USER MOD reduce.3.24.130724 H: found=0, std=0, add=1021, rem=0, adj=23 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 180:sc= 0 (180deg=0) USER MOD Single : A 10 SER OG : rot 180:sc= 0 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+ -171:sc= 0 (180deg=-0.0601) USER MOD Single : A 23 ASN : amide:sc= -1.52 X(o=-1.5,f=-1.7) USER MOD Single : A 25 LYS NZ :NH3+ -161:sc= -0.017 (180deg=-0.179) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 TYR OH : rot 0:sc= -2.81 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 33 THR OG1 : rot -2:sc= 0.299 USER MOD Single : A 35 ASN : amide:sc=-0.00971 X(o=-0.0097,f=0) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 TYR OH : rot 180:sc= 0 USER MOD Single : A 40 LYS NZ :NH3+ -146:sc= -0.831 (180deg=-2.94!) USER MOD Single : A 42 TYR OH : rot -144:sc= 0.684 USER MOD Single : A 43 SER OG : rot 180:sc= 0.121 USER MOD Single : A 47 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0016) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 TYR OH : rot 107:sc= -2.7 USER MOD Single : A 67 LYS NZ :NH3+ -179:sc= -0.228 (180deg=-0.235) USER MOD Single : A 76 GLN : amide:sc= -0.393 K(o=-0.39,f=0.18) USER MOD Single : A 79 TYR OH : rot 110:sc= -0.229 USER MOD Single : A 84 MET CE :methyl 140:sc= -3.36 (180deg=-6.9!) USER MOD Single : A 97 ASN : amide:sc= -6.42! C(o=-6.4!,f=-8.6!) USER MOD Single : A 100 TYR OH : rot 30:sc= -0.8 USER MOD Single : A 101 ASN : amide:sc= 0.709 K(o=0.71,f=-0.31) USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 111 THR OG1 : rot 105:sc= 1.31 USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 GLN : amide:sc= -0.0936 K(o=-0.094,f=-0.9) USER MOD Single : A 119 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 ASN : amide:sc= -0.052 X(o=-0.052,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 8 12.109 -1.743 -22.267 1.00 0.00 N ATOM 2 CA LYS A 8 11.557 -2.957 -21.609 1.00 0.00 C ATOM 3 C LYS A 8 10.044 -2.856 -21.443 1.00 0.00 C ATOM 4 O LYS A 8 9.521 -1.812 -21.056 1.00 0.00 O ATOM 5 CB LYS A 8 12.228 -3.119 -20.244 1.00 0.00 C ATOM 6 CG LYS A 8 11.977 -4.472 -19.598 1.00 0.00 C ATOM 7 CD LYS A 8 13.120 -5.438 -19.867 1.00 0.00 C ATOM 8 CE LYS A 8 13.092 -6.614 -18.904 1.00 0.00 C ATOM 9 NZ LYS A 8 13.686 -7.839 -19.507 1.00 0.00 N ATOM 0 HA LYS A 8 11.761 -3.826 -22.234 1.00 0.00 H new ATOM 0 HB2 LYS A 8 13.302 -2.974 -20.357 1.00 0.00 H new ATOM 0 HB3 LYS A 8 11.869 -2.335 -19.577 1.00 0.00 H new ATOM 0 HG2 LYS A 8 11.852 -4.345 -18.523 1.00 0.00 H new ATOM 0 HG3 LYS A 8 11.047 -4.892 -19.980 1.00 0.00 H new ATOM 0 HD2 LYS A 8 13.056 -5.804 -20.892 1.00 0.00 H new ATOM 0 HD3 LYS A 8 14.071 -4.913 -19.775 1.00 0.00 H new ATOM 0 HE2 LYS A 8 13.638 -6.354 -17.997 1.00 0.00 H new ATOM 0 HE3 LYS A 8 12.063 -6.817 -18.609 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 13.648 -8.618 -18.819 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 13.149 -8.102 -20.358 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 14.676 -7.654 -19.766 1.00 0.00 H new ATOM 25 N MET A 9 9.347 -3.949 -21.739 1.00 0.00 N ATOM 26 CA MET A 9 7.894 -3.983 -21.621 1.00 0.00 C ATOM 27 C MET A 9 7.469 -4.752 -20.374 1.00 0.00 C ATOM 28 O MET A 9 7.680 -5.961 -20.276 1.00 0.00 O ATOM 29 CB MET A 9 7.276 -4.622 -22.868 1.00 0.00 C ATOM 30 CG MET A 9 6.570 -3.626 -23.774 1.00 0.00 C ATOM 31 SD MET A 9 4.773 -3.720 -23.646 1.00 0.00 S ATOM 32 CE MET A 9 4.359 -1.992 -23.422 1.00 0.00 C ATOM 0 H MET A 9 9.765 -4.822 -22.062 1.00 0.00 H new ATOM 0 HA MET A 9 7.535 -2.958 -21.532 1.00 0.00 H new ATOM 0 HB2 MET A 9 8.059 -5.125 -23.435 1.00 0.00 H new ATOM 0 HB3 MET A 9 6.565 -5.388 -22.559 1.00 0.00 H new ATOM 0 HG2 MET A 9 6.896 -2.617 -23.521 1.00 0.00 H new ATOM 0 HG3 MET A 9 6.866 -3.807 -24.807 1.00 0.00 H new ATOM 0 HE1 MET A 9 3.278 -1.886 -23.327 1.00 0.00 H new ATOM 0 HE2 MET A 9 4.841 -1.616 -22.519 1.00 0.00 H new ATOM 0 HE3 MET A 9 4.705 -1.420 -24.283 1.00 0.00 H new ATOM 42 N SER A 10 6.868 -4.044 -19.424 1.00 0.00 N ATOM 43 CA SER A 10 6.413 -4.660 -18.182 1.00 0.00 C ATOM 44 C SER A 10 4.908 -4.488 -18.009 1.00 0.00 C ATOM 45 O SER A 10 4.326 -3.511 -18.482 1.00 0.00 O ATOM 46 CB SER A 10 7.147 -4.051 -16.987 1.00 0.00 C ATOM 47 OG SER A 10 8.513 -3.822 -17.289 1.00 0.00 O ATOM 0 H SER A 10 6.684 -3.043 -19.490 1.00 0.00 H new ATOM 0 HA SER A 10 6.636 -5.726 -18.232 1.00 0.00 H new ATOM 0 HB2 SER A 10 6.672 -3.112 -16.705 1.00 0.00 H new ATOM 0 HB3 SER A 10 7.068 -4.719 -16.129 1.00 0.00 H new ATOM 0 HG SER A 10 8.959 -3.431 -16.509 1.00 0.00 H new ATOM 53 N GLU A 11 4.283 -5.444 -17.330 1.00 0.00 N ATOM 54 CA GLU A 11 2.845 -5.398 -17.094 1.00 0.00 C ATOM 55 C GLU A 11 2.537 -4.786 -15.731 1.00 0.00 C ATOM 56 O GLU A 11 3.402 -4.725 -14.857 1.00 0.00 O ATOM 57 CB GLU A 11 2.247 -6.803 -17.183 1.00 0.00 C ATOM 58 CG GLU A 11 1.689 -7.140 -18.557 1.00 0.00 C ATOM 59 CD GLU A 11 0.529 -8.115 -18.492 1.00 0.00 C ATOM 60 OE1 GLU A 11 0.782 -9.330 -18.350 1.00 0.00 O ATOM 61 OE2 GLU A 11 -0.632 -7.665 -18.584 1.00 0.00 O ATOM 0 H GLU A 11 4.750 -6.260 -16.934 1.00 0.00 H new ATOM 0 HA GLU A 11 2.395 -4.771 -17.864 1.00 0.00 H new ATOM 0 HB2 GLU A 11 3.014 -7.533 -16.922 1.00 0.00 H new ATOM 0 HB3 GLU A 11 1.452 -6.898 -16.444 1.00 0.00 H new ATOM 0 HG2 GLU A 11 1.361 -6.223 -19.047 1.00 0.00 H new ATOM 0 HG3 GLU A 11 2.482 -7.565 -19.173 1.00 0.00 H new ATOM 68 N LYS A 12 1.299 -4.334 -15.557 1.00 0.00 N ATOM 69 CA LYS A 12 0.876 -3.728 -14.300 1.00 0.00 C ATOM 70 C LYS A 12 -0.319 -4.470 -13.713 1.00 0.00 C ATOM 71 O LYS A 12 -1.222 -4.886 -14.439 1.00 0.00 O ATOM 72 CB LYS A 12 0.521 -2.255 -14.513 1.00 0.00 C ATOM 73 CG LYS A 12 1.709 -1.392 -14.905 1.00 0.00 C ATOM 74 CD LYS A 12 1.761 -0.108 -14.089 1.00 0.00 C ATOM 75 CE LYS A 12 2.037 1.100 -14.968 1.00 0.00 C ATOM 76 NZ LYS A 12 1.347 2.320 -14.465 1.00 0.00 N ATOM 0 H LYS A 12 0.572 -4.376 -16.271 1.00 0.00 H new ATOM 0 HA LYS A 12 1.705 -3.797 -13.596 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -0.241 -2.182 -15.289 1.00 0.00 H new ATOM 0 HB3 LYS A 12 0.082 -1.860 -13.597 1.00 0.00 H new ATOM 0 HG2 LYS A 12 2.632 -1.954 -14.760 1.00 0.00 H new ATOM 0 HG3 LYS A 12 1.648 -1.148 -15.966 1.00 0.00 H new ATOM 0 HD2 LYS A 12 0.815 0.030 -13.566 1.00 0.00 H new ATOM 0 HD3 LYS A 12 2.537 -0.190 -13.328 1.00 0.00 H new ATOM 0 HE2 LYS A 12 3.111 1.281 -15.010 1.00 0.00 H new ATOM 0 HE3 LYS A 12 1.709 0.891 -15.986 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 1.560 3.122 -15.091 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 0.320 2.156 -14.449 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 1.678 2.534 -13.503 1.00 0.00 H new ATOM 90 N LEU A 13 -0.320 -4.631 -12.393 1.00 0.00 N ATOM 91 CA LEU A 13 -1.407 -5.321 -11.709 1.00 0.00 C ATOM 92 C LEU A 13 -2.634 -4.422 -11.602 1.00 0.00 C ATOM 93 O LEU A 13 -2.513 -3.213 -11.406 1.00 0.00 O ATOM 94 CB LEU A 13 -0.961 -5.763 -10.314 1.00 0.00 C ATOM 95 CG LEU A 13 -1.975 -6.613 -9.547 1.00 0.00 C ATOM 96 CD1 LEU A 13 -1.731 -8.093 -9.801 1.00 0.00 C ATOM 97 CD2 LEU A 13 -1.911 -6.306 -8.057 1.00 0.00 C ATOM 0 H LEU A 13 0.419 -4.293 -11.777 1.00 0.00 H new ATOM 0 HA LEU A 13 -1.672 -6.202 -12.293 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -0.034 -6.328 -10.408 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -0.734 -4.875 -9.724 1.00 0.00 H new ATOM 0 HG LEU A 13 -2.974 -6.364 -9.905 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -2.462 -8.683 -9.247 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -1.830 -8.300 -10.867 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -0.726 -8.358 -9.471 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -2.639 -6.920 -7.527 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -0.911 -6.525 -7.683 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -2.137 -5.252 -7.893 1.00 0.00 H new ATOM 109 N ARG A 14 -3.812 -5.019 -11.733 1.00 0.00 N ATOM 110 CA ARG A 14 -5.059 -4.267 -11.652 1.00 0.00 C ATOM 111 C ARG A 14 -5.350 -3.844 -10.217 1.00 0.00 C ATOM 112 O ARG A 14 -5.811 -4.641 -9.401 1.00 0.00 O ATOM 113 CB ARG A 14 -6.223 -5.096 -12.195 1.00 0.00 C ATOM 114 CG ARG A 14 -6.377 -6.450 -11.519 1.00 0.00 C ATOM 115 CD ARG A 14 -6.660 -7.553 -12.528 1.00 0.00 C ATOM 116 NE ARG A 14 -8.032 -8.047 -12.428 1.00 0.00 N ATOM 117 CZ ARG A 14 -8.639 -8.748 -13.383 1.00 0.00 C ATOM 118 NH1 ARG A 14 -8.001 -9.038 -14.511 1.00 0.00 N ATOM 119 NH2 ARG A 14 -9.887 -9.160 -13.211 1.00 0.00 N ATOM 0 H ARG A 14 -3.931 -6.019 -11.895 1.00 0.00 H new ATOM 0 HA ARG A 14 -4.947 -3.370 -12.262 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -7.147 -4.532 -12.073 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -6.081 -5.248 -13.265 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -5.468 -6.687 -10.967 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -7.188 -6.404 -10.793 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -6.482 -7.177 -13.536 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -5.965 -8.378 -12.368 1.00 0.00 H new ATOM 0 HE ARG A 14 -8.555 -7.843 -11.576 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -7.041 -8.723 -14.649 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -8.471 -9.576 -15.239 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -10.382 -8.940 -12.347 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -10.352 -9.697 -13.943 1.00 0.00 H new ATOM 133 N ILE A 15 -5.074 -2.580 -9.918 1.00 0.00 N ATOM 134 CA ILE A 15 -5.300 -2.038 -8.586 1.00 0.00 C ATOM 135 C ILE A 15 -5.968 -0.669 -8.666 1.00 0.00 C ATOM 136 O ILE A 15 -5.443 0.253 -9.290 1.00 0.00 O ATOM 137 CB ILE A 15 -3.978 -1.908 -7.807 1.00 0.00 C ATOM 138 CG1 ILE A 15 -3.198 -3.224 -7.862 1.00 0.00 C ATOM 139 CG2 ILE A 15 -4.247 -1.502 -6.365 1.00 0.00 C ATOM 140 CD1 ILE A 15 -1.726 -3.068 -7.547 1.00 0.00 C ATOM 0 H ILE A 15 -4.692 -1.909 -10.585 1.00 0.00 H new ATOM 0 HA ILE A 15 -5.956 -2.732 -8.060 1.00 0.00 H new ATOM 0 HB ILE A 15 -3.374 -1.130 -8.273 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -3.639 -3.928 -7.157 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -3.304 -3.659 -8.856 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -3.302 -1.415 -5.829 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -4.764 -0.543 -6.348 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -4.868 -2.258 -5.884 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -1.237 -4.040 -7.605 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -1.270 -2.389 -8.267 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -1.610 -2.663 -6.542 1.00 0.00 H new ATOM 152 N LYS A 16 -7.128 -0.542 -8.031 1.00 0.00 N ATOM 153 CA LYS A 16 -7.864 0.717 -8.034 1.00 0.00 C ATOM 154 C LYS A 16 -8.403 1.032 -6.644 1.00 0.00 C ATOM 155 O LYS A 16 -8.942 0.160 -5.964 1.00 0.00 O ATOM 156 CB LYS A 16 -9.014 0.663 -9.043 1.00 0.00 C ATOM 157 CG LYS A 16 -9.798 -0.641 -9.009 1.00 0.00 C ATOM 158 CD LYS A 16 -11.232 -0.424 -8.549 1.00 0.00 C ATOM 159 CE LYS A 16 -12.217 -0.576 -9.696 1.00 0.00 C ATOM 160 NZ LYS A 16 -12.605 0.740 -10.275 1.00 0.00 N ATOM 0 H LYS A 16 -7.578 -1.294 -7.509 1.00 0.00 H new ATOM 0 HA LYS A 16 -7.176 1.510 -8.327 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -9.695 1.491 -8.848 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -8.613 0.809 -10.046 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -9.799 -1.091 -10.002 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -9.304 -1.345 -8.340 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -11.475 -1.139 -7.763 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -11.329 0.571 -8.115 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -11.775 -1.198 -10.474 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -13.109 -1.094 -9.342 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -13.278 0.592 -11.054 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -13.051 1.325 -9.540 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -11.758 1.224 -10.636 1.00 0.00 H new ATOM 174 N VAL A 17 -8.251 2.284 -6.226 1.00 0.00 N ATOM 175 CA VAL A 17 -8.720 2.713 -4.915 1.00 0.00 C ATOM 176 C VAL A 17 -9.797 3.784 -5.039 1.00 0.00 C ATOM 177 O VAL A 17 -9.522 4.911 -5.452 1.00 0.00 O ATOM 178 CB VAL A 17 -7.567 3.260 -4.049 1.00 0.00 C ATOM 179 CG1 VAL A 17 -7.919 3.160 -2.574 1.00 0.00 C ATOM 180 CG2 VAL A 17 -6.269 2.519 -4.341 1.00 0.00 C ATOM 0 H VAL A 17 -7.807 3.019 -6.776 1.00 0.00 H new ATOM 0 HA VAL A 17 -9.139 1.831 -4.430 1.00 0.00 H new ATOM 0 HB VAL A 17 -7.420 4.310 -4.301 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -7.095 3.550 -1.976 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -8.819 3.741 -2.375 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -8.095 2.117 -2.312 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -5.471 2.923 -3.718 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -6.398 1.459 -4.123 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -6.007 2.644 -5.392 1.00 0.00 H new ATOM 190 N ASP A 18 -11.025 3.425 -4.678 1.00 0.00 N ATOM 191 CA ASP A 18 -12.145 4.356 -4.748 1.00 0.00 C ATOM 192 C ASP A 18 -13.013 4.264 -3.497 1.00 0.00 C ATOM 193 O ASP A 18 -14.206 4.567 -3.533 1.00 0.00 O ATOM 194 CB ASP A 18 -12.991 4.076 -5.992 1.00 0.00 C ATOM 195 CG ASP A 18 -12.539 4.884 -7.193 1.00 0.00 C ATOM 196 OD1 ASP A 18 -11.445 4.597 -7.723 1.00 0.00 O ATOM 197 OD2 ASP A 18 -13.277 5.804 -7.603 1.00 0.00 O ATOM 0 H ASP A 18 -11.269 2.496 -4.334 1.00 0.00 H new ATOM 0 HA ASP A 18 -11.740 5.366 -4.811 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -12.939 3.014 -6.232 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -14.035 4.303 -5.777 1.00 0.00 H new ATOM 202 N ASP A 19 -12.408 3.844 -2.389 1.00 0.00 N ATOM 203 CA ASP A 19 -13.127 3.714 -1.128 1.00 0.00 C ATOM 204 C ASP A 19 -12.358 4.388 0.004 1.00 0.00 C ATOM 205 O ASP A 19 -11.137 4.263 0.097 1.00 0.00 O ATOM 206 CB ASP A 19 -13.362 2.237 -0.799 1.00 0.00 C ATOM 207 CG ASP A 19 -14.824 1.848 -0.895 1.00 0.00 C ATOM 208 OD1 ASP A 19 -15.319 1.676 -2.029 1.00 0.00 O ATOM 209 OD2 ASP A 19 -15.474 1.716 0.163 1.00 0.00 O ATOM 0 H ASP A 19 -11.422 3.588 -2.340 1.00 0.00 H new ATOM 0 HA ASP A 19 -14.092 4.210 -1.233 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -12.779 1.619 -1.481 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -12.999 2.030 0.208 1.00 0.00 H new ATOM 214 N VAL A 20 -13.078 5.103 0.861 1.00 0.00 N ATOM 215 CA VAL A 20 -12.459 5.797 1.983 1.00 0.00 C ATOM 216 C VAL A 20 -13.423 5.919 3.158 1.00 0.00 C ATOM 217 O VAL A 20 -14.537 6.422 3.012 1.00 0.00 O ATOM 218 CB VAL A 20 -11.982 7.204 1.578 1.00 0.00 C ATOM 219 CG1 VAL A 20 -11.178 7.841 2.702 1.00 0.00 C ATOM 220 CG2 VAL A 20 -11.167 7.143 0.295 1.00 0.00 C ATOM 0 H VAL A 20 -14.090 5.217 0.800 1.00 0.00 H new ATOM 0 HA VAL A 20 -11.598 5.201 2.285 1.00 0.00 H new ATOM 0 HB VAL A 20 -12.858 7.826 1.394 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -10.850 8.835 2.397 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -11.800 7.922 3.593 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -10.307 7.223 2.922 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -10.839 8.147 0.024 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -10.296 6.505 0.447 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -11.781 6.734 -0.507 1.00 0.00 H new ATOM 230 N LYS A 21 -12.983 5.459 4.326 1.00 0.00 N ATOM 231 CA LYS A 21 -13.802 5.518 5.530 1.00 0.00 C ATOM 232 C LYS A 21 -13.181 6.461 6.557 1.00 0.00 C ATOM 233 O LYS A 21 -12.213 6.109 7.230 1.00 0.00 O ATOM 234 CB LYS A 21 -13.968 4.120 6.131 1.00 0.00 C ATOM 235 CG LYS A 21 -15.389 3.588 6.051 1.00 0.00 C ATOM 236 CD LYS A 21 -15.771 2.818 7.306 1.00 0.00 C ATOM 237 CE LYS A 21 -16.458 1.505 6.969 1.00 0.00 C ATOM 238 NZ LYS A 21 -17.705 1.716 6.183 1.00 0.00 N ATOM 0 H LYS A 21 -12.063 5.041 4.463 1.00 0.00 H new ATOM 0 HA LYS A 21 -14.785 5.902 5.257 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -13.301 3.430 5.614 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -13.656 4.143 7.175 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -16.081 4.418 5.908 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -15.486 2.938 5.181 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -14.878 2.620 7.898 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -16.433 3.428 7.921 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -15.774 0.873 6.402 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -16.695 0.973 7.890 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -18.222 0.817 6.104 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -18.303 2.418 6.663 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -17.462 2.060 5.232 1.00 0.00 H new ATOM 252 N ILE A 22 -13.741 7.660 6.667 1.00 0.00 N ATOM 253 CA ILE A 22 -13.241 8.655 7.606 1.00 0.00 C ATOM 254 C ILE A 22 -13.606 8.292 9.042 1.00 0.00 C ATOM 255 O ILE A 22 -14.783 8.225 9.397 1.00 0.00 O ATOM 256 CB ILE A 22 -13.796 10.055 7.287 1.00 0.00 C ATOM 257 CG1 ILE A 22 -13.597 10.386 5.807 1.00 0.00 C ATOM 258 CG2 ILE A 22 -13.129 11.100 8.166 1.00 0.00 C ATOM 259 CD1 ILE A 22 -12.151 10.620 5.425 1.00 0.00 C ATOM 0 H ILE A 22 -14.543 7.966 6.116 1.00 0.00 H new ATOM 0 HA ILE A 22 -12.156 8.668 7.503 1.00 0.00 H new ATOM 0 HB ILE A 22 -14.866 10.061 7.496 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -13.995 9.570 5.204 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -14.177 11.276 5.562 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -13.531 12.085 7.929 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -13.323 10.871 9.214 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -12.054 11.094 7.986 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -12.088 10.849 4.361 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -11.753 11.456 6.001 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -11.569 9.723 5.638 1.00 0.00 H new ATOM 271 N ASN A 23 -12.588 8.067 9.866 1.00 0.00 N ATOM 272 CA ASN A 23 -12.799 7.719 11.266 1.00 0.00 C ATOM 273 C ASN A 23 -12.238 8.807 12.180 1.00 0.00 C ATOM 274 O ASN A 23 -11.255 9.465 11.842 1.00 0.00 O ATOM 275 CB ASN A 23 -12.144 6.372 11.585 1.00 0.00 C ATOM 276 CG ASN A 23 -13.122 5.382 12.188 1.00 0.00 C ATOM 277 OD1 ASN A 23 -14.216 5.174 11.662 1.00 0.00 O ATOM 278 ND2 ASN A 23 -12.731 4.766 13.297 1.00 0.00 N ATOM 0 H ASN A 23 -11.608 8.120 9.588 1.00 0.00 H new ATOM 0 HA ASN A 23 -13.872 7.638 11.441 1.00 0.00 H new ATOM 0 HB2 ASN A 23 -11.722 5.951 10.672 1.00 0.00 H new ATOM 0 HB3 ASN A 23 -11.316 6.528 12.277 1.00 0.00 H new ATOM 0 HD21 ASN A 23 -13.346 4.089 13.748 1.00 0.00 H new ATOM 0 HD22 ASN A 23 -11.815 4.970 13.698 1.00 0.00 H new ATOM 285 N PRO A 24 -12.859 9.012 13.354 1.00 0.00 N ATOM 286 CA PRO A 24 -12.417 10.030 14.315 1.00 0.00 C ATOM 287 C PRO A 24 -10.988 9.803 14.800 1.00 0.00 C ATOM 288 O PRO A 24 -10.368 10.702 15.366 1.00 0.00 O ATOM 289 CB PRO A 24 -13.405 9.886 15.480 1.00 0.00 C ATOM 290 CG PRO A 24 -14.012 8.534 15.316 1.00 0.00 C ATOM 291 CD PRO A 24 -14.037 8.274 13.838 1.00 0.00 C ATOM 0 HA PRO A 24 -12.408 11.023 13.867 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -12.897 9.975 16.440 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -14.166 10.665 15.449 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -13.426 7.776 15.836 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -15.018 8.503 15.736 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -13.967 7.210 13.614 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -14.957 8.636 13.380 1.00 0.00 H new ATOM 299 N LYS A 25 -10.469 8.598 14.584 1.00 0.00 N ATOM 300 CA LYS A 25 -9.115 8.266 15.011 1.00 0.00 C ATOM 301 C LYS A 25 -8.157 8.202 13.824 1.00 0.00 C ATOM 302 O LYS A 25 -6.959 8.443 13.972 1.00 0.00 O ATOM 303 CB LYS A 25 -9.108 6.930 15.755 1.00 0.00 C ATOM 304 CG LYS A 25 -10.053 6.894 16.946 1.00 0.00 C ATOM 305 CD LYS A 25 -11.083 5.784 16.810 1.00 0.00 C ATOM 306 CE LYS A 25 -11.506 5.248 18.169 1.00 0.00 C ATOM 307 NZ LYS A 25 -10.429 4.445 18.810 1.00 0.00 N ATOM 0 H LYS A 25 -10.964 7.838 14.117 1.00 0.00 H new ATOM 0 HA LYS A 25 -8.775 9.055 15.681 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -9.381 6.135 15.061 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -8.095 6.720 16.098 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -9.480 6.749 17.862 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -10.561 7.854 17.037 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -11.957 6.160 16.278 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -10.669 4.973 16.210 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -11.774 6.080 18.820 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -12.398 4.632 18.055 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -10.840 3.843 19.552 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -9.969 3.847 18.094 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -9.725 5.083 19.232 1.00 0.00 H new ATOM 321 N TYR A 26 -8.686 7.873 12.650 1.00 0.00 N ATOM 322 CA TYR A 26 -7.861 7.778 11.449 1.00 0.00 C ATOM 323 C TYR A 26 -8.718 7.541 10.209 1.00 0.00 C ATOM 324 O TYR A 26 -9.871 7.124 10.307 1.00 0.00 O ATOM 325 CB TYR A 26 -6.839 6.650 11.596 1.00 0.00 C ATOM 326 CG TYR A 26 -7.414 5.381 12.187 1.00 0.00 C ATOM 327 CD1 TYR A 26 -7.476 5.200 13.563 1.00 0.00 C ATOM 328 CD2 TYR A 26 -7.896 4.366 11.370 1.00 0.00 C ATOM 329 CE1 TYR A 26 -8.001 4.043 14.107 1.00 0.00 C ATOM 330 CE2 TYR A 26 -8.423 3.207 11.906 1.00 0.00 C ATOM 331 CZ TYR A 26 -8.473 3.050 13.275 1.00 0.00 C ATOM 332 OH TYR A 26 -8.997 1.897 13.814 1.00 0.00 O ATOM 0 H TYR A 26 -9.675 7.669 12.504 1.00 0.00 H new ATOM 0 HA TYR A 26 -7.336 8.726 11.328 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -6.416 6.425 10.617 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -6.019 6.995 12.226 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -7.108 5.976 14.218 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -7.858 4.485 10.297 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -8.041 3.917 15.179 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -8.794 2.428 11.256 1.00 0.00 H new ATOM 0 HH TYR A 26 -9.286 1.300 13.092 1.00 0.00 H new ATOM 342 N VAL A 27 -8.142 7.812 9.041 1.00 0.00 N ATOM 343 CA VAL A 27 -8.849 7.628 7.778 1.00 0.00 C ATOM 344 C VAL A 27 -8.345 6.387 7.047 1.00 0.00 C ATOM 345 O VAL A 27 -7.157 6.269 6.751 1.00 0.00 O ATOM 346 CB VAL A 27 -8.686 8.854 6.860 1.00 0.00 C ATOM 347 CG1 VAL A 27 -9.596 8.740 5.646 1.00 0.00 C ATOM 348 CG2 VAL A 27 -8.970 10.138 7.626 1.00 0.00 C ATOM 0 H VAL A 27 -7.188 8.160 8.943 1.00 0.00 H new ATOM 0 HA VAL A 27 -9.905 7.503 8.018 1.00 0.00 H new ATOM 0 HB VAL A 27 -7.654 8.886 6.511 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -9.466 9.616 5.010 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -9.341 7.842 5.083 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -10.634 8.681 5.974 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -8.850 10.993 6.961 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -9.991 10.116 8.007 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -8.273 10.226 8.460 1.00 0.00 H new ATOM 358 N LEU A 28 -9.257 5.462 6.764 1.00 0.00 N ATOM 359 CA LEU A 28 -8.905 4.226 6.073 1.00 0.00 C ATOM 360 C LEU A 28 -9.021 4.391 4.561 1.00 0.00 C ATOM 361 O LEU A 28 -9.704 5.291 4.074 1.00 0.00 O ATOM 362 CB LEU A 28 -9.804 3.081 6.542 1.00 0.00 C ATOM 363 CG LEU A 28 -9.710 2.754 8.034 1.00 0.00 C ATOM 364 CD1 LEU A 28 -10.538 1.521 8.361 1.00 0.00 C ATOM 365 CD2 LEU A 28 -8.260 2.549 8.444 1.00 0.00 C ATOM 0 H LEU A 28 -10.245 5.545 7.002 1.00 0.00 H new ATOM 0 HA LEU A 28 -7.869 3.989 6.315 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -10.838 3.331 6.305 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -9.553 2.186 5.973 1.00 0.00 H new ATOM 0 HG LEU A 28 -10.110 3.596 8.598 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -10.460 1.302 9.426 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -11.581 1.704 8.104 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -10.167 0.671 7.788 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -8.212 2.317 9.508 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -7.834 1.724 7.873 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -7.693 3.459 8.245 1.00 0.00 H new ATOM 377 N TYR A 29 -8.345 3.514 3.823 1.00 0.00 N ATOM 378 CA TYR A 29 -8.369 3.560 2.366 1.00 0.00 C ATOM 379 C TYR A 29 -8.744 2.200 1.786 1.00 0.00 C ATOM 380 O TYR A 29 -8.072 1.200 2.041 1.00 0.00 O ATOM 381 CB TYR A 29 -7.006 3.997 1.827 1.00 0.00 C ATOM 382 CG TYR A 29 -6.794 5.494 1.857 1.00 0.00 C ATOM 383 CD1 TYR A 29 -6.281 6.119 2.987 1.00 0.00 C ATOM 384 CD2 TYR A 29 -7.104 6.280 0.755 1.00 0.00 C ATOM 385 CE1 TYR A 29 -6.085 7.487 3.018 1.00 0.00 C ATOM 386 CE2 TYR A 29 -6.910 7.648 0.778 1.00 0.00 C ATOM 387 CZ TYR A 29 -6.400 8.247 1.912 1.00 0.00 C ATOM 388 OH TYR A 29 -6.205 9.609 1.939 1.00 0.00 O ATOM 0 H TYR A 29 -7.774 2.763 4.211 1.00 0.00 H new ATOM 0 HA TYR A 29 -9.123 4.286 2.062 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -6.222 3.516 2.412 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -6.900 3.644 0.801 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -6.031 5.527 3.855 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -7.503 5.815 -0.134 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -5.687 7.958 3.905 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -7.156 8.246 -0.087 1.00 0.00 H new ATOM 0 HH TYR A 29 -5.840 9.870 2.810 1.00 0.00 H new ATOM 398 N GLY A 30 -9.817 2.169 1.002 1.00 0.00 N ATOM 399 CA GLY A 30 -10.258 0.926 0.397 1.00 0.00 C ATOM 400 C GLY A 30 -9.531 0.625 -0.898 1.00 0.00 C ATOM 401 O GLY A 30 -9.925 1.100 -1.964 1.00 0.00 O ATOM 0 H GLY A 30 -10.389 2.983 0.775 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -10.099 0.107 1.099 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -11.330 0.978 0.205 1.00 0.00 H new ATOM 405 N VAL A 31 -8.465 -0.164 -0.806 1.00 0.00 N ATOM 406 CA VAL A 31 -7.677 -0.523 -1.978 1.00 0.00 C ATOM 407 C VAL A 31 -8.243 -1.758 -2.668 1.00 0.00 C ATOM 408 O VAL A 31 -8.256 -2.850 -2.099 1.00 0.00 O ATOM 409 CB VAL A 31 -6.204 -0.787 -1.608 1.00 0.00 C ATOM 410 CG1 VAL A 31 -5.366 -1.004 -2.858 1.00 0.00 C ATOM 411 CG2 VAL A 31 -5.647 0.361 -0.779 1.00 0.00 C ATOM 0 H VAL A 31 -8.128 -0.566 0.068 1.00 0.00 H new ATOM 0 HA VAL A 31 -7.727 0.325 -2.660 1.00 0.00 H new ATOM 0 HB VAL A 31 -6.159 -1.696 -1.008 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -4.330 -1.189 -2.574 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -5.750 -1.863 -3.409 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -5.417 -0.116 -3.489 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -4.606 0.157 -0.527 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -5.707 1.286 -1.352 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -6.228 0.464 0.137 1.00 0.00 H new ATOM 421 N SER A 32 -8.709 -1.576 -3.899 1.00 0.00 N ATOM 422 CA SER A 32 -9.276 -2.675 -4.673 1.00 0.00 C ATOM 423 C SER A 32 -8.192 -3.402 -5.462 1.00 0.00 C ATOM 424 O SER A 32 -7.334 -2.772 -6.082 1.00 0.00 O ATOM 425 CB SER A 32 -10.356 -2.153 -5.623 1.00 0.00 C ATOM 426 OG SER A 32 -11.485 -3.011 -5.633 1.00 0.00 O ATOM 0 H SER A 32 -8.705 -0.678 -4.382 1.00 0.00 H new ATOM 0 HA SER A 32 -9.727 -3.383 -3.977 1.00 0.00 H new ATOM 0 HB2 SER A 32 -10.659 -1.151 -5.319 1.00 0.00 H new ATOM 0 HB3 SER A 32 -9.949 -2.070 -6.631 1.00 0.00 H new ATOM 0 HG SER A 32 -12.161 -2.655 -6.246 1.00 0.00 H new ATOM 432 N THR A 33 -8.232 -4.730 -5.431 1.00 0.00 N ATOM 433 CA THR A 33 -7.249 -5.541 -6.140 1.00 0.00 C ATOM 434 C THR A 33 -7.812 -6.926 -6.454 1.00 0.00 C ATOM 435 O THR A 33 -8.811 -7.341 -5.870 1.00 0.00 O ATOM 436 CB THR A 33 -5.980 -5.669 -5.296 1.00 0.00 C ATOM 437 OG1 THR A 33 -6.296 -6.069 -3.975 1.00 0.00 O ATOM 438 CG2 THR A 33 -5.196 -4.378 -5.210 1.00 0.00 C ATOM 0 H THR A 33 -8.934 -5.267 -4.923 1.00 0.00 H new ATOM 0 HA THR A 33 -7.008 -5.049 -7.083 1.00 0.00 H new ATOM 0 HB THR A 33 -5.368 -6.419 -5.797 1.00 0.00 H new ATOM 0 HG1 THR A 33 -7.269 -6.140 -3.878 1.00 0.00 H new ATOM 0 HG21 THR A 33 -4.307 -4.532 -4.598 1.00 0.00 H new ATOM 0 HG22 THR A 33 -4.898 -4.066 -6.211 1.00 0.00 H new ATOM 0 HG23 THR A 33 -5.817 -3.604 -4.759 1.00 0.00 H new ATOM 446 N PRO A 34 -7.178 -7.665 -7.384 1.00 0.00 N ATOM 447 CA PRO A 34 -7.620 -9.008 -7.768 1.00 0.00 C ATOM 448 C PRO A 34 -7.927 -9.880 -6.555 1.00 0.00 C ATOM 449 O PRO A 34 -8.766 -10.779 -6.620 1.00 0.00 O ATOM 450 CB PRO A 34 -6.431 -9.579 -8.559 1.00 0.00 C ATOM 451 CG PRO A 34 -5.325 -8.582 -8.413 1.00 0.00 C ATOM 452 CD PRO A 34 -5.985 -7.263 -8.136 1.00 0.00 C ATOM 0 HA PRO A 34 -8.545 -8.980 -8.343 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -6.134 -10.552 -8.169 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -6.692 -9.722 -9.608 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -4.655 -8.860 -7.600 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -4.723 -8.533 -9.320 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -5.343 -6.600 -7.556 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -6.241 -6.735 -9.055 1.00 0.00 H new ATOM 460 N ASN A 35 -7.248 -9.602 -5.447 1.00 0.00 N ATOM 461 CA ASN A 35 -7.453 -10.355 -4.216 1.00 0.00 C ATOM 462 C ASN A 35 -8.743 -9.918 -3.528 1.00 0.00 C ATOM 463 O ASN A 35 -9.401 -10.723 -2.872 1.00 0.00 O ATOM 464 CB ASN A 35 -6.265 -10.164 -3.271 1.00 0.00 C ATOM 465 CG ASN A 35 -5.009 -10.845 -3.779 1.00 0.00 C ATOM 466 OD1 ASN A 35 -4.661 -11.941 -3.337 1.00 0.00 O ATOM 467 ND2 ASN A 35 -4.320 -10.198 -4.711 1.00 0.00 N ATOM 0 H ASN A 35 -6.551 -8.861 -5.377 1.00 0.00 H new ATOM 0 HA ASN A 35 -7.535 -11.412 -4.471 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -6.072 -9.099 -3.145 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -6.518 -10.561 -2.288 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -3.466 -10.607 -5.090 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -4.645 -9.292 -5.049 1.00 0.00 H new ATOM 474 N LYS A 36 -9.083 -8.632 -3.704 1.00 0.00 N ATOM 475 CA LYS A 36 -10.290 -8.009 -3.137 1.00 0.00 C ATOM 476 C LYS A 36 -9.959 -6.640 -2.553 1.00 0.00 C ATOM 477 O LYS A 36 -8.820 -6.182 -2.626 1.00 0.00 O ATOM 478 CB LYS A 36 -10.949 -8.878 -2.061 1.00 0.00 C ATOM 479 CG LYS A 36 -11.849 -9.955 -2.639 1.00 0.00 C ATOM 480 CD LYS A 36 -13.274 -9.456 -2.820 1.00 0.00 C ATOM 481 CE LYS A 36 -13.513 -8.952 -4.234 1.00 0.00 C ATOM 482 NZ LYS A 36 -14.353 -9.892 -5.026 1.00 0.00 N ATOM 0 H LYS A 36 -8.518 -7.985 -4.253 1.00 0.00 H new ATOM 0 HA LYS A 36 -11.000 -7.901 -3.956 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -10.174 -9.347 -1.455 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -11.533 -8.242 -1.396 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -11.453 -10.284 -3.600 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -11.848 -10.823 -1.980 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -13.974 -10.261 -2.597 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -13.473 -8.655 -2.109 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -13.999 -7.977 -4.194 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -12.556 -8.811 -4.735 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -14.492 -9.511 -5.984 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -13.878 -10.815 -5.086 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -15.277 -10.007 -4.562 1.00 0.00 H new ATOM 496 N ARG A 37 -10.965 -5.989 -1.978 1.00 0.00 N ATOM 497 CA ARG A 37 -10.781 -4.669 -1.386 1.00 0.00 C ATOM 498 C ARG A 37 -10.174 -4.781 0.009 1.00 0.00 C ATOM 499 O ARG A 37 -10.628 -5.574 0.834 1.00 0.00 O ATOM 500 CB ARG A 37 -12.118 -3.927 -1.318 1.00 0.00 C ATOM 501 CG ARG A 37 -12.065 -2.526 -1.906 1.00 0.00 C ATOM 502 CD ARG A 37 -13.452 -1.911 -2.010 1.00 0.00 C ATOM 503 NE ARG A 37 -13.638 -1.193 -3.269 1.00 0.00 N ATOM 504 CZ ARG A 37 -14.817 -0.753 -3.705 1.00 0.00 C ATOM 505 NH1 ARG A 37 -15.915 -0.958 -2.989 1.00 0.00 N ATOM 506 NH2 ARG A 37 -14.896 -0.107 -4.861 1.00 0.00 N ATOM 0 H ARG A 37 -11.915 -6.354 -1.909 1.00 0.00 H new ATOM 0 HA ARG A 37 -10.094 -4.105 -2.017 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -12.873 -4.507 -1.848 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -12.437 -3.864 -0.278 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -11.431 -1.893 -1.284 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -11.607 -2.562 -2.895 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -14.204 -2.695 -1.925 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -13.609 -1.227 -1.176 1.00 0.00 H new ATOM 0 HE ARG A 37 -12.817 -1.019 -3.848 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -15.859 -1.455 -2.100 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -16.815 -0.619 -3.328 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -14.054 0.052 -5.415 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -15.798 0.230 -5.196 1.00 0.00 H new ATOM 520 N LEU A 38 -9.141 -3.986 0.263 1.00 0.00 N ATOM 521 CA LEU A 38 -8.467 -3.997 1.556 1.00 0.00 C ATOM 522 C LEU A 38 -8.398 -2.592 2.147 1.00 0.00 C ATOM 523 O LEU A 38 -8.071 -1.631 1.450 1.00 0.00 O ATOM 524 CB LEU A 38 -7.057 -4.574 1.408 1.00 0.00 C ATOM 525 CG LEU A 38 -6.530 -5.340 2.623 1.00 0.00 C ATOM 526 CD1 LEU A 38 -6.173 -4.380 3.746 1.00 0.00 C ATOM 527 CD2 LEU A 38 -7.549 -6.365 3.099 1.00 0.00 C ATOM 0 H LEU A 38 -8.752 -3.325 -0.410 1.00 0.00 H new ATOM 0 HA LEU A 38 -9.042 -4.626 2.236 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -7.044 -5.241 0.546 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -6.370 -3.757 1.189 1.00 0.00 H new ATOM 0 HG LEU A 38 -5.627 -5.872 2.324 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -5.800 -4.943 4.601 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -5.403 -3.689 3.403 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -7.060 -3.818 4.040 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -7.153 -6.898 3.964 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -8.473 -5.858 3.377 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -7.752 -7.075 2.297 1.00 0.00 H new ATOM 539 N TYR A 39 -8.708 -2.481 3.434 1.00 0.00 N ATOM 540 CA TYR A 39 -8.683 -1.195 4.119 1.00 0.00 C ATOM 541 C TYR A 39 -7.346 -0.976 4.819 1.00 0.00 C ATOM 542 O TYR A 39 -6.976 -1.725 5.724 1.00 0.00 O ATOM 543 CB TYR A 39 -9.822 -1.112 5.137 1.00 0.00 C ATOM 544 CG TYR A 39 -11.191 -0.990 4.508 1.00 0.00 C ATOM 545 CD1 TYR A 39 -11.514 0.100 3.709 1.00 0.00 C ATOM 546 CD2 TYR A 39 -12.160 -1.964 4.712 1.00 0.00 C ATOM 547 CE1 TYR A 39 -12.765 0.215 3.132 1.00 0.00 C ATOM 548 CE2 TYR A 39 -13.412 -1.856 4.138 1.00 0.00 C ATOM 549 CZ TYR A 39 -13.710 -0.765 3.350 1.00 0.00 C ATOM 550 OH TYR A 39 -14.956 -0.653 2.777 1.00 0.00 O ATOM 0 H TYR A 39 -8.980 -3.267 4.024 1.00 0.00 H new ATOM 0 HA TYR A 39 -8.814 -0.413 3.371 1.00 0.00 H new ATOM 0 HB2 TYR A 39 -9.799 -2.001 5.768 1.00 0.00 H new ATOM 0 HB3 TYR A 39 -9.653 -0.255 5.789 1.00 0.00 H new ATOM 0 HD1 TYR A 39 -10.776 0.869 3.536 1.00 0.00 H new ATOM 0 HD2 TYR A 39 -11.931 -2.820 5.330 1.00 0.00 H new ATOM 0 HE1 TYR A 39 -13.001 1.068 2.513 1.00 0.00 H new ATOM 0 HE2 TYR A 39 -14.154 -2.623 4.306 1.00 0.00 H new ATOM 0 HH TYR A 39 -15.502 -1.427 3.028 1.00 0.00 H new ATOM 560 N LYS A 40 -6.624 0.056 4.394 1.00 0.00 N ATOM 561 CA LYS A 40 -5.328 0.376 4.980 1.00 0.00 C ATOM 562 C LYS A 40 -5.237 1.861 5.318 1.00 0.00 C ATOM 563 O LYS A 40 -6.038 2.666 4.844 1.00 0.00 O ATOM 564 CB LYS A 40 -4.201 -0.014 4.021 1.00 0.00 C ATOM 565 CG LYS A 40 -3.579 -1.365 4.330 1.00 0.00 C ATOM 566 CD LYS A 40 -2.953 -1.389 5.717 1.00 0.00 C ATOM 567 CE LYS A 40 -3.644 -2.394 6.626 1.00 0.00 C ATOM 568 NZ LYS A 40 -4.614 -1.736 7.545 1.00 0.00 N ATOM 0 H LYS A 40 -6.915 0.685 3.646 1.00 0.00 H new ATOM 0 HA LYS A 40 -5.222 -0.194 5.903 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -4.590 -0.027 3.003 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -3.425 0.750 4.056 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -4.341 -2.141 4.260 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -2.819 -1.596 3.583 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -1.895 -1.639 5.635 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -3.012 -0.395 6.161 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -4.164 -3.135 6.019 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -2.896 -2.929 7.211 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -4.629 -2.241 8.454 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -4.328 -0.748 7.702 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -5.564 -1.758 7.121 1.00 0.00 H new ATOM 582 N ARG A 41 -4.255 2.217 6.141 1.00 0.00 N ATOM 583 CA ARG A 41 -4.061 3.605 6.543 1.00 0.00 C ATOM 584 C ARG A 41 -2.850 4.210 5.840 1.00 0.00 C ATOM 585 O ARG A 41 -1.930 3.495 5.442 1.00 0.00 O ATOM 586 CB ARG A 41 -3.882 3.697 8.060 1.00 0.00 C ATOM 587 CG ARG A 41 -4.533 4.924 8.677 1.00 0.00 C ATOM 588 CD ARG A 41 -4.380 4.938 10.191 1.00 0.00 C ATOM 589 NE ARG A 41 -3.880 6.221 10.679 1.00 0.00 N ATOM 590 CZ ARG A 41 -3.540 6.451 11.945 1.00 0.00 C ATOM 591 NH1 ARG A 41 -3.646 5.488 12.853 1.00 0.00 N ATOM 592 NH2 ARG A 41 -3.093 7.647 12.305 1.00 0.00 N ATOM 0 H ARG A 41 -3.582 1.564 6.542 1.00 0.00 H new ATOM 0 HA ARG A 41 -4.947 4.169 6.253 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -4.301 2.803 8.522 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -2.817 3.706 8.292 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -4.085 5.824 8.257 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -5.591 4.944 8.418 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -5.343 4.724 10.655 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -3.697 4.144 10.494 1.00 0.00 H new ATOM 0 HE ARG A 41 -3.786 6.985 10.010 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -3.989 4.567 12.582 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -3.384 5.670 13.822 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -3.010 8.390 11.612 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -2.832 7.823 13.275 1.00 0.00 H new ATOM 606 N TYR A 42 -2.856 5.530 5.690 1.00 0.00 N ATOM 607 CA TYR A 42 -1.757 6.228 5.036 1.00 0.00 C ATOM 608 C TYR A 42 -0.456 6.030 5.806 1.00 0.00 C ATOM 609 O TYR A 42 0.533 5.538 5.260 1.00 0.00 O ATOM 610 CB TYR A 42 -2.069 7.721 4.915 1.00 0.00 C ATOM 611 CG TYR A 42 -1.103 8.468 4.023 1.00 0.00 C ATOM 612 CD1 TYR A 42 -0.752 7.967 2.776 1.00 0.00 C ATOM 613 CD2 TYR A 42 -0.543 9.672 4.428 1.00 0.00 C ATOM 614 CE1 TYR A 42 0.131 8.647 1.957 1.00 0.00 C ATOM 615 CE2 TYR A 42 0.340 10.358 3.615 1.00 0.00 C ATOM 616 CZ TYR A 42 0.673 9.841 2.381 1.00 0.00 C ATOM 617 OH TYR A 42 1.551 10.520 1.569 1.00 0.00 O ATOM 0 H TYR A 42 -3.609 6.137 6.012 1.00 0.00 H new ATOM 0 HA TYR A 42 -1.637 5.809 4.037 1.00 0.00 H new ATOM 0 HB2 TYR A 42 -3.080 7.843 4.525 1.00 0.00 H new ATOM 0 HB3 TYR A 42 -2.055 8.169 5.909 1.00 0.00 H new ATOM 0 HD1 TYR A 42 -1.175 7.032 2.441 1.00 0.00 H new ATOM 0 HD2 TYR A 42 -0.801 10.080 5.394 1.00 0.00 H new ATOM 0 HE1 TYR A 42 0.394 8.244 0.990 1.00 0.00 H new ATOM 0 HE2 TYR A 42 0.767 11.294 3.945 1.00 0.00 H new ATOM 0 HH TYR A 42 2.238 10.952 2.119 1.00 0.00 H new ATOM 627 N SER A 43 -0.465 6.412 7.079 1.00 0.00 N ATOM 628 CA SER A 43 0.712 6.275 7.928 1.00 0.00 C ATOM 629 C SER A 43 1.206 4.830 7.946 1.00 0.00 C ATOM 630 O SER A 43 2.381 4.569 8.205 1.00 0.00 O ATOM 631 CB SER A 43 0.395 6.734 9.352 1.00 0.00 C ATOM 632 OG SER A 43 -0.724 7.601 9.371 1.00 0.00 O ATOM 0 H SER A 43 -1.276 6.819 7.545 1.00 0.00 H new ATOM 0 HA SER A 43 1.501 6.905 7.517 1.00 0.00 H new ATOM 0 HB2 SER A 43 0.197 5.866 9.981 1.00 0.00 H new ATOM 0 HB3 SER A 43 1.261 7.244 9.774 1.00 0.00 H new ATOM 0 HG SER A 43 -0.907 7.879 10.293 1.00 0.00 H new ATOM 638 N GLU A 44 0.302 3.896 7.667 1.00 0.00 N ATOM 639 CA GLU A 44 0.649 2.480 7.649 1.00 0.00 C ATOM 640 C GLU A 44 1.459 2.139 6.401 1.00 0.00 C ATOM 641 O GLU A 44 2.325 1.264 6.429 1.00 0.00 O ATOM 642 CB GLU A 44 -0.617 1.621 7.702 1.00 0.00 C ATOM 643 CG GLU A 44 -1.241 1.543 9.085 1.00 0.00 C ATOM 644 CD GLU A 44 -1.159 0.152 9.686 1.00 0.00 C ATOM 645 OE1 GLU A 44 -1.153 -0.828 8.913 1.00 0.00 O ATOM 646 OE2 GLU A 44 -1.100 0.044 10.928 1.00 0.00 O ATOM 0 H GLU A 44 -0.675 4.094 7.451 1.00 0.00 H new ATOM 0 HA GLU A 44 1.258 2.267 8.528 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -1.350 2.025 7.004 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -0.377 0.613 7.363 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -0.740 2.250 9.746 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -2.286 1.848 9.026 1.00 0.00 H new ATOM 653 N PHE A 45 1.170 2.836 5.309 1.00 0.00 N ATOM 654 CA PHE A 45 1.870 2.609 4.051 1.00 0.00 C ATOM 655 C PHE A 45 3.339 3.004 4.166 1.00 0.00 C ATOM 656 O PHE A 45 4.217 2.325 3.636 1.00 0.00 O ATOM 657 CB PHE A 45 1.198 3.396 2.922 1.00 0.00 C ATOM 658 CG PHE A 45 0.564 2.524 1.877 1.00 0.00 C ATOM 659 CD1 PHE A 45 1.341 1.869 0.935 1.00 0.00 C ATOM 660 CD2 PHE A 45 -0.812 2.361 1.836 1.00 0.00 C ATOM 661 CE1 PHE A 45 0.758 1.066 -0.028 1.00 0.00 C ATOM 662 CE2 PHE A 45 -1.400 1.560 0.875 1.00 0.00 C ATOM 663 CZ PHE A 45 -0.614 0.912 -0.058 1.00 0.00 C ATOM 0 H PHE A 45 0.456 3.563 5.269 1.00 0.00 H new ATOM 0 HA PHE A 45 1.820 1.545 3.820 1.00 0.00 H new ATOM 0 HB2 PHE A 45 0.437 4.049 3.349 1.00 0.00 H new ATOM 0 HB3 PHE A 45 1.939 4.038 2.447 1.00 0.00 H new ATOM 0 HD1 PHE A 45 2.414 1.987 0.953 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -1.431 2.865 2.563 1.00 0.00 H new ATOM 0 HE1 PHE A 45 1.375 0.560 -0.756 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -2.473 1.441 0.854 1.00 0.00 H new ATOM 0 HZ PHE A 45 -1.072 0.286 -0.810 1.00 0.00 H new ATOM 673 N TRP A 46 3.601 4.105 4.864 1.00 0.00 N ATOM 674 CA TRP A 46 4.967 4.580 5.045 1.00 0.00 C ATOM 675 C TRP A 46 5.788 3.578 5.851 1.00 0.00 C ATOM 676 O TRP A 46 6.932 3.282 5.508 1.00 0.00 O ATOM 677 CB TRP A 46 4.974 5.944 5.742 1.00 0.00 C ATOM 678 CG TRP A 46 6.349 6.409 6.124 1.00 0.00 C ATOM 679 CD1 TRP A 46 6.889 6.423 7.378 1.00 0.00 C ATOM 680 CD2 TRP A 46 7.358 6.921 5.246 1.00 0.00 C ATOM 681 NE1 TRP A 46 8.173 6.910 7.332 1.00 0.00 N ATOM 682 CE2 TRP A 46 8.483 7.225 6.036 1.00 0.00 C ATOM 683 CE3 TRP A 46 7.419 7.152 3.869 1.00 0.00 C ATOM 684 CZ2 TRP A 46 9.654 7.746 5.493 1.00 0.00 C ATOM 685 CZ3 TRP A 46 8.582 7.671 3.332 1.00 0.00 C ATOM 686 CH2 TRP A 46 9.687 7.962 4.142 1.00 0.00 C ATOM 0 H TRP A 46 2.889 4.682 5.311 1.00 0.00 H new ATOM 0 HA TRP A 46 5.420 4.686 4.059 1.00 0.00 H new ATOM 0 HB2 TRP A 46 4.518 6.683 5.083 1.00 0.00 H new ATOM 0 HB3 TRP A 46 4.355 5.890 6.637 1.00 0.00 H new ATOM 0 HD1 TRP A 46 6.381 6.099 8.274 1.00 0.00 H new ATOM 0 HE1 TRP A 46 8.795 7.019 8.133 1.00 0.00 H new ATOM 0 HE3 TRP A 46 6.573 6.929 3.236 1.00 0.00 H new ATOM 0 HZ2 TRP A 46 10.507 7.972 6.116 1.00 0.00 H new ATOM 0 HZ3 TRP A 46 8.640 7.855 2.269 1.00 0.00 H new ATOM 0 HH2 TRP A 46 10.582 8.365 3.692 1.00 0.00 H new ATOM 697 N LYS A 47 5.202 3.064 6.928 1.00 0.00 N ATOM 698 CA LYS A 47 5.893 2.103 7.780 1.00 0.00 C ATOM 699 C LYS A 47 6.297 0.861 6.990 1.00 0.00 C ATOM 700 O LYS A 47 7.291 0.214 7.312 1.00 0.00 O ATOM 701 CB LYS A 47 5.020 1.715 8.980 1.00 0.00 C ATOM 702 CG LYS A 47 3.853 0.798 8.637 1.00 0.00 C ATOM 703 CD LYS A 47 3.764 -0.376 9.598 1.00 0.00 C ATOM 704 CE LYS A 47 3.236 -1.622 8.907 1.00 0.00 C ATOM 705 NZ LYS A 47 2.735 -2.630 9.883 1.00 0.00 N ATOM 0 H LYS A 47 4.256 3.295 7.230 1.00 0.00 H new ATOM 0 HA LYS A 47 6.800 2.578 8.152 1.00 0.00 H new ATOM 0 HB2 LYS A 47 5.645 1.224 9.726 1.00 0.00 H new ATOM 0 HB3 LYS A 47 4.630 2.623 9.439 1.00 0.00 H new ATOM 0 HG2 LYS A 47 2.923 1.365 8.667 1.00 0.00 H new ATOM 0 HG3 LYS A 47 3.968 0.427 7.618 1.00 0.00 H new ATOM 0 HD2 LYS A 47 4.749 -0.581 10.016 1.00 0.00 H new ATOM 0 HD3 LYS A 47 3.111 -0.117 10.432 1.00 0.00 H new ATOM 0 HE2 LYS A 47 2.431 -1.346 8.226 1.00 0.00 H new ATOM 0 HE3 LYS A 47 4.028 -2.065 8.302 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 2.447 -3.491 9.376 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 3.490 -2.863 10.560 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 1.918 -2.241 10.396 1.00 0.00 H new ATOM 719 N LEU A 48 5.525 0.534 5.957 1.00 0.00 N ATOM 720 CA LEU A 48 5.818 -0.632 5.131 1.00 0.00 C ATOM 721 C LEU A 48 6.954 -0.342 4.154 1.00 0.00 C ATOM 722 O LEU A 48 7.688 -1.246 3.755 1.00 0.00 O ATOM 723 CB LEU A 48 4.568 -1.069 4.362 1.00 0.00 C ATOM 724 CG LEU A 48 4.780 -2.232 3.390 1.00 0.00 C ATOM 725 CD1 LEU A 48 5.148 -3.500 4.145 1.00 0.00 C ATOM 726 CD2 LEU A 48 3.534 -2.456 2.544 1.00 0.00 C ATOM 0 H LEU A 48 4.696 1.057 5.674 1.00 0.00 H new ATOM 0 HA LEU A 48 6.131 -1.440 5.792 1.00 0.00 H new ATOM 0 HB2 LEU A 48 3.798 -1.351 5.080 1.00 0.00 H new ATOM 0 HB3 LEU A 48 4.186 -0.214 3.804 1.00 0.00 H new ATOM 0 HG LEU A 48 5.605 -1.977 2.725 1.00 0.00 H new ATOM 0 HD11 LEU A 48 5.295 -4.316 3.437 1.00 0.00 H new ATOM 0 HD12 LEU A 48 6.069 -3.336 4.705 1.00 0.00 H new ATOM 0 HD13 LEU A 48 4.345 -3.759 4.835 1.00 0.00 H new ATOM 0 HD21 LEU A 48 3.704 -3.287 1.859 1.00 0.00 H new ATOM 0 HD22 LEU A 48 2.690 -2.688 3.194 1.00 0.00 H new ATOM 0 HD23 LEU A 48 3.315 -1.554 1.973 1.00 0.00 H new ATOM 738 N LYS A 49 7.090 0.921 3.767 1.00 0.00 N ATOM 739 CA LYS A 49 8.132 1.328 2.831 1.00 0.00 C ATOM 740 C LYS A 49 9.526 1.065 3.398 1.00 0.00 C ATOM 741 O LYS A 49 10.227 0.157 2.952 1.00 0.00 O ATOM 742 CB LYS A 49 7.980 2.810 2.486 1.00 0.00 C ATOM 743 CG LYS A 49 8.011 3.090 0.994 1.00 0.00 C ATOM 744 CD LYS A 49 9.401 3.494 0.531 1.00 0.00 C ATOM 745 CE LYS A 49 9.715 4.935 0.903 1.00 0.00 C ATOM 746 NZ LYS A 49 11.046 5.362 0.393 1.00 0.00 N ATOM 0 H LYS A 49 6.491 1.682 4.087 1.00 0.00 H new ATOM 0 HA LYS A 49 8.018 0.732 1.925 1.00 0.00 H new ATOM 0 HB2 LYS A 49 7.039 3.176 2.897 1.00 0.00 H new ATOM 0 HB3 LYS A 49 8.779 3.372 2.970 1.00 0.00 H new ATOM 0 HG2 LYS A 49 7.689 2.202 0.450 1.00 0.00 H new ATOM 0 HG3 LYS A 49 7.303 3.884 0.757 1.00 0.00 H new ATOM 0 HD2 LYS A 49 10.142 2.832 0.979 1.00 0.00 H new ATOM 0 HD3 LYS A 49 9.476 3.371 -0.549 1.00 0.00 H new ATOM 0 HE2 LYS A 49 8.944 5.591 0.499 1.00 0.00 H new ATOM 0 HE3 LYS A 49 9.690 5.044 1.987 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 11.222 6.350 0.667 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 11.785 4.753 0.798 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 11.062 5.283 -0.644 1.00 0.00 H new ATOM 760 N THR A 50 9.924 1.876 4.372 1.00 0.00 N ATOM 761 CA THR A 50 11.240 1.745 4.993 1.00 0.00 C ATOM 762 C THR A 50 11.488 0.326 5.496 1.00 0.00 C ATOM 763 O THR A 50 12.631 -0.127 5.551 1.00 0.00 O ATOM 764 CB THR A 50 11.388 2.745 6.145 1.00 0.00 C ATOM 765 OG1 THR A 50 12.461 2.377 6.995 1.00 0.00 O ATOM 766 CG2 THR A 50 10.146 2.868 7.002 1.00 0.00 C ATOM 0 H THR A 50 9.354 2.633 4.750 1.00 0.00 H new ATOM 0 HA THR A 50 11.987 1.964 4.229 1.00 0.00 H new ATOM 0 HB THR A 50 11.573 3.706 5.666 1.00 0.00 H new ATOM 0 HG1 THR A 50 12.540 3.028 7.723 1.00 0.00 H new ATOM 0 HG21 THR A 50 10.323 3.592 7.797 1.00 0.00 H new ATOM 0 HG22 THR A 50 9.311 3.202 6.386 1.00 0.00 H new ATOM 0 HG23 THR A 50 9.909 1.899 7.441 1.00 0.00 H new ATOM 774 N ARG A 51 10.420 -0.375 5.862 1.00 0.00 N ATOM 775 CA ARG A 51 10.548 -1.741 6.355 1.00 0.00 C ATOM 776 C ARG A 51 11.164 -2.642 5.290 1.00 0.00 C ATOM 777 O ARG A 51 12.262 -3.166 5.468 1.00 0.00 O ATOM 778 CB ARG A 51 9.181 -2.285 6.771 1.00 0.00 C ATOM 779 CG ARG A 51 9.258 -3.382 7.815 1.00 0.00 C ATOM 780 CD ARG A 51 9.170 -2.819 9.224 1.00 0.00 C ATOM 781 NE ARG A 51 7.785 -2.662 9.663 1.00 0.00 N ATOM 782 CZ ARG A 51 7.425 -2.462 10.928 1.00 0.00 C ATOM 783 NH1 ARG A 51 8.343 -2.391 11.883 1.00 0.00 N ATOM 784 NH2 ARG A 51 6.142 -2.332 11.239 1.00 0.00 N ATOM 0 H ARG A 51 9.463 -0.023 5.827 1.00 0.00 H new ATOM 0 HA ARG A 51 11.205 -1.730 7.224 1.00 0.00 H new ATOM 0 HB2 ARG A 51 8.576 -1.466 7.160 1.00 0.00 H new ATOM 0 HB3 ARG A 51 8.668 -2.669 5.889 1.00 0.00 H new ATOM 0 HG2 ARG A 51 8.448 -4.094 7.656 1.00 0.00 H new ATOM 0 HG3 ARG A 51 10.193 -3.931 7.699 1.00 0.00 H new ATOM 0 HD2 ARG A 51 9.696 -3.480 9.913 1.00 0.00 H new ATOM 0 HD3 ARG A 51 9.674 -1.853 9.261 1.00 0.00 H new ATOM 0 HE ARG A 51 7.050 -2.709 8.957 1.00 0.00 H new ATOM 0 HH11 ARG A 51 9.331 -2.490 11.649 1.00 0.00 H new ATOM 0 HH12 ARG A 51 8.061 -2.237 12.851 1.00 0.00 H new ATOM 0 HH21 ARG A 51 5.432 -2.385 10.508 1.00 0.00 H new ATOM 0 HH22 ARG A 51 5.865 -2.179 12.209 1.00 0.00 H new ATOM 798 N LEU A 52 10.452 -2.807 4.179 1.00 0.00 N ATOM 799 CA LEU A 52 10.926 -3.633 3.071 1.00 0.00 C ATOM 800 C LEU A 52 12.381 -3.320 2.739 1.00 0.00 C ATOM 801 O LEU A 52 13.142 -4.201 2.337 1.00 0.00 O ATOM 802 CB LEU A 52 10.062 -3.401 1.829 1.00 0.00 C ATOM 803 CG LEU A 52 8.555 -3.551 2.041 1.00 0.00 C ATOM 804 CD1 LEU A 52 7.788 -2.686 1.053 1.00 0.00 C ATOM 805 CD2 LEU A 52 8.146 -5.007 1.907 1.00 0.00 C ATOM 0 H LEU A 52 9.540 -2.378 4.021 1.00 0.00 H new ATOM 0 HA LEU A 52 10.852 -4.676 3.377 1.00 0.00 H new ATOM 0 HB2 LEU A 52 10.261 -2.398 1.451 1.00 0.00 H new ATOM 0 HB3 LEU A 52 10.374 -4.101 1.054 1.00 0.00 H new ATOM 0 HG LEU A 52 8.312 -3.215 3.049 1.00 0.00 H new ATOM 0 HD11 LEU A 52 6.717 -2.806 1.219 1.00 0.00 H new ATOM 0 HD12 LEU A 52 8.062 -1.641 1.195 1.00 0.00 H new ATOM 0 HD13 LEU A 52 8.034 -2.991 0.036 1.00 0.00 H new ATOM 0 HD21 LEU A 52 7.071 -5.098 2.060 1.00 0.00 H new ATOM 0 HD22 LEU A 52 8.402 -5.367 0.910 1.00 0.00 H new ATOM 0 HD23 LEU A 52 8.671 -5.603 2.654 1.00 0.00 H new ATOM 817 N GLU A 53 12.758 -2.056 2.903 1.00 0.00 N ATOM 818 CA GLU A 53 14.120 -1.619 2.614 1.00 0.00 C ATOM 819 C GLU A 53 15.119 -2.263 3.571 1.00 0.00 C ATOM 820 O GLU A 53 16.196 -2.695 3.159 1.00 0.00 O ATOM 821 CB GLU A 53 14.219 -0.095 2.703 1.00 0.00 C ATOM 822 CG GLU A 53 13.668 0.621 1.481 1.00 0.00 C ATOM 823 CD GLU A 53 13.356 2.080 1.752 1.00 0.00 C ATOM 824 OE1 GLU A 53 14.285 2.910 1.675 1.00 0.00 O ATOM 825 OE2 GLU A 53 12.180 2.392 2.041 1.00 0.00 O ATOM 0 H GLU A 53 12.139 -1.316 3.235 1.00 0.00 H new ATOM 0 HA GLU A 53 14.366 -1.934 1.600 1.00 0.00 H new ATOM 0 HB2 GLU A 53 13.680 0.245 3.587 1.00 0.00 H new ATOM 0 HB3 GLU A 53 15.263 0.186 2.839 1.00 0.00 H new ATOM 0 HG2 GLU A 53 14.391 0.553 0.668 1.00 0.00 H new ATOM 0 HG3 GLU A 53 12.762 0.116 1.146 1.00 0.00 H new ATOM 832 N ARG A 54 14.758 -2.322 4.848 1.00 0.00 N ATOM 833 CA ARG A 54 15.627 -2.912 5.861 1.00 0.00 C ATOM 834 C ARG A 54 15.350 -4.406 6.029 1.00 0.00 C ATOM 835 O ARG A 54 16.171 -5.137 6.582 1.00 0.00 O ATOM 836 CB ARG A 54 15.442 -2.195 7.200 1.00 0.00 C ATOM 837 CG ARG A 54 15.418 -0.679 7.080 1.00 0.00 C ATOM 838 CD ARG A 54 16.799 -0.122 6.773 1.00 0.00 C ATOM 839 NE ARG A 54 17.051 1.134 7.472 1.00 0.00 N ATOM 840 CZ ARG A 54 17.399 1.212 8.755 1.00 0.00 C ATOM 841 NH1 ARG A 54 17.537 0.109 9.481 1.00 0.00 N ATOM 842 NH2 ARG A 54 17.609 2.396 9.315 1.00 0.00 N ATOM 0 H ARG A 54 13.871 -1.969 5.207 1.00 0.00 H new ATOM 0 HA ARG A 54 16.658 -2.792 5.527 1.00 0.00 H new ATOM 0 HB2 ARG A 54 14.511 -2.530 7.656 1.00 0.00 H new ATOM 0 HB3 ARG A 54 16.249 -2.485 7.873 1.00 0.00 H new ATOM 0 HG2 ARG A 54 14.723 -0.386 6.293 1.00 0.00 H new ATOM 0 HG3 ARG A 54 15.048 -0.245 8.009 1.00 0.00 H new ATOM 0 HD2 ARG A 54 17.556 -0.853 7.057 1.00 0.00 H new ATOM 0 HD3 ARG A 54 16.896 0.036 5.699 1.00 0.00 H new ATOM 0 HE ARG A 54 16.955 2.003 6.947 1.00 0.00 H new ATOM 0 HH11 ARG A 54 17.376 -0.804 9.056 1.00 0.00 H new ATOM 0 HH12 ARG A 54 17.804 0.175 10.463 1.00 0.00 H new ATOM 0 HH21 ARG A 54 17.504 3.247 8.763 1.00 0.00 H new ATOM 0 HH22 ARG A 54 17.876 2.455 10.298 1.00 0.00 H new ATOM 856 N ASP A 55 14.192 -4.853 5.551 1.00 0.00 N ATOM 857 CA ASP A 55 13.815 -6.258 5.652 1.00 0.00 C ATOM 858 C ASP A 55 14.323 -7.044 4.448 1.00 0.00 C ATOM 859 O ASP A 55 14.749 -8.192 4.578 1.00 0.00 O ATOM 860 CB ASP A 55 12.295 -6.393 5.759 1.00 0.00 C ATOM 861 CG ASP A 55 11.792 -6.159 7.170 1.00 0.00 C ATOM 862 OD1 ASP A 55 12.442 -5.393 7.913 1.00 0.00 O ATOM 863 OD2 ASP A 55 10.747 -6.740 7.532 1.00 0.00 O ATOM 0 H ASP A 55 13.500 -4.262 5.090 1.00 0.00 H new ATOM 0 HA ASP A 55 14.273 -6.668 6.552 1.00 0.00 H new ATOM 0 HB2 ASP A 55 11.821 -5.680 5.084 1.00 0.00 H new ATOM 0 HB3 ASP A 55 11.997 -7.389 5.431 1.00 0.00 H new ATOM 868 N VAL A 56 14.276 -6.417 3.280 1.00 0.00 N ATOM 869 CA VAL A 56 14.732 -7.052 2.052 1.00 0.00 C ATOM 870 C VAL A 56 16.202 -6.745 1.795 1.00 0.00 C ATOM 871 O VAL A 56 16.924 -7.553 1.211 1.00 0.00 O ATOM 872 CB VAL A 56 13.904 -6.585 0.840 1.00 0.00 C ATOM 873 CG1 VAL A 56 14.274 -7.382 -0.399 1.00 0.00 C ATOM 874 CG2 VAL A 56 12.416 -6.702 1.137 1.00 0.00 C ATOM 0 H VAL A 56 13.926 -5.467 3.158 1.00 0.00 H new ATOM 0 HA VAL A 56 14.602 -8.127 2.180 1.00 0.00 H new ATOM 0 HB VAL A 56 14.132 -5.537 0.647 1.00 0.00 H new ATOM 0 HG11 VAL A 56 13.679 -7.038 -1.244 1.00 0.00 H new ATOM 0 HG12 VAL A 56 15.332 -7.242 -0.619 1.00 0.00 H new ATOM 0 HG13 VAL A 56 14.077 -8.440 -0.224 1.00 0.00 H new ATOM 0 HG21 VAL A 56 11.845 -6.368 0.271 1.00 0.00 H new ATOM 0 HG22 VAL A 56 12.169 -7.741 1.356 1.00 0.00 H new ATOM 0 HG23 VAL A 56 12.167 -6.081 1.997 1.00 0.00 H new ATOM 884 N GLY A 57 16.635 -5.568 2.233 1.00 0.00 N ATOM 885 CA GLY A 57 18.016 -5.169 2.042 1.00 0.00 C ATOM 886 C GLY A 57 18.234 -4.427 0.736 1.00 0.00 C ATOM 887 O GLY A 57 19.309 -3.877 0.501 1.00 0.00 O ATOM 0 H GLY A 57 16.054 -4.883 2.717 1.00 0.00 H new ATOM 0 HA2 GLY A 57 18.325 -4.534 2.872 1.00 0.00 H new ATOM 0 HA3 GLY A 57 18.652 -6.054 2.063 1.00 0.00 H new ATOM 891 N SER A 58 17.213 -4.411 -0.117 1.00 0.00 N ATOM 892 CA SER A 58 17.303 -3.731 -1.403 1.00 0.00 C ATOM 893 C SER A 58 16.579 -2.389 -1.359 1.00 0.00 C ATOM 894 O SER A 58 15.819 -2.113 -0.431 1.00 0.00 O ATOM 895 CB SER A 58 16.714 -4.608 -2.510 1.00 0.00 C ATOM 896 OG SER A 58 17.713 -5.000 -3.436 1.00 0.00 O ATOM 0 H SER A 58 16.315 -4.861 0.060 1.00 0.00 H new ATOM 0 HA SER A 58 18.356 -3.548 -1.618 1.00 0.00 H new ATOM 0 HB2 SER A 58 16.253 -5.493 -2.071 1.00 0.00 H new ATOM 0 HB3 SER A 58 15.926 -4.063 -3.030 1.00 0.00 H new ATOM 0 HG SER A 58 17.312 -5.561 -4.132 1.00 0.00 H new ATOM 902 N THR A 59 16.818 -1.558 -2.368 1.00 0.00 N ATOM 903 CA THR A 59 16.186 -0.248 -2.443 1.00 0.00 C ATOM 904 C THR A 59 14.782 -0.357 -3.030 1.00 0.00 C ATOM 905 O THR A 59 14.462 -1.323 -3.724 1.00 0.00 O ATOM 906 CB THR A 59 17.037 0.709 -3.283 1.00 0.00 C ATOM 907 OG1 THR A 59 16.592 2.045 -3.126 1.00 0.00 O ATOM 908 CG2 THR A 59 17.018 0.391 -4.763 1.00 0.00 C ATOM 0 H THR A 59 17.445 -1.769 -3.144 1.00 0.00 H new ATOM 0 HA THR A 59 16.106 0.149 -1.431 1.00 0.00 H new ATOM 0 HB THR A 59 18.056 0.584 -2.915 1.00 0.00 H new ATOM 0 HG1 THR A 59 17.149 2.641 -3.669 1.00 0.00 H new ATOM 0 HG21 THR A 59 17.641 1.108 -5.297 1.00 0.00 H new ATOM 0 HG22 THR A 59 17.404 -0.616 -4.924 1.00 0.00 H new ATOM 0 HG23 THR A 59 15.995 0.451 -5.135 1.00 0.00 H new ATOM 916 N ILE A 60 13.948 0.638 -2.747 1.00 0.00 N ATOM 917 CA ILE A 60 12.578 0.649 -3.249 1.00 0.00 C ATOM 918 C ILE A 60 12.360 1.807 -4.226 1.00 0.00 C ATOM 919 O ILE A 60 12.602 2.965 -3.886 1.00 0.00 O ATOM 920 CB ILE A 60 11.561 0.752 -2.093 1.00 0.00 C ATOM 921 CG1 ILE A 60 10.150 0.463 -2.603 1.00 0.00 C ATOM 922 CG2 ILE A 60 11.624 2.124 -1.436 1.00 0.00 C ATOM 923 CD1 ILE A 60 9.762 -0.997 -2.512 1.00 0.00 C ATOM 0 H ILE A 60 14.195 1.445 -2.174 1.00 0.00 H new ATOM 0 HA ILE A 60 12.419 -0.293 -3.774 1.00 0.00 H new ATOM 0 HB ILE A 60 11.819 0.007 -1.341 1.00 0.00 H new ATOM 0 HG12 ILE A 60 9.437 1.057 -2.031 1.00 0.00 H new ATOM 0 HG13 ILE A 60 10.074 0.787 -3.641 1.00 0.00 H new ATOM 0 HG21 ILE A 60 10.898 2.172 -0.624 1.00 0.00 H new ATOM 0 HG22 ILE A 60 12.625 2.291 -1.038 1.00 0.00 H new ATOM 0 HG23 ILE A 60 11.394 2.892 -2.175 1.00 0.00 H new ATOM 0 HD11 ILE A 60 8.749 -1.128 -2.891 1.00 0.00 H new ATOM 0 HD12 ILE A 60 10.452 -1.595 -3.107 1.00 0.00 H new ATOM 0 HD13 ILE A 60 9.805 -1.321 -1.472 1.00 0.00 H new ATOM 935 N PRO A 61 11.908 1.510 -5.459 1.00 0.00 N ATOM 936 CA PRO A 61 11.671 2.526 -6.480 1.00 0.00 C ATOM 937 C PRO A 61 10.261 3.111 -6.427 1.00 0.00 C ATOM 938 O PRO A 61 9.676 3.433 -7.462 1.00 0.00 O ATOM 939 CB PRO A 61 11.873 1.739 -7.770 1.00 0.00 C ATOM 940 CG PRO A 61 11.394 0.362 -7.449 1.00 0.00 C ATOM 941 CD PRO A 61 11.602 0.158 -5.965 1.00 0.00 C ATOM 0 HA PRO A 61 12.325 3.390 -6.363 1.00 0.00 H new ATOM 0 HB2 PRO A 61 11.306 2.174 -8.593 1.00 0.00 H new ATOM 0 HB3 PRO A 61 12.920 1.734 -8.072 1.00 0.00 H new ATOM 0 HG2 PRO A 61 10.342 0.249 -7.710 1.00 0.00 H new ATOM 0 HG3 PRO A 61 11.947 -0.382 -8.022 1.00 0.00 H new ATOM 0 HD2 PRO A 61 10.712 -0.254 -5.490 1.00 0.00 H new ATOM 0 HD3 PRO A 61 12.419 -0.536 -5.768 1.00 0.00 H new ATOM 949 N TYR A 62 9.718 3.246 -5.222 1.00 0.00 N ATOM 950 CA TYR A 62 8.377 3.794 -5.048 1.00 0.00 C ATOM 951 C TYR A 62 8.431 5.220 -4.512 1.00 0.00 C ATOM 952 O TYR A 62 9.375 5.600 -3.820 1.00 0.00 O ATOM 953 CB TYR A 62 7.565 2.916 -4.096 1.00 0.00 C ATOM 954 CG TYR A 62 7.183 1.577 -4.681 1.00 0.00 C ATOM 955 CD1 TYR A 62 6.668 1.481 -5.967 1.00 0.00 C ATOM 956 CD2 TYR A 62 7.334 0.409 -3.945 1.00 0.00 C ATOM 957 CE1 TYR A 62 6.315 0.258 -6.504 1.00 0.00 C ATOM 958 CE2 TYR A 62 6.983 -0.819 -4.474 1.00 0.00 C ATOM 959 CZ TYR A 62 6.474 -0.889 -5.754 1.00 0.00 C ATOM 960 OH TYR A 62 6.124 -2.110 -6.283 1.00 0.00 O ATOM 0 H TYR A 62 10.184 2.984 -4.353 1.00 0.00 H new ATOM 0 HA TYR A 62 7.894 3.811 -6.025 1.00 0.00 H new ATOM 0 HB2 TYR A 62 8.141 2.753 -3.185 1.00 0.00 H new ATOM 0 HB3 TYR A 62 6.659 3.449 -3.809 1.00 0.00 H new ATOM 0 HD1 TYR A 62 6.541 2.377 -6.557 1.00 0.00 H new ATOM 0 HD2 TYR A 62 7.732 0.461 -2.942 1.00 0.00 H new ATOM 0 HE1 TYR A 62 5.916 0.200 -7.506 1.00 0.00 H new ATOM 0 HE2 TYR A 62 7.107 -1.718 -3.889 1.00 0.00 H new ATOM 0 HH TYR A 62 6.934 -2.616 -6.503 1.00 0.00 H new ATOM 970 N ASP A 63 7.406 6.005 -4.832 1.00 0.00 N ATOM 971 CA ASP A 63 7.327 7.387 -4.377 1.00 0.00 C ATOM 972 C ASP A 63 6.433 7.493 -3.146 1.00 0.00 C ATOM 973 O ASP A 63 5.356 6.899 -3.099 1.00 0.00 O ATOM 974 CB ASP A 63 6.791 8.285 -5.495 1.00 0.00 C ATOM 975 CG ASP A 63 7.578 9.573 -5.631 1.00 0.00 C ATOM 976 OD1 ASP A 63 8.152 10.028 -4.619 1.00 0.00 O ATOM 977 OD2 ASP A 63 7.621 10.128 -6.750 1.00 0.00 O ATOM 0 H ASP A 63 6.618 5.705 -5.406 1.00 0.00 H new ATOM 0 HA ASP A 63 8.330 7.719 -4.109 1.00 0.00 H new ATOM 0 HB2 ASP A 63 6.823 7.742 -6.440 1.00 0.00 H new ATOM 0 HB3 ASP A 63 5.745 8.521 -5.298 1.00 0.00 H new ATOM 982 N PHE A 64 6.885 8.247 -2.148 1.00 0.00 N ATOM 983 CA PHE A 64 6.118 8.415 -0.919 1.00 0.00 C ATOM 984 C PHE A 64 6.283 9.823 -0.349 1.00 0.00 C ATOM 985 O PHE A 64 7.249 10.105 0.357 1.00 0.00 O ATOM 986 CB PHE A 64 6.558 7.382 0.120 1.00 0.00 C ATOM 987 CG PHE A 64 5.446 6.925 1.020 1.00 0.00 C ATOM 988 CD1 PHE A 64 4.743 7.835 1.791 1.00 0.00 C ATOM 989 CD2 PHE A 64 5.109 5.584 1.098 1.00 0.00 C ATOM 990 CE1 PHE A 64 3.721 7.416 2.622 1.00 0.00 C ATOM 991 CE2 PHE A 64 4.089 5.158 1.927 1.00 0.00 C ATOM 992 CZ PHE A 64 3.394 6.076 2.690 1.00 0.00 C ATOM 0 H PHE A 64 7.773 8.748 -2.166 1.00 0.00 H new ATOM 0 HA PHE A 64 5.065 8.265 -1.158 1.00 0.00 H new ATOM 0 HB2 PHE A 64 6.977 6.517 -0.394 1.00 0.00 H new ATOM 0 HB3 PHE A 64 7.355 7.808 0.729 1.00 0.00 H new ATOM 0 HD1 PHE A 64 4.996 8.884 1.743 1.00 0.00 H new ATOM 0 HD2 PHE A 64 5.650 4.863 0.504 1.00 0.00 H new ATOM 0 HE1 PHE A 64 3.179 8.136 3.217 1.00 0.00 H new ATOM 0 HE2 PHE A 64 3.836 4.109 1.978 1.00 0.00 H new ATOM 0 HZ PHE A 64 2.596 5.746 3.339 1.00 0.00 H new ATOM 1002 N PRO A 65 5.333 10.728 -0.645 1.00 0.00 N ATOM 1003 CA PRO A 65 5.377 12.106 -0.152 1.00 0.00 C ATOM 1004 C PRO A 65 4.944 12.211 1.307 1.00 0.00 C ATOM 1005 O PRO A 65 3.766 12.056 1.626 1.00 0.00 O ATOM 1006 CB PRO A 65 4.380 12.827 -1.057 1.00 0.00 C ATOM 1007 CG PRO A 65 3.381 11.782 -1.416 1.00 0.00 C ATOM 1008 CD PRO A 65 4.138 10.480 -1.479 1.00 0.00 C ATOM 0 HA PRO A 65 6.384 12.523 -0.180 1.00 0.00 H new ATOM 0 HB2 PRO A 65 3.910 13.665 -0.542 1.00 0.00 H new ATOM 0 HB3 PRO A 65 4.869 13.231 -1.944 1.00 0.00 H new ATOM 0 HG2 PRO A 65 2.585 11.734 -0.673 1.00 0.00 H new ATOM 0 HG3 PRO A 65 2.911 12.006 -2.374 1.00 0.00 H new ATOM 0 HD2 PRO A 65 3.544 9.652 -1.091 1.00 0.00 H new ATOM 0 HD3 PRO A 65 4.410 10.224 -2.503 1.00 0.00 H new ATOM 1016 N GLU A 66 5.904 12.471 2.189 1.00 0.00 N ATOM 1017 CA GLU A 66 5.617 12.592 3.614 1.00 0.00 C ATOM 1018 C GLU A 66 5.255 14.030 3.976 1.00 0.00 C ATOM 1019 O GLU A 66 5.741 14.978 3.359 1.00 0.00 O ATOM 1020 CB GLU A 66 6.820 12.129 4.439 1.00 0.00 C ATOM 1021 CG GLU A 66 6.626 10.766 5.085 1.00 0.00 C ATOM 1022 CD GLU A 66 7.200 10.698 6.486 1.00 0.00 C ATOM 1023 OE1 GLU A 66 8.410 10.418 6.619 1.00 0.00 O ATOM 1024 OE2 GLU A 66 6.441 10.925 7.451 1.00 0.00 O ATOM 0 H GLU A 66 6.885 12.602 1.943 1.00 0.00 H new ATOM 0 HA GLU A 66 4.763 11.955 3.844 1.00 0.00 H new ATOM 0 HB2 GLU A 66 7.700 12.095 3.796 1.00 0.00 H new ATOM 0 HB3 GLU A 66 7.022 12.865 5.217 1.00 0.00 H new ATOM 0 HG2 GLU A 66 5.562 10.533 5.121 1.00 0.00 H new ATOM 0 HG3 GLU A 66 7.098 10.004 4.465 1.00 0.00 H new ATOM 1031 N LYS A 67 4.397 14.183 4.980 1.00 0.00 N ATOM 1032 CA LYS A 67 3.967 15.503 5.425 1.00 0.00 C ATOM 1033 C LYS A 67 3.737 15.520 6.936 1.00 0.00 C ATOM 1034 O LYS A 67 2.739 14.986 7.422 1.00 0.00 O ATOM 1035 CB LYS A 67 2.684 15.914 4.700 1.00 0.00 C ATOM 1036 CG LYS A 67 2.928 16.519 3.327 1.00 0.00 C ATOM 1037 CD LYS A 67 2.900 18.038 3.374 1.00 0.00 C ATOM 1038 CE LYS A 67 3.979 18.586 4.293 1.00 0.00 C ATOM 1039 NZ LYS A 67 5.346 18.338 3.757 1.00 0.00 N ATOM 0 H LYS A 67 3.986 13.408 5.501 1.00 0.00 H new ATOM 0 HA LYS A 67 4.757 16.215 5.187 1.00 0.00 H new ATOM 0 HB2 LYS A 67 2.041 15.040 4.594 1.00 0.00 H new ATOM 0 HB3 LYS A 67 2.144 16.634 5.315 1.00 0.00 H new ATOM 0 HG2 LYS A 67 3.893 16.184 2.947 1.00 0.00 H new ATOM 0 HG3 LYS A 67 2.169 16.162 2.631 1.00 0.00 H new ATOM 0 HD2 LYS A 67 3.039 18.437 2.369 1.00 0.00 H new ATOM 0 HD3 LYS A 67 1.922 18.375 3.718 1.00 0.00 H new ATOM 0 HE2 LYS A 67 3.831 19.658 4.427 1.00 0.00 H new ATOM 0 HE3 LYS A 67 3.886 18.125 5.277 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 6.053 18.712 4.422 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 5.491 17.315 3.636 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 5.450 18.813 2.838 1.00 0.00 H new ATOM 1053 N PRO A 68 4.657 16.133 7.704 1.00 0.00 N ATOM 1054 CA PRO A 68 4.538 16.209 9.165 1.00 0.00 C ATOM 1055 C PRO A 68 3.397 17.121 9.606 1.00 0.00 C ATOM 1056 O PRO A 68 3.031 18.060 8.901 1.00 0.00 O ATOM 1057 CB PRO A 68 5.885 16.789 9.603 1.00 0.00 C ATOM 1058 CG PRO A 68 6.374 17.548 8.420 1.00 0.00 C ATOM 1059 CD PRO A 68 5.880 16.799 7.214 1.00 0.00 C ATOM 0 HA PRO A 68 4.314 15.238 9.606 1.00 0.00 H new ATOM 0 HB2 PRO A 68 5.773 17.439 10.471 1.00 0.00 H new ATOM 0 HB3 PRO A 68 6.583 16.000 9.883 1.00 0.00 H new ATOM 0 HG2 PRO A 68 5.994 18.570 8.428 1.00 0.00 H new ATOM 0 HG3 PRO A 68 7.462 17.613 8.420 1.00 0.00 H new ATOM 0 HD2 PRO A 68 5.666 17.471 6.383 1.00 0.00 H new ATOM 0 HD3 PRO A 68 6.616 16.078 6.859 1.00 0.00 H new ATOM 1067 N GLY A 69 2.839 16.835 10.778 1.00 0.00 N ATOM 1068 CA GLY A 69 1.745 17.637 11.294 1.00 0.00 C ATOM 1069 C GLY A 69 1.632 17.560 12.805 1.00 0.00 C ATOM 1070 O GLY A 69 0.722 16.923 13.335 1.00 0.00 O ATOM 0 H GLY A 69 3.125 16.062 11.379 1.00 0.00 H new ATOM 0 HA2 GLY A 69 1.888 18.676 10.996 1.00 0.00 H new ATOM 0 HA3 GLY A 69 0.810 17.302 10.845 1.00 0.00 H new ATOM 1074 N VAL A 70 2.562 18.209 13.499 1.00 0.00 N ATOM 1075 CA VAL A 70 2.563 18.212 14.957 1.00 0.00 C ATOM 1076 C VAL A 70 2.037 19.538 15.505 1.00 0.00 C ATOM 1077 O VAL A 70 0.882 19.635 15.918 1.00 0.00 O ATOM 1078 CB VAL A 70 3.978 17.945 15.516 1.00 0.00 C ATOM 1079 CG1 VAL A 70 3.985 18.022 17.035 1.00 0.00 C ATOM 1080 CG2 VAL A 70 4.488 16.592 15.043 1.00 0.00 C ATOM 0 H VAL A 70 3.324 18.739 13.075 1.00 0.00 H new ATOM 0 HA VAL A 70 1.901 17.409 15.281 1.00 0.00 H new ATOM 0 HB VAL A 70 4.647 18.718 15.138 1.00 0.00 H new ATOM 0 HG11 VAL A 70 4.992 17.830 17.404 1.00 0.00 H new ATOM 0 HG12 VAL A 70 3.666 19.015 17.350 1.00 0.00 H new ATOM 0 HG13 VAL A 70 3.302 17.276 17.440 1.00 0.00 H new ATOM 0 HG21 VAL A 70 5.486 16.418 15.445 1.00 0.00 H new ATOM 0 HG22 VAL A 70 3.815 15.808 15.391 1.00 0.00 H new ATOM 0 HG23 VAL A 70 4.528 16.579 13.954 1.00 0.00 H new ATOM 1090 N LEU A 71 2.892 20.558 15.506 1.00 0.00 N ATOM 1091 CA LEU A 71 2.510 21.874 16.003 1.00 0.00 C ATOM 1092 C LEU A 71 2.334 22.862 14.853 1.00 0.00 C ATOM 1093 O LEU A 71 2.993 23.902 14.806 1.00 0.00 O ATOM 1094 CB LEU A 71 3.561 22.395 16.986 1.00 0.00 C ATOM 1095 CG LEU A 71 3.009 23.231 18.142 1.00 0.00 C ATOM 1096 CD1 LEU A 71 2.452 24.549 17.630 1.00 0.00 C ATOM 1097 CD2 LEU A 71 1.939 22.455 18.895 1.00 0.00 C ATOM 0 H LEU A 71 3.853 20.497 15.168 1.00 0.00 H new ATOM 0 HA LEU A 71 1.556 21.777 16.521 1.00 0.00 H new ATOM 0 HB2 LEU A 71 4.103 21.544 17.399 1.00 0.00 H new ATOM 0 HB3 LEU A 71 4.284 22.997 16.436 1.00 0.00 H new ATOM 0 HG LEU A 71 3.826 23.449 18.830 1.00 0.00 H new ATOM 0 HD11 LEU A 71 2.064 25.130 18.467 1.00 0.00 H new ATOM 0 HD12 LEU A 71 3.244 25.111 17.135 1.00 0.00 H new ATOM 0 HD13 LEU A 71 1.648 24.353 16.921 1.00 0.00 H new ATOM 0 HD21 LEU A 71 1.557 23.064 19.714 1.00 0.00 H new ATOM 0 HD22 LEU A 71 1.123 22.207 18.216 1.00 0.00 H new ATOM 0 HD23 LEU A 71 2.369 21.537 19.295 1.00 0.00 H new ATOM 1109 N ASP A 72 1.441 22.530 13.927 1.00 0.00 N ATOM 1110 CA ASP A 72 1.177 23.387 12.776 1.00 0.00 C ATOM 1111 C ASP A 72 -0.284 23.825 12.749 1.00 0.00 C ATOM 1112 O ASP A 72 -1.186 23.030 13.009 1.00 0.00 O ATOM 1113 CB ASP A 72 1.527 22.657 11.478 1.00 0.00 C ATOM 1114 CG ASP A 72 3.024 22.553 11.260 1.00 0.00 C ATOM 1115 OD1 ASP A 72 3.708 23.595 11.326 1.00 0.00 O ATOM 1116 OD2 ASP A 72 3.511 21.428 11.023 1.00 0.00 O ATOM 0 H ASP A 72 0.887 21.674 13.951 1.00 0.00 H new ATOM 0 HA ASP A 72 1.803 24.275 12.864 1.00 0.00 H new ATOM 0 HB2 ASP A 72 1.095 21.656 11.499 1.00 0.00 H new ATOM 0 HB3 ASP A 72 1.075 23.182 10.636 1.00 0.00 H new ATOM 1121 N ARG A 73 -0.509 25.096 12.431 1.00 0.00 N ATOM 1122 CA ARG A 73 -1.860 25.642 12.368 1.00 0.00 C ATOM 1123 C ARG A 73 -2.256 25.948 10.928 1.00 0.00 C ATOM 1124 O ARG A 73 -3.408 25.762 10.537 1.00 0.00 O ATOM 1125 CB ARG A 73 -1.962 26.908 13.219 1.00 0.00 C ATOM 1126 CG ARG A 73 -2.267 26.633 14.683 1.00 0.00 C ATOM 1127 CD ARG A 73 -1.250 27.292 15.600 1.00 0.00 C ATOM 1128 NE ARG A 73 -1.325 28.750 15.545 1.00 0.00 N ATOM 1129 CZ ARG A 73 -0.813 29.555 16.474 1.00 0.00 C ATOM 1130 NH1 ARG A 73 -0.190 29.048 17.530 1.00 0.00 N ATOM 1131 NH2 ARG A 73 -0.925 30.870 16.347 1.00 0.00 N ATOM 0 H ARG A 73 0.227 25.767 12.213 1.00 0.00 H new ATOM 0 HA ARG A 73 -2.547 24.893 12.763 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -1.024 27.460 13.149 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -2.741 27.550 12.808 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -3.265 27.000 14.922 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -2.272 25.557 14.858 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -1.417 26.959 16.624 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -0.247 26.970 15.319 1.00 0.00 H new ATOM 0 HE ARG A 73 -1.797 29.176 14.748 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -0.101 28.037 17.633 1.00 0.00 H new ATOM 0 HH12 ARG A 73 0.200 29.669 18.239 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -1.403 31.265 15.538 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -0.533 31.486 17.059 1.00 0.00 H new ATOM 1145 N ARG A 74 -1.291 26.417 10.145 1.00 0.00 N ATOM 1146 CA ARG A 74 -1.536 26.750 8.746 1.00 0.00 C ATOM 1147 C ARG A 74 -1.127 25.595 7.838 1.00 0.00 C ATOM 1148 O ARG A 74 -1.852 25.235 6.911 1.00 0.00 O ATOM 1149 CB ARG A 74 -0.768 28.015 8.355 1.00 0.00 C ATOM 1150 CG ARG A 74 -0.740 29.076 9.445 1.00 0.00 C ATOM 1151 CD ARG A 74 -2.135 29.601 9.746 1.00 0.00 C ATOM 1152 NE ARG A 74 -2.100 30.922 10.368 1.00 0.00 N ATOM 1153 CZ ARG A 74 -1.908 32.054 9.695 1.00 0.00 C ATOM 1154 NH1 ARG A 74 -1.733 32.030 8.379 1.00 0.00 N ATOM 1155 NH2 ARG A 74 -1.890 33.213 10.338 1.00 0.00 N ATOM 0 H ARG A 74 -0.332 26.575 10.455 1.00 0.00 H new ATOM 0 HA ARG A 74 -2.604 26.931 8.623 1.00 0.00 H new ATOM 0 HB2 ARG A 74 0.256 27.743 8.099 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -1.219 28.440 7.458 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -0.304 28.656 10.352 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -0.098 29.901 9.135 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -2.711 29.651 8.822 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -2.650 28.903 10.406 1.00 0.00 H new ATOM 0 HE ARG A 74 -2.230 30.980 11.378 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -1.745 31.141 7.879 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -1.586 32.901 7.868 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -2.023 33.237 11.349 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -1.743 34.080 9.822 1.00 0.00 H new ATOM 1169 N TRP A 75 0.038 25.019 8.114 1.00 0.00 N ATOM 1170 CA TRP A 75 0.544 23.902 7.324 1.00 0.00 C ATOM 1171 C TRP A 75 -0.358 22.681 7.467 1.00 0.00 C ATOM 1172 O TRP A 75 -0.487 21.879 6.541 1.00 0.00 O ATOM 1173 CB TRP A 75 1.969 23.549 7.757 1.00 0.00 C ATOM 1174 CG TRP A 75 2.957 24.645 7.505 1.00 0.00 C ATOM 1175 CD1 TRP A 75 3.049 25.835 8.169 1.00 0.00 C ATOM 1176 CD2 TRP A 75 3.994 24.655 6.518 1.00 0.00 C ATOM 1177 NE1 TRP A 75 4.081 26.584 7.654 1.00 0.00 N ATOM 1178 CE2 TRP A 75 4.677 25.880 6.641 1.00 0.00 C ATOM 1179 CE3 TRP A 75 4.415 23.746 5.544 1.00 0.00 C ATOM 1180 CZ2 TRP A 75 5.753 26.219 5.824 1.00 0.00 C ATOM 1181 CZ3 TRP A 75 5.483 24.082 4.734 1.00 0.00 C ATOM 1182 CH2 TRP A 75 6.143 25.310 4.879 1.00 0.00 C ATOM 0 H TRP A 75 0.649 25.307 8.878 1.00 0.00 H new ATOM 0 HA TRP A 75 0.552 24.205 6.277 1.00 0.00 H new ATOM 0 HB2 TRP A 75 1.968 23.308 8.820 1.00 0.00 H new ATOM 0 HB3 TRP A 75 2.290 22.652 7.227 1.00 0.00 H new ATOM 0 HD1 TRP A 75 2.405 26.143 8.980 1.00 0.00 H new ATOM 0 HE1 TRP A 75 4.358 27.512 7.974 1.00 0.00 H new ATOM 0 HE3 TRP A 75 3.914 22.797 5.426 1.00 0.00 H new ATOM 0 HZ2 TRP A 75 6.261 27.166 5.933 1.00 0.00 H new ATOM 0 HZ3 TRP A 75 5.815 23.387 3.977 1.00 0.00 H new ATOM 0 HH2 TRP A 75 6.976 25.543 4.232 1.00 0.00 H new ATOM 1193 N GLN A 76 -0.980 22.545 8.633 1.00 0.00 N ATOM 1194 CA GLN A 76 -1.871 21.422 8.900 1.00 0.00 C ATOM 1195 C GLN A 76 -3.121 21.498 8.030 1.00 0.00 C ATOM 1196 O GLN A 76 -3.512 22.574 7.579 1.00 0.00 O ATOM 1197 CB GLN A 76 -2.264 21.396 10.378 1.00 0.00 C ATOM 1198 CG GLN A 76 -3.065 22.612 10.816 1.00 0.00 C ATOM 1199 CD GLN A 76 -4.020 22.303 11.952 1.00 0.00 C ATOM 1200 OE1 GLN A 76 -3.758 22.642 13.107 1.00 0.00 O ATOM 1201 NE2 GLN A 76 -5.134 21.655 11.631 1.00 0.00 N ATOM 0 H GLN A 76 -0.883 23.200 9.409 1.00 0.00 H new ATOM 0 HA GLN A 76 -1.338 20.503 8.657 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -2.848 20.497 10.574 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -1.361 21.328 10.984 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -2.380 23.401 11.127 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -3.629 22.996 9.966 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -5.310 21.394 10.661 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -5.813 21.419 12.354 1.00 0.00 H new ATOM 1210 N ARG A 77 -3.745 20.348 7.802 1.00 0.00 N ATOM 1211 CA ARG A 77 -4.953 20.281 6.987 1.00 0.00 C ATOM 1212 C ARG A 77 -5.986 19.360 7.628 1.00 0.00 C ATOM 1213 O ARG A 77 -5.690 18.657 8.594 1.00 0.00 O ATOM 1214 CB ARG A 77 -4.619 19.787 5.579 1.00 0.00 C ATOM 1215 CG ARG A 77 -3.380 20.436 4.983 1.00 0.00 C ATOM 1216 CD ARG A 77 -3.678 21.835 4.469 1.00 0.00 C ATOM 1217 NE ARG A 77 -4.271 21.814 3.134 1.00 0.00 N ATOM 1218 CZ ARG A 77 -4.299 22.865 2.318 1.00 0.00 C ATOM 1219 NH1 ARG A 77 -3.769 24.022 2.696 1.00 0.00 N ATOM 1220 NH2 ARG A 77 -4.858 22.760 1.120 1.00 0.00 N ATOM 0 H ARG A 77 -3.435 19.449 8.170 1.00 0.00 H new ATOM 0 HA ARG A 77 -5.374 21.284 6.921 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -4.475 18.707 5.607 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -5.469 19.979 4.925 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -2.594 20.484 5.737 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -3.002 19.820 4.167 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -4.356 22.338 5.159 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -2.757 22.417 4.447 1.00 0.00 H new ATOM 0 HE ARG A 77 -4.688 20.942 2.808 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -3.337 24.109 3.616 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -3.793 24.824 2.066 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -5.267 21.874 0.824 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -4.879 23.566 0.495 1.00 0.00 H new ATOM 1234 N ARG A 78 -7.200 19.368 7.085 1.00 0.00 N ATOM 1235 CA ARG A 78 -8.273 18.531 7.607 1.00 0.00 C ATOM 1236 C ARG A 78 -8.075 17.076 7.190 1.00 0.00 C ATOM 1237 O ARG A 78 -8.216 16.732 6.018 1.00 0.00 O ATOM 1238 CB ARG A 78 -9.631 19.040 7.115 1.00 0.00 C ATOM 1239 CG ARG A 78 -10.575 19.435 8.238 1.00 0.00 C ATOM 1240 CD ARG A 78 -10.105 20.696 8.946 1.00 0.00 C ATOM 1241 NE ARG A 78 -11.204 21.628 9.192 1.00 0.00 N ATOM 1242 CZ ARG A 78 -11.033 22.906 9.521 1.00 0.00 C ATOM 1243 NH1 ARG A 78 -9.811 23.410 9.644 1.00 0.00 N ATOM 1244 NH2 ARG A 78 -12.086 23.685 9.726 1.00 0.00 N ATOM 0 H ARG A 78 -7.464 19.944 6.286 1.00 0.00 H new ATOM 0 HA ARG A 78 -8.249 18.584 8.695 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -9.473 19.900 6.464 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -10.103 18.265 6.510 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -11.575 19.595 7.834 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -10.648 18.619 8.957 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -9.639 20.427 9.894 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -9.341 21.187 8.343 1.00 0.00 H new ATOM 0 HE ARG A 78 -12.158 21.278 9.106 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -8.996 22.817 9.486 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -9.687 24.390 9.896 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -13.028 23.305 9.632 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -11.954 24.665 9.978 1.00 0.00 H new ATOM 1258 N TYR A 79 -7.742 16.229 8.157 1.00 0.00 N ATOM 1259 CA TYR A 79 -7.521 14.814 7.886 1.00 0.00 C ATOM 1260 C TYR A 79 -8.766 14.167 7.277 1.00 0.00 C ATOM 1261 O TYR A 79 -8.679 13.120 6.634 1.00 0.00 O ATOM 1262 CB TYR A 79 -7.114 14.083 9.170 1.00 0.00 C ATOM 1263 CG TYR A 79 -8.270 13.757 10.094 1.00 0.00 C ATOM 1264 CD1 TYR A 79 -9.084 14.761 10.605 1.00 0.00 C ATOM 1265 CD2 TYR A 79 -8.541 12.444 10.456 1.00 0.00 C ATOM 1266 CE1 TYR A 79 -10.137 14.464 11.450 1.00 0.00 C ATOM 1267 CE2 TYR A 79 -9.593 12.140 11.300 1.00 0.00 C ATOM 1268 CZ TYR A 79 -10.387 13.153 11.793 1.00 0.00 C ATOM 1269 OH TYR A 79 -11.434 12.854 12.635 1.00 0.00 O ATOM 0 H TYR A 79 -7.619 16.497 9.134 1.00 0.00 H new ATOM 0 HA TYR A 79 -6.711 14.732 7.162 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -6.606 13.157 8.902 1.00 0.00 H new ATOM 0 HB3 TYR A 79 -6.393 14.696 9.711 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -8.891 15.789 10.338 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -7.920 11.648 10.072 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -10.760 15.255 11.839 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -9.792 11.114 11.572 1.00 0.00 H new ATOM 0 HH TYR A 79 -12.140 12.398 12.130 1.00 0.00 H new ATOM 1279 N ASP A 80 -9.922 14.793 7.484 1.00 0.00 N ATOM 1280 CA ASP A 80 -11.177 14.268 6.956 1.00 0.00 C ATOM 1281 C ASP A 80 -11.625 15.036 5.713 1.00 0.00 C ATOM 1282 O ASP A 80 -12.807 15.039 5.371 1.00 0.00 O ATOM 1283 CB ASP A 80 -12.269 14.333 8.026 1.00 0.00 C ATOM 1284 CG ASP A 80 -12.503 15.743 8.528 1.00 0.00 C ATOM 1285 OD1 ASP A 80 -11.765 16.180 9.436 1.00 0.00 O ATOM 1286 OD2 ASP A 80 -13.425 16.412 8.014 1.00 0.00 O ATOM 0 H ASP A 80 -10.015 15.661 8.012 1.00 0.00 H new ATOM 0 HA ASP A 80 -11.009 13.229 6.672 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -13.199 13.937 7.617 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -11.991 13.693 8.864 1.00 0.00 H new ATOM 1291 N ASP A 81 -10.678 15.682 5.038 1.00 0.00 N ATOM 1292 CA ASP A 81 -10.990 16.444 3.834 1.00 0.00 C ATOM 1293 C ASP A 81 -10.664 15.633 2.578 1.00 0.00 C ATOM 1294 O ASP A 81 -9.568 15.088 2.452 1.00 0.00 O ATOM 1295 CB ASP A 81 -10.214 17.764 3.820 1.00 0.00 C ATOM 1296 CG ASP A 81 -11.129 18.973 3.851 1.00 0.00 C ATOM 1297 OD1 ASP A 81 -12.187 18.901 4.511 1.00 0.00 O ATOM 1298 OD2 ASP A 81 -10.787 19.993 3.215 1.00 0.00 O ATOM 0 H ASP A 81 -9.693 15.693 5.303 1.00 0.00 H new ATOM 0 HA ASP A 81 -12.058 16.662 3.839 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -9.543 17.797 4.679 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -9.591 17.806 2.927 1.00 0.00 H new ATOM 1303 N PRO A 82 -11.613 15.543 1.627 1.00 0.00 N ATOM 1304 CA PRO A 82 -11.411 14.794 0.381 1.00 0.00 C ATOM 1305 C PRO A 82 -10.321 15.407 -0.489 1.00 0.00 C ATOM 1306 O PRO A 82 -9.634 14.702 -1.230 1.00 0.00 O ATOM 1307 CB PRO A 82 -12.770 14.882 -0.321 1.00 0.00 C ATOM 1308 CG PRO A 82 -13.427 16.084 0.263 1.00 0.00 C ATOM 1309 CD PRO A 82 -12.949 16.163 1.686 1.00 0.00 C ATOM 0 HA PRO A 82 -11.085 13.771 0.571 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -12.651 14.982 -1.400 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -13.363 13.984 -0.147 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -13.158 16.984 -0.290 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -14.513 15.996 0.220 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -12.900 17.194 2.038 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -13.612 15.626 2.364 1.00 0.00 H new ATOM 1317 N GLU A 83 -10.164 16.723 -0.393 1.00 0.00 N ATOM 1318 CA GLU A 83 -9.151 17.430 -1.169 1.00 0.00 C ATOM 1319 C GLU A 83 -7.760 16.889 -0.859 1.00 0.00 C ATOM 1320 O GLU A 83 -6.923 16.752 -1.752 1.00 0.00 O ATOM 1321 CB GLU A 83 -9.207 18.930 -0.873 1.00 0.00 C ATOM 1322 CG GLU A 83 -10.543 19.569 -1.224 1.00 0.00 C ATOM 1323 CD GLU A 83 -11.073 20.457 -0.114 1.00 0.00 C ATOM 1324 OE1 GLU A 83 -10.255 21.122 0.557 1.00 0.00 O ATOM 1325 OE2 GLU A 83 -12.306 20.489 0.082 1.00 0.00 O ATOM 0 H GLU A 83 -10.725 17.321 0.214 1.00 0.00 H new ATOM 0 HA GLU A 83 -9.358 17.269 -2.227 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -9.003 19.091 0.186 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -8.416 19.432 -1.430 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -10.432 20.158 -2.134 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -11.271 18.787 -1.438 1.00 0.00 H new ATOM 1332 N MET A 84 -7.523 16.577 0.410 1.00 0.00 N ATOM 1333 CA MET A 84 -6.237 16.042 0.841 1.00 0.00 C ATOM 1334 C MET A 84 -6.216 14.523 0.702 1.00 0.00 C ATOM 1335 O MET A 84 -5.200 13.936 0.330 1.00 0.00 O ATOM 1336 CB MET A 84 -5.954 16.443 2.291 1.00 0.00 C ATOM 1337 CG MET A 84 -4.642 15.899 2.834 1.00 0.00 C ATOM 1338 SD MET A 84 -4.689 15.624 4.615 1.00 0.00 S ATOM 1339 CE MET A 84 -6.117 14.551 4.758 1.00 0.00 C ATOM 0 H MET A 84 -8.206 16.686 1.160 1.00 0.00 H new ATOM 0 HA MET A 84 -5.459 16.460 0.203 1.00 0.00 H new ATOM 0 HB2 MET A 84 -5.942 17.531 2.362 1.00 0.00 H new ATOM 0 HB3 MET A 84 -6.771 16.091 2.921 1.00 0.00 H new ATOM 0 HG2 MET A 84 -4.406 14.961 2.331 1.00 0.00 H new ATOM 0 HG3 MET A 84 -3.839 16.597 2.599 1.00 0.00 H new ATOM 0 HE1 MET A 84 -5.916 13.774 5.496 1.00 0.00 H new ATOM 0 HE2 MET A 84 -6.981 15.136 5.073 1.00 0.00 H new ATOM 0 HE3 MET A 84 -6.324 14.090 3.792 1.00 0.00 H new ATOM 1349 N ILE A 85 -7.349 13.896 1.001 1.00 0.00 N ATOM 1350 CA ILE A 85 -7.471 12.446 0.908 1.00 0.00 C ATOM 1351 C ILE A 85 -7.365 11.985 -0.544 1.00 0.00 C ATOM 1352 O ILE A 85 -6.865 10.896 -0.824 1.00 0.00 O ATOM 1353 CB ILE A 85 -8.808 11.963 1.516 1.00 0.00 C ATOM 1354 CG1 ILE A 85 -8.752 12.044 3.043 1.00 0.00 C ATOM 1355 CG2 ILE A 85 -9.136 10.544 1.069 1.00 0.00 C ATOM 1356 CD1 ILE A 85 -10.093 12.336 3.681 1.00 0.00 C ATOM 0 H ILE A 85 -8.197 14.371 1.310 1.00 0.00 H new ATOM 0 HA ILE A 85 -6.651 12.008 1.477 1.00 0.00 H new ATOM 0 HB ILE A 85 -9.602 12.618 1.156 1.00 0.00 H new ATOM 0 HG12 ILE A 85 -8.369 11.102 3.435 1.00 0.00 H new ATOM 0 HG13 ILE A 85 -8.044 12.821 3.332 1.00 0.00 H new ATOM 0 HG21 ILE A 85 -10.082 10.232 1.513 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -9.218 10.515 -0.018 1.00 0.00 H new ATOM 0 HG23 ILE A 85 -8.344 9.869 1.392 1.00 0.00 H new ATOM 0 HD11 ILE A 85 -9.979 12.379 4.764 1.00 0.00 H new ATOM 0 HD12 ILE A 85 -10.469 13.292 3.317 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -10.799 11.547 3.422 1.00 0.00 H new ATOM 1368 N ASP A 86 -7.839 12.822 -1.462 1.00 0.00 N ATOM 1369 CA ASP A 86 -7.799 12.502 -2.886 1.00 0.00 C ATOM 1370 C ASP A 86 -6.391 12.099 -3.319 1.00 0.00 C ATOM 1371 O ASP A 86 -6.174 10.987 -3.799 1.00 0.00 O ATOM 1372 CB ASP A 86 -8.281 13.698 -3.712 1.00 0.00 C ATOM 1373 CG ASP A 86 -9.637 13.456 -4.344 1.00 0.00 C ATOM 1374 OD1 ASP A 86 -9.757 12.505 -5.145 1.00 0.00 O ATOM 1375 OD2 ASP A 86 -10.579 14.217 -4.039 1.00 0.00 O ATOM 0 H ASP A 86 -8.256 13.728 -1.246 1.00 0.00 H new ATOM 0 HA ASP A 86 -8.465 11.657 -3.061 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -8.333 14.580 -3.073 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -7.552 13.913 -4.494 1.00 0.00 H new ATOM 1380 N GLU A 87 -5.440 13.010 -3.145 1.00 0.00 N ATOM 1381 CA GLU A 87 -4.054 12.745 -3.518 1.00 0.00 C ATOM 1382 C GLU A 87 -3.497 11.568 -2.727 1.00 0.00 C ATOM 1383 O GLU A 87 -2.799 10.714 -3.273 1.00 0.00 O ATOM 1384 CB GLU A 87 -3.193 13.988 -3.285 1.00 0.00 C ATOM 1385 CG GLU A 87 -3.582 15.169 -4.159 1.00 0.00 C ATOM 1386 CD GLU A 87 -3.483 16.493 -3.426 1.00 0.00 C ATOM 1387 OE1 GLU A 87 -3.689 16.508 -2.194 1.00 0.00 O ATOM 1388 OE2 GLU A 87 -3.200 17.517 -4.085 1.00 0.00 O ATOM 0 H GLU A 87 -5.602 13.936 -2.749 1.00 0.00 H new ATOM 0 HA GLU A 87 -4.030 12.492 -4.578 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -3.268 14.281 -2.238 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -2.149 13.737 -3.471 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -2.937 15.195 -5.037 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -4.602 15.031 -4.517 1.00 0.00 H new ATOM 1395 N ARG A 88 -3.814 11.523 -1.436 1.00 0.00 N ATOM 1396 CA ARG A 88 -3.349 10.443 -0.575 1.00 0.00 C ATOM 1397 C ARG A 88 -3.808 9.091 -1.114 1.00 0.00 C ATOM 1398 O ARG A 88 -3.179 8.064 -0.861 1.00 0.00 O ATOM 1399 CB ARG A 88 -3.864 10.641 0.852 1.00 0.00 C ATOM 1400 CG ARG A 88 -2.875 11.353 1.762 1.00 0.00 C ATOM 1401 CD ARG A 88 -3.545 12.456 2.568 1.00 0.00 C ATOM 1402 NE ARG A 88 -3.274 12.331 3.998 1.00 0.00 N ATOM 1403 CZ ARG A 88 -2.088 12.570 4.553 1.00 0.00 C ATOM 1404 NH1 ARG A 88 -1.060 12.945 3.801 1.00 0.00 N ATOM 1405 NH2 ARG A 88 -1.928 12.432 5.861 1.00 0.00 N ATOM 0 H ARG A 88 -4.390 12.221 -0.965 1.00 0.00 H new ATOM 0 HA ARG A 88 -2.259 10.461 -0.562 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -4.791 11.213 0.819 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -4.105 9.668 1.281 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -2.420 10.631 2.441 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -2.070 11.778 1.163 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -3.194 13.426 2.216 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -4.621 12.426 2.399 1.00 0.00 H new ATOM 0 HE ARG A 88 -4.039 12.043 4.608 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -1.177 13.051 2.793 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -0.153 13.127 4.231 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -2.714 12.142 6.443 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -1.019 12.615 6.286 1.00 0.00 H new ATOM 1419 N ARG A 89 -4.907 9.103 -1.863 1.00 0.00 N ATOM 1420 CA ARG A 89 -5.451 7.883 -2.445 1.00 0.00 C ATOM 1421 C ARG A 89 -4.501 7.315 -3.493 1.00 0.00 C ATOM 1422 O ARG A 89 -4.055 6.172 -3.386 1.00 0.00 O ATOM 1423 CB ARG A 89 -6.817 8.162 -3.074 1.00 0.00 C ATOM 1424 CG ARG A 89 -7.815 7.030 -2.895 1.00 0.00 C ATOM 1425 CD ARG A 89 -9.217 7.451 -3.310 1.00 0.00 C ATOM 1426 NE ARG A 89 -9.381 7.456 -4.762 1.00 0.00 N ATOM 1427 CZ ARG A 89 -9.092 8.496 -5.542 1.00 0.00 C ATOM 1428 NH1 ARG A 89 -8.627 9.624 -5.017 1.00 0.00 N ATOM 1429 NH2 ARG A 89 -9.269 8.410 -6.853 1.00 0.00 N ATOM 0 H ARG A 89 -5.438 9.946 -2.081 1.00 0.00 H new ATOM 0 HA ARG A 89 -5.569 7.147 -1.650 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -7.230 9.071 -2.636 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -6.685 8.353 -4.139 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -7.502 6.170 -3.488 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -7.823 6.712 -1.852 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -9.945 6.773 -2.865 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -9.427 8.446 -2.918 1.00 0.00 H new ATOM 0 HE ARG A 89 -9.739 6.610 -5.206 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -8.489 9.698 -4.009 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -8.408 10.416 -5.622 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -9.626 7.548 -7.264 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -9.048 9.206 -7.451 1.00 0.00 H new ATOM 1443 N ILE A 90 -4.195 8.120 -4.507 1.00 0.00 N ATOM 1444 CA ILE A 90 -3.297 7.694 -5.574 1.00 0.00 C ATOM 1445 C ILE A 90 -1.908 7.380 -5.032 1.00 0.00 C ATOM 1446 O ILE A 90 -1.579 7.728 -3.898 1.00 0.00 O ATOM 1447 CB ILE A 90 -3.173 8.761 -6.678 1.00 0.00 C ATOM 1448 CG1 ILE A 90 -2.959 10.151 -6.063 1.00 0.00 C ATOM 1449 CG2 ILE A 90 -4.407 8.739 -7.567 1.00 0.00 C ATOM 1450 CD1 ILE A 90 -3.092 11.284 -7.057 1.00 0.00 C ATOM 0 H ILE A 90 -4.555 9.069 -4.611 1.00 0.00 H new ATOM 0 HA ILE A 90 -3.733 6.792 -6.003 1.00 0.00 H new ATOM 0 HB ILE A 90 -2.303 8.532 -7.294 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -3.681 10.298 -5.260 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -1.968 10.190 -5.612 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -4.309 9.497 -8.344 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -4.505 7.757 -8.029 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -5.292 8.948 -6.966 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -2.928 12.235 -6.549 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -2.352 11.163 -7.848 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -4.092 11.272 -7.490 1.00 0.00 H new ATOM 1462 N GLY A 91 -1.098 6.720 -5.853 1.00 0.00 N ATOM 1463 CA GLY A 91 0.249 6.369 -5.441 1.00 0.00 C ATOM 1464 C GLY A 91 0.321 4.998 -4.795 1.00 0.00 C ATOM 1465 O GLY A 91 1.214 4.208 -5.101 1.00 0.00 O ATOM 0 H GLY A 91 -1.350 6.422 -6.795 1.00 0.00 H new ATOM 0 HA2 GLY A 91 0.909 6.393 -6.308 1.00 0.00 H new ATOM 0 HA3 GLY A 91 0.617 7.117 -4.739 1.00 0.00 H new ATOM 1469 N LEU A 92 -0.620 4.716 -3.899 1.00 0.00 N ATOM 1470 CA LEU A 92 -0.658 3.431 -3.208 1.00 0.00 C ATOM 1471 C LEU A 92 -0.726 2.278 -4.205 1.00 0.00 C ATOM 1472 O LEU A 92 -0.026 1.275 -4.057 1.00 0.00 O ATOM 1473 CB LEU A 92 -1.856 3.374 -2.259 1.00 0.00 C ATOM 1474 CG LEU A 92 -1.915 4.498 -1.223 1.00 0.00 C ATOM 1475 CD1 LEU A 92 -3.194 4.403 -0.406 1.00 0.00 C ATOM 1476 CD2 LEU A 92 -0.694 4.450 -0.316 1.00 0.00 C ATOM 0 H LEU A 92 -1.366 5.359 -3.634 1.00 0.00 H new ATOM 0 HA LEU A 92 0.260 3.331 -2.628 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -2.771 3.398 -2.851 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -1.840 2.418 -1.735 1.00 0.00 H new ATOM 0 HG LEU A 92 -1.915 5.453 -1.748 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -3.219 5.210 0.326 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -4.056 4.487 -1.068 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -3.225 3.444 0.111 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -0.752 5.256 0.415 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -0.663 3.492 0.202 1.00 0.00 H new ATOM 0 HD23 LEU A 92 0.209 4.567 -0.915 1.00 0.00 H new ATOM 1488 N GLU A 93 -1.572 2.427 -5.219 1.00 0.00 N ATOM 1489 CA GLU A 93 -1.730 1.398 -6.242 1.00 0.00 C ATOM 1490 C GLU A 93 -0.390 1.064 -6.890 1.00 0.00 C ATOM 1491 O GLU A 93 -0.021 -0.104 -7.014 1.00 0.00 O ATOM 1492 CB GLU A 93 -2.724 1.858 -7.309 1.00 0.00 C ATOM 1493 CG GLU A 93 -3.994 2.463 -6.737 1.00 0.00 C ATOM 1494 CD GLU A 93 -3.983 3.979 -6.765 1.00 0.00 C ATOM 1495 OE1 GLU A 93 -3.974 4.552 -7.874 1.00 0.00 O ATOM 1496 OE2 GLU A 93 -3.984 4.593 -5.677 1.00 0.00 O ATOM 0 H GLU A 93 -2.159 3.250 -5.355 1.00 0.00 H new ATOM 0 HA GLU A 93 -2.115 0.499 -5.760 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -2.239 2.593 -7.952 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -2.988 1.008 -7.938 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -4.852 2.099 -7.303 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -4.123 2.123 -5.709 1.00 0.00 H new ATOM 1503 N ARG A 94 0.335 2.100 -7.303 1.00 0.00 N ATOM 1504 CA ARG A 94 1.636 1.919 -7.937 1.00 0.00 C ATOM 1505 C ARG A 94 2.585 1.144 -7.027 1.00 0.00 C ATOM 1506 O ARG A 94 3.479 0.442 -7.498 1.00 0.00 O ATOM 1507 CB ARG A 94 2.247 3.276 -8.291 1.00 0.00 C ATOM 1508 CG ARG A 94 1.486 4.019 -9.379 1.00 0.00 C ATOM 1509 CD ARG A 94 0.946 5.350 -8.875 1.00 0.00 C ATOM 1510 NE ARG A 94 1.984 6.378 -8.829 1.00 0.00 N ATOM 1511 CZ ARG A 94 1.734 7.677 -8.690 1.00 0.00 C ATOM 1512 NH1 ARG A 94 0.484 8.112 -8.582 1.00 0.00 N ATOM 1513 NH2 ARG A 94 2.736 8.545 -8.659 1.00 0.00 N ATOM 0 H ARG A 94 0.043 3.073 -7.210 1.00 0.00 H new ATOM 0 HA ARG A 94 1.488 1.344 -8.851 1.00 0.00 H new ATOM 0 HB2 ARG A 94 2.281 3.895 -7.395 1.00 0.00 H new ATOM 0 HB3 ARG A 94 3.277 3.128 -8.615 1.00 0.00 H new ATOM 0 HG2 ARG A 94 2.144 4.192 -10.231 1.00 0.00 H new ATOM 0 HG3 ARG A 94 0.661 3.401 -9.733 1.00 0.00 H new ATOM 0 HD2 ARG A 94 0.135 5.682 -9.524 1.00 0.00 H new ATOM 0 HD3 ARG A 94 0.523 5.216 -7.879 1.00 0.00 H new ATOM 0 HE ARG A 94 2.957 6.082 -8.908 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -0.291 7.449 -8.605 1.00 0.00 H new ATOM 0 HH12 ARG A 94 0.298 9.109 -8.476 1.00 0.00 H new ATOM 0 HH21 ARG A 94 3.698 8.216 -8.742 1.00 0.00 H new ATOM 0 HH22 ARG A 94 2.545 9.541 -8.552 1.00 0.00 H new ATOM 1527 N PHE A 95 2.383 1.278 -5.720 1.00 0.00 N ATOM 1528 CA PHE A 95 3.218 0.593 -4.741 1.00 0.00 C ATOM 1529 C PHE A 95 3.057 -0.920 -4.846 1.00 0.00 C ATOM 1530 O PHE A 95 4.034 -1.666 -4.775 1.00 0.00 O ATOM 1531 CB PHE A 95 2.862 1.056 -3.327 1.00 0.00 C ATOM 1532 CG PHE A 95 3.951 0.814 -2.323 1.00 0.00 C ATOM 1533 CD1 PHE A 95 5.068 1.632 -2.283 1.00 0.00 C ATOM 1534 CD2 PHE A 95 3.858 -0.231 -1.419 1.00 0.00 C ATOM 1535 CE1 PHE A 95 6.072 1.414 -1.360 1.00 0.00 C ATOM 1536 CE2 PHE A 95 4.861 -0.456 -0.493 1.00 0.00 C ATOM 1537 CZ PHE A 95 5.968 0.367 -0.463 1.00 0.00 C ATOM 0 H PHE A 95 1.647 1.856 -5.314 1.00 0.00 H new ATOM 0 HA PHE A 95 4.258 0.843 -4.951 1.00 0.00 H new ATOM 0 HB2 PHE A 95 2.631 2.121 -3.350 1.00 0.00 H new ATOM 0 HB3 PHE A 95 1.958 0.540 -3.002 1.00 0.00 H new ATOM 0 HD1 PHE A 95 5.155 2.450 -2.982 1.00 0.00 H new ATOM 0 HD2 PHE A 95 2.993 -0.877 -1.437 1.00 0.00 H new ATOM 0 HE1 PHE A 95 6.937 2.060 -1.339 1.00 0.00 H new ATOM 0 HE2 PHE A 95 4.778 -1.275 0.206 1.00 0.00 H new ATOM 0 HZ PHE A 95 6.752 0.194 0.260 1.00 0.00 H new ATOM 1547 N LEU A 96 1.816 -1.366 -5.012 1.00 0.00 N ATOM 1548 CA LEU A 96 1.524 -2.792 -5.121 1.00 0.00 C ATOM 1549 C LEU A 96 1.633 -3.270 -6.567 1.00 0.00 C ATOM 1550 O LEU A 96 1.893 -4.444 -6.822 1.00 0.00 O ATOM 1551 CB LEU A 96 0.125 -3.087 -4.577 1.00 0.00 C ATOM 1552 CG LEU A 96 -0.257 -2.314 -3.314 1.00 0.00 C ATOM 1553 CD1 LEU A 96 -1.720 -2.546 -2.969 1.00 0.00 C ATOM 1554 CD2 LEU A 96 0.637 -2.718 -2.152 1.00 0.00 C ATOM 0 H LEU A 96 0.997 -0.762 -5.074 1.00 0.00 H new ATOM 0 HA LEU A 96 2.262 -3.332 -4.528 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -0.605 -2.864 -5.355 1.00 0.00 H new ATOM 0 HB3 LEU A 96 0.051 -4.154 -4.367 1.00 0.00 H new ATOM 0 HG LEU A 96 -0.114 -1.250 -3.504 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -1.974 -1.988 -2.068 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -2.347 -2.207 -3.794 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -1.889 -3.609 -2.798 1.00 0.00 H new ATOM 0 HD21 LEU A 96 0.351 -2.158 -1.261 1.00 0.00 H new ATOM 0 HD22 LEU A 96 0.525 -3.785 -1.961 1.00 0.00 H new ATOM 0 HD23 LEU A 96 1.676 -2.500 -2.400 1.00 0.00 H new ATOM 1566 N ASN A 97 1.428 -2.358 -7.510 1.00 0.00 N ATOM 1567 CA ASN A 97 1.499 -2.694 -8.930 1.00 0.00 C ATOM 1568 C ASN A 97 2.830 -3.360 -9.278 1.00 0.00 C ATOM 1569 O ASN A 97 2.860 -4.490 -9.763 1.00 0.00 O ATOM 1570 CB ASN A 97 1.309 -1.438 -9.782 1.00 0.00 C ATOM 1571 CG ASN A 97 -0.119 -1.279 -10.267 1.00 0.00 C ATOM 1572 OD1 ASN A 97 -0.403 -1.427 -11.455 1.00 0.00 O ATOM 1573 ND2 ASN A 97 -1.026 -0.974 -9.347 1.00 0.00 N ATOM 0 H ASN A 97 1.211 -1.380 -7.319 1.00 0.00 H new ATOM 0 HA ASN A 97 0.697 -3.401 -9.145 1.00 0.00 H new ATOM 0 HB2 ASN A 97 1.592 -0.561 -9.200 1.00 0.00 H new ATOM 0 HB3 ASN A 97 1.979 -1.480 -10.641 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -2.003 -0.853 -9.614 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -0.746 -0.861 -8.373 1.00 0.00 H new ATOM 1580 N GLU A 98 3.925 -2.648 -9.035 1.00 0.00 N ATOM 1581 CA GLU A 98 5.257 -3.168 -9.331 1.00 0.00 C ATOM 1582 C GLU A 98 5.689 -4.224 -8.314 1.00 0.00 C ATOM 1583 O GLU A 98 6.631 -4.977 -8.556 1.00 0.00 O ATOM 1584 CB GLU A 98 6.274 -2.023 -9.360 1.00 0.00 C ATOM 1585 CG GLU A 98 7.705 -2.479 -9.597 1.00 0.00 C ATOM 1586 CD GLU A 98 8.401 -2.904 -8.319 1.00 0.00 C ATOM 1587 OE1 GLU A 98 8.403 -2.112 -7.353 1.00 0.00 O ATOM 1588 OE2 GLU A 98 8.945 -4.028 -8.284 1.00 0.00 O ATOM 0 H GLU A 98 3.918 -1.710 -8.634 1.00 0.00 H new ATOM 0 HA GLU A 98 5.217 -3.644 -10.311 1.00 0.00 H new ATOM 0 HB2 GLU A 98 5.992 -1.319 -10.143 1.00 0.00 H new ATOM 0 HB3 GLU A 98 6.226 -1.483 -8.414 1.00 0.00 H new ATOM 0 HG2 GLU A 98 7.705 -3.312 -10.301 1.00 0.00 H new ATOM 0 HG3 GLU A 98 8.268 -1.669 -10.061 1.00 0.00 H new ATOM 1595 N LEU A 99 5.003 -4.273 -7.175 1.00 0.00 N ATOM 1596 CA LEU A 99 5.334 -5.238 -6.131 1.00 0.00 C ATOM 1597 C LEU A 99 4.620 -6.567 -6.360 1.00 0.00 C ATOM 1598 O LEU A 99 5.258 -7.607 -6.522 1.00 0.00 O ATOM 1599 CB LEU A 99 4.964 -4.680 -4.758 1.00 0.00 C ATOM 1600 CG LEU A 99 5.722 -5.302 -3.584 1.00 0.00 C ATOM 1601 CD1 LEU A 99 6.173 -4.226 -2.608 1.00 0.00 C ATOM 1602 CD2 LEU A 99 4.859 -6.337 -2.878 1.00 0.00 C ATOM 0 H LEU A 99 4.219 -3.660 -6.952 1.00 0.00 H new ATOM 0 HA LEU A 99 6.409 -5.416 -6.169 1.00 0.00 H new ATOM 0 HB2 LEU A 99 5.143 -3.605 -4.759 1.00 0.00 H new ATOM 0 HB3 LEU A 99 3.895 -4.825 -4.599 1.00 0.00 H new ATOM 0 HG LEU A 99 6.608 -5.803 -3.975 1.00 0.00 H new ATOM 0 HD11 LEU A 99 6.710 -4.688 -1.780 1.00 0.00 H new ATOM 0 HD12 LEU A 99 6.830 -3.523 -3.120 1.00 0.00 H new ATOM 0 HD13 LEU A 99 5.302 -3.695 -2.224 1.00 0.00 H new ATOM 0 HD21 LEU A 99 5.416 -6.768 -2.046 1.00 0.00 H new ATOM 0 HD22 LEU A 99 3.954 -5.860 -2.501 1.00 0.00 H new ATOM 0 HD23 LEU A 99 4.588 -7.125 -3.581 1.00 0.00 H new ATOM 1614 N TYR A 100 3.293 -6.524 -6.366 1.00 0.00 N ATOM 1615 CA TYR A 100 2.487 -7.722 -6.568 1.00 0.00 C ATOM 1616 C TYR A 100 2.720 -8.316 -7.954 1.00 0.00 C ATOM 1617 O TYR A 100 2.602 -9.525 -8.150 1.00 0.00 O ATOM 1618 CB TYR A 100 1.002 -7.396 -6.383 1.00 0.00 C ATOM 1619 CG TYR A 100 0.587 -7.176 -4.940 1.00 0.00 C ATOM 1620 CD1 TYR A 100 1.525 -6.881 -3.954 1.00 0.00 C ATOM 1621 CD2 TYR A 100 -0.748 -7.263 -4.566 1.00 0.00 C ATOM 1622 CE1 TYR A 100 1.142 -6.680 -2.642 1.00 0.00 C ATOM 1623 CE2 TYR A 100 -1.138 -7.062 -3.255 1.00 0.00 C ATOM 1624 CZ TYR A 100 -0.189 -6.771 -2.298 1.00 0.00 C ATOM 1625 OH TYR A 100 -0.574 -6.571 -0.991 1.00 0.00 O ATOM 0 H TYR A 100 2.751 -5.670 -6.233 1.00 0.00 H new ATOM 0 HA TYR A 100 2.789 -8.460 -5.825 1.00 0.00 H new ATOM 0 HB2 TYR A 100 0.764 -6.501 -6.958 1.00 0.00 H new ATOM 0 HB3 TYR A 100 0.409 -8.210 -6.800 1.00 0.00 H new ATOM 0 HD1 TYR A 100 2.569 -6.808 -4.219 1.00 0.00 H new ATOM 0 HD2 TYR A 100 -1.494 -7.492 -5.312 1.00 0.00 H new ATOM 0 HE1 TYR A 100 1.883 -6.453 -1.889 1.00 0.00 H new ATOM 0 HE2 TYR A 100 -2.181 -7.133 -2.982 1.00 0.00 H new ATOM 0 HH TYR A 100 0.045 -5.946 -0.560 1.00 0.00 H new ATOM 1635 N ASN A 101 3.051 -7.456 -8.914 1.00 0.00 N ATOM 1636 CA ASN A 101 3.297 -7.899 -10.282 1.00 0.00 C ATOM 1637 C ASN A 101 4.741 -8.362 -10.455 1.00 0.00 C ATOM 1638 O ASN A 101 5.475 -7.845 -11.299 1.00 0.00 O ATOM 1639 CB ASN A 101 2.988 -6.769 -11.268 1.00 0.00 C ATOM 1640 CG ASN A 101 2.787 -7.276 -12.683 1.00 0.00 C ATOM 1641 OD1 ASN A 101 1.657 -7.407 -13.153 1.00 0.00 O ATOM 1642 ND2 ASN A 101 3.886 -7.564 -13.370 1.00 0.00 N ATOM 0 H ASN A 101 3.155 -6.452 -8.770 1.00 0.00 H new ATOM 0 HA ASN A 101 2.639 -8.743 -10.488 1.00 0.00 H new ATOM 0 HB2 ASN A 101 2.091 -6.242 -10.943 1.00 0.00 H new ATOM 0 HB3 ASN A 101 3.804 -6.047 -11.256 1.00 0.00 H new ATOM 0 HD21 ASN A 101 3.813 -7.909 -14.327 1.00 0.00 H new ATOM 0 HD22 ASN A 101 4.803 -7.440 -12.941 1.00 0.00 H new ATOM 1649 N ASP A 102 5.142 -9.341 -9.652 1.00 0.00 N ATOM 1650 CA ASP A 102 6.498 -9.876 -9.715 1.00 0.00 C ATOM 1651 C ASP A 102 6.475 -11.383 -9.951 1.00 0.00 C ATOM 1652 O ASP A 102 5.644 -12.097 -9.390 1.00 0.00 O ATOM 1653 CB ASP A 102 7.255 -9.560 -8.424 1.00 0.00 C ATOM 1654 CG ASP A 102 7.865 -8.173 -8.437 1.00 0.00 C ATOM 1655 OD1 ASP A 102 8.591 -7.852 -9.401 1.00 0.00 O ATOM 1656 OD2 ASP A 102 7.615 -7.405 -7.483 1.00 0.00 O ATOM 0 H ASP A 102 4.548 -9.781 -8.949 1.00 0.00 H new ATOM 0 HA ASP A 102 7.011 -9.402 -10.552 1.00 0.00 H new ATOM 0 HB2 ASP A 102 6.575 -9.647 -7.577 1.00 0.00 H new ATOM 0 HB3 ASP A 102 8.043 -10.299 -8.278 1.00 0.00 H new ATOM 1661 N ARG A 103 7.394 -11.861 -10.785 1.00 0.00 N ATOM 1662 CA ARG A 103 7.477 -13.283 -11.095 1.00 0.00 C ATOM 1663 C ARG A 103 8.878 -13.822 -10.816 1.00 0.00 C ATOM 1664 O ARG A 103 9.038 -14.873 -10.196 1.00 0.00 O ATOM 1665 CB ARG A 103 7.107 -13.530 -12.558 1.00 0.00 C ATOM 1666 CG ARG A 103 7.948 -12.733 -13.542 1.00 0.00 C ATOM 1667 CD ARG A 103 7.494 -12.959 -14.975 1.00 0.00 C ATOM 1668 NE ARG A 103 8.265 -14.009 -15.635 1.00 0.00 N ATOM 1669 CZ ARG A 103 7.877 -14.626 -16.749 1.00 0.00 C ATOM 1670 NH1 ARG A 103 6.729 -14.300 -17.331 1.00 0.00 N ATOM 1671 NH2 ARG A 103 8.639 -15.570 -17.283 1.00 0.00 N ATOM 0 H ARG A 103 8.090 -11.285 -11.257 1.00 0.00 H new ATOM 0 HA ARG A 103 6.770 -13.810 -10.454 1.00 0.00 H new ATOM 0 HB2 ARG A 103 7.216 -14.592 -12.777 1.00 0.00 H new ATOM 0 HB3 ARG A 103 6.056 -13.280 -12.705 1.00 0.00 H new ATOM 0 HG2 ARG A 103 7.883 -11.672 -13.302 1.00 0.00 H new ATOM 0 HG3 ARG A 103 8.995 -13.019 -13.442 1.00 0.00 H new ATOM 0 HD2 ARG A 103 6.437 -13.226 -14.982 1.00 0.00 H new ATOM 0 HD3 ARG A 103 7.592 -12.030 -15.537 1.00 0.00 H new ATOM 0 HE ARG A 103 9.154 -14.286 -15.218 1.00 0.00 H new ATOM 0 HH11 ARG A 103 6.139 -13.574 -16.925 1.00 0.00 H new ATOM 0 HH12 ARG A 103 6.437 -14.776 -18.184 1.00 0.00 H new ATOM 0 HH21 ARG A 103 9.522 -15.823 -16.840 1.00 0.00 H new ATOM 0 HH22 ARG A 103 8.342 -16.043 -18.137 1.00 0.00 H new ATOM 1685 N PHE A 104 9.889 -13.094 -11.277 1.00 0.00 N ATOM 1686 CA PHE A 104 11.276 -13.499 -11.077 1.00 0.00 C ATOM 1687 C PHE A 104 11.755 -13.124 -9.679 1.00 0.00 C ATOM 1688 O PHE A 104 12.333 -13.947 -8.968 1.00 0.00 O ATOM 1689 CB PHE A 104 12.176 -12.850 -12.130 1.00 0.00 C ATOM 1690 CG PHE A 104 11.973 -13.399 -13.512 1.00 0.00 C ATOM 1691 CD1 PHE A 104 11.983 -14.767 -13.736 1.00 0.00 C ATOM 1692 CD2 PHE A 104 11.774 -12.548 -14.588 1.00 0.00 C ATOM 1693 CE1 PHE A 104 11.797 -15.276 -15.008 1.00 0.00 C ATOM 1694 CE2 PHE A 104 11.587 -13.053 -15.862 1.00 0.00 C ATOM 1695 CZ PHE A 104 11.598 -14.418 -16.071 1.00 0.00 C ATOM 0 H PHE A 104 9.774 -12.221 -11.792 1.00 0.00 H new ATOM 0 HA PHE A 104 11.331 -14.583 -11.182 1.00 0.00 H new ATOM 0 HB2 PHE A 104 11.990 -11.776 -12.143 1.00 0.00 H new ATOM 0 HB3 PHE A 104 13.218 -12.989 -11.842 1.00 0.00 H new ATOM 0 HD1 PHE A 104 12.138 -15.443 -12.908 1.00 0.00 H new ATOM 0 HD2 PHE A 104 11.765 -11.480 -14.430 1.00 0.00 H new ATOM 0 HE1 PHE A 104 11.807 -16.344 -15.170 1.00 0.00 H new ATOM 0 HE2 PHE A 104 11.433 -12.380 -16.693 1.00 0.00 H new ATOM 0 HZ PHE A 104 11.451 -14.814 -17.065 1.00 0.00 H new ATOM 1705 N ASP A 105 11.511 -11.877 -9.289 1.00 0.00 N ATOM 1706 CA ASP A 105 11.916 -11.392 -7.975 1.00 0.00 C ATOM 1707 C ASP A 105 10.706 -10.930 -7.171 1.00 0.00 C ATOM 1708 O ASP A 105 10.148 -9.864 -7.429 1.00 0.00 O ATOM 1709 CB ASP A 105 12.916 -10.245 -8.119 1.00 0.00 C ATOM 1710 CG ASP A 105 14.172 -10.662 -8.859 1.00 0.00 C ATOM 1711 OD1 ASP A 105 14.461 -11.876 -8.901 1.00 0.00 O ATOM 1712 OD2 ASP A 105 14.868 -9.774 -9.395 1.00 0.00 O ATOM 0 H ASP A 105 11.034 -11.183 -9.865 1.00 0.00 H new ATOM 0 HA ASP A 105 12.392 -12.214 -7.441 1.00 0.00 H new ATOM 0 HB2 ASP A 105 12.443 -9.419 -8.649 1.00 0.00 H new ATOM 0 HB3 ASP A 105 13.186 -9.876 -7.130 1.00 0.00 H new ATOM 1717 N SER A 106 10.306 -11.739 -6.195 1.00 0.00 N ATOM 1718 CA SER A 106 9.163 -11.411 -5.352 1.00 0.00 C ATOM 1719 C SER A 106 9.593 -11.211 -3.903 1.00 0.00 C ATOM 1720 O SER A 106 8.816 -11.443 -2.977 1.00 0.00 O ATOM 1721 CB SER A 106 8.108 -12.514 -5.433 1.00 0.00 C ATOM 1722 OG SER A 106 8.706 -13.776 -5.673 1.00 0.00 O ATOM 0 H SER A 106 10.757 -12.626 -5.969 1.00 0.00 H new ATOM 0 HA SER A 106 8.733 -10.478 -5.717 1.00 0.00 H new ATOM 0 HB2 SER A 106 7.541 -12.548 -4.503 1.00 0.00 H new ATOM 0 HB3 SER A 106 7.400 -12.286 -6.230 1.00 0.00 H new ATOM 0 HG SER A 106 8.010 -14.464 -5.719 1.00 0.00 H new ATOM 1728 N ARG A 107 10.834 -10.777 -3.711 1.00 0.00 N ATOM 1729 CA ARG A 107 11.359 -10.543 -2.372 1.00 0.00 C ATOM 1730 C ARG A 107 10.540 -9.478 -1.654 1.00 0.00 C ATOM 1731 O ARG A 107 10.394 -9.508 -0.432 1.00 0.00 O ATOM 1732 CB ARG A 107 12.825 -10.110 -2.443 1.00 0.00 C ATOM 1733 CG ARG A 107 13.685 -11.012 -3.313 1.00 0.00 C ATOM 1734 CD ARG A 107 14.712 -10.213 -4.098 1.00 0.00 C ATOM 1735 NE ARG A 107 14.086 -9.242 -4.992 1.00 0.00 N ATOM 1736 CZ ARG A 107 14.726 -8.201 -5.521 1.00 0.00 C ATOM 1737 NH1 ARG A 107 16.008 -7.993 -5.246 1.00 0.00 N ATOM 1738 NH2 ARG A 107 14.082 -7.367 -6.325 1.00 0.00 N ATOM 0 H ARG A 107 11.493 -10.581 -4.464 1.00 0.00 H new ATOM 0 HA ARG A 107 11.291 -11.475 -1.811 1.00 0.00 H new ATOM 0 HB2 ARG A 107 12.876 -9.092 -2.828 1.00 0.00 H new ATOM 0 HB3 ARG A 107 13.238 -10.090 -1.435 1.00 0.00 H new ATOM 0 HG2 ARG A 107 14.194 -11.745 -2.687 1.00 0.00 H new ATOM 0 HG3 ARG A 107 13.050 -11.567 -4.003 1.00 0.00 H new ATOM 0 HD2 ARG A 107 15.373 -9.693 -3.405 1.00 0.00 H new ATOM 0 HD3 ARG A 107 15.333 -10.894 -4.680 1.00 0.00 H new ATOM 0 HE ARG A 107 13.101 -9.369 -5.225 1.00 0.00 H new ATOM 0 HH11 ARG A 107 16.507 -8.632 -4.627 1.00 0.00 H new ATOM 0 HH12 ARG A 107 16.494 -7.194 -5.654 1.00 0.00 H new ATOM 0 HH21 ARG A 107 13.097 -7.523 -6.538 1.00 0.00 H new ATOM 0 HH22 ARG A 107 14.572 -6.569 -6.731 1.00 0.00 H new ATOM 1752 N TRP A 108 10.008 -8.537 -2.425 1.00 0.00 N ATOM 1753 CA TRP A 108 9.203 -7.454 -1.872 1.00 0.00 C ATOM 1754 C TRP A 108 7.893 -7.982 -1.293 1.00 0.00 C ATOM 1755 O TRP A 108 7.466 -7.559 -0.218 1.00 0.00 O ATOM 1756 CB TRP A 108 8.917 -6.405 -2.947 1.00 0.00 C ATOM 1757 CG TRP A 108 10.158 -5.787 -3.515 1.00 0.00 C ATOM 1758 CD1 TRP A 108 10.587 -5.847 -4.810 1.00 0.00 C ATOM 1759 CD2 TRP A 108 11.133 -5.018 -2.803 1.00 0.00 C ATOM 1760 NE1 TRP A 108 11.769 -5.160 -4.947 1.00 0.00 N ATOM 1761 CE2 TRP A 108 12.126 -4.643 -3.729 1.00 0.00 C ATOM 1762 CE3 TRP A 108 11.263 -4.610 -1.474 1.00 0.00 C ATOM 1763 CZ2 TRP A 108 13.232 -3.879 -3.365 1.00 0.00 C ATOM 1764 CZ3 TRP A 108 12.361 -3.851 -1.114 1.00 0.00 C ATOM 1765 CH2 TRP A 108 13.332 -3.493 -2.056 1.00 0.00 C ATOM 0 H TRP A 108 10.120 -8.502 -3.438 1.00 0.00 H new ATOM 0 HA TRP A 108 9.770 -6.991 -1.064 1.00 0.00 H new ATOM 0 HB2 TRP A 108 8.347 -6.867 -3.753 1.00 0.00 H new ATOM 0 HB3 TRP A 108 8.290 -5.621 -2.522 1.00 0.00 H new ATOM 0 HD1 TRP A 108 10.073 -6.359 -5.609 1.00 0.00 H new ATOM 0 HE1 TRP A 108 12.295 -5.052 -5.814 1.00 0.00 H new ATOM 0 HE3 TRP A 108 10.519 -4.883 -0.740 1.00 0.00 H new ATOM 0 HZ2 TRP A 108 13.983 -3.601 -4.089 1.00 0.00 H new ATOM 0 HZ3 TRP A 108 12.471 -3.529 -0.089 1.00 0.00 H new ATOM 0 HH2 TRP A 108 14.178 -2.899 -1.743 1.00 0.00 H new ATOM 1776 N ARG A 109 7.255 -8.904 -2.009 1.00 0.00 N ATOM 1777 CA ARG A 109 5.994 -9.479 -1.555 1.00 0.00 C ATOM 1778 C ARG A 109 6.236 -10.631 -0.586 1.00 0.00 C ATOM 1779 O ARG A 109 5.433 -10.879 0.313 1.00 0.00 O ATOM 1780 CB ARG A 109 5.167 -9.963 -2.747 1.00 0.00 C ATOM 1781 CG ARG A 109 5.834 -11.074 -3.538 1.00 0.00 C ATOM 1782 CD ARG A 109 5.114 -11.334 -4.850 1.00 0.00 C ATOM 1783 NE ARG A 109 3.724 -11.734 -4.641 1.00 0.00 N ATOM 1784 CZ ARG A 109 2.990 -12.370 -5.552 1.00 0.00 C ATOM 1785 NH1 ARG A 109 3.509 -12.681 -6.734 1.00 0.00 N ATOM 1786 NH2 ARG A 109 1.735 -12.697 -5.280 1.00 0.00 N ATOM 0 H ARG A 109 7.589 -9.267 -2.902 1.00 0.00 H new ATOM 0 HA ARG A 109 5.439 -8.700 -1.032 1.00 0.00 H new ATOM 0 HB2 ARG A 109 4.199 -10.314 -2.389 1.00 0.00 H new ATOM 0 HB3 ARG A 109 4.975 -9.120 -3.411 1.00 0.00 H new ATOM 0 HG2 ARG A 109 6.872 -10.807 -3.738 1.00 0.00 H new ATOM 0 HG3 ARG A 109 5.849 -11.987 -2.943 1.00 0.00 H new ATOM 0 HD2 ARG A 109 5.144 -10.434 -5.465 1.00 0.00 H new ATOM 0 HD3 ARG A 109 5.637 -12.115 -5.402 1.00 0.00 H new ATOM 0 HE ARG A 109 3.291 -11.513 -3.745 1.00 0.00 H new ATOM 0 HH11 ARG A 109 4.475 -12.433 -6.948 1.00 0.00 H new ATOM 0 HH12 ARG A 109 2.942 -13.168 -7.428 1.00 0.00 H new ATOM 0 HH21 ARG A 109 1.332 -12.462 -4.373 1.00 0.00 H new ATOM 0 HH22 ARG A 109 1.172 -13.184 -5.977 1.00 0.00 H new ATOM 1800 N ASP A 110 7.351 -11.332 -0.773 1.00 0.00 N ATOM 1801 CA ASP A 110 7.700 -12.457 0.088 1.00 0.00 C ATOM 1802 C ASP A 110 7.814 -12.011 1.543 1.00 0.00 C ATOM 1803 O ASP A 110 7.532 -12.779 2.463 1.00 0.00 O ATOM 1804 CB ASP A 110 9.016 -13.089 -0.371 1.00 0.00 C ATOM 1805 CG ASP A 110 8.811 -14.444 -1.021 1.00 0.00 C ATOM 1806 OD1 ASP A 110 8.359 -15.374 -0.322 1.00 0.00 O ATOM 1807 OD2 ASP A 110 9.104 -14.574 -2.228 1.00 0.00 O ATOM 0 H ASP A 110 8.027 -11.141 -1.512 1.00 0.00 H new ATOM 0 HA ASP A 110 6.906 -13.200 0.016 1.00 0.00 H new ATOM 0 HB2 ASP A 110 9.510 -12.421 -1.077 1.00 0.00 H new ATOM 0 HB3 ASP A 110 9.682 -13.197 0.485 1.00 0.00 H new ATOM 1812 N THR A 111 8.230 -10.764 1.741 1.00 0.00 N ATOM 1813 CA THR A 111 8.384 -10.206 3.079 1.00 0.00 C ATOM 1814 C THR A 111 7.125 -10.413 3.915 1.00 0.00 C ATOM 1815 O THR A 111 6.007 -10.288 3.414 1.00 0.00 O ATOM 1816 CB THR A 111 8.710 -8.713 2.989 1.00 0.00 C ATOM 1817 OG1 THR A 111 8.932 -8.326 1.644 1.00 0.00 O ATOM 1818 CG2 THR A 111 9.935 -8.324 3.782 1.00 0.00 C ATOM 0 H THR A 111 8.467 -10.119 0.988 1.00 0.00 H new ATOM 0 HA THR A 111 9.205 -10.729 3.569 1.00 0.00 H new ATOM 0 HB THR A 111 7.843 -8.202 3.408 1.00 0.00 H new ATOM 0 HG1 THR A 111 8.157 -7.824 1.316 1.00 0.00 H new ATOM 0 HG21 THR A 111 10.112 -7.254 3.677 1.00 0.00 H new ATOM 0 HG22 THR A 111 9.779 -8.564 4.834 1.00 0.00 H new ATOM 0 HG23 THR A 111 10.800 -8.873 3.409 1.00 0.00 H new ATOM 1826 N LYS A 112 7.314 -10.726 5.193 1.00 0.00 N ATOM 1827 CA LYS A 112 6.193 -10.946 6.099 1.00 0.00 C ATOM 1828 C LYS A 112 5.346 -9.684 6.224 1.00 0.00 C ATOM 1829 O LYS A 112 4.132 -9.754 6.417 1.00 0.00 O ATOM 1830 CB LYS A 112 6.700 -11.377 7.478 1.00 0.00 C ATOM 1831 CG LYS A 112 6.148 -12.717 7.936 1.00 0.00 C ATOM 1832 CD LYS A 112 6.841 -13.873 7.234 1.00 0.00 C ATOM 1833 CE LYS A 112 7.955 -14.456 8.088 1.00 0.00 C ATOM 1834 NZ LYS A 112 7.528 -15.703 8.780 1.00 0.00 N ATOM 0 H LYS A 112 8.232 -10.833 5.624 1.00 0.00 H new ATOM 0 HA LYS A 112 5.572 -11.741 5.687 1.00 0.00 H new ATOM 0 HB2 LYS A 112 7.788 -11.430 7.456 1.00 0.00 H new ATOM 0 HB3 LYS A 112 6.433 -10.614 8.209 1.00 0.00 H new ATOM 0 HG2 LYS A 112 6.276 -12.815 9.014 1.00 0.00 H new ATOM 0 HG3 LYS A 112 5.077 -12.758 7.737 1.00 0.00 H new ATOM 0 HD2 LYS A 112 6.112 -14.650 7.005 1.00 0.00 H new ATOM 0 HD3 LYS A 112 7.251 -13.530 6.284 1.00 0.00 H new ATOM 0 HE2 LYS A 112 8.821 -14.667 7.461 1.00 0.00 H new ATOM 0 HE3 LYS A 112 8.269 -13.719 8.828 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 8.315 -16.070 9.352 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 6.717 -15.497 9.398 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 7.252 -16.415 8.074 1.00 0.00 H new ATOM 1848 N ILE A 113 5.996 -8.529 6.111 1.00 0.00 N ATOM 1849 CA ILE A 113 5.306 -7.249 6.209 1.00 0.00 C ATOM 1850 C ILE A 113 4.353 -7.052 5.034 1.00 0.00 C ATOM 1851 O ILE A 113 3.245 -6.541 5.199 1.00 0.00 O ATOM 1852 CB ILE A 113 6.303 -6.073 6.253 1.00 0.00 C ATOM 1853 CG1 ILE A 113 7.155 -6.049 4.982 1.00 0.00 C ATOM 1854 CG2 ILE A 113 7.189 -6.173 7.487 1.00 0.00 C ATOM 1855 CD1 ILE A 113 8.193 -4.948 4.970 1.00 0.00 C ATOM 0 H ILE A 113 7.001 -8.455 5.951 1.00 0.00 H new ATOM 0 HA ILE A 113 4.737 -7.264 7.139 1.00 0.00 H new ATOM 0 HB ILE A 113 5.739 -5.142 6.309 1.00 0.00 H new ATOM 0 HG12 ILE A 113 7.656 -7.011 4.872 1.00 0.00 H new ATOM 0 HG13 ILE A 113 6.501 -5.930 4.118 1.00 0.00 H new ATOM 0 HG21 ILE A 113 7.887 -5.336 7.503 1.00 0.00 H new ATOM 0 HG22 ILE A 113 6.569 -6.146 8.383 1.00 0.00 H new ATOM 0 HG23 ILE A 113 7.746 -7.109 7.460 1.00 0.00 H new ATOM 0 HD11 ILE A 113 8.759 -4.992 4.040 1.00 0.00 H new ATOM 0 HD12 ILE A 113 7.698 -3.980 5.048 1.00 0.00 H new ATOM 0 HD13 ILE A 113 8.871 -5.078 5.814 1.00 0.00 H new ATOM 1867 N ALA A 114 4.792 -7.464 3.850 1.00 0.00 N ATOM 1868 CA ALA A 114 3.978 -7.336 2.648 1.00 0.00 C ATOM 1869 C ALA A 114 2.785 -8.284 2.695 1.00 0.00 C ATOM 1870 O ALA A 114 1.694 -7.949 2.235 1.00 0.00 O ATOM 1871 CB ALA A 114 4.821 -7.602 1.410 1.00 0.00 C ATOM 0 H ALA A 114 5.707 -7.889 3.697 1.00 0.00 H new ATOM 0 HA ALA A 114 3.597 -6.316 2.600 1.00 0.00 H new ATOM 0 HB1 ALA A 114 4.201 -7.503 0.519 1.00 0.00 H new ATOM 0 HB2 ALA A 114 5.638 -6.882 1.365 1.00 0.00 H new ATOM 0 HB3 ALA A 114 5.229 -8.612 1.458 1.00 0.00 H new ATOM 1877 N GLN A 115 3.003 -9.470 3.255 1.00 0.00 N ATOM 1878 CA GLN A 115 1.946 -10.468 3.364 1.00 0.00 C ATOM 1879 C GLN A 115 0.876 -10.021 4.355 1.00 0.00 C ATOM 1880 O GLN A 115 -0.309 -10.301 4.172 1.00 0.00 O ATOM 1881 CB GLN A 115 2.530 -11.814 3.799 1.00 0.00 C ATOM 1882 CG GLN A 115 3.390 -12.475 2.736 1.00 0.00 C ATOM 1883 CD GLN A 115 2.574 -13.289 1.751 1.00 0.00 C ATOM 1884 OE1 GLN A 115 1.615 -13.962 2.128 1.00 0.00 O ATOM 1885 NE2 GLN A 115 2.953 -13.232 0.479 1.00 0.00 N ATOM 0 H GLN A 115 3.901 -9.763 3.640 1.00 0.00 H new ATOM 0 HA GLN A 115 1.483 -10.580 2.383 1.00 0.00 H new ATOM 0 HB2 GLN A 115 3.128 -11.668 4.699 1.00 0.00 H new ATOM 0 HB3 GLN A 115 1.714 -12.486 4.064 1.00 0.00 H new ATOM 0 HG2 GLN A 115 3.947 -11.709 2.196 1.00 0.00 H new ATOM 0 HG3 GLN A 115 4.123 -13.122 3.217 1.00 0.00 H new ATOM 0 HE21 GLN A 115 3.754 -12.661 0.211 1.00 0.00 H new ATOM 0 HE22 GLN A 115 2.443 -13.759 -0.229 1.00 0.00 H new ATOM 1894 N ASP A 116 1.300 -9.323 5.403 1.00 0.00 N ATOM 1895 CA ASP A 116 0.377 -8.836 6.422 1.00 0.00 C ATOM 1896 C ASP A 116 -0.225 -7.488 6.026 1.00 0.00 C ATOM 1897 O ASP A 116 -1.199 -7.035 6.626 1.00 0.00 O ATOM 1898 CB ASP A 116 1.093 -8.709 7.768 1.00 0.00 C ATOM 1899 CG ASP A 116 0.134 -8.433 8.909 1.00 0.00 C ATOM 1900 OD1 ASP A 116 -0.996 -8.964 8.878 1.00 0.00 O ATOM 1901 OD2 ASP A 116 0.513 -7.684 9.835 1.00 0.00 O ATOM 0 H ASP A 116 2.277 -9.082 5.569 1.00 0.00 H new ATOM 0 HA ASP A 116 -0.433 -9.559 6.511 1.00 0.00 H new ATOM 0 HB2 ASP A 116 1.642 -9.628 7.973 1.00 0.00 H new ATOM 0 HB3 ASP A 116 1.827 -7.905 7.712 1.00 0.00 H new ATOM 1906 N PHE A 117 0.360 -6.850 5.014 1.00 0.00 N ATOM 1907 CA PHE A 117 -0.118 -5.555 4.546 1.00 0.00 C ATOM 1908 C PHE A 117 -1.607 -5.596 4.212 1.00 0.00 C ATOM 1909 O PHE A 117 -2.368 -4.720 4.621 1.00 0.00 O ATOM 1910 CB PHE A 117 0.675 -5.116 3.315 1.00 0.00 C ATOM 1911 CG PHE A 117 0.529 -3.657 3.005 1.00 0.00 C ATOM 1912 CD1 PHE A 117 0.804 -2.702 3.968 1.00 0.00 C ATOM 1913 CD2 PHE A 117 0.115 -3.239 1.751 1.00 0.00 C ATOM 1914 CE1 PHE A 117 0.669 -1.356 3.689 1.00 0.00 C ATOM 1915 CE2 PHE A 117 -0.022 -1.895 1.463 1.00 0.00 C ATOM 1916 CZ PHE A 117 0.256 -0.952 2.434 1.00 0.00 C ATOM 0 H PHE A 117 1.166 -7.211 4.504 1.00 0.00 H new ATOM 0 HA PHE A 117 0.029 -4.835 5.351 1.00 0.00 H new ATOM 0 HB2 PHE A 117 1.730 -5.343 3.471 1.00 0.00 H new ATOM 0 HB3 PHE A 117 0.347 -5.698 2.454 1.00 0.00 H new ATOM 0 HD1 PHE A 117 1.128 -3.013 4.950 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -0.103 -3.973 0.989 1.00 0.00 H new ATOM 0 HE1 PHE A 117 0.886 -0.621 4.450 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -0.346 -1.582 0.481 1.00 0.00 H new ATOM 0 HZ PHE A 117 0.151 0.100 2.212 1.00 0.00 H new ATOM 1926 N LEU A 118 -2.017 -6.615 3.463 1.00 0.00 N ATOM 1927 CA LEU A 118 -3.415 -6.759 3.073 1.00 0.00 C ATOM 1928 C LEU A 118 -4.071 -7.931 3.796 1.00 0.00 C ATOM 1929 O LEU A 118 -5.025 -8.525 3.292 1.00 0.00 O ATOM 1930 CB LEU A 118 -3.531 -6.949 1.557 1.00 0.00 C ATOM 1931 CG LEU A 118 -3.087 -5.754 0.702 1.00 0.00 C ATOM 1932 CD1 LEU A 118 -3.722 -5.824 -0.677 1.00 0.00 C ATOM 1933 CD2 LEU A 118 -3.441 -4.437 1.381 1.00 0.00 C ATOM 0 H LEU A 118 -1.403 -7.351 3.115 1.00 0.00 H new ATOM 0 HA LEU A 118 -3.936 -5.845 3.359 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -2.937 -7.817 1.271 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -4.569 -7.179 1.316 1.00 0.00 H new ATOM 0 HG LEU A 118 -2.004 -5.800 0.592 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -3.397 -4.970 -1.271 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -3.417 -6.746 -1.171 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -4.807 -5.806 -0.579 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -3.116 -3.606 0.755 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -4.520 -4.381 1.527 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -2.941 -4.380 2.348 1.00 0.00 H new ATOM 1945 N GLN A 119 -3.559 -8.261 4.978 1.00 0.00 N ATOM 1946 CA GLN A 119 -4.102 -9.363 5.762 1.00 0.00 C ATOM 1947 C GLN A 119 -4.043 -10.669 4.978 1.00 0.00 C ATOM 1948 O GLN A 119 -5.027 -11.405 4.901 1.00 0.00 O ATOM 1949 CB GLN A 119 -5.545 -9.061 6.173 1.00 0.00 C ATOM 1950 CG GLN A 119 -5.676 -7.864 7.100 1.00 0.00 C ATOM 1951 CD GLN A 119 -6.784 -8.037 8.121 1.00 0.00 C ATOM 1952 OE1 GLN A 119 -6.587 -8.648 9.172 1.00 0.00 O ATOM 1953 NE2 GLN A 119 -7.958 -7.496 7.817 1.00 0.00 N ATOM 0 H GLN A 119 -2.770 -7.782 5.412 1.00 0.00 H new ATOM 0 HA GLN A 119 -3.493 -9.474 6.659 1.00 0.00 H new ATOM 0 HB2 GLN A 119 -6.139 -8.883 5.277 1.00 0.00 H new ATOM 0 HB3 GLN A 119 -5.965 -9.938 6.665 1.00 0.00 H new ATOM 0 HG2 GLN A 119 -4.730 -7.705 7.618 1.00 0.00 H new ATOM 0 HG3 GLN A 119 -5.869 -6.970 6.508 1.00 0.00 H new ATOM 0 HE21 GLN A 119 -8.077 -6.998 6.935 1.00 0.00 H new ATOM 0 HE22 GLN A 119 -8.741 -7.578 8.466 1.00 0.00 H new ATOM 1962 N LEU A 120 -2.881 -10.951 4.397 1.00 0.00 N ATOM 1963 CA LEU A 120 -2.691 -12.169 3.618 1.00 0.00 C ATOM 1964 C LEU A 120 -2.145 -13.295 4.490 1.00 0.00 C ATOM 1965 O LEU A 120 -1.309 -14.085 4.052 1.00 0.00 O ATOM 1966 CB LEU A 120 -1.741 -11.907 2.447 1.00 0.00 C ATOM 1967 CG LEU A 120 -1.874 -10.527 1.801 1.00 0.00 C ATOM 1968 CD1 LEU A 120 -0.593 -10.152 1.072 1.00 0.00 C ATOM 1969 CD2 LEU A 120 -3.060 -10.498 0.850 1.00 0.00 C ATOM 0 H LEU A 120 -2.057 -10.352 4.451 1.00 0.00 H new ATOM 0 HA LEU A 120 -3.662 -12.476 3.228 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -0.716 -12.030 2.796 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -1.911 -12.666 1.684 1.00 0.00 H new ATOM 0 HG LEU A 120 -2.046 -9.793 2.588 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -0.707 -9.167 0.619 1.00 0.00 H new ATOM 0 HD12 LEU A 120 0.236 -10.132 1.780 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -0.388 -10.888 0.294 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -3.140 -9.509 0.399 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -2.917 -11.243 0.068 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -3.974 -10.721 1.401 1.00 0.00 H new ATOM 1981 N SER A 121 -2.627 -13.361 5.726 1.00 0.00 N ATOM 1982 CA SER A 121 -2.192 -14.390 6.664 1.00 0.00 C ATOM 1983 C SER A 121 -3.273 -15.454 6.837 1.00 0.00 C ATOM 1984 O SER A 121 -4.196 -15.551 6.028 1.00 0.00 O ATOM 1985 CB SER A 121 -1.850 -13.760 8.016 1.00 0.00 C ATOM 1986 OG SER A 121 -0.613 -14.245 8.507 1.00 0.00 O ATOM 0 H SER A 121 -3.320 -12.714 6.102 1.00 0.00 H new ATOM 0 HA SER A 121 -1.300 -14.869 6.261 1.00 0.00 H new ATOM 0 HB2 SER A 121 -1.804 -12.676 7.914 1.00 0.00 H new ATOM 0 HB3 SER A 121 -2.641 -13.980 8.733 1.00 0.00 H new ATOM 0 HG SER A 121 -0.417 -13.826 9.371 1.00 0.00 H new ATOM 1992 N LYS A 122 -3.154 -16.251 7.894 1.00 0.00 N ATOM 1993 CA LYS A 122 -4.123 -17.307 8.169 1.00 0.00 C ATOM 1994 C LYS A 122 -5.105 -16.874 9.257 1.00 0.00 C ATOM 1995 O LYS A 122 -4.823 -17.011 10.447 1.00 0.00 O ATOM 1996 CB LYS A 122 -3.404 -18.587 8.596 1.00 0.00 C ATOM 1997 CG LYS A 122 -4.239 -19.843 8.411 1.00 0.00 C ATOM 1998 CD LYS A 122 -3.751 -20.974 9.302 1.00 0.00 C ATOM 1999 CE LYS A 122 -4.813 -22.049 9.470 1.00 0.00 C ATOM 2000 NZ LYS A 122 -4.446 -23.033 10.526 1.00 0.00 N ATOM 0 H LYS A 122 -2.397 -16.186 8.574 1.00 0.00 H new ATOM 0 HA LYS A 122 -4.683 -17.500 7.254 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -2.483 -18.685 8.022 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -3.119 -18.501 9.645 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -5.282 -19.624 8.638 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -4.199 -20.157 7.368 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -2.851 -21.414 8.873 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -3.477 -20.576 10.279 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -5.765 -21.582 9.724 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -4.956 -22.569 8.523 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -5.196 -23.749 10.609 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -3.551 -23.497 10.272 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -4.335 -22.541 11.435 1.00 0.00 H new ATOM 2014 N PRO A 123 -6.278 -16.343 8.864 1.00 0.00 N ATOM 2015 CA PRO A 123 -7.298 -15.892 9.816 1.00 0.00 C ATOM 2016 C PRO A 123 -7.932 -17.051 10.579 1.00 0.00 C ATOM 2017 O PRO A 123 -8.116 -18.139 10.034 1.00 0.00 O ATOM 2018 CB PRO A 123 -8.339 -15.204 8.929 1.00 0.00 C ATOM 2019 CG PRO A 123 -8.166 -15.828 7.589 1.00 0.00 C ATOM 2020 CD PRO A 123 -6.702 -16.141 7.464 1.00 0.00 C ATOM 0 HA PRO A 123 -6.877 -15.242 10.583 1.00 0.00 H new ATOM 0 HB2 PRO A 123 -9.348 -15.359 9.310 1.00 0.00 H new ATOM 0 HB3 PRO A 123 -8.175 -14.127 8.888 1.00 0.00 H new ATOM 0 HG2 PRO A 123 -8.767 -16.733 7.499 1.00 0.00 H new ATOM 0 HG3 PRO A 123 -8.489 -15.151 6.798 1.00 0.00 H new ATOM 0 HD2 PRO A 123 -6.531 -17.032 6.859 1.00 0.00 H new ATOM 0 HD3 PRO A 123 -6.155 -15.325 6.992 1.00 0.00 H new ATOM 2028 N ASN A 124 -8.263 -16.810 11.843 1.00 0.00 N ATOM 2029 CA ASN A 124 -8.877 -17.833 12.682 1.00 0.00 C ATOM 2030 C ASN A 124 -9.910 -17.219 13.621 1.00 0.00 C ATOM 2031 O ASN A 124 -9.905 -15.979 13.775 1.00 0.00 O ATOM 2032 CB ASN A 124 -7.806 -18.567 13.493 1.00 0.00 C ATOM 2033 CG ASN A 124 -6.846 -17.615 14.178 1.00 0.00 C ATOM 2034 OD1 ASN A 124 -5.761 -17.336 13.670 1.00 0.00 O ATOM 2035 ND2 ASN A 124 -7.242 -17.111 15.342 1.00 0.00 N ATOM 2036 OXT ASN A 124 -10.716 -17.983 14.193 1.00 0.00 O ATOM 0 H ASN A 124 -8.116 -15.915 12.309 1.00 0.00 H new ATOM 0 HA ASN A 124 -9.383 -18.546 12.031 1.00 0.00 H new ATOM 0 HB2 ASN A 124 -8.288 -19.194 14.243 1.00 0.00 H new ATOM 0 HB3 ASN A 124 -7.247 -19.231 12.834 1.00 0.00 H new ATOM 0 HD21 ASN A 124 -6.638 -16.466 15.850 1.00 0.00 H new ATOM 0 HD22 ASN A 124 -8.150 -17.370 15.727 1.00 0.00 H new TER 2043 ASN A 124