6.205 6.027 7.332 1.00 0.00 C ATOM 680 CD2 TRP A 46 6.944 6.330 5.240 1.00 0.00 C ATOM 681 NE1 TRP A 46 7.488 6.511 7.406 1.00 0.00 N ATOM 682 CE2 TRP A 46 7.964 6.705 6.135 1.00 0.00 C ATOM 683 CE3 TRP A 46 7.183 6.434 3.867 1.00 0.00 C ATOM 684 CZ2 TRP A 46 9.201 7.177 5.702 1.00 0.00 C ATOM 685 CZ3 TRP A 46 8.410 6.902 3.437 1.00 0.00 C ATOM 686 CH2 TRP A 46 9.405 7.267 4.353 1.00 0.00 C ATOM 0 H TRP A 46 2.480 4.186 4.815 1.00 0.00 H new ATOM 0 HA TRP A 46 5.149 4.038 3.990 1.00 0.00 H new ATOM 0 HB2 TRP A 46 4.135 6.100 4.762 1.00 0.00 H new ATOM 0 HB3 TRP A 46 3.786 5.408 6.335 1.00 0.00 H new ATOM 0 HD1 TRP A 46 5.585 5.783 8.182 1.00 0.00 H new ATOM 0 HE1 TRP A 46 8.003 6.696 8.267 1.00 0.00 H new ATOM 0 HE3 TRP A 46 6.422 6.153 3.154 1.00 0.00 H new ATOM 0 HZ2 TRP A 46 9.970 7.461 6.405 1.00 0.00 H new ATOM 0 HZ3 TRP A 46 8.605 6.988 2.378 1.00 0.00 H new ATOM 0 HH2 TRP A 46 10.354 7.628 3.985 1.00 0.00 H new ATOM 697 N LYS A 47 4.453 2.395 6.725 1.00 0.00 N ATOM 698 CA LYS A 47 4.978 1.446 7.699 1.00 0.00 C ATOM 699 C LYS A 47 5.598 0.240 7.001 1.00 0.00 C ATOM 700 O LYS A 47 6.492 -0.408 7.543 1.00 0.00 O ATOM 701 CB LYS A 47 3.865 0.989 8.646 1.00 0.00 C ATOM 702 CG LYS A 47 3.868 1.715 9.982 1.00 0.00 C ATOM 703 CD LYS A 47 3.753 0.744 11.147 1.00 0.00 C ATOM 704 CE LYS A 47 5.112 0.439 11.757 1.00 0.00 C ATOM 705 NZ LYS A 47 5.602 -0.915 11.374 1.00 0.00 N ATOM 0 H LYS A 47 3.440 2.513 6.754 1.00 0.00 H new ATOM 0 HA LYS A 47 5.755 1.946 8.278 1.00 0.00 H new ATOM 0 HB2 LYS A 47 2.901 1.142 8.161 1.00 0.00 H new ATOM 0 HB3 LYS A 47 3.967 -0.082 8.823 1.00 0.00 H new ATOM 0 HG2 LYS A 47 4.786 2.294 10.080 1.00 0.00 H new ATOM 0 HG3 LYS A 47 3.039 2.423 10.014 1.00 0.00 H new ATOM 0 HD2 LYS A 47 3.098 1.165 11.909 1.00 0.00 H new ATOM 0 HD3 LYS A 47 3.291 -0.182 10.805 1.00 0.00 H new ATOM 0 HE2 LYS A 47 5.832 1.191 11.433 1.00 0.00 H new ATOM 0 HE3 LYS A 47 5.046 0.507 12.843 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 6.531 -1.084 11.810 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 4.928 -1.635 11.705 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 5.690 -0.973 10.339 1.00 0.00 H new ATOM 719 N LEU A 48 5.117 -0.057 5.797 1.00 0.00 N ATOM 720 CA LEU A 48 5.627 -1.187 5.025 1.00 0.00 C ATOM 721 C LEU A 48 6.796 -0.760 4.143 1.00 0.00 C ATOM 722 O LEU A 48 7.702 -1.549 3.873 1.00 0.00 O ATOM 723 CB LEU A 48 4.511 -1.784 4.164 1.00 0.00 C ATOM 724 CG LEU A 48 4.953 -2.887 3.201 1.00 0.00 C ATOM 725 CD1 LEU A 48 5.326 -4.147 3.965 1.00 0.00 C ATOM 726 CD2 LEU A 48 3.857 -3.181 2.188 1.00 0.00 C ATOM 0 H LEU A 48 4.375 0.469 5.335 1.00 0.00 H new ATOM 0 HA LEU A 48 5.983 -1.944 5.723 1.00 0.00 H new ATOM 0 HB2 LEU A 48 3.741 -2.185 4.823 1.00 0.00 H new ATOM 0 HB3 LEU A 48 4.051 -0.982 3.587 1.00 0.00 H new ATOM 0 HG LEU A 48 5.835 -2.540 2.663 1.00 0.00 H new ATOM 0 HD11 LEU A 48 5.638 -4.920 3.262 1.00 0.00 H new ATOM 0 HD12 LEU A 48 6.145 -3.928 4.650 1.00 0.00 H new ATOM 0 HD13 LEU A 48 4.463 -4.498 4.531 1.00 0.00 H new ATOM 0 HD21 LEU A 48 4.189 -3.968 1.511 1.00 0.00 H new ATOM 0 HD22 LEU A 48 2.957 -3.507 2.710 1.00 0.00 H new ATOM 0 HD23 LEU A 48 3.638 -2.279 1.616 1.00 0.00 H new ATOM 738 N LYS A 49 6.769 0.490 3.694 1.00 0.00 N ATOM 739 CA LYS A 49 7.825 1.023 2.839 1.00 0.00 C ATOM 740 C LYS A 49 9.193 0.865 3.497 1.00 0.00 C ATOM 741 O LYS A 49 10.001 0.032 3.084 1.00 0.00 O ATOM 742 CB LYS A 49 7.563 2.498 2.527 1.00 0.00 C ATOM 743 CG LYS A 49 7.686 2.838 1.050 1.00 0.00 C ATOM 744 CD LYS A 49 8.321 4.203 0.842 1.00 0.00 C ATOM 745 CE LYS A 49 9.782 4.207 1.262 1.00 0.00 C ATOM 746 NZ LYS A 49 10.628 4.996 0.323 1.00 0.00 N ATOM 0 H LYS A 49 6.026 1.155 3.908 1.00 0.00 H new ATOM 0 HA LYS A 49 7.823 0.456 1.908 1.00 0.00 H new ATOM 0 HB2 LYS A 49 6.562 2.761 2.870 1.00 0.00 H new ATOM 0 HB3 LYS A 49 8.265 3.111 3.092 1.00 0.00 H new ATOM 0 HG2 LYS A 49 8.285 2.077 0.549 1.00 0.00 H new ATOM 0 HG3 LYS A 49 6.699 2.821 0.589 1.00 0.00 H new ATOM 0 HD2 LYS A 49 8.242 4.486 -0.208 1.00 0.00 H new ATOM 0 HD3 LYS A 49 7.774 4.951 1.416 1.00 0.00 H new ATOM 0 HE2 LYS A 49 9.870 4.622 2.266 1.00 0.00 H new ATOM 0 HE3 LYS A 49 10.149 3.182 1.308 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 11.624 4.932 0.616 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 10.525 4.616 -0.640 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 10.326 5.991 0.337 1.00 0.00 H new ATOM 760 N THR A 50 9.445 1.671 4.525 1.00 0.00 N ATOM 761 CA THR A 50 10.715 1.621 5.244 1.00 0.00 C ATOM 762 C THR A 50 11.009 0.207 5.736 1.00 0.00 C ATOM 763 O THR A 50 12.168 -0.169 5.912 1.00 0.00 O ATOM 764 CB THR A 50 10.693 2.596 6.424 1.00 0.00 C ATOM 765 OG1 THR A 50 11.735 2.301 7.339 1.00 0.00 O ATOM 766 CG2 THR A 50 9.390 2.580 7.194 1.00 0.00 C ATOM 0 H THR A 50 8.787 2.366 4.879 1.00 0.00 H new ATOM 0 HA THR A 50 11.507 1.914 4.555 1.00 0.00 H new ATOM 0 HB THR A 50 10.822 3.584 5.981 1.00 0.00 H new ATOM 0 HG1 THR A 50 11.705 2.936 8.085 1.00 0.00 H new ATOM 0 HG21 THR A 50 9.444 3.294 8.016 1.00 0.00 H new ATOM 0 HG22 THR A 50 8.571 2.854 6.529 1.00 0.00 H new ATOM 0 HG23 THR A 50 9.215 1.581 7.593 1.00 0.00 H new ATOM 774 N ARG A 51 9.955 -0.573 5.952 1.00 0.00 N ATOM 775 CA ARG A 51 10.104 -1.946 6.419 1.00 0.00 C ATOM 776 C ARG A 51 10.905 -2.770 5.418 1.00 0.00 C ATOM 777 O ARG A 51 12.003 -3.240 5.719 1.00 0.00 O ATOM 778 CB ARG A 51 8.728 -2.576 6.629 1.00 0.00 C ATOM 779 CG ARG A 51 8.721 -3.698 7.649 1.00 0.00 C ATOM 780 CD ARG A 51 8.220 -3.222 9.005 1.00 0.00 C ATOM 781 NE ARG A 51 7.085 -4.014 9.474 1.00 0.00 N ATOM 782 CZ ARG A 51 5.837 -3.848 9.044 1.00 0.00 C ATOM 783 NH1 ARG A 51 5.556 -2.915 8.141 1.00 0.00 N ATOM 784 NH2 ARG A 51 4.865 -4.616 9.518 1.00 0.00 N ATOM 0 H ARG A 51 8.989 -0.278 5.811 1.00 0.00 H new ATOM 0 HA ARG A 51 10.643 -1.933 7.367 1.00 0.00 H new ATOM 0 HB2 ARG A 51 8.029 -1.803 6.948 1.00 0.00 H new ATOM 0 HB3 ARG A 51 8.365 -2.961 5.676 1.00 0.00 H new ATOM 0 HG2 ARG A 51 8.088 -4.511 7.292 1.00 0.00 H new ATOM 0 HG3 ARG A 51 9.728 -4.101 7.754 1.00 0.00 H new ATOM 0 HD2 ARG A 51 9.030 -3.281 9.733 1.00 0.00 H new ATOM 0 HD3 ARG A 51 7.928 -2.174 8.937 1.00 0.00 H new ATOM 0 HE ARG A 51 7.260 -4.737 10.172 1.00 0.00 H new ATOM 0 HH11 ARG A 51 6.299 -2.321 7.773 1.00 0.00 H new ATOM 0 HH12 ARG A 51 4.597 -2.793 7.815 1.00 0.00 H new ATOM 0 HH21 ARG A 51 5.074 -5.334 10.212 1.00 0.00 H new ATOM 0 HH22 ARG A 51 3.908 -4.489 9.189 1.00 0.00 H new ATOM 798 N LEU A 52 10.348 -2.937 4.221 1.00 0.00 N ATOM 799 CA LEU A 52 11.006 -3.697 3.162 1.00 0.00 C ATOM 800 C LEU A 52 12.461 -3.265 2.999 1.00 0.00 C ATOM 801 O LEU A 52 13.319 -4.066 2.632 1.00 0.00 O ATOM 802 CB LEU A 52 10.267 -3.510 1.833 1.00 0.00 C ATOM 803 CG LEU A 52 8.758 -3.754 1.880 1.00 0.00 C ATOM 804 CD1 LEU A 52 8.051 -2.950 0.802 1.00 0.00 C ATOM 805 CD2 LEU A 52 8.457 -5.235 1.723 1.00 0.00 C ATOM 0 H LEU A 52 9.439 -2.555 3.960 1.00 0.00 H new ATOM 0 HA LEU A 52 10.983 -4.749 3.445 1.00 0.00 H new ATOM 0 HB2 LEU A 52 10.443 -2.494 1.479 1.00 0.00 H new ATOM 0 HB3 LEU A 52 10.704 -4.184 1.096 1.00 0.00 H new ATOM 0 HG LEU A 52 8.386 -3.425 2.850 1.00 0.00 H new ATOM 0 HD11 LEU A 52 6.978 -3.138 0.853 1.00 0.00 H new ATOM 0 HD12 LEU A 52 8.241 -1.888 0.957 1.00 0.00 H new ATOM 0 HD13 LEU A 52 8.425 -3.247 -0.178 1.00 0.00 H new ATOM 0 HD21 LEU A 52 7.379 -5.393 1.758 1.00 0.00 H new ATOM 0 HD22 LEU A 52 8.844 -5.585 0.766 1.00 0.00 H new ATOM 0 HD23 LEU A 52 8.932 -5.791 2.532 1.00 0.00 H new ATOM 817 N GLU A 53 12.729 -1.993 3.274 1.00 0.00 N ATOM 818 CA GLU A 53 14.079 -1.456 3.156 1.00 0.00 C ATOM 819 C GLU A 53 15.024 -2.136 4.142 1.00 0.00 C ATOM 820 O GLU A 53 16.108 -2.585 3.771 1.00 0.00 O ATOM 821 CB GLU A 53 14.072 0.056 3.393 1.00 0.00 C ATOM 822 CG GLU A 53 14.012 0.872 2.112 1.00 0.00 C ATOM 823 CD GLU A 53 15.259 1.708 1.894 1.00 0.00 C ATOM 824 OE1 GLU A 53 16.332 1.317 2.397 1.00 0.00 O ATOM 825 OE2 GLU A 53 15.160 2.756 1.220 1.00 0.00 O ATOM 0 H GLU A 53 12.030 -1.316 3.580 1.00 0.00 H new ATOM 0 HA GLU A 53 14.436 -1.655 2.145 1.00 0.00 H new ATOM 0 HB2 GLU A 53 13.217 0.313 4.018 1.00 0.00 H new ATOM 0 HB3 GLU A 53 14.968 0.333 3.949 1.00 0.00 H new ATOM 0 HG2 GLU A 53 13.876 0.201 1.264 1.00 0.00 H new ATOM 0 HG3 GLU A 53 13.141 1.527 2.143 1.00 0.00 H new ATOM 832 N ARG A 54 14.606 -2.205 5.402 1.00 0.00 N ATOM 833 CA ARG A 54 15.416 -2.829 6.443 1.00 0.00 C ATOM 834 C ARG A 54 15.227 -4.342 6.457 1.00 0.00 C ATOM 835 O ARG A 54 16.109 -5.084 6.889 1.00 0.00 O ATOM 836 CB ARG A 54 15.062 -2.247 7.814 1.00 0.00 C ATOM 837 CG ARG A 54 13.608 -2.445 8.209 1.00 0.00 C ATOM 838 CD ARG A 54 13.248 -1.616 9.432 1.00 0.00 C ATOM 839 NE ARG A 54 11.802 -1.507 9.612 1.00 0.00 N ATOM 840 CZ ARG A 54 11.210 -0.524 10.289 1.00 0.00 C ATOM 841 NH1 ARG A 54 11.935 0.429 10.862 1.00 0.00 N ATOM 842 NH2 ARG A 54 9.889 -0.496 10.396 1.00 0.00 N ATOM 0 H ARG A 54 13.712 -1.837 5.727 1.00 0.00 H new ATOM 0 HA ARG A 54 16.462 -2.617 6.223 1.00 0.00 H new ATOM 0 HB2 ARG A 54 15.699 -2.707 8.569 1.00 0.00 H new ATOM 0 HB3 ARG A 54 15.287 -1.180 7.814 1.00 0.00 H new ATOM 0 HG2 ARG A 54 12.962 -2.167 7.376 1.00 0.00 H new ATOM 0 HG3 ARG A 54 13.426 -3.500 8.416 1.00 0.00 H new ATOM 0 HD2 ARG A 54 13.691 -2.068 10.320 1.00 0.00 H new ATOM 0 HD3 ARG A 54 13.677 -0.619 9.334 1.00 0.00 H new ATOM 0 HE ARG A 54 11.211 -2.226 9.195 1.00 0.00 H new ATOM 0 HH11 ARG A 54 12.952 0.412 10.785 1.00 0.00 H new ATOM 0 HH12 ARG A 54 11.475 1.179 11.379 1.00 0.00 H new ATOM 0 HH21 ARG A 54 9.326 -1.227 9.960 1.00 0.00 H new ATOM 0 HH22 ARG A 54 9.435 0.256 10.914 1.00 0.00 H new ATOM 856 N ASP A 55 14.073 -4.795 5.979 1.00 0.00 N ATOM 857 CA ASP A 55 13.772 -6.220 5.933 1.00 0.00 C ATOM 858 C ASP A 55 14.454 -6.870 4.736 1.00 0.00 C ATOM 859 O ASP A 55 15.083 -7.922 4.859 1.00 0.00 O ATOM 860 CB ASP A 55 12.261 -6.443 5.860 1.00 0.00 C ATOM 861 CG ASP A 55 11.832 -7.726 6.545 1.00 0.00 C ATOM 862 OD1 ASP A 55 12.378 -8.794 6.200 1.00 0.00 O ATOM 863 OD2 ASP A 55 10.949 -7.662 7.426 1.00 0.00 O ATOM 0 H ASP A 55 13.331 -4.195 5.618 1.00 0.00 H new ATOM 0 HA ASP A 55 14.152 -6.681 6.845 1.00 0.00 H new ATOM 0 HB2 ASP A 55 11.749 -5.599 6.322 1.00 0.00 H new ATOM 0 HB3 ASP A 55 11.951 -6.471 4.815 1.00 0.00 H new ATOM 868 N VAL A 56 14.328 -6.230 3.579 1.00 0.00 N ATOM 869 CA VAL A 56 14.936 -6.732 2.355 1.00 0.00 C ATOM 870 C VAL A 56 16.380 -6.263 2.243 1.00 0.00 C ATOM 871 O VAL A 56 17.231 -6.959 1.687 1.00 0.00 O ATOM 872 CB VAL A 56 14.165 -6.261 1.108 1.00 0.00 C ATOM 873 CG1 VAL A 56 14.695 -6.952 -0.137 1.00 0.00 C ATOM 874 CG2 VAL A 56 12.673 -6.508 1.272 1.00 0.00 C ATOM 0 H VAL A 56 13.808 -5.360 3.464 1.00 0.00 H new ATOM 0 HA VAL A 56 14.902 -7.820 2.403 1.00 0.00 H new ATOM 0 HB VAL A 56 14.318 -5.188 0.994 1.00 0.00 H new ATOM 0 HG11 VAL A 56 14.139 -6.608 -1.009 1.00 0.00 H new ATOM 0 HG12 VAL A 56 15.751 -6.714 -0.263 1.00 0.00 H new ATOM 0 HG13 VAL A 56 14.576 -8.030 -0.033 1.00 0.00 H new ATOM 0 HG21 VAL A 56 12.148 -6.168 0.380 1.00 0.00 H new ATOM 0 HG22 VAL A 56 12.494 -7.574 1.414 1.00 0.00 H new ATOM 0 HG23 VAL A 56 12.307 -5.960 2.140 1.00 0.00 H new ATOM 884 N GLY A 57 16.645 -5.074 2.771 1.00 0.00 N ATOM 885 CA GLY A 57 17.986 -4.521 2.720 1.00 0.00 C ATOM 886 C GLY A 57 18.301 -3.886 1.379 1.00 0.00 C ATOM 887 O GLY A 57 19.468 -3.734 1.018 1.00 0.00 O ATOM 0 H GLY A 57 15.955 -4.482 3.234 1.00 0.00 H new ATOM 0 HA2 GLY A 57 18.098 -3.775 3.507 1.00 0.00 H new ATOM 0 HA3 GLY A 57 18.709 -5.311 2.924 1.00 0.00 H new ATOM 891 N SER A 58 17.259 -3.514 0.641 1.00 0.00 N ATOM 892 CA SER A 58 17.433 -2.892 -0.667 1.00 0.00 C ATOM 893 C SER A 58 16.723 -1.544 -0.727 1.00 0.00 C ATOM 894 O SER A 58 15.833 -1.264 0.076 1.00 0.00 O ATOM 895 CB SER A 58 16.901 -3.812 -1.768 1.00 0.00 C ATOM 896 OG SER A 58 15.883 -4.664 -1.271 1.00 0.00 O ATOM 0 H SER A 58 16.287 -3.632 0.926 1.00 0.00 H new ATOM 0 HA SER A 58 18.499 -2.728 -0.825 1.00 0.00 H new ATOM 0 HB2 SER A 58 16.509 -3.213 -2.590 1.00 0.00 H new ATOM 0 HB3 SER A 58 17.717 -4.412 -2.172 1.00 0.00 H new ATOM 0 HG SER A 58 15.008 -4.337 -1.568 1.00 0.00 H new ATOM 902 N THR A 59 17.124 -0.711 -1.682 1.00 0.00 N ATOM 903 CA THR A 59 16.526 0.608 -1.846 1.00 0.00 C ATOM 904 C THR A 59 15.247 0.519 -2.677 1.00 0.00 C ATOM 905 O THR A 59 15.292 0.242 -3.877 1.00 0.00 O ATOM 906 CB THR A 59 17.544 1.564 -2.490 1.00 0.00 C ATOM 907 OG1 THR A 59 18.036 2.485 -1.535 1.00 0.00 O ATOM 908 CG2 THR A 59 16.995 2.369 -3.652 1.00 0.00 C ATOM 0 H THR A 59 17.861 -0.927 -2.354 1.00 0.00 H new ATOM 0 HA THR A 59 16.255 1.002 -0.866 1.00 0.00 H new ATOM 0 HB THR A 59 18.331 0.913 -2.871 1.00 0.00 H new ATOM 0 HG1 THR A 59 18.684 3.084 -1.962 1.00 0.00 H new ATOM 0 HG21 THR A 59 17.777 3.017 -4.048 1.00 0.00 H new ATOM 0 HG22 THR A 59 16.654 1.692 -4.435 1.00 0.00 H new ATOM 0 HG23 THR A 59 16.158 2.978 -3.310 1.00 0.00 H new ATOM 916 N ILE A 60 14.110 0.755 -2.032 1.00 0.00 N ATOM 917 CA ILE A 60 12.822 0.701 -2.711 1.00 0.00 C ATOM 918 C ILE A 60 12.706 1.815 -3.754 1.00 0.00 C ATOM 919 O ILE A 60 12.901 2.989 -3.437 1.00 0.00 O ATOM 920 CB ILE A 60 11.655 0.814 -1.708 1.00 0.00 C ATOM 921 CG1 ILE A 60 10.329 0.479 -2.394 1.00 0.00 C ATOM 922 CG2 ILE A 60 11.605 2.205 -1.090 1.00 0.00 C ATOM 923 CD1 ILE A 60 9.778 -0.878 -2.014 1.00 0.00 C ATOM 0 H ILE A 60 14.055 0.985 -1.040 1.00 0.00 H new ATOM 0 HA ILE A 60 12.762 -0.265 -3.212 1.00 0.00 H new ATOM 0 HB ILE A 60 11.821 0.095 -0.906 1.00 0.00 H new ATOM 0 HG12 ILE A 60 9.595 1.244 -2.141 1.00 0.00 H new ATOM 0 HG13 ILE A 60 10.469 0.516 -3.474 1.00 0.00 H new ATOM 0 HG21 ILE A 60 10.774 2.261 -0.386 1.00 0.00 H new ATOM 0 HG22 ILE A 60 12.539 2.404 -0.565 1.00 0.00 H new ATOM 0 HG23 ILE A 60 11.465 2.947 -1.876 1.00 0.00 H new ATOM 0 HD11 ILE A 60 8.837 -1.048 -2.537 1.00 0.00 H new ATOM 0 HD12 ILE A 60 10.493 -1.652 -2.292 1.00 0.00 H new ATOM 0 HD13 ILE A 60 9.606 -0.913 -0.938 1.00 0.00 H new ATOM 935 N PRO A 61 12.397 1.470 -5.020 1.00 0.00 N ATOM 936 CA PRO A 61 12.269 2.447 -6.099 1.00 0.00 C ATOM 937 C PRO A 61 10.877 3.072 -6.176 1.00 0.00 C ATOM 938 O PRO A 61 10.393 3.389 -7.263 1.00 0.00 O ATOM 939 CB PRO A 61 12.552 1.625 -7.367 1.00 0.00 C ATOM 940 CG PRO A 61 12.643 0.188 -6.938 1.00 0.00 C ATOM 941 CD PRO A 61 12.159 0.113 -5.515 1.00 0.00 C ATOM 0 HA PRO A 61 12.946 3.288 -5.954 1.00 0.00 H new ATOM 0 HB2 PRO A 61 11.758 1.760 -8.101 1.00 0.00 H new ATOM 0 HB3 PRO A 61 13.480 1.948 -7.838 1.00 0.00 H new ATOM 0 HG2 PRO A 61 12.035 -0.445 -7.584 1.00 0.00 H new ATOM 0 HG3 PRO A 61 13.669 -0.171 -7.014 1.00 0.00 H new ATOM 0 HD2 PRO A 61 11.105 -0.159 -5.460 1.00 0.00 H new ATOM 0 HD3 PRO A 61 12.710 -0.630 -4.939 1.00 0.00 H new ATOM 949 N TYR A 62 10.235 3.255 -5.025 1.00 0.00 N ATOM 950 CA TYR A 62 8.904 3.847 -4.980 1.00 0.00 C ATOM 951 C TYR A 62 8.943 5.224 -4.328 1.00 0.00 C ATOM 952 O TYR A 62 9.755 5.480 -3.440 1.00 0.00 O ATOM 953 CB TYR A 62 7.944 2.936 -4.217 1.00 0.00 C ATOM 954 CG TYR A 62 7.684 1.618 -4.909 1.00 0.00 C ATOM 955 CD1 TYR A 62 7.366 1.574 -6.260 1.00 0.00 C ATOM 956 CD2 TYR A 62 7.756 0.420 -4.211 1.00 0.00 C ATOM 957 CE1 TYR A 62 7.127 0.370 -6.897 1.00 0.00 C ATOM 958 CE2 TYR A 62 7.518 -0.787 -4.840 1.00 0.00 C ATOM 959 CZ TYR A 62 7.204 -0.807 -6.182 1.00 0.00 C ATOM 960 OH TYR A 62 6.968 -2.008 -6.812 1.00 0.00 O ATOM 0 H TYR A 62 10.616 3.002 -4.113 1.00 0.00 H new ATOM 0 HA TYR A 62 8.549 3.960 -6.004 1.00 0.00 H new ATOM 0 HB2 TYR A 62 8.351 2.742 -3.225 1.00 0.00 H new ATOM 0 HB3 TYR A 62 6.997 3.456 -4.076 1.00 0.00 H new ATOM 0 HD1 TYR A 62 7.304 2.494 -6.822 1.00 0.00 H new ATOM 0 HD2 TYR A 62 8.002 0.432 -3.159 1.00 0.00 H new ATOM 0 HE1 TYR A 62 6.881 0.351 -7.949 1.00 0.00 H new ATOM 0 HE2 TYR A 62 7.578 -1.710 -4.283 1.00 0.00 H new ATOM 0 HH TYR A 62 7.063 -2.740 -6.167 1.00 0.00 H new ATOM 970 N ASP A 63 8.056 6.108 -4.774 1.00 0.00 N ATOM 971 CA ASP A 63 7.987 7.460 -4.233 1.00 0.00 C ATOM 972 C ASP A 63 6.934 7.550 -3.133 1.00 0.00 C ATOM 973 O ASP A 63 5.769 7.216 -3.347 1.00 0.00 O ATOM 974 CB ASP A 63 7.666 8.462 -5.343 1.00 0.00 C ATOM 975 CG ASP A 63 8.535 8.263 -6.569 1.00 0.00 C ATOM 976 OD1 ASP A 63 9.736 7.964 -6.404 1.00 0.00 O ATOM 977 OD2 ASP A 63 8.014 8.408 -7.695 1.00 0.00 O ATOM 0 H ASP A 63 7.376 5.912 -5.508 1.00 0.00 H new ATOM 0 HA ASP A 63 8.959 7.703 -3.805 1.00 0.00 H new ATOM 0 HB2 ASP A 63 6.617 8.365 -5.624 1.00 0.00 H new ATOM 0 HB3 ASP A 63 7.802 9.475 -4.965 1.00 0.00 H new ATOM 982 N PHE A 64 7.352 8.000 -1.953 1.00 0.00 N ATOM 983 CA PHE A 64 6.442 8.129 -0.822 1.00 0.00 C ATOM 984 C PHE A 64 6.702 9.421 -0.049 1.00 0.00 C ATOM 985 O PHE A 64 7.583 9.472 0.810 1.00 0.00 O ATOM 986 CB PHE A 64 6.592 6.928 0.114 1.00 0.00 C ATOM 987 CG PHE A 64 5.316 6.541 0.804 1.00 0.00 C ATOM 988 CD1 PHE A 64 4.682 7.425 1.663 1.00 0.00 C ATOM 989 CD2 PHE A 64 4.753 5.294 0.596 1.00 0.00 C ATOM 990 CE1 PHE A 64 3.508 7.071 2.299 1.00 0.00 C ATOM 991 CE2 PHE A 64 3.579 4.933 1.229 1.00 0.00 C ATOM 992 CZ PHE A 64 2.955 5.823 2.083 1.00 0.00 C ATOM 0 H PHE A 64 8.313 8.280 -1.757 1.00 0.00 H new ATOM 0 HA PHE A 64 5.424 8.161 -1.211 1.00 0.00 H new ATOM 0 HB2 PHE A 64 6.959 6.076 -0.458 1.00 0.00 H new ATOM 0 HB3 PHE A 64 7.347 7.156 0.866 1.00 0.00 H new ATOM 0 HD1 PHE A 64 5.110 8.401 1.837 1.00 0.00 H new ATOM 0 HD2 PHE A 64 5.237 4.594 -0.069 1.00 0.00 H new ATOM 0 HE1 PHE A 64 3.022 7.769 2.965 1.00 0.00 H new ATOM 0 HE2 PHE A 64 3.150 3.957 1.057 1.00 0.00 H new ATOM 0 HZ PHE A 64 2.038 5.544 2.580 1.00 0.00 H new ATOM 1002 N PRO A 65 5.937 10.487 -0.345 1.00 0.00 N ATOM 1003 CA PRO A 65 6.085 11.777 0.319 1.00 0.00 C ATOM 1004 C PRO A 65 5.218 11.891 1.569 1.00 0.00 C ATOM 1005 O PRO A 65 3.992 11.931 1.483 1.00 0.00 O ATOM 1006 CB PRO A 65 5.604 12.746 -0.754 1.00 0.00 C ATOM 1007 CG PRO A 65 4.539 11.997 -1.488 1.00 0.00 C ATOM 1008 CD PRO A 65 4.867 10.525 -1.360 1.00 0.00 C ATOM 0 HA PRO A 65 7.101 11.956 0.670 1.00 0.00 H new ATOM 0 HB2 PRO A 65 5.212 13.663 -0.313 1.00 0.00 H new ATOM 0 HB3 PRO A 65 6.417 13.035 -1.421 1.00 0.00 H new ATOM 0 HG2 PRO A 65 3.557 12.211 -1.067 1.00 0.00 H new ATOM 0 HG3 PRO A 65 4.509 12.296 -2.536 1.00 0.00 H new ATOM 0 HD2 PRO A 65 3.997 9.948 -1.046 1.00 0.00 H new ATOM 0 HD3 PRO A 65 5.202 10.106 -2.309 1.00 0.00 H new ATOM 1016 N GLU A 66 5.863 11.945 2.732 1.00 0.00 N ATOM 1017 CA GLU A 66 5.144 12.058 3.996 1.00 0.00 C ATOM 1018 C GLU A 66 6.042 12.635 5.086 1.00 0.00 C ATOM 1019 O GLU A 66 7.264 12.678 4.940 1.00 0.00 O ATOM 1020 CB GLU A 66 4.605 10.691 4.427 1.00 0.00 C ATOM 1021 CG GLU A 66 5.688 9.697 4.814 1.00 0.00 C ATOM 1022 CD GLU A 66 5.296 8.843 6.005 1.00 0.00 C ATOM 1023 OE1 GLU A 66 4.186 8.273 5.986 1.00 0.00 O ATOM 1024 OE2 GLU A 66 6.100 8.747 6.956 1.00 0.00 O ATOM 0 H GLU A 66 6.878 11.912 2.824 1.00 0.00 H new ATOM 0 HA GLU A 66 4.305 12.738 3.847 1.00 0.00 H new ATOM 0 HB2 GLU A 66 3.931 10.827 5.273 1.00 0.00 H new ATOM 0 HB3 GLU A 66 4.014 10.271 3.613 1.00 0.00 H new ATOM 0 HG2 GLU A 66 5.904 9.051 3.963 1.00 0.00 H new ATOM 0 HG3 GLU A 66 6.606 10.237 5.045 1.00 0.00 H new ATOM 1031 N LYS A 67 5.426 13.074 6.180 1.00 0.00 N ATOM 1032 CA LYS A 67 6.166 13.648 7.298 1.00 0.00 C ATOM 1033 C LYS A 67 5.444 13.385 8.619 1.00 0.00 C ATOM 1034 O LYS A 67 4.223 13.517 8.703 1.00 0.00 O ATOM 1035 CB LYS A 67 6.351 15.153 7.097 1.00 0.00 C ATOM 1036 CG LYS A 67 7.090 15.510 5.817 1.00 0.00 C ATOM 1037 CD LYS A 67 7.840 16.824 5.953 1.00 0.00 C ATOM 1038 CE LYS A 67 9.158 16.793 5.197 1.00 0.00 C ATOM 1039 NZ LYS A 67 9.007 17.270 3.795 1.00 0.00 N ATOM 0 H LYS A 67 4.416 13.043 6.316 1.00 0.00 H new ATOM 0 HA LYS A 67 7.145 13.171 7.336 1.00 0.00 H new ATOM 0 HB2 LYS A 67 5.372 15.633 7.087 1.00 0.00 H new ATOM 0 HB3 LYS A 67 6.897 15.560 7.948 1.00 0.00 H new ATOM 0 HG2 LYS A 67 7.791 14.714 5.567 1.00 0.00 H new ATOM 0 HG3 LYS A 67 6.380 15.579 4.993 1.00 0.00 H new ATOM 0 HD2 LYS A 67 7.222 17.638 5.575 1.00 0.00 H new ATOM 0 HD3 LYS A 67 8.028 17.029 7.007 1.00 0.00 H new ATOM 0 HE2 LYS A 67 9.888 17.415 5.715 1.00 0.00 H new ATOM 0 HE3 LYS A 67 9.551 15.776 5.194 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 9.929 17.233 3.315 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 8.330 16.661 3.292 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 8.657 18.249 3.797 1.00 0.00 H new ATOM 1053 N PRO A 68 6.190 13.006 9.674 1.00 0.00 N ATOM 1054 CA PRO A 68 5.608 12.726 10.990 1.00 0.00 C ATOM 1055 C PRO A 68 5.122 13.991 11.690 1.00 0.00 C ATOM 1056 O PRO A 68 5.689 15.069 11.512 1.00 0.00 O ATOM 1057 CB PRO A 68 6.768 12.098 11.766 1.00 0.00 C ATOM 1058 CG PRO A 68 7.992 12.649 11.122 1.00 0.00 C ATOM 1059 CD PRO A 68 7.655 12.823 9.667 1.00 0.00 C ATOM 0 HA PRO A 68 4.729 12.085 10.918 1.00 0.00 H new ATOM 0 HB2 PRO A 68 6.725 12.359 12.823 1.00 0.00 H new ATOM 0 HB3 PRO A 68 6.743 11.010 11.705 1.00 0.00 H new ATOM 0 HG2 PRO A 68 8.275 13.600 11.573 1.00 0.00 H new ATOM 0 HG3 PRO A 68 8.837 11.972 11.248 1.00 0.00 H new ATOM 0 HD2 PRO A 68 8.165 13.685 9.237 1.00 0.00 H new ATOM 0 HD3 PRO A 68 7.948 11.953 9.080 1.00 0.00 H new ATOM 1067 N GLY A 69 4.067 13.851 12.487 1.00 0.00 N ATOM 1068 CA GLY A 69 3.521 14.989 13.204 1.00 0.00 C ATOM 1069 C GLY A 69 2.667 14.575 14.385 1.00 0.00 C ATOM 1070 O GLY A 69 1.440 14.649 14.328 1.00 0.00 O ATOM 0 H GLY A 69 3.580 12.969 12.649 1.00 0.00 H new ATOM 0 HA2 GLY A 69 4.338 15.620 13.554 1.00 0.00 H new ATOM 0 HA3 GLY A 69 2.923 15.592 12.521 1.00 0.00 H new ATOM 1074 N VAL A 70 3.317 14.135 15.458 1.00 0.00 N ATOM 1075 CA VAL A 70 2.610 13.706 16.658 1.00 0.00 C ATOM 1076 C VAL A 70 1.918 14.886 17.340 1.00 0.00 C ATOM 1077 O VAL A 70 0.711 15.078 17.193 1.00 0.00 O ATOM 1078 CB VAL A 70 3.566 13.019 17.656 1.00 0.00 C ATOM 1079 CG1 VAL A 70 2.835 12.635 18.934 1.00 0.00 C ATOM 1080 CG2 VAL A 70 4.213 11.800 17.017 1.00 0.00 C ATOM 0 H VAL A 70 4.333 14.066 15.520 1.00 0.00 H new ATOM 0 HA VAL A 70 1.854 12.986 16.346 1.00 0.00 H new ATOM 0 HB VAL A 70 4.351 13.728 17.920 1.00 0.00 H new ATOM 0 HG11 VAL A 70 3.531 12.153 19.620 1.00 0.00 H new ATOM 0 HG12 VAL A 70 2.426 13.530 19.402 1.00 0.00 H new ATOM 0 HG13 VAL A 70 2.024 11.947 18.696 1.00 0.00 H new ATOM 0 HG21 VAL A 70 4.884 11.327 17.734 1.00 0.00 H new ATOM 0 HG22 VAL A 70 3.440 11.091 16.721 1.00 0.00 H new ATOM 0 HG23 VAL A 70 4.779 12.107 16.138 1.00 0.00 H new ATOM 1090 N LEU A 71 2.688 15.673 18.087 1.00 0.00 N ATOM 1091 CA LEU A 71 2.144 16.830 18.788 1.00 0.00 C ATOM 1092 C LEU A 71 2.719 18.127 18.228 1.00 0.00 C ATOM 1093 O LEU A 71 3.508 18.805 18.888 1.00 0.00 O ATOM 1094 CB LEU A 71 2.441 16.729 20.287 1.00 0.00 C ATOM 1095 CG LEU A 71 1.399 17.382 21.199 1.00 0.00 C ATOM 1096 CD1 LEU A 71 1.401 18.891 21.017 1.00 0.00 C ATOM 1097 CD2 LEU A 71 0.017 16.810 20.922 1.00 0.00 C ATOM 0 H LEU A 71 3.689 15.530 18.222 1.00 0.00 H new ATOM 0 HA LEU A 71 1.064 16.840 18.638 1.00 0.00 H new ATOM 0 HB2 LEU A 71 2.527 15.676 20.555 1.00 0.00 H new ATOM 0 HB3 LEU A 71 3.410 17.188 20.482 1.00 0.00 H new ATOM 0 HG LEU A 71 1.660 17.163 22.234 1.00 0.00 H new ATOM 0 HD11 LEU A 71 0.654 19.338 21.673 1.00 0.00 H new ATOM 0 HD12 LEU A 71 2.386 19.286 21.266 1.00 0.00 H new ATOM 0 HD13 LEU A 71 1.165 19.133 19.981 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -0.712 17.285 21.579 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -0.253 16.999 19.883 1.00 0.00 H new ATOM 0 HD23 LEU A 71 0.024 15.736 21.105 1.00 0.00 H new ATOM 1109 N ASP A 72 2.320 18.467 17.008 1.00 0.00 N ATOM 1110 CA ASP A 72 2.796 19.683 16.358 1.00 0.00 C ATOM 1111 C ASP A 72 1.633 20.612 16.025 1.00 0.00 C ATOM 1112 O ASP A 72 0.940 20.423 15.025 1.00 0.00 O ATOM 1113 CB ASP A 72 3.567 19.336 15.083 1.00 0.00 C ATOM 1114 CG ASP A 72 4.985 18.883 15.370 1.00 0.00 C ATOM 1115 OD1 ASP A 72 5.157 17.957 16.192 1.00 0.00 O ATOM 1116 OD2 ASP A 72 5.923 19.453 14.774 1.00 0.00 O ATOM 0 H ASP A 72 1.668 17.918 16.448 1.00 0.00 H new ATOM 0 HA ASP A 72 3.463 20.198 17.049 1.00 0.00 H new ATOM 0 HB2 ASP A 72 3.039 18.549 14.545 1.00 0.00 H new ATOM 0 HB3 ASP A 72 3.592 20.207 14.429 1.00 0.00 H new ATOM 1121 N ARG A 73 1.427 21.619 16.869 1.00 0.00 N ATOM 1122 CA ARG A 73 0.348 22.579 16.662 1.00 0.00 C ATOM 1123 C ARG A 73 0.782 23.712 15.731 1.00 0.00 C ATOM 1124 O ARG A 73 0.024 24.652 15.493 1.00 0.00 O ATOM 1125 CB ARG A 73 -0.111 23.157 18.002 1.00 0.00 C ATOM 1126 CG ARG A 73 -0.718 22.121 18.935 1.00 0.00 C ATOM 1127 CD ARG A 73 -1.689 22.754 19.919 1.00 0.00 C ATOM 1128 NE ARG A 73 -2.876 23.289 19.255 1.00 0.00 N ATOM 1129 CZ ARG A 73 -3.017 24.560 18.881 1.00 0.00 C ATOM 1130 NH1 ARG A 73 -2.044 25.439 19.095 1.00 0.00 N ATOM 1131 NH2 ARG A 73 -4.135 24.955 18.288 1.00 0.00 N ATOM 0 H ARG A 73 1.992 21.791 17.701 1.00 0.00 H new ATOM 0 HA ARG A 73 -0.482 22.050 16.193 1.00 0.00 H new ATOM 0 HB2 ARG A 73 0.740 23.625 18.497 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -0.844 23.942 17.818 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -1.236 21.362 18.349 1.00 0.00 H new ATOM 0 HG3 ARG A 73 0.076 21.614 19.482 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -1.991 22.011 20.657 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -1.185 23.555 20.460 1.00 0.00 H new ATOM 0 HE ARG A 73 -3.646 22.648 19.066 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -1.180 25.143 19.549 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -2.161 26.410 18.805 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -4.886 24.286 18.119 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -4.244 25.928 18.001 1.00 0.00 H new ATOM 1145 N ARG A 74 2.002 23.617 15.205 1.00 0.00 N ATOM 1146 CA ARG A 74 2.523 24.638 14.301 1.00 0.00 C ATOM 1147 C ARG A 74 2.218 24.278 12.851 1.00 0.00 C ATOM 1148 O ARG A 74 1.613 25.062 12.120 1.00 0.00 O ATOM 1149 CB ARG A 74 4.034 24.798 14.490 1.00 0.00 C ATOM 1150 CG ARG A 74 4.486 24.695 15.938 1.00 0.00 C ATOM 1151 CD ARG A 74 5.987 24.472 16.041 1.00 0.00 C ATOM 1152 NE ARG A 74 6.691 25.677 16.471 1.00 0.00 N ATOM 1153 CZ ARG A 74 8.016 25.805 16.462 1.00 0.00 C ATOM 1154 NH1 ARG A 74 8.783 24.804 16.045 1.00 0.00 N ATOM 1155 NH2 ARG A 74 8.577 26.934 16.871 1.00 0.00 N ATOM 0 H ARG A 74 2.645 22.847 15.389 1.00 0.00 H new ATOM 0 HA ARG A 74 2.034 25.583 14.538 1.00 0.00 H new ATOM 0 HB2 ARG A 74 4.547 24.035 13.904 1.00 0.00 H new ATOM 0 HB3 ARG A 74 4.340 25.765 14.092 1.00 0.00 H new ATOM 0 HG2 ARG A 74 4.216 25.607 16.470 1.00 0.00 H new ATOM 0 HG3 ARG A 74 3.961 23.874 16.426 1.00 0.00 H new ATOM 0 HD2 ARG A 74 6.186 23.665 16.746 1.00 0.00 H new ATOM 0 HD3 ARG A 74 6.373 24.152 15.073 1.00 0.00 H new ATOM 0 HE ARG A 74 6.135 26.467 16.797 1.00 0.00 H new ATOM 0 HH11 ARG A 74 8.357 23.932 15.730 1.00 0.00 H new ATOM 0 HH12 ARG A 74 9.798 24.907 16.040 1.00 0.00 H new ATOM 0 HH21 ARG A 74 7.993 27.706 17.193 1.00 0.00 H new ATOM 0 HH22 ARG A 74 9.592 27.031 16.864 1.00 0.00 H new ATOM 1169 N TRP A 75 2.642 23.087 12.443 1.00 0.00 N ATOM 1170 CA TRP A 75 2.415 22.619 11.082 1.00 0.00 C ATOM 1171 C TRP A 75 1.267 21.616 11.037 1.00 0.00 C ATOM 1172 O TRP A 75 1.257 20.704 10.210 1.00 0.00 O ATOM 1173 CB TRP A 75 3.687 21.980 10.521 1.00 0.00 C ATOM 1174 CG TRP A 75 4.890 22.869 10.614 1.00 0.00 C ATOM 1175 CD1 TRP A 75 5.850 22.849 11.584 1.00 0.00 C ATOM 1176 CD2 TRP A 75 5.260 23.909 9.702 1.00 0.00 C ATOM 1177 NE1 TRP A 75 6.795 23.814 11.332 1.00 0.00 N ATOM 1178 CE2 TRP A 75 6.455 24.478 10.182 1.00 0.00 C ATOM 1179 CE3 TRP A 75 4.698 24.414 8.527 1.00 0.00 C ATOM 1180 CZ2 TRP A 75 7.096 25.526 9.527 1.00 0.00 C ATOM 1181 CZ3 TRP A 75 5.335 25.455 7.877 1.00 0.00 C ATOM 1182 CH2 TRP A 75 6.524 26.000 8.378 1.00 0.00 C ATOM 0 H TRP A 75 3.145 22.428 13.037 1.00 0.00 H new ATOM 0 HA TRP A 75 2.148 23.479 10.468 1.00 0.00 H new ATOM 0 HB2 TRP A 75 3.887 21.053 11.059 1.00 0.00 H new ATOM 0 HB3 TRP A 75 3.521 21.714 9.477 1.00 0.00 H new ATOM 0 HD1 TRP A 75 5.865 22.173 12.426 1.00 0.00 H new ATOM 0 HE1 TRP A 75 7.616 24.005 11.907 1.00 0.00 H new ATOM 0 HE3 TRP A 75 3.782 23.999 8.133 1.00 0.00 H new ATOM 0 HZ2 TRP A 75 8.012 25.950 9.912 1.00 0.00 H new ATOM 0 HZ3 TRP A 75 4.909 25.854 6.968 1.00 0.00 H new ATOM 0 HH2 TRP A 75 6.999 26.811 7.846 1.00 0.00 H new ATOM 1193 N GLN A 76 0.302 21.790 11.934 1.00 0.00 N ATOM 1194 CA GLN A 76 -0.851 20.899 12.000 1.00 0.00 C ATOM 1195 C GLN A 76 -1.674 20.976 10.718 1.00 0.00 C ATOM 1196 O GLN A 76 -1.674 21.996 10.028 1.00 0.00 O ATOM 1197 CB GLN A 76 -1.724 21.251 13.207 1.00 0.00 C ATOM 1198 CG GLN A 76 -2.058 20.056 14.085 1.00 0.00 C ATOM 1199 CD GLN A 76 -3.155 20.357 15.086 1.00 0.00 C ATOM 1200 OE1 GLN A 76 -4.231 20.832 14.722 1.00 0.00 O ATOM 1201 NE2 GLN A 76 -2.889 20.081 16.357 1.00 0.00 N ATOM 0 H GLN A 76 0.295 22.540 12.625 1.00 0.00 H new ATOM 0 HA GLN A 76 -0.485 19.878 12.111 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -1.212 22.002 13.809 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -2.651 21.703 12.855 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -2.365 19.221 13.455 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -1.161 19.740 14.618 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -1.984 19.688 16.615 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -3.590 20.262 17.076 1.00 0.00 H new ATOM 1210 N ARG A 77 -2.375 19.891 10.407 1.00 0.00 N ATOM 1211 CA ARG A 77 -3.206 19.832 9.209 1.00 0.00 C ATOM 1212 C ARG A 77 -4.448 18.980 9.454 1.00 0.00 C ATOM 1213 O ARG A 77 -4.560 18.312 10.482 1.00 0.00 O ATOM 1214 CB ARG A 77 -2.406 19.265 8.035 1.00 0.00 C ATOM 1215 CG ARG A 77 -1.742 17.933 8.338 1.00 0.00 C ATOM 1216 CD ARG A 77 -0.402 17.804 7.631 1.00 0.00 C ATOM 1217 NE ARG A 77 0.290 16.568 7.989 1.00 0.00 N ATOM 1218 CZ ARG A 77 -0.006 15.377 7.473 1.00 0.00 C ATOM 1219 NH1 ARG A 77 -0.978 15.256 6.578 1.00 0.00 N ATOM 1220 NH2 ARG A 77 0.673 14.303 7.854 1.00 0.00 N ATOM 0 H ARG A 77 -2.385 19.039 10.968 1.00 0.00 H new ATOM 0 HA ARG A 77 -3.524 20.846 8.965 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -3.070 19.144 7.179 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -1.641 19.985 7.746 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -1.598 17.834 9.414 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -2.398 17.120 8.028 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -0.557 17.833 6.552 1.00 0.00 H new ATOM 0 HD3 ARG A 77 0.226 18.658 7.886 1.00 0.00 H new ATOM 0 HE ARG A 77 1.044 16.621 8.674 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -1.503 16.078 6.281 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -1.200 14.341 6.187 1.00 0.00 H new ATOM 0 HH21 ARG A 77 1.421 14.390 8.542 1.00 0.00 H new ATOM 0 HH22 ARG A 77 0.447 13.390 7.459 1.00 0.00 H new ATOM 1234 N ARG A 78 -5.377 19.008 8.505 1.00 0.00 N ATOM 1235 CA ARG A 78 -6.608 18.236 8.620 1.00 0.00 C ATOM 1236 C ARG A 78 -6.461 16.878 7.943 1.00 0.00 C ATOM 1237 O ARG A 78 -6.388 16.790 6.717 1.00 0.00 O ATOM 1238 CB ARG A 78 -7.778 19.010 8.006 1.00 0.00 C ATOM 1239 CG ARG A 78 -8.839 19.412 9.017 1.00 0.00 C ATOM 1240 CD ARG A 78 -8.242 20.215 10.163 1.00 0.00 C ATOM 1241 NE ARG A 78 -9.263 20.941 10.914 1.00 0.00 N ATOM 1242 CZ ARG A 78 -9.801 22.090 10.512 1.00 0.00 C ATOM 1243 NH1 ARG A 78 -9.419 22.646 9.369 1.00 0.00 N ATOM 1244 NH2 ARG A 78 -10.724 22.685 11.256 1.00 0.00 N ATOM 0 H ARG A 78 -5.301 19.556 7.648 1.00 0.00 H new ATOM 0 HA ARG A 78 -6.811 18.071 9.678 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -7.394 19.906 7.519 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -8.240 18.399 7.231 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -9.610 20.002 8.521 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -9.324 18.519 9.411 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -7.706 19.544 10.835 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -7.512 20.921 9.769 1.00 0.00 H new ATOM 0 HE ARG A 78 -9.582 20.544 11.798 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -8.709 22.193 8.793 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -9.835 23.527 9.066 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -11.021 22.262 12.135 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -11.137 23.566 10.949 1.00 0.00 H new ATOM 1258 N TYR A 79 -6.421 15.823 8.747 1.00 0.00 N ATOM 1259 CA TYR A 79 -6.285 14.470 8.223 1.00 0.00 C ATOM 1260 C TYR A 79 -7.517 14.065 7.417 1.00 0.00 C ATOM 1261 O TYR A 79 -7.482 13.093 6.662 1.00 0.00 O ATOM 1262 CB TYR A 79 -6.058 13.477 9.366 1.00 0.00 C ATOM 1263 CG TYR A 79 -7.234 13.356 10.307 1.00 0.00 C ATOM 1264 CD1 TYR A 79 -7.412 14.258 11.350 1.00 0.00 C ATOM 1265 CD2 TYR A 79 -8.167 12.338 10.156 1.00 0.00 C ATOM 1266 CE1 TYR A 79 -8.485 14.149 12.213 1.00 0.00 C ATOM 1267 CE2 TYR A 79 -9.244 12.223 11.015 1.00 0.00 C ATOM 1268 CZ TYR A 79 -9.398 13.130 12.041 1.00 0.00 C ATOM 1269 OH TYR A 79 -10.468 13.019 12.898 1.00 0.00 O ATOM 0 H TYR A 79 -6.481 15.878 9.764 1.00 0.00 H new ATOM 0 HA TYR A 79 -5.421 14.453 7.559 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -5.838 12.496 8.945 1.00 0.00 H new ATOM 0 HB3 TYR A 79 -5.180 13.784 9.934 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -6.699 15.058 11.488 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -8.049 11.624 9.354 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -8.608 14.858 13.018 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -9.961 11.426 10.883 1.00 0.00 H new ATOM 0 HH TYR A 79 -10.207 12.488 13.679 1.00 0.00 H new ATOM 1279 N ASP A 80 -8.606 14.813 7.580 1.00 0.00 N ATOM 1280 CA ASP A 80 -9.844 14.523 6.865 1.00 0.00 C ATOM 1281 C ASP A 80 -10.065 15.507 5.717 1.00 0.00 C ATOM 1282 O ASP A 80 -11.188 15.670 5.239 1.00 0.00 O ATOM 1283 CB ASP A 80 -11.032 14.569 7.826 1.00 0.00 C ATOM 1284 CG ASP A 80 -11.139 15.897 8.551 1.00 0.00 C ATOM 1285 OD1 ASP A 80 -10.785 16.932 7.949 1.00 0.00 O ATOM 1286 OD2 ASP A 80 -11.576 15.900 9.722 1.00 0.00 O ATOM 0 H ASP A 80 -8.655 15.622 8.199 1.00 0.00 H new ATOM 0 HA ASP A 80 -9.760 13.521 6.443 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -11.952 14.386 7.271 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -10.936 13.766 8.557 1.00 0.00 H new ATOM 1291 N ASP A 81 -8.992 16.157 5.274 1.00 0.00 N ATOM 1292 CA ASP A 81 -9.084 17.118 4.179 1.00 0.00 C ATOM 1293 C ASP A 81 -9.020 16.404 2.828 1.00 0.00 C ATOM 1294 O ASP A 81 -8.151 15.561 2.606 1.00 0.00 O ATOM 1295 CB ASP A 81 -7.955 18.147 4.280 1.00 0.00 C ATOM 1296 CG ASP A 81 -8.461 19.572 4.158 1.00 0.00 C ATOM 1297 OD1 ASP A 81 -8.909 19.949 3.056 1.00 0.00 O ATOM 1298 OD2 ASP A 81 -8.406 20.310 5.165 1.00 0.00 O ATOM 0 H ASP A 81 -8.053 16.037 5.654 1.00 0.00 H new ATOM 0 HA ASP A 81 -10.042 17.633 4.255 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -7.441 18.027 5.234 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -7.221 17.956 3.497 1.00 0.00 H new ATOM 1303 N PRO A 82 -9.942 16.730 1.903 1.00 0.00 N ATOM 1304 CA PRO A 82 -9.977 16.109 0.573 1.00 0.00 C ATOM 1305 C PRO A 82 -8.733 16.430 -0.249 1.00 0.00 C ATOM 1306 O PRO A 82 -8.330 15.650 -1.111 1.00 0.00 O ATOM 1307 CB PRO A 82 -11.222 16.720 -0.081 1.00 0.00 C ATOM 1308 CG PRO A 82 -11.469 17.983 0.667 1.00 0.00 C ATOM 1309 CD PRO A 82 -11.016 17.724 2.075 1.00 0.00 C ATOM 0 HA PRO A 82 -10.006 15.021 0.636 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -11.056 16.915 -1.141 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -12.076 16.046 -0.011 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -10.917 18.813 0.226 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -12.525 18.253 0.640 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -10.652 18.632 2.555 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -11.826 17.339 2.695 1.00 0.00 H new ATOM 1317 N GLU A 83 -8.130 17.582 0.023 1.00 0.00 N ATOM 1318 CA GLU A 83 -6.931 18.004 -0.692 1.00 0.00 C ATOM 1319 C GLU A 83 -5.804 16.993 -0.507 1.00 0.00 C ATOM 1320 O GLU A 83 -5.068 16.688 -1.445 1.00 0.00 O ATOM 1321 CB GLU A 83 -6.480 19.382 -0.207 1.00 0.00 C ATOM 1322 CG GLU A 83 -6.249 19.453 1.294 1.00 0.00 C ATOM 1323 CD GLU A 83 -5.720 20.803 1.739 1.00 0.00 C ATOM 1324 OE1 GLU A 83 -6.448 21.807 1.584 1.00 0.00 O ATOM 1325 OE2 GLU A 83 -4.578 20.857 2.242 1.00 0.00 O ATOM 0 H GLU A 83 -8.451 18.240 0.733 1.00 0.00 H new ATOM 0 HA GLU A 83 -7.173 18.062 -1.753 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -5.559 19.655 -0.721 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -7.232 20.120 -0.486 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -7.185 19.245 1.812 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -5.543 18.676 1.586 1.00 0.00 H new ATOM 1332 N MET A 84 -5.680 16.473 0.711 1.00 0.00 N ATOM 1333 CA MET A 84 -4.647 15.492 1.023 1.00 0.00 C ATOM 1334 C MET A 84 -5.139 14.079 0.723 1.00 0.00 C ATOM 1335 O MET A 84 -4.361 13.208 0.335 1.00 0.00 O ATOM 1336 CB MET A 84 -4.240 15.607 2.495 1.00 0.00 C ATOM 1337 CG MET A 84 -3.246 14.546 2.943 1.00 0.00 C ATOM 1338 SD MET A 84 -4.047 13.126 3.712 1.00 0.00 S ATOM 1339 CE MET A 84 -5.000 13.928 5.000 1.00 0.00 C ATOM 0 H MET A 84 -6.283 16.715 1.498 1.00 0.00 H new ATOM 0 HA MET A 84 -3.778 15.694 0.397 1.00 0.00 H new ATOM 0 HB2 MET A 84 -3.807 16.592 2.666 1.00 0.00 H new ATOM 0 HB3 MET A 84 -5.134 15.539 3.116 1.00 0.00 H new ATOM 0 HG2 MET A 84 -2.667 14.210 2.083 1.00 0.00 H new ATOM 0 HG3 MET A 84 -2.542 14.988 3.649 1.00 0.00 H new ATOM 0 HE1 MET A 84 -5.063 13.272 5.868 1.00 0.00 H new ATOM 0 HE2 MET A 84 -4.514 14.861 5.285 1.00 0.00 H new ATOM 0 HE3 MET A 84 -6.004 14.140 4.632 1.00 0.00 H new ATOM 1349 N ILE A 85 -6.438 13.864 0.904 1.00 0.00 N ATOM 1350 CA ILE A 85 -7.044 12.563 0.653 1.00 0.00 C ATOM 1351 C ILE A 85 -7.073 12.251 -0.842 1.00 0.00 C ATOM 1352 O ILE A 85 -6.794 11.127 -1.257 1.00 0.00 O ATOM 1353 CB ILE A 85 -8.479 12.502 1.223 1.00 0.00 C ATOM 1354 CG1 ILE A 85 -8.442 12.542 2.751 1.00 0.00 C ATOM 1355 CG2 ILE A 85 -9.209 11.256 0.737 1.00 0.00 C ATOM 1356 CD1 ILE A 85 -9.652 13.206 3.368 1.00 0.00 C ATOM 0 H ILE A 85 -7.093 14.577 1.225 1.00 0.00 H new ATOM 0 HA ILE A 85 -6.432 11.815 1.157 1.00 0.00 H new ATOM 0 HB ILE A 85 -9.027 13.372 0.862 1.00 0.00 H new ATOM 0 HG12 ILE A 85 -8.363 11.523 3.131 1.00 0.00 H new ATOM 0 HG13 ILE A 85 -7.545 13.072 3.071 1.00 0.00 H new ATOM 0 HG21 ILE A 85 -10.216 11.239 1.153 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -9.266 11.269 -0.351 1.00 0.00 H new ATOM 0 HG23 ILE A 85 -8.667 10.367 1.061 1.00 0.00 H new ATOM 0 HD11 ILE A 85 -9.557 13.198 4.454 1.00 0.00 H new ATOM 0 HD12 ILE A 85 -9.720 14.236 3.017 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -10.552 12.663 3.078 1.00 0.00 H new ATOM 1368 N ASP A 86 -7.413 13.255 -1.644 1.00 0.00 N ATOM 1369 CA ASP A 86 -7.481 13.090 -3.093 1.00 0.00 C ATOM 1370 C ASP A 86 -6.178 12.513 -3.642 1.00 0.00 C ATOM 1371 O ASP A 86 -6.190 11.665 -4.534 1.00 0.00 O ATOM 1372 CB ASP A 86 -7.781 14.431 -3.766 1.00 0.00 C ATOM 1373 CG ASP A 86 -9.263 14.633 -4.016 1.00 0.00 C ATOM 1374 OD1 ASP A 86 -9.992 14.941 -3.049 1.00 0.00 O ATOM 1375 OD2 ASP A 86 -9.695 14.484 -5.178 1.00 0.00 O ATOM 0 H ASP A 86 -7.646 14.192 -1.315 1.00 0.00 H new ATOM 0 HA ASP A 86 -8.287 12.390 -3.314 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -7.407 15.241 -3.139 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -7.244 14.487 -4.713 1.00 0.00 H new ATOM 1380 N GLU A 87 -5.056 12.976 -3.100 1.00 0.00 N ATOM 1381 CA GLU A 87 -3.747 12.504 -3.533 1.00 0.00 C ATOM 1382 C GLU A 87 -3.402 11.174 -2.873 1.00 0.00 C ATOM 1383 O GLU A 87 -2.911 10.254 -3.525 1.00 0.00 O ATOM 1384 CB GLU A 87 -2.672 13.543 -3.207 1.00 0.00 C ATOM 1385 CG GLU A 87 -2.842 14.852 -3.962 1.00 0.00 C ATOM 1386 CD GLU A 87 -2.734 14.676 -5.464 1.00 0.00 C ATOM 1387 OE1 GLU A 87 -3.656 14.078 -6.059 1.00 0.00 O ATOM 1388 OE2 GLU A 87 -1.731 15.138 -6.045 1.00 0.00 O ATOM 0 H GLU A 87 -5.028 13.678 -2.360 1.00 0.00 H new ATOM 0 HA GLU A 87 -3.782 12.355 -4.612 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -2.688 13.746 -2.136 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -1.692 13.125 -3.438 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -3.813 15.284 -3.719 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -2.085 15.561 -3.627 1.00 0.00 H new ATOM 1395 N ARG A 88 -3.666 11.077 -1.575 1.00 0.00 N ATOM 1396 CA ARG A 88 -3.386 9.856 -0.828 1.00 0.00 C ATOM 1397 C ARG A 88 -4.131 8.665 -1.430 1.00 0.00 C ATOM 1398 O ARG A 88 -3.747 7.513 -1.225 1.00 0.00 O ATOM 1399 CB ARG A 88 -3.777 10.032 0.642 1.00 0.00 C ATOM 1400 CG ARG A 88 -2.588 10.054 1.588 1.00 0.00 C ATOM 1401 CD ARG A 88 -1.664 11.226 1.295 1.00 0.00 C ATOM 1402 NE ARG A 88 -0.983 11.699 2.498 1.00 0.00 N ATOM 1403 CZ ARG A 88 0.119 12.446 2.480 1.00 0.00 C ATOM 1404 NH1 ARG A 88 0.667 12.808 1.325 1.00 0.00 N ATOM 1405 NH2 ARG A 88 0.675 12.834 3.620 1.00 0.00 N ATOM 0 H ARG A 88 -4.073 11.828 -1.018 1.00 0.00 H new ATOM 0 HA ARG A 88 -2.316 9.658 -0.890 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -4.336 10.961 0.752 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -4.446 9.222 0.931 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -2.942 10.117 2.617 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -2.033 9.120 1.498 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -0.924 10.927 0.553 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -2.240 12.042 0.860 1.00 0.00 H new ATOM 0 HE ARG A 88 -1.374 11.442 3.404 1.00 0.00 H new ATOM 0 HH11 ARG A 88 0.243 12.514 0.445 1.00 0.00 H new ATOM 0 HH12 ARG A 88 1.511 13.380 1.318 1.00 0.00 H new ATOM 0 HH21 ARG A 88 0.258 12.560 4.510 1.00 0.00 H new ATOM 0 HH22 ARG A 88 1.519 13.406 3.607 1.00 0.00 H new ATOM 1419 N ARG A 89 -5.199 8.951 -2.171 1.00 0.00 N ATOM 1420 CA ARG A 89 -5.997 7.905 -2.798 1.00 0.00 C ATOM 1421 C ARG A 89 -5.207 7.188 -3.888 1.00 0.00 C ATOM 1422 O ARG A 89 -5.226 5.960 -3.972 1.00 0.00 O ATOM 1423 CB ARG A 89 -7.275 8.498 -3.391 1.00 0.00 C ATOM 1424 CG ARG A 89 -8.392 7.482 -3.559 1.00 0.00 C ATOM 1425 CD ARG A 89 -9.682 8.141 -4.020 1.00 0.00 C ATOM 1426 NE ARG A 89 -10.854 7.572 -3.358 1.00 0.00 N ATOM 1427 CZ ARG A 89 -12.044 8.169 -3.315 1.00 0.00 C ATOM 1428 NH1 ARG A 89 -12.223 9.350 -3.892 1.00 0.00 N ATOM 1429 NH2 ARG A 89 -13.056 7.581 -2.694 1.00 0.00 N ATOM 0 H ARG A 89 -5.530 9.899 -2.351 1.00 0.00 H new ATOM 0 HA ARG A 89 -6.259 7.178 -2.029 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -7.623 9.307 -2.748 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -7.046 8.938 -4.361 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -8.090 6.725 -4.283 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -8.563 6.968 -2.613 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -9.635 9.211 -3.818 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -9.783 8.025 -5.099 1.00 0.00 H new ATOM 0 HE ARG A 89 -10.755 6.665 -2.902 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -11.447 9.806 -4.372 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -13.137 9.802 -3.856 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -12.923 6.672 -2.250 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -13.968 8.037 -2.660 1.00 0.00 H new ATOM 1443 N ILE A 90 -4.513 7.957 -4.721 1.00 0.00 N ATOM 1444 CA ILE A 90 -3.722 7.381 -5.803 1.00 0.00 C ATOM 1445 C ILE A 90 -2.258 7.246 -5.405 1.00 0.00 C ATOM 1446 O ILE A 90 -1.820 7.817 -4.405 1.00 0.00 O ATOM 1447 CB ILE A 90 -3.821 8.207 -7.104 1.00 0.00 C ATOM 1448 CG1 ILE A 90 -3.670 9.705 -6.820 1.00 0.00 C ATOM 1449 CG2 ILE A 90 -5.142 7.930 -7.804 1.00 0.00 C ATOM 1450 CD1 ILE A 90 -2.261 10.112 -6.447 1.00 0.00 C ATOM 0 H ILE A 90 -4.482 8.975 -4.668 1.00 0.00 H new ATOM 0 HA ILE A 90 -4.139 6.392 -5.992 1.00 0.00 H new ATOM 0 HB ILE A 90 -3.004 7.906 -7.760 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -3.980 10.266 -7.701 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -4.346 9.983 -6.011 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -5.199 8.519 -8.720 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -5.209 6.870 -8.049 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -5.967 8.203 -7.146 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -2.230 11.185 -6.260 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -1.954 9.578 -5.548 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -1.583 9.866 -7.264 1.00 0.00 H new ATOM 1462 N GLY A 91 -1.507 6.480 -6.189 1.00 0.00 N ATOM 1463 CA GLY A 91 -0.100 6.277 -5.901 1.00 0.00 C ATOM 1464 C GLY A 91 0.149 5.018 -5.093 1.00 0.00 C ATOM 1465 O GLY A 91 1.194 4.382 -5.226 1.00 0.00 O ATOM 0 H GLY A 91 -1.848 5.996 -7.019 1.00 0.00 H new ATOM 0 HA2 GLY A 91 0.455 6.220 -6.837 1.00 0.00 H new ATOM 0 HA3 GLY A 91 0.284 7.138 -5.354 1.00 0.00 H new ATOM 1469 N LEU A 92 -0.815 4.658 -4.251 1.00 0.00 N ATOM 1470 CA LEU A 92 -0.698 3.467 -3.418 1.00 0.00 C ATOM 1471 C LEU A 92 -0.866 2.200 -4.250 1.00 0.00 C ATOM 1472 O LEU A 92 -0.071 1.266 -4.145 1.00 0.00 O ATOM 1473 CB LEU A 92 -1.742 3.498 -2.300 1.00 0.00 C ATOM 1474 CG LEU A 92 -1.725 4.754 -1.430 1.00 0.00 C ATOM 1475 CD1 LEU A 92 -3.047 4.912 -0.695 1.00 0.00 C ATOM 1476 CD2 LEU A 92 -0.567 4.703 -0.444 1.00 0.00 C ATOM 0 H LEU A 92 -1.686 5.175 -4.128 1.00 0.00 H new ATOM 0 HA LEU A 92 0.299 3.460 -2.977 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -2.732 3.397 -2.746 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -1.591 2.629 -1.659 1.00 0.00 H new ATOM 0 HG LEU A 92 -1.587 5.620 -2.077 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -3.016 5.812 -0.080 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -3.858 4.994 -1.419 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -3.215 4.043 -0.058 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -0.570 5.605 0.168 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -0.674 3.829 0.198 1.00 0.00 H new ATOM 0 HD23 LEU A 92 0.374 4.638 -0.991 1.00 0.00 H new ATOM 1488 N GLU A 93 -1.906 2.176 -5.078 1.00 0.00 N ATOM 1489 CA GLU A 93 -2.181 1.023 -5.930 1.00 0.00 C ATOM 1490 C GLU A 93 -0.967 0.673 -6.785 1.00 0.00 C ATOM 1491 O GLU A 93 -0.573 -0.490 -6.874 1.00 0.00 O ATOM 1492 CB GLU A 93 -3.390 1.299 -6.826 1.00 0.00 C ATOM 1493 CG GLU A 93 -3.340 2.649 -7.524 1.00 0.00 C ATOM 1494 CD GLU A 93 -3.031 2.529 -9.003 1.00 0.00 C ATOM 1495 OE1 GLU A 93 -2.375 1.541 -9.395 1.00 0.00 O ATOM 1496 OE2 GLU A 93 -3.442 3.425 -9.771 1.00 0.00 O ATOM 0 H GLU A 93 -2.572 2.942 -5.177 1.00 0.00 H new ATOM 0 HA GLU A 93 -2.403 0.173 -5.285 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -3.460 0.514 -7.579 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -4.297 1.245 -6.224 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -4.297 3.156 -7.396 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -2.583 3.272 -7.048 1.00 0.00 H new ATOM 1503 N ARG A 94 -0.377 1.687 -7.412 1.00 0.00 N ATOM 1504 CA ARG A 94 0.794 1.483 -8.257 1.00 0.00 C ATOM 1505 C ARG A 94 1.942 0.878 -7.455 1.00 0.00 C ATOM 1506 O ARG A 94 2.693 0.043 -7.957 1.00 0.00 O ATOM 1507 CB ARG A 94 1.234 2.809 -8.883 1.00 0.00 C ATOM 1508 CG ARG A 94 0.458 3.173 -10.139 1.00 0.00 C ATOM 1509 CD ARG A 94 0.052 4.638 -10.142 1.00 0.00 C ATOM 1510 NE ARG A 94 1.009 5.471 -10.868 1.00 0.00 N ATOM 1511 CZ ARG A 94 0.730 6.685 -11.337 1.00 0.00 C ATOM 1512 NH1 ARG A 94 -0.475 7.212 -11.158 1.00 0.00 N ATOM 1513 NH2 ARG A 94 1.659 7.374 -11.986 1.00 0.00 N ATOM 0 H ARG A 94 -0.690 2.656 -7.351 1.00 0.00 H new ATOM 0 HA ARG A 94 0.524 0.788 -9.052 1.00 0.00 H new ATOM 0 HB2 ARG A 94 1.116 3.606 -8.148 1.00 0.00 H new ATOM 0 HB3 ARG A 94 2.295 2.753 -9.124 1.00 0.00 H new ATOM 0 HG2 ARG A 94 1.068 2.962 -11.018 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -0.432 2.548 -10.211 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -0.934 4.740 -10.595 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -0.031 4.993 -9.115 1.00 0.00 H new ATOM 0 HE ARG A 94 1.946 5.100 -11.024 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -1.193 6.686 -10.659 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -0.683 8.143 -11.519 1.00 0.00 H new ATOM 0 HH21 ARG A 94 2.587 6.974 -12.125 1.00 0.00 H new ATOM 0 HH22 ARG A 94 1.446 8.304 -12.346 1.00 0.00 H new ATOM 1527 N PHE A 95 2.066 1.305 -6.202 1.00 0.00 N ATOM 1528 CA PHE A 95 3.118 0.805 -5.323 1.00 0.00 C ATOM 1529 C PHE A 95 2.960 -0.694 -5.082 1.00 0.00 C ATOM 1530 O PHE A 95 3.934 -1.392 -4.797 1.00 0.00 O ATOM 1531 CB PHE A 95 3.088 1.556 -3.989 1.00 0.00 C ATOM 1532 CG PHE A 95 4.146 1.114 -3.017 1.00 0.00 C ATOM 1533 CD1 PHE A 95 4.045 -0.108 -2.369 1.00 0.00 C ATOM 1534 CD2 PHE A 95 5.241 1.921 -2.748 1.00 0.00 C ATOM 1535 CE1 PHE A 95 5.014 -0.515 -1.473 1.00 0.00 C ATOM 1536 CE2 PHE A 95 6.212 1.520 -1.851 1.00 0.00 C ATOM 1537 CZ PHE A 95 6.099 0.299 -1.213 1.00 0.00 C ATOM 0 H PHE A 95 1.451 1.996 -5.772 1.00 0.00 H new ATOM 0 HA PHE A 95 4.079 0.975 -5.809 1.00 0.00 H new ATOM 0 HB2 PHE A 95 3.207 2.622 -4.181 1.00 0.00 H new ATOM 0 HB3 PHE A 95 2.108 1.423 -3.530 1.00 0.00 H new ATOM 0 HD1 PHE A 95 3.199 -0.749 -2.567 1.00 0.00 H new ATOM 0 HD2 PHE A 95 5.336 2.875 -3.246 1.00 0.00 H new ATOM 0 HE1 PHE A 95 4.923 -1.469 -0.976 1.00 0.00 H new ATOM 0 HE2 PHE A 95 7.058 2.160 -1.648 1.00 0.00 H new ATOM 0 HZ PHE A 95 6.858 -0.018 -0.513 1.00 0.00 H new ATOM 1547 N LEU A 96 1.728 -1.183 -5.194 1.00 0.00 N ATOM 1548 CA LEU A 96 1.445 -2.598 -4.985 1.00 0.00 C ATOM 1549 C LEU A 96 1.641 -3.396 -6.271 1.00 0.00 C ATOM 1550 O LEU A 96 2.281 -4.448 -6.269 1.00 0.00 O ATOM 1551 CB LEU A 96 0.014 -2.782 -4.472 1.00 0.00 C ATOM 1552 CG LEU A 96 -0.330 -1.985 -3.213 1.00 0.00 C ATOM 1553 CD1 LEU A 96 -1.736 -2.320 -2.741 1.00 0.00 C ATOM 1554 CD2 LEU A 96 0.685 -2.261 -2.112 1.00 0.00 C ATOM 0 H LEU A 96 0.911 -0.620 -5.428 1.00 0.00 H new ATOM 0 HA LEU A 96 2.146 -2.973 -4.239 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -0.679 -2.498 -5.264 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -0.150 -3.840 -4.270 1.00 0.00 H new ATOM 0 HG LEU A 96 -0.292 -0.923 -3.455 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -1.965 -1.745 -1.844 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -2.452 -2.072 -3.525 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -1.800 -3.384 -2.515 1.00 0.00 H new ATOM 0 HD21 LEU A 96 0.424 -1.685 -1.224 1.00 0.00 H new ATOM 0 HD22 LEU A 96 0.679 -3.324 -1.870 1.00 0.00 H new ATOM 0 HD23 LEU A 96 1.679 -1.972 -2.453 1.00 0.00 H new ATOM 1566 N ASN A 97 1.082 -2.893 -7.368 1.00 0.00 N ATOM 1567 CA ASN A 97 1.189 -3.562 -8.662 1.00 0.00 C ATOM 1568 C ASN A 97 2.633 -3.953 -8.969 1.00 0.00 C ATOM 1569 O ASN A 97 2.943 -5.130 -9.144 1.00 0.00 O ATOM 1570 CB ASN A 97 0.656 -2.654 -9.773 1.00 0.00 C ATOM 1571 CG ASN A 97 -0.730 -2.119 -9.470 1.00 0.00 C ATOM 1572 OD1 ASN A 97 -0.919 -0.915 -9.293 1.00 0.00 O ATOM 1573 ND2 ASN A 97 -1.708 -3.014 -9.409 1.00 0.00 N ATOM 0 H ASN A 97 0.550 -2.023 -7.387 1.00 0.00 H new ATOM 0 HA ASN A 97 0.590 -4.471 -8.615 1.00 0.00 H new ATOM 0 HB2 ASN A 97 1.341 -1.819 -9.915 1.00 0.00 H new ATOM 0 HB3 ASN A 97 0.631 -3.209 -10.711 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -2.662 -2.714 -9.209 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -1.506 -4.002 -9.562 1.00 0.00 H new ATOM 1580 N GLU A 98 3.509 -2.957 -9.036 1.00 0.00 N ATOM 1581 CA GLU A 98 4.918 -3.194 -9.327 1.00 0.00 C ATOM 1582 C GLU A 98 5.563 -4.098 -8.275 1.00 0.00 C ATOM 1583 O GLU A 98 6.611 -4.693 -8.520 1.00 0.00 O ATOM 1584 CB GLU A 98 5.673 -1.866 -9.405 1.00 0.00 C ATOM 1585 CG GLU A 98 7.145 -2.020 -9.750 1.00 0.00 C ATOM 1586 CD GLU A 98 7.558 -1.180 -10.942 1.00 0.00 C ATOM 1587 OE1 GLU A 98 7.223 0.023 -10.967 1.00 0.00 O ATOM 1588 OE2 GLU A 98 8.218 -1.725 -11.852 1.00 0.00 O ATOM 0 H GLU A 98 3.268 -1.976 -8.893 1.00 0.00 H new ATOM 0 HA GLU A 98 4.977 -3.701 -10.290 1.00 0.00 H new ATOM 0 HB2 GLU A 98 5.198 -1.231 -10.153 1.00 0.00 H new ATOM 0 HB3 GLU A 98 5.585 -1.351 -8.448 1.00 0.00 H new ATOM 0 HG2 GLU A 98 7.748 -1.739 -8.886 1.00 0.00 H new ATOM 0 HG3 GLU A 98 7.357 -3.069 -9.959 1.00 0.00 H new ATOM 1595 N LEU A 99 4.935 -4.194 -7.107 1.00 0.00 N ATOM 1596 CA LEU A 99 5.461 -5.024 -6.028 1.00 0.00 C ATOM 1597 C LEU A 99 4.980 -6.466 -6.149 1.00 0.00 C ATOM 1598 O LEU A 99 5.784 -7.390 -6.278 1.00 0.00 O ATOM 1599 CB LEU A 99 5.051 -4.458 -4.672 1.00 0.00 C ATOM 1600 CG LEU A 99 5.825 -5.029 -3.485 1.00 0.00 C ATOM 1601 CD1 LEU A 99 6.162 -3.934 -2.489 1.00 0.00 C ATOM 1602 CD2 LEU A 99 5.031 -6.140 -2.818 1.00 0.00 C ATOM 0 H LEU A 99 4.065 -3.710 -6.884 1.00 0.00 H new ATOM 0 HA LEU A 99 6.548 -5.017 -6.109 1.00 0.00 H new ATOM 0 HB2 LEU A 99 5.184 -3.376 -4.689 1.00 0.00 H new ATOM 0 HB3 LEU A 99 3.988 -4.646 -4.521 1.00 0.00 H new ATOM 0 HG LEU A 99 6.760 -5.451 -3.853 1.00 0.00 H new ATOM 0 HD11 LEU A 99 6.713 -4.361 -1.651 1.00 0.00 H new ATOM 0 HD12 LEU A 99 6.774 -3.175 -2.976 1.00 0.00 H new ATOM 0 HD13 LEU A 99 5.242 -3.479 -2.123 1.00 0.00 H new ATOM 0 HD21 LEU A 99 5.597 -6.536 -1.975 1.00 0.00 H new ATOM 0 HD22 LEU A 99 4.079 -5.744 -2.463 1.00 0.00 H new ATOM 0 HD23 LEU A 99 4.847 -6.938 -3.537 1.00 0.00 H new ATOM 1614 N TYR A 100 3.667 -6.655 -6.097 1.00 0.00 N ATOM 1615 CA TYR A 100 3.081 -7.987 -6.192 1.00 0.00 C ATOM 1616 C TYR A 100 3.219 -8.554 -7.601 1.00 0.00 C ATOM 1617 O TYR A 100 3.296 -9.770 -7.785 1.00 0.00 O ATOM 1618 CB TYR A 100 1.607 -7.947 -5.785 1.00 0.00 C ATOM 1619 CG TYR A 100 1.396 -7.694 -4.309 1.00 0.00 C ATOM 1620 CD1 TYR A 100 1.393 -6.402 -3.798 1.00 0.00 C ATOM 1621 CD2 TYR A 100 1.202 -8.749 -3.426 1.00 0.00 C ATOM 1622 CE1 TYR A 100 1.203 -6.168 -2.450 1.00 0.00 C ATOM 1623 CE2 TYR A 100 1.011 -8.523 -2.075 1.00 0.00 C ATOM 1624 CZ TYR A 100 1.012 -7.231 -1.593 1.00 0.00 C ATOM 1625 OH TYR A 100 0.822 -7.001 -0.250 1.00 0.00 O ATOM 0 H TYR A 100 2.987 -5.902 -5.989 1.00 0.00 H new ATOM 0 HA TYR A 100 3.624 -8.641 -5.509 1.00 0.00 H new ATOM 0 HB2 TYR A 100 1.102 -7.167 -6.355 1.00 0.00 H new ATOM 0 HB3 TYR A 100 1.138 -8.893 -6.054 1.00 0.00 H new ATOM 0 HD1 TYR A 100 1.542 -5.567 -4.466 1.00 0.00 H new ATOM 0 HD2 TYR A 100 1.200 -9.762 -3.801 1.00 0.00 H new ATOM 0 HE1 TYR A 100 1.204 -5.157 -2.069 1.00 0.00 H new ATOM 0 HE2 TYR A 100 0.862 -9.354 -1.401 1.00 0.00 H new ATOM 0 HH TYR A 100 1.409 -7.589 0.269 1.00 0.00 H new ATOM 1635 N ASN A 101 3.254 -7.672 -8.593 1.00 0.00 N ATOM 1636 CA ASN A 101 3.384 -8.094 -9.983 1.00 0.00 C ATOM 1637 C ASN A 101 4.847 -8.083 -10.420 1.00 0.00 C ATOM 1638 O ASN A 101 5.197 -7.488 -11.440 1.00 0.00 O ATOM 1639 CB ASN A 101 2.556 -7.186 -10.895 1.00 0.00 C ATOM 1640 CG ASN A 101 1.854 -7.958 -11.994 1.00 0.00 C ATOM 1641 OD1 ASN A 101 2.289 -7.954 -13.146 1.00 0.00 O ATOM 1642 ND2 ASN A 101 0.761 -8.626 -11.644 1.00 0.00 N ATOM 0 H ASN A 101 3.194 -6.662 -8.461 1.00 0.00 H new ATOM 0 HA ASN A 101 3.008 -9.114 -10.064 1.00 0.00 H new ATOM 0 HB2 ASN A 101 1.815 -6.654 -10.298 1.00 0.00 H new ATOM 0 HB3 ASN A 101 3.206 -6.433 -11.341 1.00 0.00 H new ATOM 0 HD21 ASN A 101 0.246 -9.163 -12.342 1.00 0.00 H new ATOM 0 HD22 ASN A 101 0.436 -8.602 -10.677 1.00 0.00 H new ATOM 1649 N ASP A 102 5.696 -8.746 -9.643 1.00 0.00 N ATOM 1650 CA ASP A 102 7.121 -8.815 -9.949 1.00 0.00 C ATOM 1651 C ASP A 102 7.479 -10.159 -10.576 1.00 0.00 C ATOM 1652 O ASP A 102 7.077 -11.212 -10.081 1.00 0.00 O ATOM 1653 CB ASP A 102 7.947 -8.593 -8.681 1.00 0.00 C ATOM 1654 CG ASP A 102 8.314 -7.135 -8.479 1.00 0.00 C ATOM 1655 OD1 ASP A 102 8.968 -6.558 -9.374 1.00 0.00 O ATOM 1656 OD2 ASP A 102 7.949 -6.571 -7.426 1.00 0.00 O ATOM 0 H ASP A 102 5.423 -9.244 -8.796 1.00 0.00 H new ATOM 0 HA ASP A 102 7.352 -8.028 -10.667 1.00 0.00 H new ATOM 0 HB2 ASP A 102 7.384 -8.946 -7.817 1.00 0.00 H new ATOM 0 HB3 ASP A 102 8.857 -9.190 -8.734 1.00 0.00 H new ATOM 1661 N ARG A 103 8.237 -10.114 -11.667 1.00 0.00 N ATOM 1662 CA ARG A 103 8.650 -11.329 -12.362 1.00 0.00 C ATOM 1663 C ARG A 103 10.152 -11.556 -12.224 1.00 0.00 C ATOM 1664 O ARG A 103 10.619 -12.695 -12.220 1.00 0.00 O ATOM 1665 CB ARG A 103 8.269 -11.248 -13.842 1.00 0.00 C ATOM 1666 CG ARG A 103 8.830 -10.024 -14.549 1.00 0.00 C ATOM 1667 CD ARG A 103 9.481 -10.391 -15.874 1.00 0.00 C ATOM 1668 NE ARG A 103 10.573 -11.346 -15.703 1.00 0.00 N ATOM 1669 CZ ARG A 103 11.094 -12.063 -16.697 1.00 0.00 C ATOM 1670 NH1 ARG A 103 10.626 -11.936 -17.932 1.00 0.00 N ATOM 1671 NH2 ARG A 103 12.086 -12.909 -16.454 1.00 0.00 N ATOM 0 H ARG A 103 8.578 -9.250 -12.089 1.00 0.00 H new ATOM 0 HA ARG A 103 8.132 -12.172 -11.904 1.00 0.00 H new ATOM 0 HB2 ARG A 103 8.624 -12.145 -14.350 1.00 0.00 H new ATOM 0 HB3 ARG A 103 7.183 -11.241 -13.929 1.00 0.00 H new ATOM 0 HG2 ARG A 103 8.029 -9.305 -14.723 1.00 0.00 H new ATOM 0 HG3 ARG A 103 9.562 -9.536 -13.906 1.00 0.00 H new ATOM 0 HD2 ARG A 103 8.730 -10.815 -16.541 1.00 0.00 H new ATOM 0 HD3 ARG A 103 9.861 -9.489 -16.353 1.00 0.00 H new ATOM 0 HE ARG A 103 10.959 -11.471 -14.767 1.00 0.00 H new ATOM 0 HH11 ARG A 103 9.863 -11.287 -18.124 1.00 0.00 H new ATOM 0 HH12 ARG A 103 11.029 -12.488 -18.689 1.00 0.00 H new ATOM 0 HH21 ARG A 103 12.449 -13.010 -15.506 1.00 0.00 H new ATOM 0 HH22 ARG A 103 12.486 -13.459 -17.215 1.00 0.00 H new ATOM 1685 N PHE A 104 10.904 -10.466 -12.115 1.00 0.00 N ATOM 1686 CA PHE A 104 12.353 -10.548 -11.980 1.00 0.00 C ATOM 1687 C PHE A 104 12.751 -10.911 -10.552 1.00 0.00 C ATOM 1688 O PHE A 104 13.468 -11.884 -10.326 1.00 0.00 O ATOM 1689 CB PHE A 104 12.999 -9.219 -12.378 1.00 0.00 C ATOM 1690 CG PHE A 104 13.304 -9.115 -13.845 1.00 0.00 C ATOM 1691 CD1 PHE A 104 12.319 -8.750 -14.747 1.00 0.00 C ATOM 1692 CD2 PHE A 104 14.578 -9.385 -14.321 1.00 0.00 C ATOM 1693 CE1 PHE A 104 12.597 -8.654 -16.097 1.00 0.00 C ATOM 1694 CE2 PHE A 104 14.862 -9.291 -15.671 1.00 0.00 C ATOM 1695 CZ PHE A 104 13.870 -8.925 -16.561 1.00 0.00 C ATOM 0 H PHE A 104 10.534 -9.516 -12.118 1.00 0.00 H new ATOM 0 HA PHE A 104 12.709 -11.333 -12.647 1.00 0.00 H new ATOM 0 HB2 PHE A 104 12.335 -8.402 -12.095 1.00 0.00 H new ATOM 0 HB3 PHE A 104 13.922 -9.090 -11.813 1.00 0.00 H new ATOM 0 HD1 PHE A 104 11.322 -8.538 -14.391 1.00 0.00 H new ATOM 0 HD2 PHE A 104 15.357 -9.672 -13.630 1.00 0.00 H new ATOM 0 HE1 PHE A 104 11.819 -8.367 -16.789 1.00 0.00 H new ATOM 0 HE2 PHE A 104 15.858 -9.503 -16.030 1.00 0.00 H new ATOM 0 HZ PHE A 104 14.089 -8.851 -17.616 1.00 0.00 H new ATOM 1705 N ASP A 105 12.280 -10.119 -9.593 1.00 0.00 N ATOM 1706 CA ASP A 105 12.587 -10.357 -8.188 1.00 0.00 C ATOM 1707 C ASP A 105 11.378 -10.061 -7.307 1.00 0.00 C ATOM 1708 O ASP A 105 10.917 -8.923 -7.231 1.00 0.00 O ATOM 1709 CB ASP A 105 13.773 -9.494 -7.753 1.00 0.00 C ATOM 1710 CG ASP A 105 15.095 -10.227 -7.869 1.00 0.00 C ATOM 1711 OD1 ASP A 105 15.497 -10.887 -6.887 1.00 0.00 O ATOM 1712 OD2 ASP A 105 15.728 -10.145 -8.942 1.00 0.00 O ATOM 0 H ASP A 105 11.685 -9.308 -9.764 1.00 0.00 H new ATOM 0 HA ASP A 105 12.848 -11.409 -8.072 1.00 0.00 H new ATOM 0 HB2 ASP A 105 13.806 -8.592 -8.364 1.00 0.00 H new ATOM 0 HB3 ASP A 105 13.627 -9.175 -6.721 1.00 0.00 H new ATOM 1717 N SER A 106 10.872 -11.094 -6.641 1.00 0.00 N ATOM 1718 CA SER A 106 9.719 -10.944 -5.761 1.00 0.00 C ATOM 1719 C SER A 106 10.158 -10.737 -4.314 1.00 0.00 C ATOM 1720 O SER A 106 9.387 -10.968 -3.385 1.00 0.00 O ATOM 1721 CB SER A 106 8.815 -12.173 -5.855 1.00 0.00 C ATOM 1722 OG SER A 106 9.578 -13.367 -5.902 1.00 0.00 O ATOM 0 H SER A 106 11.242 -12.043 -6.694 1.00 0.00 H new ATOM 0 HA SER A 106 9.163 -10.064 -6.084 1.00 0.00 H new ATOM 0 HB2 SER A 106 8.144 -12.201 -4.997 1.00 0.00 H new ATOM 0 HB3 SER A 106 8.191 -12.102 -6.746 1.00 0.00 H new ATOM 0 HG SER A 106 8.976 -14.138 -5.960 1.00 0.00 H new ATOM 1728 N ARG A 107 11.401 -10.302 -4.132 1.00 0.00 N ATOM 1729 CA ARG A 107 11.945 -10.064 -2.799 1.00 0.00 C ATOM 1730 C ARG A 107 11.031 -9.154 -1.982 1.00 0.00 C ATOM 1731 O ARG A 107 10.891 -9.320 -0.770 1.00 0.00 O ATOM 1732 CB ARG A 107 13.333 -9.433 -2.909 1.00 0.00 C ATOM 1733 CG ARG A 107 13.367 -8.194 -3.790 1.00 0.00 C ATOM 1734 CD ARG A 107 14.753 -7.956 -4.365 1.00 0.00 C ATOM 1735 NE ARG A 107 15.709 -7.562 -3.335 1.00 0.00 N ATOM 1736 CZ ARG A 107 16.909 -7.048 -3.594 1.00 0.00 C ATOM 1737 NH1 ARG A 107 17.303 -6.862 -4.847 1.00 0.00 N ATOM 1738 NH2 ARG A 107 17.718 -6.720 -2.596 1.00 0.00 N ATOM 0 H ARG A 107 12.052 -10.107 -4.893 1.00 0.00 H new ATOM 0 HA ARG A 107 12.017 -11.024 -2.288 1.00 0.00 H new ATOM 0 HB2 ARG A 107 13.684 -9.170 -1.911 1.00 0.00 H new ATOM 0 HB3 ARG A 107 14.029 -10.172 -3.307 1.00 0.00 H new ATOM 0 HG2 ARG A 107 12.649 -8.305 -4.603 1.00 0.00 H new ATOM 0 HG3 ARG A 107 13.059 -7.325 -3.209 1.00 0.00 H new ATOM 0 HD2 ARG A 107 15.103 -8.864 -4.857 1.00 0.00 H new ATOM 0 HD3 ARG A 107 14.701 -7.180 -5.128 1.00 0.00 H new ATOM 0 HE ARG A 107 15.442 -7.688 -2.359 1.00 0.00 H new ATOM 0 HH11 ARG A 107 16.685 -7.113 -5.619 1.00 0.00 H new ATOM 0 HH12 ARG A 107 18.224 -6.468 -5.039 1.00 0.00 H new ATOM 0 HH21 ARG A 107 17.420 -6.862 -1.631 1.00 0.00 H new ATOM 0 HH22 ARG A 107 18.638 -6.326 -2.794 1.00 0.00 H new ATOM 1752 N TRP A 108 10.427 -8.183 -2.655 1.00 0.00 N ATOM 1753 CA TRP A 108 9.540 -7.227 -2.001 1.00 0.00 C ATOM 1754 C TRP A 108 8.193 -7.852 -1.640 1.00 0.00 C ATOM 1755 O TRP A 108 7.654 -7.591 -0.564 1.00 0.00 O ATOM 1756 CB TRP A 108 9.335 -6.014 -2.905 1.00 0.00 C ATOM 1757 CG TRP A 108 10.626 -5.411 -3.363 1.00 0.00 C ATOM 1758 CD1 TRP A 108 11.302 -5.691 -4.516 1.00 0.00 C ATOM 1759 CD2 TRP A 108 11.407 -4.435 -2.667 1.00 0.00 C ATOM 1760 NE1 TRP A 108 12.456 -4.947 -4.578 1.00 0.00 N ATOM 1761 CE2 TRP A 108 12.542 -4.167 -3.454 1.00 0.00 C ATOM 1762 CE3 TRP A 108 11.254 -3.763 -1.453 1.00 0.00 C ATOM 1763 CZ2 TRP A 108 13.518 -3.252 -3.065 1.00 0.00 C ATOM 1764 CZ3 TRP A 108 12.223 -2.856 -1.067 1.00 0.00 C ATOM 1765 CH2 TRP A 108 13.342 -2.608 -1.871 1.00 0.00 C ATOM 0 H TRP A 108 10.535 -8.036 -3.658 1.00 0.00 H new ATOM 0 HA TRP A 108 10.012 -6.915 -1.070 1.00 0.00 H new ATOM 0 HB2 TRP A 108 8.748 -6.309 -3.775 1.00 0.00 H new ATOM 0 HB3 TRP A 108 8.756 -5.261 -2.370 1.00 0.00 H new ATOM 0 HD1 TRP A 108 10.977 -6.394 -5.269 1.00 0.00 H new ATOM 0 HE1 TRP A 108 13.137 -4.971 -5.337 1.00 0.00 H new ATOM 0 HE3 TRP A 108 10.394 -3.948 -0.827 1.00 0.00 H new ATOM 0 HZ2 TRP A 108 14.382 -3.058 -3.683 1.00 0.00 H new ATOM 0 HZ3 TRP A 108 12.115 -2.330 -0.130 1.00 0.00 H new ATOM 0 HH2 TRP A 108 14.082 -1.893 -1.542 1.00 0.00 H new ATOM 1776 N ARG A 109 7.648 -8.670 -2.536 1.00 0.00 N ATOM 1777 CA ARG A 109 6.362 -9.312 -2.286 1.00 0.00 C ATOM 1778 C ARG A 109 6.531 -10.595 -1.476 1.00 0.00 C ATOM 1779 O ARG A 109 5.573 -11.094 -0.882 1.00 0.00 O ATOM 1780 CB ARG A 109 5.650 -9.613 -3.606 1.00 0.00 C ATOM 1781 CG ARG A 109 6.391 -10.602 -4.488 1.00 0.00 C ATOM 1782 CD ARG A 109 5.809 -10.637 -5.891 1.00 0.00 C ATOM 1783 NE ARG A 109 4.528 -11.337 -5.934 1.00 0.00 N ATOM 1784 CZ ARG A 109 4.394 -12.648 -5.747 1.00 0.00 C ATOM 1785 NH1 ARG A 109 5.459 -13.404 -5.513 1.00 0.00 N ATOM 1786 NH2 ARG A 109 3.192 -13.206 -5.796 1.00 0.00 N ATOM 0 H ARG A 109 8.073 -8.902 -3.434 1.00 0.00 H new ATOM 0 HA ARG A 109 5.753 -8.621 -1.703 1.00 0.00 H new ATOM 0 HB2 ARG A 109 4.656 -10.005 -3.391 1.00 0.00 H new ATOM 0 HB3 ARG A 109 5.513 -8.682 -4.155 1.00 0.00 H new ATOM 0 HG2 ARG A 109 7.445 -10.330 -4.536 1.00 0.00 H new ATOM 0 HG3 ARG A 109 6.339 -11.597 -4.046 1.00 0.00 H new ATOM 0 HD2 ARG A 109 5.678 -9.618 -6.255 1.00 0.00 H new ATOM 0 HD3 ARG A 109 6.513 -11.127 -6.564 1.00 0.00 H new ATOM 0 HE ARG A 109 3.687 -10.790 -6.118 1.00 0.00 H new ATOM 0 HH11 ARG A 109 6.386 -12.981 -5.476 1.00 0.00 H new ATOM 0 HH12 ARG A 109 5.350 -14.408 -5.370 1.00 0.00 H new ATOM 0 HH21 ARG A 109 2.370 -12.630 -5.977 1.00 0.00 H new ATOM 0 HH22 ARG A 109 3.090 -14.211 -5.653 1.00 0.00 H new ATOM 1800 N ASP A 110 7.749 -11.127 -1.452 1.00 0.00 N ATOM 1801 CA ASP A 110 8.036 -12.349 -0.711 1.00 0.00 C ATOM 1802 C ASP A 110 8.182 -12.061 0.779 1.00 0.00 C ATOM 1803 O ASP A 110 7.866 -12.904 1.618 1.00 0.00 O ATOM 1804 CB ASP A 110 9.311 -13.006 -1.243 1.00 0.00 C ATOM 1805 CG ASP A 110 9.420 -14.464 -0.844 1.00 0.00 C ATOM 1806 OD1 ASP A 110 8.506 -15.243 -1.188 1.00 0.00 O ATOM 1807 OD2 ASP A 110 10.419 -14.827 -0.189 1.00 0.00 O ATOM 0 H ASP A 110 8.553 -10.730 -1.938 1.00 0.00 H new ATOM 0 HA ASP A 110 7.198 -13.033 -0.850 1.00 0.00 H new ATOM 0 HB2 ASP A 110 9.331 -12.927 -2.330 1.00 0.00 H new ATOM 0 HB3 ASP A 110 10.179 -12.464 -0.868 1.00 0.00 H new ATOM 1812 N THR A 111 8.662 -10.863 1.100 1.00 0.00 N ATOM 1813 CA THR A 111 8.851 -10.454 2.488 1.00 0.00 C ATOM 1814 C THR A 111 7.606 -10.746 3.322 1.00 0.00 C ATOM 1815 O THR A 111 6.481 -10.536 2.870 1.00 0.00 O ATOM 1816 CB THR A 111 9.186 -8.962 2.553 1.00 0.00 C ATOM 1817 OG1 THR A 111 9.426 -8.442 1.257 1.00 0.00 O ATOM 1818 CG2 THR A 111 10.402 -8.660 3.398 1.00 0.00 C ATOM 0 H THR A 111 8.928 -10.156 0.415 1.00 0.00 H new ATOM 0 HA THR A 111 9.680 -11.028 2.902 1.00 0.00 H new ATOM 0 HB THR A 111 8.316 -8.492 3.012 1.00 0.00 H new ATOM 0 HG1 THR A 111 8.580 -8.145 0.862 1.00 0.00 H new ATOM 0 HG21 THR A 111 10.584 -7.585 3.402 1.00 0.00 H new ATOM 0 HG22 THR A 111 10.230 -9.003 4.418 1.00 0.00 H new ATOM 0 HG23 THR A 111 11.270 -9.174 2.984 1.00 0.00 H new ATOM 1826 N LYS A 112 7.817 -11.230 4.543 1.00 0.00 N ATOM 1827 CA LYS A 112 6.711 -11.548 5.440 1.00 0.00 C ATOM 1828 C LYS A 112 5.852 -10.315 5.697 1.00 0.00 C ATOM 1829 O LYS A 112 4.645 -10.420 5.917 1.00 0.00 O ATOM 1830 CB LYS A 112 7.242 -12.102 6.762 1.00 0.00 C ATOM 1831 CG LYS A 112 6.426 -13.264 7.306 1.00 0.00 C ATOM 1832 CD LYS A 112 6.491 -13.329 8.823 1.00 0.00 C ATOM 1833 CE LYS A 112 6.249 -14.742 9.330 1.00 0.00 C ATOM 1834 NZ LYS A 112 4.825 -15.150 9.179 1.00 0.00 N ATOM 0 H LYS A 112 8.742 -11.410 4.933 1.00 0.00 H new ATOM 0 HA LYS A 112 6.092 -12.307 4.962 1.00 0.00 H new ATOM 0 HB2 LYS A 112 8.273 -12.427 6.622 1.00 0.00 H new ATOM 0 HB3 LYS A 112 7.257 -11.302 7.502 1.00 0.00 H new ATOM 0 HG2 LYS A 112 5.388 -13.161 6.989 1.00 0.00 H new ATOM 0 HG3 LYS A 112 6.796 -14.199 6.885 1.00 0.00 H new ATOM 0 HD2 LYS A 112 7.467 -12.982 9.162 1.00 0.00 H new ATOM 0 HD3 LYS A 112 5.747 -12.656 9.249 1.00 0.00 H new ATOM 0 HE2 LYS A 112 6.886 -15.438 8.784 1.00 0.00 H new ATOM 0 HE3 LYS A 112 6.535 -14.805 10.380 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 4.702 -16.119 9.536 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 4.219 -14.502 9.721 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 4.558 -15.115 8.174 1.00 0.00 H new ATOM 1848 N ILE A 113 6.483 -9.145 5.666 1.00 0.00 N ATOM 1849 CA ILE A 113 5.778 -7.890 5.893 1.00 0.00 C ATOM 1850 C ILE A 113 4.785 -7.611 4.768 1.00 0.00 C ATOM 1851 O ILE A 113 3.697 -7.085 5.003 1.00 0.00 O ATOM 1852 CB ILE A 113 6.758 -6.706 6.006 1.00 0.00 C ATOM 1853 CG1 ILE A 113 7.555 -6.547 4.712 1.00 0.00 C ATOM 1854 CG2 ILE A 113 7.701 -6.904 7.181 1.00 0.00 C ATOM 1855 CD1 ILE A 113 8.494 -5.361 4.722 1.00 0.00 C ATOM 0 H ILE A 113 7.482 -9.041 5.486 1.00 0.00 H new ATOM 0 HA ILE A 113 5.239 -7.993 6.835 1.00 0.00 H new ATOM 0 HB ILE A 113 6.179 -5.798 6.174 1.00 0.00 H new ATOM 0 HG12 ILE A 113 8.132 -7.455 4.536 1.00 0.00 H new ATOM 0 HG13 ILE A 113 6.861 -6.444 3.878 1.00 0.00 H new ATOM 0 HG21 ILE A 113 8.385 -6.058 7.245 1.00 0.00 H new ATOM 0 HG22 ILE A 113 7.124 -6.974 8.103 1.00 0.00 H new ATOM 0 HG23 ILE A 113 8.271 -7.822 7.039 1.00 0.00 H new ATOM 0 HD11 ILE A 113 9.026 -5.310 3.772 1.00 0.00 H new ATOM 0 HD12 ILE A 113 7.921 -4.445 4.866 1.00 0.00 H new ATOM 0 HD13 ILE A 113 9.212 -5.472 5.535 1.00 0.00 H new ATOM 1867 N ALA A 114 5.169 -7.966 3.546 1.00 0.00 N ATOM 1868 CA ALA A 114 4.315 -7.755 2.383 1.00 0.00 C ATOM 1869 C ALA A 114 3.059 -8.615 2.462 1.00 0.00 C ATOM 1870 O ALA A 114 1.955 -8.149 2.176 1.00 0.00 O ATOM 1871 CB ALA A 114 5.082 -8.051 1.103 1.00 0.00 C ATOM 0 H ALA A 114 6.067 -8.402 3.336 1.00 0.00 H new ATOM 0 HA ALA A 114 4.007 -6.709 2.374 1.00 0.00 H new ATOM 0 HB1 ALA A 114 4.432 -7.889 0.243 1.00 0.00 H new ATOM 0 HB2 ALA A 114 5.945 -7.389 1.035 1.00 0.00 H new ATOM 0 HB3 ALA A 114 5.420 -9.087 1.112 1.00 0.00 H new ATOM 1877 N GLN A 115 3.233 -9.875 2.851 1.00 0.00 N ATOM 1878 CA GLN A 115 2.111 -10.800 2.967 1.00 0.00 C ATOM 1879 C GLN A 115 1.149 -10.352 4.061 1.00 0.00 C ATOM 1880 O GLN A 115 -0.066 -10.510 3.938 1.00 0.00 O ATOM 1881 CB GLN A 115 2.617 -12.213 3.264 1.00 0.00 C ATOM 1882 CG GLN A 115 3.741 -12.663 2.344 1.00 0.00 C ATOM 1883 CD GLN A 115 3.268 -13.626 1.273 1.00 0.00 C ATOM 1884 OE1 GLN A 115 2.627 -14.635 1.566 1.00 0.00 O ATOM 1885 NE2 GLN A 115 3.584 -13.318 0.020 1.00 0.00 N ATOM 0 H GLN A 115 4.139 -10.278 3.091 1.00 0.00 H new ATOM 0 HA GLN A 115 1.576 -10.805 2.017 1.00 0.00 H new ATOM 0 HB2 GLN A 115 2.964 -12.256 4.296 1.00 0.00 H new ATOM 0 HB3 GLN A 115 1.786 -12.913 3.178 1.00 0.00 H new ATOM 0 HG2 GLN A 115 4.189 -11.790 1.870 1.00 0.00 H new ATOM 0 HG3 GLN A 115 4.522 -13.140 2.937 1.00 0.00 H new ATOM 0 HE21 GLN A 115 4.117 -12.471 -0.178 1.00 0.00 H new ATOM 0 HE22 GLN A 115 3.294 -13.928 -0.744 1.00 0.00 H new ATOM 1894 N ASP A 116 1.701 -9.790 5.131 1.00 0.00 N ATOM 1895 CA ASP A 116 0.893 -9.315 6.249 1.00 0.00 C ATOM 1896 C ASP A 116 0.266 -7.957 5.936 1.00 0.00 C ATOM 1897 O ASP A 116 -0.684 -7.537 6.595 1.00 0.00 O ATOM 1898 CB ASP A 116 1.746 -9.215 7.515 1.00 0.00 C ATOM 1899 CG ASP A 116 2.361 -10.545 7.903 1.00 0.00 C ATOM 1900 OD1 ASP A 116 1.854 -11.591 7.445 1.00 0.00 O ATOM 1901 OD2 ASP A 116 3.350 -10.542 8.666 1.00 0.00 O ATOM 0 H ASP A 116 2.705 -9.652 5.248 1.00 0.00 H new ATOM 0 HA ASP A 116 0.091 -10.034 6.413 1.00 0.00 H new ATOM 0 HB2 ASP A 116 2.538 -8.483 7.359 1.00 0.00 H new ATOM 0 HB3 ASP A 116 1.131 -8.849 8.337 1.00 0.00 H new ATOM 1906 N PHE A 117 0.805 -7.274 4.927 1.00 0.00 N ATOM 1907 CA PHE A 117 0.300 -5.964 4.530 1.00 0.00 C ATOM 1908 C PHE A 117 -1.214 -5.990 4.335 1.00 0.00 C ATOM 1909 O PHE A 117 -1.927 -5.119 4.831 1.00 0.00 O ATOM 1910 CB PHE A 117 0.980 -5.512 3.237 1.00 0.00 C ATOM 1911 CG PHE A 117 0.833 -4.043 2.965 1.00 0.00 C ATOM 1912 CD1 PHE A 117 1.358 -3.109 3.843 1.00 0.00 C ATOM 1913 CD2 PHE A 117 0.170 -3.597 1.834 1.00 0.00 C ATOM 1914 CE1 PHE A 117 1.225 -1.756 3.596 1.00 0.00 C ATOM 1915 CE2 PHE A 117 0.033 -2.245 1.582 1.00 0.00 C ATOM 1916 CZ PHE A 117 0.562 -1.324 2.465 1.00 0.00 C ATOM 0 H PHE A 117 1.592 -7.608 4.370 1.00 0.00 H new ATOM 0 HA PHE A 117 0.529 -5.258 5.329 1.00 0.00 H new ATOM 0 HB2 PHE A 117 2.040 -5.760 3.288 1.00 0.00 H new ATOM 0 HB3 PHE A 117 0.561 -6.072 2.401 1.00 0.00 H new ATOM 0 HD1 PHE A 117 1.877 -3.442 4.730 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -0.245 -4.314 1.141 1.00 0.00 H new ATOM 0 HE1 PHE A 117 1.639 -1.037 4.287 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -0.487 -1.909 0.697 1.00 0.00 H new ATOM 0 HZ PHE A 117 0.457 -0.267 2.271 1.00 0.00 H new ATOM 1926 N LEU A 118 -1.696 -6.993 3.609 1.00 0.00 N ATOM 1927 CA LEU A 118 -3.126 -7.128 3.350 1.00 0.00 C ATOM 1928 C LEU A 118 -3.712 -8.315 4.109 1.00 0.00 C ATOM 1929 O LEU A 118 -4.709 -8.901 3.686 1.00 0.00 O ATOM 1930 CB LEU A 118 -3.380 -7.288 1.849 1.00 0.00 C ATOM 1931 CG LEU A 118 -2.798 -6.181 0.963 1.00 0.00 C ATOM 1932 CD1 LEU A 118 -3.425 -6.225 -0.421 1.00 0.00 C ATOM 1933 CD2 LEU A 118 -3.004 -4.813 1.597 1.00 0.00 C ATOM 0 H LEU A 118 -1.120 -7.723 3.190 1.00 0.00 H new ATOM 0 HA LEU A 118 -3.619 -6.222 3.701 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -2.965 -8.243 1.527 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -4.456 -7.335 1.683 1.00 0.00 H new ATOM 0 HG LEU A 118 -1.726 -6.352 0.866 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -3.001 -5.433 -1.038 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -3.222 -7.192 -0.882 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -4.502 -6.082 -0.337 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -2.582 -4.045 0.949 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -4.070 -4.630 1.730 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -2.507 -4.783 2.567 1.00 0.00 H new ATOM 1945 N GLN A 119 -3.089 -8.664 5.229 1.00 0.00 N ATOM 1946 CA GLN A 119 -3.552 -9.781 6.044 1.00 0.00 C ATOM 1947 C GLN A 119 -3.549 -11.077 5.240 1.00 0.00 C ATOM 1948 O GLN A 119 -4.486 -11.872 5.318 1.00 0.00 O ATOM 1949 CB GLN A 119 -4.958 -9.500 6.579 1.00 0.00 C ATOM 1950 CG GLN A 119 -5.076 -8.175 7.313 1.00 0.00 C ATOM 1951 CD GLN A 119 -6.485 -7.905 7.807 1.00 0.00 C ATOM 1952 OE1 GLN A 119 -7.115 -8.767 8.420 1.00 0.00 O ATOM 1953 NE2 GLN A 119 -6.986 -6.705 7.539 1.00 0.00 N ATOM 0 H GLN A 119 -2.263 -8.190 5.593 1.00 0.00 H new ATOM 0 HA GLN A 119 -2.868 -9.895 6.885 1.00 0.00 H new ATOM 0 HB2 GLN A 119 -5.663 -9.509 5.747 1.00 0.00 H new ATOM 0 HB3 GLN A 119 -5.249 -10.306 7.252 1.00 0.00 H new ATOM 0 HG2 GLN A 119 -4.391 -8.171 8.161 1.00 0.00 H new ATOM 0 HG3 GLN A 119 -4.767 -7.367 6.649 1.00 0.00 H new ATOM 0 HE21 GLN A 119 -6.427 -6.022 7.028 1.00 0.00 H new ATOM 0 HE22 GLN A 119 -7.930 -6.466 7.844 1.00 0.00 H new ATOM 1962 N LEU A 120 -2.489 -11.284 4.465 1.00 0.00 N ATOM 1963 CA LEU A 120 -2.362 -12.482 3.644 1.00 0.00 C ATOM 1964 C LEU A 120 -1.574 -13.565 4.376 1.00 0.00 C ATOM 1965 O LEU A 120 -0.750 -14.257 3.778 1.00 0.00 O ATOM 1966 CB LEU A 120 -1.678 -12.146 2.317 1.00 0.00 C ATOM 1967 CG LEU A 120 -2.017 -10.770 1.739 1.00 0.00 C ATOM 1968 CD1 LEU A 120 -0.926 -10.310 0.785 1.00 0.00 C ATOM 1969 CD2 LEU A 120 -3.364 -10.807 1.033 1.00 0.00 C ATOM 0 H LEU A 120 -1.705 -10.636 4.389 1.00 0.00 H new ATOM 0 HA LEU A 120 -3.364 -12.861 3.443 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -0.599 -12.208 2.457 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -1.948 -12.907 1.585 1.00 0.00 H new ATOM 0 HG LEU A 120 -2.079 -10.056 2.560 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -1.183 -9.330 0.383 1.00 0.00 H new ATOM 0 HD12 LEU A 120 0.022 -10.246 1.320 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -0.833 -11.024 -0.033 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -3.590 -9.821 0.628 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -3.329 -11.533 0.221 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -4.139 -11.094 1.743 1.00 0.00 H new ATOM 1981 N SER A 121 -1.833 -13.706 5.672 1.00 0.00 N ATOM 1982 CA SER A 121 -1.148 -14.704 6.484 1.00 0.00 C ATOM 1983 C SER A 121 -1.934 -15.004 7.756 1.00 0.00 C ATOM 1984 O SER A 121 -1.996 -14.179 8.667 1.00 0.00 O ATOM 1985 CB SER A 121 0.259 -14.224 6.842 1.00 0.00 C ATOM 1986 OG SER A 121 1.160 -14.438 5.769 1.00 0.00 O ATOM 0 H SER A 121 -2.512 -13.141 6.182 1.00 0.00 H new ATOM 0 HA SER A 121 -1.073 -15.621 5.900 1.00 0.00 H new ATOM 0 HB2 SER A 121 0.232 -13.163 7.092 1.00 0.00 H new ATOM 0 HB3 SER A 121 0.612 -14.752 7.728 1.00 0.00 H new ATOM 0 HG SER A 121 0.667 -14.431 4.922 1.00 0.00 H new ATOM 1992 N LYS A 122 -2.534 -16.190 7.812 1.00 0.00 N ATOM 1993 CA LYS A 122 -3.315 -16.597 8.972 1.00 0.00 C ATOM 1994 C LYS A 122 -2.601 -17.699 9.751 1.00 0.00 C ATOM 1995 O LYS A 122 -1.878 -18.510 9.172 1.00 0.00 O ATOM 1996 CB LYS A 122 -4.700 -17.080 8.538 1.00 0.00 C ATOM 1997 CG LYS A 122 -4.670 -18.017 7.341 1.00 0.00 C ATOM 1998 CD LYS A 122 -5.726 -19.103 7.458 1.00 0.00 C ATOM 1999 CE LYS A 122 -6.362 -19.410 6.111 1.00 0.00 C ATOM 2000 NZ LYS A 122 -7.616 -20.200 6.255 1.00 0.00 N ATOM 0 H LYS A 122 -2.493 -16.885 7.066 1.00 0.00 H new ATOM 0 HA LYS A 122 -3.428 -15.730 9.624 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -5.177 -17.589 9.375 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -5.318 -16.215 8.297 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -4.833 -17.446 6.427 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -3.684 -18.474 7.260 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -5.275 -20.009 7.863 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -6.496 -18.788 8.162 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -6.579 -18.477 5.591 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -5.654 -19.962 5.493 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -8.018 -20.388 5.314 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -7.406 -21.102 6.728 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -8.302 -19.663 6.823 1.00 0.00 H new ATOM 2014 N PRO A 123 -2.793 -17.742 11.081 1.00 0.00 N ATOM 2015 CA PRO A 123 -2.164 -18.752 11.938 1.00 0.00 C ATOM 2016 C PRO A 123 -2.760 -20.140 11.732 1.00 0.00 C ATOM 2017 O PRO A 123 -3.960 -20.345 11.916 1.00 0.00 O ATOM 2018 CB PRO A 123 -2.456 -18.249 13.352 1.00 0.00 C ATOM 2019 CG PRO A 123 -3.701 -17.443 13.217 1.00 0.00 C ATOM 2020 CD PRO A 123 -3.641 -16.813 11.853 1.00 0.00 C ATOM 0 HA PRO A 123 -1.102 -18.865 11.722 1.00 0.00 H new ATOM 0 HB2 PRO A 123 -2.594 -19.078 14.046 1.00 0.00 H new ATOM 0 HB3 PRO A 123 -1.633 -17.646 13.735 1.00 0.00 H new ATOM 0 HG2 PRO A 123 -4.586 -18.072 13.318 1.00 0.00 H new ATOM 0 HG3 PRO A 123 -3.760 -16.683 13.996 1.00 0.00 H new ATOM 0 HD2 PRO A 123 -4.633 -16.715 11.412 1.00 0.00 H new ATOM 0 HD3 PRO A 123 -3.209 -15.813 11.891 1.00 0.00 H new ATOM 2028 N ASN A 124 -1.914 -21.091 11.351 1.00 0.00 N ATOM 2029 CA ASN A 124 -2.358 -22.461 11.120 1.00 0.00 C ATOM 2030 C ASN A 124 -3.405 -22.515 10.012 1.00 0.00 C ATOM 2031 O ASN A 124 -4.085 -23.556 9.893 1.00 0.00 O ATOM 2032 CB ASN A 124 -2.926 -23.058 12.408 1.00 0.00 C ATOM 2033 CG ASN A 124 -2.400 -24.453 12.682 1.00 0.00 C ATOM 2034 OD1 ASN A 124 -2.183 -25.239 11.760 1.00 0.00 O ATOM 2035 ND2 ASN A 124 -2.190 -24.768 13.955 1.00 0.00 N ATOM 2036 OXT ASN A 124 -3.537 -21.516 9.274 1.00 0.00 O ATOM 0 H ASN A 124 -0.917 -20.939 11.196 1.00 0.00 H new ATOM 0 HA ASN A 124 -1.495 -23.049 10.806 1.00 0.00 H new ATOM 0 HB2 ASN A 124 -2.677 -22.408 13.247 1.00 0.00 H new ATOM 0 HB3 ASN A 124 -4.013 -23.090 12.341 1.00 0.00 H new ATOM 0 HD21 ASN A 124 -1.835 -25.692 14.200 1.00 0.00 H new ATOM 0 HD22 ASN A 124 -2.383 -24.085 14.688 1.00 0.00 H new TER 2043 ASN A 124