USER MOD reduce.3.24.130724 H: found=0, std=0, add=1098, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1098 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 85 THR OG1 : rot -83:sc= 1.02 USER MOD Set 1.2: A 106 SER OG : rot 180:sc= 0.888 USER MOD Set 2.1: A 89 SER OG : rot 180:sc= -0.386 USER MOD Set 2.2: A 91 LYS NZ :NH3+ 160:sc= 1.21 (180deg=1.08) USER MOD Set 3.1: A 69 TYR OH : rot 180:sc= 0.571 USER MOD Set 3.2: A 100 GLN : amide:sc= -3.58! C(o=-3!,f=-2.8!) USER MOD Set 4.1: A 60 LYS NZ :NH3+ 177:sc= 1.23 (180deg=0) USER MOD Set 4.2: A 62 GLN : amide:sc= 1.07 K(o=2.3,f=-7.6!) USER MOD Set 5.1: A 46 GLN : amide:sc= 0 K(o=-0.11,f=-1.1) USER MOD Set 5.2: A 48 MET CE :methyl -162:sc= -0.113 (180deg=-0.584) USER MOD Single : A 1 GLY N :NH3+ -116:sc= 0.104 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ -165:sc= 1.3 (180deg=1.05) USER MOD Single : A 5 LYS NZ :NH3+ -172:sc= -0.0103 (180deg=-0.116) USER MOD Single : A 8 LYS NZ :NH3+ 165:sc= -0.0734 (180deg=-0.349) USER MOD Single : A 9 LYS NZ :NH3+ -170:sc= 0.0194 (180deg=-0.108) USER MOD Single : A 11 LYS NZ :NH3+ 165:sc= -0.0367 (180deg=-0.358) USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 19 GLN : amide:sc= 0 X(o=0,f=-0.3) USER MOD Single : A 21 SER OG : rot 180:sc= -0.0286 USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 40 THR OG1 : rot 131:sc= -0.628 USER MOD Single : A 45 LYS NZ :NH3+ -165:sc= -0.021 (180deg=-0.187) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ -167:sc= -0.0201 (180deg=-0.176) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 GLN : amide:sc= -0.0749 K(o=-0.075,f=-0.62) USER MOD Single : A 54 LYS NZ :NH3+ -143:sc= -0.0256 (180deg=-0.309) USER MOD Single : A 58 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 LYS NZ :NH3+ 167:sc= -0.0339 (180deg=-0.218) USER MOD Single : A 70 GLN : amide:sc= 0.426 K(o=0.43,f=-1.5!) USER MOD Single : A 72 GLN :FLIP amide:sc= -0.161 F(o=-0.69,f=-0.16) USER MOD Single : A 80 ASN : amide:sc= 0 X(o=0,f=-0.26) USER MOD Single : A 81 THR OG1 : rot 180:sc= -0.255 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 THR OG1 : rot 180:sc= 0 USER MOD Single : A 95 HIS : no HD1:sc= -0.0217 X(o=-0.022,f=-0.019) USER MOD Single : A 96 ASN : amide:sc= -0.401 X(o=-0.4,f=-0.086) USER MOD Single : A 101 LYS NZ :NH3+ -164:sc= -0.0232 (180deg=-0.221) USER MOD Single : A 102 THR OG1 : rot 34:sc= 1 USER MOD Single : A 104 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 LYS NZ :NH3+ -143:sc=-0.000564 (180deg=-0.452) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 THR OG1 : rot 180:sc= 0.015 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0942) USER MOD Single : A 118 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 122 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0547) USER MOD Single : A 123 LYS NZ :NH3+ -167:sc= -0.0201 (180deg=-0.215) USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 LYS NZ :NH3+ 140:sc= 1.3 (180deg=1.04) USER MOD Single : A 126 LYS NZ :NH3+ 165:sc= -0.0579 (180deg=-0.279) USER MOD Single : A 129 LYS NZ :NH3+ 146:sc= 1.21 (180deg=0.87) USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 GLN : amide:sc= 0 X(o=0,f=-0.39) USER MOD Single : A 133 LYS NZ :NH3+ 163:sc= -0.0377 (180deg=-0.26) USER MOD Single : A 134 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -38.899 29.739 -1.240 1.00 0.00 N ATOM 2 CA GLY A 1 -37.971 30.587 -2.011 1.00 0.00 C ATOM 3 C GLY A 1 -36.739 30.936 -1.214 1.00 0.00 C ATOM 4 O GLY A 1 -36.638 30.586 -0.041 1.00 0.00 O ATOM 0 H1 GLY A 1 -38.984 28.810 -1.700 1.00 0.00 H new ATOM 0 H2 GLY A 1 -38.534 29.615 -0.274 1.00 0.00 H new ATOM 0 H3 GLY A 1 -39.834 30.193 -1.201 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -37.679 30.069 -2.924 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -38.480 31.502 -2.313 1.00 0.00 H new ATOM 10 N LYS A 2 -35.811 31.646 -1.839 1.00 0.00 N ATOM 11 CA LYS A 2 -34.554 32.007 -1.194 1.00 0.00 C ATOM 12 C LYS A 2 -34.659 33.339 -0.450 1.00 0.00 C ATOM 13 O LYS A 2 -33.666 33.842 0.081 1.00 0.00 O ATOM 14 CB LYS A 2 -33.419 32.068 -2.225 1.00 0.00 C ATOM 15 CG LYS A 2 -33.626 33.103 -3.325 1.00 0.00 C ATOM 16 CD LYS A 2 -32.431 33.170 -4.265 1.00 0.00 C ATOM 17 CE LYS A 2 -31.176 33.656 -3.546 1.00 0.00 C ATOM 18 NZ LYS A 2 -30.013 33.747 -4.464 1.00 0.00 N ATOM 0 H LYS A 2 -35.904 31.985 -2.796 1.00 0.00 H new ATOM 0 HA LYS A 2 -34.331 31.232 -0.461 1.00 0.00 H new ATOM 0 HB2 LYS A 2 -32.485 32.287 -1.707 1.00 0.00 H new ATOM 0 HB3 LYS A 2 -33.307 31.085 -2.683 1.00 0.00 H new ATOM 0 HG2 LYS A 2 -34.523 32.856 -3.893 1.00 0.00 H new ATOM 0 HG3 LYS A 2 -33.792 34.083 -2.877 1.00 0.00 H new ATOM 0 HD2 LYS A 2 -32.247 32.184 -4.692 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -32.658 33.839 -5.095 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -31.367 34.634 -3.103 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -30.940 32.976 -2.727 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -29.180 34.081 -3.938 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -29.815 32.809 -4.867 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -30.228 34.415 -5.231 1.00 0.00 H new ATOM 32 N LYS A 3 -35.862 33.907 -0.413 1.00 0.00 N ATOM 33 CA LYS A 3 -36.088 35.184 0.268 1.00 0.00 C ATOM 34 C LYS A 3 -35.868 35.063 1.774 1.00 0.00 C ATOM 35 O LYS A 3 -35.505 36.041 2.431 1.00 0.00 O ATOM 36 CB LYS A 3 -37.511 35.703 0.003 1.00 0.00 C ATOM 37 CG LYS A 3 -38.618 34.786 0.528 1.00 0.00 C ATOM 38 CD LYS A 3 -39.993 35.440 0.431 1.00 0.00 C ATOM 39 CE LYS A 3 -40.144 36.611 1.406 1.00 0.00 C ATOM 40 NZ LYS A 3 -40.099 36.177 2.828 1.00 0.00 N ATOM 0 H LYS A 3 -36.695 33.506 -0.845 1.00 0.00 H new ATOM 0 HA LYS A 3 -35.364 35.892 -0.135 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -37.619 36.685 0.462 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -37.643 35.837 -1.071 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -38.618 33.855 -0.039 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -38.412 34.526 1.566 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -40.155 35.794 -0.587 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -40.763 34.696 0.636 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -39.350 37.335 1.225 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -41.089 37.120 1.214 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -40.453 36.943 3.436 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -40.694 35.333 2.952 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -39.118 35.952 3.091 1.00 0.00 H new ATOM 54 N GLU A 4 -36.088 33.853 2.310 1.00 0.00 N ATOM 55 CA GLU A 4 -35.984 33.594 3.752 1.00 0.00 C ATOM 56 C GLU A 4 -36.990 34.446 4.525 1.00 0.00 C ATOM 57 O GLU A 4 -37.860 35.091 3.924 1.00 0.00 O ATOM 58 CB GLU A 4 -34.566 33.886 4.276 1.00 0.00 C ATOM 59 CG GLU A 4 -33.473 33.008 3.698 1.00 0.00 C ATOM 60 CD GLU A 4 -32.133 33.284 4.348 1.00 0.00 C ATOM 61 OE1 GLU A 4 -31.908 32.804 5.481 1.00 0.00 O ATOM 62 OE2 GLU A 4 -31.301 33.996 3.743 1.00 0.00 O ATOM 0 H GLU A 4 -36.341 33.032 1.760 1.00 0.00 H new ATOM 0 HA GLU A 4 -36.203 32.538 3.907 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -34.324 34.927 4.064 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -34.566 33.773 5.360 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -33.736 31.959 3.837 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -33.399 33.178 2.624 1.00 0.00 H new ATOM 69 N LYS A 5 -36.875 34.413 5.855 1.00 0.00 N ATOM 70 CA LYS A 5 -37.687 35.237 6.763 1.00 0.00 C ATOM 71 C LYS A 5 -39.184 35.173 6.441 1.00 0.00 C ATOM 72 O LYS A 5 -39.729 36.064 5.782 1.00 0.00 O ATOM 73 CB LYS A 5 -37.195 36.689 6.733 1.00 0.00 C ATOM 74 CG LYS A 5 -35.686 36.816 6.859 1.00 0.00 C ATOM 75 CD LYS A 5 -35.229 38.258 6.752 1.00 0.00 C ATOM 76 CE LYS A 5 -33.715 38.346 6.632 1.00 0.00 C ATOM 77 NZ LYS A 5 -33.022 37.673 7.760 1.00 0.00 N ATOM 0 H LYS A 5 -36.211 33.809 6.339 1.00 0.00 H new ATOM 0 HA LYS A 5 -37.564 34.829 7.766 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -37.515 37.154 5.801 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -37.668 37.242 7.544 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -35.366 36.404 7.816 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -35.206 36.224 6.080 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -35.693 38.726 5.884 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -35.560 38.814 7.629 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -33.400 37.893 5.692 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -33.415 39.393 6.597 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -32.003 37.873 7.710 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -33.401 38.028 8.661 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -33.177 36.646 7.700 1.00 0.00 H new ATOM 91 N PRO A 6 -39.862 34.107 6.876 1.00 0.00 N ATOM 92 CA PRO A 6 -41.289 33.940 6.664 1.00 0.00 C ATOM 93 C PRO A 6 -42.073 34.478 7.855 1.00 0.00 C ATOM 94 O PRO A 6 -41.718 35.499 8.443 1.00 0.00 O ATOM 95 CB PRO A 6 -41.376 32.425 6.607 1.00 0.00 C ATOM 96 CG PRO A 6 -40.504 32.025 7.723 1.00 0.00 C ATOM 97 CD PRO A 6 -39.300 32.944 7.617 1.00 0.00 C ATOM 0 HA PRO A 6 -41.691 34.458 5.793 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -42.398 32.070 6.740 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -41.024 32.032 5.653 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -41.009 32.142 8.682 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -40.212 30.978 7.642 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -38.918 33.231 8.597 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -38.476 32.476 7.078 1.00 0.00 H new ATOM 105 N GLU A 7 -43.104 33.771 8.218 1.00 0.00 N ATOM 106 CA GLU A 7 -43.944 34.160 9.343 1.00 0.00 C ATOM 107 C GLU A 7 -43.688 33.234 10.497 1.00 0.00 C ATOM 108 O GLU A 7 -44.600 32.863 11.234 1.00 0.00 O ATOM 109 CB GLU A 7 -45.416 34.119 8.961 1.00 0.00 C ATOM 110 CG GLU A 7 -45.770 34.932 7.735 1.00 0.00 C ATOM 111 CD GLU A 7 -47.233 34.828 7.399 1.00 0.00 C ATOM 112 OE1 GLU A 7 -47.644 33.792 6.831 1.00 0.00 O ATOM 113 OE2 GLU A 7 -47.984 35.773 7.712 1.00 0.00 O ATOM 0 H GLU A 7 -43.396 32.911 7.753 1.00 0.00 H new ATOM 0 HA GLU A 7 -43.696 35.182 9.629 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -45.705 33.082 8.789 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -46.007 34.479 9.803 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -45.509 35.977 7.904 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -45.177 34.588 6.887 1.00 0.00 H new ATOM 120 N LYS A 8 -42.425 32.894 10.653 1.00 0.00 N ATOM 121 CA LYS A 8 -41.973 31.943 11.673 1.00 0.00 C ATOM 122 C LYS A 8 -42.731 30.629 11.552 1.00 0.00 C ATOM 123 O LYS A 8 -42.881 29.888 12.521 1.00 0.00 O ATOM 124 CB LYS A 8 -42.159 32.542 13.055 1.00 0.00 C ATOM 125 CG LYS A 8 -41.384 33.820 13.249 1.00 0.00 C ATOM 126 CD LYS A 8 -41.693 34.463 14.582 1.00 0.00 C ATOM 127 CE LYS A 8 -40.912 35.750 14.763 1.00 0.00 C ATOM 128 NZ LYS A 8 -41.201 36.736 13.689 1.00 0.00 N ATOM 0 H LYS A 8 -41.671 33.267 10.077 1.00 0.00 H new ATOM 0 HA LYS A 8 -40.914 31.738 11.519 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -43.218 32.737 13.222 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -41.846 31.816 13.805 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -40.316 33.612 13.184 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -41.622 34.516 12.445 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -42.761 34.670 14.650 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -41.450 33.771 15.388 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -41.155 36.188 15.731 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -39.845 35.528 14.773 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -40.857 37.674 13.977 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -40.722 36.445 12.813 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -42.227 36.779 13.524 1.00 0.00 H new ATOM 142 N LYS A 9 -43.199 30.355 10.346 1.00 0.00 N ATOM 143 CA LYS A 9 -43.959 29.176 10.067 1.00 0.00 C ATOM 144 C LYS A 9 -43.125 27.931 10.232 1.00 0.00 C ATOM 145 O LYS A 9 -42.045 27.799 9.644 1.00 0.00 O ATOM 146 CB LYS A 9 -44.535 29.216 8.659 1.00 0.00 C ATOM 147 CG LYS A 9 -45.411 28.017 8.322 1.00 0.00 C ATOM 148 CD LYS A 9 -45.756 27.971 6.842 1.00 0.00 C ATOM 149 CE LYS A 9 -46.624 26.762 6.515 1.00 0.00 C ATOM 150 NZ LYS A 9 -45.971 25.481 6.903 1.00 0.00 N ATOM 0 H LYS A 9 -43.054 30.957 9.535 1.00 0.00 H new ATOM 0 HA LYS A 9 -44.777 29.147 10.786 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -45.121 30.127 8.541 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -43.716 29.269 7.942 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -44.896 27.099 8.604 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -46.329 28.061 8.908 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -46.279 28.885 6.559 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -44.839 27.934 6.253 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -47.580 26.852 7.032 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -46.839 26.749 5.447 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -46.513 24.683 6.513 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -45.002 25.458 6.527 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -45.942 25.406 7.940 1.00 0.00 H new ATOM 164 N VAL A 10 -43.629 27.034 11.017 1.00 0.00 N ATOM 165 CA VAL A 10 -42.980 25.774 11.238 1.00 0.00 C ATOM 166 C VAL A 10 -43.551 24.752 10.268 1.00 0.00 C ATOM 167 O VAL A 10 -44.591 24.991 9.634 1.00 0.00 O ATOM 168 CB VAL A 10 -43.163 25.296 12.707 1.00 0.00 C ATOM 169 CG1 VAL A 10 -44.614 24.939 12.999 1.00 0.00 C ATOM 170 CG2 VAL A 10 -42.236 24.132 13.045 1.00 0.00 C ATOM 0 H VAL A 10 -44.505 27.151 11.526 1.00 0.00 H new ATOM 0 HA VAL A 10 -41.910 25.888 11.066 1.00 0.00 H new ATOM 0 HB VAL A 10 -42.887 26.132 13.350 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -44.706 24.609 14.034 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -45.243 25.815 12.840 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -44.933 24.137 12.333 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -42.395 23.829 14.080 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -42.450 23.293 12.384 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -41.199 24.442 12.914 1.00 0.00 H new ATOM 180 N LYS A 11 -42.882 23.646 10.134 1.00 0.00 N ATOM 181 CA LYS A 11 -43.330 22.598 9.252 1.00 0.00 C ATOM 182 C LYS A 11 -44.333 21.722 9.975 1.00 0.00 C ATOM 183 O LYS A 11 -44.439 21.775 11.206 1.00 0.00 O ATOM 184 CB LYS A 11 -42.144 21.768 8.774 1.00 0.00 C ATOM 185 CG LYS A 11 -41.067 22.595 8.100 1.00 0.00 C ATOM 186 CD LYS A 11 -39.877 21.746 7.706 1.00 0.00 C ATOM 187 CE LYS A 11 -38.791 22.592 7.065 1.00 0.00 C ATOM 188 NZ LYS A 11 -38.293 23.649 7.982 1.00 0.00 N ATOM 0 H LYS A 11 -42.014 23.440 10.628 1.00 0.00 H new ATOM 0 HA LYS A 11 -43.810 23.042 8.380 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -41.710 21.243 9.625 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -42.498 21.008 8.077 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -41.479 23.078 7.214 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -40.742 23.388 8.773 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -39.478 21.242 8.587 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -40.195 20.969 7.011 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -37.961 21.951 6.767 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -39.180 23.054 6.157 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -37.398 24.033 7.616 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -38.996 24.412 8.046 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -38.135 23.243 8.926 1.00 0.00 H new ATOM 202 N LYS A 12 -45.073 20.929 9.228 1.00 0.00 N ATOM 203 CA LYS A 12 -46.056 20.049 9.825 1.00 0.00 C ATOM 204 C LYS A 12 -45.368 18.889 10.521 1.00 0.00 C ATOM 205 O LYS A 12 -44.146 18.817 10.527 1.00 0.00 O ATOM 206 CB LYS A 12 -47.051 19.561 8.776 1.00 0.00 C ATOM 207 CG LYS A 12 -47.888 20.685 8.193 1.00 0.00 C ATOM 208 CD LYS A 12 -48.919 20.174 7.210 1.00 0.00 C ATOM 209 CE LYS A 12 -49.785 21.312 6.697 1.00 0.00 C ATOM 210 NZ LYS A 12 -50.805 20.842 5.736 1.00 0.00 N ATOM 0 H LYS A 12 -45.013 20.876 8.211 1.00 0.00 H new ATOM 0 HA LYS A 12 -46.618 20.606 10.575 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -46.509 19.063 7.972 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -47.710 18.818 9.225 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -48.390 21.219 9.000 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -47.235 21.402 7.694 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -48.420 19.685 6.373 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -49.545 19.422 7.691 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -50.277 21.801 7.538 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -49.154 22.061 6.218 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -51.374 21.650 5.411 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -50.336 20.399 4.921 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -51.424 20.147 6.199 1.00 0.00 H new ATOM 224 N SER A 13 -46.155 17.996 11.105 1.00 0.00 N ATOM 225 CA SER A 13 -45.633 16.867 11.871 1.00 0.00 C ATOM 226 C SER A 13 -44.603 16.048 11.096 1.00 0.00 C ATOM 227 O SER A 13 -44.948 15.174 10.302 1.00 0.00 O ATOM 228 CB SER A 13 -46.786 15.985 12.336 1.00 0.00 C ATOM 229 OG SER A 13 -47.734 16.755 13.062 1.00 0.00 O ATOM 0 H SER A 13 -47.173 18.032 11.063 1.00 0.00 H new ATOM 0 HA SER A 13 -45.110 17.274 12.736 1.00 0.00 H new ATOM 0 HB2 SER A 13 -47.267 15.520 11.475 1.00 0.00 H new ATOM 0 HB3 SER A 13 -46.406 15.178 12.963 1.00 0.00 H new ATOM 0 HG SER A 13 -48.470 16.177 13.353 1.00 0.00 H new ATOM 235 N ASP A 14 -43.341 16.373 11.318 1.00 0.00 N ATOM 236 CA ASP A 14 -42.238 15.670 10.710 1.00 0.00 C ATOM 237 C ASP A 14 -41.433 14.977 11.797 1.00 0.00 C ATOM 238 O ASP A 14 -41.166 15.557 12.850 1.00 0.00 O ATOM 239 CB ASP A 14 -41.355 16.638 9.895 1.00 0.00 C ATOM 240 CG ASP A 14 -40.582 17.640 10.747 1.00 0.00 C ATOM 241 OD1 ASP A 14 -41.209 18.422 11.485 1.00 0.00 O ATOM 242 OD2 ASP A 14 -39.333 17.661 10.659 1.00 0.00 O ATOM 0 H ASP A 14 -43.057 17.138 11.930 1.00 0.00 H new ATOM 0 HA ASP A 14 -42.622 14.921 10.018 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -40.647 16.057 9.304 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -41.985 17.184 9.192 1.00 0.00 H new ATOM 247 N CYS A 15 -41.074 13.737 11.563 1.00 0.00 N ATOM 248 CA CYS A 15 -40.355 12.969 12.566 1.00 0.00 C ATOM 249 C CYS A 15 -38.905 12.723 12.169 1.00 0.00 C ATOM 250 O CYS A 15 -38.249 11.832 12.713 1.00 0.00 O ATOM 251 CB CYS A 15 -41.073 11.642 12.821 1.00 0.00 C ATOM 252 SG CYS A 15 -41.409 10.677 11.312 1.00 0.00 S ATOM 0 H CYS A 15 -41.264 13.236 10.695 1.00 0.00 H new ATOM 0 HA CYS A 15 -40.341 13.555 13.485 1.00 0.00 H new ATOM 0 HB2 CYS A 15 -40.469 11.039 13.498 1.00 0.00 H new ATOM 0 HB3 CYS A 15 -42.016 11.843 13.329 1.00 0.00 H new ATOM 257 N GLY A 16 -38.389 13.521 11.248 1.00 0.00 N ATOM 258 CA GLY A 16 -37.025 13.346 10.819 1.00 0.00 C ATOM 259 C GLY A 16 -36.619 14.372 9.795 1.00 0.00 C ATOM 260 O GLY A 16 -37.353 14.622 8.837 1.00 0.00 O ATOM 0 H GLY A 16 -38.891 14.283 10.793 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -36.362 13.413 11.682 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -36.902 12.347 10.400 1.00 0.00 H new ATOM 264 N GLU A 17 -35.481 14.996 10.003 1.00 0.00 N ATOM 265 CA GLU A 17 -34.957 15.949 9.074 1.00 0.00 C ATOM 266 C GLU A 17 -33.776 15.355 8.370 1.00 0.00 C ATOM 267 O GLU A 17 -33.244 14.333 8.802 1.00 0.00 O ATOM 268 CB GLU A 17 -34.482 17.208 9.782 1.00 0.00 C ATOM 269 CG GLU A 17 -35.471 17.820 10.769 1.00 0.00 C ATOM 270 CD GLU A 17 -35.293 17.292 12.185 1.00 0.00 C ATOM 271 OE1 GLU A 17 -35.866 16.231 12.515 1.00 0.00 O ATOM 272 OE2 GLU A 17 -34.584 17.943 12.980 1.00 0.00 O ATOM 0 H GLU A 17 -34.897 14.850 10.827 1.00 0.00 H new ATOM 0 HA GLU A 17 -35.753 16.204 8.375 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -33.559 16.978 10.315 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -34.237 17.957 9.029 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -35.351 18.903 10.772 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -36.487 17.613 10.434 1.00 0.00 H new ATOM 279 N TRP A 18 -33.382 15.973 7.279 1.00 0.00 N ATOM 280 CA TRP A 18 -32.187 15.594 6.597 1.00 0.00 C ATOM 281 C TRP A 18 -30.986 15.666 7.519 1.00 0.00 C ATOM 282 O TRP A 18 -30.698 16.715 8.103 1.00 0.00 O ATOM 283 CB TRP A 18 -31.970 16.504 5.418 1.00 0.00 C ATOM 284 CG TRP A 18 -32.913 16.238 4.319 1.00 0.00 C ATOM 285 CD1 TRP A 18 -33.890 17.058 3.871 1.00 0.00 C ATOM 286 CD2 TRP A 18 -32.989 15.049 3.545 1.00 0.00 C ATOM 287 NE1 TRP A 18 -34.573 16.456 2.859 1.00 0.00 N ATOM 288 CE2 TRP A 18 -34.035 15.215 2.633 1.00 0.00 C ATOM 289 CE3 TRP A 18 -32.265 13.863 3.538 1.00 0.00 C ATOM 290 CZ2 TRP A 18 -34.382 14.226 1.711 1.00 0.00 C ATOM 291 CZ3 TRP A 18 -32.602 12.882 2.632 1.00 0.00 C ATOM 292 CH2 TRP A 18 -33.650 13.066 1.728 1.00 0.00 C ATOM 0 H TRP A 18 -33.886 16.749 6.849 1.00 0.00 H new ATOM 0 HA TRP A 18 -32.298 14.564 6.257 1.00 0.00 H new ATOM 0 HB2 TRP A 18 -32.074 17.540 5.739 1.00 0.00 H new ATOM 0 HB3 TRP A 18 -30.950 16.384 5.054 1.00 0.00 H new ATOM 0 HD1 TRP A 18 -34.098 18.044 4.259 1.00 0.00 H new ATOM 0 HE1 TRP A 18 -35.358 16.862 2.351 1.00 0.00 H new ATOM 0 HE3 TRP A 18 -31.451 13.713 4.232 1.00 0.00 H new ATOM 0 HZ2 TRP A 18 -35.194 14.368 1.013 1.00 0.00 H new ATOM 0 HZ3 TRP A 18 -32.047 11.956 2.621 1.00 0.00 H new ATOM 0 HH2 TRP A 18 -33.889 12.279 1.028 1.00 0.00 H new ATOM 303 N GLN A 19 -30.296 14.561 7.642 1.00 0.00 N ATOM 304 CA GLN A 19 -29.104 14.488 8.448 1.00 0.00 C ATOM 305 C GLN A 19 -27.951 14.189 7.522 1.00 0.00 C ATOM 306 O GLN A 19 -27.914 13.130 6.901 1.00 0.00 O ATOM 307 CB GLN A 19 -29.241 13.383 9.496 1.00 0.00 C ATOM 308 CG GLN A 19 -30.381 13.606 10.481 1.00 0.00 C ATOM 309 CD GLN A 19 -30.628 12.403 11.366 1.00 0.00 C ATOM 310 OE1 GLN A 19 -29.710 11.635 11.666 1.00 0.00 O ATOM 311 NE2 GLN A 19 -31.863 12.230 11.792 1.00 0.00 N ATOM 0 H GLN A 19 -30.546 13.684 7.185 1.00 0.00 H new ATOM 0 HA GLN A 19 -28.939 15.428 8.975 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -29.394 12.431 8.988 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -28.306 13.303 10.050 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -30.154 14.471 11.104 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -31.292 13.841 9.930 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -32.593 12.889 11.521 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -32.089 11.438 12.393 1.00 0.00 H new ATOM 320 N TRP A 20 -27.025 15.114 7.412 1.00 0.00 N ATOM 321 CA TRP A 20 -25.935 14.967 6.470 1.00 0.00 C ATOM 322 C TRP A 20 -24.632 14.587 7.139 1.00 0.00 C ATOM 323 O TRP A 20 -24.322 15.039 8.248 1.00 0.00 O ATOM 324 CB TRP A 20 -25.762 16.243 5.645 1.00 0.00 C ATOM 325 CG TRP A 20 -26.894 16.497 4.706 1.00 0.00 C ATOM 326 CD1 TRP A 20 -27.889 17.402 4.868 1.00 0.00 C ATOM 327 CD2 TRP A 20 -27.148 15.832 3.461 1.00 0.00 C ATOM 328 NE1 TRP A 20 -28.757 17.348 3.802 1.00 0.00 N ATOM 329 CE2 TRP A 20 -28.323 16.391 2.925 1.00 0.00 C ATOM 330 CE3 TRP A 20 -26.496 14.819 2.749 1.00 0.00 C ATOM 331 CZ2 TRP A 20 -28.860 15.972 1.709 1.00 0.00 C ATOM 332 CZ3 TRP A 20 -27.031 14.405 1.542 1.00 0.00 C ATOM 333 CH2 TRP A 20 -28.202 14.980 1.034 1.00 0.00 C ATOM 0 H TRP A 20 -27.003 15.974 7.960 1.00 0.00 H new ATOM 0 HA TRP A 20 -26.201 14.145 5.806 1.00 0.00 H new ATOM 0 HB2 TRP A 20 -25.661 17.093 6.320 1.00 0.00 H new ATOM 0 HB3 TRP A 20 -24.835 16.176 5.076 1.00 0.00 H new ATOM 0 HD1 TRP A 20 -27.987 18.069 5.712 1.00 0.00 H new ATOM 0 HE1 TRP A 20 -29.589 17.927 3.684 1.00 0.00 H new ATOM 0 HE3 TRP A 20 -25.593 14.369 3.134 1.00 0.00 H new ATOM 0 HZ2 TRP A 20 -29.763 16.414 1.314 1.00 0.00 H new ATOM 0 HZ3 TRP A 20 -26.537 13.625 0.982 1.00 0.00 H new ATOM 0 HH2 TRP A 20 -28.594 14.633 0.089 1.00 0.00 H new ATOM 344 N SER A 21 -23.878 13.759 6.452 1.00 0.00 N ATOM 345 CA SER A 21 -22.587 13.305 6.903 1.00 0.00 C ATOM 346 C SER A 21 -21.501 14.040 6.115 1.00 0.00 C ATOM 347 O SER A 21 -21.800 14.739 5.139 1.00 0.00 O ATOM 348 CB SER A 21 -22.460 11.781 6.725 1.00 0.00 C ATOM 349 OG SER A 21 -21.264 11.281 7.312 1.00 0.00 O ATOM 0 H SER A 21 -24.152 13.376 5.547 1.00 0.00 H new ATOM 0 HA SER A 21 -22.470 13.524 7.964 1.00 0.00 H new ATOM 0 HB2 SER A 21 -23.321 11.289 7.177 1.00 0.00 H new ATOM 0 HB3 SER A 21 -22.474 11.536 5.663 1.00 0.00 H new ATOM 0 HG SER A 21 -21.217 10.311 7.182 1.00 0.00 H new ATOM 355 N VAL A 22 -20.261 13.872 6.516 1.00 0.00 N ATOM 356 CA VAL A 22 -19.154 14.567 5.885 1.00 0.00 C ATOM 357 C VAL A 22 -18.525 13.695 4.808 1.00 0.00 C ATOM 358 O VAL A 22 -18.655 12.472 4.839 1.00 0.00 O ATOM 359 CB VAL A 22 -18.072 14.975 6.914 1.00 0.00 C ATOM 360 CG1 VAL A 22 -18.628 15.991 7.900 1.00 0.00 C ATOM 361 CG2 VAL A 22 -17.536 13.750 7.651 1.00 0.00 C ATOM 0 H VAL A 22 -19.989 13.256 7.282 1.00 0.00 H new ATOM 0 HA VAL A 22 -19.556 15.474 5.434 1.00 0.00 H new ATOM 0 HB VAL A 22 -17.245 15.436 6.374 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -17.853 16.266 8.615 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -18.955 16.880 7.361 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -19.475 15.557 8.431 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -16.777 14.061 8.369 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -18.353 13.256 8.177 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -17.095 13.058 6.934 1.00 0.00 H new ATOM 371 N CYS A 23 -17.890 14.338 3.835 1.00 0.00 N ATOM 372 CA CYS A 23 -17.262 13.636 2.719 1.00 0.00 C ATOM 373 C CYS A 23 -16.250 12.608 3.210 1.00 0.00 C ATOM 374 O CYS A 23 -15.224 12.958 3.799 1.00 0.00 O ATOM 375 CB CYS A 23 -16.588 14.637 1.765 1.00 0.00 C ATOM 376 SG CYS A 23 -15.695 13.870 0.364 1.00 0.00 S ATOM 0 H CYS A 23 -17.795 15.353 3.796 1.00 0.00 H new ATOM 0 HA CYS A 23 -18.044 13.105 2.177 1.00 0.00 H new ATOM 0 HB2 CYS A 23 -17.348 15.310 1.369 1.00 0.00 H new ATOM 0 HB3 CYS A 23 -15.887 15.247 2.335 1.00 0.00 H new ATOM 381 N VAL A 24 -16.547 11.347 2.971 1.00 0.00 N ATOM 382 CA VAL A 24 -15.669 10.267 3.365 1.00 0.00 C ATOM 383 C VAL A 24 -15.038 9.629 2.128 1.00 0.00 C ATOM 384 O VAL A 24 -15.745 9.160 1.230 1.00 0.00 O ATOM 385 CB VAL A 24 -16.405 9.196 4.217 1.00 0.00 C ATOM 386 CG1 VAL A 24 -16.693 9.739 5.611 1.00 0.00 C ATOM 387 CG2 VAL A 24 -17.702 8.756 3.549 1.00 0.00 C ATOM 0 H VAL A 24 -17.400 11.044 2.500 1.00 0.00 H new ATOM 0 HA VAL A 24 -14.884 10.690 3.992 1.00 0.00 H new ATOM 0 HB VAL A 24 -15.754 8.326 4.299 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -17.209 8.979 6.198 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -15.755 10.001 6.100 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -17.322 10.626 5.533 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -18.194 8.006 4.169 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -18.360 9.617 3.429 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -17.481 8.330 2.571 1.00 0.00 H new ATOM 397 N PRO A 25 -13.700 9.640 2.051 1.00 0.00 N ATOM 398 CA PRO A 25 -12.967 9.115 0.895 1.00 0.00 C ATOM 399 C PRO A 25 -13.072 7.596 0.737 1.00 0.00 C ATOM 400 O PRO A 25 -12.860 6.838 1.682 1.00 0.00 O ATOM 401 CB PRO A 25 -11.516 9.528 1.168 1.00 0.00 C ATOM 402 CG PRO A 25 -11.436 9.701 2.646 1.00 0.00 C ATOM 403 CD PRO A 25 -12.794 10.178 3.086 1.00 0.00 C ATOM 0 HA PRO A 25 -13.375 9.508 -0.036 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -10.817 8.767 0.821 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -11.264 10.452 0.648 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -11.176 8.762 3.135 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -10.664 10.423 2.912 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -13.049 9.803 4.077 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -12.841 11.266 3.135 1.00 0.00 H new ATOM 411 N THR A 26 -13.422 7.179 -0.467 1.00 0.00 N ATOM 412 CA THR A 26 -13.503 5.783 -0.816 1.00 0.00 C ATOM 413 C THR A 26 -12.096 5.242 -1.054 1.00 0.00 C ATOM 414 O THR A 26 -11.843 4.042 -0.939 1.00 0.00 O ATOM 415 CB THR A 26 -14.384 5.587 -2.085 1.00 0.00 C ATOM 416 OG1 THR A 26 -15.722 6.042 -1.815 1.00 0.00 O ATOM 417 CG2 THR A 26 -14.426 4.129 -2.524 1.00 0.00 C ATOM 0 H THR A 26 -13.659 7.810 -1.232 1.00 0.00 H new ATOM 0 HA THR A 26 -13.967 5.234 0.003 1.00 0.00 H new ATOM 0 HB THR A 26 -13.941 6.169 -2.893 1.00 0.00 H new ATOM 0 HG1 THR A 26 -16.276 5.920 -2.614 1.00 0.00 H new ATOM 0 HG21 THR A 26 -15.051 4.034 -3.412 1.00 0.00 H new ATOM 0 HG22 THR A 26 -13.416 3.789 -2.753 1.00 0.00 H new ATOM 0 HG23 THR A 26 -14.841 3.519 -1.722 1.00 0.00 H new ATOM 425 N SER A 27 -11.181 6.147 -1.362 1.00 0.00 N ATOM 426 CA SER A 27 -9.810 5.783 -1.614 1.00 0.00 C ATOM 427 C SER A 27 -8.887 7.000 -1.448 1.00 0.00 C ATOM 428 O SER A 27 -9.021 7.996 -2.161 1.00 0.00 O ATOM 429 CB SER A 27 -9.700 5.206 -3.018 1.00 0.00 C ATOM 430 OG SER A 27 -8.422 4.634 -3.259 1.00 0.00 O ATOM 0 H SER A 27 -11.373 7.146 -1.442 1.00 0.00 H new ATOM 0 HA SER A 27 -9.495 5.031 -0.891 1.00 0.00 H new ATOM 0 HB2 SER A 27 -10.470 4.447 -3.160 1.00 0.00 H new ATOM 0 HB3 SER A 27 -9.889 5.992 -3.749 1.00 0.00 H new ATOM 0 HG SER A 27 -8.392 4.273 -4.170 1.00 0.00 H new ATOM 436 N GLY A 28 -7.984 6.912 -0.475 1.00 0.00 N ATOM 437 CA GLY A 28 -7.030 7.978 -0.205 1.00 0.00 C ATOM 438 C GLY A 28 -6.119 8.269 -1.376 1.00 0.00 C ATOM 439 O GLY A 28 -5.718 9.413 -1.588 1.00 0.00 O ATOM 0 H GLY A 28 -7.895 6.105 0.143 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -7.573 8.885 0.059 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -6.425 7.706 0.660 1.00 0.00 H new ATOM 443 N ASP A 29 -5.796 7.239 -2.146 1.00 0.00 N ATOM 444 CA ASP A 29 -4.937 7.391 -3.328 1.00 0.00 C ATOM 445 C ASP A 29 -5.696 8.006 -4.487 1.00 0.00 C ATOM 446 O ASP A 29 -5.713 7.452 -5.592 1.00 0.00 O ATOM 447 CB ASP A 29 -4.347 6.051 -3.761 1.00 0.00 C ATOM 448 CG ASP A 29 -3.107 5.681 -2.993 1.00 0.00 C ATOM 449 OD1 ASP A 29 -2.039 6.267 -3.268 1.00 0.00 O ATOM 450 OD2 ASP A 29 -3.183 4.792 -2.120 1.00 0.00 O ATOM 0 H ASP A 29 -6.113 6.284 -1.979 1.00 0.00 H new ATOM 0 HA ASP A 29 -4.124 8.060 -3.045 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -5.096 5.270 -3.629 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -4.111 6.090 -4.824 1.00 0.00 H new ATOM 455 N CYS A 30 -6.329 9.140 -4.227 1.00 0.00 N ATOM 456 CA CYS A 30 -7.090 9.868 -5.239 1.00 0.00 C ATOM 457 C CYS A 30 -8.297 9.052 -5.674 1.00 0.00 C ATOM 458 O CYS A 30 -8.262 8.350 -6.694 1.00 0.00 O ATOM 459 CB CYS A 30 -6.202 10.233 -6.447 1.00 0.00 C ATOM 460 SG CYS A 30 -7.073 11.102 -7.795 1.00 0.00 S ATOM 0 H CYS A 30 -6.331 9.584 -3.309 1.00 0.00 H new ATOM 0 HA CYS A 30 -7.444 10.801 -4.800 1.00 0.00 H new ATOM 0 HB2 CYS A 30 -5.380 10.859 -6.101 1.00 0.00 H new ATOM 0 HB3 CYS A 30 -5.761 9.320 -6.846 1.00 0.00 H new ATOM 465 N GLY A 31 -9.345 9.109 -4.878 1.00 0.00 N ATOM 466 CA GLY A 31 -10.515 8.337 -5.168 1.00 0.00 C ATOM 467 C GLY A 31 -11.799 8.971 -4.714 1.00 0.00 C ATOM 468 O GLY A 31 -11.807 9.818 -3.819 1.00 0.00 O ATOM 0 H GLY A 31 -9.402 9.679 -4.034 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -10.567 8.167 -6.243 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -10.418 7.360 -4.695 1.00 0.00 H new ATOM 472 N LEU A 32 -12.880 8.552 -5.360 1.00 0.00 N ATOM 473 CA LEU A 32 -14.241 9.007 -5.078 1.00 0.00 C ATOM 474 C LEU A 32 -14.578 8.947 -3.598 1.00 0.00 C ATOM 475 O LEU A 32 -13.934 8.249 -2.833 1.00 0.00 O ATOM 476 CB LEU A 32 -15.277 8.211 -5.895 1.00 0.00 C ATOM 477 CG LEU A 32 -15.463 8.630 -7.370 1.00 0.00 C ATOM 478 CD1 LEU A 32 -15.906 10.083 -7.470 1.00 0.00 C ATOM 479 CD2 LEU A 32 -14.193 8.400 -8.181 1.00 0.00 C ATOM 0 H LEU A 32 -12.836 7.868 -6.115 1.00 0.00 H new ATOM 0 HA LEU A 32 -14.285 10.053 -5.381 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -14.993 7.159 -5.873 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -16.241 8.292 -5.394 1.00 0.00 H new ATOM 0 HG LEU A 32 -16.246 8.001 -7.792 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -16.030 10.354 -8.518 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -16.854 10.211 -6.947 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -15.152 10.725 -7.016 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -14.360 8.706 -9.214 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -13.379 8.987 -7.756 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -13.930 7.342 -8.154 1.00 0.00 H new ATOM 491 N GLY A 33 -15.561 9.715 -3.202 1.00 0.00 N ATOM 492 CA GLY A 33 -15.958 9.779 -1.826 1.00 0.00 C ATOM 493 C GLY A 33 -17.460 9.716 -1.748 1.00 0.00 C ATOM 494 O GLY A 33 -18.121 9.689 -2.783 1.00 0.00 O ATOM 0 H GLY A 33 -16.105 10.311 -3.826 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -15.517 8.953 -1.268 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -15.595 10.701 -1.372 1.00 0.00 H new ATOM 498 N THR A 34 -18.019 9.695 -0.563 1.00 0.00 N ATOM 499 CA THR A 34 -19.464 9.632 -0.450 1.00 0.00 C ATOM 500 C THR A 34 -20.013 10.506 0.669 1.00 0.00 C ATOM 501 O THR A 34 -19.303 10.866 1.610 1.00 0.00 O ATOM 502 CB THR A 34 -19.967 8.181 -0.263 1.00 0.00 C ATOM 503 OG1 THR A 34 -19.102 7.469 0.626 1.00 0.00 O ATOM 504 CG2 THR A 34 -20.051 7.451 -1.596 1.00 0.00 C ATOM 0 H THR A 34 -17.513 9.720 0.322 1.00 0.00 H new ATOM 0 HA THR A 34 -19.841 10.021 -1.396 1.00 0.00 H new ATOM 0 HB THR A 34 -20.968 8.226 0.166 1.00 0.00 H new ATOM 0 HG1 THR A 34 -19.431 6.553 0.738 1.00 0.00 H new ATOM 0 HG21 THR A 34 -20.407 6.434 -1.432 1.00 0.00 H new ATOM 0 HG22 THR A 34 -20.742 7.976 -2.255 1.00 0.00 H new ATOM 0 HG23 THR A 34 -19.064 7.420 -2.056 1.00 0.00 H new ATOM 512 N ARG A 35 -21.272 10.874 0.516 1.00 0.00 N ATOM 513 CA ARG A 35 -22.018 11.611 1.514 1.00 0.00 C ATOM 514 C ARG A 35 -23.388 10.990 1.645 1.00 0.00 C ATOM 515 O ARG A 35 -24.002 10.622 0.640 1.00 0.00 O ATOM 516 CB ARG A 35 -22.155 13.090 1.138 1.00 0.00 C ATOM 517 CG ARG A 35 -20.890 13.906 1.326 1.00 0.00 C ATOM 518 CD ARG A 35 -21.157 15.381 1.084 1.00 0.00 C ATOM 519 NE ARG A 35 -20.014 16.215 1.455 1.00 0.00 N ATOM 520 CZ ARG A 35 -19.970 16.983 2.548 1.00 0.00 C ATOM 521 NH1 ARG A 35 -20.996 17.013 3.388 1.00 0.00 N ATOM 522 NH2 ARG A 35 -18.895 17.714 2.801 1.00 0.00 N ATOM 0 H ARG A 35 -21.813 10.664 -0.323 1.00 0.00 H new ATOM 0 HA ARG A 35 -21.480 11.561 2.461 1.00 0.00 H new ATOM 0 HB2 ARG A 35 -22.466 13.160 0.096 1.00 0.00 H new ATOM 0 HB3 ARG A 35 -22.950 13.532 1.738 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -20.506 13.763 2.336 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -20.120 13.554 0.640 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -21.394 15.538 0.032 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -22.031 15.689 1.657 1.00 0.00 H new ATOM 0 HE ARG A 35 -19.199 16.210 0.841 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -21.824 16.448 3.202 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -20.957 17.601 4.220 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -18.101 17.691 2.162 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -18.862 18.300 3.635 1.00 0.00 H new ATOM 536 N GLU A 36 -23.863 10.864 2.857 1.00 0.00 N ATOM 537 CA GLU A 36 -25.141 10.234 3.103 1.00 0.00 C ATOM 538 C GLU A 36 -26.069 11.142 3.891 1.00 0.00 C ATOM 539 O GLU A 36 -25.663 11.755 4.885 1.00 0.00 O ATOM 540 CB GLU A 36 -24.951 8.899 3.824 1.00 0.00 C ATOM 541 CG GLU A 36 -24.149 9.000 5.108 1.00 0.00 C ATOM 542 CD GLU A 36 -23.997 7.671 5.797 1.00 0.00 C ATOM 543 OE1 GLU A 36 -24.856 7.327 6.631 1.00 0.00 O ATOM 544 OE2 GLU A 36 -23.013 6.961 5.512 1.00 0.00 O ATOM 0 H GLU A 36 -23.383 11.190 3.696 1.00 0.00 H new ATOM 0 HA GLU A 36 -25.609 10.045 2.137 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -25.930 8.478 4.052 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -24.453 8.202 3.150 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -23.162 9.405 4.885 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -24.637 9.702 5.784 1.00 0.00 H new ATOM 551 N GLY A 37 -27.287 11.270 3.407 1.00 0.00 N ATOM 552 CA GLY A 37 -28.291 12.047 4.081 1.00 0.00 C ATOM 553 C GLY A 37 -29.584 11.274 4.141 1.00 0.00 C ATOM 554 O GLY A 37 -29.975 10.641 3.155 1.00 0.00 O ATOM 0 H GLY A 37 -27.602 10.838 2.538 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -27.957 12.293 5.089 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -28.445 12.991 3.557 1.00 0.00 H new ATOM 558 N THR A 38 -30.253 11.301 5.270 1.00 0.00 N ATOM 559 CA THR A 38 -31.475 10.537 5.434 1.00 0.00 C ATOM 560 C THR A 38 -32.580 11.394 6.034 1.00 0.00 C ATOM 561 O THR A 38 -32.304 12.371 6.732 1.00 0.00 O ATOM 562 CB THR A 38 -31.236 9.300 6.325 1.00 0.00 C ATOM 563 OG1 THR A 38 -30.435 9.668 7.460 1.00 0.00 O ATOM 564 CG2 THR A 38 -30.535 8.197 5.545 1.00 0.00 C ATOM 0 H THR A 38 -29.975 11.842 6.089 1.00 0.00 H new ATOM 0 HA THR A 38 -31.788 10.205 4.444 1.00 0.00 H new ATOM 0 HB THR A 38 -32.203 8.927 6.661 1.00 0.00 H new ATOM 0 HG1 THR A 38 -30.286 8.881 8.025 1.00 0.00 H new ATOM 0 HG21 THR A 38 -30.378 7.336 6.194 1.00 0.00 H new ATOM 0 HG22 THR A 38 -31.152 7.903 4.696 1.00 0.00 H new ATOM 0 HG23 THR A 38 -29.573 8.561 5.185 1.00 0.00 H new ATOM 572 N ARG A 39 -33.827 11.043 5.733 1.00 0.00 N ATOM 573 CA ARG A 39 -34.982 11.761 6.255 1.00 0.00 C ATOM 574 C ARG A 39 -36.200 10.838 6.277 1.00 0.00 C ATOM 575 O ARG A 39 -36.225 9.815 5.594 1.00 0.00 O ATOM 576 CB ARG A 39 -35.286 12.992 5.389 1.00 0.00 C ATOM 577 CG ARG A 39 -36.338 13.916 5.982 1.00 0.00 C ATOM 578 CD ARG A 39 -36.723 15.022 5.022 1.00 0.00 C ATOM 579 NE ARG A 39 -37.628 15.993 5.644 1.00 0.00 N ATOM 580 CZ ARG A 39 -38.317 16.922 4.977 1.00 0.00 C ATOM 581 NH1 ARG A 39 -38.246 16.991 3.654 1.00 0.00 N ATOM 582 NH2 ARG A 39 -39.082 17.778 5.639 1.00 0.00 N ATOM 0 H ARG A 39 -34.063 10.259 5.125 1.00 0.00 H new ATOM 0 HA ARG A 39 -34.756 12.091 7.269 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -34.365 13.555 5.239 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -35.620 12.659 4.406 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -37.224 13.337 6.243 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -35.959 14.353 6.906 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -35.824 15.533 4.677 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -37.202 14.590 4.143 1.00 0.00 H new ATOM 0 HE ARG A 39 -37.739 15.956 6.657 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -37.662 16.332 3.140 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -38.775 17.703 3.151 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -39.143 17.726 6.656 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -39.609 18.489 5.132 1.00 0.00 H new ATOM 596 N THR A 40 -37.198 11.192 7.063 1.00 0.00 N ATOM 597 CA THR A 40 -38.418 10.430 7.113 1.00 0.00 C ATOM 598 C THR A 40 -39.587 11.292 6.653 1.00 0.00 C ATOM 599 O THR A 40 -39.481 12.522 6.605 1.00 0.00 O ATOM 600 CB THR A 40 -38.684 9.884 8.527 1.00 0.00 C ATOM 601 OG1 THR A 40 -38.390 10.891 9.500 1.00 0.00 O ATOM 602 CG2 THR A 40 -37.839 8.650 8.797 1.00 0.00 C ATOM 0 H THR A 40 -37.182 12.007 7.676 1.00 0.00 H new ATOM 0 HA THR A 40 -38.311 9.577 6.443 1.00 0.00 H new ATOM 0 HB THR A 40 -39.736 9.606 8.596 1.00 0.00 H new ATOM 0 HG1 THR A 40 -39.139 10.969 10.127 1.00 0.00 H new ATOM 0 HG21 THR A 40 -38.044 8.282 9.802 1.00 0.00 H new ATOM 0 HG22 THR A 40 -38.083 7.876 8.070 1.00 0.00 H new ATOM 0 HG23 THR A 40 -36.783 8.907 8.713 1.00 0.00 H new ATOM 610 N GLY A 41 -40.686 10.653 6.292 1.00 0.00 N ATOM 611 CA GLY A 41 -41.854 11.390 5.836 1.00 0.00 C ATOM 612 C GLY A 41 -42.675 11.934 6.989 1.00 0.00 C ATOM 613 O GLY A 41 -42.274 11.817 8.148 1.00 0.00 O ATOM 0 H GLY A 41 -40.795 9.639 6.305 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -41.535 12.215 5.199 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -42.477 10.737 5.225 1.00 0.00 H new ATOM 617 N ALA A 42 -43.837 12.499 6.681 1.00 0.00 N ATOM 618 CA ALA A 42 -44.694 13.081 7.713 1.00 0.00 C ATOM 619 C ALA A 42 -45.299 11.995 8.597 1.00 0.00 C ATOM 620 O ALA A 42 -45.500 12.192 9.792 1.00 0.00 O ATOM 621 CB ALA A 42 -45.791 13.922 7.074 1.00 0.00 C ATOM 0 H ALA A 42 -44.207 12.567 5.733 1.00 0.00 H new ATOM 0 HA ALA A 42 -44.081 13.725 8.343 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -46.422 14.350 7.853 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -45.341 14.725 6.490 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -46.397 13.294 6.420 1.00 0.00 H new ATOM 627 N GLU A 43 -45.575 10.843 8.006 1.00 0.00 N ATOM 628 CA GLU A 43 -46.079 9.694 8.748 1.00 0.00 C ATOM 629 C GLU A 43 -44.926 8.756 9.072 1.00 0.00 C ATOM 630 O GLU A 43 -45.122 7.584 9.401 1.00 0.00 O ATOM 631 CB GLU A 43 -47.152 8.969 7.933 1.00 0.00 C ATOM 632 CG GLU A 43 -48.311 9.862 7.522 1.00 0.00 C ATOM 633 CD GLU A 43 -49.436 9.095 6.870 1.00 0.00 C ATOM 634 OE1 GLU A 43 -49.397 8.896 5.640 1.00 0.00 O ATOM 635 OE2 GLU A 43 -50.369 8.682 7.590 1.00 0.00 O ATOM 0 H GLU A 43 -45.458 10.677 7.006 1.00 0.00 H new ATOM 0 HA GLU A 43 -46.531 10.034 9.680 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -46.694 8.548 7.038 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -47.537 8.133 8.517 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -48.693 10.382 8.401 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -47.950 10.625 6.832 1.00 0.00 H new ATOM 642 N CYS A 44 -43.727 9.311 8.978 1.00 0.00 N ATOM 643 CA CYS A 44 -42.483 8.589 9.200 1.00 0.00 C ATOM 644 C CYS A 44 -42.235 7.578 8.090 1.00 0.00 C ATOM 645 O CYS A 44 -42.164 6.367 8.322 1.00 0.00 O ATOM 646 CB CYS A 44 -42.452 7.923 10.582 1.00 0.00 C ATOM 647 SG CYS A 44 -42.523 9.109 11.968 1.00 0.00 S ATOM 0 H CYS A 44 -43.589 10.293 8.741 1.00 0.00 H new ATOM 0 HA CYS A 44 -41.672 9.317 9.177 1.00 0.00 H new ATOM 0 HB2 CYS A 44 -43.292 7.233 10.662 1.00 0.00 H new ATOM 0 HB3 CYS A 44 -41.542 7.329 10.669 1.00 0.00 H new ATOM 652 N LYS A 45 -42.139 8.094 6.873 1.00 0.00 N ATOM 653 CA LYS A 45 -41.838 7.287 5.702 1.00 0.00 C ATOM 654 C LYS A 45 -40.328 6.978 5.686 1.00 0.00 C ATOM 655 O LYS A 45 -39.717 6.840 6.741 1.00 0.00 O ATOM 656 CB LYS A 45 -42.262 8.053 4.435 1.00 0.00 C ATOM 657 CG LYS A 45 -42.587 7.175 3.232 1.00 0.00 C ATOM 658 CD LYS A 45 -43.657 6.150 3.564 1.00 0.00 C ATOM 659 CE LYS A 45 -44.140 5.427 2.317 1.00 0.00 C ATOM 660 NZ LYS A 45 -44.913 6.321 1.416 1.00 0.00 N ATOM 0 H LYS A 45 -42.268 9.085 6.671 1.00 0.00 H new ATOM 0 HA LYS A 45 -42.387 6.346 5.732 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -43.137 8.659 4.670 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -41.462 8.740 4.159 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -42.924 7.800 2.405 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -41.684 6.664 2.898 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -43.261 5.426 4.276 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -44.499 6.645 4.048 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -43.283 5.023 1.778 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -44.762 4.580 2.607 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -45.432 5.748 0.721 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -45.587 6.880 1.977 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -44.261 6.961 0.919 1.00 0.00 H new ATOM 674 N GLN A 46 -39.727 6.898 4.515 1.00 0.00 N ATOM 675 CA GLN A 46 -38.353 6.590 4.408 1.00 0.00 C ATOM 676 C GLN A 46 -37.773 7.252 3.165 1.00 0.00 C ATOM 677 O GLN A 46 -38.185 6.949 2.043 1.00 0.00 O ATOM 678 CB GLN A 46 -38.177 5.092 4.336 1.00 0.00 C ATOM 679 CG GLN A 46 -36.758 4.698 4.181 1.00 0.00 C ATOM 680 CD GLN A 46 -36.541 3.208 4.291 1.00 0.00 C ATOM 681 OE1 GLN A 46 -37.285 2.507 4.978 1.00 0.00 O ATOM 682 NE2 GLN A 46 -35.520 2.716 3.629 1.00 0.00 N ATOM 0 H GLN A 46 -40.196 7.048 3.622 1.00 0.00 H new ATOM 0 HA GLN A 46 -37.825 6.967 5.284 1.00 0.00 H new ATOM 0 HB2 GLN A 46 -38.581 4.637 5.241 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -38.754 4.701 3.498 1.00 0.00 H new ATOM 0 HG2 GLN A 46 -36.396 5.041 3.212 1.00 0.00 H new ATOM 0 HG3 GLN A 46 -36.162 5.203 4.941 1.00 0.00 H new ATOM 0 HE21 GLN A 46 -34.929 3.332 3.072 1.00 0.00 H new ATOM 0 HE22 GLN A 46 -35.318 1.717 3.672 1.00 0.00 H new ATOM 691 N THR A 47 -36.849 8.165 3.365 1.00 0.00 N ATOM 692 CA THR A 47 -36.218 8.859 2.264 1.00 0.00 C ATOM 693 C THR A 47 -34.705 8.884 2.470 1.00 0.00 C ATOM 694 O THR A 47 -34.216 9.377 3.488 1.00 0.00 O ATOM 695 CB THR A 47 -36.737 10.303 2.157 1.00 0.00 C ATOM 696 OG1 THR A 47 -38.165 10.315 2.338 1.00 0.00 O ATOM 697 CG2 THR A 47 -36.402 10.893 0.794 1.00 0.00 C ATOM 0 H THR A 47 -36.516 8.446 4.287 1.00 0.00 H new ATOM 0 HA THR A 47 -36.460 8.329 1.343 1.00 0.00 H new ATOM 0 HB THR A 47 -36.257 10.903 2.930 1.00 0.00 H new ATOM 0 HG1 THR A 47 -38.495 11.235 2.271 1.00 0.00 H new ATOM 0 HG21 THR A 47 -36.777 11.915 0.738 1.00 0.00 H new ATOM 0 HG22 THR A 47 -35.321 10.895 0.654 1.00 0.00 H new ATOM 0 HG23 THR A 47 -36.868 10.292 0.013 1.00 0.00 H new ATOM 705 N MET A 48 -33.969 8.349 1.517 1.00 0.00 N ATOM 706 CA MET A 48 -32.521 8.279 1.642 1.00 0.00 C ATOM 707 C MET A 48 -31.837 8.842 0.407 1.00 0.00 C ATOM 708 O MET A 48 -32.233 8.552 -0.724 1.00 0.00 O ATOM 709 CB MET A 48 -32.064 6.830 1.865 1.00 0.00 C ATOM 710 CG MET A 48 -32.715 6.144 3.059 1.00 0.00 C ATOM 711 SD MET A 48 -32.082 4.473 3.342 1.00 0.00 S ATOM 712 CE MET A 48 -32.501 3.674 1.791 1.00 0.00 C ATOM 0 H MET A 48 -34.343 7.958 0.652 1.00 0.00 H new ATOM 0 HA MET A 48 -32.237 8.881 2.505 1.00 0.00 H new ATOM 0 HB2 MET A 48 -32.279 6.251 0.967 1.00 0.00 H new ATOM 0 HB3 MET A 48 -30.982 6.819 2.000 1.00 0.00 H new ATOM 0 HG2 MET A 48 -32.549 6.746 3.952 1.00 0.00 H new ATOM 0 HG3 MET A 48 -33.793 6.097 2.902 1.00 0.00 H new ATOM 0 HE1 MET A 48 -32.473 2.592 1.920 1.00 0.00 H new ATOM 0 HE2 MET A 48 -33.502 3.977 1.484 1.00 0.00 H new ATOM 0 HE3 MET A 48 -31.783 3.967 1.025 1.00 0.00 H new ATOM 722 N LYS A 49 -30.822 9.655 0.629 1.00 0.00 N ATOM 723 CA LYS A 49 -30.047 10.231 -0.447 1.00 0.00 C ATOM 724 C LYS A 49 -28.567 10.076 -0.177 1.00 0.00 C ATOM 725 O LYS A 49 -28.090 10.400 0.909 1.00 0.00 O ATOM 726 CB LYS A 49 -30.366 11.704 -0.613 1.00 0.00 C ATOM 727 CG LYS A 49 -31.701 11.973 -1.261 1.00 0.00 C ATOM 728 CD LYS A 49 -31.804 13.420 -1.643 1.00 0.00 C ATOM 729 CE LYS A 49 -33.107 13.732 -2.359 1.00 0.00 C ATOM 730 NZ LYS A 49 -33.194 13.047 -3.669 1.00 0.00 N ATOM 0 H LYS A 49 -30.514 9.933 1.561 1.00 0.00 H new ATOM 0 HA LYS A 49 -30.308 9.701 -1.363 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -30.346 12.182 0.366 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -29.583 12.170 -1.211 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -31.818 11.346 -2.145 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -32.507 11.711 -0.575 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -31.726 14.037 -0.748 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -30.965 13.685 -2.286 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -33.947 13.428 -1.734 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -33.192 14.809 -2.506 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -33.980 13.449 -4.219 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -32.303 13.179 -4.190 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -33.360 12.031 -3.519 1.00 0.00 H new ATOM 744 N THR A 50 -27.843 9.583 -1.147 1.00 0.00 N ATOM 745 CA THR A 50 -26.422 9.455 -1.044 1.00 0.00 C ATOM 746 C THR A 50 -25.784 10.040 -2.284 1.00 0.00 C ATOM 747 O THR A 50 -26.202 9.730 -3.405 1.00 0.00 O ATOM 748 CB THR A 50 -25.995 7.989 -0.862 1.00 0.00 C ATOM 749 OG1 THR A 50 -26.842 7.119 -1.633 1.00 0.00 O ATOM 750 CG2 THR A 50 -26.050 7.593 0.602 1.00 0.00 C ATOM 0 H THR A 50 -28.229 9.259 -2.034 1.00 0.00 H new ATOM 0 HA THR A 50 -26.087 9.999 -0.161 1.00 0.00 H new ATOM 0 HB THR A 50 -24.968 7.889 -1.215 1.00 0.00 H new ATOM 0 HG1 THR A 50 -26.557 6.190 -1.508 1.00 0.00 H new ATOM 0 HG21 THR A 50 -25.744 6.552 0.709 1.00 0.00 H new ATOM 0 HG22 THR A 50 -25.377 8.230 1.177 1.00 0.00 H new ATOM 0 HG23 THR A 50 -27.068 7.712 0.973 1.00 0.00 H new ATOM 758 N GLN A 51 -24.788 10.883 -2.108 1.00 0.00 N ATOM 759 CA GLN A 51 -24.163 11.541 -3.237 1.00 0.00 C ATOM 760 C GLN A 51 -22.686 11.289 -3.231 1.00 0.00 C ATOM 761 O GLN A 51 -22.049 11.244 -2.170 1.00 0.00 O ATOM 762 CB GLN A 51 -24.451 13.047 -3.222 1.00 0.00 C ATOM 763 CG GLN A 51 -25.934 13.396 -3.279 1.00 0.00 C ATOM 764 CD GLN A 51 -26.607 12.897 -4.543 1.00 0.00 C ATOM 765 OE1 GLN A 51 -25.986 12.798 -5.598 1.00 0.00 O ATOM 766 NE2 GLN A 51 -27.882 12.579 -4.446 1.00 0.00 N ATOM 0 H GLN A 51 -24.395 11.128 -1.199 1.00 0.00 H new ATOM 0 HA GLN A 51 -24.586 11.126 -4.152 1.00 0.00 H new ATOM 0 HB2 GLN A 51 -24.021 13.480 -2.319 1.00 0.00 H new ATOM 0 HB3 GLN A 51 -23.946 13.511 -4.069 1.00 0.00 H new ATOM 0 HG2 GLN A 51 -26.437 12.968 -2.412 1.00 0.00 H new ATOM 0 HG3 GLN A 51 -26.051 14.478 -3.213 1.00 0.00 H new ATOM 0 HE21 GLN A 51 -28.365 12.674 -3.553 1.00 0.00 H new ATOM 0 HE22 GLN A 51 -28.386 12.237 -5.264 1.00 0.00 H new ATOM 775 N ARG A 52 -22.144 11.106 -4.403 1.00 0.00 N ATOM 776 CA ARG A 52 -20.751 10.799 -4.515 1.00 0.00 C ATOM 777 C ARG A 52 -19.889 12.044 -4.526 1.00 0.00 C ATOM 778 O ARG A 52 -19.904 12.849 -5.456 1.00 0.00 O ATOM 779 CB ARG A 52 -20.478 9.920 -5.730 1.00 0.00 C ATOM 780 CG ARG A 52 -21.205 8.586 -5.668 1.00 0.00 C ATOM 781 CD ARG A 52 -22.597 8.668 -6.262 1.00 0.00 C ATOM 782 NE ARG A 52 -23.331 7.407 -6.098 1.00 0.00 N ATOM 783 CZ ARG A 52 -23.785 6.654 -7.107 1.00 0.00 C ATOM 784 NH1 ARG A 52 -23.576 7.018 -8.371 1.00 0.00 N ATOM 785 NH2 ARG A 52 -24.447 5.534 -6.848 1.00 0.00 N ATOM 0 H ARG A 52 -22.646 11.164 -5.289 1.00 0.00 H new ATOM 0 HA ARG A 52 -20.475 10.235 -3.624 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -20.780 10.452 -6.632 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -19.406 9.741 -5.809 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -20.627 7.833 -6.203 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -21.273 8.258 -4.631 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -23.150 9.476 -5.784 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -22.527 8.913 -7.322 1.00 0.00 H new ATOM 0 HE ARG A 52 -23.507 7.082 -5.147 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -23.066 7.877 -8.577 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -23.926 6.438 -9.133 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -24.609 5.249 -5.882 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -24.794 4.958 -7.615 1.00 0.00 H new ATOM 799 N CYS A 53 -19.168 12.178 -3.442 1.00 0.00 N ATOM 800 CA CYS A 53 -18.195 13.226 -3.245 1.00 0.00 C ATOM 801 C CYS A 53 -17.010 13.015 -4.180 1.00 0.00 C ATOM 802 O CYS A 53 -16.656 11.880 -4.502 1.00 0.00 O ATOM 803 CB CYS A 53 -17.741 13.221 -1.776 1.00 0.00 C ATOM 804 SG CYS A 53 -16.637 14.587 -1.292 1.00 0.00 S ATOM 0 H CYS A 53 -19.243 11.543 -2.648 1.00 0.00 H new ATOM 0 HA CYS A 53 -18.640 14.194 -3.474 1.00 0.00 H new ATOM 0 HB2 CYS A 53 -18.626 13.249 -1.140 1.00 0.00 H new ATOM 0 HB3 CYS A 53 -17.234 12.278 -1.574 1.00 0.00 H new ATOM 809 N LYS A 54 -16.411 14.097 -4.623 1.00 0.00 N ATOM 810 CA LYS A 54 -15.298 14.022 -5.521 1.00 0.00 C ATOM 811 C LYS A 54 -14.043 14.534 -4.854 1.00 0.00 C ATOM 812 O LYS A 54 -14.084 15.501 -4.094 1.00 0.00 O ATOM 813 CB LYS A 54 -15.554 14.814 -6.795 1.00 0.00 C ATOM 814 CG LYS A 54 -14.555 14.489 -7.883 1.00 0.00 C ATOM 815 CD LYS A 54 -14.535 15.535 -8.976 1.00 0.00 C ATOM 816 CE LYS A 54 -13.588 15.135 -10.100 1.00 0.00 C ATOM 817 NZ LYS A 54 -12.237 14.746 -9.594 1.00 0.00 N ATOM 0 H LYS A 54 -16.685 15.046 -4.368 1.00 0.00 H new ATOM 0 HA LYS A 54 -15.166 12.973 -5.787 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -16.561 14.604 -7.155 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -15.511 15.880 -6.572 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -13.560 14.404 -7.446 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -14.796 13.518 -8.316 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -15.541 15.669 -9.374 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -14.226 16.494 -8.560 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -14.019 14.302 -10.655 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -13.486 15.965 -10.799 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -11.509 15.077 -10.259 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -12.078 15.179 -8.662 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -12.183 13.711 -9.509 1.00 0.00 H new ATOM 831 N ILE A 55 -12.941 13.890 -5.142 1.00 0.00 N ATOM 832 CA ILE A 55 -11.674 14.270 -4.577 1.00 0.00 C ATOM 833 C ILE A 55 -10.913 15.141 -5.587 1.00 0.00 C ATOM 834 O ILE A 55 -10.855 14.815 -6.782 1.00 0.00 O ATOM 835 CB ILE A 55 -10.838 13.005 -4.211 1.00 0.00 C ATOM 836 CG1 ILE A 55 -9.526 13.383 -3.525 1.00 0.00 C ATOM 837 CG2 ILE A 55 -10.561 12.167 -5.455 1.00 0.00 C ATOM 838 CD1 ILE A 55 -8.852 12.226 -2.818 1.00 0.00 C ATOM 0 H ILE A 55 -12.898 13.090 -5.773 1.00 0.00 H new ATOM 0 HA ILE A 55 -11.843 14.839 -3.663 1.00 0.00 H new ATOM 0 HB ILE A 55 -11.426 12.412 -3.510 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -8.842 13.791 -4.269 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -9.720 14.176 -2.802 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -9.977 11.289 -5.180 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -11.505 11.850 -5.898 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -10.003 12.762 -6.178 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -7.927 12.571 -2.355 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -9.517 11.832 -2.050 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -8.626 11.441 -3.539 1.00 0.00 H new ATOM 850 N PRO A 56 -10.390 16.301 -5.132 1.00 0.00 N ATOM 851 CA PRO A 56 -9.635 17.224 -5.984 1.00 0.00 C ATOM 852 C PRO A 56 -8.523 16.522 -6.750 1.00 0.00 C ATOM 853 O PRO A 56 -8.444 16.632 -7.976 1.00 0.00 O ATOM 854 CB PRO A 56 -9.047 18.226 -4.991 1.00 0.00 C ATOM 855 CG PRO A 56 -10.001 18.220 -3.850 1.00 0.00 C ATOM 856 CD PRO A 56 -10.520 16.811 -3.751 1.00 0.00 C ATOM 0 HA PRO A 56 -10.265 17.681 -6.747 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -8.047 17.931 -4.674 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -8.962 19.219 -5.432 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -9.506 18.519 -2.926 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -10.815 18.925 -4.018 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -9.938 16.217 -3.047 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -11.555 16.787 -3.409 1.00 0.00 H new ATOM 864 N CYS A 57 -7.682 15.791 -6.015 1.00 0.00 N ATOM 865 CA CYS A 57 -6.566 15.042 -6.591 1.00 0.00 C ATOM 866 C CYS A 57 -5.465 15.993 -7.085 1.00 0.00 C ATOM 867 O CYS A 57 -5.606 17.219 -7.010 1.00 0.00 O ATOM 868 CB CYS A 57 -7.057 14.125 -7.726 1.00 0.00 C ATOM 869 SG CYS A 57 -5.934 12.748 -8.136 1.00 0.00 S ATOM 0 H CYS A 57 -7.757 15.702 -5.002 1.00 0.00 H new ATOM 0 HA CYS A 57 -6.137 14.413 -5.811 1.00 0.00 H new ATOM 0 HB2 CYS A 57 -8.027 13.714 -7.448 1.00 0.00 H new ATOM 0 HB3 CYS A 57 -7.211 14.728 -8.621 1.00 0.00 H new ATOM 874 N ASN A 58 -4.373 15.429 -7.574 1.00 0.00 N ATOM 875 CA ASN A 58 -3.249 16.227 -8.050 1.00 0.00 C ATOM 876 C ASN A 58 -3.454 16.673 -9.482 1.00 0.00 C ATOM 877 O ASN A 58 -3.909 15.891 -10.324 1.00 0.00 O ATOM 878 CB ASN A 58 -1.941 15.449 -7.928 1.00 0.00 C ATOM 879 CG ASN A 58 -1.460 15.343 -6.497 1.00 0.00 C ATOM 880 OD1 ASN A 58 -1.834 14.423 -5.765 1.00 0.00 O ATOM 881 ND2 ASN A 58 -0.630 16.282 -6.087 1.00 0.00 N ATOM 0 H ASN A 58 -4.238 14.421 -7.653 1.00 0.00 H new ATOM 0 HA ASN A 58 -3.191 17.115 -7.421 1.00 0.00 H new ATOM 0 HB2 ASN A 58 -2.078 14.448 -8.337 1.00 0.00 H new ATOM 0 HB3 ASN A 58 -1.175 15.937 -8.530 1.00 0.00 H new ATOM 0 HD21 ASN A 58 -0.272 16.265 -5.132 1.00 0.00 H new ATOM 0 HD22 ASN A 58 -0.346 17.025 -6.725 1.00 0.00 H new ATOM 888 N TRP A 59 -3.101 17.938 -9.749 1.00 0.00 N ATOM 889 CA TRP A 59 -3.231 18.555 -11.073 1.00 0.00 C ATOM 890 C TRP A 59 -4.593 18.261 -11.692 1.00 0.00 C ATOM 891 O TRP A 59 -4.695 17.558 -12.702 1.00 0.00 O ATOM 892 CB TRP A 59 -2.110 18.084 -12.002 1.00 0.00 C ATOM 893 CG TRP A 59 -0.736 18.286 -11.438 1.00 0.00 C ATOM 894 CD1 TRP A 59 0.085 17.322 -10.937 1.00 0.00 C ATOM 895 CD2 TRP A 59 -0.025 19.525 -11.311 1.00 0.00 C ATOM 896 NE1 TRP A 59 1.264 17.879 -10.518 1.00 0.00 N ATOM 897 CE2 TRP A 59 1.223 19.230 -10.732 1.00 0.00 C ATOM 898 CE3 TRP A 59 -0.319 20.854 -11.634 1.00 0.00 C ATOM 899 CZ2 TRP A 59 2.175 20.210 -10.468 1.00 0.00 C ATOM 900 CZ3 TRP A 59 0.626 21.827 -11.369 1.00 0.00 C ATOM 901 CH2 TRP A 59 1.860 21.501 -10.794 1.00 0.00 C ATOM 0 H TRP A 59 -2.714 18.566 -9.045 1.00 0.00 H new ATOM 0 HA TRP A 59 -3.147 19.634 -10.944 1.00 0.00 H new ATOM 0 HB2 TRP A 59 -2.252 17.026 -12.220 1.00 0.00 H new ATOM 0 HB3 TRP A 59 -2.187 18.618 -12.949 1.00 0.00 H new ATOM 0 HD1 TRP A 59 -0.158 16.271 -10.879 1.00 0.00 H new ATOM 0 HE1 TRP A 59 2.048 17.368 -10.111 1.00 0.00 H new ATOM 0 HE3 TRP A 59 -1.267 21.115 -12.082 1.00 0.00 H new ATOM 0 HZ2 TRP A 59 3.127 19.961 -10.023 1.00 0.00 H new ATOM 0 HZ3 TRP A 59 0.409 22.857 -11.610 1.00 0.00 H new ATOM 0 HH2 TRP A 59 2.578 22.285 -10.604 1.00 0.00 H new ATOM 912 N LYS A 60 -5.630 18.789 -11.077 1.00 0.00 N ATOM 913 CA LYS A 60 -6.978 18.544 -11.524 1.00 0.00 C ATOM 914 C LYS A 60 -7.440 19.582 -12.524 1.00 0.00 C ATOM 915 O LYS A 60 -7.098 20.766 -12.425 1.00 0.00 O ATOM 916 CB LYS A 60 -7.939 18.528 -10.348 1.00 0.00 C ATOM 917 CG LYS A 60 -8.022 19.840 -9.595 1.00 0.00 C ATOM 918 CD LYS A 60 -9.299 19.910 -8.796 1.00 0.00 C ATOM 919 CE LYS A 60 -9.411 21.219 -8.032 1.00 0.00 C ATOM 920 NZ LYS A 60 -10.728 21.360 -7.351 1.00 0.00 N ATOM 0 H LYS A 60 -5.560 19.395 -10.260 1.00 0.00 H new ATOM 0 HA LYS A 60 -6.975 17.570 -12.013 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -8.933 18.266 -10.710 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -7.635 17.743 -9.655 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -7.164 19.939 -8.930 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -7.979 20.673 -10.297 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -10.153 19.804 -9.465 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -9.337 19.075 -8.096 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -8.613 21.276 -7.292 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -9.268 22.053 -8.719 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -10.742 22.243 -6.801 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -11.486 21.384 -8.063 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -10.877 20.552 -6.713 1.00 0.00 H new ATOM 934 N LYS A 61 -8.195 19.132 -13.492 1.00 0.00 N ATOM 935 CA LYS A 61 -8.835 20.018 -14.435 1.00 0.00 C ATOM 936 C LYS A 61 -10.292 20.114 -14.073 1.00 0.00 C ATOM 937 O LYS A 61 -10.930 19.105 -13.756 1.00 0.00 O ATOM 938 CB LYS A 61 -8.646 19.542 -15.887 1.00 0.00 C ATOM 939 CG LYS A 61 -9.242 18.174 -16.189 1.00 0.00 C ATOM 940 CD LYS A 61 -9.106 17.830 -17.663 1.00 0.00 C ATOM 941 CE LYS A 61 -9.778 16.506 -17.989 1.00 0.00 C ATOM 942 NZ LYS A 61 -9.738 16.206 -19.442 1.00 0.00 N ATOM 0 H LYS A 61 -8.385 18.142 -13.651 1.00 0.00 H new ATOM 0 HA LYS A 61 -8.373 21.004 -14.379 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -9.095 20.275 -16.557 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -7.580 19.516 -16.111 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -8.741 17.415 -15.588 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -10.294 18.162 -15.905 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -9.550 18.623 -18.265 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -8.050 17.779 -17.930 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -9.285 15.704 -17.439 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -10.814 16.533 -17.653 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -10.207 15.295 -19.621 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -10.231 16.958 -19.965 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -8.749 16.155 -19.759 1.00 0.00 H new ATOM 956 N GLN A 62 -10.818 21.312 -14.084 1.00 0.00 N ATOM 957 CA GLN A 62 -12.163 21.520 -13.650 1.00 0.00 C ATOM 958 C GLN A 62 -12.741 22.748 -14.338 1.00 0.00 C ATOM 959 O GLN A 62 -13.782 23.279 -13.949 1.00 0.00 O ATOM 960 CB GLN A 62 -12.147 21.687 -12.130 1.00 0.00 C ATOM 961 CG GLN A 62 -13.490 21.552 -11.476 1.00 0.00 C ATOM 962 CD GLN A 62 -13.391 21.480 -9.965 1.00 0.00 C ATOM 963 OE1 GLN A 62 -12.451 22.005 -9.361 1.00 0.00 O ATOM 964 NE2 GLN A 62 -14.361 20.846 -9.343 1.00 0.00 N ATOM 0 H GLN A 62 -10.330 22.154 -14.390 1.00 0.00 H new ATOM 0 HA GLN A 62 -12.794 20.671 -13.912 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -11.472 20.945 -11.703 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -11.736 22.668 -11.889 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -14.115 22.400 -11.757 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -13.984 20.655 -11.848 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -15.121 20.425 -9.878 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -14.354 20.775 -8.325 1.00 0.00 H new ATOM 973 N PHE A 63 -12.068 23.176 -15.386 1.00 0.00 N ATOM 974 CA PHE A 63 -12.486 24.340 -16.115 1.00 0.00 C ATOM 975 C PHE A 63 -13.264 23.941 -17.351 1.00 0.00 C ATOM 976 O PHE A 63 -12.693 23.668 -18.400 1.00 0.00 O ATOM 977 CB PHE A 63 -11.290 25.201 -16.493 1.00 0.00 C ATOM 978 CG PHE A 63 -10.532 25.725 -15.306 1.00 0.00 C ATOM 979 CD1 PHE A 63 -9.435 25.040 -14.806 1.00 0.00 C ATOM 980 CD2 PHE A 63 -10.923 26.899 -14.686 1.00 0.00 C ATOM 981 CE1 PHE A 63 -8.743 25.519 -13.711 1.00 0.00 C ATOM 982 CE2 PHE A 63 -10.236 27.383 -13.593 1.00 0.00 C ATOM 983 CZ PHE A 63 -9.145 26.693 -13.103 1.00 0.00 C ATOM 0 H PHE A 63 -11.226 22.728 -15.748 1.00 0.00 H new ATOM 0 HA PHE A 63 -13.138 24.929 -15.470 1.00 0.00 H new ATOM 0 HB2 PHE A 63 -10.614 24.617 -17.117 1.00 0.00 H new ATOM 0 HB3 PHE A 63 -11.633 26.042 -17.096 1.00 0.00 H new ATOM 0 HD1 PHE A 63 -9.118 24.122 -15.278 1.00 0.00 H new ATOM 0 HD2 PHE A 63 -11.777 27.443 -15.063 1.00 0.00 H new ATOM 0 HE1 PHE A 63 -7.890 24.977 -13.331 1.00 0.00 H new ATOM 0 HE2 PHE A 63 -10.551 28.301 -13.120 1.00 0.00 H new ATOM 0 HZ PHE A 63 -8.607 27.070 -12.246 1.00 0.00 H new ATOM 993 N GLY A 64 -14.569 23.884 -17.208 1.00 0.00 N ATOM 994 CA GLY A 64 -15.424 23.505 -18.315 1.00 0.00 C ATOM 995 C GLY A 64 -15.738 24.668 -19.234 1.00 0.00 C ATOM 996 O GLY A 64 -16.216 24.470 -20.347 1.00 0.00 O ATOM 0 H GLY A 64 -15.062 24.094 -16.340 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -14.940 22.714 -18.888 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -16.355 23.093 -17.926 1.00 0.00 H new ATOM 1000 N ALA A 65 -15.477 25.892 -18.751 1.00 0.00 N ATOM 1001 CA ALA A 65 -15.727 27.128 -19.515 1.00 0.00 C ATOM 1002 C ALA A 65 -17.216 27.307 -19.833 1.00 0.00 C ATOM 1003 O ALA A 65 -17.589 28.124 -20.673 1.00 0.00 O ATOM 1004 CB ALA A 65 -14.892 27.155 -20.796 1.00 0.00 C ATOM 0 H ALA A 65 -15.088 26.055 -17.822 1.00 0.00 H new ATOM 0 HA ALA A 65 -15.423 27.966 -18.888 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -15.094 28.076 -21.342 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -13.833 27.109 -20.541 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -15.153 26.299 -21.419 1.00 0.00 H new ATOM 1010 N GLU A 66 -18.060 26.556 -19.134 1.00 0.00 N ATOM 1011 CA GLU A 66 -19.503 26.615 -19.335 1.00 0.00 C ATOM 1012 C GLU A 66 -20.105 27.762 -18.523 1.00 0.00 C ATOM 1013 O GLU A 66 -21.290 28.069 -18.631 1.00 0.00 O ATOM 1014 CB GLU A 66 -20.139 25.274 -18.947 1.00 0.00 C ATOM 1015 CG GLU A 66 -19.527 24.088 -19.684 1.00 0.00 C ATOM 1016 CD GLU A 66 -20.143 22.759 -19.303 1.00 0.00 C ATOM 1017 OE1 GLU A 66 -21.122 22.345 -19.955 1.00 0.00 O ATOM 1018 OE2 GLU A 66 -19.634 22.106 -18.369 1.00 0.00 O ATOM 0 H GLU A 66 -17.766 25.893 -18.417 1.00 0.00 H new ATOM 0 HA GLU A 66 -19.710 26.803 -20.389 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -20.029 25.123 -17.873 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -21.208 25.312 -19.156 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -19.642 24.239 -20.757 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -18.457 24.056 -19.479 1.00 0.00 H new ATOM 1025 N CYS A 67 -19.263 28.390 -17.726 1.00 0.00 N ATOM 1026 CA CYS A 67 -19.649 29.519 -16.897 1.00 0.00 C ATOM 1027 C CYS A 67 -18.558 30.581 -16.997 1.00 0.00 C ATOM 1028 O CYS A 67 -17.748 30.542 -17.929 1.00 0.00 O ATOM 1029 CB CYS A 67 -19.815 29.069 -15.447 1.00 0.00 C ATOM 1030 SG CYS A 67 -20.933 27.650 -15.218 1.00 0.00 S ATOM 0 H CYS A 67 -18.281 28.129 -17.634 1.00 0.00 H new ATOM 0 HA CYS A 67 -20.600 29.929 -17.239 1.00 0.00 H new ATOM 0 HB2 CYS A 67 -18.835 28.811 -15.046 1.00 0.00 H new ATOM 0 HB3 CYS A 67 -20.189 29.908 -14.860 1.00 0.00 H new ATOM 1035 N LYS A 68 -18.499 31.508 -16.046 1.00 0.00 N ATOM 1036 CA LYS A 68 -17.474 32.543 -16.069 1.00 0.00 C ATOM 1037 C LYS A 68 -16.739 32.578 -14.746 1.00 0.00 C ATOM 1038 O LYS A 68 -17.357 32.491 -13.677 1.00 0.00 O ATOM 1039 CB LYS A 68 -18.059 33.925 -16.371 1.00 0.00 C ATOM 1040 CG LYS A 68 -18.451 34.127 -17.824 1.00 0.00 C ATOM 1041 CD LYS A 68 -18.776 35.588 -18.123 1.00 0.00 C ATOM 1042 CE LYS A 68 -17.560 36.496 -17.921 1.00 0.00 C ATOM 1043 NZ LYS A 68 -16.398 36.067 -18.744 1.00 0.00 N ATOM 0 H LYS A 68 -19.143 31.563 -15.257 1.00 0.00 H new ATOM 0 HA LYS A 68 -16.779 32.294 -16.871 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -18.937 34.081 -15.744 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -17.329 34.685 -16.093 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -17.638 33.796 -18.470 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -19.316 33.507 -18.057 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -19.130 35.678 -19.150 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -19.588 35.919 -17.476 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -17.827 37.521 -18.178 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -17.278 36.495 -16.868 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -15.680 36.820 -18.750 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -15.988 35.201 -18.341 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -16.712 35.880 -19.718 1.00 0.00 H new ATOM 1057 N TYR A 69 -15.429 32.705 -14.818 1.00 0.00 N ATOM 1058 CA TYR A 69 -14.602 32.730 -13.632 1.00 0.00 C ATOM 1059 C TYR A 69 -13.762 33.984 -13.554 1.00 0.00 C ATOM 1060 O TYR A 69 -13.400 34.573 -14.575 1.00 0.00 O ATOM 1061 CB TYR A 69 -13.695 31.506 -13.576 1.00 0.00 C ATOM 1062 CG TYR A 69 -14.391 30.271 -13.093 1.00 0.00 C ATOM 1063 CD1 TYR A 69 -14.287 29.068 -13.774 1.00 0.00 C ATOM 1064 CD2 TYR A 69 -15.152 30.307 -11.943 1.00 0.00 C ATOM 1065 CE1 TYR A 69 -14.929 27.938 -13.309 1.00 0.00 C ATOM 1066 CE2 TYR A 69 -15.790 29.199 -11.480 1.00 0.00 C ATOM 1067 CZ TYR A 69 -15.682 28.013 -12.159 1.00 0.00 C ATOM 1068 OH TYR A 69 -16.319 26.901 -11.681 1.00 0.00 O ATOM 0 H TYR A 69 -14.913 32.793 -15.693 1.00 0.00 H new ATOM 0 HA TYR A 69 -15.278 32.719 -12.777 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -13.288 31.319 -14.570 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -12.851 31.718 -12.920 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -13.698 29.014 -14.677 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -15.243 31.235 -11.399 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -14.841 27.003 -13.843 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -16.381 29.253 -10.578 1.00 0.00 H new ATOM 0 HH TYR A 69 -16.805 27.129 -10.861 1.00 0.00 H new ATOM 1078 N GLN A 70 -13.482 34.388 -12.338 1.00 0.00 N ATOM 1079 CA GLN A 70 -12.619 35.510 -12.067 1.00 0.00 C ATOM 1080 C GLN A 70 -11.518 35.032 -11.125 1.00 0.00 C ATOM 1081 O GLN A 70 -11.807 34.449 -10.067 1.00 0.00 O ATOM 1082 CB GLN A 70 -13.434 36.663 -11.451 1.00 0.00 C ATOM 1083 CG GLN A 70 -12.690 37.991 -11.334 1.00 0.00 C ATOM 1084 CD GLN A 70 -11.799 38.069 -10.110 1.00 0.00 C ATOM 1085 OE1 GLN A 70 -12.097 37.482 -9.068 1.00 0.00 O ATOM 1086 NE2 GLN A 70 -10.708 38.792 -10.228 1.00 0.00 N ATOM 0 H GLN A 70 -13.852 33.941 -11.499 1.00 0.00 H new ATOM 0 HA GLN A 70 -12.169 35.890 -12.984 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -14.329 36.817 -12.054 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -13.767 36.362 -10.458 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -12.084 38.141 -12.227 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -13.415 38.805 -11.301 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -10.500 39.261 -11.109 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -10.069 38.884 -9.438 1.00 0.00 H new ATOM 1095 N PHE A 71 -10.272 35.238 -11.516 1.00 0.00 N ATOM 1096 CA PHE A 71 -9.142 34.753 -10.737 1.00 0.00 C ATOM 1097 C PHE A 71 -8.609 35.807 -9.786 1.00 0.00 C ATOM 1098 O PHE A 71 -8.369 36.952 -10.172 1.00 0.00 O ATOM 1099 CB PHE A 71 -8.021 34.261 -11.657 1.00 0.00 C ATOM 1100 CG PHE A 71 -8.396 33.059 -12.476 1.00 0.00 C ATOM 1101 CD1 PHE A 71 -8.837 33.201 -13.783 1.00 0.00 C ATOM 1102 CD2 PHE A 71 -8.311 31.785 -11.936 1.00 0.00 C ATOM 1103 CE1 PHE A 71 -9.186 32.096 -14.534 1.00 0.00 C ATOM 1104 CE2 PHE A 71 -8.657 30.676 -12.683 1.00 0.00 C ATOM 1105 CZ PHE A 71 -9.095 30.832 -13.984 1.00 0.00 C ATOM 0 H PHE A 71 -10.016 35.737 -12.368 1.00 0.00 H new ATOM 0 HA PHE A 71 -9.505 33.919 -10.137 1.00 0.00 H new ATOM 0 HB2 PHE A 71 -7.732 35.070 -12.327 1.00 0.00 H new ATOM 0 HB3 PHE A 71 -7.147 34.019 -11.053 1.00 0.00 H new ATOM 0 HD1 PHE A 71 -8.908 34.187 -14.218 1.00 0.00 H new ATOM 0 HD2 PHE A 71 -7.970 31.658 -10.919 1.00 0.00 H new ATOM 0 HE1 PHE A 71 -9.530 32.220 -15.550 1.00 0.00 H new ATOM 0 HE2 PHE A 71 -8.585 29.689 -12.251 1.00 0.00 H new ATOM 0 HZ PHE A 71 -9.366 29.967 -14.571 1.00 0.00 H new ATOM 1115 N GLN A 72 -8.422 35.410 -8.547 1.00 0.00 N ATOM 1116 CA GLN A 72 -7.903 36.287 -7.528 1.00 0.00 C ATOM 1117 C GLN A 72 -6.405 36.066 -7.370 1.00 0.00 C ATOM 1118 O GLN A 72 -5.857 35.048 -7.813 1.00 0.00 O ATOM 1119 CB GLN A 72 -8.609 36.058 -6.190 1.00 0.00 C ATOM 1120 CG GLN A 72 -7.973 34.983 -5.353 1.00 0.00 C ATOM 1121 CD GLN A 72 -8.818 34.581 -4.161 1.00 0.00 C ATOM 1122 OE1 GLN A 72 -9.723 33.643 -4.368 1.00 0.00 O flip ATOM 1123 NE2 GLN A 72 -8.669 35.120 -3.071 1.00 0.00 N flip ATOM 0 H GLN A 72 -8.627 34.466 -8.219 1.00 0.00 H new ATOM 0 HA GLN A 72 -8.088 37.316 -7.837 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -8.614 36.991 -5.626 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -9.650 35.793 -6.378 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -7.792 34.106 -5.975 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -7.002 35.331 -5.002 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -7.958 35.841 -2.952 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -9.256 34.847 -2.283 1.00 0.00 H new ATOM 1132 N ALA A 73 -5.766 37.002 -6.734 1.00 0.00 N ATOM 1133 CA ALA A 73 -4.339 36.946 -6.524 1.00 0.00 C ATOM 1134 C ALA A 73 -4.022 37.113 -5.051 1.00 0.00 C ATOM 1135 O ALA A 73 -3.669 38.201 -4.595 1.00 0.00 O ATOM 1136 CB ALA A 73 -3.624 37.999 -7.362 1.00 0.00 C ATOM 0 H ALA A 73 -6.215 37.830 -6.343 1.00 0.00 H new ATOM 0 HA ALA A 73 -3.978 35.969 -6.845 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -2.550 37.936 -7.186 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -3.829 37.825 -8.418 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -3.980 38.990 -7.082 1.00 0.00 H new ATOM 1142 N TRP A 74 -4.185 36.034 -4.305 1.00 0.00 N ATOM 1143 CA TRP A 74 -3.951 36.057 -2.870 1.00 0.00 C ATOM 1144 C TRP A 74 -2.466 35.897 -2.576 1.00 0.00 C ATOM 1145 O TRP A 74 -1.963 36.381 -1.555 1.00 0.00 O ATOM 1146 CB TRP A 74 -4.753 34.938 -2.189 1.00 0.00 C ATOM 1147 CG TRP A 74 -4.790 35.046 -0.692 1.00 0.00 C ATOM 1148 CD1 TRP A 74 -3.887 34.534 0.194 1.00 0.00 C ATOM 1149 CD2 TRP A 74 -5.792 35.705 0.091 1.00 0.00 C ATOM 1150 NE1 TRP A 74 -4.260 34.843 1.477 1.00 0.00 N ATOM 1151 CE2 TRP A 74 -5.427 35.559 1.442 1.00 0.00 C ATOM 1152 CE3 TRP A 74 -6.961 36.407 -0.222 1.00 0.00 C ATOM 1153 CZ2 TRP A 74 -6.189 36.089 2.480 1.00 0.00 C ATOM 1154 CZ3 TRP A 74 -7.716 36.933 0.809 1.00 0.00 C ATOM 1155 CH2 TRP A 74 -7.327 36.771 2.144 1.00 0.00 C ATOM 0 H TRP A 74 -4.479 35.128 -4.670 1.00 0.00 H new ATOM 0 HA TRP A 74 -4.282 37.017 -2.474 1.00 0.00 H new ATOM 0 HB2 TRP A 74 -5.774 34.951 -2.571 1.00 0.00 H new ATOM 0 HB3 TRP A 74 -4.322 33.975 -2.464 1.00 0.00 H new ATOM 0 HD1 TRP A 74 -3.007 33.968 -0.076 1.00 0.00 H new ATOM 0 HE1 TRP A 74 -3.751 34.582 2.321 1.00 0.00 H new ATOM 0 HE3 TRP A 74 -7.267 36.535 -1.250 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 -5.893 35.966 3.511 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 -8.620 37.478 0.581 1.00 0.00 H new ATOM 0 HH2 TRP A 74 -7.939 37.194 2.927 1.00 0.00 H new ATOM 1166 N GLY A 75 -1.761 35.256 -3.487 1.00 0.00 N ATOM 1167 CA GLY A 75 -0.355 35.028 -3.306 1.00 0.00 C ATOM 1168 C GLY A 75 0.394 35.125 -4.609 1.00 0.00 C ATOM 1169 O GLY A 75 -0.193 34.969 -5.684 1.00 0.00 O ATOM 0 H GLY A 75 -2.145 34.887 -4.357 1.00 0.00 H new ATOM 0 HA2 GLY A 75 0.045 35.757 -2.601 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -0.199 34.042 -2.868 1.00 0.00 H new ATOM 1173 N GLU A 76 1.675 35.397 -4.523 1.00 0.00 N ATOM 1174 CA GLU A 76 2.532 35.516 -5.670 1.00 0.00 C ATOM 1175 C GLU A 76 3.252 34.210 -5.920 1.00 0.00 C ATOM 1176 O GLU A 76 3.472 33.445 -4.978 1.00 0.00 O ATOM 1177 CB GLU A 76 3.541 36.628 -5.461 1.00 0.00 C ATOM 1178 CG GLU A 76 2.924 38.003 -5.331 1.00 0.00 C ATOM 1179 CD GLU A 76 3.965 39.088 -5.309 1.00 0.00 C ATOM 1180 OE1 GLU A 76 4.459 39.425 -4.215 1.00 0.00 O ATOM 1181 OE2 GLU A 76 4.302 39.609 -6.389 1.00 0.00 O ATOM 0 H GLU A 76 2.156 35.544 -3.635 1.00 0.00 H new ATOM 0 HA GLU A 76 1.918 35.756 -6.538 1.00 0.00 H new ATOM 0 HB2 GLU A 76 4.120 36.415 -4.563 1.00 0.00 H new ATOM 0 HB3 GLU A 76 4.240 36.632 -6.297 1.00 0.00 H new ATOM 0 HG2 GLU A 76 2.240 38.174 -6.163 1.00 0.00 H new ATOM 0 HG3 GLU A 76 2.332 38.050 -4.417 1.00 0.00 H new ATOM 1188 N CYS A 77 3.523 33.924 -7.204 1.00 0.00 N ATOM 1189 CA CYS A 77 4.270 32.718 -7.636 1.00 0.00 C ATOM 1190 C CYS A 77 5.288 32.283 -6.580 1.00 0.00 C ATOM 1191 O CYS A 77 6.008 33.114 -6.015 1.00 0.00 O ATOM 1192 CB CYS A 77 4.994 33.008 -8.967 1.00 0.00 C ATOM 1193 SG CYS A 77 6.027 31.640 -9.607 1.00 0.00 S ATOM 0 H CYS A 77 3.232 34.521 -7.978 1.00 0.00 H new ATOM 0 HA CYS A 77 3.555 31.906 -7.771 1.00 0.00 H new ATOM 0 HB2 CYS A 77 4.248 33.261 -9.720 1.00 0.00 H new ATOM 0 HB3 CYS A 77 5.625 33.887 -8.835 1.00 0.00 H new ATOM 1198 N ASP A 78 5.368 30.990 -6.341 1.00 0.00 N ATOM 1199 CA ASP A 78 6.245 30.475 -5.315 1.00 0.00 C ATOM 1200 C ASP A 78 7.663 30.462 -5.815 1.00 0.00 C ATOM 1201 O ASP A 78 7.981 29.844 -6.827 1.00 0.00 O ATOM 1202 CB ASP A 78 5.812 29.092 -4.839 1.00 0.00 C ATOM 1203 CG ASP A 78 4.551 29.143 -4.000 1.00 0.00 C ATOM 1204 OD1 ASP A 78 4.593 29.726 -2.893 1.00 0.00 O ATOM 1205 OD2 ASP A 78 3.513 28.601 -4.438 1.00 0.00 O ATOM 0 H ASP A 78 4.836 30.279 -6.844 1.00 0.00 H new ATOM 0 HA ASP A 78 6.183 31.136 -4.451 1.00 0.00 H new ATOM 0 HB2 ASP A 78 5.646 28.448 -5.703 1.00 0.00 H new ATOM 0 HB3 ASP A 78 6.616 28.642 -4.256 1.00 0.00 H new ATOM 1210 N LEU A 79 8.494 31.147 -5.097 1.00 0.00 N ATOM 1211 CA LEU A 79 9.869 31.371 -5.503 1.00 0.00 C ATOM 1212 C LEU A 79 10.695 30.117 -5.419 1.00 0.00 C ATOM 1213 O LEU A 79 11.599 29.902 -6.225 1.00 0.00 O ATOM 1214 CB LEU A 79 10.473 32.415 -4.610 1.00 0.00 C ATOM 1215 CG LEU A 79 9.603 33.638 -4.385 1.00 0.00 C ATOM 1216 CD1 LEU A 79 10.192 34.526 -3.305 1.00 0.00 C ATOM 1217 CD2 LEU A 79 9.414 34.416 -5.679 1.00 0.00 C ATOM 0 H LEU A 79 8.249 31.575 -4.204 1.00 0.00 H new ATOM 0 HA LEU A 79 9.864 31.698 -6.543 1.00 0.00 H new ATOM 0 HB2 LEU A 79 10.696 31.962 -3.644 1.00 0.00 H new ATOM 0 HB3 LEU A 79 11.422 32.735 -5.039 1.00 0.00 H new ATOM 0 HG LEU A 79 8.623 33.298 -4.049 1.00 0.00 H new ATOM 0 HD11 LEU A 79 9.552 35.396 -3.161 1.00 0.00 H new ATOM 0 HD12 LEU A 79 10.261 33.967 -2.372 1.00 0.00 H new ATOM 0 HD13 LEU A 79 11.187 34.853 -3.606 1.00 0.00 H new ATOM 0 HD21 LEU A 79 8.787 35.288 -5.491 1.00 0.00 H new ATOM 0 HD22 LEU A 79 10.385 34.741 -6.053 1.00 0.00 H new ATOM 0 HD23 LEU A 79 8.935 33.777 -6.421 1.00 0.00 H new ATOM 1229 N ASN A 80 10.376 29.288 -4.461 1.00 0.00 N ATOM 1230 CA ASN A 80 11.103 28.061 -4.270 1.00 0.00 C ATOM 1231 C ASN A 80 10.801 27.064 -5.361 1.00 0.00 C ATOM 1232 O ASN A 80 11.688 26.348 -5.824 1.00 0.00 O ATOM 1233 CB ASN A 80 10.761 27.447 -2.906 1.00 0.00 C ATOM 1234 CG ASN A 80 11.466 26.119 -2.660 1.00 0.00 C ATOM 1235 OD1 ASN A 80 12.601 25.909 -3.093 1.00 0.00 O ATOM 1236 ND2 ASN A 80 10.791 25.213 -1.983 1.00 0.00 N ATOM 0 H ASN A 80 9.615 29.441 -3.799 1.00 0.00 H new ATOM 0 HA ASN A 80 12.166 28.300 -4.308 1.00 0.00 H new ATOM 0 HB2 ASN A 80 11.034 28.149 -2.118 1.00 0.00 H new ATOM 0 HB3 ASN A 80 9.683 27.298 -2.840 1.00 0.00 H new ATOM 0 HD21 ASN A 80 11.206 24.299 -1.800 1.00 0.00 H new ATOM 0 HD22 ASN A 80 9.854 25.425 -1.641 1.00 0.00 H new ATOM 1243 N THR A 81 9.567 27.027 -5.795 1.00 0.00 N ATOM 1244 CA THR A 81 9.150 25.985 -6.721 1.00 0.00 C ATOM 1245 C THR A 81 9.006 26.488 -8.145 1.00 0.00 C ATOM 1246 O THR A 81 8.851 25.691 -9.075 1.00 0.00 O ATOM 1247 CB THR A 81 7.816 25.384 -6.258 1.00 0.00 C ATOM 1248 OG1 THR A 81 6.827 26.417 -6.206 1.00 0.00 O ATOM 1249 CG2 THR A 81 7.966 24.774 -4.874 1.00 0.00 C ATOM 0 H THR A 81 8.838 27.691 -5.532 1.00 0.00 H new ATOM 0 HA THR A 81 9.933 25.227 -6.720 1.00 0.00 H new ATOM 0 HB THR A 81 7.514 24.608 -6.961 1.00 0.00 H new ATOM 0 HG1 THR A 81 5.973 26.037 -5.912 1.00 0.00 H new ATOM 0 HG21 THR A 81 7.013 24.351 -4.557 1.00 0.00 H new ATOM 0 HG22 THR A 81 8.720 23.987 -4.903 1.00 0.00 H new ATOM 0 HG23 THR A 81 8.273 25.545 -4.168 1.00 0.00 H new ATOM 1257 N ALA A 82 9.111 27.796 -8.313 1.00 0.00 N ATOM 1258 CA ALA A 82 8.900 28.446 -9.602 1.00 0.00 C ATOM 1259 C ALA A 82 7.506 28.123 -10.144 1.00 0.00 C ATOM 1260 O ALA A 82 7.306 27.987 -11.347 1.00 0.00 O ATOM 1261 CB ALA A 82 9.988 28.054 -10.601 1.00 0.00 C ATOM 0 H ALA A 82 9.346 28.441 -7.559 1.00 0.00 H new ATOM 0 HA ALA A 82 8.964 29.524 -9.455 1.00 0.00 H new ATOM 0 HB1 ALA A 82 9.805 28.553 -11.553 1.00 0.00 H new ATOM 0 HB2 ALA A 82 10.962 28.355 -10.215 1.00 0.00 H new ATOM 0 HB3 ALA A 82 9.974 26.974 -10.749 1.00 0.00 H new ATOM 1267 N LEU A 83 6.560 28.002 -9.235 1.00 0.00 N ATOM 1268 CA LEU A 83 5.185 27.659 -9.589 1.00 0.00 C ATOM 1269 C LEU A 83 4.219 28.648 -9.017 1.00 0.00 C ATOM 1270 O LEU A 83 4.438 29.183 -7.945 1.00 0.00 O ATOM 1271 CB LEU A 83 4.847 26.249 -9.116 1.00 0.00 C ATOM 1272 CG LEU A 83 5.852 25.161 -9.505 1.00 0.00 C ATOM 1273 CD1 LEU A 83 5.434 23.831 -8.936 1.00 0.00 C ATOM 1274 CD2 LEU A 83 5.990 25.058 -11.013 1.00 0.00 C ATOM 0 H LEU A 83 6.714 28.136 -8.236 1.00 0.00 H new ATOM 0 HA LEU A 83 5.099 27.692 -10.675 1.00 0.00 H new ATOM 0 HB2 LEU A 83 4.755 26.262 -8.030 1.00 0.00 H new ATOM 0 HB3 LEU A 83 3.870 25.976 -9.515 1.00 0.00 H new ATOM 0 HG LEU A 83 6.821 25.438 -9.089 1.00 0.00 H new ATOM 0 HD11 LEU A 83 6.159 23.069 -9.222 1.00 0.00 H new ATOM 0 HD12 LEU A 83 5.388 23.899 -7.849 1.00 0.00 H new ATOM 0 HD13 LEU A 83 4.452 23.561 -9.325 1.00 0.00 H new ATOM 0 HD21 LEU A 83 6.710 24.278 -11.260 1.00 0.00 H new ATOM 0 HD22 LEU A 83 5.023 24.811 -11.451 1.00 0.00 H new ATOM 0 HD23 LEU A 83 6.337 26.011 -11.413 1.00 0.00 H new ATOM 1286 N LYS A 84 3.143 28.882 -9.722 1.00 0.00 N ATOM 1287 CA LYS A 84 2.171 29.840 -9.287 1.00 0.00 C ATOM 1288 C LYS A 84 0.807 29.211 -9.198 1.00 0.00 C ATOM 1289 O LYS A 84 0.404 28.454 -10.076 1.00 0.00 O ATOM 1290 CB LYS A 84 2.132 31.027 -10.245 1.00 0.00 C ATOM 1291 CG LYS A 84 1.384 32.214 -9.698 1.00 0.00 C ATOM 1292 CD LYS A 84 1.482 33.418 -10.626 1.00 0.00 C ATOM 1293 CE LYS A 84 0.850 34.656 -10.002 1.00 0.00 C ATOM 1294 NZ LYS A 84 1.089 35.878 -10.819 1.00 0.00 N ATOM 0 H LYS A 84 2.921 28.418 -10.603 1.00 0.00 H new ATOM 0 HA LYS A 84 2.459 30.191 -8.296 1.00 0.00 H new ATOM 0 HB2 LYS A 84 3.153 31.328 -10.481 1.00 0.00 H new ATOM 0 HB3 LYS A 84 1.668 30.714 -11.180 1.00 0.00 H new ATOM 0 HG2 LYS A 84 0.336 31.949 -9.555 1.00 0.00 H new ATOM 0 HG3 LYS A 84 1.784 32.476 -8.718 1.00 0.00 H new ATOM 0 HD2 LYS A 84 2.529 33.618 -10.855 1.00 0.00 H new ATOM 0 HD3 LYS A 84 0.987 33.192 -11.570 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -0.223 34.498 -9.891 1.00 0.00 H new ATOM 0 HE3 LYS A 84 1.255 34.804 -9.001 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 0.642 36.696 -10.358 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 2.112 36.044 -10.904 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 0.680 35.748 -11.766 1.00 0.00 H new ATOM 1308 N THR A 85 0.103 29.524 -8.148 1.00 0.00 N ATOM 1309 CA THR A 85 -1.236 29.034 -7.955 1.00 0.00 C ATOM 1310 C THR A 85 -2.196 30.212 -7.885 1.00 0.00 C ATOM 1311 O THR A 85 -1.850 31.273 -7.363 1.00 0.00 O ATOM 1312 CB THR A 85 -1.348 28.196 -6.670 1.00 0.00 C ATOM 1313 OG1 THR A 85 -0.381 27.132 -6.700 1.00 0.00 O ATOM 1314 CG2 THR A 85 -2.739 27.598 -6.522 1.00 0.00 C ATOM 0 H THR A 85 0.440 30.128 -7.398 1.00 0.00 H new ATOM 0 HA THR A 85 -1.492 28.391 -8.797 1.00 0.00 H new ATOM 0 HB THR A 85 -1.159 28.854 -5.821 1.00 0.00 H new ATOM 0 HG1 THR A 85 -0.738 26.380 -7.218 1.00 0.00 H new ATOM 0 HG21 THR A 85 -2.787 27.011 -5.605 1.00 0.00 H new ATOM 0 HG22 THR A 85 -3.477 28.399 -6.479 1.00 0.00 H new ATOM 0 HG23 THR A 85 -2.951 26.954 -7.376 1.00 0.00 H new ATOM 1322 N ARG A 86 -3.378 30.038 -8.426 1.00 0.00 N ATOM 1323 CA ARG A 86 -4.379 31.085 -8.436 1.00 0.00 C ATOM 1324 C ARG A 86 -5.715 30.505 -8.036 1.00 0.00 C ATOM 1325 O ARG A 86 -6.050 29.381 -8.418 1.00 0.00 O ATOM 1326 CB ARG A 86 -4.490 31.743 -9.821 1.00 0.00 C ATOM 1327 CG ARG A 86 -3.248 32.513 -10.254 1.00 0.00 C ATOM 1328 CD ARG A 86 -3.483 33.266 -11.559 1.00 0.00 C ATOM 1329 NE ARG A 86 -3.805 32.366 -12.674 1.00 0.00 N ATOM 1330 CZ ARG A 86 -4.149 32.779 -13.903 1.00 0.00 C ATOM 1331 NH1 ARG A 86 -4.228 34.081 -14.179 1.00 0.00 N ATOM 1332 NH2 ARG A 86 -4.418 31.888 -14.857 1.00 0.00 N ATOM 0 H ARG A 86 -3.675 29.170 -8.871 1.00 0.00 H new ATOM 0 HA ARG A 86 -4.078 31.853 -7.724 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -4.700 30.971 -10.561 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -5.342 32.423 -9.819 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -2.965 33.218 -9.472 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -2.415 31.821 -10.377 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -4.297 33.978 -11.423 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -2.593 33.844 -11.807 1.00 0.00 H new ATOM 0 HE ARG A 86 -3.764 31.361 -12.503 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -4.026 34.769 -13.454 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -4.490 34.389 -15.115 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -4.362 30.890 -14.653 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -4.679 32.204 -15.791 1.00 0.00 H new ATOM 1346 N THR A 87 -6.461 31.247 -7.259 1.00 0.00 N ATOM 1347 CA THR A 87 -7.756 30.805 -6.819 1.00 0.00 C ATOM 1348 C THR A 87 -8.824 31.638 -7.506 1.00 0.00 C ATOM 1349 O THR A 87 -8.636 32.831 -7.721 1.00 0.00 O ATOM 1350 CB THR A 87 -7.887 30.946 -5.292 1.00 0.00 C ATOM 1351 OG1 THR A 87 -6.688 30.470 -4.666 1.00 0.00 O ATOM 1352 CG2 THR A 87 -9.076 30.144 -4.770 1.00 0.00 C ATOM 0 H THR A 87 -6.189 32.168 -6.916 1.00 0.00 H new ATOM 0 HA THR A 87 -7.881 29.754 -7.078 1.00 0.00 H new ATOM 0 HB THR A 87 -8.045 31.998 -5.055 1.00 0.00 H new ATOM 0 HG1 THR A 87 -6.769 30.560 -3.694 1.00 0.00 H new ATOM 0 HG21 THR A 87 -9.147 30.260 -3.689 1.00 0.00 H new ATOM 0 HG22 THR A 87 -9.992 30.508 -5.235 1.00 0.00 H new ATOM 0 HG23 THR A 87 -8.939 29.090 -5.013 1.00 0.00 H new ATOM 1360 N GLY A 88 -9.929 31.028 -7.842 1.00 0.00 N ATOM 1361 CA GLY A 88 -10.971 31.736 -8.520 1.00 0.00 C ATOM 1362 C GLY A 88 -12.319 31.403 -7.951 1.00 0.00 C ATOM 1363 O GLY A 88 -12.457 30.449 -7.181 1.00 0.00 O ATOM 0 H GLY A 88 -10.127 30.045 -7.656 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -10.796 32.809 -8.440 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -10.951 31.488 -9.581 1.00 0.00 H new ATOM 1367 N SER A 89 -13.300 32.176 -8.317 1.00 0.00 N ATOM 1368 CA SER A 89 -14.649 31.973 -7.844 1.00 0.00 C ATOM 1369 C SER A 89 -15.629 32.089 -8.972 1.00 0.00 C ATOM 1370 O SER A 89 -15.430 32.885 -9.903 1.00 0.00 O ATOM 1371 CB SER A 89 -14.969 32.975 -6.732 1.00 0.00 C ATOM 1372 OG SER A 89 -14.504 34.278 -7.071 1.00 0.00 O ATOM 0 H SER A 89 -13.193 32.967 -8.952 1.00 0.00 H new ATOM 0 HA SER A 89 -14.731 30.966 -7.436 1.00 0.00 H new ATOM 0 HB2 SER A 89 -16.045 33.002 -6.560 1.00 0.00 H new ATOM 0 HB3 SER A 89 -14.506 32.650 -5.800 1.00 0.00 H new ATOM 0 HG SER A 89 -14.721 34.901 -6.347 1.00 0.00 H new ATOM 1378 N LEU A 90 -16.671 31.280 -8.915 1.00 0.00 N ATOM 1379 CA LEU A 90 -17.688 31.309 -9.890 1.00 0.00 C ATOM 1380 C LEU A 90 -18.485 32.603 -9.709 1.00 0.00 C ATOM 1381 O LEU A 90 -19.001 32.876 -8.626 1.00 0.00 O ATOM 1382 CB LEU A 90 -18.547 30.043 -9.705 1.00 0.00 C ATOM 1383 CG LEU A 90 -19.603 29.730 -10.759 1.00 0.00 C ATOM 1384 CD1 LEU A 90 -20.688 30.746 -10.735 1.00 0.00 C ATOM 1385 CD2 LEU A 90 -18.987 29.660 -12.140 1.00 0.00 C ATOM 0 H LEU A 90 -16.815 30.589 -8.178 1.00 0.00 H new ATOM 0 HA LEU A 90 -17.298 31.305 -10.908 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -17.873 29.189 -9.645 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -19.051 30.120 -8.741 1.00 0.00 H new ATOM 0 HG LEU A 90 -20.031 28.756 -10.522 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -21.431 30.503 -11.495 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -21.161 30.750 -9.753 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -20.269 31.731 -10.939 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -19.762 29.435 -12.873 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -18.526 30.618 -12.382 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -18.229 28.877 -12.161 1.00 0.00 H new ATOM 1397 N LYS A 91 -18.555 33.401 -10.757 1.00 0.00 N ATOM 1398 CA LYS A 91 -19.238 34.684 -10.685 1.00 0.00 C ATOM 1399 C LYS A 91 -20.649 34.574 -11.221 1.00 0.00 C ATOM 1400 O LYS A 91 -21.575 35.190 -10.696 1.00 0.00 O ATOM 1401 CB LYS A 91 -18.453 35.754 -11.444 1.00 0.00 C ATOM 1402 CG LYS A 91 -17.063 36.003 -10.878 1.00 0.00 C ATOM 1403 CD LYS A 91 -17.131 36.484 -9.434 1.00 0.00 C ATOM 1404 CE LYS A 91 -15.747 36.670 -8.839 1.00 0.00 C ATOM 1405 NZ LYS A 91 -15.807 37.244 -7.475 1.00 0.00 N ATOM 0 H LYS A 91 -18.149 33.187 -11.668 1.00 0.00 H new ATOM 0 HA LYS A 91 -19.297 34.980 -9.638 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -18.363 35.455 -12.488 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -19.016 36.687 -11.427 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -16.477 35.085 -10.931 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -16.548 36.746 -11.487 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -17.676 37.427 -9.390 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -17.690 35.764 -8.836 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -15.233 35.709 -8.807 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -15.159 37.324 -9.483 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -14.916 37.048 -6.976 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -15.950 38.272 -7.537 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -16.597 36.815 -6.952 1.00 0.00 H new ATOM 1419 N ARG A 92 -20.811 33.784 -12.263 1.00 0.00 N ATOM 1420 CA ARG A 92 -22.108 33.568 -12.854 1.00 0.00 C ATOM 1421 C ARG A 92 -22.136 32.245 -13.584 1.00 0.00 C ATOM 1422 O ARG A 92 -21.191 31.900 -14.306 1.00 0.00 O ATOM 1423 CB ARG A 92 -22.483 34.702 -13.806 1.00 0.00 C ATOM 1424 CG ARG A 92 -23.877 34.556 -14.401 1.00 0.00 C ATOM 1425 CD ARG A 92 -24.254 35.761 -15.229 1.00 0.00 C ATOM 1426 NE ARG A 92 -23.332 35.970 -16.345 1.00 0.00 N ATOM 1427 CZ ARG A 92 -23.060 37.155 -16.888 1.00 0.00 C ATOM 1428 NH1 ARG A 92 -23.666 38.250 -16.444 1.00 0.00 N ATOM 1429 NH2 ARG A 92 -22.186 37.239 -17.884 1.00 0.00 N ATOM 0 H ARG A 92 -20.051 33.279 -12.718 1.00 0.00 H new ATOM 0 HA ARG A 92 -22.843 33.548 -12.049 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -22.421 35.650 -13.272 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -21.753 34.744 -14.615 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -23.917 33.660 -15.021 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -24.604 34.422 -13.600 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -25.266 35.634 -15.614 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -24.263 36.648 -14.595 1.00 0.00 H new ATOM 0 HE ARG A 92 -22.865 35.151 -16.734 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -24.343 38.186 -15.684 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -23.454 39.156 -16.863 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -21.725 36.398 -18.231 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -21.975 38.145 -18.302 1.00 0.00 H new ATOM 1443 N ALA A 93 -23.195 31.505 -13.378 1.00 0.00 N ATOM 1444 CA ALA A 93 -23.387 30.236 -14.031 1.00 0.00 C ATOM 1445 C ALA A 93 -24.724 30.247 -14.719 1.00 0.00 C ATOM 1446 O ALA A 93 -25.671 30.853 -14.220 1.00 0.00 O ATOM 1447 CB ALA A 93 -23.319 29.098 -13.021 1.00 0.00 C ATOM 0 H ALA A 93 -23.953 31.768 -12.748 1.00 0.00 H new ATOM 0 HA ALA A 93 -22.596 30.079 -14.764 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -23.466 28.147 -13.534 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -22.343 29.101 -12.535 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -24.099 29.230 -12.271 1.00 0.00 H new ATOM 1453 N LEU A 94 -24.812 29.605 -15.858 1.00 0.00 N ATOM 1454 CA LEU A 94 -26.057 29.568 -16.587 1.00 0.00 C ATOM 1455 C LEU A 94 -26.927 28.430 -16.135 1.00 0.00 C ATOM 1456 O LEU A 94 -26.523 27.597 -15.324 1.00 0.00 O ATOM 1457 CB LEU A 94 -25.824 29.490 -18.090 1.00 0.00 C ATOM 1458 CG LEU A 94 -25.426 30.796 -18.750 1.00 0.00 C ATOM 1459 CD1 LEU A 94 -24.968 30.563 -20.178 1.00 0.00 C ATOM 1460 CD2 LEU A 94 -26.578 31.791 -18.720 1.00 0.00 C ATOM 0 H LEU A 94 -24.041 29.103 -16.299 1.00 0.00 H new ATOM 0 HA LEU A 94 -26.577 30.501 -16.371 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -25.046 28.752 -18.283 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -26.735 29.124 -18.564 1.00 0.00 H new ATOM 0 HG LEU A 94 -24.593 31.215 -18.186 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -24.688 31.514 -20.630 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -24.108 29.893 -20.180 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -25.779 30.114 -20.751 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -26.269 32.720 -19.199 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -27.432 31.375 -19.253 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -26.859 31.992 -17.686 1.00 0.00 H new ATOM 1472 N HIS A 95 -28.114 28.399 -16.666 1.00 0.00 N ATOM 1473 CA HIS A 95 -29.091 27.378 -16.308 1.00 0.00 C ATOM 1474 C HIS A 95 -28.735 26.028 -16.916 1.00 0.00 C ATOM 1475 O HIS A 95 -29.087 24.982 -16.380 1.00 0.00 O ATOM 1476 CB HIS A 95 -30.520 27.803 -16.708 1.00 0.00 C ATOM 1477 CG HIS A 95 -30.729 28.051 -18.179 1.00 0.00 C ATOM 1478 ND1 HIS A 95 -30.793 29.309 -18.728 1.00 0.00 N ATOM 1479 CD2 HIS A 95 -30.904 27.190 -19.210 1.00 0.00 C ATOM 1480 CE1 HIS A 95 -30.996 29.213 -20.025 1.00 0.00 C ATOM 1481 NE2 HIS A 95 -31.068 27.937 -20.344 1.00 0.00 N ATOM 0 H HIS A 95 -28.444 29.072 -17.358 1.00 0.00 H new ATOM 0 HA HIS A 95 -29.065 27.271 -15.224 1.00 0.00 H new ATOM 0 HB2 HIS A 95 -31.216 27.029 -16.384 1.00 0.00 H new ATOM 0 HB3 HIS A 95 -30.777 28.711 -16.163 1.00 0.00 H new ATOM 0 HD2 HIS A 95 -30.912 26.112 -19.148 1.00 0.00 H new ATOM 0 HE1 HIS A 95 -31.088 30.041 -20.712 1.00 0.00 H new ATOM 0 HE2 HIS A 95 -31.221 27.567 -21.282 1.00 0.00 H new ATOM 1490 N ASN A 96 -28.025 26.054 -18.026 1.00 0.00 N ATOM 1491 CA ASN A 96 -27.627 24.826 -18.698 1.00 0.00 C ATOM 1492 C ASN A 96 -26.146 24.567 -18.449 1.00 0.00 C ATOM 1493 O ASN A 96 -25.431 24.049 -19.302 1.00 0.00 O ATOM 1494 CB ASN A 96 -27.927 24.929 -20.204 1.00 0.00 C ATOM 1495 CG ASN A 96 -27.934 23.582 -20.915 1.00 0.00 C ATOM 1496 OD1 ASN A 96 -28.951 22.892 -20.948 1.00 0.00 O ATOM 1497 ND2 ASN A 96 -26.816 23.217 -21.510 1.00 0.00 N ATOM 0 H ASN A 96 -27.710 26.909 -18.484 1.00 0.00 H new ATOM 0 HA ASN A 96 -28.197 23.987 -18.298 1.00 0.00 H new ATOM 0 HB2 ASN A 96 -28.896 25.409 -20.341 1.00 0.00 H new ATOM 0 HB3 ASN A 96 -27.183 25.574 -20.671 1.00 0.00 H new ATOM 0 HD21 ASN A 96 -26.774 22.335 -22.020 1.00 0.00 H new ATOM 0 HD22 ASN A 96 -25.992 23.817 -21.460 1.00 0.00 H new ATOM 1504 N ALA A 97 -25.704 24.908 -17.260 1.00 0.00 N ATOM 1505 CA ALA A 97 -24.313 24.742 -16.884 1.00 0.00 C ATOM 1506 C ALA A 97 -24.172 24.591 -15.377 1.00 0.00 C ATOM 1507 O ALA A 97 -24.798 25.321 -14.609 1.00 0.00 O ATOM 1508 CB ALA A 97 -23.492 25.924 -17.373 1.00 0.00 C ATOM 0 H ALA A 97 -26.292 25.306 -16.528 1.00 0.00 H new ATOM 0 HA ALA A 97 -23.939 23.833 -17.354 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -22.450 25.787 -17.084 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -23.562 25.991 -18.459 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -23.875 26.842 -16.927 1.00 0.00 H new ATOM 1514 N GLU A 98 -23.377 23.631 -14.962 1.00 0.00 N ATOM 1515 CA GLU A 98 -23.111 23.415 -13.553 1.00 0.00 C ATOM 1516 C GLU A 98 -21.666 23.746 -13.251 1.00 0.00 C ATOM 1517 O GLU A 98 -20.756 23.169 -13.849 1.00 0.00 O ATOM 1518 CB GLU A 98 -23.401 21.970 -13.161 1.00 0.00 C ATOM 1519 CG GLU A 98 -24.840 21.547 -13.366 1.00 0.00 C ATOM 1520 CD GLU A 98 -25.071 20.121 -12.951 1.00 0.00 C ATOM 1521 OE1 GLU A 98 -24.919 19.224 -13.797 1.00 0.00 O ATOM 1522 OE2 GLU A 98 -25.394 19.886 -11.767 1.00 0.00 O ATOM 0 H GLU A 98 -22.898 22.980 -15.585 1.00 0.00 H new ATOM 0 HA GLU A 98 -23.765 24.067 -12.974 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -22.755 21.311 -13.741 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -23.139 21.831 -12.112 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -25.496 22.202 -12.793 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -25.107 21.667 -14.416 1.00 0.00 H new ATOM 1529 N CYS A 99 -21.449 24.665 -12.335 1.00 0.00 N ATOM 1530 CA CYS A 99 -20.108 25.067 -11.997 1.00 0.00 C ATOM 1531 C CYS A 99 -19.946 25.272 -10.500 1.00 0.00 C ATOM 1532 O CYS A 99 -20.851 25.758 -9.821 1.00 0.00 O ATOM 1533 CB CYS A 99 -19.725 26.342 -12.751 1.00 0.00 C ATOM 1534 SG CYS A 99 -19.702 26.170 -14.571 1.00 0.00 S ATOM 0 H CYS A 99 -22.184 25.144 -11.815 1.00 0.00 H new ATOM 0 HA CYS A 99 -19.437 24.262 -12.298 1.00 0.00 H new ATOM 0 HB2 CYS A 99 -20.426 27.132 -12.482 1.00 0.00 H new ATOM 0 HB3 CYS A 99 -18.739 26.664 -12.417 1.00 0.00 H new ATOM 1539 N GLN A 100 -18.798 24.860 -10.009 1.00 0.00 N ATOM 1540 CA GLN A 100 -18.412 25.030 -8.613 1.00 0.00 C ATOM 1541 C GLN A 100 -18.173 26.499 -8.293 1.00 0.00 C ATOM 1542 O GLN A 100 -17.824 27.282 -9.172 1.00 0.00 O ATOM 1543 CB GLN A 100 -17.150 24.235 -8.305 1.00 0.00 C ATOM 1544 CG GLN A 100 -16.013 24.532 -9.259 1.00 0.00 C ATOM 1545 CD GLN A 100 -16.094 23.703 -10.533 1.00 0.00 C ATOM 1546 OE1 GLN A 100 -16.599 22.584 -10.529 1.00 0.00 O ATOM 1547 NE2 GLN A 100 -15.620 24.252 -11.627 1.00 0.00 N ATOM 0 H GLN A 100 -18.090 24.389 -10.572 1.00 0.00 H new ATOM 0 HA GLN A 100 -19.230 24.660 -7.995 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -16.829 24.455 -7.287 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -17.380 23.170 -8.344 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -16.025 25.591 -9.516 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -15.064 24.336 -8.761 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -15.207 25.184 -11.592 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -15.664 23.747 -12.512 1.00 0.00 H new ATOM 1556 N LYS A 101 -18.340 26.852 -7.024 1.00 0.00 N ATOM 1557 CA LYS A 101 -18.239 28.220 -6.567 1.00 0.00 C ATOM 1558 C LYS A 101 -16.792 28.692 -6.530 1.00 0.00 C ATOM 1559 O LYS A 101 -16.531 29.881 -6.632 1.00 0.00 O ATOM 1560 CB LYS A 101 -18.887 28.384 -5.184 1.00 0.00 C ATOM 1561 CG LYS A 101 -18.352 27.427 -4.124 1.00 0.00 C ATOM 1562 CD LYS A 101 -18.949 27.723 -2.758 1.00 0.00 C ATOM 1563 CE LYS A 101 -18.588 26.648 -1.740 1.00 0.00 C ATOM 1564 NZ LYS A 101 -19.211 25.332 -2.064 1.00 0.00 N ATOM 0 H LYS A 101 -18.551 26.185 -6.281 1.00 0.00 H new ATOM 0 HA LYS A 101 -18.778 28.842 -7.282 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -18.734 29.408 -4.843 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -19.963 28.237 -5.280 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -18.582 26.400 -4.409 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -17.266 27.508 -4.073 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -18.592 28.691 -2.407 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -20.033 27.795 -2.843 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -17.504 26.535 -1.702 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -18.910 26.966 -0.749 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -19.171 24.714 -1.229 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -20.203 25.476 -2.341 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -18.694 24.887 -2.849 1.00 0.00 H new ATOM 1578 N THR A 102 -15.854 27.775 -6.367 1.00 0.00 N ATOM 1579 CA THR A 102 -14.462 28.154 -6.337 1.00 0.00 C ATOM 1580 C THR A 102 -13.589 27.146 -7.072 1.00 0.00 C ATOM 1581 O THR A 102 -13.911 25.959 -7.151 1.00 0.00 O ATOM 1582 CB THR A 102 -13.947 28.353 -4.884 1.00 0.00 C ATOM 1583 OG1 THR A 102 -12.586 28.813 -4.892 1.00 0.00 O ATOM 1584 CG2 THR A 102 -14.051 27.063 -4.078 1.00 0.00 C ATOM 0 H THR A 102 -16.032 26.777 -6.255 1.00 0.00 H new ATOM 0 HA THR A 102 -14.390 29.110 -6.855 1.00 0.00 H new ATOM 0 HB THR A 102 -14.577 29.106 -4.410 1.00 0.00 H new ATOM 0 HG1 THR A 102 -12.443 29.397 -5.666 1.00 0.00 H new ATOM 0 HG21 THR A 102 -13.683 27.235 -3.067 1.00 0.00 H new ATOM 0 HG22 THR A 102 -15.092 26.743 -4.036 1.00 0.00 H new ATOM 0 HG23 THR A 102 -13.452 26.287 -4.555 1.00 0.00 H new ATOM 1592 N VAL A 103 -12.497 27.646 -7.608 1.00 0.00 N ATOM 1593 CA VAL A 103 -11.532 26.838 -8.339 1.00 0.00 C ATOM 1594 C VAL A 103 -10.117 27.234 -7.997 1.00 0.00 C ATOM 1595 O VAL A 103 -9.843 28.378 -7.649 1.00 0.00 O ATOM 1596 CB VAL A 103 -11.723 26.937 -9.879 1.00 0.00 C ATOM 1597 CG1 VAL A 103 -13.003 26.244 -10.317 1.00 0.00 C ATOM 1598 CG2 VAL A 103 -11.722 28.393 -10.333 1.00 0.00 C ATOM 0 H VAL A 103 -12.247 28.633 -7.551 1.00 0.00 H new ATOM 0 HA VAL A 103 -11.710 25.807 -8.033 1.00 0.00 H new ATOM 0 HB VAL A 103 -10.883 26.428 -10.352 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -13.111 26.329 -11.398 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -12.960 25.191 -10.038 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -13.857 26.714 -9.829 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -11.857 28.437 -11.414 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -12.536 28.927 -9.843 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -10.772 28.856 -10.067 1.00 0.00 H new ATOM 1608 N THR A 104 -9.241 26.275 -8.061 1.00 0.00 N ATOM 1609 CA THR A 104 -7.846 26.491 -7.810 1.00 0.00 C ATOM 1610 C THR A 104 -7.027 25.904 -8.957 1.00 0.00 C ATOM 1611 O THR A 104 -7.318 24.802 -9.429 1.00 0.00 O ATOM 1612 CB THR A 104 -7.434 25.845 -6.478 1.00 0.00 C ATOM 1613 OG1 THR A 104 -8.170 26.455 -5.403 1.00 0.00 O ATOM 1614 CG2 THR A 104 -5.941 25.991 -6.224 1.00 0.00 C ATOM 0 H THR A 104 -9.477 25.310 -8.292 1.00 0.00 H new ATOM 0 HA THR A 104 -7.657 27.562 -7.743 1.00 0.00 H new ATOM 0 HB THR A 104 -7.662 24.780 -6.532 1.00 0.00 H new ATOM 0 HG1 THR A 104 -7.909 26.043 -4.553 1.00 0.00 H new ATOM 0 HG21 THR A 104 -5.686 25.523 -5.273 1.00 0.00 H new ATOM 0 HG22 THR A 104 -5.386 25.507 -7.028 1.00 0.00 H new ATOM 0 HG23 THR A 104 -5.680 27.049 -6.189 1.00 0.00 H new ATOM 1622 N ILE A 105 -6.028 26.634 -9.408 1.00 0.00 N ATOM 1623 CA ILE A 105 -5.196 26.184 -10.503 1.00 0.00 C ATOM 1624 C ILE A 105 -3.748 26.543 -10.254 1.00 0.00 C ATOM 1625 O ILE A 105 -3.445 27.613 -9.728 1.00 0.00 O ATOM 1626 CB ILE A 105 -5.658 26.787 -11.857 1.00 0.00 C ATOM 1627 CG1 ILE A 105 -4.745 26.335 -13.009 1.00 0.00 C ATOM 1628 CG2 ILE A 105 -5.730 28.312 -11.783 1.00 0.00 C ATOM 1629 CD1 ILE A 105 -5.173 26.844 -14.372 1.00 0.00 C ATOM 0 H ILE A 105 -5.772 27.546 -9.030 1.00 0.00 H new ATOM 0 HA ILE A 105 -5.294 25.100 -10.560 1.00 0.00 H new ATOM 0 HB ILE A 105 -6.661 26.412 -12.061 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -3.729 26.675 -12.808 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -4.718 25.246 -13.031 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -6.056 28.708 -12.745 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -6.440 28.606 -11.010 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -4.745 28.711 -11.541 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -4.479 26.482 -15.130 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -6.176 26.483 -14.597 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -5.172 27.934 -14.370 1.00 0.00 H new ATOM 1641 N SER A 106 -2.864 25.650 -10.617 1.00 0.00 N ATOM 1642 CA SER A 106 -1.450 25.880 -10.469 1.00 0.00 C ATOM 1643 C SER A 106 -0.774 25.786 -11.826 1.00 0.00 C ATOM 1644 O SER A 106 -1.055 24.871 -12.609 1.00 0.00 O ATOM 1645 CB SER A 106 -0.841 24.872 -9.488 1.00 0.00 C ATOM 1646 OG SER A 106 -1.437 24.992 -8.200 1.00 0.00 O ATOM 0 H SER A 106 -3.103 24.745 -11.023 1.00 0.00 H new ATOM 0 HA SER A 106 -1.291 26.880 -10.064 1.00 0.00 H new ATOM 0 HB2 SER A 106 -0.983 23.860 -9.866 1.00 0.00 H new ATOM 0 HB3 SER A 106 0.234 25.036 -9.412 1.00 0.00 H new ATOM 0 HG SER A 106 -1.034 24.338 -7.591 1.00 0.00 H new ATOM 1652 N LYS A 107 0.097 26.728 -12.107 1.00 0.00 N ATOM 1653 CA LYS A 107 0.786 26.778 -13.373 1.00 0.00 C ATOM 1654 C LYS A 107 2.271 27.039 -13.160 1.00 0.00 C ATOM 1655 O LYS A 107 2.643 27.900 -12.359 1.00 0.00 O ATOM 1656 CB LYS A 107 0.201 27.883 -14.256 1.00 0.00 C ATOM 1657 CG LYS A 107 0.849 27.967 -15.626 1.00 0.00 C ATOM 1658 CD LYS A 107 0.525 29.271 -16.322 1.00 0.00 C ATOM 1659 CE LYS A 107 1.203 29.349 -17.680 1.00 0.00 C ATOM 1660 NZ LYS A 107 2.671 29.118 -17.587 1.00 0.00 N ATOM 0 H LYS A 107 0.347 27.480 -11.464 1.00 0.00 H new ATOM 0 HA LYS A 107 0.657 25.815 -13.867 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -0.869 27.712 -14.378 1.00 0.00 H new ATOM 0 HB3 LYS A 107 0.315 28.841 -13.749 1.00 0.00 H new ATOM 0 HG2 LYS A 107 1.930 27.868 -15.524 1.00 0.00 H new ATOM 0 HG3 LYS A 107 0.510 27.133 -16.240 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -0.554 29.363 -16.445 1.00 0.00 H new ATOM 0 HD3 LYS A 107 0.848 30.108 -15.702 1.00 0.00 H new ATOM 0 HE2 LYS A 107 0.762 28.609 -18.348 1.00 0.00 H new ATOM 0 HE3 LYS A 107 1.018 30.328 -18.122 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 3.163 29.736 -18.264 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 2.996 29.333 -16.623 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 2.881 28.124 -17.809 1.00 0.00 H new ATOM 1674 N PRO A 108 3.132 26.279 -13.846 1.00 0.00 N ATOM 1675 CA PRO A 108 4.573 26.501 -13.788 1.00 0.00 C ATOM 1676 C PRO A 108 4.940 27.917 -14.231 1.00 0.00 C ATOM 1677 O PRO A 108 4.471 28.399 -15.277 1.00 0.00 O ATOM 1678 CB PRO A 108 5.145 25.467 -14.765 1.00 0.00 C ATOM 1679 CG PRO A 108 4.086 24.424 -14.882 1.00 0.00 C ATOM 1680 CD PRO A 108 2.780 25.140 -14.711 1.00 0.00 C ATOM 0 HA PRO A 108 4.965 26.396 -12.776 1.00 0.00 H new ATOM 0 HB2 PRO A 108 5.365 25.917 -15.733 1.00 0.00 H new ATOM 0 HB3 PRO A 108 6.077 25.044 -14.391 1.00 0.00 H new ATOM 0 HG2 PRO A 108 4.134 23.926 -15.850 1.00 0.00 H new ATOM 0 HG3 PRO A 108 4.211 23.654 -14.121 1.00 0.00 H new ATOM 0 HD2 PRO A 108 2.374 25.471 -15.667 1.00 0.00 H new ATOM 0 HD3 PRO A 108 2.028 24.501 -14.249 1.00 0.00 H new ATOM 1688 N CYS A 109 5.753 28.583 -13.435 1.00 0.00 N ATOM 1689 CA CYS A 109 6.173 29.946 -13.736 1.00 0.00 C ATOM 1690 C CYS A 109 7.325 29.970 -14.731 1.00 0.00 C ATOM 1691 O CYS A 109 7.874 28.928 -15.103 1.00 0.00 O ATOM 1692 CB CYS A 109 6.566 30.708 -12.458 1.00 0.00 C ATOM 1693 SG CYS A 109 5.163 31.148 -11.382 1.00 0.00 S ATOM 0 H CYS A 109 6.140 28.204 -12.570 1.00 0.00 H new ATOM 0 HA CYS A 109 5.318 30.447 -14.189 1.00 0.00 H new ATOM 0 HB2 CYS A 109 7.268 30.099 -11.888 1.00 0.00 H new ATOM 0 HB3 CYS A 109 7.091 31.620 -12.741 1.00 0.00 H new ATOM 1698 N GLY A 110 7.676 31.166 -15.157 1.00 0.00 N ATOM 1699 CA GLY A 110 8.740 31.359 -16.106 1.00 0.00 C ATOM 1700 C GLY A 110 8.721 32.773 -16.616 1.00 0.00 C ATOM 1701 O GLY A 110 8.325 33.687 -15.882 1.00 0.00 O ATOM 0 H GLY A 110 7.227 32.030 -14.851 1.00 0.00 H new ATOM 0 HA2 GLY A 110 9.700 31.145 -15.637 1.00 0.00 H new ATOM 0 HA3 GLY A 110 8.629 30.662 -16.937 1.00 0.00 H new ATOM 1705 N LYS A 111 9.116 32.974 -17.852 1.00 0.00 N ATOM 1706 CA LYS A 111 9.091 34.302 -18.427 1.00 0.00 C ATOM 1707 C LYS A 111 7.741 34.589 -19.048 1.00 0.00 C ATOM 1708 O LYS A 111 7.556 34.502 -20.265 1.00 0.00 O ATOM 1709 CB LYS A 111 10.213 34.490 -19.431 1.00 0.00 C ATOM 1710 CG LYS A 111 11.577 34.407 -18.792 1.00 0.00 C ATOM 1711 CD LYS A 111 12.675 34.670 -19.798 1.00 0.00 C ATOM 1712 CE LYS A 111 14.047 34.542 -19.169 1.00 0.00 C ATOM 1713 NZ LYS A 111 15.131 34.830 -20.142 1.00 0.00 N ATOM 0 H LYS A 111 9.456 32.242 -18.476 1.00 0.00 H new ATOM 0 HA LYS A 111 9.252 35.021 -17.624 1.00 0.00 H new ATOM 0 HB2 LYS A 111 10.132 33.730 -20.208 1.00 0.00 H new ATOM 0 HB3 LYS A 111 10.102 35.458 -19.919 1.00 0.00 H new ATOM 0 HG2 LYS A 111 11.645 35.131 -17.980 1.00 0.00 H new ATOM 0 HG3 LYS A 111 11.714 33.420 -18.351 1.00 0.00 H new ATOM 0 HD2 LYS A 111 12.587 33.967 -20.627 1.00 0.00 H new ATOM 0 HD3 LYS A 111 12.556 35.670 -20.214 1.00 0.00 H new ATOM 0 HE2 LYS A 111 14.125 35.228 -18.325 1.00 0.00 H new ATOM 0 HE3 LYS A 111 14.172 33.534 -18.773 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 16.054 34.732 -19.673 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 15.073 34.160 -20.935 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 15.027 35.801 -20.501 1.00 0.00 H new ATOM 1727 N LEU A 112 6.796 34.890 -18.185 1.00 0.00 N ATOM 1728 CA LEU A 112 5.423 35.184 -18.576 1.00 0.00 C ATOM 1729 C LEU A 112 4.943 36.452 -17.891 1.00 0.00 C ATOM 1730 O LEU A 112 5.570 36.929 -16.943 1.00 0.00 O ATOM 1731 CB LEU A 112 4.468 34.024 -18.200 1.00 0.00 C ATOM 1732 CG LEU A 112 4.512 32.754 -19.067 1.00 0.00 C ATOM 1733 CD1 LEU A 112 4.431 33.100 -20.541 1.00 0.00 C ATOM 1734 CD2 LEU A 112 5.744 31.909 -18.766 1.00 0.00 C ATOM 0 H LEU A 112 6.955 34.940 -17.179 1.00 0.00 H new ATOM 0 HA LEU A 112 5.412 35.314 -19.658 1.00 0.00 H new ATOM 0 HB2 LEU A 112 4.680 33.735 -17.171 1.00 0.00 H new ATOM 0 HB3 LEU A 112 3.448 34.409 -18.220 1.00 0.00 H new ATOM 0 HG LEU A 112 3.638 32.154 -18.813 1.00 0.00 H new ATOM 0 HD11 LEU A 112 4.464 32.185 -21.132 1.00 0.00 H new ATOM 0 HD12 LEU A 112 3.498 33.627 -20.740 1.00 0.00 H new ATOM 0 HD13 LEU A 112 5.273 33.737 -20.812 1.00 0.00 H new ATOM 0 HD21 LEU A 112 5.739 31.021 -19.398 1.00 0.00 H new ATOM 0 HD22 LEU A 112 6.643 32.492 -18.966 1.00 0.00 H new ATOM 0 HD23 LEU A 112 5.732 31.609 -17.718 1.00 0.00 H new ATOM 1746 N THR A 113 3.829 36.979 -18.362 1.00 0.00 N ATOM 1747 CA THR A 113 3.228 38.159 -17.780 1.00 0.00 C ATOM 1748 C THR A 113 2.391 37.781 -16.564 1.00 0.00 C ATOM 1749 O THR A 113 2.334 36.605 -16.183 1.00 0.00 O ATOM 1750 CB THR A 113 2.351 38.886 -18.814 1.00 0.00 C ATOM 1751 OG1 THR A 113 1.529 37.930 -19.506 1.00 0.00 O ATOM 1752 CG2 THR A 113 3.212 39.638 -19.819 1.00 0.00 C ATOM 0 H THR A 113 3.317 36.600 -19.159 1.00 0.00 H new ATOM 0 HA THR A 113 4.027 38.830 -17.466 1.00 0.00 H new ATOM 0 HB THR A 113 1.721 39.604 -18.290 1.00 0.00 H new ATOM 0 HG1 THR A 113 0.970 38.394 -20.163 1.00 0.00 H new ATOM 0 HG21 THR A 113 2.571 40.144 -20.540 1.00 0.00 H new ATOM 0 HG22 THR A 113 3.822 40.374 -19.296 1.00 0.00 H new ATOM 0 HG23 THR A 113 3.860 38.934 -20.341 1.00 0.00 H new ATOM 1760 N LYS A 114 1.755 38.758 -15.951 1.00 0.00 N ATOM 1761 CA LYS A 114 0.927 38.506 -14.785 1.00 0.00 C ATOM 1762 C LYS A 114 -0.539 38.802 -15.088 1.00 0.00 C ATOM 1763 O LYS A 114 -1.013 39.917 -14.872 1.00 0.00 O ATOM 1764 CB LYS A 114 1.405 39.339 -13.593 1.00 0.00 C ATOM 1765 CG LYS A 114 2.862 39.108 -13.236 1.00 0.00 C ATOM 1766 CD LYS A 114 3.271 39.913 -12.018 1.00 0.00 C ATOM 1767 CE LYS A 114 4.750 39.748 -11.723 1.00 0.00 C ATOM 1768 NZ LYS A 114 5.162 40.482 -10.500 1.00 0.00 N ATOM 0 H LYS A 114 1.794 39.736 -16.240 1.00 0.00 H new ATOM 0 HA LYS A 114 1.018 37.451 -14.527 1.00 0.00 H new ATOM 0 HB2 LYS A 114 1.257 40.396 -13.816 1.00 0.00 H new ATOM 0 HB3 LYS A 114 0.786 39.107 -12.726 1.00 0.00 H new ATOM 0 HG2 LYS A 114 3.027 38.048 -13.045 1.00 0.00 H new ATOM 0 HG3 LYS A 114 3.493 39.381 -14.082 1.00 0.00 H new ATOM 0 HD2 LYS A 114 3.046 40.967 -12.183 1.00 0.00 H new ATOM 0 HD3 LYS A 114 2.687 39.593 -11.155 1.00 0.00 H new ATOM 0 HE2 LYS A 114 4.979 38.689 -11.604 1.00 0.00 H new ATOM 0 HE3 LYS A 114 5.331 40.106 -12.573 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 6.179 40.341 -10.337 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 4.968 41.496 -10.622 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 4.628 40.123 -9.683 1.00 0.00 H new ATOM 1782 N PRO A 115 -1.262 37.811 -15.635 1.00 0.00 N ATOM 1783 CA PRO A 115 -2.677 37.957 -15.971 1.00 0.00 C ATOM 1784 C PRO A 115 -3.557 38.193 -14.763 1.00 0.00 C ATOM 1785 O PRO A 115 -3.417 37.535 -13.721 1.00 0.00 O ATOM 1786 CB PRO A 115 -3.050 36.616 -16.596 1.00 0.00 C ATOM 1787 CG PRO A 115 -1.754 36.019 -17.019 1.00 0.00 C ATOM 1788 CD PRO A 115 -0.751 36.488 -16.005 1.00 0.00 C ATOM 0 HA PRO A 115 -2.826 38.820 -16.620 1.00 0.00 H new ATOM 0 HB2 PRO A 115 -3.565 35.976 -15.880 1.00 0.00 H new ATOM 0 HB3 PRO A 115 -3.720 36.748 -17.445 1.00 0.00 H new ATOM 0 HG2 PRO A 115 -1.811 34.931 -17.041 1.00 0.00 H new ATOM 0 HG3 PRO A 115 -1.480 36.344 -18.023 1.00 0.00 H new ATOM 0 HD2 PRO A 115 -0.700 35.819 -15.146 1.00 0.00 H new ATOM 0 HD3 PRO A 115 0.253 36.545 -16.425 1.00 0.00 H new ATOM 1796 N LYS A 116 -4.464 39.119 -14.921 1.00 0.00 N ATOM 1797 CA LYS A 116 -5.461 39.434 -13.918 1.00 0.00 C ATOM 1798 C LYS A 116 -6.699 40.074 -14.579 1.00 0.00 C ATOM 1799 O LYS A 116 -7.117 41.168 -14.200 1.00 0.00 O ATOM 1800 CB LYS A 116 -4.871 40.358 -12.838 1.00 0.00 C ATOM 1801 CG LYS A 116 -4.059 41.524 -13.387 1.00 0.00 C ATOM 1802 CD LYS A 116 -3.466 42.360 -12.266 1.00 0.00 C ATOM 1803 CE LYS A 116 -2.503 43.406 -12.802 1.00 0.00 C ATOM 1804 NZ LYS A 116 -3.157 44.334 -13.757 1.00 0.00 N ATOM 0 H LYS A 116 -4.537 39.689 -15.764 1.00 0.00 H new ATOM 0 HA LYS A 116 -5.773 38.509 -13.432 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -5.685 40.752 -12.229 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -4.236 39.767 -12.178 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -3.259 41.145 -14.023 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -4.695 42.150 -14.013 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -4.267 42.851 -11.713 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -2.945 41.710 -11.563 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -2.089 43.976 -11.970 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -1.668 42.909 -13.295 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -2.491 45.089 -14.018 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -3.440 43.811 -14.611 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -3.999 44.753 -13.313 1.00 0.00 H new ATOM 1818 N PRO A 117 -7.289 39.388 -15.610 1.00 0.00 N ATOM 1819 CA PRO A 117 -8.470 39.895 -16.332 1.00 0.00 C ATOM 1820 C PRO A 117 -9.663 40.182 -15.418 1.00 0.00 C ATOM 1821 O PRO A 117 -10.363 39.262 -14.987 1.00 0.00 O ATOM 1822 CB PRO A 117 -8.821 38.766 -17.306 1.00 0.00 C ATOM 1823 CG PRO A 117 -7.565 37.989 -17.468 1.00 0.00 C ATOM 1824 CD PRO A 117 -6.835 38.089 -16.163 1.00 0.00 C ATOM 0 HA PRO A 117 -8.249 40.848 -16.813 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -9.623 38.141 -16.913 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -9.165 39.162 -18.261 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -7.780 36.949 -17.714 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -6.962 38.391 -18.282 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -7.085 37.261 -15.499 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -5.754 38.069 -16.305 1.00 0.00 H new ATOM 1832 N GLN A 118 -9.865 41.472 -15.128 1.00 0.00 N ATOM 1833 CA GLN A 118 -10.981 41.958 -14.307 1.00 0.00 C ATOM 1834 C GLN A 118 -10.870 41.560 -12.837 1.00 0.00 C ATOM 1835 O GLN A 118 -10.698 40.394 -12.494 1.00 0.00 O ATOM 1836 CB GLN A 118 -12.343 41.543 -14.876 1.00 0.00 C ATOM 1837 CG GLN A 118 -12.726 42.279 -16.148 1.00 0.00 C ATOM 1838 CD GLN A 118 -14.156 42.014 -16.565 1.00 0.00 C ATOM 1839 OE1 GLN A 118 -15.077 42.718 -16.145 1.00 0.00 O ATOM 1840 NE2 GLN A 118 -14.355 41.011 -17.395 1.00 0.00 N ATOM 0 H GLN A 118 -9.252 42.217 -15.460 1.00 0.00 H new ATOM 0 HA GLN A 118 -10.911 43.045 -14.348 1.00 0.00 H new ATOM 0 HB2 GLN A 118 -12.331 40.472 -15.077 1.00 0.00 H new ATOM 0 HB3 GLN A 118 -13.110 41.718 -14.121 1.00 0.00 H new ATOM 0 HG2 GLN A 118 -12.587 43.350 -16.000 1.00 0.00 H new ATOM 0 HG3 GLN A 118 -12.055 41.979 -16.953 1.00 0.00 H new ATOM 0 HE21 GLN A 118 -13.565 40.453 -17.719 1.00 0.00 H new ATOM 0 HE22 GLN A 118 -15.299 40.792 -17.714 1.00 0.00 H new ATOM 1849 N ALA A 119 -10.980 42.552 -11.979 1.00 0.00 N ATOM 1850 CA ALA A 119 -10.946 42.352 -10.558 1.00 0.00 C ATOM 1851 C ALA A 119 -12.045 43.171 -9.903 1.00 0.00 C ATOM 1852 O ALA A 119 -12.040 44.403 -9.977 1.00 0.00 O ATOM 1853 CB ALA A 119 -9.584 42.728 -9.993 1.00 0.00 C ATOM 0 H ALA A 119 -11.096 43.526 -12.258 1.00 0.00 H new ATOM 0 HA ALA A 119 -11.115 41.297 -10.344 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -9.581 42.569 -8.915 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -8.815 42.108 -10.454 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -9.379 43.777 -10.205 1.00 0.00 H new ATOM 1859 N GLU A 120 -12.998 42.492 -9.283 1.00 0.00 N ATOM 1860 CA GLU A 120 -14.121 43.163 -8.647 1.00 0.00 C ATOM 1861 C GLU A 120 -13.658 43.965 -7.437 1.00 0.00 C ATOM 1862 O GLU A 120 -13.288 43.400 -6.411 1.00 0.00 O ATOM 1863 CB GLU A 120 -15.193 42.156 -8.233 1.00 0.00 C ATOM 1864 CG GLU A 120 -15.652 41.242 -9.357 1.00 0.00 C ATOM 1865 CD GLU A 120 -16.906 40.468 -9.002 1.00 0.00 C ATOM 1866 OE1 GLU A 120 -16.821 39.533 -8.184 1.00 0.00 O ATOM 1867 OE2 GLU A 120 -17.980 40.793 -9.550 1.00 0.00 O ATOM 0 H GLU A 120 -13.016 41.475 -9.207 1.00 0.00 H new ATOM 0 HA GLU A 120 -14.554 43.850 -9.374 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -14.807 41.545 -7.417 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -16.055 42.698 -7.845 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -15.837 41.837 -10.251 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -14.853 40.541 -9.600 1.00 0.00 H new ATOM 1874 N SER A 121 -13.665 45.278 -7.571 1.00 0.00 N ATOM 1875 CA SER A 121 -13.229 46.150 -6.501 1.00 0.00 C ATOM 1876 C SER A 121 -14.418 46.661 -5.690 1.00 0.00 C ATOM 1877 O SER A 121 -14.277 47.024 -4.517 1.00 0.00 O ATOM 1878 CB SER A 121 -12.448 47.325 -7.078 1.00 0.00 C ATOM 1879 OG SER A 121 -11.449 46.878 -7.991 1.00 0.00 O ATOM 0 H SER A 121 -13.969 45.764 -8.415 1.00 0.00 H new ATOM 0 HA SER A 121 -12.584 45.578 -5.834 1.00 0.00 H new ATOM 0 HB2 SER A 121 -13.131 48.005 -7.586 1.00 0.00 H new ATOM 0 HB3 SER A 121 -11.981 47.887 -6.270 1.00 0.00 H new ATOM 0 HG SER A 121 -10.963 47.650 -8.348 1.00 0.00 H new ATOM 1885 N LYS A 122 -15.586 46.688 -6.315 1.00 0.00 N ATOM 1886 CA LYS A 122 -16.788 47.169 -5.648 1.00 0.00 C ATOM 1887 C LYS A 122 -17.544 46.021 -4.994 1.00 0.00 C ATOM 1888 O LYS A 122 -18.249 46.214 -4.001 1.00 0.00 O ATOM 1889 CB LYS A 122 -17.693 47.933 -6.619 1.00 0.00 C ATOM 1890 CG LYS A 122 -17.045 49.175 -7.211 1.00 0.00 C ATOM 1891 CD LYS A 122 -18.038 49.993 -8.023 1.00 0.00 C ATOM 1892 CE LYS A 122 -17.398 51.260 -8.577 1.00 0.00 C ATOM 1893 NZ LYS A 122 -16.360 50.963 -9.597 1.00 0.00 N ATOM 0 H LYS A 122 -15.727 46.384 -7.278 1.00 0.00 H new ATOM 0 HA LYS A 122 -16.478 47.861 -4.865 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -17.986 47.266 -7.429 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -18.606 48.223 -6.099 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -16.636 49.790 -6.409 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -16.209 48.882 -7.846 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -18.422 49.389 -8.845 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -18.890 50.258 -7.397 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -18.169 51.892 -9.019 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -16.951 51.827 -7.760 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -16.036 51.851 -10.031 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -15.555 50.485 -9.144 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -16.761 50.345 -10.331 1.00 0.00 H new ATOM 1907 N LYS A 123 -17.409 44.835 -5.552 1.00 0.00 N ATOM 1908 CA LYS A 123 -18.033 43.659 -4.979 1.00 0.00 C ATOM 1909 C LYS A 123 -17.139 43.058 -3.917 1.00 0.00 C ATOM 1910 O LYS A 123 -16.298 42.207 -4.200 1.00 0.00 O ATOM 1911 CB LYS A 123 -18.360 42.619 -6.055 1.00 0.00 C ATOM 1912 CG LYS A 123 -19.566 42.967 -6.907 1.00 0.00 C ATOM 1913 CD LYS A 123 -20.857 42.819 -6.114 1.00 0.00 C ATOM 1914 CE LYS A 123 -22.062 43.225 -6.938 1.00 0.00 C ATOM 1915 NZ LYS A 123 -22.047 44.668 -7.263 1.00 0.00 N ATOM 0 H LYS A 123 -16.873 44.660 -6.402 1.00 0.00 H new ATOM 0 HA LYS A 123 -18.972 43.967 -4.519 1.00 0.00 H new ATOM 0 HB2 LYS A 123 -17.493 42.499 -6.704 1.00 0.00 H new ATOM 0 HB3 LYS A 123 -18.534 41.657 -5.574 1.00 0.00 H new ATOM 0 HG2 LYS A 123 -19.475 43.990 -7.272 1.00 0.00 H new ATOM 0 HG3 LYS A 123 -19.597 42.318 -7.782 1.00 0.00 H new ATOM 0 HD2 LYS A 123 -20.969 41.785 -5.788 1.00 0.00 H new ATOM 0 HD3 LYS A 123 -20.806 43.433 -5.215 1.00 0.00 H new ATOM 0 HE2 LYS A 123 -22.083 42.645 -7.861 1.00 0.00 H new ATOM 0 HE3 LYS A 123 -22.974 42.986 -6.390 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 -22.978 44.951 -7.630 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 -21.832 45.215 -6.405 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 -21.320 44.854 -7.983 1.00 0.00 H new ATOM 1929 N LYS A 124 -17.296 43.533 -2.702 1.00 0.00 N ATOM 1930 CA LYS A 124 -16.506 43.048 -1.595 1.00 0.00 C ATOM 1931 C LYS A 124 -17.106 41.769 -1.038 1.00 0.00 C ATOM 1932 O LYS A 124 -16.386 40.810 -0.748 1.00 0.00 O ATOM 1933 CB LYS A 124 -16.390 44.117 -0.497 1.00 0.00 C ATOM 1934 CG LYS A 124 -17.731 44.645 0.012 1.00 0.00 C ATOM 1935 CD LYS A 124 -17.550 45.675 1.116 1.00 0.00 C ATOM 1936 CE LYS A 124 -16.904 45.065 2.353 1.00 0.00 C ATOM 1937 NZ LYS A 124 -16.637 46.084 3.393 1.00 0.00 N ATOM 0 H LYS A 124 -17.968 44.259 -2.455 1.00 0.00 H new ATOM 0 HA LYS A 124 -15.502 42.829 -1.959 1.00 0.00 H new ATOM 0 HB2 LYS A 124 -15.835 43.699 0.343 1.00 0.00 H new ATOM 0 HB3 LYS A 124 -15.806 44.953 -0.881 1.00 0.00 H new ATOM 0 HG2 LYS A 124 -18.283 45.092 -0.815 1.00 0.00 H new ATOM 0 HG3 LYS A 124 -18.331 43.815 0.384 1.00 0.00 H new ATOM 0 HD2 LYS A 124 -16.933 46.496 0.750 1.00 0.00 H new ATOM 0 HD3 LYS A 124 -18.519 46.098 1.382 1.00 0.00 H new ATOM 0 HE2 LYS A 124 -17.556 44.292 2.760 1.00 0.00 H new ATOM 0 HE3 LYS A 124 -15.970 44.578 2.073 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 -16.197 45.630 4.219 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 -15.994 46.808 3.013 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 -17.532 46.531 3.679 1.00 0.00 H new ATOM 1951 N LYS A 125 -18.436 41.765 -0.921 1.00 0.00 N ATOM 1952 CA LYS A 125 -19.201 40.641 -0.391 1.00 0.00 C ATOM 1953 C LYS A 125 -18.816 40.316 1.056 1.00 0.00 C ATOM 1954 O LYS A 125 -19.518 40.720 1.984 1.00 0.00 O ATOM 1955 CB LYS A 125 -19.073 39.399 -1.296 1.00 0.00 C ATOM 1956 CG LYS A 125 -19.874 38.188 -0.825 1.00 0.00 C ATOM 1957 CD LYS A 125 -21.344 38.528 -0.618 1.00 0.00 C ATOM 1958 CE LYS A 125 -22.161 37.291 -0.279 1.00 0.00 C ATOM 1959 NZ LYS A 125 -23.560 37.629 0.080 1.00 0.00 N ATOM 0 H LYS A 125 -19.018 42.556 -1.197 1.00 0.00 H new ATOM 0 HA LYS A 125 -20.248 40.943 -0.384 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -19.396 39.664 -2.303 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -18.021 39.120 -1.362 1.00 0.00 H new ATOM 0 HG2 LYS A 125 -19.786 37.386 -1.558 1.00 0.00 H new ATOM 0 HG3 LYS A 125 -19.453 37.814 0.108 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -21.440 39.259 0.185 1.00 0.00 H new ATOM 0 HD3 LYS A 125 -21.742 38.992 -1.521 1.00 0.00 H new ATOM 0 HE2 LYS A 125 -22.160 36.611 -1.131 1.00 0.00 H new ATOM 0 HE3 LYS A 125 -21.691 36.763 0.551 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 -24.204 36.925 -0.334 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 -23.663 37.627 1.115 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 -23.795 38.573 -0.289 1.00 0.00 H new ATOM 1973 N LYS A 126 -17.681 39.626 1.233 1.00 0.00 N ATOM 1974 CA LYS A 126 -17.207 39.166 2.525 1.00 0.00 C ATOM 1975 C LYS A 126 -18.190 38.175 3.132 1.00 0.00 C ATOM 1976 O LYS A 126 -17.978 36.961 3.052 1.00 0.00 O ATOM 1977 CB LYS A 126 -16.941 40.334 3.477 1.00 0.00 C ATOM 1978 CG LYS A 126 -16.212 39.915 4.727 1.00 0.00 C ATOM 1979 CD LYS A 126 -15.962 41.093 5.655 1.00 0.00 C ATOM 1980 CE LYS A 126 -15.175 40.677 6.891 1.00 0.00 C ATOM 1981 NZ LYS A 126 -13.846 40.114 6.541 1.00 0.00 N ATOM 0 H LYS A 126 -17.063 39.373 0.462 1.00 0.00 H new ATOM 0 HA LYS A 126 -16.257 38.655 2.370 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -16.356 41.093 2.958 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -17.889 40.795 3.752 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -16.794 39.157 5.251 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -15.261 39.456 4.457 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -15.415 41.869 5.119 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -16.915 41.526 5.959 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -15.043 41.540 7.544 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -15.746 39.937 7.452 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -13.248 40.081 7.391 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -13.965 39.152 6.163 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -13.393 40.714 5.823 1.00 0.00 H new ATOM 1995 N GLU A 127 -19.263 38.709 3.711 1.00 0.00 N ATOM 1996 CA GLU A 127 -20.350 37.928 4.286 1.00 0.00 C ATOM 1997 C GLU A 127 -19.911 37.118 5.514 1.00 0.00 C ATOM 1998 O GLU A 127 -18.719 37.013 5.829 1.00 0.00 O ATOM 1999 CB GLU A 127 -20.976 37.015 3.218 1.00 0.00 C ATOM 2000 CG GLU A 127 -22.404 36.590 3.519 1.00 0.00 C ATOM 2001 CD GLU A 127 -23.327 37.773 3.679 1.00 0.00 C ATOM 2002 OE1 GLU A 127 -23.913 38.217 2.670 1.00 0.00 O ATOM 2003 OE2 GLU A 127 -23.468 38.272 4.813 1.00 0.00 O ATOM 0 H GLU A 127 -19.402 39.716 3.794 1.00 0.00 H new ATOM 0 HA GLU A 127 -21.104 38.634 4.635 1.00 0.00 H new ATOM 0 HB2 GLU A 127 -20.958 37.532 2.259 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -20.358 36.123 3.112 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -22.769 35.952 2.714 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -22.419 35.993 4.431 1.00 0.00 H new ATOM 2010 N GLY A 128 -20.890 36.584 6.205 1.00 0.00 N ATOM 2011 CA GLY A 128 -20.664 35.765 7.359 1.00 0.00 C ATOM 2012 C GLY A 128 -21.939 35.068 7.746 1.00 0.00 C ATOM 2013 O GLY A 128 -22.283 34.042 7.167 1.00 0.00 O ATOM 0 H GLY A 128 -21.875 36.711 5.974 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -19.887 35.031 7.149 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -20.308 36.378 8.187 1.00 0.00 H new ATOM 2017 N LYS A 129 -22.656 35.659 8.703 1.00 0.00 N ATOM 2018 CA LYS A 129 -23.953 35.152 9.159 1.00 0.00 C ATOM 2019 C LYS A 129 -23.909 33.669 9.493 1.00 0.00 C ATOM 2020 O LYS A 129 -24.341 32.831 8.693 1.00 0.00 O ATOM 2021 CB LYS A 129 -25.040 35.411 8.108 1.00 0.00 C ATOM 2022 CG LYS A 129 -25.309 36.876 7.836 1.00 0.00 C ATOM 2023 CD LYS A 129 -26.284 37.047 6.684 1.00 0.00 C ATOM 2024 CE LYS A 129 -26.627 38.508 6.452 1.00 0.00 C ATOM 2025 NZ LYS A 129 -25.418 39.338 6.230 1.00 0.00 N ATOM 0 H LYS A 129 -22.354 36.505 9.186 1.00 0.00 H new ATOM 0 HA LYS A 129 -24.195 35.694 10.073 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -24.749 34.928 7.175 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -25.966 34.939 8.436 1.00 0.00 H new ATOM 0 HG2 LYS A 129 -25.713 37.347 8.732 1.00 0.00 H new ATOM 0 HG3 LYS A 129 -24.373 37.384 7.603 1.00 0.00 H new ATOM 0 HD2 LYS A 129 -25.852 36.626 5.776 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -27.196 36.488 6.893 1.00 0.00 H new ATOM 0 HE2 LYS A 129 -27.287 38.592 5.589 1.00 0.00 H new ATOM 0 HE3 LYS A 129 -27.176 38.892 7.312 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 -25.638 40.098 5.554 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 -25.113 39.755 7.133 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -24.655 38.744 5.847 1.00 0.00 H new ATOM 2039 N LYS A 130 -23.370 33.340 10.654 1.00 0.00 N ATOM 2040 CA LYS A 130 -23.330 31.974 11.087 1.00 0.00 C ATOM 2041 C LYS A 130 -24.738 31.500 11.427 1.00 0.00 C ATOM 2042 O LYS A 130 -25.201 31.634 12.567 1.00 0.00 O ATOM 2043 CB LYS A 130 -22.377 31.790 12.274 1.00 0.00 C ATOM 2044 CG LYS A 130 -22.217 30.338 12.716 1.00 0.00 C ATOM 2045 CD LYS A 130 -21.086 30.180 13.723 1.00 0.00 C ATOM 2046 CE LYS A 130 -21.340 30.979 14.990 1.00 0.00 C ATOM 2047 NZ LYS A 130 -20.203 30.884 15.940 1.00 0.00 N ATOM 0 H LYS A 130 -22.957 34.007 11.306 1.00 0.00 H new ATOM 0 HA LYS A 130 -22.943 31.362 10.272 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -21.398 32.189 12.007 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -22.742 32.378 13.116 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -23.150 29.987 13.157 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -22.020 29.712 11.846 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -20.969 29.126 13.976 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -20.149 30.505 13.271 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -21.512 32.024 14.732 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -22.248 30.616 15.472 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -20.415 31.442 16.792 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -20.055 29.890 16.206 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -19.342 31.254 15.489 1.00 0.00 H new ATOM 2061 N GLN A 131 -25.422 31.001 10.409 1.00 0.00 N ATOM 2062 CA GLN A 131 -26.792 30.526 10.525 1.00 0.00 C ATOM 2063 C GLN A 131 -26.905 29.466 11.603 1.00 0.00 C ATOM 2064 O GLN A 131 -27.579 29.666 12.618 1.00 0.00 O ATOM 2065 CB GLN A 131 -27.258 29.970 9.177 1.00 0.00 C ATOM 2066 CG GLN A 131 -27.118 30.966 8.033 1.00 0.00 C ATOM 2067 CD GLN A 131 -27.448 30.366 6.678 1.00 0.00 C ATOM 2068 OE1 GLN A 131 -28.279 29.468 6.562 1.00 0.00 O ATOM 2069 NE2 GLN A 131 -26.789 30.856 5.643 1.00 0.00 N ATOM 0 H GLN A 131 -25.037 30.914 9.468 1.00 0.00 H new ATOM 0 HA GLN A 131 -27.431 31.362 10.808 1.00 0.00 H new ATOM 0 HB2 GLN A 131 -26.682 29.075 8.943 1.00 0.00 H new ATOM 0 HB3 GLN A 131 -28.301 29.665 9.259 1.00 0.00 H new ATOM 0 HG2 GLN A 131 -27.775 31.816 8.217 1.00 0.00 H new ATOM 0 HG3 GLN A 131 -26.098 31.349 8.015 1.00 0.00 H new ATOM 0 HE21 GLN A 131 -26.107 31.602 5.780 1.00 0.00 H new ATOM 0 HE22 GLN A 131 -26.963 30.489 4.707 1.00 0.00 H new ATOM 2078 N GLU A 132 -26.241 28.349 11.385 1.00 0.00 N ATOM 2079 CA GLU A 132 -26.238 27.269 12.334 1.00 0.00 C ATOM 2080 C GLU A 132 -25.010 26.389 12.136 1.00 0.00 C ATOM 2081 O GLU A 132 -24.677 25.998 11.008 1.00 0.00 O ATOM 2082 CB GLU A 132 -27.516 26.446 12.204 1.00 0.00 C ATOM 2083 CG GLU A 132 -27.712 25.808 10.840 1.00 0.00 C ATOM 2084 CD GLU A 132 -28.934 24.935 10.789 1.00 0.00 C ATOM 2085 OE1 GLU A 132 -28.925 23.863 11.425 1.00 0.00 O ATOM 2086 OE2 GLU A 132 -29.909 25.306 10.107 1.00 0.00 O ATOM 0 H GLU A 132 -25.691 28.170 10.545 1.00 0.00 H new ATOM 0 HA GLU A 132 -26.199 27.689 13.339 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -27.508 25.662 12.961 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -28.371 27.087 12.418 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -27.795 26.589 10.084 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -26.833 25.214 10.590 1.00 0.00 H new ATOM 2093 N LYS A 133 -24.327 26.106 13.220 1.00 0.00 N ATOM 2094 CA LYS A 133 -23.167 25.261 13.194 1.00 0.00 C ATOM 2095 C LYS A 133 -23.004 24.594 14.550 1.00 0.00 C ATOM 2096 O LYS A 133 -22.129 24.956 15.338 1.00 0.00 O ATOM 2097 CB LYS A 133 -21.912 26.068 12.829 1.00 0.00 C ATOM 2098 CG LYS A 133 -20.732 25.212 12.389 1.00 0.00 C ATOM 2099 CD LYS A 133 -19.505 26.061 12.078 1.00 0.00 C ATOM 2100 CE LYS A 133 -18.848 26.589 13.347 1.00 0.00 C ATOM 2101 NZ LYS A 133 -18.244 25.496 14.152 1.00 0.00 N ATOM 0 H LYS A 133 -24.565 26.459 14.147 1.00 0.00 H new ATOM 0 HA LYS A 133 -23.299 24.494 12.430 1.00 0.00 H new ATOM 0 HB2 LYS A 133 -22.161 26.765 12.029 1.00 0.00 H new ATOM 0 HB3 LYS A 133 -21.613 26.665 13.690 1.00 0.00 H new ATOM 0 HG2 LYS A 133 -20.489 24.496 13.174 1.00 0.00 H new ATOM 0 HG3 LYS A 133 -21.009 24.636 11.506 1.00 0.00 H new ATOM 0 HD2 LYS A 133 -18.785 25.467 11.516 1.00 0.00 H new ATOM 0 HD3 LYS A 133 -19.793 26.898 11.442 1.00 0.00 H new ATOM 0 HE2 LYS A 133 -18.078 27.314 13.083 1.00 0.00 H new ATOM 0 HE3 LYS A 133 -19.589 27.116 13.948 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 -17.573 25.899 14.836 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 -18.993 24.985 14.661 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 -17.743 24.837 13.522 1.00 0.00 H new ATOM 2115 N MET A 134 -23.879 23.648 14.830 1.00 0.00 N ATOM 2116 CA MET A 134 -23.873 22.961 16.108 1.00 0.00 C ATOM 2117 C MET A 134 -22.813 21.869 16.151 1.00 0.00 C ATOM 2118 O MET A 134 -22.731 21.023 15.251 1.00 0.00 O ATOM 2119 CB MET A 134 -25.256 22.371 16.413 1.00 0.00 C ATOM 2120 CG MET A 134 -25.338 21.661 17.762 1.00 0.00 C ATOM 2121 SD MET A 134 -26.986 21.023 18.122 1.00 0.00 S ATOM 2122 CE MET A 134 -26.708 20.271 19.726 1.00 0.00 C ATOM 0 H MET A 134 -24.607 23.336 14.187 1.00 0.00 H new ATOM 0 HA MET A 134 -23.628 23.697 16.874 1.00 0.00 H new ATOM 0 HB2 MET A 134 -25.996 23.171 16.388 1.00 0.00 H new ATOM 0 HB3 MET A 134 -25.522 21.666 15.625 1.00 0.00 H new ATOM 0 HG2 MET A 134 -24.624 20.837 17.777 1.00 0.00 H new ATOM 0 HG3 MET A 134 -25.042 22.354 18.550 1.00 0.00 H new ATOM 0 HE1 MET A 134 -27.637 19.830 20.087 1.00 0.00 H new ATOM 0 HE2 MET A 134 -25.948 19.495 19.637 1.00 0.00 H new ATOM 0 HE3 MET A 134 -26.370 21.031 20.430 1.00 0.00 H new ATOM 2132 N LEU A 135 -22.007 21.908 17.189 1.00 0.00 N ATOM 2133 CA LEU A 135 -20.974 20.921 17.424 1.00 0.00 C ATOM 2134 C LEU A 135 -20.933 20.609 18.908 1.00 0.00 C ATOM 2135 O LEU A 135 -20.415 21.395 19.707 1.00 0.00 O ATOM 2136 CB LEU A 135 -19.617 21.435 16.950 1.00 0.00 C ATOM 2137 CG LEU A 135 -18.452 20.445 17.048 1.00 0.00 C ATOM 2138 CD1 LEU A 135 -18.689 19.241 16.149 1.00 0.00 C ATOM 2139 CD2 LEU A 135 -17.141 21.130 16.691 1.00 0.00 C ATOM 0 H LEU A 135 -22.050 22.635 17.903 1.00 0.00 H new ATOM 0 HA LEU A 135 -21.200 20.015 16.861 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -19.713 21.751 15.911 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -19.364 22.322 17.531 1.00 0.00 H new ATOM 0 HG LEU A 135 -18.389 20.092 18.077 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -17.849 18.552 16.235 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -19.606 18.735 16.452 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -18.782 19.572 15.115 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -16.324 20.413 16.766 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -17.196 21.513 15.672 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -16.963 21.956 17.379 1.00 0.00 H new ATOM 2151 N ASP A 136 -21.495 19.481 19.268 1.00 0.00 N ATOM 2152 CA ASP A 136 -21.612 19.088 20.665 1.00 0.00 C ATOM 2153 C ASP A 136 -20.282 18.611 21.218 1.00 0.00 C ATOM 2154 O ASP A 136 -19.622 19.395 21.928 1.00 0.00 O ATOM 2155 CB ASP A 136 -22.685 18.012 20.834 1.00 0.00 C ATOM 2156 CG ASP A 136 -22.936 17.662 22.285 1.00 0.00 C ATOM 2157 OD1 ASP A 136 -22.283 16.734 22.804 1.00 0.00 O ATOM 2158 OD2 ASP A 136 -23.789 18.317 22.916 1.00 0.00 O ATOM 2159 OXT ASP A 136 -19.889 17.465 20.929 1.00 0.00 O ATOM 0 H ASP A 136 -21.885 18.807 18.609 1.00 0.00 H new ATOM 0 HA ASP A 136 -21.912 19.968 21.235 1.00 0.00 H new ATOM 0 HB2 ASP A 136 -23.615 18.357 20.381 1.00 0.00 H new ATOM 0 HB3 ASP A 136 -22.382 17.114 20.295 1.00 0.00 H new TER 2164 ASP A 136