USER MOD reduce.3.24.130724 H: found=0, std=0, add=687, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 689 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: A 890 HIS H : A 890 HIS N : A 855 ARG O :(H bumps) USER MOD Set 1.1: A 842 CYS SG : rot -106:sc= -3.4! USER MOD Set 1.2: A 843 GLN : amide:sc= 0.419 K(o=-3,f=-3.9) USER MOD Single : A 840 THR OG1 : rot 180:sc= 0.00263 USER MOD Single : A 844 THR OG1 : rot 180:sc= 0 USER MOD Single : A 845 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 852 THR OG1 : rot 180:sc= 0 USER MOD Single : A 857 TYR OH : rot 180:sc= -0.0411 USER MOD Single : A 861 SER OG : rot 180:sc= 0 USER MOD Single : A 862 THR OG1 : rot -90:sc= -1.96! USER MOD Single : A 866 SER OG : rot 180:sc= 0 USER MOD Single : A 881 GLN : amide:sc=-0.00578 X(o=-0.0058,f=-0.0047) USER MOD Single : A 885 MET CE :methyl 138:sc= -18.4! (180deg=-26.2!) USER MOD Single : A 886 THR OG1 : rot 180:sc= -0.401 USER MOD Single : A 887 SER OG : rot 180:sc= 0 USER MOD Single : A 889 THR OG1 : rot 180:sc= -0.0404 USER MOD Single : A 890 HIS : no HD1:sc= -20.8! C(o=-21!,f=-22!) USER MOD Single : A 894 SER OG : rot 105:sc= 0.0171 USER MOD Single : A 897 LYS NZ :NH3+ 154:sc= -20.3! (180deg=-21.9!) USER MOD Single : A 898 ASN : amide:sc= -22.4! C(o=-22!,f=-28!) USER MOD Single : A 902 GLN : amide:sc= -6.18! C(o=-6.2!,f=-2.7!) USER MOD Single : A 903 GLN : amide:sc= -19.2! C(o=-19!,f=-8.9!) USER MOD Single : A 905 SER OG : rot 180:sc= -2.74! USER MOD Single : A 912 CYS SG : rot -156:sc= -12.7! USER MOD Single : A 915 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 922 CYS SG : rot -50:sc= -0.21 USER MOD ----------------------------------------------------------------- ATOM 19 N ALA A 837 -9.772 -4.308 6.801 1.00 0.00 N ATOM 20 CA ALA A 837 -9.611 -4.850 5.467 1.00 0.00 C ATOM 21 C ALA A 837 -10.861 -5.623 5.070 1.00 0.00 C ATOM 22 O ALA A 837 -11.539 -5.259 4.112 1.00 0.00 O ATOM 23 CB ALA A 837 -8.382 -5.754 5.431 1.00 0.00 C ATOM 0 HA ALA A 837 -9.469 -4.037 4.755 1.00 0.00 H new ATOM 0 HB1 ALA A 837 -8.260 -6.162 4.428 1.00 0.00 H new ATOM 0 HB2 ALA A 837 -7.497 -5.176 5.698 1.00 0.00 H new ATOM 0 HB3 ALA A 837 -8.510 -6.570 6.142 1.00 0.00 H new ATOM 29 N ASP A 838 -11.164 -6.692 5.809 1.00 0.00 N ATOM 30 CA ASP A 838 -12.327 -7.510 5.530 1.00 0.00 C ATOM 31 C ASP A 838 -13.533 -6.618 5.272 1.00 0.00 C ATOM 32 O ASP A 838 -14.349 -6.912 4.402 1.00 0.00 O ATOM 33 CB ASP A 838 -12.587 -8.442 6.710 1.00 0.00 C ATOM 34 CG ASP A 838 -12.285 -9.887 6.337 1.00 0.00 C ATOM 35 OD1 ASP A 838 -13.108 -10.466 5.596 1.00 0.00 O ATOM 36 OD2 ASP A 838 -11.236 -10.385 6.801 1.00 0.00 O ATOM 0 H ASP A 838 -10.612 -7.006 6.607 1.00 0.00 H new ATOM 0 HA ASP A 838 -12.148 -8.113 4.640 1.00 0.00 H new ATOM 0 HB2 ASP A 838 -11.969 -8.144 7.557 1.00 0.00 H new ATOM 0 HB3 ASP A 838 -13.626 -8.353 7.027 1.00 0.00 H new ATOM 41 N GLU A 839 -13.644 -5.524 6.030 1.00 0.00 N ATOM 42 CA GLU A 839 -14.748 -4.599 5.876 1.00 0.00 C ATOM 43 C GLU A 839 -14.518 -3.713 4.660 1.00 0.00 C ATOM 44 O GLU A 839 -15.469 -3.210 4.066 1.00 0.00 O ATOM 45 CB GLU A 839 -14.884 -3.756 7.141 1.00 0.00 C ATOM 46 CG GLU A 839 -16.108 -4.214 7.929 1.00 0.00 C ATOM 47 CD GLU A 839 -17.191 -3.145 7.920 1.00 0.00 C ATOM 48 OE1 GLU A 839 -17.431 -2.589 6.826 1.00 0.00 O ATOM 49 OE2 GLU A 839 -17.759 -2.903 9.007 1.00 0.00 O ATOM 0 H GLU A 839 -12.976 -5.265 6.756 1.00 0.00 H new ATOM 0 HA GLU A 839 -15.673 -5.155 5.723 1.00 0.00 H new ATOM 0 HB2 GLU A 839 -13.987 -3.852 7.753 1.00 0.00 H new ATOM 0 HB3 GLU A 839 -14.980 -2.702 6.880 1.00 0.00 H new ATOM 0 HG2 GLU A 839 -16.498 -5.136 7.499 1.00 0.00 H new ATOM 0 HG3 GLU A 839 -15.821 -4.438 8.956 1.00 0.00 H new ATOM 56 N THR A 840 -13.250 -3.524 4.289 1.00 0.00 N ATOM 57 CA THR A 840 -12.906 -2.703 3.146 1.00 0.00 C ATOM 58 C THR A 840 -13.072 -3.503 1.862 1.00 0.00 C ATOM 59 O THR A 840 -13.686 -3.031 0.908 1.00 0.00 O ATOM 60 CB THR A 840 -11.470 -2.207 3.291 1.00 0.00 C ATOM 61 OG1 THR A 840 -11.177 -2.008 4.656 1.00 0.00 O ATOM 62 CG2 THR A 840 -11.308 -0.888 2.540 1.00 0.00 C ATOM 0 H THR A 840 -12.449 -3.933 4.770 1.00 0.00 H new ATOM 0 HA THR A 840 -13.573 -1.842 3.101 1.00 0.00 H new ATOM 0 HB THR A 840 -10.787 -2.948 2.876 1.00 0.00 H new ATOM 0 HG1 THR A 840 -10.254 -1.691 4.750 1.00 0.00 H new ATOM 0 HG21 THR A 840 -10.282 -0.534 2.644 1.00 0.00 H new ATOM 0 HG22 THR A 840 -11.534 -1.040 1.485 1.00 0.00 H new ATOM 0 HG23 THR A 840 -11.991 -0.147 2.955 1.00 0.00 H new ATOM 70 N LEU A 841 -12.523 -4.720 1.841 1.00 0.00 N ATOM 71 CA LEU A 841 -12.612 -5.580 0.678 1.00 0.00 C ATOM 72 C LEU A 841 -14.050 -6.039 0.485 1.00 0.00 C ATOM 73 O LEU A 841 -14.356 -6.745 -0.474 1.00 0.00 O ATOM 74 CB LEU A 841 -11.682 -6.776 0.858 1.00 0.00 C ATOM 75 CG LEU A 841 -10.266 -6.386 0.445 1.00 0.00 C ATOM 76 CD1 LEU A 841 -10.033 -6.785 -1.010 1.00 0.00 C ATOM 77 CD2 LEU A 841 -10.090 -4.878 0.593 1.00 0.00 C ATOM 0 H LEU A 841 -12.012 -5.126 2.625 1.00 0.00 H new ATOM 0 HA LEU A 841 -12.305 -5.029 -0.211 1.00 0.00 H new ATOM 0 HB2 LEU A 841 -11.692 -7.105 1.897 1.00 0.00 H new ATOM 0 HB3 LEU A 841 -12.030 -7.615 0.255 1.00 0.00 H new ATOM 0 HG LEU A 841 -9.547 -6.900 1.083 1.00 0.00 H new ATOM 0 HD11 LEU A 841 -9.022 -6.507 -1.306 1.00 0.00 H new ATOM 0 HD12 LEU A 841 -10.159 -7.862 -1.116 1.00 0.00 H new ATOM 0 HD13 LEU A 841 -10.752 -6.271 -1.648 1.00 0.00 H new ATOM 0 HD21 LEU A 841 -9.078 -4.599 0.298 1.00 0.00 H new ATOM 0 HD22 LEU A 841 -10.809 -4.363 -0.045 1.00 0.00 H new ATOM 0 HD23 LEU A 841 -10.257 -4.592 1.632 1.00 0.00 H new ATOM 89 N CYS A 842 -14.934 -5.637 1.401 1.00 0.00 N ATOM 90 CA CYS A 842 -16.334 -6.004 1.332 1.00 0.00 C ATOM 91 C CYS A 842 -16.902 -5.596 -0.019 1.00 0.00 C ATOM 92 O CYS A 842 -18.047 -5.914 -0.334 1.00 0.00 O ATOM 93 CB CYS A 842 -17.094 -5.324 2.468 1.00 0.00 C ATOM 94 SG CYS A 842 -17.413 -3.603 2.006 1.00 0.00 S ATOM 0 H CYS A 842 -14.694 -5.053 2.202 1.00 0.00 H new ATOM 0 HA CYS A 842 -16.440 -7.083 1.440 1.00 0.00 H new ATOM 0 HB2 CYS A 842 -18.033 -5.844 2.659 1.00 0.00 H new ATOM 0 HB3 CYS A 842 -16.513 -5.366 3.389 1.00 0.00 H new ATOM 0 HG CYS A 842 -16.622 -2.820 2.678 1.00 0.00 H new ATOM 100 N GLN A 843 -16.100 -4.889 -0.819 1.00 0.00 N ATOM 101 CA GLN A 843 -16.529 -4.443 -2.130 1.00 0.00 C ATOM 102 C GLN A 843 -15.677 -5.102 -3.205 1.00 0.00 C ATOM 103 O GLN A 843 -14.891 -4.434 -3.874 1.00 0.00 O ATOM 104 CB GLN A 843 -16.417 -2.923 -2.208 1.00 0.00 C ATOM 105 CG GLN A 843 -16.818 -2.312 -0.868 1.00 0.00 C ATOM 106 CD GLN A 843 -18.064 -1.452 -1.015 1.00 0.00 C ATOM 107 OE1 GLN A 843 -18.109 -0.559 -1.858 1.00 0.00 O ATOM 108 NE2 GLN A 843 -19.078 -1.722 -0.189 1.00 0.00 N ATOM 0 H GLN A 843 -15.148 -4.617 -0.573 1.00 0.00 H new ATOM 0 HA GLN A 843 -17.568 -4.728 -2.294 1.00 0.00 H new ATOM 0 HB2 GLN A 843 -15.396 -2.636 -2.459 1.00 0.00 H new ATOM 0 HB3 GLN A 843 -17.060 -2.541 -3.001 1.00 0.00 H new ATOM 0 HG2 GLN A 843 -17.002 -3.105 -0.143 1.00 0.00 H new ATOM 0 HG3 GLN A 843 -15.998 -1.708 -0.479 1.00 0.00 H new ATOM 0 HE21 GLN A 843 -18.993 -2.474 0.495 1.00 0.00 H new ATOM 0 HE22 GLN A 843 -19.938 -1.176 -0.242 1.00 0.00 H new ATOM 117 N THR A 844 -15.833 -6.418 -3.370 1.00 0.00 N ATOM 118 CA THR A 844 -15.078 -7.155 -4.364 1.00 0.00 C ATOM 119 C THR A 844 -13.603 -7.165 -3.991 1.00 0.00 C ATOM 120 O THR A 844 -13.059 -8.206 -3.626 1.00 0.00 O ATOM 121 CB THR A 844 -15.285 -6.517 -5.734 1.00 0.00 C ATOM 122 OG1 THR A 844 -15.727 -7.497 -6.647 1.00 0.00 O ATOM 123 CG2 THR A 844 -13.966 -5.925 -6.224 1.00 0.00 C ATOM 0 H THR A 844 -16.478 -6.988 -2.823 1.00 0.00 H new ATOM 0 HA THR A 844 -15.429 -8.186 -4.401 1.00 0.00 H new ATOM 0 HB THR A 844 -16.032 -5.727 -5.658 1.00 0.00 H new ATOM 0 HG1 THR A 844 -15.862 -7.087 -7.527 1.00 0.00 H new ATOM 0 HG21 THR A 844 -14.113 -5.469 -7.203 1.00 0.00 H new ATOM 0 HG22 THR A 844 -13.623 -5.168 -5.519 1.00 0.00 H new ATOM 0 HG23 THR A 844 -13.219 -6.715 -6.300 1.00 0.00 H new ATOM 131 N LYS A 845 -12.954 -6.002 -4.084 1.00 0.00 N ATOM 132 CA LYS A 845 -11.547 -5.885 -3.756 1.00 0.00 C ATOM 133 C LYS A 845 -11.211 -4.437 -3.430 1.00 0.00 C ATOM 134 O LYS A 845 -10.063 -4.116 -3.130 1.00 0.00 O ATOM 135 CB LYS A 845 -10.709 -6.382 -4.931 1.00 0.00 C ATOM 136 CG LYS A 845 -9.754 -7.470 -4.448 1.00 0.00 C ATOM 137 CD LYS A 845 -10.496 -8.801 -4.368 1.00 0.00 C ATOM 138 CE LYS A 845 -10.703 -9.181 -2.904 1.00 0.00 C ATOM 139 NZ LYS A 845 -10.836 -10.638 -2.751 1.00 0.00 N ATOM 0 H LYS A 845 -13.389 -5.130 -4.386 1.00 0.00 H new ATOM 0 HA LYS A 845 -11.322 -6.495 -2.881 1.00 0.00 H new ATOM 0 HB2 LYS A 845 -11.358 -6.774 -5.715 1.00 0.00 H new ATOM 0 HB3 LYS A 845 -10.147 -5.556 -5.366 1.00 0.00 H new ATOM 0 HG2 LYS A 845 -8.907 -7.554 -5.129 1.00 0.00 H new ATOM 0 HG3 LYS A 845 -9.351 -7.207 -3.470 1.00 0.00 H new ATOM 0 HD2 LYS A 845 -11.458 -8.724 -4.874 1.00 0.00 H new ATOM 0 HD3 LYS A 845 -9.928 -9.578 -4.880 1.00 0.00 H new ATOM 0 HE2 LYS A 845 -9.862 -8.825 -2.310 1.00 0.00 H new ATOM 0 HE3 LYS A 845 -11.596 -8.688 -2.520 1.00 0.00 H new ATOM 0 HZ1 LYS A 845 -10.976 -10.870 -1.747 1.00 0.00 H new ATOM 0 HZ2 LYS A 845 -11.653 -10.972 -3.301 1.00 0.00 H new ATOM 0 HZ3 LYS A 845 -9.973 -11.104 -3.097 1.00 0.00 H new ATOM 153 N VAL A 846 -12.217 -3.561 -3.489 1.00 0.00 N ATOM 154 CA VAL A 846 -12.025 -2.154 -3.200 1.00 0.00 C ATOM 155 C VAL A 846 -10.703 -1.684 -3.790 1.00 0.00 C ATOM 156 O VAL A 846 -9.648 -2.226 -3.466 1.00 0.00 O ATOM 157 CB VAL A 846 -12.051 -1.937 -1.690 1.00 0.00 C ATOM 158 CG1 VAL A 846 -13.485 -1.678 -1.238 1.00 0.00 C ATOM 159 CG2 VAL A 846 -11.513 -3.181 -0.988 1.00 0.00 C ATOM 0 H VAL A 846 -13.174 -3.812 -3.736 1.00 0.00 H new ATOM 0 HA VAL A 846 -12.829 -1.572 -3.650 1.00 0.00 H new ATOM 0 HB VAL A 846 -11.429 -1.079 -1.435 1.00 0.00 H new ATOM 0 HG11 VAL A 846 -13.504 -1.523 -0.159 1.00 0.00 H new ATOM 0 HG12 VAL A 846 -13.870 -0.790 -1.739 1.00 0.00 H new ATOM 0 HG13 VAL A 846 -14.107 -2.536 -1.492 1.00 0.00 H new ATOM 0 HG21 VAL A 846 -11.531 -3.027 0.091 1.00 0.00 H new ATOM 0 HG22 VAL A 846 -12.134 -4.040 -1.242 1.00 0.00 H new ATOM 0 HG23 VAL A 846 -10.488 -3.366 -1.311 1.00 0.00 H new ATOM 169 N LEU A 847 -10.761 -0.671 -4.658 1.00 0.00 N ATOM 170 CA LEU A 847 -9.571 -0.134 -5.287 1.00 0.00 C ATOM 171 C LEU A 847 -9.820 1.305 -5.718 1.00 0.00 C ATOM 172 O LEU A 847 -10.106 1.566 -6.884 1.00 0.00 O ATOM 173 CB LEU A 847 -9.195 -0.999 -6.486 1.00 0.00 C ATOM 174 CG LEU A 847 -9.339 -2.472 -6.115 1.00 0.00 C ATOM 175 CD1 LEU A 847 -8.372 -2.809 -4.984 1.00 0.00 C ATOM 176 CD2 LEU A 847 -10.770 -2.745 -5.660 1.00 0.00 C ATOM 0 H LEU A 847 -11.627 -0.210 -4.936 1.00 0.00 H new ATOM 0 HA LEU A 847 -8.745 -0.142 -4.576 1.00 0.00 H new ATOM 0 HB2 LEU A 847 -9.837 -0.762 -7.335 1.00 0.00 H new ATOM 0 HB3 LEU A 847 -8.170 -0.789 -6.793 1.00 0.00 H new ATOM 0 HG LEU A 847 -9.110 -3.089 -6.984 1.00 0.00 H new ATOM 0 HD11 LEU A 847 -8.475 -3.861 -4.719 1.00 0.00 H new ATOM 0 HD12 LEU A 847 -7.350 -2.615 -5.309 1.00 0.00 H new ATOM 0 HD13 LEU A 847 -8.600 -2.192 -4.115 1.00 0.00 H new ATOM 0 HD21 LEU A 847 -10.873 -3.797 -5.395 1.00 0.00 H new ATOM 0 HD22 LEU A 847 -11.000 -2.128 -4.791 1.00 0.00 H new ATOM 0 HD23 LEU A 847 -11.461 -2.505 -6.468 1.00 0.00 H new ATOM 188 N LEU A 848 -9.709 2.241 -4.772 1.00 0.00 N ATOM 189 CA LEU A 848 -9.921 3.646 -5.056 1.00 0.00 C ATOM 190 C LEU A 848 -8.608 4.292 -5.476 1.00 0.00 C ATOM 191 O LEU A 848 -7.602 3.606 -5.646 1.00 0.00 O ATOM 192 CB LEU A 848 -10.491 4.334 -3.820 1.00 0.00 C ATOM 193 CG LEU A 848 -12.013 4.374 -3.916 1.00 0.00 C ATOM 194 CD1 LEU A 848 -12.608 4.509 -2.518 1.00 0.00 C ATOM 195 CD2 LEU A 848 -12.438 5.566 -4.768 1.00 0.00 C ATOM 0 H LEU A 848 -9.472 2.041 -3.800 1.00 0.00 H new ATOM 0 HA LEU A 848 -10.633 3.752 -5.875 1.00 0.00 H new ATOM 0 HB2 LEU A 848 -10.187 3.799 -2.920 1.00 0.00 H new ATOM 0 HB3 LEU A 848 -10.094 5.346 -3.739 1.00 0.00 H new ATOM 0 HG LEU A 848 -12.372 3.453 -4.376 1.00 0.00 H new ATOM 0 HD11 LEU A 848 -13.695 4.538 -2.587 1.00 0.00 H new ATOM 0 HD12 LEU A 848 -12.305 3.657 -1.910 1.00 0.00 H new ATOM 0 HD13 LEU A 848 -12.249 5.429 -2.057 1.00 0.00 H new ATOM 0 HD21 LEU A 848 -13.525 5.595 -4.837 1.00 0.00 H new ATOM 0 HD22 LEU A 848 -12.079 6.487 -4.310 1.00 0.00 H new ATOM 0 HD23 LEU A 848 -12.014 5.469 -5.767 1.00 0.00 H new ATOM 207 N ASP A 849 -8.619 5.616 -5.643 1.00 0.00 N ATOM 208 CA ASP A 849 -7.433 6.346 -6.042 1.00 0.00 C ATOM 209 C ASP A 849 -6.672 6.807 -4.807 1.00 0.00 C ATOM 210 O ASP A 849 -6.368 7.989 -4.668 1.00 0.00 O ATOM 211 CB ASP A 849 -7.836 7.539 -6.904 1.00 0.00 C ATOM 212 CG ASP A 849 -8.557 8.591 -6.074 1.00 0.00 C ATOM 213 OD1 ASP A 849 -8.670 8.368 -4.849 1.00 0.00 O ATOM 214 OD2 ASP A 849 -8.981 9.599 -6.679 1.00 0.00 O ATOM 0 H ASP A 849 -9.444 6.199 -5.505 1.00 0.00 H new ATOM 0 HA ASP A 849 -6.781 5.696 -6.626 1.00 0.00 H new ATOM 0 HB2 ASP A 849 -6.950 7.977 -7.363 1.00 0.00 H new ATOM 0 HB3 ASP A 849 -8.483 7.204 -7.715 1.00 0.00 H new ATOM 219 N ILE A 850 -6.365 5.868 -3.908 1.00 0.00 N ATOM 220 CA ILE A 850 -5.642 6.179 -2.691 1.00 0.00 C ATOM 221 C ILE A 850 -4.156 6.314 -2.996 1.00 0.00 C ATOM 222 O ILE A 850 -3.677 7.409 -3.283 1.00 0.00 O ATOM 223 CB ILE A 850 -5.886 5.081 -1.660 1.00 0.00 C ATOM 224 CG1 ILE A 850 -6.693 3.954 -2.298 1.00 0.00 C ATOM 225 CG2 ILE A 850 -6.661 5.657 -0.478 1.00 0.00 C ATOM 226 CD1 ILE A 850 -8.148 4.391 -2.445 1.00 0.00 C ATOM 0 H ILE A 850 -6.611 4.883 -4.009 1.00 0.00 H new ATOM 0 HA ILE A 850 -5.997 7.126 -2.283 1.00 0.00 H new ATOM 0 HB ILE A 850 -4.930 4.690 -1.312 1.00 0.00 H new ATOM 0 HG12 ILE A 850 -6.277 3.702 -3.274 1.00 0.00 H new ATOM 0 HG13 ILE A 850 -6.632 3.056 -1.684 1.00 0.00 H new ATOM 0 HG21 ILE A 850 -6.836 4.873 0.259 1.00 0.00 H new ATOM 0 HG22 ILE A 850 -6.084 6.462 -0.022 1.00 0.00 H new ATOM 0 HG23 ILE A 850 -7.617 6.048 -0.826 1.00 0.00 H new ATOM 0 HD11 ILE A 850 -8.725 3.587 -2.901 1.00 0.00 H new ATOM 0 HD12 ILE A 850 -8.560 4.621 -1.462 1.00 0.00 H new ATOM 0 HD13 ILE A 850 -8.200 5.278 -3.077 1.00 0.00 H new ATOM 238 N PHE A 851 -3.427 5.197 -2.932 1.00 0.00 N ATOM 239 CA PHE A 851 -2.003 5.200 -3.202 1.00 0.00 C ATOM 240 C PHE A 851 -1.741 5.770 -4.588 1.00 0.00 C ATOM 241 O PHE A 851 -0.658 5.590 -5.141 1.00 0.00 O ATOM 242 CB PHE A 851 -1.464 3.776 -3.091 1.00 0.00 C ATOM 243 CG PHE A 851 -2.075 2.987 -1.958 1.00 0.00 C ATOM 244 CD1 PHE A 851 -2.078 3.512 -0.660 1.00 0.00 C ATOM 245 CD2 PHE A 851 -2.641 1.730 -2.206 1.00 0.00 C ATOM 246 CE1 PHE A 851 -2.646 2.780 0.390 1.00 0.00 C ATOM 247 CE2 PHE A 851 -3.209 0.999 -1.156 1.00 0.00 C ATOM 248 CZ PHE A 851 -3.212 1.524 0.142 1.00 0.00 C ATOM 0 H PHE A 851 -3.808 4.281 -2.694 1.00 0.00 H new ATOM 0 HA PHE A 851 -1.491 5.827 -2.472 1.00 0.00 H new ATOM 0 HB2 PHE A 851 -1.649 3.252 -4.029 1.00 0.00 H new ATOM 0 HB3 PHE A 851 -0.383 3.815 -2.955 1.00 0.00 H new ATOM 0 HD1 PHE A 851 -1.642 4.481 -0.469 1.00 0.00 H new ATOM 0 HD2 PHE A 851 -2.639 1.325 -3.207 1.00 0.00 H new ATOM 0 HE1 PHE A 851 -2.647 3.185 1.391 1.00 0.00 H new ATOM 0 HE2 PHE A 851 -3.645 0.030 -1.347 1.00 0.00 H new ATOM 0 HZ PHE A 851 -3.651 0.960 0.952 1.00 0.00 H new ATOM 258 N THR A 852 -2.735 6.460 -5.151 1.00 0.00 N ATOM 259 CA THR A 852 -2.602 7.052 -6.467 1.00 0.00 C ATOM 260 C THR A 852 -1.163 7.489 -6.696 1.00 0.00 C ATOM 261 O THR A 852 -0.716 8.484 -6.129 1.00 0.00 O ATOM 262 CB THR A 852 -3.554 8.239 -6.588 1.00 0.00 C ATOM 263 OG1 THR A 852 -4.109 8.265 -7.884 1.00 0.00 O ATOM 264 CG2 THR A 852 -2.787 9.534 -6.337 1.00 0.00 C ATOM 0 H THR A 852 -3.640 6.618 -4.708 1.00 0.00 H new ATOM 0 HA THR A 852 -2.861 6.316 -7.228 1.00 0.00 H new ATOM 0 HB THR A 852 -4.352 8.142 -5.852 1.00 0.00 H new ATOM 0 HG1 THR A 852 -4.722 9.026 -7.962 1.00 0.00 H new ATOM 0 HG21 THR A 852 -3.466 10.382 -6.423 1.00 0.00 H new ATOM 0 HG22 THR A 852 -2.357 9.514 -5.336 1.00 0.00 H new ATOM 0 HG23 THR A 852 -1.989 9.632 -7.073 1.00 0.00 H new ATOM 272 N GLY A 853 -0.436 6.743 -7.530 1.00 0.00 N ATOM 273 CA GLY A 853 0.947 7.060 -7.827 1.00 0.00 C ATOM 274 C GLY A 853 1.805 6.896 -6.580 1.00 0.00 C ATOM 275 O GLY A 853 2.812 7.582 -6.422 1.00 0.00 O ATOM 0 H GLY A 853 -0.790 5.915 -8.009 1.00 0.00 H new ATOM 0 HA2 GLY A 853 1.315 6.407 -8.619 1.00 0.00 H new ATOM 0 HA3 GLY A 853 1.022 8.083 -8.196 1.00 0.00 H new ATOM 279 N VAL A 854 1.403 5.982 -5.694 1.00 0.00 N ATOM 280 CA VAL A 854 2.133 5.732 -4.468 1.00 0.00 C ATOM 281 C VAL A 854 2.836 4.384 -4.553 1.00 0.00 C ATOM 282 O VAL A 854 2.203 3.342 -4.403 1.00 0.00 O ATOM 283 CB VAL A 854 1.169 5.765 -3.286 1.00 0.00 C ATOM 284 CG1 VAL A 854 1.803 5.060 -2.091 1.00 0.00 C ATOM 285 CG2 VAL A 854 0.865 7.215 -2.919 1.00 0.00 C ATOM 0 H VAL A 854 0.570 5.405 -5.812 1.00 0.00 H new ATOM 0 HA VAL A 854 2.888 6.506 -4.325 1.00 0.00 H new ATOM 0 HB VAL A 854 0.244 5.257 -3.558 1.00 0.00 H new ATOM 0 HG11 VAL A 854 1.114 5.084 -1.247 1.00 0.00 H new ATOM 0 HG12 VAL A 854 2.020 4.024 -2.353 1.00 0.00 H new ATOM 0 HG13 VAL A 854 2.728 5.567 -1.818 1.00 0.00 H new ATOM 0 HG21 VAL A 854 0.176 7.240 -2.075 1.00 0.00 H new ATOM 0 HG22 VAL A 854 1.790 7.723 -2.648 1.00 0.00 H new ATOM 0 HG23 VAL A 854 0.411 7.719 -3.772 1.00 0.00 H new ATOM 295 N ARG A 855 4.148 4.408 -4.794 1.00 0.00 N ATOM 296 CA ARG A 855 4.929 3.191 -4.899 1.00 0.00 C ATOM 297 C ARG A 855 5.499 2.826 -3.536 1.00 0.00 C ATOM 298 O ARG A 855 6.570 3.298 -3.162 1.00 0.00 O ATOM 299 CB ARG A 855 6.048 3.392 -5.916 1.00 0.00 C ATOM 300 CG ARG A 855 7.246 4.045 -5.233 1.00 0.00 C ATOM 301 CD ARG A 855 8.203 4.586 -6.291 1.00 0.00 C ATOM 302 NE ARG A 855 7.490 5.393 -7.281 1.00 0.00 N ATOM 303 CZ ARG A 855 8.111 6.025 -8.286 1.00 0.00 C ATOM 304 NH1 ARG A 855 9.442 5.931 -8.416 1.00 0.00 N ATOM 305 NH2 ARG A 855 7.402 6.751 -9.161 1.00 0.00 N ATOM 0 H ARG A 855 4.687 5.265 -4.919 1.00 0.00 H new ATOM 0 HA ARG A 855 4.292 2.373 -5.236 1.00 0.00 H new ATOM 0 HB2 ARG A 855 6.339 2.434 -6.346 1.00 0.00 H new ATOM 0 HB3 ARG A 855 5.699 4.017 -6.738 1.00 0.00 H new ATOM 0 HG2 ARG A 855 6.911 4.853 -4.583 1.00 0.00 H new ATOM 0 HG3 ARG A 855 7.758 3.319 -4.601 1.00 0.00 H new ATOM 0 HD2 ARG A 855 8.975 5.189 -5.813 1.00 0.00 H new ATOM 0 HD3 ARG A 855 8.708 3.757 -6.788 1.00 0.00 H new ATOM 0 HE ARG A 855 6.477 5.478 -7.203 1.00 0.00 H new ATOM 0 HH11 ARG A 855 9.982 5.378 -7.750 1.00 0.00 H new ATOM 0 HH12 ARG A 855 9.915 6.412 -9.181 1.00 0.00 H new ATOM 0 HH21 ARG A 855 6.389 6.823 -9.062 1.00 0.00 H new ATOM 0 HH22 ARG A 855 7.875 7.232 -9.926 1.00 0.00 H new ATOM 319 N LEU A 856 4.779 1.982 -2.792 1.00 0.00 N ATOM 320 CA LEU A 856 5.216 1.558 -1.477 1.00 0.00 C ATOM 321 C LEU A 856 5.646 0.098 -1.522 1.00 0.00 C ATOM 322 O LEU A 856 5.014 -0.718 -2.189 1.00 0.00 O ATOM 323 CB LEU A 856 4.081 1.756 -0.477 1.00 0.00 C ATOM 324 CG LEU A 856 3.361 0.429 -0.255 1.00 0.00 C ATOM 325 CD1 LEU A 856 4.372 -0.635 0.163 1.00 0.00 C ATOM 326 CD2 LEU A 856 2.313 0.595 0.842 1.00 0.00 C ATOM 0 H LEU A 856 3.888 1.582 -3.088 1.00 0.00 H new ATOM 0 HA LEU A 856 6.070 2.158 -1.162 1.00 0.00 H new ATOM 0 HB2 LEU A 856 4.476 2.130 0.468 1.00 0.00 H new ATOM 0 HB3 LEU A 856 3.381 2.504 -0.849 1.00 0.00 H new ATOM 0 HG LEU A 856 2.872 0.122 -1.180 1.00 0.00 H new ATOM 0 HD11 LEU A 856 3.858 -1.583 0.322 1.00 0.00 H new ATOM 0 HD12 LEU A 856 5.120 -0.754 -0.621 1.00 0.00 H new ATOM 0 HD13 LEU A 856 4.861 -0.329 1.087 1.00 0.00 H new ATOM 0 HD21 LEU A 856 1.799 -0.353 1.000 1.00 0.00 H new ATOM 0 HD22 LEU A 856 2.800 0.903 1.767 1.00 0.00 H new ATOM 0 HD23 LEU A 856 1.590 1.354 0.543 1.00 0.00 H new ATOM 338 N TYR A 857 6.726 -0.229 -0.808 1.00 0.00 N ATOM 339 CA TYR A 857 7.233 -1.586 -0.772 1.00 0.00 C ATOM 340 C TYR A 857 6.394 -2.427 0.179 1.00 0.00 C ATOM 341 O TYR A 857 6.561 -2.348 1.394 1.00 0.00 O ATOM 342 CB TYR A 857 8.695 -1.569 -0.332 1.00 0.00 C ATOM 343 CG TYR A 857 9.037 -2.652 0.663 1.00 0.00 C ATOM 344 CD1 TYR A 857 8.691 -3.982 0.397 1.00 0.00 C ATOM 345 CD2 TYR A 857 9.701 -2.325 1.852 1.00 0.00 C ATOM 346 CE1 TYR A 857 9.008 -4.986 1.320 1.00 0.00 C ATOM 347 CE2 TYR A 857 10.018 -3.329 2.775 1.00 0.00 C ATOM 348 CZ TYR A 857 9.672 -4.659 2.509 1.00 0.00 C ATOM 349 OH TYR A 857 9.980 -5.637 3.408 1.00 0.00 O ATOM 0 H TYR A 857 7.261 0.435 -0.249 1.00 0.00 H new ATOM 0 HA TYR A 857 7.170 -2.028 -1.766 1.00 0.00 H new ATOM 0 HB2 TYR A 857 9.332 -1.679 -1.210 1.00 0.00 H new ATOM 0 HB3 TYR A 857 8.923 -0.598 0.107 1.00 0.00 H new ATOM 0 HD1 TYR A 857 8.179 -4.234 -0.520 1.00 0.00 H new ATOM 0 HD2 TYR A 857 9.968 -1.299 2.057 1.00 0.00 H new ATOM 0 HE1 TYR A 857 8.741 -6.012 1.115 1.00 0.00 H new ATOM 0 HE2 TYR A 857 10.530 -3.077 3.692 1.00 0.00 H new ATOM 0 HH TYR A 857 10.440 -5.241 4.177 1.00 0.00 H new ATOM 359 N LEU A 858 5.487 -3.234 -0.377 1.00 0.00 N ATOM 360 CA LEU A 858 4.627 -4.084 0.422 1.00 0.00 C ATOM 361 C LEU A 858 5.392 -5.323 0.864 1.00 0.00 C ATOM 362 O LEU A 858 5.743 -6.166 0.040 1.00 0.00 O ATOM 363 CB LEU A 858 3.396 -4.471 -0.393 1.00 0.00 C ATOM 364 CG LEU A 858 2.399 -5.196 0.506 1.00 0.00 C ATOM 365 CD1 LEU A 858 2.763 -4.956 1.968 1.00 0.00 C ATOM 366 CD2 LEU A 858 0.993 -4.665 0.238 1.00 0.00 C ATOM 0 H LEU A 858 5.335 -3.310 -1.383 1.00 0.00 H new ATOM 0 HA LEU A 858 4.303 -3.545 1.312 1.00 0.00 H new ATOM 0 HB2 LEU A 858 2.935 -3.581 -0.821 1.00 0.00 H new ATOM 0 HB3 LEU A 858 3.685 -5.112 -1.226 1.00 0.00 H new ATOM 0 HG LEU A 858 2.431 -6.265 0.295 1.00 0.00 H new ATOM 0 HD11 LEU A 858 2.051 -5.474 2.610 1.00 0.00 H new ATOM 0 HD12 LEU A 858 3.767 -5.335 2.160 1.00 0.00 H new ATOM 0 HD13 LEU A 858 2.732 -3.887 2.180 1.00 0.00 H new ATOM 0 HD21 LEU A 858 0.280 -5.183 0.880 1.00 0.00 H new ATOM 0 HD22 LEU A 858 0.961 -3.596 0.449 1.00 0.00 H new ATOM 0 HD23 LEU A 858 0.732 -4.837 -0.806 1.00 0.00 H new ATOM 378 N PRO A 859 5.650 -5.433 2.169 1.00 0.00 N ATOM 379 CA PRO A 859 6.363 -6.540 2.770 1.00 0.00 C ATOM 380 C PRO A 859 5.477 -7.778 2.769 1.00 0.00 C ATOM 381 O PRO A 859 4.261 -7.673 2.913 1.00 0.00 O ATOM 382 CB PRO A 859 6.665 -6.084 4.195 1.00 0.00 C ATOM 383 CG PRO A 859 5.497 -5.149 4.506 1.00 0.00 C ATOM 384 CD PRO A 859 5.253 -4.461 3.165 1.00 0.00 C ATOM 0 HA PRO A 859 7.274 -6.800 2.232 1.00 0.00 H new ATOM 0 HB2 PRO A 859 6.706 -6.924 4.888 1.00 0.00 H new ATOM 0 HB3 PRO A 859 7.624 -5.569 4.260 1.00 0.00 H new ATOM 0 HG2 PRO A 859 4.618 -5.697 4.846 1.00 0.00 H new ATOM 0 HG3 PRO A 859 5.748 -4.433 5.289 1.00 0.00 H new ATOM 0 HD2 PRO A 859 4.206 -4.182 3.049 1.00 0.00 H new ATOM 0 HD3 PRO A 859 5.838 -3.545 3.079 1.00 0.00 H new ATOM 392 N PRO A 860 6.090 -8.952 2.604 1.00 0.00 N ATOM 393 CA PRO A 860 5.411 -10.230 2.577 1.00 0.00 C ATOM 394 C PRO A 860 4.944 -10.590 3.980 1.00 0.00 C ATOM 395 O PRO A 860 4.007 -11.368 4.144 1.00 0.00 O ATOM 396 CB PRO A 860 6.461 -11.221 2.078 1.00 0.00 C ATOM 397 CG PRO A 860 7.768 -10.611 2.582 1.00 0.00 C ATOM 398 CD PRO A 860 7.517 -9.112 2.432 1.00 0.00 C ATOM 0 HA PRO A 860 4.528 -10.228 1.939 1.00 0.00 H new ATOM 0 HB2 PRO A 860 6.299 -12.220 2.482 1.00 0.00 H new ATOM 0 HB3 PRO A 860 6.449 -11.311 0.992 1.00 0.00 H new ATOM 0 HG2 PRO A 860 7.971 -10.886 3.617 1.00 0.00 H new ATOM 0 HG3 PRO A 860 8.623 -10.940 1.991 1.00 0.00 H new ATOM 0 HD2 PRO A 860 8.071 -8.543 3.178 1.00 0.00 H new ATOM 0 HD3 PRO A 860 7.839 -8.754 1.454 1.00 0.00 H new ATOM 406 N SER A 861 5.601 -10.023 4.994 1.00 0.00 N ATOM 407 CA SER A 861 5.250 -10.287 6.374 1.00 0.00 C ATOM 408 C SER A 861 4.043 -9.449 6.771 1.00 0.00 C ATOM 409 O SER A 861 3.434 -9.686 7.811 1.00 0.00 O ATOM 410 CB SER A 861 6.445 -9.973 7.271 1.00 0.00 C ATOM 411 OG SER A 861 6.890 -11.158 7.891 1.00 0.00 O ATOM 0 H SER A 861 6.381 -9.377 4.875 1.00 0.00 H new ATOM 0 HA SER A 861 4.990 -11.339 6.491 1.00 0.00 H new ATOM 0 HB2 SER A 861 7.250 -9.533 6.682 1.00 0.00 H new ATOM 0 HB3 SER A 861 6.164 -9.238 8.026 1.00 0.00 H new ATOM 0 HG SER A 861 7.658 -10.958 8.466 1.00 0.00 H new ATOM 417 N THR A 862 3.697 -8.466 5.936 1.00 0.00 N ATOM 418 CA THR A 862 2.564 -7.603 6.206 1.00 0.00 C ATOM 419 C THR A 862 1.274 -8.407 6.149 1.00 0.00 C ATOM 420 O THR A 862 1.129 -9.297 5.314 1.00 0.00 O ATOM 421 CB THR A 862 2.538 -6.467 5.187 1.00 0.00 C ATOM 422 OG1 THR A 862 2.769 -5.241 5.844 1.00 0.00 O ATOM 423 CG2 THR A 862 1.175 -6.429 4.502 1.00 0.00 C ATOM 0 H THR A 862 4.191 -8.255 5.069 1.00 0.00 H new ATOM 0 HA THR A 862 2.658 -7.177 7.205 1.00 0.00 H new ATOM 0 HB THR A 862 3.315 -6.631 4.440 1.00 0.00 H new ATOM 0 HG1 THR A 862 1.914 -4.856 6.129 1.00 0.00 H new ATOM 0 HG21 THR A 862 1.156 -5.618 3.774 1.00 0.00 H new ATOM 0 HG22 THR A 862 0.997 -7.377 3.994 1.00 0.00 H new ATOM 0 HG23 THR A 862 0.397 -6.265 5.248 1.00 0.00 H new ATOM 431 N PRO A 863 0.334 -8.091 7.043 1.00 0.00 N ATOM 432 CA PRO A 863 -0.954 -8.745 7.138 1.00 0.00 C ATOM 433 C PRO A 863 -1.828 -8.325 5.965 1.00 0.00 C ATOM 434 O PRO A 863 -1.843 -7.155 5.587 1.00 0.00 O ATOM 435 CB PRO A 863 -1.543 -8.259 8.461 1.00 0.00 C ATOM 436 CG PRO A 863 -0.933 -6.866 8.611 1.00 0.00 C ATOM 437 CD PRO A 863 0.470 -7.051 8.039 1.00 0.00 C ATOM 0 HA PRO A 863 -0.881 -9.832 7.107 1.00 0.00 H new ATOM 0 HB2 PRO A 863 -2.632 -8.223 8.430 1.00 0.00 H new ATOM 0 HB3 PRO A 863 -1.269 -8.912 9.290 1.00 0.00 H new ATOM 0 HG2 PRO A 863 -1.499 -6.115 8.060 1.00 0.00 H new ATOM 0 HG3 PRO A 863 -0.907 -6.545 9.652 1.00 0.00 H new ATOM 0 HD2 PRO A 863 0.841 -6.127 7.596 1.00 0.00 H new ATOM 0 HD3 PRO A 863 1.178 -7.339 8.816 1.00 0.00 H new ATOM 445 N ASP A 864 -2.556 -9.283 5.387 1.00 0.00 N ATOM 446 CA ASP A 864 -3.425 -9.008 4.260 1.00 0.00 C ATOM 447 C ASP A 864 -2.587 -8.749 3.016 1.00 0.00 C ATOM 448 O ASP A 864 -3.083 -8.196 2.037 1.00 0.00 O ATOM 449 CB ASP A 864 -4.305 -7.804 4.580 1.00 0.00 C ATOM 450 CG ASP A 864 -5.776 -8.194 4.592 1.00 0.00 C ATOM 451 OD1 ASP A 864 -6.218 -8.776 3.578 1.00 0.00 O ATOM 452 OD2 ASP A 864 -6.432 -7.902 5.616 1.00 0.00 O ATOM 0 H ASP A 864 -2.555 -10.257 5.689 1.00 0.00 H new ATOM 0 HA ASP A 864 -4.066 -9.869 4.070 1.00 0.00 H new ATOM 0 HB2 ASP A 864 -4.026 -7.392 5.550 1.00 0.00 H new ATOM 0 HB3 ASP A 864 -4.139 -7.020 3.841 1.00 0.00 H new ATOM 457 N PHE A 865 -1.315 -9.151 3.056 1.00 0.00 N ATOM 458 CA PHE A 865 -0.419 -8.960 1.933 1.00 0.00 C ATOM 459 C PHE A 865 -1.115 -9.368 0.642 1.00 0.00 C ATOM 460 O PHE A 865 -1.071 -8.640 -0.347 1.00 0.00 O ATOM 461 CB PHE A 865 0.848 -9.783 2.148 1.00 0.00 C ATOM 462 CG PHE A 865 1.964 -9.432 1.193 1.00 0.00 C ATOM 463 CD1 PHE A 865 2.494 -8.136 1.181 1.00 0.00 C ATOM 464 CD2 PHE A 865 2.470 -10.404 0.322 1.00 0.00 C ATOM 465 CE1 PHE A 865 3.530 -7.812 0.298 1.00 0.00 C ATOM 466 CE2 PHE A 865 3.506 -10.079 -0.562 1.00 0.00 C ATOM 467 CZ PHE A 865 4.036 -8.784 -0.574 1.00 0.00 C ATOM 0 H PHE A 865 -0.889 -9.611 3.860 1.00 0.00 H new ATOM 0 HA PHE A 865 -0.144 -7.908 1.857 1.00 0.00 H new ATOM 0 HB2 PHE A 865 1.197 -9.638 3.171 1.00 0.00 H new ATOM 0 HB3 PHE A 865 0.607 -10.841 2.040 1.00 0.00 H new ATOM 0 HD1 PHE A 865 2.103 -7.386 1.853 1.00 0.00 H new ATOM 0 HD2 PHE A 865 2.062 -11.404 0.332 1.00 0.00 H new ATOM 0 HE1 PHE A 865 3.939 -6.813 0.289 1.00 0.00 H new ATOM 0 HE2 PHE A 865 3.896 -10.828 -1.235 1.00 0.00 H new ATOM 0 HZ PHE A 865 4.835 -8.534 -1.256 1.00 0.00 H new ATOM 477 N SER A 866 -1.760 -10.537 0.653 1.00 0.00 N ATOM 478 CA SER A 866 -2.461 -11.034 -0.513 1.00 0.00 C ATOM 479 C SER A 866 -2.922 -9.867 -1.375 1.00 0.00 C ATOM 480 O SER A 866 -2.204 -9.435 -2.275 1.00 0.00 O ATOM 481 CB SER A 866 -3.650 -11.880 -0.069 1.00 0.00 C ATOM 482 OG SER A 866 -4.392 -12.279 -1.200 1.00 0.00 O ATOM 0 H SER A 866 -1.806 -11.153 1.465 1.00 0.00 H new ATOM 0 HA SER A 866 -1.791 -11.656 -1.107 1.00 0.00 H new ATOM 0 HB2 SER A 866 -3.302 -12.756 0.479 1.00 0.00 H new ATOM 0 HB3 SER A 866 -4.282 -11.309 0.611 1.00 0.00 H new ATOM 0 HG SER A 866 -5.155 -12.824 -0.915 1.00 0.00 H new ATOM 488 N ARG A 867 -4.123 -9.355 -1.097 1.00 0.00 N ATOM 489 CA ARG A 867 -4.673 -8.243 -1.845 1.00 0.00 C ATOM 490 C ARG A 867 -3.762 -7.031 -1.712 1.00 0.00 C ATOM 491 O ARG A 867 -3.542 -6.308 -2.681 1.00 0.00 O ATOM 492 CB ARG A 867 -6.073 -7.926 -1.327 1.00 0.00 C ATOM 493 CG ARG A 867 -6.168 -8.305 0.148 1.00 0.00 C ATOM 494 CD ARG A 867 -6.673 -9.740 0.273 1.00 0.00 C ATOM 495 NE ARG A 867 -6.070 -10.410 1.425 1.00 0.00 N ATOM 496 CZ ARG A 867 -6.380 -11.665 1.778 1.00 0.00 C ATOM 497 NH1 ARG A 867 -7.274 -12.361 1.064 1.00 0.00 N ATOM 498 NH2 ARG A 867 -5.794 -12.225 2.846 1.00 0.00 N ATOM 0 H ARG A 867 -4.729 -9.701 -0.353 1.00 0.00 H new ATOM 0 HA ARG A 867 -4.741 -8.508 -2.900 1.00 0.00 H new ATOM 0 HB2 ARG A 867 -6.288 -6.865 -1.455 1.00 0.00 H new ATOM 0 HB3 ARG A 867 -6.818 -8.474 -1.903 1.00 0.00 H new ATOM 0 HG2 ARG A 867 -5.192 -8.209 0.623 1.00 0.00 H new ATOM 0 HG3 ARG A 867 -6.843 -7.624 0.667 1.00 0.00 H new ATOM 0 HD2 ARG A 867 -7.758 -9.740 0.375 1.00 0.00 H new ATOM 0 HD3 ARG A 867 -6.439 -10.292 -0.637 1.00 0.00 H new ATOM 0 HE ARG A 867 -5.385 -9.901 1.983 1.00 0.00 H new ATOM 0 HH11 ARG A 867 -7.719 -11.936 0.251 1.00 0.00 H new ATOM 0 HH12 ARG A 867 -7.509 -13.316 1.333 1.00 0.00 H new ATOM 0 HH21 ARG A 867 -5.112 -11.696 3.390 1.00 0.00 H new ATOM 0 HH22 ARG A 867 -6.030 -13.180 3.115 1.00 0.00 H new ATOM 512 N LEU A 868 -3.230 -6.811 -0.507 1.00 0.00 N ATOM 513 CA LEU A 868 -2.346 -5.691 -0.254 1.00 0.00 C ATOM 514 C LEU A 868 -1.521 -5.392 -1.498 1.00 0.00 C ATOM 515 O LEU A 868 -1.465 -4.250 -1.948 1.00 0.00 O ATOM 516 CB LEU A 868 -1.440 -6.016 0.930 1.00 0.00 C ATOM 517 CG LEU A 868 -2.016 -5.391 2.198 1.00 0.00 C ATOM 518 CD1 LEU A 868 -0.877 -5.006 3.138 1.00 0.00 C ATOM 519 CD2 LEU A 868 -2.817 -4.145 1.831 1.00 0.00 C ATOM 0 H LEU A 868 -3.403 -7.402 0.306 1.00 0.00 H new ATOM 0 HA LEU A 868 -2.935 -4.806 -0.012 1.00 0.00 H new ATOM 0 HB2 LEU A 868 -1.354 -7.096 1.051 1.00 0.00 H new ATOM 0 HB3 LEU A 868 -0.435 -5.635 0.748 1.00 0.00 H new ATOM 0 HG LEU A 868 -2.669 -6.110 2.694 1.00 0.00 H new ATOM 0 HD11 LEU A 868 -1.288 -4.560 4.044 1.00 0.00 H new ATOM 0 HD12 LEU A 868 -0.305 -5.896 3.400 1.00 0.00 H new ATOM 0 HD13 LEU A 868 -0.224 -4.287 2.643 1.00 0.00 H new ATOM 0 HD21 LEU A 868 -3.229 -3.698 2.736 1.00 0.00 H new ATOM 0 HD22 LEU A 868 -2.165 -3.426 1.335 1.00 0.00 H new ATOM 0 HD23 LEU A 868 -3.630 -4.420 1.160 1.00 0.00 H new ATOM 531 N ARG A 869 -0.880 -6.424 -2.052 1.00 0.00 N ATOM 532 CA ARG A 869 -0.063 -6.268 -3.238 1.00 0.00 C ATOM 533 C ARG A 869 -0.935 -5.855 -4.415 1.00 0.00 C ATOM 534 O ARG A 869 -1.104 -4.666 -4.678 1.00 0.00 O ATOM 535 CB ARG A 869 0.658 -7.580 -3.534 1.00 0.00 C ATOM 536 CG ARG A 869 1.703 -7.352 -4.623 1.00 0.00 C ATOM 537 CD ARG A 869 3.100 -7.515 -4.030 1.00 0.00 C ATOM 538 NE ARG A 869 3.780 -8.677 -4.601 1.00 0.00 N ATOM 539 CZ ARG A 869 3.585 -9.925 -4.153 1.00 0.00 C ATOM 540 NH1 ARG A 869 2.735 -10.148 -3.141 1.00 0.00 N ATOM 541 NH2 ARG A 869 4.239 -10.950 -4.716 1.00 0.00 N ATOM 0 H ARG A 869 -0.917 -7.377 -1.690 1.00 0.00 H new ATOM 0 HA ARG A 869 0.681 -5.489 -3.072 1.00 0.00 H new ATOM 0 HB2 ARG A 869 1.136 -7.957 -2.630 1.00 0.00 H new ATOM 0 HB3 ARG A 869 -0.058 -8.336 -3.855 1.00 0.00 H new ATOM 0 HG2 ARG A 869 1.557 -8.062 -5.437 1.00 0.00 H new ATOM 0 HG3 ARG A 869 1.590 -6.354 -5.047 1.00 0.00 H new ATOM 0 HD2 ARG A 869 3.687 -6.616 -4.220 1.00 0.00 H new ATOM 0 HD3 ARG A 869 3.029 -7.626 -2.948 1.00 0.00 H new ATOM 0 HE ARG A 869 4.430 -8.531 -5.373 1.00 0.00 H new ATOM 0 HH11 ARG A 869 2.237 -9.368 -2.712 1.00 0.00 H new ATOM 0 HH12 ARG A 869 2.586 -11.098 -2.800 1.00 0.00 H new ATOM 0 HH21 ARG A 869 4.886 -10.781 -5.486 1.00 0.00 H new ATOM 0 HH22 ARG A 869 4.090 -11.899 -4.374 1.00 0.00 H new ATOM 555 N ARG A 870 -1.490 -6.841 -5.124 1.00 0.00 N ATOM 556 CA ARG A 870 -2.339 -6.576 -6.268 1.00 0.00 C ATOM 557 C ARG A 870 -3.200 -5.350 -5.998 1.00 0.00 C ATOM 558 O ARG A 870 -3.193 -4.400 -6.778 1.00 0.00 O ATOM 559 CB ARG A 870 -3.211 -7.797 -6.546 1.00 0.00 C ATOM 560 CG ARG A 870 -4.005 -7.574 -7.829 1.00 0.00 C ATOM 561 CD ARG A 870 -3.251 -8.183 -9.008 1.00 0.00 C ATOM 562 NE ARG A 870 -3.735 -7.641 -10.278 1.00 0.00 N ATOM 563 CZ ARG A 870 -3.517 -6.374 -10.657 1.00 0.00 C ATOM 564 NH1 ARG A 870 -2.829 -5.546 -9.860 1.00 0.00 N ATOM 565 NH2 ARG A 870 -3.988 -5.936 -11.833 1.00 0.00 N ATOM 0 H ARG A 870 -1.360 -7.831 -4.918 1.00 0.00 H new ATOM 0 HA ARG A 870 -1.723 -6.377 -7.145 1.00 0.00 H new ATOM 0 HB2 ARG A 870 -2.589 -8.687 -6.641 1.00 0.00 H new ATOM 0 HB3 ARG A 870 -3.890 -7.970 -5.711 1.00 0.00 H new ATOM 0 HG2 ARG A 870 -4.992 -8.028 -7.742 1.00 0.00 H new ATOM 0 HG3 ARG A 870 -4.158 -6.507 -7.994 1.00 0.00 H new ATOM 0 HD2 ARG A 870 -2.185 -7.981 -8.905 1.00 0.00 H new ATOM 0 HD3 ARG A 870 -3.372 -9.266 -9.001 1.00 0.00 H new ATOM 0 HE ARG A 870 -4.261 -8.254 -10.902 1.00 0.00 H new ATOM 0 HH11 ARG A 870 -2.471 -5.880 -8.965 1.00 0.00 H new ATOM 0 HH12 ARG A 870 -2.663 -4.582 -10.148 1.00 0.00 H new ATOM 0 HH21 ARG A 870 -4.512 -6.567 -12.439 1.00 0.00 H new ATOM 0 HH22 ARG A 870 -3.822 -4.972 -12.122 1.00 0.00 H new ATOM 579 N TYR A 871 -3.943 -5.372 -4.889 1.00 0.00 N ATOM 580 CA TYR A 871 -4.804 -4.265 -4.526 1.00 0.00 C ATOM 581 C TYR A 871 -4.076 -2.948 -4.755 1.00 0.00 C ATOM 582 O TYR A 871 -4.482 -2.150 -5.597 1.00 0.00 O ATOM 583 CB TYR A 871 -5.220 -4.405 -3.064 1.00 0.00 C ATOM 584 CG TYR A 871 -6.299 -3.432 -2.649 1.00 0.00 C ATOM 585 CD1 TYR A 871 -7.468 -3.316 -3.410 1.00 0.00 C ATOM 586 CD2 TYR A 871 -6.129 -2.647 -1.503 1.00 0.00 C ATOM 587 CE1 TYR A 871 -8.467 -2.415 -3.025 1.00 0.00 C ATOM 588 CE2 TYR A 871 -7.129 -1.746 -1.117 1.00 0.00 C ATOM 589 CZ TYR A 871 -8.298 -1.630 -1.879 1.00 0.00 C ATOM 590 OH TYR A 871 -9.272 -0.752 -1.503 1.00 0.00 O ATOM 0 H TYR A 871 -3.959 -6.151 -4.231 1.00 0.00 H new ATOM 0 HA TYR A 871 -5.699 -4.275 -5.149 1.00 0.00 H new ATOM 0 HB2 TYR A 871 -5.572 -5.422 -2.890 1.00 0.00 H new ATOM 0 HB3 TYR A 871 -4.346 -4.258 -2.430 1.00 0.00 H new ATOM 0 HD1 TYR A 871 -7.599 -3.922 -4.294 1.00 0.00 H new ATOM 0 HD2 TYR A 871 -5.227 -2.736 -0.916 1.00 0.00 H new ATOM 0 HE1 TYR A 871 -9.369 -2.325 -3.613 1.00 0.00 H new ATOM 0 HE2 TYR A 871 -6.999 -1.141 -0.232 1.00 0.00 H new ATOM 600 N PHE A 872 -2.996 -2.721 -4.003 1.00 0.00 N ATOM 601 CA PHE A 872 -2.220 -1.504 -4.130 1.00 0.00 C ATOM 602 C PHE A 872 -1.924 -1.231 -5.598 1.00 0.00 C ATOM 603 O PHE A 872 -2.715 -0.587 -6.284 1.00 0.00 O ATOM 604 CB PHE A 872 -0.925 -1.643 -3.334 1.00 0.00 C ATOM 605 CG PHE A 872 -0.197 -0.335 -3.135 1.00 0.00 C ATOM 606 CD1 PHE A 872 0.422 0.294 -4.222 1.00 0.00 C ATOM 607 CD2 PHE A 872 -0.143 0.250 -1.864 1.00 0.00 C ATOM 608 CE1 PHE A 872 1.095 1.508 -4.038 1.00 0.00 C ATOM 609 CE2 PHE A 872 0.530 1.463 -1.680 1.00 0.00 C ATOM 610 CZ PHE A 872 1.149 2.092 -2.767 1.00 0.00 C ATOM 0 H PHE A 872 -2.645 -3.372 -3.300 1.00 0.00 H new ATOM 0 HA PHE A 872 -2.788 -0.663 -3.732 1.00 0.00 H new ATOM 0 HB2 PHE A 872 -1.151 -2.076 -2.359 1.00 0.00 H new ATOM 0 HB3 PHE A 872 -0.265 -2.342 -3.848 1.00 0.00 H new ATOM 0 HD1 PHE A 872 0.380 -0.157 -5.202 1.00 0.00 H new ATOM 0 HD2 PHE A 872 -0.621 -0.235 -1.026 1.00 0.00 H new ATOM 0 HE1 PHE A 872 1.572 1.994 -4.876 1.00 0.00 H new ATOM 0 HE2 PHE A 872 0.572 1.914 -0.700 1.00 0.00 H new ATOM 0 HZ PHE A 872 1.668 3.028 -2.625 1.00 0.00 H new ATOM 620 N VAL A 873 -0.780 -1.723 -6.080 1.00 0.00 N ATOM 621 CA VAL A 873 -0.386 -1.531 -7.461 1.00 0.00 C ATOM 622 C VAL A 873 -1.621 -1.503 -8.350 1.00 0.00 C ATOM 623 O VAL A 873 -1.649 -0.795 -9.354 1.00 0.00 O ATOM 624 CB VAL A 873 0.558 -2.654 -7.881 1.00 0.00 C ATOM 625 CG1 VAL A 873 0.443 -3.811 -6.893 1.00 0.00 C ATOM 626 CG2 VAL A 873 0.181 -3.138 -9.278 1.00 0.00 C ATOM 0 H VAL A 873 -0.113 -2.259 -5.524 1.00 0.00 H new ATOM 0 HA VAL A 873 0.134 -0.579 -7.566 1.00 0.00 H new ATOM 0 HB VAL A 873 1.583 -2.284 -7.889 1.00 0.00 H new ATOM 0 HG11 VAL A 873 1.117 -4.614 -7.192 1.00 0.00 H new ATOM 0 HG12 VAL A 873 0.711 -3.465 -5.895 1.00 0.00 H new ATOM 0 HG13 VAL A 873 -0.582 -4.182 -6.885 1.00 0.00 H new ATOM 0 HG21 VAL A 873 0.855 -3.940 -9.579 1.00 0.00 H new ATOM 0 HG22 VAL A 873 -0.844 -3.509 -9.270 1.00 0.00 H new ATOM 0 HG23 VAL A 873 0.263 -2.311 -9.984 1.00 0.00 H new ATOM 636 N ALA A 874 -2.644 -2.276 -7.977 1.00 0.00 N ATOM 637 CA ALA A 874 -3.874 -2.337 -8.741 1.00 0.00 C ATOM 638 C ALA A 874 -4.491 -0.948 -8.835 1.00 0.00 C ATOM 639 O ALA A 874 -4.785 -0.471 -9.929 1.00 0.00 O ATOM 640 CB ALA A 874 -4.838 -3.313 -8.074 1.00 0.00 C ATOM 0 H ALA A 874 -2.636 -2.867 -7.146 1.00 0.00 H new ATOM 0 HA ALA A 874 -3.663 -2.689 -9.751 1.00 0.00 H new ATOM 0 HB1 ALA A 874 -5.764 -3.360 -8.648 1.00 0.00 H new ATOM 0 HB2 ALA A 874 -4.384 -4.303 -8.036 1.00 0.00 H new ATOM 0 HB3 ALA A 874 -5.056 -2.974 -7.061 1.00 0.00 H new ATOM 646 N PHE A 875 -4.686 -0.300 -7.685 1.00 0.00 N ATOM 647 CA PHE A 875 -5.266 1.027 -7.646 1.00 0.00 C ATOM 648 C PHE A 875 -4.726 1.861 -8.800 1.00 0.00 C ATOM 649 O PHE A 875 -5.491 2.506 -9.513 1.00 0.00 O ATOM 650 CB PHE A 875 -4.942 1.684 -6.307 1.00 0.00 C ATOM 651 CG PHE A 875 -5.381 0.868 -5.115 1.00 0.00 C ATOM 652 CD1 PHE A 875 -6.009 -0.369 -5.305 1.00 0.00 C ATOM 653 CD2 PHE A 875 -5.162 1.349 -3.818 1.00 0.00 C ATOM 654 CE1 PHE A 875 -6.417 -1.125 -4.200 1.00 0.00 C ATOM 655 CE2 PHE A 875 -5.571 0.593 -2.713 1.00 0.00 C ATOM 656 CZ PHE A 875 -6.198 -0.644 -2.904 1.00 0.00 C ATOM 0 H PHE A 875 -4.447 -0.682 -6.770 1.00 0.00 H new ATOM 0 HA PHE A 875 -6.349 0.957 -7.750 1.00 0.00 H new ATOM 0 HB2 PHE A 875 -3.867 1.854 -6.245 1.00 0.00 H new ATOM 0 HB3 PHE A 875 -5.422 2.662 -6.265 1.00 0.00 H new ATOM 0 HD1 PHE A 875 -6.179 -0.740 -6.305 1.00 0.00 H new ATOM 0 HD2 PHE A 875 -4.678 2.303 -3.670 1.00 0.00 H new ATOM 0 HE1 PHE A 875 -6.901 -2.079 -4.347 1.00 0.00 H new ATOM 0 HE2 PHE A 875 -5.403 0.964 -1.713 1.00 0.00 H new ATOM 0 HZ PHE A 875 -6.513 -1.227 -2.051 1.00 0.00 H new ATOM 666 N ASP A 876 -3.404 1.845 -8.983 1.00 0.00 N ATOM 667 CA ASP A 876 -2.770 2.598 -10.047 1.00 0.00 C ATOM 668 C ASP A 876 -1.378 3.032 -9.611 1.00 0.00 C ATOM 669 O ASP A 876 -0.729 3.819 -10.296 1.00 0.00 O ATOM 670 CB ASP A 876 -3.631 3.809 -10.394 1.00 0.00 C ATOM 671 CG ASP A 876 -4.491 3.532 -11.618 1.00 0.00 C ATOM 672 OD1 ASP A 876 -4.214 2.514 -12.288 1.00 0.00 O ATOM 673 OD2 ASP A 876 -5.411 4.343 -11.862 1.00 0.00 O ATOM 0 H ASP A 876 -2.756 1.314 -8.401 1.00 0.00 H new ATOM 0 HA ASP A 876 -2.673 1.972 -10.934 1.00 0.00 H new ATOM 0 HB2 ASP A 876 -4.268 4.062 -9.547 1.00 0.00 H new ATOM 0 HB3 ASP A 876 -2.993 4.672 -10.581 1.00 0.00 H new ATOM 678 N GLY A 877 -0.919 2.517 -8.469 1.00 0.00 N ATOM 679 CA GLY A 877 0.392 2.857 -7.954 1.00 0.00 C ATOM 680 C GLY A 877 1.426 1.849 -8.435 1.00 0.00 C ATOM 681 O GLY A 877 1.366 1.390 -9.574 1.00 0.00 O ATOM 0 H GLY A 877 -1.443 1.862 -7.888 1.00 0.00 H new ATOM 0 HA2 GLY A 877 0.671 3.859 -8.282 1.00 0.00 H new ATOM 0 HA3 GLY A 877 0.369 2.873 -6.864 1.00 0.00 H new ATOM 685 N ASP A 878 2.378 1.505 -7.564 1.00 0.00 N ATOM 686 CA ASP A 878 3.419 0.556 -7.904 1.00 0.00 C ATOM 687 C ASP A 878 3.931 -0.121 -6.641 1.00 0.00 C ATOM 688 O ASP A 878 3.717 0.377 -5.538 1.00 0.00 O ATOM 689 CB ASP A 878 4.551 1.282 -8.626 1.00 0.00 C ATOM 690 CG ASP A 878 4.319 1.289 -10.130 1.00 0.00 C ATOM 691 OD1 ASP A 878 3.310 0.684 -10.552 1.00 0.00 O ATOM 692 OD2 ASP A 878 5.156 1.900 -10.830 1.00 0.00 O ATOM 0 H ASP A 878 2.442 1.876 -6.616 1.00 0.00 H new ATOM 0 HA ASP A 878 3.017 -0.211 -8.566 1.00 0.00 H new ATOM 0 HB2 ASP A 878 4.623 2.306 -8.260 1.00 0.00 H new ATOM 0 HB3 ASP A 878 5.501 0.796 -8.403 1.00 0.00 H new ATOM 697 N LEU A 879 4.608 -1.260 -6.804 1.00 0.00 N ATOM 698 CA LEU A 879 5.145 -1.998 -5.678 1.00 0.00 C ATOM 699 C LEU A 879 6.542 -2.504 -6.012 1.00 0.00 C ATOM 700 O LEU A 879 6.778 -3.002 -7.110 1.00 0.00 O ATOM 701 CB LEU A 879 4.215 -3.160 -5.342 1.00 0.00 C ATOM 702 CG LEU A 879 3.436 -2.836 -4.071 1.00 0.00 C ATOM 703 CD1 LEU A 879 2.884 -1.417 -4.160 1.00 0.00 C ATOM 704 CD2 LEU A 879 2.282 -3.823 -3.917 1.00 0.00 C ATOM 0 H LEU A 879 4.793 -1.686 -7.712 1.00 0.00 H new ATOM 0 HA LEU A 879 5.215 -1.343 -4.809 1.00 0.00 H new ATOM 0 HB2 LEU A 879 3.526 -3.339 -6.168 1.00 0.00 H new ATOM 0 HB3 LEU A 879 4.793 -4.074 -5.204 1.00 0.00 H new ATOM 0 HG LEU A 879 4.098 -2.914 -3.209 1.00 0.00 H new ATOM 0 HD11 LEU A 879 2.327 -1.186 -3.252 1.00 0.00 H new ATOM 0 HD12 LEU A 879 3.708 -0.712 -4.270 1.00 0.00 H new ATOM 0 HD13 LEU A 879 2.221 -1.338 -5.022 1.00 0.00 H new ATOM 0 HD21 LEU A 879 1.725 -3.592 -3.009 1.00 0.00 H new ATOM 0 HD22 LEU A 879 1.619 -3.745 -4.779 1.00 0.00 H new ATOM 0 HD23 LEU A 879 2.677 -4.837 -3.853 1.00 0.00 H new ATOM 716 N VAL A 880 7.468 -2.375 -5.059 1.00 0.00 N ATOM 717 CA VAL A 880 8.834 -2.818 -5.255 1.00 0.00 C ATOM 718 C VAL A 880 9.157 -3.937 -4.275 1.00 0.00 C ATOM 719 O VAL A 880 8.321 -4.307 -3.454 1.00 0.00 O ATOM 720 CB VAL A 880 9.783 -1.639 -5.063 1.00 0.00 C ATOM 721 CG1 VAL A 880 10.725 -1.543 -6.259 1.00 0.00 C ATOM 722 CG2 VAL A 880 8.975 -0.349 -4.948 1.00 0.00 C ATOM 0 H VAL A 880 7.287 -1.964 -4.143 1.00 0.00 H new ATOM 0 HA VAL A 880 8.955 -3.202 -6.268 1.00 0.00 H new ATOM 0 HB VAL A 880 10.365 -1.786 -4.153 1.00 0.00 H new ATOM 0 HG11 VAL A 880 11.403 -0.701 -6.122 1.00 0.00 H new ATOM 0 HG12 VAL A 880 11.303 -2.464 -6.342 1.00 0.00 H new ATOM 0 HG13 VAL A 880 10.144 -1.396 -7.169 1.00 0.00 H new ATOM 0 HG21 VAL A 880 9.653 0.494 -4.811 1.00 0.00 H new ATOM 0 HG22 VAL A 880 8.393 -0.202 -5.858 1.00 0.00 H new ATOM 0 HG23 VAL A 880 8.302 -0.416 -4.093 1.00 0.00 H new ATOM 732 N GLN A 881 10.376 -4.475 -4.362 1.00 0.00 N ATOM 733 CA GLN A 881 10.802 -5.547 -3.485 1.00 0.00 C ATOM 734 C GLN A 881 11.779 -5.009 -2.449 1.00 0.00 C ATOM 735 O GLN A 881 12.706 -4.278 -2.788 1.00 0.00 O ATOM 736 CB GLN A 881 11.447 -6.654 -4.313 1.00 0.00 C ATOM 737 CG GLN A 881 10.600 -6.921 -5.554 1.00 0.00 C ATOM 738 CD GLN A 881 11.269 -7.947 -6.458 1.00 0.00 C ATOM 739 OE1 GLN A 881 11.543 -7.666 -7.622 1.00 0.00 O ATOM 740 NE2 GLN A 881 11.532 -9.139 -5.918 1.00 0.00 N ATOM 0 H GLN A 881 11.081 -4.178 -5.036 1.00 0.00 H new ATOM 0 HA GLN A 881 9.939 -5.959 -2.962 1.00 0.00 H new ATOM 0 HB2 GLN A 881 12.456 -6.364 -4.604 1.00 0.00 H new ATOM 0 HB3 GLN A 881 11.536 -7.563 -3.718 1.00 0.00 H new ATOM 0 HG2 GLN A 881 9.615 -7.280 -5.256 1.00 0.00 H new ATOM 0 HG3 GLN A 881 10.448 -5.991 -6.102 1.00 0.00 H new ATOM 0 HE21 GLN A 881 11.285 -9.324 -4.946 1.00 0.00 H new ATOM 0 HE22 GLN A 881 11.980 -9.865 -6.478 1.00 0.00 H new ATOM 749 N GLU A 882 11.569 -5.374 -1.181 1.00 0.00 N ATOM 750 CA GLU A 882 12.433 -4.928 -0.107 1.00 0.00 C ATOM 751 C GLU A 882 13.823 -4.624 -0.650 1.00 0.00 C ATOM 752 O GLU A 882 14.245 -3.471 -0.671 1.00 0.00 O ATOM 753 CB GLU A 882 12.497 -6.004 0.973 1.00 0.00 C ATOM 754 CG GLU A 882 13.269 -5.471 2.176 1.00 0.00 C ATOM 755 CD GLU A 882 13.933 -6.607 2.942 1.00 0.00 C ATOM 756 OE1 GLU A 882 14.243 -7.627 2.288 1.00 0.00 O ATOM 757 OE2 GLU A 882 14.118 -6.435 4.166 1.00 0.00 O ATOM 0 H GLU A 882 10.804 -5.979 -0.882 1.00 0.00 H new ATOM 0 HA GLU A 882 12.031 -4.015 0.331 1.00 0.00 H new ATOM 0 HB2 GLU A 882 11.490 -6.294 1.273 1.00 0.00 H new ATOM 0 HB3 GLU A 882 12.983 -6.898 0.582 1.00 0.00 H new ATOM 0 HG2 GLU A 882 14.026 -4.761 1.842 1.00 0.00 H new ATOM 0 HG3 GLU A 882 12.592 -4.929 2.836 1.00 0.00 H new ATOM 764 N PHE A 883 14.533 -5.665 -1.090 1.00 0.00 N ATOM 765 CA PHE A 883 15.868 -5.504 -1.630 1.00 0.00 C ATOM 766 C PHE A 883 15.799 -4.796 -2.976 1.00 0.00 C ATOM 767 O PHE A 883 16.805 -4.681 -3.671 1.00 0.00 O ATOM 768 CB PHE A 883 16.527 -6.873 -1.772 1.00 0.00 C ATOM 769 CG PHE A 883 15.843 -7.770 -2.777 1.00 0.00 C ATOM 770 CD1 PHE A 883 14.801 -8.611 -2.369 1.00 0.00 C ATOM 771 CD2 PHE A 883 16.250 -7.757 -4.116 1.00 0.00 C ATOM 772 CE1 PHE A 883 14.166 -9.441 -3.301 1.00 0.00 C ATOM 773 CE2 PHE A 883 15.615 -8.587 -5.048 1.00 0.00 C ATOM 774 CZ PHE A 883 14.573 -9.428 -4.640 1.00 0.00 C ATOM 0 H PHE A 883 14.197 -6.628 -1.079 1.00 0.00 H new ATOM 0 HA PHE A 883 16.467 -4.895 -0.953 1.00 0.00 H new ATOM 0 HB2 PHE A 883 17.568 -6.738 -2.067 1.00 0.00 H new ATOM 0 HB3 PHE A 883 16.533 -7.367 -0.800 1.00 0.00 H new ATOM 0 HD1 PHE A 883 14.487 -8.620 -1.336 1.00 0.00 H new ATOM 0 HD2 PHE A 883 17.053 -7.107 -4.430 1.00 0.00 H new ATOM 0 HE1 PHE A 883 13.363 -10.091 -2.987 1.00 0.00 H new ATOM 0 HE2 PHE A 883 15.929 -8.578 -6.081 1.00 0.00 H new ATOM 0 HZ PHE A 883 14.083 -10.067 -5.359 1.00 0.00 H new ATOM 784 N ASP A 884 14.606 -4.320 -3.341 1.00 0.00 N ATOM 785 CA ASP A 884 14.412 -3.628 -4.599 1.00 0.00 C ATOM 786 C ASP A 884 13.539 -2.401 -4.382 1.00 0.00 C ATOM 787 O ASP A 884 12.324 -2.463 -4.556 1.00 0.00 O ATOM 788 CB ASP A 884 13.770 -4.577 -5.607 1.00 0.00 C ATOM 789 CG ASP A 884 14.682 -5.761 -5.896 1.00 0.00 C ATOM 790 OD1 ASP A 884 15.912 -5.573 -5.778 1.00 0.00 O ATOM 791 OD2 ASP A 884 14.132 -6.833 -6.229 1.00 0.00 O ATOM 0 H ASP A 884 13.762 -4.406 -2.774 1.00 0.00 H new ATOM 0 HA ASP A 884 15.375 -3.300 -4.991 1.00 0.00 H new ATOM 0 HB2 ASP A 884 12.816 -4.934 -5.220 1.00 0.00 H new ATOM 0 HB3 ASP A 884 13.558 -4.042 -6.533 1.00 0.00 H new ATOM 796 N MET A 885 14.161 -1.282 -4.002 1.00 0.00 N ATOM 797 CA MET A 885 13.436 -0.050 -3.762 1.00 0.00 C ATOM 798 C MET A 885 14.234 1.132 -4.292 1.00 0.00 C ATOM 799 O MET A 885 13.662 2.093 -4.800 1.00 0.00 O ATOM 800 CB MET A 885 13.174 0.102 -2.267 1.00 0.00 C ATOM 801 CG MET A 885 14.267 -0.620 -1.483 1.00 0.00 C ATOM 802 SD MET A 885 13.850 -0.919 0.253 1.00 0.00 S ATOM 803 CE MET A 885 12.446 -2.039 0.024 1.00 0.00 C ATOM 0 H MET A 885 15.168 -1.213 -3.856 1.00 0.00 H new ATOM 0 HA MET A 885 12.480 -0.080 -4.285 1.00 0.00 H new ATOM 0 HB2 MET A 885 13.154 1.158 -1.996 1.00 0.00 H new ATOM 0 HB3 MET A 885 12.197 -0.311 -2.014 1.00 0.00 H new ATOM 0 HG2 MET A 885 14.476 -1.575 -1.966 1.00 0.00 H new ATOM 0 HG3 MET A 885 15.183 -0.031 -1.530 1.00 0.00 H new ATOM 0 HE1 MET A 885 12.509 -2.854 0.745 1.00 0.00 H new ATOM 0 HE2 MET A 885 11.516 -1.492 0.175 1.00 0.00 H new ATOM 0 HE3 MET A 885 12.467 -2.447 -0.987 1.00 0.00 H new ATOM 813 N THR A 886 15.562 1.060 -4.172 1.00 0.00 N ATOM 814 CA THR A 886 16.428 2.123 -4.641 1.00 0.00 C ATOM 815 C THR A 886 15.630 3.108 -5.484 1.00 0.00 C ATOM 816 O THR A 886 15.692 4.314 -5.259 1.00 0.00 O ATOM 817 CB THR A 886 17.575 1.525 -5.450 1.00 0.00 C ATOM 818 OG1 THR A 886 17.106 1.154 -6.727 1.00 0.00 O ATOM 819 CG2 THR A 886 18.117 0.293 -4.730 1.00 0.00 C ATOM 0 H THR A 886 16.053 0.271 -3.752 1.00 0.00 H new ATOM 0 HA THR A 886 16.843 2.660 -3.788 1.00 0.00 H new ATOM 0 HB THR A 886 18.369 2.264 -5.555 1.00 0.00 H new ATOM 0 HG1 THR A 886 17.843 0.771 -7.248 1.00 0.00 H new ATOM 0 HG21 THR A 886 18.937 -0.135 -5.308 1.00 0.00 H new ATOM 0 HG22 THR A 886 18.479 0.579 -3.743 1.00 0.00 H new ATOM 0 HG23 THR A 886 17.323 -0.446 -4.625 1.00 0.00 H new ATOM 827 N SER A 887 14.879 2.589 -6.458 1.00 0.00 N ATOM 828 CA SER A 887 14.073 3.423 -7.327 1.00 0.00 C ATOM 829 C SER A 887 12.641 3.473 -6.813 1.00 0.00 C ATOM 830 O SER A 887 11.864 4.335 -7.217 1.00 0.00 O ATOM 831 CB SER A 887 14.119 2.868 -8.748 1.00 0.00 C ATOM 832 OG SER A 887 15.053 3.600 -9.508 1.00 0.00 O ATOM 0 H SER A 887 14.818 1.591 -6.658 1.00 0.00 H new ATOM 0 HA SER A 887 14.470 4.438 -7.334 1.00 0.00 H new ATOM 0 HB2 SER A 887 14.396 1.814 -8.729 1.00 0.00 H new ATOM 0 HB3 SER A 887 13.132 2.931 -9.206 1.00 0.00 H new ATOM 0 HG SER A 887 15.084 3.243 -10.420 1.00 0.00 H new ATOM 838 N ALA A 888 12.294 2.545 -5.919 1.00 0.00 N ATOM 839 CA ALA A 888 10.960 2.488 -5.355 1.00 0.00 C ATOM 840 C ALA A 888 10.508 3.886 -4.958 1.00 0.00 C ATOM 841 O ALA A 888 11.255 4.849 -5.114 1.00 0.00 O ATOM 842 CB ALA A 888 10.959 1.555 -4.147 1.00 0.00 C ATOM 0 H ALA A 888 12.927 1.823 -5.574 1.00 0.00 H new ATOM 0 HA ALA A 888 10.263 2.100 -6.098 1.00 0.00 H new ATOM 0 HB1 ALA A 888 9.956 1.511 -3.722 1.00 0.00 H new ATOM 0 HB2 ALA A 888 11.265 0.556 -4.458 1.00 0.00 H new ATOM 0 HB3 ALA A 888 11.655 1.930 -3.397 1.00 0.00 H new ATOM 848 N THR A 889 9.281 3.996 -4.443 1.00 0.00 N ATOM 849 CA THR A 889 8.741 5.275 -4.029 1.00 0.00 C ATOM 850 C THR A 889 8.251 5.189 -2.590 1.00 0.00 C ATOM 851 O THR A 889 8.467 6.107 -1.802 1.00 0.00 O ATOM 852 CB THR A 889 7.604 5.673 -4.964 1.00 0.00 C ATOM 853 OG1 THR A 889 7.637 7.066 -5.178 1.00 0.00 O ATOM 854 CG2 THR A 889 6.268 5.287 -4.335 1.00 0.00 C ATOM 0 H THR A 889 8.648 3.208 -4.306 1.00 0.00 H new ATOM 0 HA THR A 889 9.520 6.036 -4.081 1.00 0.00 H new ATOM 0 HB THR A 889 7.720 5.156 -5.916 1.00 0.00 H new ATOM 0 HG1 THR A 889 6.907 7.322 -5.780 1.00 0.00 H new ATOM 0 HG21 THR A 889 5.455 5.572 -5.003 1.00 0.00 H new ATOM 0 HG22 THR A 889 6.241 4.210 -4.169 1.00 0.00 H new ATOM 0 HG23 THR A 889 6.152 5.803 -3.382 1.00 0.00 H new ATOM 862 N HIS A 890 7.589 4.081 -2.248 1.00 0.00 N ATOM 863 CA HIS A 890 7.073 3.886 -0.908 1.00 0.00 C ATOM 864 C HIS A 890 7.530 2.538 -0.366 1.00 0.00 C ATOM 865 O HIS A 890 7.993 1.687 -1.122 1.00 0.00 O ATOM 866 CB HIS A 890 5.549 3.969 -0.935 1.00 0.00 C ATOM 867 CG HIS A 890 5.047 5.382 -1.053 1.00 0.00 C ATOM 868 ND1 HIS A 890 5.534 6.347 -1.904 1.00 0.00 N ATOM 869 CD2 HIS A 890 4.024 5.937 -0.333 1.00 0.00 C ATOM 870 CE1 HIS A 890 4.813 7.464 -1.696 1.00 0.00 C ATOM 871 NE2 HIS A 890 3.881 7.265 -0.749 1.00 0.00 N ATOM 0 HA HIS A 890 7.457 4.666 -0.251 1.00 0.00 H new ATOM 0 HB2 HIS A 890 5.172 3.383 -1.773 1.00 0.00 H new ATOM 0 HB3 HIS A 890 5.149 3.520 -0.026 1.00 0.00 H new ATOM 0 HD2 HIS A 890 3.433 5.439 0.421 1.00 0.00 H new ATOM 0 HE1 HIS A 890 4.963 8.396 -2.220 1.00 0.00 H new ATOM 0 HE2 HIS A 890 3.205 7.946 -0.403 1.00 0.00 H new ATOM 879 N VAL A 891 7.398 2.347 0.948 1.00 0.00 N ATOM 880 CA VAL A 891 7.796 1.107 1.585 1.00 0.00 C ATOM 881 C VAL A 891 6.930 0.856 2.810 1.00 0.00 C ATOM 882 O VAL A 891 6.857 1.696 3.705 1.00 0.00 O ATOM 883 CB VAL A 891 9.270 1.186 1.971 1.00 0.00 C ATOM 884 CG1 VAL A 891 10.133 1.057 0.719 1.00 0.00 C ATOM 885 CG2 VAL A 891 9.548 2.527 2.644 1.00 0.00 C ATOM 0 H VAL A 891 7.016 3.044 1.588 1.00 0.00 H new ATOM 0 HA VAL A 891 7.659 0.277 0.892 1.00 0.00 H new ATOM 0 HB VAL A 891 9.508 0.376 2.661 1.00 0.00 H new ATOM 0 HG11 VAL A 891 11.186 1.114 0.995 1.00 0.00 H new ATOM 0 HG12 VAL A 891 9.935 0.099 0.238 1.00 0.00 H new ATOM 0 HG13 VAL A 891 9.895 1.866 0.028 1.00 0.00 H new ATOM 0 HG21 VAL A 891 10.601 2.584 2.920 1.00 0.00 H new ATOM 0 HG22 VAL A 891 9.309 3.337 1.954 1.00 0.00 H new ATOM 0 HG23 VAL A 891 8.933 2.619 3.539 1.00 0.00 H new ATOM 895 N LEU A 892 6.271 -0.305 2.850 1.00 0.00 N ATOM 896 CA LEU A 892 5.414 -0.661 3.963 1.00 0.00 C ATOM 897 C LEU A 892 6.264 -1.066 5.160 1.00 0.00 C ATOM 898 O LEU A 892 7.236 -1.804 5.012 1.00 0.00 O ATOM 899 CB LEU A 892 4.488 -1.800 3.548 1.00 0.00 C ATOM 900 CG LEU A 892 3.048 -1.440 3.905 1.00 0.00 C ATOM 901 CD1 LEU A 892 2.165 -1.587 2.669 1.00 0.00 C ATOM 902 CD2 LEU A 892 2.548 -2.374 5.002 1.00 0.00 C ATOM 0 H LEU A 892 6.321 -1.012 2.116 1.00 0.00 H new ATOM 0 HA LEU A 892 4.806 0.198 4.248 1.00 0.00 H new ATOM 0 HB2 LEU A 892 4.574 -1.981 2.477 1.00 0.00 H new ATOM 0 HB3 LEU A 892 4.779 -2.722 4.051 1.00 0.00 H new ATOM 0 HG LEU A 892 3.008 -0.410 4.259 1.00 0.00 H new ATOM 0 HD11 LEU A 892 1.137 -1.330 2.924 1.00 0.00 H new ATOM 0 HD12 LEU A 892 2.522 -0.919 1.885 1.00 0.00 H new ATOM 0 HD13 LEU A 892 2.204 -2.617 2.314 1.00 0.00 H new ATOM 0 HD21 LEU A 892 1.520 -2.118 5.258 1.00 0.00 H new ATOM 0 HD22 LEU A 892 2.588 -3.404 4.649 1.00 0.00 H new ATOM 0 HD23 LEU A 892 3.178 -2.268 5.885 1.00 0.00 H new ATOM 914 N GLY A 893 5.895 -0.582 6.348 1.00 0.00 N ATOM 915 CA GLY A 893 6.626 -0.899 7.558 1.00 0.00 C ATOM 916 C GLY A 893 8.116 -0.997 7.264 1.00 0.00 C ATOM 917 O GLY A 893 8.578 -1.994 6.714 1.00 0.00 O ATOM 0 H GLY A 893 5.092 0.031 6.489 1.00 0.00 H new ATOM 0 HA2 GLY A 893 6.447 -0.132 8.311 1.00 0.00 H new ATOM 0 HA3 GLY A 893 6.267 -1.841 7.972 1.00 0.00 H new ATOM 921 N SER A 894 8.869 0.042 7.632 1.00 0.00 N ATOM 922 CA SER A 894 10.300 0.067 7.407 1.00 0.00 C ATOM 923 C SER A 894 10.606 0.805 6.111 1.00 0.00 C ATOM 924 O SER A 894 9.739 0.940 5.251 1.00 0.00 O ATOM 925 CB SER A 894 10.830 -1.363 7.353 1.00 0.00 C ATOM 926 OG SER A 894 10.453 -2.048 8.527 1.00 0.00 O ATOM 0 H SER A 894 8.501 0.877 8.089 1.00 0.00 H new ATOM 0 HA SER A 894 10.792 0.593 8.226 1.00 0.00 H new ATOM 0 HB2 SER A 894 10.434 -1.876 6.477 1.00 0.00 H new ATOM 0 HB3 SER A 894 11.916 -1.357 7.255 1.00 0.00 H new ATOM 0 HG SER A 894 9.716 -2.661 8.325 1.00 0.00 H new ATOM 932 N ARG A 895 11.846 1.281 5.973 1.00 0.00 N ATOM 933 CA ARG A 895 12.260 2.002 4.787 1.00 0.00 C ATOM 934 C ARG A 895 13.701 1.649 4.447 1.00 0.00 C ATOM 935 O ARG A 895 14.083 1.647 3.278 1.00 0.00 O ATOM 936 CB ARG A 895 12.113 3.502 5.026 1.00 0.00 C ATOM 937 CG ARG A 895 12.898 3.897 6.274 1.00 0.00 C ATOM 938 CD ARG A 895 14.163 4.644 5.864 1.00 0.00 C ATOM 939 NE ARG A 895 15.073 4.800 6.999 1.00 0.00 N ATOM 940 CZ ARG A 895 14.808 5.608 8.035 1.00 0.00 C ATOM 941 NH1 ARG A 895 13.670 6.315 8.061 1.00 0.00 N ATOM 942 NH2 ARG A 895 15.682 5.709 9.047 1.00 0.00 N ATOM 0 H ARG A 895 12.577 1.175 6.676 1.00 0.00 H new ATOM 0 HA ARG A 895 11.628 1.719 3.945 1.00 0.00 H new ATOM 0 HB2 ARG A 895 12.479 4.056 4.162 1.00 0.00 H new ATOM 0 HB3 ARG A 895 11.061 3.760 5.148 1.00 0.00 H new ATOM 0 HG2 ARG A 895 12.284 4.526 6.919 1.00 0.00 H new ATOM 0 HG3 ARG A 895 13.158 3.009 6.849 1.00 0.00 H new ATOM 0 HD2 ARG A 895 14.665 4.102 5.063 1.00 0.00 H new ATOM 0 HD3 ARG A 895 13.898 5.625 5.469 1.00 0.00 H new ATOM 0 HE ARG A 895 15.946 4.272 7.002 1.00 0.00 H new ATOM 0 HH11 ARG A 895 13.004 6.239 7.292 1.00 0.00 H new ATOM 0 HH12 ARG A 895 13.469 6.930 8.850 1.00 0.00 H new ATOM 0 HH21 ARG A 895 16.548 5.171 9.028 1.00 0.00 H new ATOM 0 HH22 ARG A 895 15.480 6.324 9.835 1.00 0.00 H new ATOM 956 N ASP A 896 14.502 1.350 5.472 1.00 0.00 N ATOM 957 CA ASP A 896 15.895 0.998 5.276 1.00 0.00 C ATOM 958 C ASP A 896 16.132 0.627 3.820 1.00 0.00 C ATOM 959 O ASP A 896 16.670 1.424 3.054 1.00 0.00 O ATOM 960 CB ASP A 896 16.259 -0.163 6.197 1.00 0.00 C ATOM 961 CG ASP A 896 17.500 -0.887 5.694 1.00 0.00 C ATOM 962 OD1 ASP A 896 18.344 -0.203 5.075 1.00 0.00 O ATOM 963 OD2 ASP A 896 17.582 -2.110 5.938 1.00 0.00 O ATOM 0 H ASP A 896 14.201 1.347 6.447 1.00 0.00 H new ATOM 0 HA ASP A 896 16.529 1.851 5.520 1.00 0.00 H new ATOM 0 HB2 ASP A 896 16.434 0.209 7.206 1.00 0.00 H new ATOM 0 HB3 ASP A 896 15.424 -0.861 6.256 1.00 0.00 H new ATOM 968 N LYS A 897 15.731 -0.588 3.437 1.00 0.00 N ATOM 969 CA LYS A 897 15.903 -1.055 2.077 1.00 0.00 C ATOM 970 C LYS A 897 15.872 0.125 1.116 1.00 0.00 C ATOM 971 O LYS A 897 16.571 0.124 0.105 1.00 0.00 O ATOM 972 CB LYS A 897 14.801 -2.055 1.740 1.00 0.00 C ATOM 973 CG LYS A 897 13.806 -2.123 2.895 1.00 0.00 C ATOM 974 CD LYS A 897 12.850 -0.937 2.814 1.00 0.00 C ATOM 975 CE LYS A 897 12.143 -0.761 4.155 1.00 0.00 C ATOM 976 NZ LYS A 897 10.753 -0.319 3.964 1.00 0.00 N ATOM 0 H LYS A 897 15.284 -1.261 4.059 1.00 0.00 H new ATOM 0 HA LYS A 897 16.869 -1.551 1.980 1.00 0.00 H new ATOM 0 HB2 LYS A 897 14.291 -1.756 0.824 1.00 0.00 H new ATOM 0 HB3 LYS A 897 15.232 -3.040 1.558 1.00 0.00 H new ATOM 0 HG2 LYS A 897 13.247 -3.058 2.853 1.00 0.00 H new ATOM 0 HG3 LYS A 897 14.337 -2.112 3.847 1.00 0.00 H new ATOM 0 HD2 LYS A 897 13.399 -0.031 2.558 1.00 0.00 H new ATOM 0 HD3 LYS A 897 12.118 -1.100 2.023 1.00 0.00 H new ATOM 0 HE2 LYS A 897 12.157 -1.703 4.704 1.00 0.00 H new ATOM 0 HE3 LYS A 897 12.680 -0.031 4.761 1.00 0.00 H new ATOM 0 HZ1 LYS A 897 10.179 -0.617 4.778 1.00 0.00 H new ATOM 0 HZ2 LYS A 897 10.726 0.717 3.883 1.00 0.00 H new ATOM 0 HZ3 LYS A 897 10.370 -0.744 3.096 1.00 0.00 H new ATOM 990 N ASN A 898 15.057 1.134 1.433 1.00 0.00 N ATOM 991 CA ASN A 898 14.941 2.312 0.598 1.00 0.00 C ATOM 992 C ASN A 898 14.405 3.478 1.417 1.00 0.00 C ATOM 993 O ASN A 898 13.197 3.603 1.608 1.00 0.00 O ATOM 994 CB ASN A 898 14.018 2.010 -0.579 1.00 0.00 C ATOM 995 CG ASN A 898 14.641 2.471 -1.889 1.00 0.00 C ATOM 996 OD1 ASN A 898 15.849 2.356 -2.079 1.00 0.00 O ATOM 997 ND2 ASN A 898 13.811 2.993 -2.796 1.00 0.00 N ATOM 0 H ASN A 898 14.470 1.150 2.267 1.00 0.00 H new ATOM 0 HA ASN A 898 15.923 2.587 0.214 1.00 0.00 H new ATOM 0 HB2 ASN A 898 13.817 0.940 -0.624 1.00 0.00 H new ATOM 0 HB3 ASN A 898 13.060 2.508 -0.432 1.00 0.00 H new ATOM 0 HD21 ASN A 898 14.174 3.317 -3.693 1.00 0.00 H new ATOM 0 HD22 ASN A 898 12.814 3.068 -2.592 1.00 0.00 H new ATOM 1004 N PRO A 899 15.308 4.333 1.901 1.00 0.00 N ATOM 1005 CA PRO A 899 14.984 5.498 2.697 1.00 0.00 C ATOM 1006 C PRO A 899 14.348 6.560 1.813 1.00 0.00 C ATOM 1007 O PRO A 899 13.770 7.522 2.313 1.00 0.00 O ATOM 1008 CB PRO A 899 16.324 5.977 3.252 1.00 0.00 C ATOM 1009 CG PRO A 899 17.312 5.550 2.167 1.00 0.00 C ATOM 1010 CD PRO A 899 16.736 4.217 1.696 1.00 0.00 C ATOM 0 HA PRO A 899 14.274 5.283 3.495 1.00 0.00 H new ATOM 0 HB2 PRO A 899 16.335 7.056 3.407 1.00 0.00 H new ATOM 0 HB3 PRO A 899 16.553 5.514 4.212 1.00 0.00 H new ATOM 0 HG2 PRO A 899 17.364 6.278 1.357 1.00 0.00 H new ATOM 0 HG3 PRO A 899 18.322 5.438 2.560 1.00 0.00 H new ATOM 0 HD2 PRO A 899 16.971 4.034 0.647 1.00 0.00 H new ATOM 0 HD3 PRO A 899 17.150 3.385 2.265 1.00 0.00 H new ATOM 1018 N ALA A 900 14.457 6.384 0.494 1.00 0.00 N ATOM 1019 CA ALA A 900 13.895 7.328 -0.452 1.00 0.00 C ATOM 1020 C ALA A 900 12.429 7.002 -0.697 1.00 0.00 C ATOM 1021 O ALA A 900 11.736 7.736 -1.397 1.00 0.00 O ATOM 1022 CB ALA A 900 14.687 7.272 -1.755 1.00 0.00 C ATOM 0 H ALA A 900 14.933 5.591 0.064 1.00 0.00 H new ATOM 0 HA ALA A 900 13.958 8.338 -0.046 1.00 0.00 H new ATOM 0 HB1 ALA A 900 14.266 7.981 -2.468 1.00 0.00 H new ATOM 0 HB2 ALA A 900 15.728 7.529 -1.559 1.00 0.00 H new ATOM 0 HB3 ALA A 900 14.634 6.266 -2.170 1.00 0.00 H new ATOM 1028 N ALA A 901 11.957 5.895 -0.117 1.00 0.00 N ATOM 1029 CA ALA A 901 10.579 5.477 -0.276 1.00 0.00 C ATOM 1030 C ALA A 901 9.768 5.905 0.939 1.00 0.00 C ATOM 1031 O ALA A 901 10.291 5.960 2.049 1.00 0.00 O ATOM 1032 CB ALA A 901 10.525 3.963 -0.457 1.00 0.00 C ATOM 0 H ALA A 901 12.519 5.276 0.467 1.00 0.00 H new ATOM 0 HA ALA A 901 10.150 5.950 -1.159 1.00 0.00 H new ATOM 0 HB1 ALA A 901 9.489 3.648 -0.577 1.00 0.00 H new ATOM 0 HB2 ALA A 901 11.094 3.682 -1.343 1.00 0.00 H new ATOM 0 HB3 ALA A 901 10.953 3.476 0.419 1.00 0.00 H new ATOM 1038 N GLN A 902 8.485 6.208 0.725 1.00 0.00 N ATOM 1039 CA GLN A 902 7.611 6.629 1.801 1.00 0.00 C ATOM 1040 C GLN A 902 7.375 5.470 2.760 1.00 0.00 C ATOM 1041 O GLN A 902 6.953 4.393 2.343 1.00 0.00 O ATOM 1042 CB GLN A 902 6.291 7.125 1.217 1.00 0.00 C ATOM 1043 CG GLN A 902 6.065 8.577 1.628 1.00 0.00 C ATOM 1044 CD GLN A 902 6.770 8.885 2.942 1.00 0.00 C ATOM 1045 OE1 GLN A 902 7.494 9.873 3.043 1.00 0.00 O ATOM 1046 NE2 GLN A 902 6.557 8.035 3.949 1.00 0.00 N ATOM 0 H GLN A 902 8.036 6.167 -0.190 1.00 0.00 H new ATOM 0 HA GLN A 902 8.078 7.443 2.356 1.00 0.00 H new ATOM 0 HB2 GLN A 902 6.308 7.042 0.130 1.00 0.00 H new ATOM 0 HB3 GLN A 902 5.468 6.504 1.571 1.00 0.00 H new ATOM 0 HG2 GLN A 902 6.435 9.242 0.848 1.00 0.00 H new ATOM 0 HG3 GLN A 902 4.997 8.768 1.730 1.00 0.00 H new ATOM 0 HE21 GLN A 902 5.947 7.229 3.815 1.00 0.00 H new ATOM 0 HE22 GLN A 902 7.004 8.192 4.852 1.00 0.00 H new ATOM 1055 N GLN A 903 7.648 5.693 4.047 1.00 0.00 N ATOM 1056 CA GLN A 903 7.465 4.668 5.055 1.00 0.00 C ATOM 1057 C GLN A 903 6.024 4.678 5.546 1.00 0.00 C ATOM 1058 O GLN A 903 5.700 5.363 6.513 1.00 0.00 O ATOM 1059 CB GLN A 903 8.431 4.916 6.211 1.00 0.00 C ATOM 1060 CG GLN A 903 9.047 3.591 6.652 1.00 0.00 C ATOM 1061 CD GLN A 903 9.981 3.795 7.836 1.00 0.00 C ATOM 1062 OE1 GLN A 903 9.612 4.435 8.818 1.00 0.00 O ATOM 1063 NE2 GLN A 903 11.195 3.248 7.741 1.00 0.00 N ATOM 0 H GLN A 903 7.998 6.580 4.408 1.00 0.00 H new ATOM 0 HA GLN A 903 7.675 3.688 4.626 1.00 0.00 H new ATOM 0 HB2 GLN A 903 9.214 5.609 5.902 1.00 0.00 H new ATOM 0 HB3 GLN A 903 7.905 5.380 7.045 1.00 0.00 H new ATOM 0 HG2 GLN A 903 8.257 2.890 6.923 1.00 0.00 H new ATOM 0 HG3 GLN A 903 9.597 3.147 5.822 1.00 0.00 H new ATOM 0 HE21 GLN A 903 11.455 2.725 6.905 1.00 0.00 H new ATOM 0 HE22 GLN A 903 11.863 3.353 8.505 1.00 0.00 H new ATOM 1072 N VAL A 904 5.159 3.913 4.876 1.00 0.00 N ATOM 1073 CA VAL A 904 3.760 3.836 5.246 1.00 0.00 C ATOM 1074 C VAL A 904 3.493 2.532 5.984 1.00 0.00 C ATOM 1075 O VAL A 904 4.396 1.714 6.149 1.00 0.00 O ATOM 1076 CB VAL A 904 2.897 3.934 3.991 1.00 0.00 C ATOM 1077 CG1 VAL A 904 3.774 4.301 2.798 1.00 0.00 C ATOM 1078 CG2 VAL A 904 2.223 2.589 3.732 1.00 0.00 C ATOM 0 H VAL A 904 5.413 3.339 4.072 1.00 0.00 H new ATOM 0 HA VAL A 904 3.509 4.664 5.909 1.00 0.00 H new ATOM 0 HB VAL A 904 2.136 4.701 4.132 1.00 0.00 H new ATOM 0 HG11 VAL A 904 3.158 4.371 1.901 1.00 0.00 H new ATOM 0 HG12 VAL A 904 4.256 5.261 2.983 1.00 0.00 H new ATOM 0 HG13 VAL A 904 4.535 3.534 2.656 1.00 0.00 H new ATOM 0 HG21 VAL A 904 1.606 2.658 2.836 1.00 0.00 H new ATOM 0 HG22 VAL A 904 2.984 1.822 3.591 1.00 0.00 H new ATOM 0 HG23 VAL A 904 1.597 2.326 4.584 1.00 0.00 H new ATOM 1088 N SER A 905 2.249 2.339 6.428 1.00 0.00 N ATOM 1089 CA SER A 905 1.872 1.137 7.143 1.00 0.00 C ATOM 1090 C SER A 905 0.606 0.549 6.536 1.00 0.00 C ATOM 1091 O SER A 905 0.151 1.001 5.487 1.00 0.00 O ATOM 1092 CB SER A 905 1.661 1.468 8.618 1.00 0.00 C ATOM 1093 OG SER A 905 2.389 0.559 9.413 1.00 0.00 O ATOM 0 H SER A 905 1.489 3.008 6.300 1.00 0.00 H new ATOM 0 HA SER A 905 2.668 0.397 7.060 1.00 0.00 H new ATOM 0 HB2 SER A 905 1.986 2.488 8.823 1.00 0.00 H new ATOM 0 HB3 SER A 905 0.601 1.416 8.865 1.00 0.00 H new ATOM 0 HG SER A 905 2.255 0.772 10.360 1.00 0.00 H new ATOM 1099 N PRO A 906 0.037 -0.460 7.199 1.00 0.00 N ATOM 1100 CA PRO A 906 -1.169 -1.138 6.774 1.00 0.00 C ATOM 1101 C PRO A 906 -2.369 -0.227 6.988 1.00 0.00 C ATOM 1102 O PRO A 906 -3.328 -0.269 6.221 1.00 0.00 O ATOM 1103 CB PRO A 906 -1.256 -2.376 7.664 1.00 0.00 C ATOM 1104 CG PRO A 906 -0.574 -1.916 8.952 1.00 0.00 C ATOM 1105 CD PRO A 906 0.545 -1.015 8.434 1.00 0.00 C ATOM 0 HA PRO A 906 -1.156 -1.405 5.717 1.00 0.00 H new ATOM 0 HB2 PRO A 906 -2.289 -2.677 7.839 1.00 0.00 H new ATOM 0 HB3 PRO A 906 -0.746 -3.231 7.219 1.00 0.00 H new ATOM 0 HG2 PRO A 906 -1.261 -1.375 9.603 1.00 0.00 H new ATOM 0 HG3 PRO A 906 -0.184 -2.756 9.527 1.00 0.00 H new ATOM 0 HD2 PRO A 906 0.783 -0.230 9.151 1.00 0.00 H new ATOM 0 HD3 PRO A 906 1.461 -1.581 8.265 1.00 0.00 H new ATOM 1113 N GLU A 907 -2.316 0.599 8.036 1.00 0.00 N ATOM 1114 CA GLU A 907 -3.398 1.512 8.343 1.00 0.00 C ATOM 1115 C GLU A 907 -3.448 2.625 7.306 1.00 0.00 C ATOM 1116 O GLU A 907 -4.502 3.211 7.070 1.00 0.00 O ATOM 1117 CB GLU A 907 -3.196 2.086 9.742 1.00 0.00 C ATOM 1118 CG GLU A 907 -4.555 2.339 10.390 1.00 0.00 C ATOM 1119 CD GLU A 907 -4.454 3.412 11.464 1.00 0.00 C ATOM 1120 OE1 GLU A 907 -4.101 3.041 12.605 1.00 0.00 O ATOM 1121 OE2 GLU A 907 -4.730 4.583 11.124 1.00 0.00 O ATOM 0 H GLU A 907 -1.529 0.647 8.683 1.00 0.00 H new ATOM 0 HA GLU A 907 -4.347 0.977 8.316 1.00 0.00 H new ATOM 0 HB2 GLU A 907 -2.615 1.393 10.350 1.00 0.00 H new ATOM 0 HB3 GLU A 907 -2.629 3.015 9.687 1.00 0.00 H new ATOM 0 HG2 GLU A 907 -5.273 2.646 9.630 1.00 0.00 H new ATOM 0 HG3 GLU A 907 -4.931 1.415 10.828 1.00 0.00 H new ATOM 1128 N TRP A 908 -2.303 2.916 6.684 1.00 0.00 N ATOM 1129 CA TRP A 908 -2.227 3.954 5.675 1.00 0.00 C ATOM 1130 C TRP A 908 -3.059 3.561 4.463 1.00 0.00 C ATOM 1131 O TRP A 908 -3.941 4.307 4.044 1.00 0.00 O ATOM 1132 CB TRP A 908 -0.769 4.174 5.282 1.00 0.00 C ATOM 1133 CG TRP A 908 -0.550 5.218 4.235 1.00 0.00 C ATOM 1134 CD1 TRP A 908 -0.548 6.552 4.451 1.00 0.00 C ATOM 1135 CD2 TRP A 908 -0.300 5.045 2.807 1.00 0.00 C ATOM 1136 NE1 TRP A 908 -0.316 7.211 3.262 1.00 0.00 N ATOM 1137 CE2 TRP A 908 -0.156 6.329 2.214 1.00 0.00 C ATOM 1138 CE3 TRP A 908 -0.180 3.935 1.952 1.00 0.00 C ATOM 1139 CZ2 TRP A 908 0.093 6.503 0.850 1.00 0.00 C ATOM 1140 CZ3 TRP A 908 0.069 4.099 0.581 1.00 0.00 C ATOM 1141 CH2 TRP A 908 0.206 5.377 0.028 1.00 0.00 C ATOM 0 H TRP A 908 -1.419 2.442 6.868 1.00 0.00 H new ATOM 0 HA TRP A 908 -2.627 4.885 6.077 1.00 0.00 H new ATOM 0 HB2 TRP A 908 -0.205 4.450 6.173 1.00 0.00 H new ATOM 0 HB3 TRP A 908 -0.358 3.230 4.925 1.00 0.00 H new ATOM 0 HD1 TRP A 908 -0.704 7.029 5.407 1.00 0.00 H new ATOM 0 HE1 TRP A 908 -0.269 8.226 3.169 1.00 0.00 H new ATOM 0 HE3 TRP A 908 -0.281 2.939 2.358 1.00 0.00 H new ATOM 0 HZ2 TRP A 908 0.197 7.495 0.436 1.00 0.00 H new ATOM 0 HZ3 TRP A 908 0.156 3.230 -0.054 1.00 0.00 H new ATOM 0 HH2 TRP A 908 0.398 5.493 -1.028 1.00 0.00 H new ATOM 1152 N ILE A 909 -2.775 2.384 3.900 1.00 0.00 N ATOM 1153 CA ILE A 909 -3.496 1.896 2.741 1.00 0.00 C ATOM 1154 C ILE A 909 -4.991 2.107 2.938 1.00 0.00 C ATOM 1155 O ILE A 909 -5.638 2.770 2.131 1.00 0.00 O ATOM 1156 CB ILE A 909 -3.181 0.417 2.533 1.00 0.00 C ATOM 1157 CG1 ILE A 909 -1.989 0.279 1.589 1.00 0.00 C ATOM 1158 CG2 ILE A 909 -4.394 -0.281 1.926 1.00 0.00 C ATOM 1159 CD1 ILE A 909 -0.876 -0.497 2.287 1.00 0.00 C ATOM 0 H ILE A 909 -2.046 1.755 4.236 1.00 0.00 H new ATOM 0 HA ILE A 909 -3.185 2.448 1.854 1.00 0.00 H new ATOM 0 HB ILE A 909 -2.940 -0.042 3.492 1.00 0.00 H new ATOM 0 HG12 ILE A 909 -2.291 -0.237 0.678 1.00 0.00 H new ATOM 0 HG13 ILE A 909 -1.630 1.265 1.293 1.00 0.00 H new ATOM 0 HG21 ILE A 909 -4.169 -1.337 1.777 1.00 0.00 H new ATOM 0 HG22 ILE A 909 -5.245 -0.182 2.599 1.00 0.00 H new ATOM 0 HG23 ILE A 909 -4.635 0.177 0.967 1.00 0.00 H new ATOM 0 HD11 ILE A 909 -0.024 -0.596 1.614 1.00 0.00 H new ATOM 0 HD12 ILE A 909 -0.568 0.038 3.186 1.00 0.00 H new ATOM 0 HD13 ILE A 909 -1.239 -1.487 2.561 1.00 0.00 H new ATOM 1171 N TRP A 910 -5.540 1.541 4.016 1.00 0.00 N ATOM 1172 CA TRP A 910 -6.953 1.674 4.309 1.00 0.00 C ATOM 1173 C TRP A 910 -7.333 3.146 4.372 1.00 0.00 C ATOM 1174 O TRP A 910 -8.166 3.609 3.596 1.00 0.00 O ATOM 1175 CB TRP A 910 -7.265 0.978 5.630 1.00 0.00 C ATOM 1176 CG TRP A 910 -6.627 -0.363 5.802 1.00 0.00 C ATOM 1177 CD1 TRP A 910 -5.859 -0.734 6.850 1.00 0.00 C ATOM 1178 CD2 TRP A 910 -6.683 -1.524 4.918 1.00 0.00 C ATOM 1179 NE1 TRP A 910 -5.439 -2.036 6.676 1.00 0.00 N ATOM 1180 CE2 TRP A 910 -5.919 -2.573 5.499 1.00 0.00 C ATOM 1181 CE3 TRP A 910 -7.301 -1.799 3.685 1.00 0.00 C ATOM 1182 CZ2 TRP A 910 -5.776 -3.823 4.892 1.00 0.00 C ATOM 1183 CZ3 TRP A 910 -7.163 -3.051 3.067 1.00 0.00 C ATOM 1184 CH2 TRP A 910 -6.403 -4.062 3.666 1.00 0.00 C ATOM 0 H TRP A 910 -5.019 0.987 4.696 1.00 0.00 H new ATOM 0 HA TRP A 910 -7.537 1.204 3.518 1.00 0.00 H new ATOM 0 HB2 TRP A 910 -6.946 1.624 6.448 1.00 0.00 H new ATOM 0 HB3 TRP A 910 -8.345 0.864 5.717 1.00 0.00 H new ATOM 0 HD1 TRP A 910 -5.612 -0.107 7.694 1.00 0.00 H new ATOM 0 HE1 TRP A 910 -4.847 -2.540 7.336 1.00 0.00 H new ATOM 0 HE3 TRP A 910 -7.892 -1.033 3.205 1.00 0.00 H new ATOM 0 HZ2 TRP A 910 -5.188 -4.596 5.365 1.00 0.00 H new ATOM 0 HZ3 TRP A 910 -7.648 -3.236 2.120 1.00 0.00 H new ATOM 0 HH2 TRP A 910 -6.301 -5.023 3.183 1.00 0.00 H new ATOM 1195 N ALA A 911 -6.718 3.883 5.300 1.00 0.00 N ATOM 1196 CA ALA A 911 -6.994 5.296 5.460 1.00 0.00 C ATOM 1197 C ALA A 911 -6.872 6.001 4.117 1.00 0.00 C ATOM 1198 O ALA A 911 -7.588 6.965 3.853 1.00 0.00 O ATOM 1199 CB ALA A 911 -6.020 5.892 6.473 1.00 0.00 C ATOM 0 H ALA A 911 -6.024 3.514 5.950 1.00 0.00 H new ATOM 0 HA ALA A 911 -8.011 5.432 5.829 1.00 0.00 H new ATOM 0 HB1 ALA A 911 -6.227 6.955 6.594 1.00 0.00 H new ATOM 0 HB2 ALA A 911 -6.139 5.388 7.432 1.00 0.00 H new ATOM 0 HB3 ALA A 911 -4.998 5.759 6.117 1.00 0.00 H new ATOM 1205 N CYS A 912 -5.963 5.517 3.268 1.00 0.00 N ATOM 1206 CA CYS A 912 -5.749 6.097 1.957 1.00 0.00 C ATOM 1207 C CYS A 912 -6.915 5.740 1.046 1.00 0.00 C ATOM 1208 O CYS A 912 -7.811 6.554 0.836 1.00 0.00 O ATOM 1209 CB CYS A 912 -4.433 5.582 1.382 1.00 0.00 C ATOM 1210 SG CYS A 912 -3.099 5.971 2.543 1.00 0.00 S ATOM 0 H CYS A 912 -5.363 4.718 3.475 1.00 0.00 H new ATOM 0 HA CYS A 912 -5.692 7.183 2.036 1.00 0.00 H new ATOM 0 HB2 CYS A 912 -4.488 4.506 1.217 1.00 0.00 H new ATOM 0 HB3 CYS A 912 -4.238 6.043 0.414 1.00 0.00 H new ATOM 0 HG CYS A 912 -1.968 6.019 1.904 1.00 0.00 H new ATOM 1216 N ILE A 913 -6.900 4.520 0.503 1.00 0.00 N ATOM 1217 CA ILE A 913 -7.954 4.062 -0.380 1.00 0.00 C ATOM 1218 C ILE A 913 -9.302 4.552 0.129 1.00 0.00 C ATOM 1219 O ILE A 913 -10.130 5.018 -0.651 1.00 0.00 O ATOM 1220 CB ILE A 913 -7.925 2.538 -0.458 1.00 0.00 C ATOM 1221 CG1 ILE A 913 -9.178 2.041 -1.172 1.00 0.00 C ATOM 1222 CG2 ILE A 913 -7.878 1.958 0.953 1.00 0.00 C ATOM 1223 CD1 ILE A 913 -9.076 0.533 -1.388 1.00 0.00 C ATOM 0 H ILE A 913 -6.162 3.835 0.666 1.00 0.00 H new ATOM 0 HA ILE A 913 -7.798 4.466 -1.380 1.00 0.00 H new ATOM 0 HB ILE A 913 -7.042 2.219 -1.012 1.00 0.00 H new ATOM 0 HG12 ILE A 913 -10.063 2.275 -0.581 1.00 0.00 H new ATOM 0 HG13 ILE A 913 -9.290 2.550 -2.130 1.00 0.00 H new ATOM 0 HG21 ILE A 913 -7.857 0.870 0.898 1.00 0.00 H new ATOM 0 HG22 ILE A 913 -6.982 2.313 1.463 1.00 0.00 H new ATOM 0 HG23 ILE A 913 -8.761 2.277 1.507 1.00 0.00 H new ATOM 0 HD11 ILE A 913 -9.971 0.177 -1.898 1.00 0.00 H new ATOM 0 HD12 ILE A 913 -8.199 0.311 -1.996 1.00 0.00 H new ATOM 0 HD13 ILE A 913 -8.985 0.033 -0.424 1.00 0.00 H new ATOM 1235 N ARG A 914 -9.521 4.445 1.441 1.00 0.00 N ATOM 1236 CA ARG A 914 -10.766 4.875 2.046 1.00 0.00 C ATOM 1237 C ARG A 914 -10.912 6.384 1.907 1.00 0.00 C ATOM 1238 O ARG A 914 -12.026 6.899 1.857 1.00 0.00 O ATOM 1239 CB ARG A 914 -10.785 4.463 3.515 1.00 0.00 C ATOM 1240 CG ARG A 914 -12.209 4.567 4.054 1.00 0.00 C ATOM 1241 CD ARG A 914 -13.189 4.051 3.004 1.00 0.00 C ATOM 1242 NE ARG A 914 -13.682 5.143 2.165 1.00 0.00 N ATOM 1243 CZ ARG A 914 -14.672 5.962 2.547 1.00 0.00 C ATOM 1244 NH1 ARG A 914 -15.253 5.798 3.743 1.00 0.00 N ATOM 1245 NH2 ARG A 914 -15.082 6.944 1.732 1.00 0.00 N ATOM 0 H ARG A 914 -8.844 4.061 2.101 1.00 0.00 H new ATOM 0 HA ARG A 914 -11.605 4.400 1.538 1.00 0.00 H new ATOM 0 HB2 ARG A 914 -10.418 3.442 3.622 1.00 0.00 H new ATOM 0 HB3 ARG A 914 -10.119 5.104 4.092 1.00 0.00 H new ATOM 0 HG2 ARG A 914 -12.305 3.988 4.972 1.00 0.00 H new ATOM 0 HG3 ARG A 914 -12.440 5.602 4.305 1.00 0.00 H new ATOM 0 HD2 ARG A 914 -12.699 3.302 2.382 1.00 0.00 H new ATOM 0 HD3 ARG A 914 -14.028 3.558 3.495 1.00 0.00 H new ATOM 0 HE ARG A 914 -13.254 5.287 1.250 1.00 0.00 H new ATOM 0 HH11 ARG A 914 -14.942 5.050 4.363 1.00 0.00 H new ATOM 0 HH12 ARG A 914 -16.006 6.421 4.034 1.00 0.00 H new ATOM 0 HH21 ARG A 914 -14.641 7.068 0.821 1.00 0.00 H new ATOM 0 HH22 ARG A 914 -15.835 7.567 2.023 1.00 0.00 H new ATOM 1259 N LYS A 915 -9.782 7.092 1.845 1.00 0.00 N ATOM 1260 CA LYS A 915 -9.792 8.535 1.713 1.00 0.00 C ATOM 1261 C LYS A 915 -9.721 8.920 0.242 1.00 0.00 C ATOM 1262 O LYS A 915 -9.960 10.073 -0.112 1.00 0.00 O ATOM 1263 CB LYS A 915 -8.613 9.124 2.482 1.00 0.00 C ATOM 1264 CG LYS A 915 -8.887 9.031 3.981 1.00 0.00 C ATOM 1265 CD LYS A 915 -9.895 10.104 4.382 1.00 0.00 C ATOM 1266 CE LYS A 915 -10.437 9.798 5.775 1.00 0.00 C ATOM 1267 NZ LYS A 915 -9.551 10.340 6.816 1.00 0.00 N ATOM 0 H LYS A 915 -8.850 6.680 1.885 1.00 0.00 H new ATOM 0 HA LYS A 915 -10.717 8.935 2.129 1.00 0.00 H new ATOM 0 HB2 LYS A 915 -7.698 8.586 2.234 1.00 0.00 H new ATOM 0 HB3 LYS A 915 -8.459 10.164 2.193 1.00 0.00 H new ATOM 0 HG2 LYS A 915 -9.273 8.043 4.230 1.00 0.00 H new ATOM 0 HG3 LYS A 915 -7.960 9.161 4.540 1.00 0.00 H new ATOM 0 HD2 LYS A 915 -9.421 11.085 4.372 1.00 0.00 H new ATOM 0 HD3 LYS A 915 -10.712 10.138 3.662 1.00 0.00 H new ATOM 0 HE2 LYS A 915 -11.434 10.225 5.883 1.00 0.00 H new ATOM 0 HE3 LYS A 915 -10.536 8.720 5.902 1.00 0.00 H new ATOM 0 HZ1 LYS A 915 -9.942 10.119 7.754 1.00 0.00 H new ATOM 0 HZ2 LYS A 915 -8.607 9.914 6.725 1.00 0.00 H new ATOM 0 HZ3 LYS A 915 -9.477 11.372 6.706 1.00 0.00 H new ATOM 1281 N ARG A 916 -9.393 7.951 -0.615 1.00 0.00 N ATOM 1282 CA ARG A 916 -9.292 8.192 -2.040 1.00 0.00 C ATOM 1283 C ARG A 916 -8.093 9.085 -2.328 1.00 0.00 C ATOM 1284 O ARG A 916 -7.730 9.286 -3.485 1.00 0.00 O ATOM 1285 CB ARG A 916 -10.580 8.840 -2.538 1.00 0.00 C ATOM 1286 CG ARG A 916 -11.134 8.036 -3.711 1.00 0.00 C ATOM 1287 CD ARG A 916 -10.595 8.607 -5.019 1.00 0.00 C ATOM 1288 NE ARG A 916 -11.547 9.546 -5.614 1.00 0.00 N ATOM 1289 CZ ARG A 916 -11.633 9.753 -6.935 1.00 0.00 C ATOM 1290 NH1 ARG A 916 -10.827 9.086 -7.772 1.00 0.00 N ATOM 1291 NH2 ARG A 916 -12.525 10.628 -7.419 1.00 0.00 N ATOM 0 H ARG A 916 -9.194 6.990 -0.337 1.00 0.00 H new ATOM 0 HA ARG A 916 -9.150 7.247 -2.564 1.00 0.00 H new ATOM 0 HB2 ARG A 916 -11.314 8.881 -1.733 1.00 0.00 H new ATOM 0 HB3 ARG A 916 -10.387 9.867 -2.846 1.00 0.00 H new ATOM 0 HG2 ARG A 916 -10.849 6.988 -3.614 1.00 0.00 H new ATOM 0 HG3 ARG A 916 -12.223 8.072 -3.708 1.00 0.00 H new ATOM 0 HD2 ARG A 916 -9.647 9.112 -4.836 1.00 0.00 H new ATOM 0 HD3 ARG A 916 -10.394 7.796 -5.718 1.00 0.00 H new ATOM 0 HE ARG A 916 -12.172 10.065 -4.997 1.00 0.00 H new ATOM 0 HH11 ARG A 916 -10.148 8.420 -7.404 1.00 0.00 H new ATOM 0 HH12 ARG A 916 -10.893 9.244 -8.778 1.00 0.00 H new ATOM 0 HH21 ARG A 916 -13.138 11.136 -6.782 1.00 0.00 H new ATOM 0 HH22 ARG A 916 -12.591 10.786 -8.425 1.00 0.00 H new ATOM 1305 N ARG A 917 -7.478 9.620 -1.271 1.00 0.00 N ATOM 1306 CA ARG A 917 -6.326 10.488 -1.415 1.00 0.00 C ATOM 1307 C ARG A 917 -5.246 10.079 -0.424 1.00 0.00 C ATOM 1308 O ARG A 917 -5.448 10.162 0.786 1.00 0.00 O ATOM 1309 CB ARG A 917 -6.750 11.936 -1.187 1.00 0.00 C ATOM 1310 CG ARG A 917 -8.098 11.965 -0.472 1.00 0.00 C ATOM 1311 CD ARG A 917 -9.221 11.952 -1.505 1.00 0.00 C ATOM 1312 NE ARG A 917 -10.515 12.220 -0.877 1.00 0.00 N ATOM 1313 CZ ARG A 917 -10.904 13.449 -0.512 1.00 0.00 C ATOM 1314 NH1 ARG A 917 -10.096 14.497 -0.719 1.00 0.00 N ATOM 1315 NH2 ARG A 917 -12.102 13.630 0.061 1.00 0.00 N ATOM 0 H ARG A 917 -7.766 9.461 -0.306 1.00 0.00 H new ATOM 0 HA ARG A 917 -5.920 10.397 -2.422 1.00 0.00 H new ATOM 0 HB2 ARG A 917 -6.000 12.456 -0.592 1.00 0.00 H new ATOM 0 HB3 ARG A 917 -6.821 12.460 -2.140 1.00 0.00 H new ATOM 0 HG2 ARG A 917 -8.189 11.104 0.191 1.00 0.00 H new ATOM 0 HG3 ARG A 917 -8.172 12.856 0.151 1.00 0.00 H new ATOM 0 HD2 ARG A 917 -9.023 12.701 -2.272 1.00 0.00 H new ATOM 0 HD3 ARG A 917 -9.249 10.984 -2.005 1.00 0.00 H new ATOM 0 HE ARG A 917 -11.148 11.438 -0.710 1.00 0.00 H new ATOM 0 HH11 ARG A 917 -9.184 14.360 -1.155 1.00 0.00 H new ATOM 0 HH12 ARG A 917 -10.393 15.432 -0.441 1.00 0.00 H new ATOM 0 HH21 ARG A 917 -12.717 12.832 0.219 1.00 0.00 H new ATOM 0 HH22 ARG A 917 -12.398 14.566 0.339 1.00 0.00 H new ATOM 1329 N LEU A 918 -4.096 9.638 -0.939 1.00 0.00 N ATOM 1330 CA LEU A 918 -2.992 9.220 -0.099 1.00 0.00 C ATOM 1331 C LEU A 918 -2.943 10.080 1.156 1.00 0.00 C ATOM 1332 O LEU A 918 -2.856 11.303 1.070 1.00 0.00 O ATOM 1333 CB LEU A 918 -1.687 9.332 -0.882 1.00 0.00 C ATOM 1334 CG LEU A 918 -1.457 8.048 -1.674 1.00 0.00 C ATOM 1335 CD1 LEU A 918 -2.566 7.049 -1.356 1.00 0.00 C ATOM 1336 CD2 LEU A 918 -1.468 8.362 -3.167 1.00 0.00 C ATOM 0 H LEU A 918 -3.913 9.564 -1.940 1.00 0.00 H new ATOM 0 HA LEU A 918 -3.132 8.182 0.202 1.00 0.00 H new ATOM 0 HB2 LEU A 918 -1.728 10.186 -1.558 1.00 0.00 H new ATOM 0 HB3 LEU A 918 -0.855 9.505 -0.200 1.00 0.00 H new ATOM 0 HG LEU A 918 -0.493 7.620 -1.400 1.00 0.00 H new ATOM 0 HD11 LEU A 918 -2.402 6.132 -1.921 1.00 0.00 H new ATOM 0 HD12 LEU A 918 -2.558 6.824 -0.289 1.00 0.00 H new ATOM 0 HD13 LEU A 918 -3.530 7.477 -1.630 1.00 0.00 H new ATOM 0 HD21 LEU A 918 -1.304 7.445 -3.733 1.00 0.00 H new ATOM 0 HD22 LEU A 918 -2.432 8.790 -3.442 1.00 0.00 H new ATOM 0 HD23 LEU A 918 -0.676 9.076 -3.395 1.00 0.00 H new ATOM 1348 N VAL A 919 -2.998 9.437 2.324 1.00 0.00 N ATOM 1349 CA VAL A 919 -2.960 10.143 3.589 1.00 0.00 C ATOM 1350 C VAL A 919 -1.539 10.147 4.133 1.00 0.00 C ATOM 1351 O VAL A 919 -0.598 9.803 3.421 1.00 0.00 O ATOM 1352 CB VAL A 919 -3.915 9.475 4.573 1.00 0.00 C ATOM 1353 CG1 VAL A 919 -5.087 8.863 3.811 1.00 0.00 C ATOM 1354 CG2 VAL A 919 -3.175 8.378 5.334 1.00 0.00 C ATOM 0 H VAL A 919 -3.069 8.423 2.411 1.00 0.00 H new ATOM 0 HA VAL A 919 -3.275 11.176 3.444 1.00 0.00 H new ATOM 0 HB VAL A 919 -4.289 10.218 5.277 1.00 0.00 H new ATOM 0 HG11 VAL A 919 -5.769 8.386 4.515 1.00 0.00 H new ATOM 0 HG12 VAL A 919 -5.616 9.646 3.267 1.00 0.00 H new ATOM 0 HG13 VAL A 919 -4.714 8.120 3.106 1.00 0.00 H new ATOM 0 HG21 VAL A 919 -3.857 7.900 6.038 1.00 0.00 H new ATOM 0 HG22 VAL A 919 -2.801 7.635 4.629 1.00 0.00 H new ATOM 0 HG23 VAL A 919 -2.338 8.814 5.879 1.00 0.00 H new ATOM 1364 N ALA A 920 -1.385 10.539 5.401 1.00 0.00 N ATOM 1365 CA ALA A 920 -0.082 10.586 6.033 1.00 0.00 C ATOM 1366 C ALA A 920 0.465 9.175 6.193 1.00 0.00 C ATOM 1367 O ALA A 920 -0.070 8.384 6.967 1.00 0.00 O ATOM 1368 CB ALA A 920 -0.200 11.278 7.388 1.00 0.00 C ATOM 0 H ALA A 920 -2.155 10.828 6.004 1.00 0.00 H new ATOM 0 HA ALA A 920 0.609 11.153 5.409 1.00 0.00 H new ATOM 0 HB1 ALA A 920 0.780 11.314 7.865 1.00 0.00 H new ATOM 0 HB2 ALA A 920 -0.573 12.293 7.247 1.00 0.00 H new ATOM 0 HB3 ALA A 920 -0.891 10.722 8.021 1.00 0.00 H new ATOM 1374 N PRO A 921 1.534 8.860 5.459 1.00 0.00 N ATOM 1375 CA PRO A 921 2.189 7.569 5.481 1.00 0.00 C ATOM 1376 C PRO A 921 2.951 7.406 6.789 1.00 0.00 C ATOM 1377 O PRO A 921 3.719 8.285 7.175 1.00 0.00 O ATOM 1378 CB PRO A 921 3.144 7.593 4.290 1.00 0.00 C ATOM 1379 CG PRO A 921 3.500 9.075 4.172 1.00 0.00 C ATOM 1380 CD PRO A 921 2.189 9.765 4.539 1.00 0.00 C ATOM 0 HA PRO A 921 1.488 6.737 5.415 1.00 0.00 H new ATOM 0 HB2 PRO A 921 4.026 6.978 4.466 1.00 0.00 H new ATOM 0 HB3 PRO A 921 2.670 7.217 3.383 1.00 0.00 H new ATOM 0 HG2 PRO A 921 4.307 9.353 4.850 1.00 0.00 H new ATOM 0 HG3 PRO A 921 3.826 9.334 3.165 1.00 0.00 H new ATOM 0 HD2 PRO A 921 2.370 10.735 5.001 1.00 0.00 H new ATOM 0 HD3 PRO A 921 1.575 9.942 3.656 1.00 0.00 H new ATOM 1388 N CYS A 922 2.735 6.279 7.470 1.00 0.00 N ATOM 1389 CA CYS A 922 3.397 6.002 8.729 1.00 0.00 C ATOM 1390 C CYS A 922 3.570 4.499 8.894 1.00 0.00 C ATOM 1391 O CYS A 922 3.806 4.019 10.001 1.00 0.00 O ATOM 1392 CB CYS A 922 2.574 6.583 9.875 1.00 0.00 C ATOM 1393 SG CYS A 922 3.618 6.676 11.351 1.00 0.00 S ATOM 0 H CYS A 922 2.100 5.543 7.161 1.00 0.00 H new ATOM 0 HA CYS A 922 4.383 6.466 8.739 1.00 0.00 H new ATOM 0 HB2 CYS A 922 2.205 7.574 9.610 1.00 0.00 H new ATOM 0 HB3 CYS A 922 1.702 5.959 10.068 1.00 0.00 H new ATOM 0 HG CYS A 922 4.206 5.532 11.539 1.00 0.00 H new