USER MOD reduce.3.24.130724 H: found=0, std=0, add=1016, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 1014 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 56 CYS SG : rot 180:sc= -0.0026 USER MOD Set 1.2: A 90 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 29 GLN : amide:sc= -0.143 K(o=1.2,f=-1.9!) USER MOD Set 2.2: A 48 LYS NZ :NH3+ 174:sc= 1.31 (180deg=1.21) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -163:sc= 1.19 (180deg=0.885) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 HIS : no HD1:sc= -0.154 X(o=-0.15,f=-0.21) USER MOD Single : A 8 LYS NZ :NH3+ 171:sc= 0.934 (180deg=0.795) USER MOD Single : A 9 THR OG1 : rot 51:sc= 0.232 USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot 83:sc= 0.599 USER MOD Single : A 32 GLN : amide:sc= -2.18! K(o=-2.2!,f=-0.011) USER MOD Single : A 34 SER OG : rot 70:sc= 1.1 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 GLN : amide:sc= -0.253 X(o=-0.25,f=0) USER MOD Single : A 45 ASN : amide:sc= 0.617 K(o=0.62,f=-0.087) USER MOD Single : A 51 SER OG : rot -70:sc= 1.25 USER MOD Single : A 53 ASN : amide:sc= 1.7 K(o=1.7,f=-0.1) USER MOD Single : A 58 HIS : no HE2:sc= 0.644 K(o=1.8,f=-8.4!) USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot -130:sc= 0.233 USER MOD Single : A 63 GLN : amide:sc= -0.146 K(o=-0.15,f=-1.3) USER MOD Single : A 65 HIS : no HD1:sc=-0.00845 X(o=-0.0084,f=-0.004) USER MOD Single : A 67 ASN : amide:sc= 0.183 K(o=0.18,f=-3!) USER MOD Single : A 68 ASN : amide:sc= -0.257 K(o=-0.26,f=-3.2!) USER MOD Single : A 72 GLN : amide:sc= 0.73 K(o=0.73,f=-1.8) USER MOD Single : A 73 GLN : amide:sc= -0.158 K(o=-0.16,f=-0.89) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 SER OG : rot 61:sc= 1.25 USER MOD Single : A 81 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 86 THR OG1 : rot 180:sc= 0.00828 USER MOD Single : A 96 ASN : amide:sc= -1.14 K(o=-1.1,f=-0.0038) USER MOD Single : A 101 THR OG1 : rot 180:sc= 0.282 USER MOD Single : A 107 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 GLN : amide:sc= -0.461 X(o=-0.46,f=-0.45) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 125 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 126 ASN : amide:sc= -0.0619 K(o=-0.062,f=-1.5) USER MOD Single : A 128 GLN : amide:sc= -0.358 X(o=-0.36,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -24.278 14.920 -2.941 1.00 0.00 N ATOM 2 CA MET A 1 -25.212 15.605 -2.035 1.00 0.00 C ATOM 3 C MET A 1 -25.354 14.833 -0.726 1.00 0.00 C ATOM 4 O MET A 1 -25.100 15.427 0.319 1.00 0.00 O ATOM 5 CB MET A 1 -26.557 15.932 -2.698 1.00 0.00 C ATOM 6 CG MET A 1 -26.378 16.936 -3.841 1.00 0.00 C ATOM 7 SD MET A 1 -27.920 17.491 -4.608 1.00 0.00 S ATOM 8 CE MET A 1 -27.238 18.631 -5.843 1.00 0.00 C ATOM 0 H1 MET A 1 -23.970 15.578 -3.685 1.00 0.00 H new ATOM 0 H2 MET A 1 -23.450 14.593 -2.404 1.00 0.00 H new ATOM 0 H3 MET A 1 -24.753 14.103 -3.376 1.00 0.00 H new ATOM 0 HA MET A 1 -24.784 16.577 -1.791 1.00 0.00 H new ATOM 0 HB2 MET A 1 -27.009 15.017 -3.081 1.00 0.00 H new ATOM 0 HB3 MET A 1 -27.243 16.340 -1.955 1.00 0.00 H new ATOM 0 HG2 MET A 1 -25.843 17.807 -3.461 1.00 0.00 H new ATOM 0 HG3 MET A 1 -25.749 16.484 -4.608 1.00 0.00 H new ATOM 0 HE1 MET A 1 -28.051 19.074 -6.418 1.00 0.00 H new ATOM 0 HE2 MET A 1 -26.678 19.419 -5.340 1.00 0.00 H new ATOM 0 HE3 MET A 1 -26.574 18.086 -6.514 1.00 0.00 H new ATOM 18 N LYS A 2 -25.686 13.529 -0.740 1.00 0.00 N ATOM 19 CA LYS A 2 -25.397 12.653 0.400 1.00 0.00 C ATOM 20 C LYS A 2 -23.882 12.661 0.566 1.00 0.00 C ATOM 21 O LYS A 2 -23.377 13.222 1.536 1.00 0.00 O ATOM 22 CB LYS A 2 -25.980 11.239 0.199 1.00 0.00 C ATOM 23 CG LYS A 2 -25.476 10.270 1.284 1.00 0.00 C ATOM 24 CD LYS A 2 -25.941 8.825 1.098 1.00 0.00 C ATOM 25 CE LYS A 2 -27.385 8.608 1.563 1.00 0.00 C ATOM 26 NZ LYS A 2 -27.647 7.173 1.790 1.00 0.00 N ATOM 0 H LYS A 2 -26.150 13.066 -1.522 1.00 0.00 H new ATOM 0 HA LYS A 2 -25.875 13.011 1.312 1.00 0.00 H new ATOM 0 HB2 LYS A 2 -27.069 11.284 0.226 1.00 0.00 H new ATOM 0 HB3 LYS A 2 -25.701 10.864 -0.786 1.00 0.00 H new ATOM 0 HG2 LYS A 2 -24.386 10.291 1.296 1.00 0.00 H new ATOM 0 HG3 LYS A 2 -25.812 10.626 2.258 1.00 0.00 H new ATOM 0 HD2 LYS A 2 -25.857 8.552 0.046 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -25.280 8.160 1.654 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -27.565 9.166 2.482 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -28.076 8.996 0.814 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -28.630 7.045 2.105 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -27.496 6.648 0.905 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -27.000 6.813 2.521 1.00 0.00 H new ATOM 40 N ALA A 3 -23.167 12.059 -0.391 1.00 0.00 N ATOM 41 CA ALA A 3 -21.718 12.122 -0.417 1.00 0.00 C ATOM 42 C ALA A 3 -21.389 13.597 -0.652 1.00 0.00 C ATOM 43 O ALA A 3 -21.887 14.186 -1.619 1.00 0.00 O ATOM 44 CB ALA A 3 -21.168 11.220 -1.524 1.00 0.00 C ATOM 0 H ALA A 3 -23.578 11.523 -1.156 1.00 0.00 H new ATOM 0 HA ALA A 3 -21.262 11.766 0.507 1.00 0.00 H new ATOM 0 HB1 ALA A 3 -20.080 11.277 -1.532 1.00 0.00 H new ATOM 0 HB2 ALA A 3 -21.476 10.191 -1.341 1.00 0.00 H new ATOM 0 HB3 ALA A 3 -21.556 11.549 -2.488 1.00 0.00 H new ATOM 50 N LEU A 4 -20.651 14.212 0.266 1.00 0.00 N ATOM 51 CA LEU A 4 -20.343 15.626 0.278 1.00 0.00 C ATOM 52 C LEU A 4 -19.051 15.714 1.072 1.00 0.00 C ATOM 53 O LEU A 4 -19.074 15.534 2.289 1.00 0.00 O ATOM 54 CB LEU A 4 -21.495 16.423 0.931 1.00 0.00 C ATOM 55 CG LEU A 4 -21.492 17.943 0.670 1.00 0.00 C ATOM 56 CD1 LEU A 4 -20.191 18.657 1.052 1.00 0.00 C ATOM 57 CD2 LEU A 4 -21.829 18.258 -0.793 1.00 0.00 C ATOM 0 H LEU A 4 -20.237 13.712 1.053 1.00 0.00 H new ATOM 0 HA LEU A 4 -20.229 16.055 -0.718 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -22.441 16.014 0.576 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -21.461 16.258 2.008 1.00 0.00 H new ATOM 0 HG LEU A 4 -22.267 18.331 1.331 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -20.282 19.721 0.833 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -20.000 18.521 2.116 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -19.364 18.238 0.478 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -21.819 19.337 -0.944 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -21.089 17.793 -1.445 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -22.819 17.868 -1.031 1.00 0.00 H new ATOM 69 N GLU A 5 -17.930 15.920 0.386 1.00 0.00 N ATOM 70 CA GLU A 5 -16.606 16.125 0.977 1.00 0.00 C ATOM 71 C GLU A 5 -16.270 14.965 1.917 1.00 0.00 C ATOM 72 O GLU A 5 -16.087 15.094 3.131 1.00 0.00 O ATOM 73 CB GLU A 5 -16.570 17.522 1.605 1.00 0.00 C ATOM 74 CG GLU A 5 -15.232 17.981 2.194 1.00 0.00 C ATOM 75 CD GLU A 5 -14.169 18.326 1.157 1.00 0.00 C ATOM 76 OE1 GLU A 5 -14.031 17.637 0.123 1.00 0.00 O ATOM 77 OE2 GLU A 5 -13.394 19.272 1.426 1.00 0.00 O ATOM 0 H GLU A 5 -17.916 15.950 -0.633 1.00 0.00 H new ATOM 0 HA GLU A 5 -15.811 16.108 0.231 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -16.872 18.243 0.846 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -17.319 17.558 2.396 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -15.407 18.855 2.821 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -14.846 17.195 2.843 1.00 0.00 H new ATOM 84 N HIS A 6 -16.246 13.792 1.297 1.00 0.00 N ATOM 85 CA HIS A 6 -16.011 12.495 1.924 1.00 0.00 C ATOM 86 C HIS A 6 -14.662 11.887 1.514 1.00 0.00 C ATOM 87 O HIS A 6 -14.333 10.775 1.931 1.00 0.00 O ATOM 88 CB HIS A 6 -17.194 11.566 1.589 1.00 0.00 C ATOM 89 CG HIS A 6 -17.187 10.312 2.424 1.00 0.00 C ATOM 90 ND1 HIS A 6 -16.808 9.046 2.010 1.00 0.00 N ATOM 91 CD2 HIS A 6 -17.345 10.285 3.778 1.00 0.00 C ATOM 92 CE1 HIS A 6 -16.712 8.278 3.108 1.00 0.00 C ATOM 93 NE2 HIS A 6 -17.029 9.010 4.191 1.00 0.00 N ATOM 0 H HIS A 6 -16.398 13.714 0.291 1.00 0.00 H new ATOM 0 HA HIS A 6 -15.952 12.625 3.005 1.00 0.00 H new ATOM 0 HB2 HIS A 6 -18.130 12.101 1.748 1.00 0.00 H new ATOM 0 HB3 HIS A 6 -17.155 11.298 0.533 1.00 0.00 H new ATOM 0 HD2 HIS A 6 -17.658 11.106 4.406 1.00 0.00 H new ATOM 0 HE1 HIS A 6 -16.425 7.237 3.119 1.00 0.00 H new ATOM 0 HE2 HIS A 6 -17.034 8.677 5.155 1.00 0.00 H new ATOM 102 N GLU A 7 -13.891 12.574 0.673 1.00 0.00 N ATOM 103 CA GLU A 7 -12.654 12.042 0.112 1.00 0.00 C ATOM 104 C GLU A 7 -11.589 13.142 -0.026 1.00 0.00 C ATOM 105 O GLU A 7 -10.722 13.018 -0.884 1.00 0.00 O ATOM 106 CB GLU A 7 -13.026 11.372 -1.229 1.00 0.00 C ATOM 107 CG GLU A 7 -12.097 10.207 -1.595 1.00 0.00 C ATOM 108 CD GLU A 7 -12.493 9.549 -2.915 1.00 0.00 C ATOM 109 OE1 GLU A 7 -12.797 10.247 -3.907 1.00 0.00 O ATOM 110 OE2 GLU A 7 -12.539 8.298 -2.988 1.00 0.00 O ATOM 0 H GLU A 7 -14.110 13.520 0.361 1.00 0.00 H new ATOM 0 HA GLU A 7 -12.200 11.301 0.770 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -14.052 11.008 -1.175 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -12.994 12.118 -2.023 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -11.072 10.570 -1.665 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -12.118 9.463 -0.799 1.00 0.00 H new ATOM 117 N LYS A 8 -11.682 14.216 0.783 1.00 0.00 N ATOM 118 CA LYS A 8 -10.879 15.454 0.778 1.00 0.00 C ATOM 119 C LYS A 8 -9.674 15.433 -0.160 1.00 0.00 C ATOM 120 O LYS A 8 -8.669 14.775 0.110 1.00 0.00 O ATOM 121 CB LYS A 8 -10.449 15.867 2.193 1.00 0.00 C ATOM 122 CG LYS A 8 -11.623 16.501 2.949 1.00 0.00 C ATOM 123 CD LYS A 8 -11.188 17.193 4.242 1.00 0.00 C ATOM 124 CE LYS A 8 -12.367 17.943 4.866 1.00 0.00 C ATOM 125 NZ LYS A 8 -12.696 19.201 4.156 1.00 0.00 N ATOM 0 H LYS A 8 -12.384 14.241 1.523 1.00 0.00 H new ATOM 0 HA LYS A 8 -11.557 16.208 0.377 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -10.086 14.995 2.738 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -9.621 16.574 2.136 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -12.117 17.226 2.302 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -12.357 15.730 3.183 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -10.804 16.455 4.946 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -10.375 17.888 4.034 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -13.243 17.294 4.868 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -12.136 18.170 5.907 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -13.589 19.585 4.525 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -11.934 19.893 4.305 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -12.796 19.010 3.139 1.00 0.00 H new ATOM 139 N THR A 9 -9.793 16.212 -1.229 1.00 0.00 N ATOM 140 CA THR A 9 -8.896 16.317 -2.355 1.00 0.00 C ATOM 141 C THR A 9 -8.388 14.949 -2.818 1.00 0.00 C ATOM 142 O THR A 9 -7.202 14.647 -2.632 1.00 0.00 O ATOM 143 CB THR A 9 -7.777 17.335 -2.116 1.00 0.00 C ATOM 144 OG1 THR A 9 -6.970 16.969 -1.012 1.00 0.00 O ATOM 145 CG2 THR A 9 -8.313 18.748 -1.874 1.00 0.00 C ATOM 0 H THR A 9 -10.592 16.838 -1.331 1.00 0.00 H new ATOM 0 HA THR A 9 -9.476 16.714 -3.188 1.00 0.00 H new ATOM 0 HB THR A 9 -7.181 17.335 -3.029 1.00 0.00 H new ATOM 0 HG1 THR A 9 -6.683 16.037 -1.111 1.00 0.00 H new ATOM 0 HG21 THR A 9 -7.479 19.430 -1.710 1.00 0.00 H new ATOM 0 HG22 THR A 9 -8.884 19.075 -2.743 1.00 0.00 H new ATOM 0 HG23 THR A 9 -8.959 18.747 -0.996 1.00 0.00 H new ATOM 153 N PRO A 10 -9.238 14.126 -3.457 1.00 0.00 N ATOM 154 CA PRO A 10 -8.791 12.848 -3.969 1.00 0.00 C ATOM 155 C PRO A 10 -7.775 13.019 -5.093 1.00 0.00 C ATOM 156 O PRO A 10 -7.072 12.060 -5.385 1.00 0.00 O ATOM 157 CB PRO A 10 -10.046 12.119 -4.435 1.00 0.00 C ATOM 158 CG PRO A 10 -10.982 13.253 -4.821 1.00 0.00 C ATOM 159 CD PRO A 10 -10.631 14.352 -3.817 1.00 0.00 C ATOM 0 HA PRO A 10 -8.273 12.273 -3.202 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -9.840 11.462 -5.280 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -10.469 11.499 -3.644 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -10.818 13.579 -5.848 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -12.028 12.956 -4.744 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -10.767 15.341 -4.255 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -11.276 14.301 -2.939 1.00 0.00 H new ATOM 167 N GLU A 11 -7.638 14.213 -5.687 1.00 0.00 N ATOM 168 CA GLU A 11 -6.602 14.450 -6.679 1.00 0.00 C ATOM 169 C GLU A 11 -5.247 14.315 -5.997 1.00 0.00 C ATOM 170 O GLU A 11 -4.442 13.481 -6.404 1.00 0.00 O ATOM 171 CB GLU A 11 -6.744 15.836 -7.317 1.00 0.00 C ATOM 172 CG GLU A 11 -7.964 15.959 -8.237 1.00 0.00 C ATOM 173 CD GLU A 11 -7.836 15.072 -9.468 1.00 0.00 C ATOM 174 OE1 GLU A 11 -7.090 15.443 -10.400 1.00 0.00 O ATOM 175 OE2 GLU A 11 -8.537 14.037 -9.534 1.00 0.00 O ATOM 0 H GLU A 11 -8.232 15.019 -5.493 1.00 0.00 H new ATOM 0 HA GLU A 11 -6.697 13.717 -7.480 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -6.815 16.585 -6.529 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -5.843 16.059 -7.888 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -8.864 15.687 -7.685 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -8.082 16.997 -8.548 1.00 0.00 H new ATOM 182 N LEU A 12 -4.994 15.088 -4.934 1.00 0.00 N ATOM 183 CA LEU A 12 -3.701 15.015 -4.271 1.00 0.00 C ATOM 184 C LEU A 12 -3.554 13.686 -3.549 1.00 0.00 C ATOM 185 O LEU A 12 -2.466 13.128 -3.537 1.00 0.00 O ATOM 186 CB LEU A 12 -3.420 16.184 -3.320 1.00 0.00 C ATOM 187 CG LEU A 12 -1.939 16.119 -2.856 1.00 0.00 C ATOM 188 CD1 LEU A 12 -1.255 17.469 -3.033 1.00 0.00 C ATOM 189 CD2 LEU A 12 -1.795 15.635 -1.407 1.00 0.00 C ATOM 0 H LEU A 12 -5.653 15.753 -4.528 1.00 0.00 H new ATOM 0 HA LEU A 12 -2.952 15.091 -5.059 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -3.615 17.132 -3.822 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -4.086 16.136 -2.459 1.00 0.00 H new ATOM 0 HG LEU A 12 -1.446 15.384 -3.492 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -0.219 17.398 -2.701 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -1.281 17.755 -4.085 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -1.775 18.221 -2.440 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -0.740 15.609 -1.135 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -2.324 16.317 -0.741 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -2.219 14.635 -1.314 1.00 0.00 H new ATOM 201 N ALA A 13 -4.624 13.134 -2.980 1.00 0.00 N ATOM 202 CA ALA A 13 -4.536 11.847 -2.309 1.00 0.00 C ATOM 203 C ALA A 13 -4.198 10.719 -3.295 1.00 0.00 C ATOM 204 O ALA A 13 -3.584 9.721 -2.906 1.00 0.00 O ATOM 205 CB ALA A 13 -5.854 11.575 -1.602 1.00 0.00 C ATOM 0 H ALA A 13 -5.552 13.556 -2.972 1.00 0.00 H new ATOM 0 HA ALA A 13 -3.727 11.879 -1.579 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -5.802 10.612 -1.094 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -6.044 12.361 -0.871 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -6.662 11.557 -2.333 1.00 0.00 H new ATOM 211 N ALA A 14 -4.584 10.871 -4.563 1.00 0.00 N ATOM 212 CA ALA A 14 -4.219 9.947 -5.626 1.00 0.00 C ATOM 213 C ALA A 14 -2.844 10.287 -6.208 1.00 0.00 C ATOM 214 O ALA A 14 -2.158 9.382 -6.677 1.00 0.00 O ATOM 215 CB ALA A 14 -5.290 9.934 -6.703 1.00 0.00 C ATOM 0 H ALA A 14 -5.164 11.648 -4.879 1.00 0.00 H new ATOM 0 HA ALA A 14 -4.150 8.945 -5.203 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -5.004 9.239 -7.492 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -6.239 9.620 -6.269 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -5.397 10.934 -7.122 1.00 0.00 H new ATOM 221 N LYS A 15 -2.410 11.551 -6.185 1.00 0.00 N ATOM 222 CA LYS A 15 -1.054 11.941 -6.587 1.00 0.00 C ATOM 223 C LYS A 15 -0.079 11.386 -5.553 1.00 0.00 C ATOM 224 O LYS A 15 0.979 10.885 -5.910 1.00 0.00 O ATOM 225 CB LYS A 15 -0.936 13.473 -6.689 1.00 0.00 C ATOM 226 CG LYS A 15 -1.524 14.056 -7.984 1.00 0.00 C ATOM 227 CD LYS A 15 -0.725 13.626 -9.222 1.00 0.00 C ATOM 228 CE LYS A 15 -1.205 14.403 -10.450 1.00 0.00 C ATOM 229 NZ LYS A 15 -0.478 14.005 -11.671 1.00 0.00 N ATOM 0 H LYS A 15 -2.990 12.335 -5.886 1.00 0.00 H new ATOM 0 HA LYS A 15 -0.822 11.535 -7.572 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -1.442 13.925 -5.836 1.00 0.00 H new ATOM 0 HB3 LYS A 15 0.115 13.752 -6.620 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -2.559 13.732 -8.090 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -1.535 15.144 -7.920 1.00 0.00 H new ATOM 0 HD2 LYS A 15 0.338 13.806 -9.060 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -0.845 12.556 -9.389 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -2.273 14.235 -10.592 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -1.071 15.471 -10.279 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -0.832 14.554 -12.480 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 0.538 14.189 -11.546 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -0.627 12.991 -11.849 1.00 0.00 H new ATOM 243 N LEU A 16 -0.452 11.428 -4.279 1.00 0.00 N ATOM 244 CA LEU A 16 0.273 10.837 -3.169 1.00 0.00 C ATOM 245 C LEU A 16 0.332 9.324 -3.384 1.00 0.00 C ATOM 246 O LEU A 16 1.385 8.714 -3.205 1.00 0.00 O ATOM 247 CB LEU A 16 -0.452 11.217 -1.869 1.00 0.00 C ATOM 248 CG LEU A 16 0.210 10.677 -0.594 1.00 0.00 C ATOM 249 CD1 LEU A 16 1.555 11.363 -0.351 1.00 0.00 C ATOM 250 CD2 LEU A 16 -0.736 10.911 0.589 1.00 0.00 C ATOM 0 H LEU A 16 -1.308 11.897 -3.982 1.00 0.00 H new ATOM 0 HA LEU A 16 1.297 11.205 -3.104 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -0.508 12.304 -1.803 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -1.476 10.847 -1.917 1.00 0.00 H new ATOM 0 HG LEU A 16 0.399 9.609 -0.706 1.00 0.00 H new ATOM 0 HD11 LEU A 16 2.007 10.966 0.558 1.00 0.00 H new ATOM 0 HD12 LEU A 16 2.217 11.177 -1.197 1.00 0.00 H new ATOM 0 HD13 LEU A 16 1.401 12.436 -0.240 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -0.277 10.532 1.502 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -0.928 11.979 0.696 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -1.676 10.389 0.411 1.00 0.00 H new ATOM 262 N ALA A 17 -0.785 8.714 -3.804 1.00 0.00 N ATOM 263 CA ALA A 17 -0.812 7.308 -4.169 1.00 0.00 C ATOM 264 C ALA A 17 0.154 7.043 -5.329 1.00 0.00 C ATOM 265 O ALA A 17 0.862 6.042 -5.295 1.00 0.00 O ATOM 266 CB ALA A 17 -2.234 6.846 -4.520 1.00 0.00 C ATOM 0 H ALA A 17 -1.685 9.185 -3.897 1.00 0.00 H new ATOM 0 HA ALA A 17 -0.486 6.727 -3.306 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -2.218 5.790 -4.788 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -2.887 6.992 -3.659 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -2.608 7.428 -5.362 1.00 0.00 H new ATOM 272 N ALA A 18 0.209 7.934 -6.326 1.00 0.00 N ATOM 273 CA ALA A 18 1.072 7.829 -7.496 1.00 0.00 C ATOM 274 C ALA A 18 2.552 7.943 -7.119 1.00 0.00 C ATOM 275 O ALA A 18 3.390 7.331 -7.773 1.00 0.00 O ATOM 276 CB ALA A 18 0.700 8.886 -8.543 1.00 0.00 C ATOM 0 H ALA A 18 -0.368 8.775 -6.335 1.00 0.00 H new ATOM 0 HA ALA A 18 0.916 6.841 -7.929 1.00 0.00 H new ATOM 0 HB1 ALA A 18 1.357 8.789 -9.407 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -0.334 8.741 -8.855 1.00 0.00 H new ATOM 0 HB3 ALA A 18 0.812 9.881 -8.112 1.00 0.00 H new ATOM 282 N GLU A 19 2.902 8.717 -6.091 1.00 0.00 N ATOM 283 CA GLU A 19 4.267 8.790 -5.574 1.00 0.00 C ATOM 284 C GLU A 19 4.619 7.476 -4.878 1.00 0.00 C ATOM 285 O GLU A 19 5.685 6.907 -5.111 1.00 0.00 O ATOM 286 CB GLU A 19 4.395 9.948 -4.575 1.00 0.00 C ATOM 287 CG GLU A 19 4.386 11.335 -5.207 1.00 0.00 C ATOM 288 CD GLU A 19 5.536 11.555 -6.180 1.00 0.00 C ATOM 289 OE1 GLU A 19 6.676 11.114 -5.917 1.00 0.00 O ATOM 290 OE2 GLU A 19 5.309 12.269 -7.183 1.00 0.00 O ATOM 0 H GLU A 19 2.242 9.314 -5.592 1.00 0.00 H new ATOM 0 HA GLU A 19 4.952 8.961 -6.405 1.00 0.00 H new ATOM 0 HB2 GLU A 19 3.576 9.884 -3.858 1.00 0.00 H new ATOM 0 HB3 GLU A 19 5.321 9.825 -4.013 1.00 0.00 H new ATOM 0 HG2 GLU A 19 3.442 11.483 -5.731 1.00 0.00 H new ATOM 0 HG3 GLU A 19 4.435 12.087 -4.419 1.00 0.00 H new ATOM 297 N ALA A 20 3.707 6.964 -4.047 1.00 0.00 N ATOM 298 CA ALA A 20 3.871 5.673 -3.402 1.00 0.00 C ATOM 299 C ALA A 20 3.980 4.550 -4.421 1.00 0.00 C ATOM 300 O ALA A 20 4.698 3.597 -4.169 1.00 0.00 O ATOM 301 CB ALA A 20 2.712 5.426 -2.438 1.00 0.00 C ATOM 0 H ALA A 20 2.837 7.438 -3.807 1.00 0.00 H new ATOM 0 HA ALA A 20 4.804 5.686 -2.838 1.00 0.00 H new ATOM 0 HB1 ALA A 20 2.839 4.456 -1.957 1.00 0.00 H new ATOM 0 HB2 ALA A 20 2.697 6.209 -1.679 1.00 0.00 H new ATOM 0 HB3 ALA A 20 1.772 5.437 -2.989 1.00 0.00 H new ATOM 307 N ILE A 21 3.306 4.658 -5.561 1.00 0.00 N ATOM 308 CA ILE A 21 3.391 3.724 -6.675 1.00 0.00 C ATOM 309 C ILE A 21 4.716 3.885 -7.409 1.00 0.00 C ATOM 310 O ILE A 21 5.312 2.893 -7.833 1.00 0.00 O ATOM 311 CB ILE A 21 2.165 3.994 -7.587 1.00 0.00 C ATOM 312 CG1 ILE A 21 0.912 3.350 -6.962 1.00 0.00 C ATOM 313 CG2 ILE A 21 2.323 3.595 -9.063 1.00 0.00 C ATOM 314 CD1 ILE A 21 -0.397 3.890 -7.542 1.00 0.00 C ATOM 0 H ILE A 21 2.661 5.428 -5.740 1.00 0.00 H new ATOM 0 HA ILE A 21 3.367 2.689 -6.333 1.00 0.00 H new ATOM 0 HB ILE A 21 2.063 5.078 -7.629 1.00 0.00 H new ATOM 0 HG12 ILE A 21 0.952 2.271 -7.114 1.00 0.00 H new ATOM 0 HG13 ILE A 21 0.922 3.521 -5.885 1.00 0.00 H new ATOM 0 HG21 ILE A 21 1.406 3.829 -9.603 1.00 0.00 H new ATOM 0 HG22 ILE A 21 3.154 4.147 -9.502 1.00 0.00 H new ATOM 0 HG23 ILE A 21 2.521 2.525 -9.132 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -1.240 3.396 -7.059 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -0.457 4.964 -7.366 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -0.428 3.695 -8.614 1.00 0.00 H new ATOM 326 N GLU A 22 5.191 5.119 -7.577 1.00 0.00 N ATOM 327 CA GLU A 22 6.433 5.371 -8.282 1.00 0.00 C ATOM 328 C GLU A 22 7.583 4.748 -7.479 1.00 0.00 C ATOM 329 O GLU A 22 8.526 4.197 -8.056 1.00 0.00 O ATOM 330 CB GLU A 22 6.601 6.882 -8.510 1.00 0.00 C ATOM 331 CG GLU A 22 7.873 7.249 -9.283 1.00 0.00 C ATOM 332 CD GLU A 22 7.772 6.877 -10.764 1.00 0.00 C ATOM 333 OE1 GLU A 22 7.481 5.708 -11.096 1.00 0.00 O ATOM 334 OE2 GLU A 22 7.844 7.790 -11.618 1.00 0.00 O ATOM 0 H GLU A 22 4.727 5.959 -7.230 1.00 0.00 H new ATOM 0 HA GLU A 22 6.431 4.909 -9.269 1.00 0.00 H new ATOM 0 HB2 GLU A 22 5.734 7.257 -9.054 1.00 0.00 H new ATOM 0 HB3 GLU A 22 6.614 7.387 -7.544 1.00 0.00 H new ATOM 0 HG2 GLU A 22 8.058 8.319 -9.190 1.00 0.00 H new ATOM 0 HG3 GLU A 22 8.727 6.738 -8.838 1.00 0.00 H new ATOM 341 N ARG A 23 7.492 4.775 -6.148 1.00 0.00 N ATOM 342 CA ARG A 23 8.402 4.135 -5.239 1.00 0.00 C ATOM 343 C ARG A 23 8.171 2.627 -5.164 1.00 0.00 C ATOM 344 O ARG A 23 9.121 1.865 -5.344 1.00 0.00 O ATOM 345 CB ARG A 23 8.118 4.787 -3.885 1.00 0.00 C ATOM 346 CG ARG A 23 9.055 4.288 -2.791 1.00 0.00 C ATOM 347 CD ARG A 23 10.016 5.392 -2.382 1.00 0.00 C ATOM 348 NE ARG A 23 11.031 5.705 -3.404 1.00 0.00 N ATOM 349 CZ ARG A 23 11.724 6.847 -3.459 1.00 0.00 C ATOM 350 NH1 ARG A 23 11.624 7.759 -2.498 1.00 0.00 N ATOM 351 NH2 ARG A 23 12.528 7.066 -4.487 1.00 0.00 N ATOM 0 H ARG A 23 6.741 5.271 -5.667 1.00 0.00 H new ATOM 0 HA ARG A 23 9.436 4.258 -5.561 1.00 0.00 H new ATOM 0 HB2 ARG A 23 8.216 5.869 -3.978 1.00 0.00 H new ATOM 0 HB3 ARG A 23 7.087 4.584 -3.596 1.00 0.00 H new ATOM 0 HG2 ARG A 23 8.476 3.961 -1.927 1.00 0.00 H new ATOM 0 HG3 ARG A 23 9.614 3.422 -3.147 1.00 0.00 H new ATOM 0 HD2 ARG A 23 9.446 6.294 -2.161 1.00 0.00 H new ATOM 0 HD3 ARG A 23 10.520 5.100 -1.461 1.00 0.00 H new ATOM 0 HE ARG A 23 11.218 5.002 -4.119 1.00 0.00 H new ATOM 0 HH11 ARG A 23 11.010 7.594 -1.700 1.00 0.00 H new ATOM 0 HH12 ARG A 23 12.161 8.624 -2.558 1.00 0.00 H new ATOM 0 HH21 ARG A 23 12.613 6.368 -5.225 1.00 0.00 H new ATOM 0 HH22 ARG A 23 13.062 7.933 -4.541 1.00 0.00 H new ATOM 365 N ASP A 24 6.953 2.190 -4.863 1.00 0.00 N ATOM 366 CA ASP A 24 6.599 0.797 -4.613 1.00 0.00 C ATOM 367 C ASP A 24 6.074 0.052 -5.838 1.00 0.00 C ATOM 368 O ASP A 24 4.928 0.266 -6.247 1.00 0.00 O ATOM 369 CB ASP A 24 5.551 0.688 -3.502 1.00 0.00 C ATOM 370 CG ASP A 24 5.395 -0.760 -3.015 1.00 0.00 C ATOM 371 OD1 ASP A 24 6.371 -1.551 -3.076 1.00 0.00 O ATOM 372 OD2 ASP A 24 4.280 -1.133 -2.595 1.00 0.00 O ATOM 0 H ASP A 24 6.155 2.820 -4.783 1.00 0.00 H new ATOM 0 HA ASP A 24 7.536 0.325 -4.317 1.00 0.00 H new ATOM 0 HB2 ASP A 24 5.838 1.325 -2.666 1.00 0.00 H new ATOM 0 HB3 ASP A 24 4.592 1.055 -3.868 1.00 0.00 H new ATOM 377 N PRO A 25 6.846 -0.884 -6.412 1.00 0.00 N ATOM 378 CA PRO A 25 6.345 -1.705 -7.495 1.00 0.00 C ATOM 379 C PRO A 25 5.158 -2.576 -7.066 1.00 0.00 C ATOM 380 O PRO A 25 4.336 -2.875 -7.927 1.00 0.00 O ATOM 381 CB PRO A 25 7.533 -2.531 -7.986 1.00 0.00 C ATOM 382 CG PRO A 25 8.450 -2.574 -6.769 1.00 0.00 C ATOM 383 CD PRO A 25 8.223 -1.228 -6.102 1.00 0.00 C ATOM 0 HA PRO A 25 5.947 -1.087 -8.300 1.00 0.00 H new ATOM 0 HB2 PRO A 25 7.228 -3.530 -8.297 1.00 0.00 H new ATOM 0 HB3 PRO A 25 8.021 -2.066 -8.842 1.00 0.00 H new ATOM 0 HG2 PRO A 25 8.195 -3.399 -6.104 1.00 0.00 H new ATOM 0 HG3 PRO A 25 9.493 -2.708 -7.057 1.00 0.00 H new ATOM 0 HD2 PRO A 25 8.382 -1.289 -5.025 1.00 0.00 H new ATOM 0 HD3 PRO A 25 8.914 -0.476 -6.484 1.00 0.00 H new ATOM 391 N TRP A 26 4.994 -2.968 -5.790 1.00 0.00 N ATOM 392 CA TRP A 26 3.777 -3.691 -5.416 1.00 0.00 C ATOM 393 C TRP A 26 2.575 -2.751 -5.473 1.00 0.00 C ATOM 394 O TRP A 26 1.576 -3.136 -6.067 1.00 0.00 O ATOM 395 CB TRP A 26 3.869 -4.398 -4.064 1.00 0.00 C ATOM 396 CG TRP A 26 2.567 -4.986 -3.584 1.00 0.00 C ATOM 397 CD1 TRP A 26 1.879 -4.521 -2.522 1.00 0.00 C ATOM 398 CD2 TRP A 26 1.746 -6.075 -4.126 1.00 0.00 C ATOM 399 NE1 TRP A 26 0.709 -5.230 -2.352 1.00 0.00 N ATOM 400 CE2 TRP A 26 0.572 -6.198 -3.323 1.00 0.00 C ATOM 401 CE3 TRP A 26 1.878 -6.998 -5.188 1.00 0.00 C ATOM 402 CZ2 TRP A 26 -0.424 -7.150 -3.592 1.00 0.00 C ATOM 403 CZ3 TRP A 26 0.922 -8.007 -5.426 1.00 0.00 C ATOM 404 CH2 TRP A 26 -0.242 -8.065 -4.643 1.00 0.00 C ATOM 0 H TRP A 26 5.659 -2.804 -5.034 1.00 0.00 H new ATOM 0 HA TRP A 26 3.648 -4.490 -6.147 1.00 0.00 H new ATOM 0 HB2 TRP A 26 4.611 -5.194 -4.133 1.00 0.00 H new ATOM 0 HB3 TRP A 26 4.231 -3.689 -3.320 1.00 0.00 H new ATOM 0 HD1 TRP A 26 2.200 -3.705 -1.891 1.00 0.00 H new ATOM 0 HE1 TRP A 26 0.034 -5.060 -1.606 1.00 0.00 H new ATOM 0 HE3 TRP A 26 2.738 -6.928 -5.838 1.00 0.00 H new ATOM 0 HZ2 TRP A 26 -1.324 -7.179 -2.995 1.00 0.00 H new ATOM 0 HZ3 TRP A 26 1.085 -8.733 -6.209 1.00 0.00 H new ATOM 0 HH2 TRP A 26 -0.996 -8.811 -4.848 1.00 0.00 H new ATOM 415 N ALA A 27 2.635 -1.524 -4.944 1.00 0.00 N ATOM 416 CA ALA A 27 1.543 -0.556 -5.083 1.00 0.00 C ATOM 417 C ALA A 27 1.176 -0.355 -6.558 1.00 0.00 C ATOM 418 O ALA A 27 -0.010 -0.275 -6.899 1.00 0.00 O ATOM 419 CB ALA A 27 1.927 0.795 -4.474 1.00 0.00 C ATOM 0 H ALA A 27 3.434 -1.177 -4.413 1.00 0.00 H new ATOM 0 HA ALA A 27 0.682 -0.958 -4.549 1.00 0.00 H new ATOM 0 HB1 ALA A 27 1.100 1.495 -4.590 1.00 0.00 H new ATOM 0 HB2 ALA A 27 2.148 0.667 -3.414 1.00 0.00 H new ATOM 0 HB3 ALA A 27 2.808 1.186 -4.983 1.00 0.00 H new ATOM 425 N ALA A 28 2.183 -0.289 -7.436 1.00 0.00 N ATOM 426 CA ALA A 28 1.984 -0.196 -8.874 1.00 0.00 C ATOM 427 C ALA A 28 1.271 -1.449 -9.388 1.00 0.00 C ATOM 428 O ALA A 28 0.332 -1.334 -10.178 1.00 0.00 O ATOM 429 CB ALA A 28 3.339 -0.010 -9.573 1.00 0.00 C ATOM 0 H ALA A 28 3.165 -0.299 -7.159 1.00 0.00 H new ATOM 0 HA ALA A 28 1.357 0.667 -9.098 1.00 0.00 H new ATOM 0 HB1 ALA A 28 3.186 0.059 -10.650 1.00 0.00 H new ATOM 0 HB2 ALA A 28 3.811 0.904 -9.214 1.00 0.00 H new ATOM 0 HB3 ALA A 28 3.982 -0.862 -9.352 1.00 0.00 H new ATOM 435 N GLN A 29 1.677 -2.632 -8.927 1.00 0.00 N ATOM 436 CA GLN A 29 1.027 -3.889 -9.265 1.00 0.00 C ATOM 437 C GLN A 29 -0.427 -3.863 -8.779 1.00 0.00 C ATOM 438 O GLN A 29 -1.310 -4.179 -9.568 1.00 0.00 O ATOM 439 CB GLN A 29 1.817 -5.099 -8.725 1.00 0.00 C ATOM 440 CG GLN A 29 3.073 -5.392 -9.563 1.00 0.00 C ATOM 441 CD GLN A 29 3.930 -6.541 -9.012 1.00 0.00 C ATOM 442 OE1 GLN A 29 3.988 -6.817 -7.819 1.00 0.00 O ATOM 443 NE2 GLN A 29 4.608 -7.262 -9.886 1.00 0.00 N ATOM 0 H GLN A 29 2.476 -2.741 -8.302 1.00 0.00 H new ATOM 0 HA GLN A 29 1.014 -4.005 -10.349 1.00 0.00 H new ATOM 0 HB2 GLN A 29 2.108 -4.910 -7.692 1.00 0.00 H new ATOM 0 HB3 GLN A 29 1.173 -5.978 -8.719 1.00 0.00 H new ATOM 0 HG2 GLN A 29 2.771 -5.633 -10.582 1.00 0.00 H new ATOM 0 HG3 GLN A 29 3.682 -4.490 -9.616 1.00 0.00 H new ATOM 0 HE21 GLN A 29 4.562 -7.035 -10.879 1.00 0.00 H new ATOM 0 HE22 GLN A 29 5.178 -8.046 -9.568 1.00 0.00 H new ATOM 452 N VAL A 30 -0.721 -3.441 -7.541 1.00 0.00 N ATOM 453 CA VAL A 30 -2.087 -3.408 -7.004 1.00 0.00 C ATOM 454 C VAL A 30 -2.938 -2.483 -7.856 1.00 0.00 C ATOM 455 O VAL A 30 -4.065 -2.823 -8.218 1.00 0.00 O ATOM 456 CB VAL A 30 -2.118 -2.973 -5.517 1.00 0.00 C ATOM 457 CG1 VAL A 30 -3.544 -2.948 -4.947 1.00 0.00 C ATOM 458 CG2 VAL A 30 -1.339 -3.938 -4.623 1.00 0.00 C ATOM 0 H VAL A 30 -0.015 -3.112 -6.882 1.00 0.00 H new ATOM 0 HA VAL A 30 -2.495 -4.418 -7.042 1.00 0.00 H new ATOM 0 HB VAL A 30 -1.675 -1.977 -5.513 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -3.513 -2.637 -3.903 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -4.151 -2.245 -5.517 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -3.981 -3.944 -5.016 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -1.387 -3.595 -3.589 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -1.776 -4.934 -4.696 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -0.298 -3.974 -4.946 1.00 0.00 H new ATOM 468 N SER A 31 -2.399 -1.322 -8.203 1.00 0.00 N ATOM 469 CA SER A 31 -3.101 -0.333 -8.991 1.00 0.00 C ATOM 470 C SER A 31 -3.349 -0.849 -10.412 1.00 0.00 C ATOM 471 O SER A 31 -4.354 -0.490 -11.027 1.00 0.00 O ATOM 472 CB SER A 31 -2.313 0.973 -8.896 1.00 0.00 C ATOM 473 OG SER A 31 -2.207 1.313 -7.516 1.00 0.00 O ATOM 0 H SER A 31 -1.454 -1.043 -7.940 1.00 0.00 H new ATOM 0 HA SER A 31 -4.102 -0.135 -8.608 1.00 0.00 H new ATOM 0 HB2 SER A 31 -1.324 0.856 -9.339 1.00 0.00 H new ATOM 0 HB3 SER A 31 -2.818 1.766 -9.448 1.00 0.00 H new ATOM 0 HG SER A 31 -1.456 0.826 -7.116 1.00 0.00 H new ATOM 479 N GLN A 32 -2.518 -1.772 -10.902 1.00 0.00 N ATOM 480 CA GLN A 32 -2.732 -2.429 -12.178 1.00 0.00 C ATOM 481 C GLN A 32 -3.799 -3.520 -11.994 1.00 0.00 C ATOM 482 O GLN A 32 -4.709 -3.635 -12.818 1.00 0.00 O ATOM 483 CB GLN A 32 -1.386 -2.962 -12.697 1.00 0.00 C ATOM 484 CG GLN A 32 -1.528 -3.653 -14.051 1.00 0.00 C ATOM 485 CD GLN A 32 -0.170 -3.926 -14.693 1.00 0.00 C ATOM 486 OE1 GLN A 32 0.290 -3.183 -15.560 1.00 0.00 O ATOM 487 NE2 GLN A 32 0.507 -4.989 -14.300 1.00 0.00 N ATOM 0 H GLN A 32 -1.676 -2.081 -10.417 1.00 0.00 H new ATOM 0 HA GLN A 32 -3.107 -1.739 -12.934 1.00 0.00 H new ATOM 0 HB2 GLN A 32 -0.679 -2.137 -12.783 1.00 0.00 H new ATOM 0 HB3 GLN A 32 -0.971 -3.664 -11.974 1.00 0.00 H new ATOM 0 HG2 GLN A 32 -2.066 -4.593 -13.925 1.00 0.00 H new ATOM 0 HG3 GLN A 32 -2.126 -3.030 -14.716 1.00 0.00 H new ATOM 0 HE21 GLN A 32 0.122 -5.602 -13.581 1.00 0.00 H new ATOM 0 HE22 GLN A 32 1.415 -5.197 -14.715 1.00 0.00 H new ATOM 496 N LEU A 33 -3.759 -4.270 -10.882 1.00 0.00 N ATOM 497 CA LEU A 33 -4.692 -5.359 -10.575 1.00 0.00 C ATOM 498 C LEU A 33 -6.131 -4.878 -10.534 1.00 0.00 C ATOM 499 O LEU A 33 -7.039 -5.664 -10.795 1.00 0.00 O ATOM 500 CB LEU A 33 -4.394 -6.025 -9.215 1.00 0.00 C ATOM 501 CG LEU A 33 -3.187 -6.962 -9.129 1.00 0.00 C ATOM 502 CD1 LEU A 33 -3.298 -7.836 -7.871 1.00 0.00 C ATOM 503 CD2 LEU A 33 -3.120 -7.835 -10.369 1.00 0.00 C ATOM 0 H LEU A 33 -3.058 -4.130 -10.154 1.00 0.00 H new ATOM 0 HA LEU A 33 -4.555 -6.082 -11.379 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -4.257 -5.234 -8.477 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -5.278 -6.589 -8.917 1.00 0.00 H new ATOM 0 HG LEU A 33 -2.275 -6.368 -9.069 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -2.437 -8.502 -7.813 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -3.324 -7.199 -6.987 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -4.212 -8.428 -7.919 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -2.258 -8.499 -10.300 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -4.031 -8.429 -10.445 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -3.023 -7.205 -11.253 1.00 0.00 H new ATOM 515 N SER A 34 -6.324 -3.602 -10.234 1.00 0.00 N ATOM 516 CA SER A 34 -7.612 -2.915 -10.265 1.00 0.00 C ATOM 517 C SER A 34 -8.668 -3.694 -9.465 1.00 0.00 C ATOM 518 O SER A 34 -9.680 -4.133 -10.016 1.00 0.00 O ATOM 519 CB SER A 34 -8.012 -2.710 -11.733 1.00 0.00 C ATOM 520 OG SER A 34 -6.984 -2.048 -12.457 1.00 0.00 O ATOM 0 H SER A 34 -5.559 -2.990 -9.951 1.00 0.00 H new ATOM 0 HA SER A 34 -7.536 -1.939 -9.786 1.00 0.00 H new ATOM 0 HB2 SER A 34 -8.222 -3.675 -12.194 1.00 0.00 H new ATOM 0 HB3 SER A 34 -8.931 -2.126 -11.784 1.00 0.00 H new ATOM 0 HG SER A 34 -6.220 -2.652 -12.566 1.00 0.00 H new ATOM 526 N LEU A 35 -8.403 -3.956 -8.182 1.00 0.00 N ATOM 527 CA LEU A 35 -9.278 -4.793 -7.361 1.00 0.00 C ATOM 528 C LEU A 35 -10.616 -4.078 -7.109 1.00 0.00 C ATOM 529 O LEU A 35 -10.653 -2.845 -7.148 1.00 0.00 O ATOM 530 CB LEU A 35 -8.625 -5.126 -6.009 1.00 0.00 C ATOM 531 CG LEU A 35 -7.386 -6.036 -5.990 1.00 0.00 C ATOM 532 CD1 LEU A 35 -7.496 -7.250 -6.916 1.00 0.00 C ATOM 533 CD2 LEU A 35 -6.110 -5.251 -6.275 1.00 0.00 C ATOM 0 H LEU A 35 -7.585 -3.598 -7.689 1.00 0.00 H new ATOM 0 HA LEU A 35 -9.451 -5.721 -7.906 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -8.350 -4.184 -5.534 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -9.385 -5.590 -5.381 1.00 0.00 H new ATOM 0 HG LEU A 35 -7.334 -6.432 -4.976 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -6.584 -7.843 -6.848 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -8.349 -7.859 -6.617 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -7.633 -6.913 -7.943 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -5.255 -5.926 -6.253 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -6.181 -4.786 -7.258 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -5.981 -4.478 -5.517 1.00 0.00 H new ATOM 545 N PRO A 36 -11.695 -4.818 -6.776 1.00 0.00 N ATOM 546 CA PRO A 36 -12.994 -4.241 -6.446 1.00 0.00 C ATOM 547 C PRO A 36 -12.924 -3.336 -5.202 1.00 0.00 C ATOM 548 O PRO A 36 -12.798 -2.122 -5.378 1.00 0.00 O ATOM 549 CB PRO A 36 -13.982 -5.411 -6.370 1.00 0.00 C ATOM 550 CG PRO A 36 -13.090 -6.633 -6.145 1.00 0.00 C ATOM 551 CD PRO A 36 -11.808 -6.267 -6.883 1.00 0.00 C ATOM 0 HA PRO A 36 -13.347 -3.549 -7.211 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -14.694 -5.280 -5.555 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -14.562 -5.504 -7.288 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -12.908 -6.809 -5.085 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -13.541 -7.540 -6.546 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -10.945 -6.762 -6.438 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -11.853 -6.581 -7.926 1.00 0.00 H new ATOM 559 N LYS A 37 -13.003 -3.845 -3.959 1.00 0.00 N ATOM 560 CA LYS A 37 -12.814 -2.994 -2.772 1.00 0.00 C ATOM 561 C LYS A 37 -12.293 -3.748 -1.551 1.00 0.00 C ATOM 562 O LYS A 37 -11.260 -3.355 -1.025 1.00 0.00 O ATOM 563 CB LYS A 37 -14.092 -2.202 -2.439 1.00 0.00 C ATOM 564 CG LYS A 37 -13.790 -0.823 -1.825 1.00 0.00 C ATOM 565 CD LYS A 37 -13.262 0.178 -2.865 1.00 0.00 C ATOM 566 CE LYS A 37 -12.940 1.535 -2.230 1.00 0.00 C ATOM 567 NZ LYS A 37 -12.389 2.473 -3.231 1.00 0.00 N ATOM 0 H LYS A 37 -13.193 -4.826 -3.753 1.00 0.00 H new ATOM 0 HA LYS A 37 -12.030 -2.286 -3.039 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -14.681 -2.070 -3.347 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -14.702 -2.779 -1.744 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -14.696 -0.425 -1.369 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -13.055 -0.936 -1.028 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -12.366 -0.225 -3.337 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -14.004 0.311 -3.652 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -13.843 1.957 -1.789 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -12.223 1.400 -1.420 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -12.180 3.384 -2.775 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -11.515 2.078 -3.633 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -13.084 2.618 -3.991 1.00 0.00 H new ATOM 581 N LEU A 38 -12.925 -4.838 -1.105 1.00 0.00 N ATOM 582 CA LEU A 38 -12.376 -5.660 -0.018 1.00 0.00 C ATOM 583 C LEU A 38 -11.011 -6.182 -0.449 1.00 0.00 C ATOM 584 O LEU A 38 -10.037 -6.091 0.289 1.00 0.00 O ATOM 585 CB LEU A 38 -13.311 -6.834 0.330 1.00 0.00 C ATOM 586 CG LEU A 38 -12.677 -7.910 1.246 1.00 0.00 C ATOM 587 CD1 LEU A 38 -12.237 -7.346 2.601 1.00 0.00 C ATOM 588 CD2 LEU A 38 -13.665 -9.055 1.487 1.00 0.00 C ATOM 0 H LEU A 38 -13.814 -5.172 -1.477 1.00 0.00 H new ATOM 0 HA LEU A 38 -12.281 -5.047 0.878 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -14.203 -6.440 0.817 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -13.637 -7.309 -0.595 1.00 0.00 H new ATOM 0 HG LEU A 38 -11.791 -8.274 0.726 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -11.800 -8.143 3.202 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -11.497 -6.561 2.445 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -13.101 -6.932 3.121 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -13.205 -9.803 2.132 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -14.563 -8.666 1.966 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -13.931 -9.512 0.534 1.00 0.00 H new ATOM 600 N VAL A 39 -10.941 -6.713 -1.666 1.00 0.00 N ATOM 601 CA VAL A 39 -9.722 -7.289 -2.208 1.00 0.00 C ATOM 602 C VAL A 39 -8.665 -6.179 -2.371 1.00 0.00 C ATOM 603 O VAL A 39 -7.474 -6.448 -2.226 1.00 0.00 O ATOM 604 CB VAL A 39 -10.055 -8.028 -3.526 1.00 0.00 C ATOM 605 CG1 VAL A 39 -8.922 -8.970 -3.946 1.00 0.00 C ATOM 606 CG2 VAL A 39 -11.348 -8.864 -3.455 1.00 0.00 C ATOM 0 H VAL A 39 -11.735 -6.754 -2.305 1.00 0.00 H new ATOM 0 HA VAL A 39 -9.295 -8.029 -1.531 1.00 0.00 H new ATOM 0 HB VAL A 39 -10.191 -7.231 -4.257 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -9.191 -9.471 -4.876 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -8.008 -8.396 -4.095 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -8.760 -9.714 -3.166 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -11.518 -9.353 -4.414 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -11.251 -9.619 -2.675 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -12.191 -8.212 -3.226 1.00 0.00 H new ATOM 616 N GLU A 40 -9.091 -4.928 -2.616 1.00 0.00 N ATOM 617 CA GLU A 40 -8.193 -3.776 -2.661 1.00 0.00 C ATOM 618 C GLU A 40 -7.663 -3.552 -1.243 1.00 0.00 C ATOM 619 O GLU A 40 -6.457 -3.505 -1.066 1.00 0.00 O ATOM 620 CB GLU A 40 -8.909 -2.520 -3.201 1.00 0.00 C ATOM 621 CG GLU A 40 -8.004 -1.277 -3.301 1.00 0.00 C ATOM 622 CD GLU A 40 -7.005 -1.288 -4.465 1.00 0.00 C ATOM 623 OE1 GLU A 40 -7.248 -2.007 -5.460 1.00 0.00 O ATOM 624 OE2 GLU A 40 -6.063 -0.467 -4.482 1.00 0.00 O ATOM 0 H GLU A 40 -10.069 -4.694 -2.788 1.00 0.00 H new ATOM 0 HA GLU A 40 -7.368 -3.970 -3.346 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -9.315 -2.742 -4.188 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -9.755 -2.290 -2.553 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -8.636 -0.394 -3.394 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -7.449 -1.175 -2.368 1.00 0.00 H new ATOM 631 N GLN A 41 -8.536 -3.468 -0.230 1.00 0.00 N ATOM 632 CA GLN A 41 -8.186 -3.249 1.175 1.00 0.00 C ATOM 633 C GLN A 41 -7.132 -4.256 1.647 1.00 0.00 C ATOM 634 O GLN A 41 -6.227 -3.890 2.397 1.00 0.00 O ATOM 635 CB GLN A 41 -9.460 -3.350 2.038 1.00 0.00 C ATOM 636 CG GLN A 41 -9.302 -2.817 3.469 1.00 0.00 C ATOM 637 CD GLN A 41 -10.632 -2.737 4.232 1.00 0.00 C ATOM 638 OE1 GLN A 41 -10.796 -1.919 5.134 1.00 0.00 O ATOM 639 NE2 GLN A 41 -11.609 -3.578 3.935 1.00 0.00 N ATOM 0 H GLN A 41 -9.542 -3.554 -0.375 1.00 0.00 H new ATOM 0 HA GLN A 41 -7.755 -2.253 1.280 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -10.262 -2.800 1.545 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -9.771 -4.394 2.085 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -8.614 -3.461 4.016 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -8.850 -1.826 3.433 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -11.484 -4.261 3.188 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -12.487 -3.543 4.453 1.00 0.00 H new ATOM 648 N VAL A 42 -7.254 -5.510 1.209 1.00 0.00 N ATOM 649 CA VAL A 42 -6.314 -6.589 1.477 1.00 0.00 C ATOM 650 C VAL A 42 -4.985 -6.300 0.799 1.00 0.00 C ATOM 651 O VAL A 42 -3.971 -6.186 1.484 1.00 0.00 O ATOM 652 CB VAL A 42 -6.945 -7.924 1.034 1.00 0.00 C ATOM 653 CG1 VAL A 42 -5.976 -9.114 0.992 1.00 0.00 C ATOM 654 CG2 VAL A 42 -8.055 -8.252 2.029 1.00 0.00 C ATOM 0 H VAL A 42 -8.043 -5.809 0.636 1.00 0.00 H new ATOM 0 HA VAL A 42 -6.104 -6.665 2.544 1.00 0.00 H new ATOM 0 HB VAL A 42 -7.296 -7.785 0.012 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -6.511 -10.007 0.670 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -5.169 -8.901 0.291 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -5.559 -9.279 1.986 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -8.528 -9.193 1.749 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -7.632 -8.342 3.030 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -8.799 -7.455 2.020 1.00 0.00 H new ATOM 664 N ALA A 43 -4.974 -6.172 -0.531 1.00 0.00 N ATOM 665 CA ALA A 43 -3.755 -5.931 -1.286 1.00 0.00 C ATOM 666 C ALA A 43 -3.050 -4.643 -0.826 1.00 0.00 C ATOM 667 O ALA A 43 -1.827 -4.548 -0.911 1.00 0.00 O ATOM 668 CB ALA A 43 -4.113 -5.881 -2.773 1.00 0.00 C ATOM 0 H ALA A 43 -5.813 -6.234 -1.108 1.00 0.00 H new ATOM 0 HA ALA A 43 -3.048 -6.742 -1.109 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -3.211 -5.701 -3.358 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -4.556 -6.831 -3.073 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -4.827 -5.076 -2.949 1.00 0.00 H new ATOM 674 N LEU A 44 -3.824 -3.682 -0.318 1.00 0.00 N ATOM 675 CA LEU A 44 -3.385 -2.416 0.228 1.00 0.00 C ATOM 676 C LEU A 44 -2.717 -2.610 1.583 1.00 0.00 C ATOM 677 O LEU A 44 -1.696 -1.983 1.850 1.00 0.00 O ATOM 678 CB LEU A 44 -4.558 -1.422 0.368 1.00 0.00 C ATOM 679 CG LEU A 44 -4.865 -0.590 -0.892 1.00 0.00 C ATOM 680 CD1 LEU A 44 -6.055 0.334 -0.595 1.00 0.00 C ATOM 681 CD2 LEU A 44 -3.684 0.286 -1.333 1.00 0.00 C ATOM 0 H LEU A 44 -4.838 -3.783 -0.279 1.00 0.00 H new ATOM 0 HA LEU A 44 -2.660 -2.000 -0.472 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -5.454 -1.978 0.644 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -4.340 -0.740 1.190 1.00 0.00 H new ATOM 0 HG LEU A 44 -5.080 -1.293 -1.697 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -6.283 0.929 -1.479 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -6.924 -0.267 -0.328 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -5.803 0.996 0.233 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -3.961 0.848 -2.225 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -3.427 0.980 -0.533 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -2.825 -0.347 -1.555 1.00 0.00 H new ATOM 693 N ASN A 45 -3.289 -3.435 2.464 1.00 0.00 N ATOM 694 CA ASN A 45 -2.786 -3.575 3.832 1.00 0.00 C ATOM 695 C ASN A 45 -1.770 -4.700 3.971 1.00 0.00 C ATOM 696 O ASN A 45 -1.488 -5.133 5.092 1.00 0.00 O ATOM 697 CB ASN A 45 -3.940 -3.658 4.845 1.00 0.00 C ATOM 698 CG ASN A 45 -4.461 -2.258 5.107 1.00 0.00 C ATOM 699 OD1 ASN A 45 -3.961 -1.555 5.984 1.00 0.00 O ATOM 700 ND2 ASN A 45 -5.424 -1.797 4.332 1.00 0.00 N ATOM 0 H ASN A 45 -4.101 -4.016 2.254 1.00 0.00 H new ATOM 0 HA ASN A 45 -2.231 -2.668 4.072 1.00 0.00 H new ATOM 0 HB2 ASN A 45 -4.738 -4.291 4.457 1.00 0.00 H new ATOM 0 HB3 ASN A 45 -3.595 -4.112 5.774 1.00 0.00 H new ATOM 0 HD21 ASN A 45 -5.765 -0.844 4.455 1.00 0.00 H new ATOM 0 HD22 ASN A 45 -5.827 -2.394 3.610 1.00 0.00 H new ATOM 707 N ALA A 46 -1.201 -5.180 2.865 1.00 0.00 N ATOM 708 CA ALA A 46 -0.135 -6.154 2.882 1.00 0.00 C ATOM 709 C ALA A 46 1.050 -5.659 2.086 1.00 0.00 C ATOM 710 O ALA A 46 0.884 -4.964 1.092 1.00 0.00 O ATOM 711 CB ALA A 46 -0.633 -7.481 2.313 1.00 0.00 C ATOM 0 H ALA A 46 -1.478 -4.893 1.926 1.00 0.00 H new ATOM 0 HA ALA A 46 0.182 -6.305 3.914 1.00 0.00 H new ATOM 0 HB1 ALA A 46 0.177 -8.211 2.329 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -1.463 -7.847 2.917 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -0.968 -7.334 1.286 1.00 0.00 H new ATOM 717 N TRP A 47 2.229 -6.117 2.483 1.00 0.00 N ATOM 718 CA TRP A 47 3.470 -5.866 1.781 1.00 0.00 C ATOM 719 C TRP A 47 3.801 -7.192 1.115 1.00 0.00 C ATOM 720 O TRP A 47 3.655 -8.270 1.704 1.00 0.00 O ATOM 721 CB TRP A 47 4.571 -5.345 2.714 1.00 0.00 C ATOM 722 CG TRP A 47 5.074 -6.205 3.841 1.00 0.00 C ATOM 723 CD1 TRP A 47 4.673 -6.134 5.134 1.00 0.00 C ATOM 724 CD2 TRP A 47 6.155 -7.194 3.820 1.00 0.00 C ATOM 725 NE1 TRP A 47 5.476 -6.943 5.918 1.00 0.00 N ATOM 726 CE2 TRP A 47 6.405 -7.623 5.159 1.00 0.00 C ATOM 727 CE3 TRP A 47 6.951 -7.773 2.809 1.00 0.00 C ATOM 728 CZ2 TRP A 47 7.385 -8.575 5.471 1.00 0.00 C ATOM 729 CZ3 TRP A 47 7.915 -8.755 3.111 1.00 0.00 C ATOM 730 CH2 TRP A 47 8.119 -9.170 4.434 1.00 0.00 C ATOM 0 H TRP A 47 2.347 -6.686 3.322 1.00 0.00 H new ATOM 0 HA TRP A 47 3.382 -5.070 1.042 1.00 0.00 H new ATOM 0 HB2 TRP A 47 5.430 -5.092 2.092 1.00 0.00 H new ATOM 0 HB3 TRP A 47 4.210 -4.415 3.153 1.00 0.00 H new ATOM 0 HD1 TRP A 47 3.850 -5.536 5.497 1.00 0.00 H new ATOM 0 HE1 TRP A 47 5.391 -7.026 6.931 1.00 0.00 H new ATOM 0 HE3 TRP A 47 6.819 -7.458 1.785 1.00 0.00 H new ATOM 0 HZ2 TRP A 47 7.573 -8.848 6.499 1.00 0.00 H new ATOM 0 HZ3 TRP A 47 8.502 -9.192 2.316 1.00 0.00 H new ATOM 0 HH2 TRP A 47 8.838 -9.945 4.654 1.00 0.00 H new ATOM 741 N LYS A 48 4.115 -7.121 -0.173 1.00 0.00 N ATOM 742 CA LYS A 48 4.315 -8.312 -0.970 1.00 0.00 C ATOM 743 C LYS A 48 5.716 -8.854 -0.770 1.00 0.00 C ATOM 744 O LYS A 48 6.685 -8.095 -0.742 1.00 0.00 O ATOM 745 CB LYS A 48 3.979 -7.968 -2.425 1.00 0.00 C ATOM 746 CG LYS A 48 3.931 -9.185 -3.348 1.00 0.00 C ATOM 747 CD LYS A 48 5.171 -9.413 -4.222 1.00 0.00 C ATOM 748 CE LYS A 48 5.377 -8.332 -5.288 1.00 0.00 C ATOM 749 NZ LYS A 48 6.501 -8.650 -6.191 1.00 0.00 N ATOM 0 H LYS A 48 4.236 -6.246 -0.683 1.00 0.00 H new ATOM 0 HA LYS A 48 3.652 -9.119 -0.658 1.00 0.00 H new ATOM 0 HB2 LYS A 48 3.014 -7.461 -2.456 1.00 0.00 H new ATOM 0 HB3 LYS A 48 4.721 -7.265 -2.804 1.00 0.00 H new ATOM 0 HG2 LYS A 48 3.773 -10.074 -2.737 1.00 0.00 H new ATOM 0 HG3 LYS A 48 3.063 -9.088 -4.001 1.00 0.00 H new ATOM 0 HD2 LYS A 48 6.053 -9.454 -3.583 1.00 0.00 H new ATOM 0 HD3 LYS A 48 5.087 -10.383 -4.712 1.00 0.00 H new ATOM 0 HE2 LYS A 48 4.463 -8.221 -5.872 1.00 0.00 H new ATOM 0 HE3 LYS A 48 5.563 -7.374 -4.802 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 6.541 -7.947 -6.956 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 7.392 -8.631 -5.656 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 6.362 -9.597 -6.598 1.00 0.00 H new ATOM 763 N GLU A 49 5.812 -10.171 -0.690 1.00 0.00 N ATOM 764 CA GLU A 49 7.023 -10.956 -0.626 1.00 0.00 C ATOM 765 C GLU A 49 6.811 -12.007 -1.709 1.00 0.00 C ATOM 766 O GLU A 49 5.784 -12.685 -1.710 1.00 0.00 O ATOM 767 CB GLU A 49 7.160 -11.560 0.770 1.00 0.00 C ATOM 768 CG GLU A 49 8.428 -12.403 0.953 1.00 0.00 C ATOM 769 CD GLU A 49 8.095 -13.893 1.026 1.00 0.00 C ATOM 770 OE1 GLU A 49 7.383 -14.282 1.985 1.00 0.00 O ATOM 771 OE2 GLU A 49 8.538 -14.660 0.137 1.00 0.00 O ATOM 0 H GLU A 49 4.979 -10.759 -0.667 1.00 0.00 H new ATOM 0 HA GLU A 49 7.943 -10.395 -0.791 1.00 0.00 H new ATOM 0 HB2 GLU A 49 7.159 -10.756 1.506 1.00 0.00 H new ATOM 0 HB3 GLU A 49 6.288 -12.181 0.975 1.00 0.00 H new ATOM 0 HG2 GLU A 49 9.112 -12.221 0.124 1.00 0.00 H new ATOM 0 HG3 GLU A 49 8.943 -12.098 1.864 1.00 0.00 H new ATOM 778 N GLU A 50 7.700 -12.068 -2.689 1.00 0.00 N ATOM 779 CA GLU A 50 7.606 -12.970 -3.825 1.00 0.00 C ATOM 780 C GLU A 50 8.745 -13.961 -3.671 1.00 0.00 C ATOM 781 O GLU A 50 9.915 -13.571 -3.672 1.00 0.00 O ATOM 782 CB GLU A 50 7.631 -12.148 -5.112 1.00 0.00 C ATOM 783 CG GLU A 50 7.623 -12.919 -6.437 1.00 0.00 C ATOM 784 CD GLU A 50 7.396 -11.964 -7.619 1.00 0.00 C ATOM 785 OE1 GLU A 50 6.538 -11.052 -7.537 1.00 0.00 O ATOM 786 OE2 GLU A 50 8.055 -12.127 -8.672 1.00 0.00 O ATOM 0 H GLU A 50 8.529 -11.475 -2.716 1.00 0.00 H new ATOM 0 HA GLU A 50 6.676 -13.536 -3.870 1.00 0.00 H new ATOM 0 HB2 GLU A 50 6.768 -11.482 -5.104 1.00 0.00 H new ATOM 0 HB3 GLU A 50 8.520 -11.518 -5.093 1.00 0.00 H new ATOM 0 HG2 GLU A 50 8.570 -13.444 -6.564 1.00 0.00 H new ATOM 0 HG3 GLU A 50 6.839 -13.676 -6.419 1.00 0.00 H new ATOM 793 N SER A 51 8.363 -15.208 -3.434 1.00 0.00 N ATOM 794 CA SER A 51 9.211 -16.364 -3.259 1.00 0.00 C ATOM 795 C SER A 51 9.359 -17.045 -4.629 1.00 0.00 C ATOM 796 O SER A 51 8.764 -16.600 -5.618 1.00 0.00 O ATOM 797 CB SER A 51 8.618 -17.305 -2.192 1.00 0.00 C ATOM 798 OG SER A 51 7.723 -16.687 -1.270 1.00 0.00 O ATOM 0 H SER A 51 7.375 -15.449 -3.354 1.00 0.00 H new ATOM 0 HA SER A 51 10.199 -16.078 -2.898 1.00 0.00 H new ATOM 0 HB2 SER A 51 8.092 -18.116 -2.697 1.00 0.00 H new ATOM 0 HB3 SER A 51 9.437 -17.756 -1.632 1.00 0.00 H new ATOM 0 HG SER A 51 8.225 -16.090 -0.677 1.00 0.00 H new ATOM 804 N ASP A 52 10.138 -18.130 -4.684 1.00 0.00 N ATOM 805 CA ASP A 52 10.532 -18.905 -5.867 1.00 0.00 C ATOM 806 C ASP A 52 9.429 -18.948 -6.930 1.00 0.00 C ATOM 807 O ASP A 52 9.650 -18.541 -8.074 1.00 0.00 O ATOM 808 CB ASP A 52 10.941 -20.308 -5.394 1.00 0.00 C ATOM 809 CG ASP A 52 11.938 -20.988 -6.322 1.00 0.00 C ATOM 810 OD1 ASP A 52 11.777 -20.937 -7.563 1.00 0.00 O ATOM 811 OD2 ASP A 52 12.894 -21.600 -5.800 1.00 0.00 O ATOM 0 H ASP A 52 10.543 -18.521 -3.833 1.00 0.00 H new ATOM 0 HA ASP A 52 11.376 -18.421 -6.358 1.00 0.00 H new ATOM 0 HB2 ASP A 52 11.374 -20.236 -4.396 1.00 0.00 H new ATOM 0 HB3 ASP A 52 10.050 -20.930 -5.310 1.00 0.00 H new ATOM 816 N ASN A 53 8.222 -19.371 -6.551 1.00 0.00 N ATOM 817 CA ASN A 53 7.019 -19.341 -7.381 1.00 0.00 C ATOM 818 C ASN A 53 5.836 -19.185 -6.415 1.00 0.00 C ATOM 819 O ASN A 53 4.850 -19.929 -6.470 1.00 0.00 O ATOM 820 CB ASN A 53 6.909 -20.556 -8.326 1.00 0.00 C ATOM 821 CG ASN A 53 5.889 -20.333 -9.449 1.00 0.00 C ATOM 822 OD1 ASN A 53 6.239 -20.203 -10.621 1.00 0.00 O ATOM 823 ND2 ASN A 53 4.606 -20.270 -9.141 1.00 0.00 N ATOM 0 H ASN A 53 8.050 -19.758 -5.623 1.00 0.00 H new ATOM 0 HA ASN A 53 7.041 -18.502 -8.076 1.00 0.00 H new ATOM 0 HB2 ASN A 53 7.886 -20.763 -8.762 1.00 0.00 H new ATOM 0 HB3 ASN A 53 6.624 -21.436 -7.750 1.00 0.00 H new ATOM 0 HD21 ASN A 53 3.913 -20.114 -9.873 1.00 0.00 H new ATOM 0 HD22 ASN A 53 4.308 -20.377 -8.171 1.00 0.00 H new ATOM 830 N ALA A 54 5.940 -18.264 -5.456 1.00 0.00 N ATOM 831 CA ALA A 54 4.858 -17.950 -4.537 1.00 0.00 C ATOM 832 C ALA A 54 4.865 -16.455 -4.298 1.00 0.00 C ATOM 833 O ALA A 54 5.858 -15.784 -4.570 1.00 0.00 O ATOM 834 CB ALA A 54 5.033 -18.711 -3.214 1.00 0.00 C ATOM 0 H ALA A 54 6.785 -17.714 -5.298 1.00 0.00 H new ATOM 0 HA ALA A 54 3.903 -18.256 -4.965 1.00 0.00 H new ATOM 0 HB1 ALA A 54 4.213 -18.462 -2.540 1.00 0.00 H new ATOM 0 HB2 ALA A 54 5.031 -19.784 -3.408 1.00 0.00 H new ATOM 0 HB3 ALA A 54 5.980 -18.428 -2.754 1.00 0.00 H new ATOM 840 N VAL A 55 3.759 -15.932 -3.793 1.00 0.00 N ATOM 841 CA VAL A 55 3.657 -14.550 -3.387 1.00 0.00 C ATOM 842 C VAL A 55 2.926 -14.554 -2.048 1.00 0.00 C ATOM 843 O VAL A 55 1.705 -14.685 -1.997 1.00 0.00 O ATOM 844 CB VAL A 55 2.999 -13.686 -4.482 1.00 0.00 C ATOM 845 CG1 VAL A 55 2.961 -12.240 -3.997 1.00 0.00 C ATOM 846 CG2 VAL A 55 3.799 -13.656 -5.796 1.00 0.00 C ATOM 0 H VAL A 55 2.901 -16.466 -3.654 1.00 0.00 H new ATOM 0 HA VAL A 55 4.633 -14.083 -3.254 1.00 0.00 H new ATOM 0 HB VAL A 55 2.016 -14.120 -4.667 1.00 0.00 H new ATOM 0 HG11 VAL A 55 2.498 -11.613 -4.759 1.00 0.00 H new ATOM 0 HG12 VAL A 55 2.381 -12.180 -3.076 1.00 0.00 H new ATOM 0 HG13 VAL A 55 3.977 -11.893 -3.809 1.00 0.00 H new ATOM 0 HG21 VAL A 55 3.281 -13.031 -6.523 1.00 0.00 H new ATOM 0 HG22 VAL A 55 4.792 -13.247 -5.608 1.00 0.00 H new ATOM 0 HG23 VAL A 55 3.892 -14.669 -6.189 1.00 0.00 H new ATOM 856 N CYS A 56 3.671 -14.446 -0.952 1.00 0.00 N ATOM 857 CA CYS A 56 3.082 -14.309 0.364 1.00 0.00 C ATOM 858 C CYS A 56 2.846 -12.821 0.589 1.00 0.00 C ATOM 859 O CYS A 56 3.776 -12.019 0.572 1.00 0.00 O ATOM 860 CB CYS A 56 3.983 -14.924 1.439 1.00 0.00 C ATOM 861 SG CYS A 56 4.057 -16.722 1.197 1.00 0.00 S ATOM 0 H CYS A 56 4.691 -14.451 -0.956 1.00 0.00 H new ATOM 0 HA CYS A 56 2.138 -14.849 0.430 1.00 0.00 H new ATOM 0 HB2 CYS A 56 4.984 -14.496 1.381 1.00 0.00 H new ATOM 0 HB3 CYS A 56 3.595 -14.694 2.431 1.00 0.00 H new ATOM 0 HG CYS A 56 4.822 -17.251 2.105 1.00 0.00 H new ATOM 867 N LEU A 57 1.592 -12.426 0.756 1.00 0.00 N ATOM 868 CA LEU A 57 1.224 -11.068 1.111 1.00 0.00 C ATOM 869 C LEU A 57 1.232 -10.988 2.626 1.00 0.00 C ATOM 870 O LEU A 57 0.364 -11.547 3.296 1.00 0.00 O ATOM 871 CB LEU A 57 -0.115 -10.672 0.469 1.00 0.00 C ATOM 872 CG LEU A 57 0.183 -10.025 -0.893 1.00 0.00 C ATOM 873 CD1 LEU A 57 -1.050 -9.944 -1.783 1.00 0.00 C ATOM 874 CD2 LEU A 57 0.728 -8.600 -0.758 1.00 0.00 C ATOM 0 H LEU A 57 0.793 -13.050 0.647 1.00 0.00 H new ATOM 0 HA LEU A 57 1.936 -10.341 0.720 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -0.751 -11.548 0.343 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -0.654 -9.976 1.111 1.00 0.00 H new ATOM 0 HG LEU A 57 0.932 -10.676 -1.344 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -0.784 -9.479 -2.732 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -1.433 -10.948 -1.966 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -1.817 -9.347 -1.289 1.00 0.00 H new ATOM 0 HD21 LEU A 57 0.922 -8.189 -1.749 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -0.004 -7.978 -0.244 1.00 0.00 H new ATOM 0 HD23 LEU A 57 1.655 -8.618 -0.185 1.00 0.00 H new ATOM 886 N HIS A 58 2.269 -10.351 3.160 1.00 0.00 N ATOM 887 CA HIS A 58 2.460 -10.111 4.577 1.00 0.00 C ATOM 888 C HIS A 58 1.487 -9.007 4.973 1.00 0.00 C ATOM 889 O HIS A 58 1.794 -7.825 4.824 1.00 0.00 O ATOM 890 CB HIS A 58 3.931 -9.744 4.811 1.00 0.00 C ATOM 891 CG HIS A 58 4.914 -10.890 4.681 1.00 0.00 C ATOM 892 ND1 HIS A 58 5.792 -11.305 5.662 1.00 0.00 N ATOM 893 CD2 HIS A 58 5.176 -11.625 3.555 1.00 0.00 C ATOM 894 CE1 HIS A 58 6.567 -12.269 5.130 1.00 0.00 C ATOM 895 NE2 HIS A 58 6.195 -12.511 3.859 1.00 0.00 N ATOM 0 H HIS A 58 3.027 -9.975 2.590 1.00 0.00 H new ATOM 0 HA HIS A 58 2.253 -10.985 5.195 1.00 0.00 H new ATOM 0 HB2 HIS A 58 4.211 -8.965 4.102 1.00 0.00 H new ATOM 0 HB3 HIS A 58 4.027 -9.316 5.809 1.00 0.00 H new ATOM 0 HD1 HIS A 58 5.844 -10.947 6.616 1.00 0.00 H new ATOM 0 HD2 HIS A 58 4.677 -11.530 2.602 1.00 0.00 H new ATOM 0 HE1 HIS A 58 7.369 -12.774 5.647 1.00 0.00 H new ATOM 904 N LEU A 59 0.280 -9.385 5.391 1.00 0.00 N ATOM 905 CA LEU A 59 -0.808 -8.462 5.688 1.00 0.00 C ATOM 906 C LEU A 59 -0.692 -8.026 7.131 1.00 0.00 C ATOM 907 O LEU A 59 -0.602 -8.877 8.017 1.00 0.00 O ATOM 908 CB LEU A 59 -2.155 -9.148 5.427 1.00 0.00 C ATOM 909 CG LEU A 59 -3.360 -8.183 5.522 1.00 0.00 C ATOM 910 CD1 LEU A 59 -4.133 -8.106 4.206 1.00 0.00 C ATOM 911 CD2 LEU A 59 -4.361 -8.657 6.571 1.00 0.00 C ATOM 0 H LEU A 59 0.028 -10.363 5.535 1.00 0.00 H new ATOM 0 HA LEU A 59 -0.747 -7.584 5.045 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -2.138 -9.601 4.436 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -2.288 -9.957 6.145 1.00 0.00 H new ATOM 0 HG LEU A 59 -2.939 -7.211 5.780 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -4.971 -7.418 4.316 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -3.472 -7.750 3.416 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -4.508 -9.096 3.946 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -5.198 -7.960 6.617 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -4.728 -9.648 6.302 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -3.873 -8.703 7.545 1.00 0.00 H new ATOM 923 N ARG A 60 -0.706 -6.711 7.364 1.00 0.00 N ATOM 924 CA ARG A 60 -0.525 -6.154 8.695 1.00 0.00 C ATOM 925 C ARG A 60 -1.460 -6.836 9.667 1.00 0.00 C ATOM 926 O ARG A 60 -2.672 -6.873 9.441 1.00 0.00 O ATOM 927 CB ARG A 60 -0.758 -4.640 8.730 1.00 0.00 C ATOM 928 CG ARG A 60 0.515 -3.842 8.426 1.00 0.00 C ATOM 929 CD ARG A 60 1.496 -3.847 9.615 1.00 0.00 C ATOM 930 NE ARG A 60 2.323 -2.628 9.600 1.00 0.00 N ATOM 931 CZ ARG A 60 2.080 -1.503 10.285 1.00 0.00 C ATOM 932 NH1 ARG A 60 1.087 -1.416 11.170 1.00 0.00 N ATOM 933 NH2 ARG A 60 2.816 -0.431 10.038 1.00 0.00 N ATOM 0 H ARG A 60 -0.843 -6.011 6.635 1.00 0.00 H new ATOM 0 HA ARG A 60 0.511 -6.332 8.984 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -1.529 -4.378 8.005 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -1.135 -4.356 9.713 1.00 0.00 H new ATOM 0 HG2 ARG A 60 1.006 -4.263 7.549 1.00 0.00 H new ATOM 0 HG3 ARG A 60 0.249 -2.814 8.180 1.00 0.00 H new ATOM 0 HD2 ARG A 60 0.942 -3.908 10.552 1.00 0.00 H new ATOM 0 HD3 ARG A 60 2.135 -4.729 9.565 1.00 0.00 H new ATOM 0 HE ARG A 60 3.158 -2.642 9.014 1.00 0.00 H new ATOM 0 HH11 ARG A 60 0.485 -2.221 11.342 1.00 0.00 H new ATOM 0 HH12 ARG A 60 0.929 -0.544 11.675 1.00 0.00 H new ATOM 0 HH21 ARG A 60 3.554 -0.470 9.335 1.00 0.00 H new ATOM 0 HH22 ARG A 60 2.645 0.434 10.550 1.00 0.00 H new ATOM 947 N SER A 61 -0.903 -7.300 10.780 1.00 0.00 N ATOM 948 CA SER A 61 -1.666 -7.859 11.879 1.00 0.00 C ATOM 949 C SER A 61 -2.728 -6.839 12.328 1.00 0.00 C ATOM 950 O SER A 61 -3.837 -7.223 12.700 1.00 0.00 O ATOM 951 CB SER A 61 -0.675 -8.242 12.985 1.00 0.00 C ATOM 952 OG SER A 61 -1.301 -9.032 13.964 1.00 0.00 O ATOM 0 H SER A 61 0.104 -7.296 10.942 1.00 0.00 H new ATOM 0 HA SER A 61 -2.210 -8.759 11.592 1.00 0.00 H new ATOM 0 HB2 SER A 61 0.165 -8.787 12.554 1.00 0.00 H new ATOM 0 HB3 SER A 61 -0.269 -7.341 13.444 1.00 0.00 H new ATOM 0 HG SER A 61 -0.652 -9.267 14.659 1.00 0.00 H new ATOM 958 N SER A 62 -2.460 -5.539 12.136 1.00 0.00 N ATOM 959 CA SER A 62 -3.334 -4.411 12.438 1.00 0.00 C ATOM 960 C SER A 62 -4.687 -4.503 11.720 1.00 0.00 C ATOM 961 O SER A 62 -5.668 -3.904 12.162 1.00 0.00 O ATOM 962 CB SER A 62 -2.616 -3.116 12.009 1.00 0.00 C ATOM 963 OG SER A 62 -1.217 -3.160 12.270 1.00 0.00 O ATOM 0 H SER A 62 -1.570 -5.235 11.741 1.00 0.00 H new ATOM 0 HA SER A 62 -3.540 -4.419 13.508 1.00 0.00 H new ATOM 0 HB2 SER A 62 -2.779 -2.949 10.944 1.00 0.00 H new ATOM 0 HB3 SER A 62 -3.055 -2.269 12.536 1.00 0.00 H new ATOM 0 HG SER A 62 -0.948 -2.348 12.748 1.00 0.00 H new ATOM 969 N GLN A 63 -4.731 -5.247 10.613 1.00 0.00 N ATOM 970 CA GLN A 63 -5.871 -5.421 9.727 1.00 0.00 C ATOM 971 C GLN A 63 -6.085 -6.904 9.385 1.00 0.00 C ATOM 972 O GLN A 63 -6.724 -7.211 8.374 1.00 0.00 O ATOM 973 CB GLN A 63 -5.673 -4.545 8.473 1.00 0.00 C ATOM 974 CG GLN A 63 -5.788 -3.034 8.741 1.00 0.00 C ATOM 975 CD GLN A 63 -7.158 -2.610 9.279 1.00 0.00 C ATOM 976 OE1 GLN A 63 -8.204 -2.941 8.723 1.00 0.00 O ATOM 977 NE2 GLN A 63 -7.196 -1.822 10.339 1.00 0.00 N ATOM 0 H GLN A 63 -3.918 -5.775 10.296 1.00 0.00 H new ATOM 0 HA GLN A 63 -6.782 -5.094 10.229 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -4.692 -4.754 8.047 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -6.413 -4.828 7.724 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -5.019 -2.741 9.456 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -5.587 -2.493 7.816 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -6.329 -1.547 10.801 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -8.092 -1.489 10.695 1.00 0.00 H new ATOM 986 N ARG A 64 -5.644 -7.847 10.236 1.00 0.00 N ATOM 987 CA ARG A 64 -5.747 -9.287 9.945 1.00 0.00 C ATOM 988 C ARG A 64 -7.199 -9.703 9.711 1.00 0.00 C ATOM 989 O ARG A 64 -7.425 -10.665 8.980 1.00 0.00 O ATOM 990 CB ARG A 64 -5.123 -10.114 11.095 1.00 0.00 C ATOM 991 CG ARG A 64 -5.398 -11.633 10.997 1.00 0.00 C ATOM 992 CD ARG A 64 -4.746 -12.421 12.134 1.00 0.00 C ATOM 993 NE ARG A 64 -5.235 -13.811 12.203 1.00 0.00 N ATOM 994 CZ ARG A 64 -4.981 -14.665 13.203 1.00 0.00 C ATOM 995 NH1 ARG A 64 -4.059 -14.391 14.111 1.00 0.00 N ATOM 996 NH2 ARG A 64 -5.648 -15.808 13.291 1.00 0.00 N ATOM 0 H ARG A 64 -5.211 -7.636 11.135 1.00 0.00 H new ATOM 0 HA ARG A 64 -5.192 -9.486 9.028 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -4.045 -9.950 11.104 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -5.509 -9.746 12.045 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -6.474 -11.806 11.010 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -5.027 -12.005 10.042 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -3.665 -12.425 11.997 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -4.946 -11.920 13.081 1.00 0.00 H new ATOM 0 HE ARG A 64 -5.810 -14.147 11.431 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -3.531 -13.520 14.055 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -3.876 -15.051 14.867 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -6.357 -16.039 12.596 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -5.452 -16.456 14.054 1.00 0.00 H new ATOM 1010 N HIS A 65 -8.194 -8.969 10.214 1.00 0.00 N ATOM 1011 CA HIS A 65 -9.592 -9.282 9.960 1.00 0.00 C ATOM 1012 C HIS A 65 -9.973 -9.300 8.473 1.00 0.00 C ATOM 1013 O HIS A 65 -11.002 -9.898 8.151 1.00 0.00 O ATOM 1014 CB HIS A 65 -10.498 -8.323 10.741 1.00 0.00 C ATOM 1015 CG HIS A 65 -11.844 -8.948 10.968 1.00 0.00 C ATOM 1016 ND1 HIS A 65 -12.988 -8.752 10.218 1.00 0.00 N ATOM 1017 CD2 HIS A 65 -12.087 -9.941 11.873 1.00 0.00 C ATOM 1018 CE1 HIS A 65 -13.912 -9.615 10.678 1.00 0.00 C ATOM 1019 NE2 HIS A 65 -13.397 -10.330 11.699 1.00 0.00 N ATOM 0 H HIS A 65 -8.050 -8.149 10.803 1.00 0.00 H new ATOM 0 HA HIS A 65 -9.742 -10.303 10.311 1.00 0.00 H new ATOM 0 HB2 HIS A 65 -10.038 -8.075 11.698 1.00 0.00 H new ATOM 0 HB3 HIS A 65 -10.611 -7.389 10.191 1.00 0.00 H new ATOM 0 HD2 HIS A 65 -11.386 -10.344 12.589 1.00 0.00 H new ATOM 0 HE1 HIS A 65 -14.914 -9.719 10.289 1.00 0.00 H new ATOM 0 HE2 HIS A 65 -13.891 -11.035 12.246 1.00 0.00 H new ATOM 1028 N LEU A 66 -9.213 -8.676 7.562 1.00 0.00 N ATOM 1029 CA LEU A 66 -9.510 -8.763 6.128 1.00 0.00 C ATOM 1030 C LEU A 66 -8.850 -9.985 5.476 1.00 0.00 C ATOM 1031 O LEU A 66 -9.142 -10.277 4.320 1.00 0.00 O ATOM 1032 CB LEU A 66 -9.132 -7.479 5.358 1.00 0.00 C ATOM 1033 CG LEU A 66 -9.884 -6.171 5.681 1.00 0.00 C ATOM 1034 CD1 LEU A 66 -11.338 -6.398 6.106 1.00 0.00 C ATOM 1035 CD2 LEU A 66 -9.175 -5.348 6.756 1.00 0.00 C ATOM 0 H LEU A 66 -8.395 -8.111 7.791 1.00 0.00 H new ATOM 0 HA LEU A 66 -10.592 -8.879 6.062 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -8.069 -7.298 5.520 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -9.262 -7.681 4.295 1.00 0.00 H new ATOM 0 HG LEU A 66 -9.887 -5.615 4.743 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -11.809 -5.438 6.319 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -11.878 -6.897 5.302 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -11.363 -7.020 7.001 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -9.741 -4.437 6.949 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -9.103 -5.932 7.673 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -8.174 -5.087 6.413 1.00 0.00 H new ATOM 1047 N ASN A 67 -7.972 -10.715 6.172 1.00 0.00 N ATOM 1048 CA ASN A 67 -7.403 -11.958 5.659 1.00 0.00 C ATOM 1049 C ASN A 67 -8.478 -13.038 5.709 1.00 0.00 C ATOM 1050 O ASN A 67 -8.621 -13.717 6.731 1.00 0.00 O ATOM 1051 CB ASN A 67 -6.170 -12.399 6.465 1.00 0.00 C ATOM 1052 CG ASN A 67 -5.513 -13.651 5.892 1.00 0.00 C ATOM 1053 OD1 ASN A 67 -6.014 -14.284 4.968 1.00 0.00 O ATOM 1054 ND2 ASN A 67 -4.357 -14.005 6.413 1.00 0.00 N ATOM 0 H ASN A 67 -7.639 -10.459 7.102 1.00 0.00 H new ATOM 0 HA ASN A 67 -7.072 -11.796 4.633 1.00 0.00 H new ATOM 0 HB2 ASN A 67 -5.443 -11.587 6.483 1.00 0.00 H new ATOM 0 HB3 ASN A 67 -6.464 -12.587 7.498 1.00 0.00 H new ATOM 0 HD21 ASN A 67 -3.861 -14.819 6.049 1.00 0.00 H new ATOM 0 HD22 ASN A 67 -3.957 -13.466 7.181 1.00 0.00 H new ATOM 1061 N ASN A 68 -9.244 -13.188 4.631 1.00 0.00 N ATOM 1062 CA ASN A 68 -10.278 -14.203 4.501 1.00 0.00 C ATOM 1063 C ASN A 68 -10.120 -14.953 3.172 1.00 0.00 C ATOM 1064 O ASN A 68 -9.379 -14.520 2.279 1.00 0.00 O ATOM 1065 CB ASN A 68 -11.649 -13.529 4.649 1.00 0.00 C ATOM 1066 CG ASN A 68 -12.184 -13.026 3.320 1.00 0.00 C ATOM 1067 OD1 ASN A 68 -11.601 -12.184 2.660 1.00 0.00 O ATOM 1068 ND2 ASN A 68 -13.278 -13.591 2.869 1.00 0.00 N ATOM 0 H ASN A 68 -9.159 -12.593 3.807 1.00 0.00 H new ATOM 0 HA ASN A 68 -10.186 -14.952 5.288 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -12.356 -14.238 5.079 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -11.569 -12.695 5.346 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -13.650 -13.327 1.957 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -13.757 -14.295 3.431 1.00 0.00 H new ATOM 1075 N ARG A 69 -10.791 -16.100 3.034 1.00 0.00 N ATOM 1076 CA ARG A 69 -10.672 -16.950 1.845 1.00 0.00 C ATOM 1077 C ARG A 69 -11.182 -16.227 0.604 1.00 0.00 C ATOM 1078 O ARG A 69 -10.561 -16.353 -0.453 1.00 0.00 O ATOM 1079 CB ARG A 69 -11.478 -18.257 2.017 1.00 0.00 C ATOM 1080 CG ARG A 69 -10.732 -19.463 2.603 1.00 0.00 C ATOM 1081 CD ARG A 69 -10.109 -19.226 3.980 1.00 0.00 C ATOM 1082 NE ARG A 69 -9.987 -20.490 4.718 1.00 0.00 N ATOM 1083 CZ ARG A 69 -9.569 -20.620 5.979 1.00 0.00 C ATOM 1084 NH1 ARG A 69 -8.970 -19.618 6.604 1.00 0.00 N ATOM 1085 NH2 ARG A 69 -9.756 -21.770 6.609 1.00 0.00 N ATOM 0 H ARG A 69 -11.430 -16.465 3.740 1.00 0.00 H new ATOM 0 HA ARG A 69 -9.615 -17.185 1.723 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -12.335 -18.045 2.657 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -11.872 -18.543 1.042 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -11.425 -20.302 2.673 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -9.944 -19.757 1.909 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -9.126 -18.769 3.866 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -10.723 -18.526 4.547 1.00 0.00 H new ATOM 0 HE ARG A 69 -10.244 -21.344 4.223 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -8.822 -18.731 6.122 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -8.656 -19.733 7.568 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -10.215 -22.545 6.130 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -9.441 -21.881 7.573 1.00 0.00 H new ATOM 1099 N GLY A 70 -12.297 -15.506 0.712 1.00 0.00 N ATOM 1100 CA GLY A 70 -12.930 -14.833 -0.408 1.00 0.00 C ATOM 1101 C GLY A 70 -12.008 -13.780 -1.008 1.00 0.00 C ATOM 1102 O GLY A 70 -11.867 -13.725 -2.235 1.00 0.00 O ATOM 0 H GLY A 70 -12.789 -15.375 1.596 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -13.197 -15.564 -1.171 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -13.857 -14.364 -0.078 1.00 0.00 H new ATOM 1106 N ALA A 71 -11.350 -12.963 -0.172 1.00 0.00 N ATOM 1107 CA ALA A 71 -10.378 -12.015 -0.684 1.00 0.00 C ATOM 1108 C ALA A 71 -9.255 -12.767 -1.377 1.00 0.00 C ATOM 1109 O ALA A 71 -8.950 -12.439 -2.517 1.00 0.00 O ATOM 1110 CB ALA A 71 -9.825 -11.110 0.414 1.00 0.00 C ATOM 0 H ALA A 71 -11.476 -12.946 0.840 1.00 0.00 H new ATOM 0 HA ALA A 71 -10.881 -11.367 -1.402 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -9.101 -10.417 -0.016 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -10.641 -10.547 0.867 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -9.337 -11.718 1.175 1.00 0.00 H new ATOM 1116 N GLN A 72 -8.666 -13.778 -0.723 1.00 0.00 N ATOM 1117 CA GLN A 72 -7.532 -14.518 -1.260 1.00 0.00 C ATOM 1118 C GLN A 72 -7.846 -15.059 -2.644 1.00 0.00 C ATOM 1119 O GLN A 72 -7.015 -14.912 -3.528 1.00 0.00 O ATOM 1120 CB GLN A 72 -7.143 -15.663 -0.301 1.00 0.00 C ATOM 1121 CG GLN A 72 -5.850 -16.422 -0.686 1.00 0.00 C ATOM 1122 CD GLN A 72 -6.031 -17.532 -1.737 1.00 0.00 C ATOM 1123 OE1 GLN A 72 -7.140 -17.980 -2.024 1.00 0.00 O ATOM 1124 NE2 GLN A 72 -4.954 -18.045 -2.303 1.00 0.00 N ATOM 0 H GLN A 72 -8.969 -14.101 0.196 1.00 0.00 H new ATOM 0 HA GLN A 72 -6.686 -13.837 -1.351 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -7.022 -15.253 0.702 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -7.966 -16.376 -0.256 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -5.123 -15.702 -1.062 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -5.424 -16.863 0.215 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -4.031 -17.678 -2.070 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -5.045 -18.808 -2.974 1.00 0.00 H new ATOM 1133 N GLN A 73 -9.022 -15.650 -2.845 1.00 0.00 N ATOM 1134 CA GLN A 73 -9.403 -16.249 -4.112 1.00 0.00 C ATOM 1135 C GLN A 73 -9.428 -15.200 -5.215 1.00 0.00 C ATOM 1136 O GLN A 73 -8.791 -15.354 -6.261 1.00 0.00 O ATOM 1137 CB GLN A 73 -10.784 -16.896 -3.949 1.00 0.00 C ATOM 1138 CG GLN A 73 -10.689 -18.307 -3.375 1.00 0.00 C ATOM 1139 CD GLN A 73 -10.022 -19.307 -4.324 1.00 0.00 C ATOM 1140 OE1 GLN A 73 -9.845 -19.058 -5.517 1.00 0.00 O ATOM 1141 NE2 GLN A 73 -9.612 -20.460 -3.836 1.00 0.00 N ATOM 0 H GLN A 73 -9.740 -15.725 -2.124 1.00 0.00 H new ATOM 0 HA GLN A 73 -8.673 -17.007 -4.395 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -11.399 -16.279 -3.294 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -11.285 -16.931 -4.917 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -10.128 -18.274 -2.441 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -11.691 -18.661 -3.132 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -9.754 -20.676 -2.849 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -9.153 -21.137 -4.445 1.00 0.00 H new ATOM 1150 N LYS A 74 -10.152 -14.108 -4.973 1.00 0.00 N ATOM 1151 CA LYS A 74 -10.310 -13.082 -5.994 1.00 0.00 C ATOM 1152 C LYS A 74 -8.984 -12.347 -6.228 1.00 0.00 C ATOM 1153 O LYS A 74 -8.732 -11.886 -7.346 1.00 0.00 O ATOM 1154 CB LYS A 74 -11.478 -12.170 -5.590 1.00 0.00 C ATOM 1155 CG LYS A 74 -12.028 -11.265 -6.706 1.00 0.00 C ATOM 1156 CD LYS A 74 -12.629 -12.024 -7.906 1.00 0.00 C ATOM 1157 CE LYS A 74 -11.651 -12.343 -9.048 1.00 0.00 C ATOM 1158 NZ LYS A 74 -11.399 -11.176 -9.923 1.00 0.00 N ATOM 0 H LYS A 74 -10.630 -13.915 -4.093 1.00 0.00 H new ATOM 0 HA LYS A 74 -10.563 -13.520 -6.960 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -12.291 -12.793 -5.218 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -11.154 -11.540 -4.761 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -12.793 -10.613 -6.284 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -11.224 -10.622 -7.064 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -13.055 -12.960 -7.544 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -13.452 -11.435 -8.310 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -10.706 -12.688 -8.627 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -12.051 -13.162 -9.646 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -10.734 -11.444 -10.676 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -12.294 -10.861 -10.348 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -10.992 -10.402 -9.361 1.00 0.00 H new ATOM 1172 N LEU A 75 -8.119 -12.252 -5.210 1.00 0.00 N ATOM 1173 CA LEU A 75 -6.776 -11.698 -5.344 1.00 0.00 C ATOM 1174 C LEU A 75 -5.917 -12.689 -6.139 1.00 0.00 C ATOM 1175 O LEU A 75 -5.083 -12.268 -6.933 1.00 0.00 O ATOM 1176 CB LEU A 75 -6.158 -11.465 -3.951 1.00 0.00 C ATOM 1177 CG LEU A 75 -5.297 -10.203 -3.772 1.00 0.00 C ATOM 1178 CD1 LEU A 75 -4.772 -10.230 -2.331 1.00 0.00 C ATOM 1179 CD2 LEU A 75 -4.158 -10.012 -4.780 1.00 0.00 C ATOM 0 H LEU A 75 -8.339 -12.562 -4.263 1.00 0.00 H new ATOM 0 HA LEU A 75 -6.820 -10.742 -5.865 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -6.968 -11.429 -3.223 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -5.545 -12.331 -3.703 1.00 0.00 H new ATOM 0 HG LEU A 75 -5.932 -9.340 -3.972 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -4.152 -9.351 -2.153 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -5.613 -10.228 -1.637 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -4.177 -11.130 -2.177 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -3.622 -9.090 -4.553 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -3.471 -10.856 -4.717 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -4.570 -9.954 -5.788 1.00 0.00 H new ATOM 1191 N ALA A 76 -6.110 -13.998 -5.946 1.00 0.00 N ATOM 1192 CA ALA A 76 -5.298 -15.047 -6.543 1.00 0.00 C ATOM 1193 C ALA A 76 -5.511 -15.054 -8.037 1.00 0.00 C ATOM 1194 O ALA A 76 -4.525 -15.102 -8.761 1.00 0.00 O ATOM 1195 CB ALA A 76 -5.592 -16.426 -5.936 1.00 0.00 C ATOM 0 H ALA A 76 -6.857 -14.360 -5.353 1.00 0.00 H new ATOM 0 HA ALA A 76 -4.251 -14.833 -6.327 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -4.962 -17.176 -6.414 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -5.383 -16.405 -4.866 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -6.640 -16.678 -6.096 1.00 0.00 H new ATOM 1201 N GLU A 77 -6.755 -14.973 -8.513 1.00 0.00 N ATOM 1202 CA GLU A 77 -7.019 -14.849 -9.944 1.00 0.00 C ATOM 1203 C GLU A 77 -6.317 -13.601 -10.498 1.00 0.00 C ATOM 1204 O GLU A 77 -5.746 -13.643 -11.587 1.00 0.00 O ATOM 1205 CB GLU A 77 -8.540 -14.813 -10.194 1.00 0.00 C ATOM 1206 CG GLU A 77 -8.905 -15.055 -11.673 1.00 0.00 C ATOM 1207 CD GLU A 77 -9.621 -16.388 -11.922 1.00 0.00 C ATOM 1208 OE1 GLU A 77 -8.926 -17.418 -12.095 1.00 0.00 O ATOM 1209 OE2 GLU A 77 -10.876 -16.405 -11.974 1.00 0.00 O ATOM 0 H GLU A 77 -7.591 -14.991 -7.929 1.00 0.00 H new ATOM 0 HA GLU A 77 -6.617 -15.715 -10.471 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -9.024 -15.569 -9.576 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -8.933 -13.846 -9.880 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -9.542 -14.241 -12.019 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -7.995 -15.024 -12.272 1.00 0.00 H new ATOM 1216 N ALA A 78 -6.310 -12.496 -9.744 1.00 0.00 N ATOM 1217 CA ALA A 78 -5.697 -11.244 -10.165 1.00 0.00 C ATOM 1218 C ALA A 78 -4.176 -11.388 -10.286 1.00 0.00 C ATOM 1219 O ALA A 78 -3.608 -11.018 -11.315 1.00 0.00 O ATOM 1220 CB ALA A 78 -6.109 -10.120 -9.210 1.00 0.00 C ATOM 0 H ALA A 78 -6.735 -12.452 -8.818 1.00 0.00 H new ATOM 0 HA ALA A 78 -6.058 -10.982 -11.160 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -5.648 -9.185 -9.528 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -7.194 -10.012 -9.221 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -5.779 -10.362 -8.200 1.00 0.00 H new ATOM 1226 N LEU A 79 -3.509 -11.941 -9.268 1.00 0.00 N ATOM 1227 CA LEU A 79 -2.073 -12.193 -9.269 1.00 0.00 C ATOM 1228 C LEU A 79 -1.691 -13.247 -10.315 1.00 0.00 C ATOM 1229 O LEU A 79 -0.658 -13.115 -10.962 1.00 0.00 O ATOM 1230 CB LEU A 79 -1.626 -12.623 -7.857 1.00 0.00 C ATOM 1231 CG LEU A 79 -0.556 -11.690 -7.264 1.00 0.00 C ATOM 1232 CD1 LEU A 79 -0.404 -11.989 -5.777 1.00 0.00 C ATOM 1233 CD2 LEU A 79 0.795 -11.847 -7.972 1.00 0.00 C ATOM 0 H LEU A 79 -3.967 -12.231 -8.404 1.00 0.00 H new ATOM 0 HA LEU A 79 -1.556 -11.273 -9.540 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -2.492 -12.642 -7.196 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -1.234 -13.639 -7.898 1.00 0.00 H new ATOM 0 HG LEU A 79 -0.881 -10.660 -7.410 1.00 0.00 H new ATOM 0 HD11 LEU A 79 0.353 -11.332 -5.349 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -1.356 -11.822 -5.273 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -0.100 -13.027 -5.644 1.00 0.00 H new ATOM 0 HD21 LEU A 79 1.522 -11.171 -7.523 1.00 0.00 H new ATOM 0 HD22 LEU A 79 1.143 -12.875 -7.868 1.00 0.00 H new ATOM 0 HD23 LEU A 79 0.682 -11.608 -9.029 1.00 0.00 H new ATOM 1245 N SER A 80 -2.526 -14.267 -10.517 1.00 0.00 N ATOM 1246 CA SER A 80 -2.313 -15.313 -11.517 1.00 0.00 C ATOM 1247 C SER A 80 -2.416 -14.736 -12.936 1.00 0.00 C ATOM 1248 O SER A 80 -1.712 -15.179 -13.842 1.00 0.00 O ATOM 1249 CB SER A 80 -3.349 -16.419 -11.320 1.00 0.00 C ATOM 1250 OG SER A 80 -3.225 -16.981 -10.026 1.00 0.00 O ATOM 0 H SER A 80 -3.385 -14.391 -9.980 1.00 0.00 H new ATOM 0 HA SER A 80 -1.312 -15.726 -11.391 1.00 0.00 H new ATOM 0 HB2 SER A 80 -4.353 -16.015 -11.454 1.00 0.00 H new ATOM 0 HB3 SER A 80 -3.213 -17.193 -12.075 1.00 0.00 H new ATOM 0 HG SER A 80 -3.384 -16.288 -9.352 1.00 0.00 H new ATOM 1256 N MET A 81 -3.278 -13.735 -13.145 1.00 0.00 N ATOM 1257 CA MET A 81 -3.399 -13.003 -14.401 1.00 0.00 C ATOM 1258 C MET A 81 -2.195 -12.081 -14.581 1.00 0.00 C ATOM 1259 O MET A 81 -1.641 -12.008 -15.676 1.00 0.00 O ATOM 1260 CB MET A 81 -4.740 -12.247 -14.398 1.00 0.00 C ATOM 1261 CG MET A 81 -4.938 -11.231 -15.527 1.00 0.00 C ATOM 1262 SD MET A 81 -5.033 -11.880 -17.205 1.00 0.00 S ATOM 1263 CE MET A 81 -5.697 -10.396 -18.003 1.00 0.00 C ATOM 0 H MET A 81 -3.924 -13.407 -12.426 1.00 0.00 H new ATOM 0 HA MET A 81 -3.399 -13.682 -15.254 1.00 0.00 H new ATOM 0 HB2 MET A 81 -5.547 -12.978 -14.448 1.00 0.00 H new ATOM 0 HB3 MET A 81 -4.839 -11.727 -13.445 1.00 0.00 H new ATOM 0 HG2 MET A 81 -5.854 -10.676 -15.326 1.00 0.00 H new ATOM 0 HG3 MET A 81 -4.117 -10.516 -15.487 1.00 0.00 H new ATOM 0 HE1 MET A 81 -5.834 -10.586 -19.068 1.00 0.00 H new ATOM 0 HE2 MET A 81 -6.656 -10.140 -17.554 1.00 0.00 H new ATOM 0 HE3 MET A 81 -5.001 -9.568 -17.869 1.00 0.00 H new ATOM 1273 N LEU A 82 -1.757 -11.412 -13.511 1.00 0.00 N ATOM 1274 CA LEU A 82 -0.615 -10.503 -13.510 1.00 0.00 C ATOM 1275 C LEU A 82 0.654 -11.254 -13.901 1.00 0.00 C ATOM 1276 O LEU A 82 1.351 -10.846 -14.827 1.00 0.00 O ATOM 1277 CB LEU A 82 -0.481 -9.875 -12.115 1.00 0.00 C ATOM 1278 CG LEU A 82 0.699 -8.904 -11.938 1.00 0.00 C ATOM 1279 CD1 LEU A 82 0.440 -7.595 -12.681 1.00 0.00 C ATOM 1280 CD2 LEU A 82 0.903 -8.593 -10.452 1.00 0.00 C ATOM 0 H LEU A 82 -2.202 -11.492 -12.597 1.00 0.00 H new ATOM 0 HA LEU A 82 -0.769 -9.710 -14.242 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -1.404 -9.344 -11.884 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -0.383 -10.676 -11.383 1.00 0.00 H new ATOM 0 HG LEU A 82 1.590 -9.380 -12.347 1.00 0.00 H new ATOM 0 HD11 LEU A 82 1.287 -6.924 -12.542 1.00 0.00 H new ATOM 0 HD12 LEU A 82 0.310 -7.799 -13.744 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -0.462 -7.126 -12.289 1.00 0.00 H new ATOM 0 HD21 LEU A 82 1.740 -7.905 -10.336 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -0.001 -8.136 -10.048 1.00 0.00 H new ATOM 0 HD23 LEU A 82 1.115 -9.516 -9.913 1.00 0.00 H new ATOM 1292 N LYS A 83 0.946 -12.346 -13.194 1.00 0.00 N ATOM 1293 CA LYS A 83 2.079 -13.227 -13.460 1.00 0.00 C ATOM 1294 C LYS A 83 1.880 -13.998 -14.771 1.00 0.00 C ATOM 1295 O LYS A 83 2.854 -14.444 -15.371 1.00 0.00 O ATOM 1296 CB LYS A 83 2.202 -14.183 -12.258 1.00 0.00 C ATOM 1297 CG LYS A 83 3.518 -14.973 -12.162 1.00 0.00 C ATOM 1298 CD LYS A 83 4.642 -14.265 -11.385 1.00 0.00 C ATOM 1299 CE LYS A 83 5.416 -13.261 -12.245 1.00 0.00 C ATOM 1300 NZ LYS A 83 6.575 -12.698 -11.525 1.00 0.00 N ATOM 0 H LYS A 83 0.384 -12.649 -12.399 1.00 0.00 H new ATOM 0 HA LYS A 83 2.996 -12.650 -13.580 1.00 0.00 H new ATOM 0 HB2 LYS A 83 2.081 -13.603 -11.343 1.00 0.00 H new ATOM 0 HB3 LYS A 83 1.376 -14.893 -12.297 1.00 0.00 H new ATOM 0 HG2 LYS A 83 3.315 -15.932 -11.686 1.00 0.00 H new ATOM 0 HG3 LYS A 83 3.872 -15.186 -13.171 1.00 0.00 H new ATOM 0 HD2 LYS A 83 4.214 -13.747 -10.527 1.00 0.00 H new ATOM 0 HD3 LYS A 83 5.334 -15.011 -10.995 1.00 0.00 H new ATOM 0 HE2 LYS A 83 5.758 -13.751 -13.156 1.00 0.00 H new ATOM 0 HE3 LYS A 83 4.750 -12.453 -12.548 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 7.072 -12.023 -12.141 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 6.247 -12.208 -10.668 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 7.224 -13.466 -11.258 1.00 0.00 H new ATOM 1314 N GLY A 84 0.632 -14.197 -15.199 1.00 0.00 N ATOM 1315 CA GLY A 84 0.268 -15.000 -16.356 1.00 0.00 C ATOM 1316 C GLY A 84 0.309 -16.506 -16.078 1.00 0.00 C ATOM 1317 O GLY A 84 -0.134 -17.295 -16.917 1.00 0.00 O ATOM 0 H GLY A 84 -0.176 -13.788 -14.730 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -0.735 -14.724 -16.682 1.00 0.00 H new ATOM 0 HA3 GLY A 84 0.945 -14.770 -17.178 1.00 0.00 H new ATOM 1321 N SER A 85 0.778 -16.920 -14.905 1.00 0.00 N ATOM 1322 CA SER A 85 1.002 -18.301 -14.515 1.00 0.00 C ATOM 1323 C SER A 85 0.485 -18.508 -13.092 1.00 0.00 C ATOM 1324 O SER A 85 0.055 -17.562 -12.429 1.00 0.00 O ATOM 1325 CB SER A 85 2.504 -18.594 -14.636 1.00 0.00 C ATOM 1326 OG SER A 85 2.909 -18.525 -15.993 1.00 0.00 O ATOM 0 H SER A 85 1.024 -16.263 -14.164 1.00 0.00 H new ATOM 0 HA SER A 85 0.463 -18.993 -15.162 1.00 0.00 H new ATOM 0 HB2 SER A 85 3.071 -17.876 -14.043 1.00 0.00 H new ATOM 0 HB3 SER A 85 2.722 -19.583 -14.234 1.00 0.00 H new ATOM 0 HG SER A 85 3.869 -18.712 -16.058 1.00 0.00 H new ATOM 1332 N THR A 86 0.502 -19.755 -12.637 1.00 0.00 N ATOM 1333 CA THR A 86 0.045 -20.161 -11.321 1.00 0.00 C ATOM 1334 C THR A 86 0.918 -19.491 -10.260 1.00 0.00 C ATOM 1335 O THR A 86 2.148 -19.544 -10.350 1.00 0.00 O ATOM 1336 CB THR A 86 0.127 -21.695 -11.224 1.00 0.00 C ATOM 1337 OG1 THR A 86 -0.414 -22.286 -12.393 1.00 0.00 O ATOM 1338 CG2 THR A 86 -0.622 -22.240 -10.008 1.00 0.00 C ATOM 0 H THR A 86 0.847 -20.535 -13.196 1.00 0.00 H new ATOM 0 HA THR A 86 -0.988 -19.855 -11.156 1.00 0.00 H new ATOM 0 HB THR A 86 1.182 -21.949 -11.119 1.00 0.00 H new ATOM 0 HG1 THR A 86 -0.356 -23.262 -12.323 1.00 0.00 H new ATOM 0 HG21 THR A 86 -0.535 -23.326 -9.984 1.00 0.00 H new ATOM 0 HG22 THR A 86 -0.192 -21.821 -9.098 1.00 0.00 H new ATOM 0 HG23 THR A 86 -1.674 -21.962 -10.074 1.00 0.00 H new ATOM 1346 N VAL A 87 0.298 -18.892 -9.243 1.00 0.00 N ATOM 1347 CA VAL A 87 0.996 -18.314 -8.103 1.00 0.00 C ATOM 1348 C VAL A 87 0.413 -18.880 -6.807 1.00 0.00 C ATOM 1349 O VAL A 87 -0.801 -19.060 -6.689 1.00 0.00 O ATOM 1350 CB VAL A 87 0.866 -16.772 -8.149 1.00 0.00 C ATOM 1351 CG1 VAL A 87 1.504 -16.099 -6.924 1.00 0.00 C ATOM 1352 CG2 VAL A 87 1.532 -16.176 -9.396 1.00 0.00 C ATOM 0 H VAL A 87 -0.716 -18.795 -9.191 1.00 0.00 H new ATOM 0 HA VAL A 87 2.055 -18.571 -8.142 1.00 0.00 H new ATOM 0 HB VAL A 87 -0.206 -16.577 -8.165 1.00 0.00 H new ATOM 0 HG11 VAL A 87 1.388 -15.018 -7.001 1.00 0.00 H new ATOM 0 HG12 VAL A 87 1.013 -16.453 -6.017 1.00 0.00 H new ATOM 0 HG13 VAL A 87 2.564 -16.348 -6.883 1.00 0.00 H new ATOM 0 HG21 VAL A 87 1.417 -15.092 -9.387 1.00 0.00 H new ATOM 0 HG22 VAL A 87 2.592 -16.428 -9.398 1.00 0.00 H new ATOM 0 HG23 VAL A 87 1.061 -16.584 -10.290 1.00 0.00 H new ATOM 1362 N GLU A 88 1.286 -19.190 -5.847 1.00 0.00 N ATOM 1363 CA GLU A 88 0.901 -19.593 -4.504 1.00 0.00 C ATOM 1364 C GLU A 88 0.713 -18.262 -3.794 1.00 0.00 C ATOM 1365 O GLU A 88 1.663 -17.705 -3.251 1.00 0.00 O ATOM 1366 CB GLU A 88 1.992 -20.453 -3.843 1.00 0.00 C ATOM 1367 CG GLU A 88 1.798 -21.954 -4.064 1.00 0.00 C ATOM 1368 CD GLU A 88 0.872 -22.506 -2.975 1.00 0.00 C ATOM 1369 OE1 GLU A 88 1.219 -22.395 -1.773 1.00 0.00 O ATOM 1370 OE2 GLU A 88 -0.207 -23.049 -3.298 1.00 0.00 O ATOM 0 H GLU A 88 2.296 -19.166 -5.989 1.00 0.00 H new ATOM 0 HA GLU A 88 0.008 -20.217 -4.476 1.00 0.00 H new ATOM 0 HB2 GLU A 88 2.965 -20.158 -4.236 1.00 0.00 H new ATOM 0 HB3 GLU A 88 2.006 -20.250 -2.772 1.00 0.00 H new ATOM 0 HG2 GLU A 88 1.370 -22.137 -5.050 1.00 0.00 H new ATOM 0 HG3 GLU A 88 2.760 -22.466 -4.034 1.00 0.00 H new ATOM 1377 N LEU A 89 -0.481 -17.685 -3.913 1.00 0.00 N ATOM 1378 CA LEU A 89 -0.805 -16.442 -3.242 1.00 0.00 C ATOM 1379 C LEU A 89 -1.241 -16.793 -1.832 1.00 0.00 C ATOM 1380 O LEU A 89 -2.345 -17.311 -1.649 1.00 0.00 O ATOM 1381 CB LEU A 89 -1.868 -15.653 -4.009 1.00 0.00 C ATOM 1382 CG LEU A 89 -2.474 -14.511 -3.169 1.00 0.00 C ATOM 1383 CD1 LEU A 89 -1.516 -13.548 -2.472 1.00 0.00 C ATOM 1384 CD2 LEU A 89 -3.342 -13.661 -4.077 1.00 0.00 C ATOM 0 H LEU A 89 -1.242 -18.068 -4.475 1.00 0.00 H new ATOM 0 HA LEU A 89 0.064 -15.785 -3.202 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -1.425 -15.238 -4.915 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -2.662 -16.330 -4.323 1.00 0.00 H new ATOM 0 HG LEU A 89 -2.996 -15.036 -2.369 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -2.088 -12.801 -1.921 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -0.882 -14.103 -1.780 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -0.893 -13.052 -3.216 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -3.781 -12.846 -3.502 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -2.733 -13.250 -4.882 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -4.137 -14.275 -4.500 1.00 0.00 H new ATOM 1396 N THR A 90 -0.403 -16.538 -0.844 1.00 0.00 N ATOM 1397 CA THR A 90 -0.769 -16.718 0.551 1.00 0.00 C ATOM 1398 C THR A 90 -0.975 -15.327 1.134 1.00 0.00 C ATOM 1399 O THR A 90 -0.393 -14.354 0.661 1.00 0.00 O ATOM 1400 CB THR A 90 0.352 -17.461 1.291 1.00 0.00 C ATOM 1401 OG1 THR A 90 0.869 -18.499 0.484 1.00 0.00 O ATOM 1402 CG2 THR A 90 -0.118 -18.082 2.606 1.00 0.00 C ATOM 0 H THR A 90 0.549 -16.201 -0.984 1.00 0.00 H new ATOM 0 HA THR A 90 -1.677 -17.312 0.653 1.00 0.00 H new ATOM 0 HB THR A 90 1.115 -16.714 1.510 1.00 0.00 H new ATOM 0 HG1 THR A 90 1.584 -18.964 0.967 1.00 0.00 H new ATOM 0 HG21 THR A 90 0.716 -18.594 3.085 1.00 0.00 H new ATOM 0 HG22 THR A 90 -0.490 -17.298 3.266 1.00 0.00 H new ATOM 0 HG23 THR A 90 -0.916 -18.797 2.406 1.00 0.00 H new ATOM 1410 N ILE A 91 -1.793 -15.209 2.167 1.00 0.00 N ATOM 1411 CA ILE A 91 -1.981 -13.981 2.913 1.00 0.00 C ATOM 1412 C ILE A 91 -1.594 -14.421 4.314 1.00 0.00 C ATOM 1413 O ILE A 91 -2.291 -15.232 4.928 1.00 0.00 O ATOM 1414 CB ILE A 91 -3.409 -13.424 2.807 1.00 0.00 C ATOM 1415 CG1 ILE A 91 -3.829 -13.234 1.337 1.00 0.00 C ATOM 1416 CG2 ILE A 91 -3.480 -12.078 3.558 1.00 0.00 C ATOM 1417 CD1 ILE A 91 -5.310 -12.894 1.224 1.00 0.00 C ATOM 0 H ILE A 91 -2.357 -15.984 2.516 1.00 0.00 H new ATOM 0 HA ILE A 91 -1.391 -13.142 2.546 1.00 0.00 H new ATOM 0 HB ILE A 91 -4.098 -14.139 3.257 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -3.236 -12.438 0.887 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -3.619 -14.145 0.776 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -4.490 -11.675 3.488 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -3.223 -12.232 4.606 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -2.777 -11.375 3.111 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -5.575 -12.766 0.174 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -5.903 -13.703 1.652 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -5.513 -11.970 1.765 1.00 0.00 H new ATOM 1429 N VAL A 92 -0.438 -13.965 4.771 1.00 0.00 N ATOM 1430 CA VAL A 92 0.090 -14.288 6.085 1.00 0.00 C ATOM 1431 C VAL A 92 -0.154 -13.054 6.955 1.00 0.00 C ATOM 1432 O VAL A 92 -0.499 -11.990 6.426 1.00 0.00 O ATOM 1433 CB VAL A 92 1.575 -14.719 5.959 1.00 0.00 C ATOM 1434 CG1 VAL A 92 1.730 -15.838 4.912 1.00 0.00 C ATOM 1435 CG2 VAL A 92 2.545 -13.593 5.575 1.00 0.00 C ATOM 0 H VAL A 92 0.169 -13.350 4.229 1.00 0.00 H new ATOM 0 HA VAL A 92 -0.401 -15.139 6.557 1.00 0.00 H new ATOM 0 HB VAL A 92 1.840 -15.055 6.961 1.00 0.00 H new ATOM 0 HG11 VAL A 92 2.779 -16.125 4.839 1.00 0.00 H new ATOM 0 HG12 VAL A 92 1.137 -16.702 5.212 1.00 0.00 H new ATOM 0 HG13 VAL A 92 1.384 -15.480 3.942 1.00 0.00 H new ATOM 0 HG21 VAL A 92 3.558 -13.991 5.511 1.00 0.00 H new ATOM 0 HG22 VAL A 92 2.257 -13.178 4.609 1.00 0.00 H new ATOM 0 HG23 VAL A 92 2.510 -12.809 6.331 1.00 0.00 H new ATOM 1445 N GLU A 93 -0.104 -13.171 8.280 1.00 0.00 N ATOM 1446 CA GLU A 93 -0.189 -11.976 9.110 1.00 0.00 C ATOM 1447 C GLU A 93 1.249 -11.531 9.326 1.00 0.00 C ATOM 1448 O GLU A 93 2.161 -12.362 9.338 1.00 0.00 O ATOM 1449 CB GLU A 93 -0.940 -12.184 10.433 1.00 0.00 C ATOM 1450 CG GLU A 93 -0.319 -13.211 11.384 1.00 0.00 C ATOM 1451 CD GLU A 93 -0.619 -12.872 12.844 1.00 0.00 C ATOM 1452 OE1 GLU A 93 0.145 -12.103 13.459 1.00 0.00 O ATOM 1453 OE2 GLU A 93 -1.618 -13.371 13.414 1.00 0.00 O ATOM 0 H GLU A 93 -0.008 -14.051 8.787 1.00 0.00 H new ATOM 0 HA GLU A 93 -0.783 -11.211 8.609 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -1.003 -11.227 10.950 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -1.961 -12.493 10.208 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -0.705 -14.204 11.153 1.00 0.00 H new ATOM 0 HG3 GLU A 93 0.760 -13.245 11.231 1.00 0.00 H new ATOM 1460 N ASP A 94 1.467 -10.231 9.427 1.00 0.00 N ATOM 1461 CA ASP A 94 2.764 -9.690 9.766 1.00 0.00 C ATOM 1462 C ASP A 94 2.532 -8.506 10.675 1.00 0.00 C ATOM 1463 O ASP A 94 1.921 -7.520 10.263 1.00 0.00 O ATOM 1464 CB ASP A 94 3.550 -9.337 8.510 1.00 0.00 C ATOM 1465 CG ASP A 94 5.037 -9.344 8.829 1.00 0.00 C ATOM 1466 OD1 ASP A 94 5.426 -8.876 9.915 1.00 0.00 O ATOM 1467 OD2 ASP A 94 5.784 -9.888 7.983 1.00 0.00 O ATOM 0 H ASP A 94 0.747 -9.524 9.276 1.00 0.00 H new ATOM 0 HA ASP A 94 3.376 -10.424 10.290 1.00 0.00 H new ATOM 0 HB2 ASP A 94 3.333 -10.054 7.718 1.00 0.00 H new ATOM 0 HB3 ASP A 94 3.250 -8.356 8.143 1.00 0.00 H new ATOM 1472 N ASP A 95 2.876 -8.622 11.948 1.00 0.00 N ATOM 1473 CA ASP A 95 2.796 -7.486 12.856 1.00 0.00 C ATOM 1474 C ASP A 95 4.006 -6.570 12.723 1.00 0.00 C ATOM 1475 O ASP A 95 3.923 -5.418 13.152 1.00 0.00 O ATOM 1476 CB ASP A 95 2.650 -7.948 14.320 1.00 0.00 C ATOM 1477 CG ASP A 95 3.951 -8.422 14.987 1.00 0.00 C ATOM 1478 OD1 ASP A 95 4.853 -7.601 15.260 1.00 0.00 O ATOM 1479 OD2 ASP A 95 4.029 -9.630 15.318 1.00 0.00 O ATOM 0 H ASP A 95 3.212 -9.485 12.375 1.00 0.00 H new ATOM 0 HA ASP A 95 1.907 -6.922 12.575 1.00 0.00 H new ATOM 0 HB2 ASP A 95 2.239 -7.125 14.905 1.00 0.00 H new ATOM 0 HB3 ASP A 95 1.924 -8.760 14.358 1.00 0.00 H new ATOM 1484 N ASN A 96 5.091 -7.049 12.110 1.00 0.00 N ATOM 1485 CA ASN A 96 6.348 -6.341 12.039 1.00 0.00 C ATOM 1486 C ASN A 96 6.393 -5.366 10.860 1.00 0.00 C ATOM 1487 O ASN A 96 6.348 -5.802 9.706 1.00 0.00 O ATOM 1488 CB ASN A 96 7.489 -7.359 11.935 1.00 0.00 C ATOM 1489 CG ASN A 96 8.774 -6.683 12.349 1.00 0.00 C ATOM 1490 OD1 ASN A 96 9.123 -6.710 13.523 1.00 0.00 O ATOM 1491 ND2 ASN A 96 9.478 -6.042 11.436 1.00 0.00 N ATOM 0 H ASN A 96 5.109 -7.956 11.645 1.00 0.00 H new ATOM 0 HA ASN A 96 6.459 -5.746 12.946 1.00 0.00 H new ATOM 0 HB2 ASN A 96 7.290 -8.218 12.576 1.00 0.00 H new ATOM 0 HB3 ASN A 96 7.570 -7.734 10.915 1.00 0.00 H new ATOM 0 HD21 ASN A 96 10.334 -5.554 11.701 1.00 0.00 H new ATOM 0 HD22 ASN A 96 9.167 -6.034 10.465 1.00 0.00 H new ATOM 1498 N PRO A 97 6.544 -4.048 11.078 1.00 0.00 N ATOM 1499 CA PRO A 97 6.722 -3.093 9.991 1.00 0.00 C ATOM 1500 C PRO A 97 8.165 -3.155 9.460 1.00 0.00 C ATOM 1501 O PRO A 97 8.928 -2.198 9.586 1.00 0.00 O ATOM 1502 CB PRO A 97 6.346 -1.746 10.601 1.00 0.00 C ATOM 1503 CG PRO A 97 6.810 -1.882 12.049 1.00 0.00 C ATOM 1504 CD PRO A 97 6.529 -3.353 12.360 1.00 0.00 C ATOM 0 HA PRO A 97 6.102 -3.297 9.118 1.00 0.00 H new ATOM 0 HB2 PRO A 97 6.845 -0.920 10.094 1.00 0.00 H new ATOM 0 HB3 PRO A 97 5.274 -1.559 10.537 1.00 0.00 H new ATOM 0 HG2 PRO A 97 7.867 -1.640 12.159 1.00 0.00 H new ATOM 0 HG3 PRO A 97 6.260 -1.216 12.714 1.00 0.00 H new ATOM 0 HD2 PRO A 97 7.284 -3.760 13.033 1.00 0.00 H new ATOM 0 HD3 PRO A 97 5.565 -3.469 12.855 1.00 0.00 H new ATOM 1512 N ALA A 98 8.559 -4.300 8.897 1.00 0.00 N ATOM 1513 CA ALA A 98 9.857 -4.475 8.234 1.00 0.00 C ATOM 1514 C ALA A 98 9.878 -3.805 6.862 1.00 0.00 C ATOM 1515 O ALA A 98 10.931 -3.506 6.300 1.00 0.00 O ATOM 1516 CB ALA A 98 10.160 -5.968 8.045 1.00 0.00 C ATOM 0 H ALA A 98 7.982 -5.141 8.888 1.00 0.00 H new ATOM 0 HA ALA A 98 10.610 -4.011 8.871 1.00 0.00 H new ATOM 0 HB1 ALA A 98 11.125 -6.084 7.552 1.00 0.00 H new ATOM 0 HB2 ALA A 98 10.188 -6.460 9.017 1.00 0.00 H new ATOM 0 HB3 ALA A 98 9.382 -6.422 7.431 1.00 0.00 H new ATOM 1522 N VAL A 99 8.688 -3.619 6.311 1.00 0.00 N ATOM 1523 CA VAL A 99 8.396 -3.128 4.981 1.00 0.00 C ATOM 1524 C VAL A 99 7.150 -2.254 5.127 1.00 0.00 C ATOM 1525 O VAL A 99 6.321 -2.472 6.023 1.00 0.00 O ATOM 1526 CB VAL A 99 8.171 -4.342 4.048 1.00 0.00 C ATOM 1527 CG1 VAL A 99 8.002 -3.983 2.569 1.00 0.00 C ATOM 1528 CG2 VAL A 99 9.314 -5.370 4.104 1.00 0.00 C ATOM 0 H VAL A 99 7.834 -3.826 6.829 1.00 0.00 H new ATOM 0 HA VAL A 99 9.203 -2.541 4.543 1.00 0.00 H new ATOM 0 HB VAL A 99 7.243 -4.760 4.438 1.00 0.00 H new ATOM 0 HG11 VAL A 99 7.849 -4.893 1.989 1.00 0.00 H new ATOM 0 HG12 VAL A 99 7.139 -3.328 2.450 1.00 0.00 H new ATOM 0 HG13 VAL A 99 8.897 -3.472 2.214 1.00 0.00 H new ATOM 0 HG21 VAL A 99 9.094 -6.196 3.427 1.00 0.00 H new ATOM 0 HG22 VAL A 99 10.247 -4.893 3.804 1.00 0.00 H new ATOM 0 HG23 VAL A 99 9.412 -5.751 5.121 1.00 0.00 H new ATOM 1538 N ARG A 100 7.024 -1.230 4.286 1.00 0.00 N ATOM 1539 CA ARG A 100 5.823 -0.410 4.243 1.00 0.00 C ATOM 1540 C ARG A 100 4.844 -1.133 3.319 1.00 0.00 C ATOM 1541 O ARG A 100 5.258 -1.576 2.249 1.00 0.00 O ATOM 1542 CB ARG A 100 6.110 0.983 3.645 1.00 0.00 C ATOM 1543 CG ARG A 100 7.212 1.867 4.269 1.00 0.00 C ATOM 1544 CD ARG A 100 8.614 1.398 3.848 1.00 0.00 C ATOM 1545 NE ARG A 100 9.639 2.457 3.864 1.00 0.00 N ATOM 1546 CZ ARG A 100 10.885 2.289 3.393 1.00 0.00 C ATOM 1547 NH1 ARG A 100 11.290 1.114 2.930 1.00 0.00 N ATOM 1548 NH2 ARG A 100 11.756 3.289 3.371 1.00 0.00 N ATOM 0 H ARG A 100 7.746 -0.950 3.622 1.00 0.00 H new ATOM 0 HA ARG A 100 5.434 -0.270 5.252 1.00 0.00 H new ATOM 0 HB2 ARG A 100 6.361 0.842 2.594 1.00 0.00 H new ATOM 0 HB3 ARG A 100 5.180 1.550 3.677 1.00 0.00 H new ATOM 0 HG2 ARG A 100 7.066 2.903 3.963 1.00 0.00 H new ATOM 0 HG3 ARG A 100 7.129 1.841 5.356 1.00 0.00 H new ATOM 0 HD2 ARG A 100 8.930 0.593 4.512 1.00 0.00 H new ATOM 0 HD3 ARG A 100 8.557 0.979 2.843 1.00 0.00 H new ATOM 0 HE ARG A 100 9.388 3.366 4.254 1.00 0.00 H new ATOM 0 HH11 ARG A 100 10.651 0.319 2.928 1.00 0.00 H new ATOM 0 HH12 ARG A 100 12.240 1.005 2.576 1.00 0.00 H new ATOM 0 HH21 ARG A 100 11.485 4.209 3.717 1.00 0.00 H new ATOM 0 HH22 ARG A 100 12.697 3.138 3.008 1.00 0.00 H new ATOM 1562 N THR A 101 3.593 -1.328 3.730 1.00 0.00 N ATOM 1563 CA THR A 101 2.576 -1.875 2.829 1.00 0.00 C ATOM 1564 C THR A 101 2.311 -0.748 1.803 1.00 0.00 C ATOM 1565 O THR A 101 2.699 0.390 2.068 1.00 0.00 O ATOM 1566 CB THR A 101 1.324 -2.251 3.651 1.00 0.00 C ATOM 1567 OG1 THR A 101 0.771 -1.099 4.254 1.00 0.00 O ATOM 1568 CG2 THR A 101 1.639 -3.253 4.770 1.00 0.00 C ATOM 0 H THR A 101 3.259 -1.119 4.671 1.00 0.00 H new ATOM 0 HA THR A 101 2.881 -2.786 2.315 1.00 0.00 H new ATOM 0 HB THR A 101 0.623 -2.706 2.951 1.00 0.00 H new ATOM 0 HG1 THR A 101 -0.023 -1.349 4.771 1.00 0.00 H new ATOM 0 HG21 THR A 101 0.726 -3.485 5.318 1.00 0.00 H new ATOM 0 HG22 THR A 101 2.044 -4.167 4.336 1.00 0.00 H new ATOM 0 HG23 THR A 101 2.371 -2.819 5.451 1.00 0.00 H new ATOM 1576 N PRO A 102 1.618 -0.934 0.674 1.00 0.00 N ATOM 1577 CA PRO A 102 1.365 0.169 -0.252 1.00 0.00 C ATOM 1578 C PRO A 102 0.430 1.222 0.381 1.00 0.00 C ATOM 1579 O PRO A 102 0.471 2.403 0.025 1.00 0.00 O ATOM 1580 CB PRO A 102 0.813 -0.501 -1.509 1.00 0.00 C ATOM 1581 CG PRO A 102 0.102 -1.715 -0.953 1.00 0.00 C ATOM 1582 CD PRO A 102 1.002 -2.150 0.197 1.00 0.00 C ATOM 0 HA PRO A 102 2.258 0.743 -0.500 1.00 0.00 H new ATOM 0 HB2 PRO A 102 0.132 0.154 -2.051 1.00 0.00 H new ATOM 0 HB3 PRO A 102 1.607 -0.779 -2.202 1.00 0.00 H new ATOM 0 HG2 PRO A 102 -0.902 -1.470 -0.608 1.00 0.00 H new ATOM 0 HG3 PRO A 102 -0.001 -2.500 -1.703 1.00 0.00 H new ATOM 0 HD2 PRO A 102 0.427 -2.636 0.985 1.00 0.00 H new ATOM 0 HD3 PRO A 102 1.752 -2.866 -0.139 1.00 0.00 H new ATOM 1590 N LEU A 103 -0.397 0.826 1.356 1.00 0.00 N ATOM 1591 CA LEU A 103 -1.244 1.724 2.137 1.00 0.00 C ATOM 1592 C LEU A 103 -0.378 2.555 3.088 1.00 0.00 C ATOM 1593 O LEU A 103 -0.557 3.774 3.180 1.00 0.00 O ATOM 1594 CB LEU A 103 -2.293 0.860 2.859 1.00 0.00 C ATOM 1595 CG LEU A 103 -3.517 1.523 3.513 1.00 0.00 C ATOM 1596 CD1 LEU A 103 -3.243 2.012 4.931 1.00 0.00 C ATOM 1597 CD2 LEU A 103 -4.129 2.627 2.648 1.00 0.00 C ATOM 0 H LEU A 103 -0.495 -0.152 1.627 1.00 0.00 H new ATOM 0 HA LEU A 103 -1.770 2.442 1.507 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -2.665 0.132 2.138 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -1.773 0.301 3.637 1.00 0.00 H new ATOM 0 HG LEU A 103 -4.262 0.732 3.591 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -4.144 2.470 5.338 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -2.950 1.169 5.556 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -2.439 2.747 4.913 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -4.989 3.057 3.162 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -3.386 3.404 2.471 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -4.449 2.207 1.695 1.00 0.00 H new ATOM 1609 N GLU A 104 0.588 1.920 3.760 1.00 0.00 N ATOM 1610 CA GLU A 104 1.557 2.611 4.604 1.00 0.00 C ATOM 1611 C GLU A 104 2.574 3.405 3.785 1.00 0.00 C ATOM 1612 O GLU A 104 3.080 4.390 4.308 1.00 0.00 O ATOM 1613 CB GLU A 104 2.319 1.634 5.513 1.00 0.00 C ATOM 1614 CG GLU A 104 1.493 1.057 6.666 1.00 0.00 C ATOM 1615 CD GLU A 104 0.819 2.113 7.539 1.00 0.00 C ATOM 1616 OE1 GLU A 104 1.497 2.992 8.123 1.00 0.00 O ATOM 1617 OE2 GLU A 104 -0.415 2.009 7.710 1.00 0.00 O ATOM 0 H GLU A 104 0.717 0.909 3.731 1.00 0.00 H new ATOM 0 HA GLU A 104 0.975 3.301 5.216 1.00 0.00 H new ATOM 0 HB2 GLU A 104 2.694 0.811 4.905 1.00 0.00 H new ATOM 0 HB3 GLU A 104 3.188 2.146 5.927 1.00 0.00 H new ATOM 0 HG2 GLU A 104 0.728 0.397 6.256 1.00 0.00 H new ATOM 0 HG3 GLU A 104 2.141 0.443 7.292 1.00 0.00 H new ATOM 1624 N TRP A 105 2.880 3.033 2.538 1.00 0.00 N ATOM 1625 CA TRP A 105 3.751 3.799 1.658 1.00 0.00 C ATOM 1626 C TRP A 105 3.074 5.124 1.363 1.00 0.00 C ATOM 1627 O TRP A 105 3.693 6.153 1.570 1.00 0.00 O ATOM 1628 CB TRP A 105 4.077 3.078 0.341 1.00 0.00 C ATOM 1629 CG TRP A 105 5.285 2.192 0.315 1.00 0.00 C ATOM 1630 CD1 TRP A 105 5.289 0.859 0.095 1.00 0.00 C ATOM 1631 CD2 TRP A 105 6.692 2.575 0.423 1.00 0.00 C ATOM 1632 NE1 TRP A 105 6.586 0.397 0.040 1.00 0.00 N ATOM 1633 CE2 TRP A 105 7.498 1.421 0.185 1.00 0.00 C ATOM 1634 CE3 TRP A 105 7.372 3.782 0.697 1.00 0.00 C ATOM 1635 CZ2 TRP A 105 8.901 1.475 0.171 1.00 0.00 C ATOM 1636 CZ3 TRP A 105 8.779 3.844 0.711 1.00 0.00 C ATOM 1637 CH2 TRP A 105 9.543 2.698 0.424 1.00 0.00 C ATOM 0 H TRP A 105 2.522 2.179 2.111 1.00 0.00 H new ATOM 0 HA TRP A 105 4.703 3.938 2.170 1.00 0.00 H new ATOM 0 HB2 TRP A 105 3.212 2.475 0.065 1.00 0.00 H new ATOM 0 HB3 TRP A 105 4.198 3.834 -0.435 1.00 0.00 H new ATOM 0 HD1 TRP A 105 4.407 0.247 -0.021 1.00 0.00 H new ATOM 0 HE1 TRP A 105 6.840 -0.582 -0.092 1.00 0.00 H new ATOM 0 HE3 TRP A 105 6.801 4.676 0.900 1.00 0.00 H new ATOM 0 HZ2 TRP A 105 9.480 0.586 -0.032 1.00 0.00 H new ATOM 0 HZ3 TRP A 105 9.274 4.776 0.943 1.00 0.00 H new ATOM 0 HH2 TRP A 105 10.621 2.759 0.398 1.00 0.00 H new ATOM 1648 N ARG A 106 1.810 5.136 0.934 1.00 0.00 N ATOM 1649 CA ARG A 106 1.067 6.374 0.669 1.00 0.00 C ATOM 1650 C ARG A 106 1.129 7.319 1.868 1.00 0.00 C ATOM 1651 O ARG A 106 1.371 8.511 1.707 1.00 0.00 O ATOM 1652 CB ARG A 106 -0.345 5.968 0.244 1.00 0.00 C ATOM 1653 CG ARG A 106 -1.264 7.108 -0.214 1.00 0.00 C ATOM 1654 CD ARG A 106 -2.541 6.496 -0.808 1.00 0.00 C ATOM 1655 NE ARG A 106 -3.658 7.452 -0.922 1.00 0.00 N ATOM 1656 CZ ARG A 106 -4.553 7.656 0.055 1.00 0.00 C ATOM 1657 NH1 ARG A 106 -4.333 7.235 1.302 1.00 0.00 N ATOM 1658 NH2 ARG A 106 -5.692 8.280 -0.214 1.00 0.00 N ATOM 0 H ARG A 106 1.271 4.288 0.760 1.00 0.00 H new ATOM 0 HA ARG A 106 1.511 6.952 -0.141 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -0.265 5.244 -0.567 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -0.822 5.457 1.081 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -1.510 7.757 0.627 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -0.759 7.726 -0.957 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -2.316 6.095 -1.796 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -2.854 5.657 -0.187 1.00 0.00 H new ATOM 0 HE ARG A 106 -3.754 7.984 -1.787 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -3.468 6.745 1.530 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -5.030 7.403 2.027 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -5.885 8.603 -1.162 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -6.375 8.437 0.527 1.00 0.00 H new ATOM 1672 N GLN A 107 0.974 6.776 3.072 1.00 0.00 N ATOM 1673 CA GLN A 107 1.130 7.524 4.314 1.00 0.00 C ATOM 1674 C GLN A 107 2.583 7.997 4.500 1.00 0.00 C ATOM 1675 O GLN A 107 2.811 9.168 4.801 1.00 0.00 O ATOM 1676 CB GLN A 107 0.672 6.616 5.470 1.00 0.00 C ATOM 1677 CG GLN A 107 0.629 7.302 6.838 1.00 0.00 C ATOM 1678 CD GLN A 107 -0.652 8.098 7.062 1.00 0.00 C ATOM 1679 OE1 GLN A 107 -1.732 7.519 7.175 1.00 0.00 O ATOM 1680 NE2 GLN A 107 -0.585 9.413 7.155 1.00 0.00 N ATOM 0 H GLN A 107 0.734 5.795 3.213 1.00 0.00 H new ATOM 0 HA GLN A 107 0.518 8.426 4.291 1.00 0.00 H new ATOM 0 HB2 GLN A 107 -0.321 6.230 5.240 1.00 0.00 H new ATOM 0 HB3 GLN A 107 1.342 5.758 5.529 1.00 0.00 H new ATOM 0 HG2 GLN A 107 0.724 6.549 7.620 1.00 0.00 H new ATOM 0 HG3 GLN A 107 1.486 7.969 6.932 1.00 0.00 H new ATOM 0 HE21 GLN A 107 0.314 9.886 7.060 1.00 0.00 H new ATOM 0 HE22 GLN A 107 -1.432 9.956 7.322 1.00 0.00 H new ATOM 1689 N ALA A 108 3.561 7.102 4.369 1.00 0.00 N ATOM 1690 CA ALA A 108 4.973 7.377 4.606 1.00 0.00 C ATOM 1691 C ALA A 108 5.474 8.454 3.653 1.00 0.00 C ATOM 1692 O ALA A 108 6.104 9.399 4.090 1.00 0.00 O ATOM 1693 CB ALA A 108 5.800 6.098 4.434 1.00 0.00 C ATOM 0 H ALA A 108 3.385 6.138 4.087 1.00 0.00 H new ATOM 0 HA ALA A 108 5.087 7.736 5.629 1.00 0.00 H new ATOM 0 HB1 ALA A 108 6.852 6.318 4.614 1.00 0.00 H new ATOM 0 HB2 ALA A 108 5.460 5.346 5.146 1.00 0.00 H new ATOM 0 HB3 ALA A 108 5.677 5.719 3.420 1.00 0.00 H new ATOM 1699 N ILE A 109 5.162 8.335 2.367 1.00 0.00 N ATOM 1700 CA ILE A 109 5.551 9.212 1.270 1.00 0.00 C ATOM 1701 C ILE A 109 5.110 10.654 1.555 1.00 0.00 C ATOM 1702 O ILE A 109 5.792 11.590 1.134 1.00 0.00 O ATOM 1703 CB ILE A 109 4.939 8.619 -0.018 1.00 0.00 C ATOM 1704 CG1 ILE A 109 5.637 7.291 -0.413 1.00 0.00 C ATOM 1705 CG2 ILE A 109 4.888 9.568 -1.216 1.00 0.00 C ATOM 1706 CD1 ILE A 109 6.880 7.390 -1.304 1.00 0.00 C ATOM 0 H ILE A 109 4.584 7.561 2.039 1.00 0.00 H new ATOM 0 HA ILE A 109 6.633 9.264 1.151 1.00 0.00 H new ATOM 0 HB ILE A 109 3.898 8.429 0.243 1.00 0.00 H new ATOM 0 HG12 ILE A 109 5.919 6.772 0.503 1.00 0.00 H new ATOM 0 HG13 ILE A 109 4.906 6.664 -0.922 1.00 0.00 H new ATOM 0 HG21 ILE A 109 4.442 9.055 -2.068 1.00 0.00 H new ATOM 0 HG22 ILE A 109 4.287 10.442 -0.963 1.00 0.00 H new ATOM 0 HG23 ILE A 109 5.899 9.885 -1.472 1.00 0.00 H new ATOM 0 HD11 ILE A 109 7.266 6.390 -1.502 1.00 0.00 H new ATOM 0 HD12 ILE A 109 6.615 7.870 -2.246 1.00 0.00 H new ATOM 0 HD13 ILE A 109 7.644 7.980 -0.798 1.00 0.00 H new ATOM 1718 N TYR A 110 3.998 10.841 2.273 1.00 0.00 N ATOM 1719 CA TYR A 110 3.565 12.159 2.708 1.00 0.00 C ATOM 1720 C TYR A 110 4.598 12.695 3.695 1.00 0.00 C ATOM 1721 O TYR A 110 5.177 13.759 3.492 1.00 0.00 O ATOM 1722 CB TYR A 110 2.170 12.083 3.348 1.00 0.00 C ATOM 1723 CG TYR A 110 1.563 13.442 3.634 1.00 0.00 C ATOM 1724 CD1 TYR A 110 1.807 14.098 4.857 1.00 0.00 C ATOM 1725 CD2 TYR A 110 0.745 14.052 2.668 1.00 0.00 C ATOM 1726 CE1 TYR A 110 1.182 15.327 5.139 1.00 0.00 C ATOM 1727 CE2 TYR A 110 0.121 15.280 2.938 1.00 0.00 C ATOM 1728 CZ TYR A 110 0.314 15.911 4.186 1.00 0.00 C ATOM 1729 OH TYR A 110 -0.326 17.082 4.447 1.00 0.00 O ATOM 0 H TYR A 110 3.380 10.083 2.564 1.00 0.00 H new ATOM 0 HA TYR A 110 3.490 12.834 1.855 1.00 0.00 H new ATOM 0 HB2 TYR A 110 1.505 11.528 2.686 1.00 0.00 H new ATOM 0 HB3 TYR A 110 2.236 11.520 4.279 1.00 0.00 H new ATOM 0 HD1 TYR A 110 2.476 13.656 5.581 1.00 0.00 H new ATOM 0 HD2 TYR A 110 0.595 13.573 1.712 1.00 0.00 H new ATOM 0 HE1 TYR A 110 1.364 15.823 6.081 1.00 0.00 H new ATOM 0 HE2 TYR A 110 -0.507 15.742 2.191 1.00 0.00 H new ATOM 0 HH TYR A 110 -0.879 17.331 3.677 1.00 0.00 H new ATOM 1739 N GLU A 111 4.848 11.936 4.764 1.00 0.00 N ATOM 1740 CA GLU A 111 5.764 12.315 5.825 1.00 0.00 C ATOM 1741 C GLU A 111 7.191 12.462 5.293 1.00 0.00 C ATOM 1742 O GLU A 111 7.893 13.362 5.729 1.00 0.00 O ATOM 1743 CB GLU A 111 5.683 11.285 6.965 1.00 0.00 C ATOM 1744 CG GLU A 111 6.332 11.855 8.230 1.00 0.00 C ATOM 1745 CD GLU A 111 6.294 10.898 9.424 1.00 0.00 C ATOM 1746 OE1 GLU A 111 6.662 9.703 9.298 1.00 0.00 O ATOM 1747 OE2 GLU A 111 5.916 11.351 10.532 1.00 0.00 O ATOM 0 H GLU A 111 4.409 11.027 4.913 1.00 0.00 H new ATOM 0 HA GLU A 111 5.473 13.289 6.219 1.00 0.00 H new ATOM 0 HB2 GLU A 111 4.642 11.030 7.163 1.00 0.00 H new ATOM 0 HB3 GLU A 111 6.186 10.364 6.671 1.00 0.00 H new ATOM 0 HG2 GLU A 111 7.369 12.110 8.013 1.00 0.00 H new ATOM 0 HG3 GLU A 111 5.826 12.782 8.502 1.00 0.00 H new ATOM 1754 N GLU A 112 7.612 11.677 4.301 1.00 0.00 N ATOM 1755 CA GLU A 112 8.895 11.761 3.640 1.00 0.00 C ATOM 1756 C GLU A 112 9.076 13.134 2.991 1.00 0.00 C ATOM 1757 O GLU A 112 10.193 13.652 2.983 1.00 0.00 O ATOM 1758 CB GLU A 112 8.955 10.657 2.580 1.00 0.00 C ATOM 1759 CG GLU A 112 9.197 9.243 3.126 1.00 0.00 C ATOM 1760 CD GLU A 112 10.673 8.962 3.402 1.00 0.00 C ATOM 1761 OE1 GLU A 112 11.154 9.194 4.537 1.00 0.00 O ATOM 1762 OE2 GLU A 112 11.356 8.409 2.506 1.00 0.00 O ATOM 0 H GLU A 112 7.029 10.929 3.924 1.00 0.00 H new ATOM 0 HA GLU A 112 9.698 11.630 4.365 1.00 0.00 H new ATOM 0 HB2 GLU A 112 8.019 10.659 2.022 1.00 0.00 H new ATOM 0 HB3 GLU A 112 9.748 10.897 1.872 1.00 0.00 H new ATOM 0 HG2 GLU A 112 8.628 9.111 4.046 1.00 0.00 H new ATOM 0 HG3 GLU A 112 8.820 8.512 2.411 1.00 0.00 H new ATOM 1769 N LYS A 113 8.003 13.756 2.483 1.00 0.00 N ATOM 1770 CA LYS A 113 8.056 15.107 1.926 1.00 0.00 C ATOM 1771 C LYS A 113 8.104 16.171 3.032 1.00 0.00 C ATOM 1772 O LYS A 113 8.489 17.312 2.782 1.00 0.00 O ATOM 1773 CB LYS A 113 6.845 15.330 1.008 1.00 0.00 C ATOM 1774 CG LYS A 113 7.096 16.473 0.004 1.00 0.00 C ATOM 1775 CD LYS A 113 5.821 17.282 -0.239 1.00 0.00 C ATOM 1776 CE LYS A 113 6.153 18.608 -0.929 1.00 0.00 C ATOM 1777 NZ LYS A 113 4.977 19.496 -0.990 1.00 0.00 N ATOM 0 H LYS A 113 7.075 13.333 2.449 1.00 0.00 H new ATOM 0 HA LYS A 113 8.973 15.206 1.344 1.00 0.00 H new ATOM 0 HB2 LYS A 113 6.625 14.411 0.466 1.00 0.00 H new ATOM 0 HB3 LYS A 113 5.968 15.562 1.612 1.00 0.00 H new ATOM 0 HG2 LYS A 113 7.880 17.129 0.383 1.00 0.00 H new ATOM 0 HG3 LYS A 113 7.454 16.061 -0.939 1.00 0.00 H new ATOM 0 HD2 LYS A 113 5.130 16.707 -0.855 1.00 0.00 H new ATOM 0 HD3 LYS A 113 5.318 17.474 0.709 1.00 0.00 H new ATOM 0 HE2 LYS A 113 6.959 19.107 -0.391 1.00 0.00 H new ATOM 0 HE3 LYS A 113 6.516 18.413 -1.938 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 5.237 20.385 -1.463 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 4.217 19.029 -1.524 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 4.647 19.701 -0.025 1.00 0.00 H new ATOM 1791 N LEU A 114 7.699 15.850 4.258 1.00 0.00 N ATOM 1792 CA LEU A 114 7.835 16.754 5.401 1.00 0.00 C ATOM 1793 C LEU A 114 9.224 16.551 6.018 1.00 0.00 C ATOM 1794 O LEU A 114 9.822 17.505 6.516 1.00 0.00 O ATOM 1795 CB LEU A 114 6.706 16.499 6.423 1.00 0.00 C ATOM 1796 CG LEU A 114 5.373 17.208 6.093 1.00 0.00 C ATOM 1797 CD1 LEU A 114 4.654 16.698 4.841 1.00 0.00 C ATOM 1798 CD2 LEU A 114 4.398 17.067 7.265 1.00 0.00 C ATOM 0 H LEU A 114 7.267 14.956 4.489 1.00 0.00 H new ATOM 0 HA LEU A 114 7.742 17.791 5.080 1.00 0.00 H new ATOM 0 HB2 LEU A 114 6.526 15.426 6.487 1.00 0.00 H new ATOM 0 HB3 LEU A 114 7.043 16.825 7.407 1.00 0.00 H new ATOM 0 HG LEU A 114 5.659 18.243 5.904 1.00 0.00 H new ATOM 0 HD11 LEU A 114 3.731 17.260 4.697 1.00 0.00 H new ATOM 0 HD12 LEU A 114 5.298 16.831 3.972 1.00 0.00 H new ATOM 0 HD13 LEU A 114 4.420 15.640 4.961 1.00 0.00 H new ATOM 0 HD21 LEU A 114 3.462 17.570 7.022 1.00 0.00 H new ATOM 0 HD22 LEU A 114 4.204 16.011 7.452 1.00 0.00 H new ATOM 0 HD23 LEU A 114 4.833 17.520 8.156 1.00 0.00 H new ATOM 1810 N ALA A 115 9.759 15.330 5.962 1.00 0.00 N ATOM 1811 CA ALA A 115 11.090 14.966 6.404 1.00 0.00 C ATOM 1812 C ALA A 115 12.135 15.543 5.457 1.00 0.00 C ATOM 1813 O ALA A 115 13.155 16.022 5.935 1.00 0.00 O ATOM 1814 CB ALA A 115 11.218 13.441 6.478 1.00 0.00 C ATOM 0 H ALA A 115 9.243 14.534 5.587 1.00 0.00 H new ATOM 0 HA ALA A 115 11.259 15.380 7.398 1.00 0.00 H new ATOM 0 HB1 ALA A 115 12.221 13.176 6.811 1.00 0.00 H new ATOM 0 HB2 ALA A 115 10.486 13.048 7.184 1.00 0.00 H new ATOM 0 HB3 ALA A 115 11.038 13.012 5.492 1.00 0.00 H new ATOM 1820 N GLN A 116 11.897 15.554 4.137 1.00 0.00 N ATOM 1821 CA GLN A 116 12.887 16.013 3.158 1.00 0.00 C ATOM 1822 C GLN A 116 13.290 17.463 3.434 1.00 0.00 C ATOM 1823 O GLN A 116 14.448 17.832 3.250 1.00 0.00 O ATOM 1824 CB GLN A 116 12.442 15.754 1.702 1.00 0.00 C ATOM 1825 CG GLN A 116 11.383 16.693 1.121 1.00 0.00 C ATOM 1826 CD GLN A 116 11.932 18.016 0.602 1.00 0.00 C ATOM 1827 OE1 GLN A 116 11.517 19.076 1.063 1.00 0.00 O ATOM 1828 NE2 GLN A 116 12.825 18.001 -0.371 1.00 0.00 N ATOM 0 H GLN A 116 11.017 15.246 3.722 1.00 0.00 H new ATOM 0 HA GLN A 116 13.788 15.412 3.280 1.00 0.00 H new ATOM 0 HB2 GLN A 116 13.325 15.803 1.064 1.00 0.00 H new ATOM 0 HB3 GLN A 116 12.061 14.735 1.641 1.00 0.00 H new ATOM 0 HG2 GLN A 116 10.869 16.182 0.307 1.00 0.00 H new ATOM 0 HG3 GLN A 116 10.637 16.899 1.889 1.00 0.00 H new ATOM 0 HE21 GLN A 116 13.159 17.112 -0.743 1.00 0.00 H new ATOM 0 HE22 GLN A 116 13.180 18.878 -0.751 1.00 0.00 H new ATOM 1837 N ALA A 117 12.343 18.244 3.959 1.00 0.00 N ATOM 1838 CA ALA A 117 12.525 19.637 4.325 1.00 0.00 C ATOM 1839 C ALA A 117 13.510 19.814 5.492 1.00 0.00 C ATOM 1840 O ALA A 117 14.067 20.900 5.663 1.00 0.00 O ATOM 1841 CB ALA A 117 11.143 20.221 4.659 1.00 0.00 C ATOM 0 H ALA A 117 11.399 17.906 4.144 1.00 0.00 H new ATOM 0 HA ALA A 117 12.969 20.174 3.487 1.00 0.00 H new ATOM 0 HB1 ALA A 117 11.249 21.269 4.938 1.00 0.00 H new ATOM 0 HB2 ALA A 117 10.494 20.142 3.787 1.00 0.00 H new ATOM 0 HB3 ALA A 117 10.705 19.667 5.489 1.00 0.00 H new ATOM 1847 N ARG A 118 13.704 18.792 6.332 1.00 0.00 N ATOM 1848 CA ARG A 118 14.687 18.731 7.408 1.00 0.00 C ATOM 1849 C ARG A 118 15.934 18.029 6.893 1.00 0.00 C ATOM 1850 O ARG A 118 17.043 18.410 7.267 1.00 0.00 O ATOM 1851 CB ARG A 118 14.084 18.017 8.641 1.00 0.00 C ATOM 1852 CG ARG A 118 15.130 17.300 9.519 1.00 0.00 C ATOM 1853 CD ARG A 118 14.544 16.735 10.814 1.00 0.00 C ATOM 1854 NE ARG A 118 14.387 17.779 11.838 1.00 0.00 N ATOM 1855 CZ ARG A 118 15.262 18.104 12.798 1.00 0.00 C ATOM 1856 NH1 ARG A 118 16.469 17.549 12.855 1.00 0.00 N ATOM 1857 NH2 ARG A 118 14.917 19.009 13.703 1.00 0.00 N ATOM 0 H ARG A 118 13.146 17.940 6.272 1.00 0.00 H new ATOM 0 HA ARG A 118 14.965 19.736 7.726 1.00 0.00 H new ATOM 0 HB2 ARG A 118 13.553 18.749 9.250 1.00 0.00 H new ATOM 0 HB3 ARG A 118 13.347 17.289 8.303 1.00 0.00 H new ATOM 0 HG2 ARG A 118 15.580 16.489 8.947 1.00 0.00 H new ATOM 0 HG3 ARG A 118 15.930 17.999 9.764 1.00 0.00 H new ATOM 0 HD2 ARG A 118 13.576 16.279 10.607 1.00 0.00 H new ATOM 0 HD3 ARG A 118 15.193 15.946 11.194 1.00 0.00 H new ATOM 0 HE ARG A 118 13.518 18.313 11.814 1.00 0.00 H new ATOM 0 HH11 ARG A 118 16.746 16.859 12.157 1.00 0.00 H new ATOM 0 HH12 ARG A 118 17.118 17.814 13.596 1.00 0.00 H new ATOM 0 HH21 ARG A 118 13.997 19.447 13.662 1.00 0.00 H new ATOM 0 HH22 ARG A 118 15.572 19.268 14.441 1.00 0.00 H new ATOM 1871 N GLU A 119 15.770 17.032 6.028 1.00 0.00 N ATOM 1872 CA GLU A 119 16.873 16.294 5.450 1.00 0.00 C ATOM 1873 C GLU A 119 17.767 17.223 4.636 1.00 0.00 C ATOM 1874 O GLU A 119 18.922 16.875 4.427 1.00 0.00 O ATOM 1875 CB GLU A 119 16.382 15.077 4.654 1.00 0.00 C ATOM 1876 CG GLU A 119 16.800 13.735 5.258 1.00 0.00 C ATOM 1877 CD GLU A 119 16.079 13.356 6.557 1.00 0.00 C ATOM 1878 OE1 GLU A 119 15.886 14.193 7.467 1.00 0.00 O ATOM 1879 OE2 GLU A 119 15.811 12.147 6.731 1.00 0.00 O ATOM 0 H GLU A 119 14.854 16.715 5.709 1.00 0.00 H new ATOM 0 HA GLU A 119 17.485 15.891 6.257 1.00 0.00 H new ATOM 0 HB2 GLU A 119 15.295 15.112 4.588 1.00 0.00 H new ATOM 0 HB3 GLU A 119 16.765 15.142 3.636 1.00 0.00 H new ATOM 0 HG2 GLU A 119 16.624 12.952 4.521 1.00 0.00 H new ATOM 0 HG3 GLU A 119 17.873 13.758 5.449 1.00 0.00 H new ATOM 1886 N SER A 120 17.300 18.419 4.245 1.00 0.00 N ATOM 1887 CA SER A 120 18.135 19.420 3.589 1.00 0.00 C ATOM 1888 C SER A 120 19.388 19.750 4.426 1.00 0.00 C ATOM 1889 O SER A 120 20.430 20.095 3.865 1.00 0.00 O ATOM 1890 CB SER A 120 17.328 20.701 3.375 1.00 0.00 C ATOM 1891 OG SER A 120 16.141 20.473 2.635 1.00 0.00 O ATOM 0 H SER A 120 16.332 18.713 4.378 1.00 0.00 H new ATOM 0 HA SER A 120 18.458 19.009 2.632 1.00 0.00 H new ATOM 0 HB2 SER A 120 17.073 21.133 4.343 1.00 0.00 H new ATOM 0 HB3 SER A 120 17.944 21.433 2.852 1.00 0.00 H new ATOM 0 HG SER A 120 15.657 21.318 2.524 1.00 0.00 H new ATOM 1897 N ILE A 121 19.316 19.615 5.757 1.00 0.00 N ATOM 1898 CA ILE A 121 20.459 19.785 6.650 1.00 0.00 C ATOM 1899 C ILE A 121 21.503 18.693 6.354 1.00 0.00 C ATOM 1900 O ILE A 121 22.696 18.978 6.278 1.00 0.00 O ATOM 1901 CB ILE A 121 19.978 19.777 8.124 1.00 0.00 C ATOM 1902 CG1 ILE A 121 18.951 20.909 8.384 1.00 0.00 C ATOM 1903 CG2 ILE A 121 21.165 19.915 9.097 1.00 0.00 C ATOM 1904 CD1 ILE A 121 18.243 20.816 9.743 1.00 0.00 C ATOM 0 H ILE A 121 18.451 19.382 6.245 1.00 0.00 H new ATOM 0 HA ILE A 121 20.940 20.748 6.480 1.00 0.00 H new ATOM 0 HB ILE A 121 19.492 18.818 8.300 1.00 0.00 H new ATOM 0 HG12 ILE A 121 19.462 21.870 8.318 1.00 0.00 H new ATOM 0 HG13 ILE A 121 18.200 20.892 7.594 1.00 0.00 H new ATOM 0 HG21 ILE A 121 20.797 19.906 10.123 1.00 0.00 H new ATOM 0 HG22 ILE A 121 21.854 19.083 8.951 1.00 0.00 H new ATOM 0 HG23 ILE A 121 21.685 20.854 8.906 1.00 0.00 H new ATOM 0 HD11 ILE A 121 17.542 21.644 9.845 1.00 0.00 H new ATOM 0 HD12 ILE A 121 17.701 19.872 9.807 1.00 0.00 H new ATOM 0 HD13 ILE A 121 18.982 20.865 10.543 1.00 0.00 H new ATOM 1916 N ILE A 122 21.073 17.442 6.178 1.00 0.00 N ATOM 1917 CA ILE A 122 21.956 16.327 5.857 1.00 0.00 C ATOM 1918 C ILE A 122 22.401 16.427 4.395 1.00 0.00 C ATOM 1919 O ILE A 122 23.550 16.112 4.101 1.00 0.00 O ATOM 1920 CB ILE A 122 21.276 14.974 6.178 1.00 0.00 C ATOM 1921 CG1 ILE A 122 20.915 14.859 7.679 1.00 0.00 C ATOM 1922 CG2 ILE A 122 22.192 13.793 5.830 1.00 0.00 C ATOM 1923 CD1 ILE A 122 19.459 15.222 7.962 1.00 0.00 C ATOM 0 H ILE A 122 20.092 17.175 6.256 1.00 0.00 H new ATOM 0 HA ILE A 122 22.848 16.379 6.481 1.00 0.00 H new ATOM 0 HB ILE A 122 20.370 14.940 5.574 1.00 0.00 H new ATOM 0 HG12 ILE A 122 21.104 13.840 8.017 1.00 0.00 H new ATOM 0 HG13 ILE A 122 21.568 15.513 8.257 1.00 0.00 H new ATOM 0 HG21 ILE A 122 21.685 12.857 6.067 1.00 0.00 H new ATOM 0 HG22 ILE A 122 22.429 13.818 4.766 1.00 0.00 H new ATOM 0 HG23 ILE A 122 23.113 13.864 6.409 1.00 0.00 H new ATOM 0 HD11 ILE A 122 19.260 15.124 9.029 1.00 0.00 H new ATOM 0 HD12 ILE A 122 19.273 16.250 7.651 1.00 0.00 H new ATOM 0 HD13 ILE A 122 18.802 14.551 7.408 1.00 0.00 H new ATOM 1935 N ALA A 123 21.542 16.894 3.484 1.00 0.00 N ATOM 1936 CA ALA A 123 21.877 17.106 2.081 1.00 0.00 C ATOM 1937 C ALA A 123 23.024 18.109 1.927 1.00 0.00 C ATOM 1938 O ALA A 123 23.760 18.042 0.941 1.00 0.00 O ATOM 1939 CB ALA A 123 20.645 17.598 1.315 1.00 0.00 C ATOM 0 H ALA A 123 20.578 17.138 3.710 1.00 0.00 H new ATOM 0 HA ALA A 123 22.204 16.153 1.666 1.00 0.00 H new ATOM 0 HB1 ALA A 123 20.906 17.753 0.268 1.00 0.00 H new ATOM 0 HB2 ALA A 123 19.852 16.854 1.385 1.00 0.00 H new ATOM 0 HB3 ALA A 123 20.300 18.538 1.746 1.00 0.00 H new ATOM 1945 N ASP A 124 23.180 19.014 2.898 1.00 0.00 N ATOM 1946 CA ASP A 124 24.260 19.993 2.973 1.00 0.00 C ATOM 1947 C ASP A 124 25.605 19.288 3.133 1.00 0.00 C ATOM 1948 O ASP A 124 26.533 19.540 2.370 1.00 0.00 O ATOM 1949 CB ASP A 124 24.015 20.940 4.158 1.00 0.00 C ATOM 1950 CG ASP A 124 24.586 22.324 3.893 1.00 0.00 C ATOM 1951 OD1 ASP A 124 25.796 22.552 4.104 1.00 0.00 O ATOM 1952 OD2 ASP A 124 23.792 23.213 3.499 1.00 0.00 O ATOM 0 H ASP A 124 22.531 19.084 3.682 1.00 0.00 H new ATOM 0 HA ASP A 124 24.281 20.571 2.049 1.00 0.00 H new ATOM 0 HB2 ASP A 124 22.944 21.017 4.348 1.00 0.00 H new ATOM 0 HB3 ASP A 124 24.469 20.524 5.057 1.00 0.00 H new ATOM 1957 N ASN A 125 25.670 18.361 4.097 1.00 0.00 N ATOM 1958 CA ASN A 125 26.835 17.608 4.566 1.00 0.00 C ATOM 1959 C ASN A 125 28.139 18.395 4.437 1.00 0.00 C ATOM 1960 O ASN A 125 29.070 17.982 3.742 1.00 0.00 O ATOM 1961 CB ASN A 125 26.924 16.216 3.923 1.00 0.00 C ATOM 1962 CG ASN A 125 27.525 15.238 4.919 1.00 0.00 C ATOM 1963 OD1 ASN A 125 26.831 14.802 5.831 1.00 0.00 O ATOM 1964 ND2 ASN A 125 28.791 14.886 4.824 1.00 0.00 N ATOM 0 H ASN A 125 24.831 18.097 4.614 1.00 0.00 H new ATOM 0 HA ASN A 125 26.685 17.449 5.634 1.00 0.00 H new ATOM 0 HB2 ASN A 125 25.933 15.880 3.619 1.00 0.00 H new ATOM 0 HB3 ASN A 125 27.537 16.258 3.022 1.00 0.00 H new ATOM 0 HD21 ASN A 125 29.196 14.249 5.510 1.00 0.00 H new ATOM 0 HD22 ASN A 125 29.366 15.250 4.064 1.00 0.00 H new ATOM 1971 N ASN A 126 28.199 19.533 5.128 1.00 0.00 N ATOM 1972 CA ASN A 126 29.282 20.524 5.111 1.00 0.00 C ATOM 1973 C ASN A 126 30.645 20.029 5.622 1.00 0.00 C ATOM 1974 O ASN A 126 31.544 20.829 5.872 1.00 0.00 O ATOM 1975 CB ASN A 126 28.837 21.793 5.843 1.00 0.00 C ATOM 1976 CG ASN A 126 28.510 21.618 7.321 1.00 0.00 C ATOM 1977 OD1 ASN A 126 28.790 20.604 7.948 1.00 0.00 O ATOM 1978 ND2 ASN A 126 27.836 22.597 7.900 1.00 0.00 N ATOM 0 H ASN A 126 27.444 19.808 5.757 1.00 0.00 H new ATOM 0 HA ASN A 126 29.464 20.739 4.058 1.00 0.00 H new ATOM 0 HB2 ASN A 126 29.625 22.541 5.749 1.00 0.00 H new ATOM 0 HB3 ASN A 126 27.957 22.192 5.339 1.00 0.00 H new ATOM 0 HD21 ASN A 126 27.546 22.510 8.874 1.00 0.00 H new ATOM 0 HD22 ASN A 126 27.606 23.439 7.373 1.00 0.00 H new ATOM 1985 N ILE A 127 30.798 18.718 5.799 1.00 0.00 N ATOM 1986 CA ILE A 127 32.042 18.039 6.138 1.00 0.00 C ATOM 1987 C ILE A 127 32.947 18.072 4.878 1.00 0.00 C ATOM 1988 O ILE A 127 34.154 17.831 4.969 1.00 0.00 O ATOM 1989 CB ILE A 127 31.684 16.615 6.649 1.00 0.00 C ATOM 1990 CG1 ILE A 127 30.830 16.724 7.941 1.00 0.00 C ATOM 1991 CG2 ILE A 127 32.925 15.741 6.911 1.00 0.00 C ATOM 1992 CD1 ILE A 127 30.227 15.402 8.432 1.00 0.00 C ATOM 0 H ILE A 127 30.016 18.070 5.704 1.00 0.00 H new ATOM 0 HA ILE A 127 32.603 18.519 6.940 1.00 0.00 H new ATOM 0 HB ILE A 127 31.115 16.124 5.860 1.00 0.00 H new ATOM 0 HG12 ILE A 127 31.450 17.140 8.735 1.00 0.00 H new ATOM 0 HG13 ILE A 127 30.020 17.432 7.765 1.00 0.00 H new ATOM 0 HG21 ILE A 127 32.610 14.759 7.266 1.00 0.00 H new ATOM 0 HG22 ILE A 127 33.492 15.628 5.987 1.00 0.00 H new ATOM 0 HG23 ILE A 127 33.552 16.216 7.666 1.00 0.00 H new ATOM 0 HD11 ILE A 127 29.649 15.580 9.339 1.00 0.00 H new ATOM 0 HD12 ILE A 127 29.576 14.991 7.661 1.00 0.00 H new ATOM 0 HD13 ILE A 127 31.028 14.694 8.646 1.00 0.00 H new ATOM 2004 N GLN A 128 32.379 18.383 3.708 1.00 0.00 N ATOM 2005 CA GLN A 128 33.000 18.607 2.414 1.00 0.00 C ATOM 2006 C GLN A 128 32.290 19.814 1.813 1.00 0.00 C ATOM 2007 O GLN A 128 32.836 20.407 0.866 1.00 0.00 O ATOM 2008 CB GLN A 128 32.836 17.385 1.497 1.00 0.00 C ATOM 2009 CG GLN A 128 33.709 16.191 1.914 1.00 0.00 C ATOM 2010 CD GLN A 128 33.579 14.958 1.009 1.00 0.00 C ATOM 2011 OE1 GLN A 128 34.178 13.920 1.291 1.00 0.00 O ATOM 2012 NE2 GLN A 128 32.839 15.007 -0.091 1.00 0.00 N ATOM 2013 OXT GLN A 128 31.165 20.145 2.258 1.00 0.00 O ATOM 0 H GLN A 128 31.367 18.494 3.647 1.00 0.00 H new ATOM 0 HA GLN A 128 34.071 18.776 2.522 1.00 0.00 H new ATOM 0 HB2 GLN A 128 31.790 17.078 1.495 1.00 0.00 H new ATOM 0 HB3 GLN A 128 33.086 17.670 0.475 1.00 0.00 H new ATOM 0 HG2 GLN A 128 34.752 16.507 1.927 1.00 0.00 H new ATOM 0 HG3 GLN A 128 33.449 15.906 2.934 1.00 0.00 H new ATOM 0 HE21 GLN A 128 32.339 15.863 -0.332 1.00 0.00 H new ATOM 0 HE22 GLN A 128 32.770 14.189 -0.696 1.00 0.00 H new TER 2022 GLN A 128