USER MOD reduce.3.24.130724 H: found=0, std=0, add=1253, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1248 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 76 CYS SG : rot 75:sc= 0.687 USER MOD Set 1.2: A 120 SER OG : rot 111:sc= 1.03 USER MOD Set 2.1: A 112 SER OG : rot 180:sc= 0.12 USER MOD Set 2.2: A 117 THR OG1 : rot -131:sc= 0.0987 USER MOD Set 3.1: A 28 GLN : amide:sc= 0.989 K(o=2.1,f=-6.7!) USER MOD Set 3.2: A 88 LYS NZ :NH3+ -174:sc= 1.14 (180deg=-0.000316) USER MOD Set 4.1: A 75 MET CE :methyl -177:sc= -0.739 (180deg=-0.784) USER MOD Set 4.2: A 86 GLN : amide:sc= 0 X(o=-0.74,f=-1.2) USER MOD Set 5.1: A 49 CYS SG : rot 160:sc= -1.51 USER MOD Set 5.2: A 51 HIS : no HE2:sc= -1.08 K(o=-2.6,f=-6.7!) USER MOD Set 6.1: A 12 GLN : amide:sc= 0.549 K(o=0.87,f=-1.7) USER MOD Set 6.2: A 68 ASN : amide:sc= 0.322 K(o=0.87,f=-1.7!) USER MOD Single : A 1 MET CE :methyl 179:sc= -0.0821 (180deg=-0.0915) USER MOD Single : A 1 MET N :NH3+ -165:sc= 0.791 (180deg=0.64) USER MOD Single : A 3 LYS NZ :NH3+ -164:sc= -0.0257 (180deg=-0.242) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 THR OG1 : rot 180:sc= -0.0223 USER MOD Single : A 11 GLN : amide:sc=-0.00173 X(o=-0.0017,f=-0.45) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 16 GLN : amide:sc= -4.52! C(o=-4.5!,f=-3!) USER MOD Single : A 19 ASN : amide:sc= -0.375 K(o=-0.37,f=-1.8!) USER MOD Single : A 20 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 26 GLN : amide:sc= 0 X(o=0,f=-0.044) USER MOD Single : A 29 THR OG1 : rot 68:sc= 0.682 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 MET CE :methyl 139:sc= -0.56 (180deg=-2.37) USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 43 THR OG1 : rot 92:sc= 0.096 USER MOD Single : A 48 SER OG : rot 42:sc= 0.0806 USER MOD Single : A 54 THR OG1 : rot -38:sc= 0.00209 USER MOD Single : A 57 LYS NZ :NH3+ -165:sc= 1.24 (180deg=1.16) USER MOD Single : A 61 ASN : amide:sc= -0.153 K(o=-0.15,f=-0.76) USER MOD Single : A 64 TYR OH : rot -96:sc= 0.00453 USER MOD Single : A 71 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 73 CYS SG : rot 170:sc= -4.12! USER MOD Single : A 78 LYS NZ :NH3+ 161:sc= 1.21 (180deg=0.961) USER MOD Single : A 82 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 84 THR OG1 : rot -26:sc= 0.969 USER MOD Single : A 90 LYS NZ :NH3+ -143:sc= 0.822 (180deg=-1.56!) USER MOD Single : A 93 MET CE :methyl 165:sc= -0.0901 (180deg=-0.448) USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 ASN : amide:sc= 0 X(o=0,f=-0.22) USER MOD Single : A 98 GLN : amide:sc= 1.1 K(o=1.1,f=-0.27) USER MOD Single : A 103 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.109) USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 108 TYR OH : rot 30:sc= -0.242 USER MOD Single : A 109 HIS : no HD1:sc= -0.0488 K(o=-0.049,f=-0.85) USER MOD Single : A 110 SER OG : rot 180:sc= 0.0381 USER MOD Single : A 111 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 115 ASN : amide:sc= -0.198 X(o=-0.2,f=-0.021) USER MOD Single : A 116 SER OG : rot -56:sc= 1.19 USER MOD Single : A 131 SER OG : rot -149:sc= -0.564 USER MOD Single : A 132 SER OG : rot -176:sc= 0.394 USER MOD Single : A 136 CYS SG : rot 180:sc= 0 USER MOD Single : A 141 THR OG1 : rot 140:sc= 0 USER MOD Single : A 142 GLN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : A 146 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 148 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 149 THR OG1 : rot -120:sc= 0.169 USER MOD Single : A 150 THR OG1 : rot -174:sc= -0.357 USER MOD Single : A 155 THR OG1 : rot 180:sc=0.000573 USER MOD Single : A 156 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -14.982 -3.223 8.519 1.00 0.00 N ATOM 2 CA MET A 1 -14.950 -2.211 9.588 1.00 0.00 C ATOM 3 C MET A 1 -14.223 -0.962 9.092 1.00 0.00 C ATOM 4 O MET A 1 -13.579 -1.023 8.047 1.00 0.00 O ATOM 5 CB MET A 1 -14.380 -2.796 10.895 1.00 0.00 C ATOM 6 CG MET A 1 -12.878 -3.126 10.914 1.00 0.00 C ATOM 7 SD MET A 1 -11.705 -1.731 10.960 1.00 0.00 S ATOM 8 CE MET A 1 -12.014 -1.088 12.630 1.00 0.00 C ATOM 0 H1 MET A 1 -15.681 -3.956 8.756 1.00 0.00 H new ATOM 0 H2 MET A 1 -15.246 -2.771 7.620 1.00 0.00 H new ATOM 0 H3 MET A 1 -14.042 -3.658 8.425 1.00 0.00 H new ATOM 0 HA MET A 1 -15.965 -1.904 9.838 1.00 0.00 H new ATOM 0 HB2 MET A 1 -14.582 -2.089 11.699 1.00 0.00 H new ATOM 0 HB3 MET A 1 -14.930 -3.708 11.127 1.00 0.00 H new ATOM 0 HG2 MET A 1 -12.684 -3.756 11.782 1.00 0.00 H new ATOM 0 HG3 MET A 1 -12.655 -3.723 10.030 1.00 0.00 H new ATOM 0 HE1 MET A 1 -11.358 -0.239 12.820 1.00 0.00 H new ATOM 0 HE2 MET A 1 -13.053 -0.769 12.711 1.00 0.00 H new ATOM 0 HE3 MET A 1 -11.817 -1.870 13.363 1.00 0.00 H new ATOM 18 N GLU A 2 -14.316 0.161 9.806 1.00 0.00 N ATOM 19 CA GLU A 2 -13.673 1.441 9.484 1.00 0.00 C ATOM 20 C GLU A 2 -12.990 1.994 10.735 1.00 0.00 C ATOM 21 O GLU A 2 -13.293 1.590 11.856 1.00 0.00 O ATOM 22 CB GLU A 2 -14.719 2.478 9.057 1.00 0.00 C ATOM 23 CG GLU A 2 -15.304 2.294 7.655 1.00 0.00 C ATOM 24 CD GLU A 2 -16.829 2.360 7.701 1.00 0.00 C ATOM 25 OE1 GLU A 2 -17.376 3.334 8.274 1.00 0.00 O ATOM 26 OE2 GLU A 2 -17.453 1.370 7.255 1.00 0.00 O ATOM 0 H GLU A 2 -14.866 0.208 10.664 1.00 0.00 H new ATOM 0 HA GLU A 2 -12.959 1.265 8.679 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -15.537 2.459 9.777 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -14.266 3.468 9.115 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -14.920 3.067 6.990 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -14.987 1.335 7.245 1.00 0.00 H new ATOM 33 N LYS A 3 -12.118 2.990 10.561 1.00 0.00 N ATOM 34 CA LYS A 3 -11.375 3.648 11.641 1.00 0.00 C ATOM 35 C LYS A 3 -12.233 4.626 12.474 1.00 0.00 C ATOM 36 O LYS A 3 -11.700 5.620 12.963 1.00 0.00 O ATOM 37 CB LYS A 3 -10.145 4.347 11.023 1.00 0.00 C ATOM 38 CG LYS A 3 -8.904 4.290 11.913 1.00 0.00 C ATOM 39 CD LYS A 3 -8.226 2.916 11.828 1.00 0.00 C ATOM 40 CE LYS A 3 -6.811 2.927 12.404 1.00 0.00 C ATOM 41 NZ LYS A 3 -5.880 3.785 11.639 1.00 0.00 N ATOM 0 H LYS A 3 -11.903 3.372 9.640 1.00 0.00 H new ATOM 0 HA LYS A 3 -11.058 2.887 12.354 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -9.917 3.883 10.064 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -10.392 5.390 10.822 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -8.200 5.066 11.611 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -9.184 4.498 12.946 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -8.828 2.183 12.365 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -8.189 2.596 10.787 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -6.848 3.272 13.437 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -6.425 1.908 12.422 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -4.900 3.550 11.897 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -6.018 3.625 10.621 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -6.067 4.784 11.861 1.00 0.00 H new ATOM 55 N ALA A 4 -13.542 4.387 12.600 1.00 0.00 N ATOM 56 CA ALA A 4 -14.512 5.207 13.332 1.00 0.00 C ATOM 57 C ALA A 4 -14.494 6.688 12.917 1.00 0.00 C ATOM 58 O ALA A 4 -14.568 7.604 13.743 1.00 0.00 O ATOM 59 CB ALA A 4 -14.388 4.975 14.843 1.00 0.00 C ATOM 0 H ALA A 4 -13.977 3.571 12.170 1.00 0.00 H new ATOM 0 HA ALA A 4 -15.510 4.873 13.046 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -15.117 5.593 15.367 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -14.576 3.925 15.066 1.00 0.00 H new ATOM 0 HB3 ALA A 4 -13.383 5.242 15.171 1.00 0.00 H new ATOM 65 N LEU A 5 -14.360 6.910 11.609 1.00 0.00 N ATOM 66 CA LEU A 5 -14.341 8.216 10.971 1.00 0.00 C ATOM 67 C LEU A 5 -15.695 8.441 10.285 1.00 0.00 C ATOM 68 O LEU A 5 -16.646 7.698 10.535 1.00 0.00 O ATOM 69 CB LEU A 5 -13.113 8.383 10.056 1.00 0.00 C ATOM 70 CG LEU A 5 -13.114 7.537 8.764 1.00 0.00 C ATOM 71 CD1 LEU A 5 -12.267 8.244 7.696 1.00 0.00 C ATOM 72 CD2 LEU A 5 -12.505 6.154 8.987 1.00 0.00 C ATOM 0 H LEU A 5 -14.258 6.147 10.940 1.00 0.00 H new ATOM 0 HA LEU A 5 -14.220 9.007 11.711 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -13.031 9.434 9.779 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -12.220 8.134 10.630 1.00 0.00 H new ATOM 0 HG LEU A 5 -14.152 7.425 8.451 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -12.265 7.650 6.782 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -12.689 9.227 7.489 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -11.245 8.357 8.058 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -12.526 5.592 8.053 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -11.474 6.261 9.324 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -13.080 5.621 9.744 1.00 0.00 H new ATOM 84 N LYS A 6 -15.799 9.498 9.478 1.00 0.00 N ATOM 85 CA LYS A 6 -17.015 9.878 8.741 1.00 0.00 C ATOM 86 C LYS A 6 -16.711 10.753 7.531 1.00 0.00 C ATOM 87 O LYS A 6 -17.342 10.651 6.481 1.00 0.00 O ATOM 88 CB LYS A 6 -17.987 10.575 9.719 1.00 0.00 C ATOM 89 CG LYS A 6 -17.421 11.848 10.386 1.00 0.00 C ATOM 90 CD LYS A 6 -18.314 12.407 11.496 1.00 0.00 C ATOM 91 CE LYS A 6 -18.569 11.385 12.616 1.00 0.00 C ATOM 92 NZ LYS A 6 -19.321 11.977 13.742 1.00 0.00 N ATOM 0 H LYS A 6 -15.020 10.135 9.311 1.00 0.00 H new ATOM 0 HA LYS A 6 -17.481 8.977 8.342 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -18.898 10.836 9.181 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -18.269 9.867 10.498 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -16.438 11.625 10.800 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -17.279 12.615 9.624 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -17.848 13.297 11.919 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -19.267 12.719 11.069 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -19.124 10.537 12.214 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -17.616 10.999 12.979 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -19.472 11.256 14.476 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -18.780 12.770 14.142 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -20.241 12.323 13.402 1.00 0.00 H new ATOM 106 N ILE A 7 -15.699 11.590 7.715 1.00 0.00 N ATOM 107 CA ILE A 7 -15.138 12.545 6.787 1.00 0.00 C ATOM 108 C ILE A 7 -14.584 11.896 5.512 1.00 0.00 C ATOM 109 O ILE A 7 -14.661 12.509 4.447 1.00 0.00 O ATOM 110 CB ILE A 7 -14.030 13.320 7.538 1.00 0.00 C ATOM 111 CG1 ILE A 7 -13.093 12.478 8.469 1.00 0.00 C ATOM 112 CG2 ILE A 7 -14.674 14.446 8.369 1.00 0.00 C ATOM 113 CD1 ILE A 7 -11.674 12.299 7.955 1.00 0.00 C ATOM 0 H ILE A 7 -15.207 11.614 8.608 1.00 0.00 H new ATOM 0 HA ILE A 7 -15.929 13.214 6.447 1.00 0.00 H new ATOM 0 HB ILE A 7 -13.377 13.694 6.749 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -13.052 12.957 9.447 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -13.538 11.494 8.614 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -13.897 14.996 8.901 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -15.211 15.125 7.707 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -15.370 14.015 9.088 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -11.102 11.703 8.666 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -11.698 11.790 6.992 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -11.204 13.275 7.838 1.00 0.00 H new ATOM 125 N ASP A 8 -13.986 10.705 5.625 1.00 0.00 N ATOM 126 CA ASP A 8 -13.387 9.912 4.542 1.00 0.00 C ATOM 127 C ASP A 8 -12.453 10.717 3.625 1.00 0.00 C ATOM 128 O ASP A 8 -12.331 10.413 2.436 1.00 0.00 O ATOM 129 CB ASP A 8 -14.485 9.155 3.767 1.00 0.00 C ATOM 130 CG ASP A 8 -15.319 8.222 4.650 1.00 0.00 C ATOM 131 OD1 ASP A 8 -16.492 7.968 4.287 1.00 0.00 O ATOM 132 OD2 ASP A 8 -14.813 7.747 5.694 1.00 0.00 O ATOM 0 H ASP A 8 -13.901 10.240 6.529 1.00 0.00 H new ATOM 0 HA ASP A 8 -12.730 9.177 5.007 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -15.146 9.878 3.289 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -14.021 8.572 2.971 1.00 0.00 H new ATOM 137 N THR A 9 -11.843 11.798 4.126 1.00 0.00 N ATOM 138 CA THR A 9 -10.951 12.637 3.342 1.00 0.00 C ATOM 139 C THR A 9 -9.672 11.861 3.020 1.00 0.00 C ATOM 140 O THR A 9 -9.289 10.965 3.778 1.00 0.00 O ATOM 141 CB THR A 9 -10.668 13.967 4.076 1.00 0.00 C ATOM 142 OG1 THR A 9 -10.617 13.816 5.479 1.00 0.00 O ATOM 143 CG2 THR A 9 -11.802 14.958 3.792 1.00 0.00 C ATOM 0 H THR A 9 -11.960 12.110 5.090 1.00 0.00 H new ATOM 0 HA THR A 9 -11.427 12.900 2.397 1.00 0.00 H new ATOM 0 HB THR A 9 -9.702 14.317 3.713 1.00 0.00 H new ATOM 0 HG1 THR A 9 -10.434 14.684 5.895 1.00 0.00 H new ATOM 0 HG21 THR A 9 -11.603 15.897 4.309 1.00 0.00 H new ATOM 0 HG22 THR A 9 -11.865 15.141 2.719 1.00 0.00 H new ATOM 0 HG23 THR A 9 -12.746 14.542 4.145 1.00 0.00 H new ATOM 151 N PRO A 10 -9.006 12.179 1.900 1.00 0.00 N ATOM 152 CA PRO A 10 -7.783 11.498 1.517 1.00 0.00 C ATOM 153 C PRO A 10 -6.671 11.953 2.465 1.00 0.00 C ATOM 154 O PRO A 10 -6.510 13.158 2.687 1.00 0.00 O ATOM 155 CB PRO A 10 -7.554 11.942 0.069 1.00 0.00 C ATOM 156 CG PRO A 10 -8.126 13.360 0.028 1.00 0.00 C ATOM 157 CD PRO A 10 -9.347 13.221 0.934 1.00 0.00 C ATOM 0 HA PRO A 10 -7.817 10.410 1.581 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -6.495 11.930 -0.191 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -8.063 11.285 -0.636 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -7.418 14.099 0.404 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -8.398 13.664 -0.983 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -9.571 14.162 1.436 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -10.232 12.948 0.359 1.00 0.00 H new ATOM 165 N GLN A 11 -5.925 11.026 3.064 1.00 0.00 N ATOM 166 CA GLN A 11 -4.837 11.370 3.975 1.00 0.00 C ATOM 167 C GLN A 11 -3.529 11.034 3.287 1.00 0.00 C ATOM 168 O GLN A 11 -3.289 9.871 2.968 1.00 0.00 O ATOM 169 CB GLN A 11 -4.989 10.741 5.368 1.00 0.00 C ATOM 170 CG GLN A 11 -5.443 9.271 5.429 1.00 0.00 C ATOM 171 CD GLN A 11 -6.950 9.102 5.568 1.00 0.00 C ATOM 172 OE1 GLN A 11 -7.604 8.543 4.702 1.00 0.00 O ATOM 173 NE2 GLN A 11 -7.536 9.516 6.680 1.00 0.00 N ATOM 0 H GLN A 11 -6.057 10.023 2.932 1.00 0.00 H new ATOM 0 HA GLN A 11 -4.860 12.439 4.186 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -4.031 10.820 5.881 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -5.704 11.339 5.933 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -5.111 8.759 4.526 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -4.952 8.783 6.271 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -6.987 9.983 7.402 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -8.536 9.368 6.815 1.00 0.00 H new ATOM 182 N GLN A 12 -2.711 12.048 2.999 1.00 0.00 N ATOM 183 CA GLN A 12 -1.434 11.868 2.331 1.00 0.00 C ATOM 184 C GLN A 12 -0.271 12.199 3.278 1.00 0.00 C ATOM 185 O GLN A 12 -0.297 13.220 3.961 1.00 0.00 O ATOM 186 CB GLN A 12 -1.351 12.695 1.034 1.00 0.00 C ATOM 187 CG GLN A 12 -1.609 14.204 1.214 1.00 0.00 C ATOM 188 CD GLN A 12 -0.583 15.111 0.532 1.00 0.00 C ATOM 189 OE1 GLN A 12 -0.057 14.821 -0.544 1.00 0.00 O ATOM 190 NE2 GLN A 12 -0.284 16.238 1.153 1.00 0.00 N ATOM 0 H GLN A 12 -2.923 13.020 3.226 1.00 0.00 H new ATOM 0 HA GLN A 12 -1.352 10.818 2.050 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -0.362 12.559 0.595 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -2.074 12.299 0.320 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -2.599 14.439 0.823 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -1.625 14.432 2.280 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -0.728 16.463 2.043 1.00 0.00 H new ATOM 0 HE22 GLN A 12 0.391 16.883 0.742 1.00 0.00 H new ATOM 199 N GLY A 13 0.775 11.380 3.311 1.00 0.00 N ATOM 200 CA GLY A 13 1.948 11.594 4.153 1.00 0.00 C ATOM 201 C GLY A 13 3.064 10.656 3.735 1.00 0.00 C ATOM 202 O GLY A 13 3.381 10.633 2.548 1.00 0.00 O ATOM 0 H GLY A 13 0.833 10.534 2.744 1.00 0.00 H new ATOM 0 HA2 GLY A 13 2.281 12.629 4.071 1.00 0.00 H new ATOM 0 HA3 GLY A 13 1.691 11.424 5.199 1.00 0.00 H new ATOM 206 N SER A 14 3.641 9.854 4.633 1.00 0.00 N ATOM 207 CA SER A 14 4.728 8.961 4.266 1.00 0.00 C ATOM 208 C SER A 14 4.868 7.779 5.222 1.00 0.00 C ATOM 209 O SER A 14 4.010 7.537 6.064 1.00 0.00 O ATOM 210 CB SER A 14 6.012 9.797 4.161 1.00 0.00 C ATOM 211 OG SER A 14 6.234 10.583 5.313 1.00 0.00 O ATOM 0 H SER A 14 3.370 9.809 5.615 1.00 0.00 H new ATOM 0 HA SER A 14 4.513 8.503 3.300 1.00 0.00 H new ATOM 0 HB2 SER A 14 6.863 9.134 4.006 1.00 0.00 H new ATOM 0 HB3 SER A 14 5.950 10.446 3.287 1.00 0.00 H new ATOM 0 HG SER A 14 7.061 11.097 5.204 1.00 0.00 H new ATOM 217 N ILE A 15 5.921 6.987 5.020 1.00 0.00 N ATOM 218 CA ILE A 15 6.282 5.814 5.823 1.00 0.00 C ATOM 219 C ILE A 15 7.812 5.769 5.957 1.00 0.00 C ATOM 220 O ILE A 15 8.327 5.140 6.870 1.00 0.00 O ATOM 221 CB ILE A 15 5.806 4.474 5.204 1.00 0.00 C ATOM 222 CG1 ILE A 15 4.400 4.508 4.599 1.00 0.00 C ATOM 223 CG2 ILE A 15 5.929 3.318 6.219 1.00 0.00 C ATOM 224 CD1 ILE A 15 3.995 3.171 3.958 1.00 0.00 C ATOM 0 H ILE A 15 6.577 7.152 4.257 1.00 0.00 H new ATOM 0 HA ILE A 15 5.785 5.919 6.787 1.00 0.00 H new ATOM 0 HB ILE A 15 6.480 4.300 4.365 1.00 0.00 H new ATOM 0 HG12 ILE A 15 3.681 4.765 5.377 1.00 0.00 H new ATOM 0 HG13 ILE A 15 4.352 5.296 3.847 1.00 0.00 H new ATOM 0 HG21 ILE A 15 5.588 2.391 5.758 1.00 0.00 H new ATOM 0 HG22 ILE A 15 6.970 3.211 6.524 1.00 0.00 H new ATOM 0 HG23 ILE A 15 5.316 3.535 7.094 1.00 0.00 H new ATOM 0 HD11 ILE A 15 2.989 3.255 3.546 1.00 0.00 H new ATOM 0 HD12 ILE A 15 4.695 2.923 3.160 1.00 0.00 H new ATOM 0 HD13 ILE A 15 4.013 2.385 4.713 1.00 0.00 H new ATOM 236 N GLN A 16 8.558 6.463 5.086 1.00 0.00 N ATOM 237 CA GLN A 16 10.013 6.469 5.096 1.00 0.00 C ATOM 238 C GLN A 16 10.611 6.697 6.484 1.00 0.00 C ATOM 239 O GLN A 16 11.552 6.000 6.854 1.00 0.00 O ATOM 240 CB GLN A 16 10.528 7.469 4.050 1.00 0.00 C ATOM 241 CG GLN A 16 10.292 8.956 4.369 1.00 0.00 C ATOM 242 CD GLN A 16 10.066 9.823 3.134 1.00 0.00 C ATOM 243 OE1 GLN A 16 8.956 10.255 2.848 1.00 0.00 O ATOM 244 NE2 GLN A 16 11.092 10.110 2.355 1.00 0.00 N ATOM 0 H GLN A 16 8.155 7.041 4.348 1.00 0.00 H new ATOM 0 HA GLN A 16 10.356 5.472 4.820 1.00 0.00 H new ATOM 0 HB2 GLN A 16 11.599 7.311 3.920 1.00 0.00 H new ATOM 0 HB3 GLN A 16 10.054 7.243 3.095 1.00 0.00 H new ATOM 0 HG2 GLN A 16 9.427 9.044 5.026 1.00 0.00 H new ATOM 0 HG3 GLN A 16 11.151 9.341 4.919 1.00 0.00 H new ATOM 0 HE21 GLN A 16 12.021 9.756 2.584 1.00 0.00 H new ATOM 0 HE22 GLN A 16 10.956 10.686 1.524 1.00 0.00 H new ATOM 253 N ASP A 17 10.010 7.595 7.265 1.00 0.00 N ATOM 254 CA ASP A 17 10.406 7.986 8.615 1.00 0.00 C ATOM 255 C ASP A 17 10.615 6.821 9.588 1.00 0.00 C ATOM 256 O ASP A 17 11.529 6.880 10.410 1.00 0.00 O ATOM 257 CB ASP A 17 9.351 8.957 9.147 1.00 0.00 C ATOM 258 CG ASP A 17 9.920 9.825 10.260 1.00 0.00 C ATOM 259 OD1 ASP A 17 9.462 9.645 11.413 1.00 0.00 O ATOM 260 OD2 ASP A 17 10.743 10.715 9.954 1.00 0.00 O ATOM 0 H ASP A 17 9.181 8.100 6.950 1.00 0.00 H new ATOM 0 HA ASP A 17 11.388 8.454 8.546 1.00 0.00 H new ATOM 0 HB2 ASP A 17 8.992 9.590 8.335 1.00 0.00 H new ATOM 0 HB3 ASP A 17 8.492 8.398 9.520 1.00 0.00 H new ATOM 265 N ILE A 18 9.835 5.741 9.439 1.00 0.00 N ATOM 266 CA ILE A 18 9.857 4.517 10.242 1.00 0.00 C ATOM 267 C ILE A 18 11.294 4.078 10.536 1.00 0.00 C ATOM 268 O ILE A 18 11.680 3.843 11.681 1.00 0.00 O ATOM 269 CB ILE A 18 9.063 3.428 9.471 1.00 0.00 C ATOM 270 CG1 ILE A 18 7.535 3.709 9.430 1.00 0.00 C ATOM 271 CG2 ILE A 18 9.298 2.012 9.993 1.00 0.00 C ATOM 272 CD1 ILE A 18 6.740 3.487 10.718 1.00 0.00 C ATOM 0 H ILE A 18 9.127 5.700 8.706 1.00 0.00 H new ATOM 0 HA ILE A 18 9.389 4.690 11.211 1.00 0.00 H new ATOM 0 HB ILE A 18 9.460 3.484 8.457 1.00 0.00 H new ATOM 0 HG12 ILE A 18 7.392 4.744 9.121 1.00 0.00 H new ATOM 0 HG13 ILE A 18 7.099 3.081 8.653 1.00 0.00 H new ATOM 0 HG21 ILE A 18 8.711 1.306 9.406 1.00 0.00 H new ATOM 0 HG22 ILE A 18 10.356 1.764 9.907 1.00 0.00 H new ATOM 0 HG23 ILE A 18 8.995 1.955 11.039 1.00 0.00 H new ATOM 0 HD11 ILE A 18 5.690 3.722 10.543 1.00 0.00 H new ATOM 0 HD12 ILE A 18 6.832 2.446 11.028 1.00 0.00 H new ATOM 0 HD13 ILE A 18 7.130 4.135 11.503 1.00 0.00 H new ATOM 284 N ASN A 19 12.087 3.901 9.479 1.00 0.00 N ATOM 285 CA ASN A 19 13.479 3.482 9.611 1.00 0.00 C ATOM 286 C ASN A 19 14.342 4.240 8.593 1.00 0.00 C ATOM 287 O ASN A 19 15.393 3.754 8.170 1.00 0.00 O ATOM 288 CB ASN A 19 13.599 1.935 9.559 1.00 0.00 C ATOM 289 CG ASN A 19 14.861 1.385 10.234 1.00 0.00 C ATOM 290 OD1 ASN A 19 14.984 0.197 10.479 1.00 0.00 O ATOM 291 ND2 ASN A 19 15.880 2.174 10.502 1.00 0.00 N ATOM 0 H ASN A 19 11.784 4.043 8.515 1.00 0.00 H new ATOM 0 HA ASN A 19 13.870 3.751 10.592 1.00 0.00 H new ATOM 0 HB2 ASN A 19 12.723 1.497 10.037 1.00 0.00 H new ATOM 0 HB3 ASN A 19 13.587 1.615 8.517 1.00 0.00 H new ATOM 0 HD21 ASN A 19 16.735 1.786 10.901 1.00 0.00 H new ATOM 0 HD22 ASN A 19 15.815 3.174 10.311 1.00 0.00 H new ATOM 298 N HIS A 20 13.902 5.436 8.192 1.00 0.00 N ATOM 299 CA HIS A 20 14.537 6.340 7.226 1.00 0.00 C ATOM 300 C HIS A 20 14.694 5.719 5.821 1.00 0.00 C ATOM 301 O HIS A 20 15.619 6.039 5.072 1.00 0.00 O ATOM 302 CB HIS A 20 15.841 6.867 7.833 1.00 0.00 C ATOM 303 CG HIS A 20 15.649 7.536 9.169 1.00 0.00 C ATOM 304 ND1 HIS A 20 16.225 7.145 10.361 1.00 0.00 N ATOM 305 CD2 HIS A 20 14.885 8.649 9.406 1.00 0.00 C ATOM 306 CE1 HIS A 20 15.822 8.016 11.302 1.00 0.00 C ATOM 307 NE2 HIS A 20 15.037 8.961 10.757 1.00 0.00 N ATOM 0 H HIS A 20 13.033 5.826 8.558 1.00 0.00 H new ATOM 0 HA HIS A 20 13.880 7.191 7.044 1.00 0.00 H new ATOM 0 HB2 HIS A 20 16.541 6.039 7.946 1.00 0.00 H new ATOM 0 HB3 HIS A 20 16.295 7.576 7.141 1.00 0.00 H new ATOM 0 HD2 HIS A 20 14.282 9.182 8.686 1.00 0.00 H new ATOM 0 HE1 HIS A 20 16.091 7.964 12.347 1.00 0.00 H new ATOM 0 HE2 HIS A 20 14.628 9.759 11.242 1.00 0.00 H new ATOM 315 N ARG A 21 13.844 4.746 5.489 1.00 0.00 N ATOM 316 CA ARG A 21 13.814 3.994 4.234 1.00 0.00 C ATOM 317 C ARG A 21 13.029 4.826 3.218 1.00 0.00 C ATOM 318 O ARG A 21 11.824 4.676 3.102 1.00 0.00 O ATOM 319 CB ARG A 21 13.172 2.599 4.496 1.00 0.00 C ATOM 320 CG ARG A 21 13.713 1.845 5.715 1.00 0.00 C ATOM 321 CD ARG A 21 15.074 1.190 5.468 1.00 0.00 C ATOM 322 NE ARG A 21 15.583 0.510 6.677 1.00 0.00 N ATOM 323 CZ ARG A 21 16.838 0.440 7.137 1.00 0.00 C ATOM 324 NH1 ARG A 21 17.872 0.813 6.390 1.00 0.00 N ATOM 325 NH2 ARG A 21 17.047 -0.027 8.360 1.00 0.00 N ATOM 0 H ARG A 21 13.111 4.443 6.131 1.00 0.00 H new ATOM 0 HA ARG A 21 14.812 3.815 3.835 1.00 0.00 H new ATOM 0 HB2 ARG A 21 12.097 2.730 4.619 1.00 0.00 H new ATOM 0 HB3 ARG A 21 13.319 1.979 3.612 1.00 0.00 H new ATOM 0 HG2 ARG A 21 13.797 2.537 6.553 1.00 0.00 H new ATOM 0 HG3 ARG A 21 12.996 1.078 6.006 1.00 0.00 H new ATOM 0 HD2 ARG A 21 14.988 0.470 4.655 1.00 0.00 H new ATOM 0 HD3 ARG A 21 15.790 1.948 5.149 1.00 0.00 H new ATOM 0 HE ARG A 21 14.881 0.027 7.238 1.00 0.00 H new ATOM 0 HH11 ARG A 21 17.718 1.162 5.444 1.00 0.00 H new ATOM 0 HH12 ARG A 21 18.819 0.750 6.763 1.00 0.00 H new ATOM 0 HH21 ARG A 21 16.258 -0.326 8.934 1.00 0.00 H new ATOM 0 HH22 ARG A 21 17.997 -0.088 8.727 1.00 0.00 H new ATOM 339 N VAL A 22 13.667 5.766 2.525 1.00 0.00 N ATOM 340 CA VAL A 22 12.968 6.591 1.541 1.00 0.00 C ATOM 341 C VAL A 22 12.592 5.714 0.351 1.00 0.00 C ATOM 342 O VAL A 22 13.411 4.916 -0.094 1.00 0.00 O ATOM 343 CB VAL A 22 13.813 7.817 1.177 1.00 0.00 C ATOM 344 CG1 VAL A 22 13.092 8.646 0.113 1.00 0.00 C ATOM 345 CG2 VAL A 22 14.134 8.644 2.433 1.00 0.00 C ATOM 0 H VAL A 22 14.660 5.975 2.625 1.00 0.00 H new ATOM 0 HA VAL A 22 12.041 6.993 1.949 1.00 0.00 H new ATOM 0 HB VAL A 22 14.764 7.490 0.758 1.00 0.00 H new ATOM 0 HG11 VAL A 22 13.697 9.516 -0.142 1.00 0.00 H new ATOM 0 HG12 VAL A 22 12.937 8.038 -0.778 1.00 0.00 H new ATOM 0 HG13 VAL A 22 12.128 8.975 0.500 1.00 0.00 H new ATOM 0 HG21 VAL A 22 14.734 9.510 2.155 1.00 0.00 H new ATOM 0 HG22 VAL A 22 13.205 8.979 2.895 1.00 0.00 H new ATOM 0 HG23 VAL A 22 14.690 8.029 3.141 1.00 0.00 H new ATOM 355 N TRP A 23 11.372 5.860 -0.161 1.00 0.00 N ATOM 356 CA TRP A 23 10.846 5.094 -1.280 1.00 0.00 C ATOM 357 C TRP A 23 11.015 5.837 -2.601 1.00 0.00 C ATOM 358 O TRP A 23 10.690 7.018 -2.660 1.00 0.00 O ATOM 359 CB TRP A 23 9.341 4.882 -1.049 1.00 0.00 C ATOM 360 CG TRP A 23 8.903 4.630 0.354 1.00 0.00 C ATOM 361 CD1 TRP A 23 7.969 5.347 1.017 1.00 0.00 C ATOM 362 CD2 TRP A 23 9.377 3.615 1.285 1.00 0.00 C ATOM 363 NE1 TRP A 23 7.826 4.835 2.285 1.00 0.00 N ATOM 364 CE2 TRP A 23 8.701 3.799 2.526 1.00 0.00 C ATOM 365 CE3 TRP A 23 10.307 2.559 1.199 1.00 0.00 C ATOM 366 CZ2 TRP A 23 8.942 2.978 3.637 1.00 0.00 C ATOM 367 CZ3 TRP A 23 10.551 1.731 2.306 1.00 0.00 C ATOM 368 CH2 TRP A 23 9.875 1.943 3.516 1.00 0.00 C ATOM 0 H TRP A 23 10.704 6.538 0.206 1.00 0.00 H new ATOM 0 HA TRP A 23 11.391 4.152 -1.337 1.00 0.00 H new ATOM 0 HB2 TRP A 23 8.814 5.763 -1.416 1.00 0.00 H new ATOM 0 HB3 TRP A 23 9.019 4.040 -1.661 1.00 0.00 H new ATOM 0 HD1 TRP A 23 7.422 6.187 0.615 1.00 0.00 H new ATOM 0 HE1 TRP A 23 7.151 5.182 2.967 1.00 0.00 H new ATOM 0 HE3 TRP A 23 10.836 2.386 0.274 1.00 0.00 H new ATOM 0 HZ2 TRP A 23 8.418 3.142 4.567 1.00 0.00 H new ATOM 0 HZ3 TRP A 23 11.265 0.925 2.225 1.00 0.00 H new ATOM 0 HH2 TRP A 23 10.076 1.302 4.361 1.00 0.00 H new ATOM 379 N VAL A 24 11.467 5.177 -3.671 1.00 0.00 N ATOM 380 CA VAL A 24 11.626 5.821 -4.978 1.00 0.00 C ATOM 381 C VAL A 24 11.213 4.803 -6.034 1.00 0.00 C ATOM 382 O VAL A 24 11.596 3.632 -5.940 1.00 0.00 O ATOM 383 CB VAL A 24 13.086 6.274 -5.207 1.00 0.00 C ATOM 384 CG1 VAL A 24 13.291 6.950 -6.569 1.00 0.00 C ATOM 385 CG2 VAL A 24 13.507 7.329 -4.179 1.00 0.00 C ATOM 0 H VAL A 24 11.731 4.192 -3.657 1.00 0.00 H new ATOM 0 HA VAL A 24 11.005 6.715 -5.034 1.00 0.00 H new ATOM 0 HB VAL A 24 13.673 5.359 -5.132 1.00 0.00 H new ATOM 0 HG11 VAL A 24 14.334 7.247 -6.674 1.00 0.00 H new ATOM 0 HG12 VAL A 24 13.030 6.252 -7.365 1.00 0.00 H new ATOM 0 HG13 VAL A 24 12.654 7.832 -6.637 1.00 0.00 H new ATOM 0 HG21 VAL A 24 14.538 7.628 -4.366 1.00 0.00 H new ATOM 0 HG22 VAL A 24 12.856 8.199 -4.263 1.00 0.00 H new ATOM 0 HG23 VAL A 24 13.426 6.912 -3.175 1.00 0.00 H new ATOM 395 N LEU A 25 10.359 5.219 -6.977 1.00 0.00 N ATOM 396 CA LEU A 25 9.891 4.367 -8.066 1.00 0.00 C ATOM 397 C LEU A 25 11.067 4.281 -9.056 1.00 0.00 C ATOM 398 O LEU A 25 11.234 5.199 -9.863 1.00 0.00 O ATOM 399 CB LEU A 25 8.639 4.963 -8.735 1.00 0.00 C ATOM 400 CG LEU A 25 8.249 4.260 -10.063 1.00 0.00 C ATOM 401 CD1 LEU A 25 6.916 3.532 -10.017 1.00 0.00 C ATOM 402 CD2 LEU A 25 8.239 5.259 -11.226 1.00 0.00 C ATOM 0 H LEU A 25 9.973 6.163 -7.002 1.00 0.00 H new ATOM 0 HA LEU A 25 9.598 3.380 -7.708 1.00 0.00 H new ATOM 0 HB2 LEU A 25 7.801 4.899 -8.041 1.00 0.00 H new ATOM 0 HB3 LEU A 25 8.811 6.021 -8.931 1.00 0.00 H new ATOM 0 HG LEU A 25 9.016 3.501 -10.217 1.00 0.00 H new ATOM 0 HD11 LEU A 25 6.720 3.069 -10.984 1.00 0.00 H new ATOM 0 HD12 LEU A 25 6.948 2.762 -9.246 1.00 0.00 H new ATOM 0 HD13 LEU A 25 6.121 4.242 -9.787 1.00 0.00 H new ATOM 0 HD21 LEU A 25 7.963 4.744 -12.146 1.00 0.00 H new ATOM 0 HD22 LEU A 25 7.516 6.048 -11.021 1.00 0.00 H new ATOM 0 HD23 LEU A 25 9.231 5.696 -11.339 1.00 0.00 H new ATOM 414 N GLN A 26 11.910 3.256 -8.987 1.00 0.00 N ATOM 415 CA GLN A 26 13.059 3.077 -9.866 1.00 0.00 C ATOM 416 C GLN A 26 12.748 1.950 -10.846 1.00 0.00 C ATOM 417 O GLN A 26 12.510 0.821 -10.427 1.00 0.00 O ATOM 418 CB GLN A 26 14.321 2.756 -9.046 1.00 0.00 C ATOM 419 CG GLN A 26 15.521 3.613 -9.454 1.00 0.00 C ATOM 420 CD GLN A 26 15.533 4.941 -8.712 1.00 0.00 C ATOM 421 OE1 GLN A 26 15.835 4.956 -7.522 1.00 0.00 O ATOM 422 NE2 GLN A 26 15.225 6.039 -9.381 1.00 0.00 N ATOM 0 H GLN A 26 11.810 2.508 -8.301 1.00 0.00 H new ATOM 0 HA GLN A 26 13.251 3.998 -10.417 1.00 0.00 H new ATOM 0 HB2 GLN A 26 14.111 2.911 -7.988 1.00 0.00 H new ATOM 0 HB3 GLN A 26 14.572 1.703 -9.170 1.00 0.00 H new ATOM 0 HG2 GLN A 26 16.444 3.071 -9.248 1.00 0.00 H new ATOM 0 HG3 GLN A 26 15.491 3.795 -10.528 1.00 0.00 H new ATOM 0 HE21 GLN A 26 14.980 5.982 -10.369 1.00 0.00 H new ATOM 0 HE22 GLN A 26 15.233 6.943 -8.909 1.00 0.00 H new ATOM 431 N ASP A 27 12.760 2.249 -12.146 1.00 0.00 N ATOM 432 CA ASP A 27 12.480 1.305 -13.236 1.00 0.00 C ATOM 433 C ASP A 27 11.294 0.398 -12.905 1.00 0.00 C ATOM 434 O ASP A 27 11.433 -0.809 -12.677 1.00 0.00 O ATOM 435 CB ASP A 27 13.743 0.537 -13.627 1.00 0.00 C ATOM 436 CG ASP A 27 13.523 -0.380 -14.833 1.00 0.00 C ATOM 437 OD1 ASP A 27 12.814 0.011 -15.794 1.00 0.00 O ATOM 438 OD2 ASP A 27 14.114 -1.478 -14.845 1.00 0.00 O ATOM 0 H ASP A 27 12.972 3.188 -12.484 1.00 0.00 H new ATOM 0 HA ASP A 27 12.178 1.872 -14.116 1.00 0.00 H new ATOM 0 HB2 ASP A 27 14.539 1.246 -13.854 1.00 0.00 H new ATOM 0 HB3 ASP A 27 14.079 -0.059 -12.778 1.00 0.00 H new ATOM 443 N GLN A 28 10.117 1.032 -12.804 1.00 0.00 N ATOM 444 CA GLN A 28 8.830 0.401 -12.505 1.00 0.00 C ATOM 445 C GLN A 28 8.787 -0.389 -11.180 1.00 0.00 C ATOM 446 O GLN A 28 7.768 -1.027 -10.896 1.00 0.00 O ATOM 447 CB GLN A 28 8.440 -0.489 -13.707 1.00 0.00 C ATOM 448 CG GLN A 28 8.119 0.316 -14.979 1.00 0.00 C ATOM 449 CD GLN A 28 7.913 -0.623 -16.163 1.00 0.00 C ATOM 450 OE1 GLN A 28 7.233 -1.638 -16.039 1.00 0.00 O ATOM 451 NE2 GLN A 28 8.497 -0.325 -17.307 1.00 0.00 N ATOM 0 H GLN A 28 10.036 2.040 -12.934 1.00 0.00 H new ATOM 0 HA GLN A 28 8.103 1.199 -12.355 1.00 0.00 H new ATOM 0 HB2 GLN A 28 9.256 -1.180 -13.919 1.00 0.00 H new ATOM 0 HB3 GLN A 28 7.573 -1.092 -13.438 1.00 0.00 H new ATOM 0 HG2 GLN A 28 7.222 0.915 -14.821 1.00 0.00 H new ATOM 0 HG3 GLN A 28 8.932 1.009 -15.193 1.00 0.00 H new ATOM 0 HE21 GLN A 28 9.057 0.523 -17.388 1.00 0.00 H new ATOM 0 HE22 GLN A 28 8.388 -0.943 -18.111 1.00 0.00 H new ATOM 460 N THR A 29 9.812 -0.311 -10.329 1.00 0.00 N ATOM 461 CA THR A 29 9.915 -1.037 -9.070 1.00 0.00 C ATOM 462 C THR A 29 10.150 -0.062 -7.919 1.00 0.00 C ATOM 463 O THR A 29 10.984 0.833 -8.024 1.00 0.00 O ATOM 464 CB THR A 29 11.084 -2.040 -9.189 1.00 0.00 C ATOM 465 OG1 THR A 29 11.151 -2.629 -10.482 1.00 0.00 O ATOM 466 CG2 THR A 29 10.938 -3.165 -8.158 1.00 0.00 C ATOM 0 H THR A 29 10.622 0.283 -10.508 1.00 0.00 H new ATOM 0 HA THR A 29 8.989 -1.574 -8.864 1.00 0.00 H new ATOM 0 HB THR A 29 11.998 -1.474 -9.008 1.00 0.00 H new ATOM 0 HG1 THR A 29 11.403 -1.947 -11.139 1.00 0.00 H new ATOM 0 HG21 THR A 29 11.771 -3.861 -8.258 1.00 0.00 H new ATOM 0 HG22 THR A 29 10.938 -2.741 -7.154 1.00 0.00 H new ATOM 0 HG23 THR A 29 10.001 -3.695 -8.328 1.00 0.00 H new ATOM 474 N LEU A 30 9.419 -0.196 -6.816 1.00 0.00 N ATOM 475 CA LEU A 30 9.631 0.704 -5.694 1.00 0.00 C ATOM 476 C LEU A 30 10.800 0.166 -4.903 1.00 0.00 C ATOM 477 O LEU A 30 10.736 -0.964 -4.419 1.00 0.00 O ATOM 478 CB LEU A 30 8.377 0.836 -4.832 1.00 0.00 C ATOM 479 CG LEU A 30 7.533 2.054 -5.219 1.00 0.00 C ATOM 480 CD1 LEU A 30 6.228 2.019 -4.423 1.00 0.00 C ATOM 481 CD2 LEU A 30 8.223 3.385 -4.885 1.00 0.00 C ATOM 0 H LEU A 30 8.694 -0.900 -6.679 1.00 0.00 H new ATOM 0 HA LEU A 30 9.849 1.710 -6.052 1.00 0.00 H new ATOM 0 HB2 LEU A 30 7.774 -0.067 -4.930 1.00 0.00 H new ATOM 0 HB3 LEU A 30 8.666 0.915 -3.784 1.00 0.00 H new ATOM 0 HG LEU A 30 7.373 2.001 -6.296 1.00 0.00 H new ATOM 0 HD11 LEU A 30 5.617 2.881 -4.689 1.00 0.00 H new ATOM 0 HD12 LEU A 30 5.684 1.103 -4.655 1.00 0.00 H new ATOM 0 HD13 LEU A 30 6.451 2.047 -3.357 1.00 0.00 H new ATOM 0 HD21 LEU A 30 7.579 4.213 -5.181 1.00 0.00 H new ATOM 0 HD22 LEU A 30 8.412 3.438 -3.813 1.00 0.00 H new ATOM 0 HD23 LEU A 30 9.168 3.450 -5.424 1.00 0.00 H new ATOM 493 N ILE A 31 11.847 0.969 -4.725 1.00 0.00 N ATOM 494 CA ILE A 31 13.032 0.536 -3.989 1.00 0.00 C ATOM 495 C ILE A 31 13.332 1.526 -2.870 1.00 0.00 C ATOM 496 O ILE A 31 13.059 2.724 -3.000 1.00 0.00 O ATOM 497 CB ILE A 31 14.236 0.297 -4.938 1.00 0.00 C ATOM 498 CG1 ILE A 31 13.807 -0.010 -6.400 1.00 0.00 C ATOM 499 CG2 ILE A 31 15.134 -0.814 -4.359 1.00 0.00 C ATOM 500 CD1 ILE A 31 14.928 -0.357 -7.376 1.00 0.00 C ATOM 0 H ILE A 31 11.898 1.924 -5.081 1.00 0.00 H new ATOM 0 HA ILE A 31 12.835 -0.430 -3.524 1.00 0.00 H new ATOM 0 HB ILE A 31 14.806 1.225 -4.995 1.00 0.00 H new ATOM 0 HG12 ILE A 31 13.100 -0.840 -6.382 1.00 0.00 H new ATOM 0 HG13 ILE A 31 13.272 0.856 -6.788 1.00 0.00 H new ATOM 0 HG21 ILE A 31 15.980 -0.982 -5.025 1.00 0.00 H new ATOM 0 HG22 ILE A 31 15.500 -0.512 -3.378 1.00 0.00 H new ATOM 0 HG23 ILE A 31 14.558 -1.735 -4.264 1.00 0.00 H new ATOM 0 HD11 ILE A 31 14.505 -0.551 -8.362 1.00 0.00 H new ATOM 0 HD12 ILE A 31 15.627 0.477 -7.438 1.00 0.00 H new ATOM 0 HD13 ILE A 31 15.453 -1.246 -7.026 1.00 0.00 H new ATOM 512 N ALA A 32 13.815 1.008 -1.738 1.00 0.00 N ATOM 513 CA ALA A 32 14.167 1.811 -0.583 1.00 0.00 C ATOM 514 C ALA A 32 15.600 2.323 -0.767 1.00 0.00 C ATOM 515 O ALA A 32 16.512 1.546 -1.069 1.00 0.00 O ATOM 516 CB ALA A 32 14.036 0.969 0.683 1.00 0.00 C ATOM 0 H ALA A 32 13.971 0.009 -1.604 1.00 0.00 H new ATOM 0 HA ALA A 32 13.496 2.665 -0.487 1.00 0.00 H new ATOM 0 HB1 ALA A 32 14.301 1.573 1.551 1.00 0.00 H new ATOM 0 HB2 ALA A 32 13.008 0.620 0.783 1.00 0.00 H new ATOM 0 HB3 ALA A 32 14.705 0.111 0.620 1.00 0.00 H new ATOM 522 N VAL A 33 15.818 3.612 -0.524 1.00 0.00 N ATOM 523 CA VAL A 33 17.092 4.319 -0.641 1.00 0.00 C ATOM 524 C VAL A 33 17.422 5.099 0.643 1.00 0.00 C ATOM 525 O VAL A 33 17.511 6.325 0.607 1.00 0.00 O ATOM 526 CB VAL A 33 17.078 5.228 -1.893 1.00 0.00 C ATOM 527 CG1 VAL A 33 17.246 4.428 -3.183 1.00 0.00 C ATOM 528 CG2 VAL A 33 15.785 6.042 -2.032 1.00 0.00 C ATOM 0 H VAL A 33 15.065 4.230 -0.222 1.00 0.00 H new ATOM 0 HA VAL A 33 17.890 3.587 -0.768 1.00 0.00 H new ATOM 0 HB VAL A 33 17.920 5.904 -1.746 1.00 0.00 H new ATOM 0 HG11 VAL A 33 17.230 5.106 -4.036 1.00 0.00 H new ATOM 0 HG12 VAL A 33 18.197 3.896 -3.160 1.00 0.00 H new ATOM 0 HG13 VAL A 33 16.431 3.710 -3.275 1.00 0.00 H new ATOM 0 HG21 VAL A 33 15.838 6.659 -2.929 1.00 0.00 H new ATOM 0 HG22 VAL A 33 14.935 5.364 -2.107 1.00 0.00 H new ATOM 0 HG23 VAL A 33 15.662 6.682 -1.158 1.00 0.00 H new ATOM 538 N PRO A 34 17.633 4.432 1.794 1.00 0.00 N ATOM 539 CA PRO A 34 17.977 5.133 3.024 1.00 0.00 C ATOM 540 C PRO A 34 19.258 5.965 2.864 1.00 0.00 C ATOM 541 O PRO A 34 19.207 7.175 3.070 1.00 0.00 O ATOM 542 CB PRO A 34 18.075 4.085 4.134 1.00 0.00 C ATOM 543 CG PRO A 34 18.143 2.757 3.396 1.00 0.00 C ATOM 544 CD PRO A 34 17.552 3.000 2.014 1.00 0.00 C ATOM 0 HA PRO A 34 17.207 5.860 3.283 1.00 0.00 H new ATOM 0 HB2 PRO A 34 18.959 4.242 4.752 1.00 0.00 H new ATOM 0 HB3 PRO A 34 17.211 4.127 4.797 1.00 0.00 H new ATOM 0 HG2 PRO A 34 19.173 2.407 3.322 1.00 0.00 H new ATOM 0 HG3 PRO A 34 17.582 1.988 3.928 1.00 0.00 H new ATOM 0 HD2 PRO A 34 18.107 2.455 1.250 1.00 0.00 H new ATOM 0 HD3 PRO A 34 16.519 2.655 1.964 1.00 0.00 H new ATOM 552 N ARG A 35 20.392 5.365 2.475 1.00 0.00 N ATOM 553 CA ARG A 35 21.663 6.068 2.292 1.00 0.00 C ATOM 554 C ARG A 35 22.089 5.956 0.835 1.00 0.00 C ATOM 555 O ARG A 35 22.396 4.854 0.380 1.00 0.00 O ATOM 556 CB ARG A 35 22.747 5.505 3.224 1.00 0.00 C ATOM 557 CG ARG A 35 22.437 5.729 4.714 1.00 0.00 C ATOM 558 CD ARG A 35 23.709 5.629 5.572 1.00 0.00 C ATOM 559 NE ARG A 35 24.616 6.779 5.369 1.00 0.00 N ATOM 560 CZ ARG A 35 24.471 8.015 5.873 1.00 0.00 C ATOM 561 NH1 ARG A 35 23.471 8.309 6.697 1.00 0.00 N ATOM 562 NH2 ARG A 35 25.346 8.956 5.533 1.00 0.00 N ATOM 0 H ARG A 35 20.450 4.366 2.277 1.00 0.00 H new ATOM 0 HA ARG A 35 21.529 7.119 2.550 1.00 0.00 H new ATOM 0 HB2 ARG A 35 22.858 4.437 3.039 1.00 0.00 H new ATOM 0 HB3 ARG A 35 23.702 5.971 2.984 1.00 0.00 H new ATOM 0 HG2 ARG A 35 21.981 6.710 4.849 1.00 0.00 H new ATOM 0 HG3 ARG A 35 21.710 4.990 5.051 1.00 0.00 H new ATOM 0 HD2 ARG A 35 23.431 5.570 6.624 1.00 0.00 H new ATOM 0 HD3 ARG A 35 24.236 4.706 5.330 1.00 0.00 H new ATOM 0 HE ARG A 35 25.437 6.617 4.786 1.00 0.00 H new ATOM 0 HH11 ARG A 35 22.796 7.590 6.957 1.00 0.00 H new ATOM 0 HH12 ARG A 35 23.378 9.254 7.069 1.00 0.00 H new ATOM 0 HH21 ARG A 35 26.113 8.734 4.898 1.00 0.00 H new ATOM 0 HH22 ARG A 35 25.250 9.900 5.907 1.00 0.00 H new ATOM 576 N LYS A 36 22.030 7.050 0.069 1.00 0.00 N ATOM 577 CA LYS A 36 22.403 7.097 -1.346 1.00 0.00 C ATOM 578 C LYS A 36 22.490 8.556 -1.793 1.00 0.00 C ATOM 579 O LYS A 36 22.576 9.442 -0.947 1.00 0.00 O ATOM 580 CB LYS A 36 21.433 6.221 -2.197 1.00 0.00 C ATOM 581 CG LYS A 36 22.253 5.270 -3.086 1.00 0.00 C ATOM 582 CD LYS A 36 21.457 4.049 -3.555 1.00 0.00 C ATOM 583 CE LYS A 36 22.458 3.105 -4.222 1.00 0.00 C ATOM 584 NZ LYS A 36 21.900 1.769 -4.507 1.00 0.00 N ATOM 0 H LYS A 36 21.713 7.951 0.427 1.00 0.00 H new ATOM 0 HA LYS A 36 23.391 6.662 -1.501 1.00 0.00 H new ATOM 0 HB2 LYS A 36 20.774 5.649 -1.544 1.00 0.00 H new ATOM 0 HB3 LYS A 36 20.797 6.856 -2.814 1.00 0.00 H new ATOM 0 HG2 LYS A 36 22.614 5.817 -3.957 1.00 0.00 H new ATOM 0 HG3 LYS A 36 23.131 4.934 -2.535 1.00 0.00 H new ATOM 0 HD2 LYS A 36 20.965 3.561 -2.714 1.00 0.00 H new ATOM 0 HD3 LYS A 36 20.675 4.342 -4.255 1.00 0.00 H new ATOM 0 HE2 LYS A 36 22.804 3.553 -5.154 1.00 0.00 H new ATOM 0 HE3 LYS A 36 23.330 2.997 -3.577 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 22.627 1.178 -4.958 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 21.594 1.324 -3.618 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 21.085 1.862 -5.146 1.00 0.00 H new ATOM 598 N ASP A 37 22.461 8.787 -3.101 1.00 0.00 N ATOM 599 CA ASP A 37 22.518 10.101 -3.751 1.00 0.00 C ATOM 600 C ASP A 37 21.261 10.203 -4.610 1.00 0.00 C ATOM 601 O ASP A 37 20.455 11.116 -4.430 1.00 0.00 O ATOM 602 CB ASP A 37 23.824 10.245 -4.545 1.00 0.00 C ATOM 603 CG ASP A 37 25.017 10.195 -3.583 1.00 0.00 C ATOM 604 OD1 ASP A 37 25.324 11.207 -2.911 1.00 0.00 O ATOM 605 OD2 ASP A 37 25.553 9.082 -3.400 1.00 0.00 O ATOM 0 H ASP A 37 22.394 8.025 -3.776 1.00 0.00 H new ATOM 0 HA ASP A 37 22.531 10.925 -3.037 1.00 0.00 H new ATOM 0 HB2 ASP A 37 23.904 9.446 -5.282 1.00 0.00 H new ATOM 0 HB3 ASP A 37 23.826 11.186 -5.095 1.00 0.00 H new ATOM 610 N ARG A 38 21.005 9.175 -5.439 1.00 0.00 N ATOM 611 CA ARG A 38 19.848 9.038 -6.337 1.00 0.00 C ATOM 612 C ARG A 38 18.490 8.890 -5.629 1.00 0.00 C ATOM 613 O ARG A 38 17.581 8.267 -6.174 1.00 0.00 O ATOM 614 CB ARG A 38 20.081 7.896 -7.345 1.00 0.00 C ATOM 615 CG ARG A 38 20.105 6.477 -6.731 1.00 0.00 C ATOM 616 CD ARG A 38 19.529 5.437 -7.699 1.00 0.00 C ATOM 617 NE ARG A 38 20.234 5.445 -8.989 1.00 0.00 N ATOM 618 CZ ARG A 38 19.840 4.844 -10.115 1.00 0.00 C ATOM 619 NH1 ARG A 38 18.881 3.927 -10.094 1.00 0.00 N ATOM 620 NH2 ARG A 38 20.426 5.156 -11.263 1.00 0.00 N ATOM 0 H ARG A 38 21.635 8.375 -5.503 1.00 0.00 H new ATOM 0 HA ARG A 38 19.778 9.987 -6.868 1.00 0.00 H new ATOM 0 HB2 ARG A 38 19.298 7.935 -8.102 1.00 0.00 H new ATOM 0 HB3 ARG A 38 21.028 8.070 -7.856 1.00 0.00 H new ATOM 0 HG2 ARG A 38 21.129 6.208 -6.473 1.00 0.00 H new ATOM 0 HG3 ARG A 38 19.531 6.470 -5.804 1.00 0.00 H new ATOM 0 HD2 ARG A 38 19.600 4.445 -7.252 1.00 0.00 H new ATOM 0 HD3 ARG A 38 18.470 5.639 -7.862 1.00 0.00 H new ATOM 0 HE ARG A 38 21.113 5.962 -9.028 1.00 0.00 H new ATOM 0 HH11 ARG A 38 18.436 3.674 -9.212 1.00 0.00 H new ATOM 0 HH12 ARG A 38 18.589 3.475 -10.960 1.00 0.00 H new ATOM 0 HH21 ARG A 38 21.172 5.851 -11.282 1.00 0.00 H new ATOM 0 HH22 ARG A 38 20.130 4.701 -12.127 1.00 0.00 H new ATOM 634 N MET A 39 18.368 9.297 -4.371 1.00 0.00 N ATOM 635 CA MET A 39 17.117 9.213 -3.634 1.00 0.00 C ATOM 636 C MET A 39 16.161 10.301 -4.128 1.00 0.00 C ATOM 637 O MET A 39 16.476 11.011 -5.086 1.00 0.00 O ATOM 638 CB MET A 39 17.385 9.258 -2.118 1.00 0.00 C ATOM 639 CG MET A 39 18.066 10.552 -1.650 1.00 0.00 C ATOM 640 SD MET A 39 18.451 10.635 0.121 1.00 0.00 S ATOM 641 CE MET A 39 19.561 9.215 0.258 1.00 0.00 C ATOM 0 H MET A 39 19.138 9.696 -3.833 1.00 0.00 H new ATOM 0 HA MET A 39 16.627 8.257 -3.819 1.00 0.00 H new ATOM 0 HB2 MET A 39 16.440 9.143 -1.587 1.00 0.00 H new ATOM 0 HB3 MET A 39 18.011 8.409 -1.843 1.00 0.00 H new ATOM 0 HG2 MET A 39 18.992 10.679 -2.212 1.00 0.00 H new ATOM 0 HG3 MET A 39 17.421 11.394 -1.904 1.00 0.00 H new ATOM 0 HE1 MET A 39 20.397 9.468 0.910 1.00 0.00 H new ATOM 0 HE2 MET A 39 19.018 8.368 0.676 1.00 0.00 H new ATOM 0 HE3 MET A 39 19.939 8.952 -0.730 1.00 0.00 H new ATOM 651 N SER A 40 14.972 10.381 -3.538 1.00 0.00 N ATOM 652 CA SER A 40 13.947 11.363 -3.843 1.00 0.00 C ATOM 653 C SER A 40 12.828 11.154 -2.821 1.00 0.00 C ATOM 654 O SER A 40 12.416 10.007 -2.634 1.00 0.00 O ATOM 655 CB SER A 40 13.397 11.236 -5.275 1.00 0.00 C ATOM 656 OG SER A 40 12.715 12.437 -5.570 1.00 0.00 O ATOM 0 H SER A 40 14.688 9.733 -2.803 1.00 0.00 H new ATOM 0 HA SER A 40 14.375 12.364 -3.785 1.00 0.00 H new ATOM 0 HB2 SER A 40 14.207 11.070 -5.985 1.00 0.00 H new ATOM 0 HB3 SER A 40 12.724 10.382 -5.354 1.00 0.00 H new ATOM 0 HG SER A 40 12.351 12.392 -6.479 1.00 0.00 H new ATOM 662 N PRO A 41 12.354 12.182 -2.104 1.00 0.00 N ATOM 663 CA PRO A 41 11.275 12.003 -1.156 1.00 0.00 C ATOM 664 C PRO A 41 9.985 11.850 -1.962 1.00 0.00 C ATOM 665 O PRO A 41 9.827 12.452 -3.028 1.00 0.00 O ATOM 666 CB PRO A 41 11.255 13.281 -0.325 1.00 0.00 C ATOM 667 CG PRO A 41 11.760 14.347 -1.299 1.00 0.00 C ATOM 668 CD PRO A 41 12.739 13.577 -2.189 1.00 0.00 C ATOM 0 HA PRO A 41 11.388 11.131 -0.512 1.00 0.00 H new ATOM 0 HB2 PRO A 41 10.252 13.510 0.036 1.00 0.00 H new ATOM 0 HB3 PRO A 41 11.898 13.200 0.551 1.00 0.00 H new ATOM 0 HG2 PRO A 41 10.945 14.780 -1.879 1.00 0.00 H new ATOM 0 HG3 PRO A 41 12.252 15.168 -0.777 1.00 0.00 H new ATOM 0 HD2 PRO A 41 12.690 13.932 -3.218 1.00 0.00 H new ATOM 0 HD3 PRO A 41 13.766 13.718 -1.851 1.00 0.00 H new ATOM 676 N VAL A 42 9.055 11.040 -1.471 1.00 0.00 N ATOM 677 CA VAL A 42 7.773 10.813 -2.122 1.00 0.00 C ATOM 678 C VAL A 42 6.707 10.924 -1.041 1.00 0.00 C ATOM 679 O VAL A 42 7.013 11.018 0.155 1.00 0.00 O ATOM 680 CB VAL A 42 7.754 9.499 -2.945 1.00 0.00 C ATOM 681 CG1 VAL A 42 8.934 9.433 -3.934 1.00 0.00 C ATOM 682 CG2 VAL A 42 7.742 8.227 -2.091 1.00 0.00 C ATOM 0 H VAL A 42 9.172 10.518 -0.602 1.00 0.00 H new ATOM 0 HA VAL A 42 7.568 11.565 -2.884 1.00 0.00 H new ATOM 0 HB VAL A 42 6.811 9.530 -3.491 1.00 0.00 H new ATOM 0 HG11 VAL A 42 8.888 8.499 -4.493 1.00 0.00 H new ATOM 0 HG12 VAL A 42 8.876 10.273 -4.626 1.00 0.00 H new ATOM 0 HG13 VAL A 42 9.873 9.480 -3.383 1.00 0.00 H new ATOM 0 HG21 VAL A 42 7.729 7.352 -2.741 1.00 0.00 H new ATOM 0 HG22 VAL A 42 8.634 8.201 -1.465 1.00 0.00 H new ATOM 0 HG23 VAL A 42 6.854 8.222 -1.458 1.00 0.00 H new ATOM 692 N THR A 43 5.453 10.928 -1.458 1.00 0.00 N ATOM 693 CA THR A 43 4.318 11.033 -0.545 1.00 0.00 C ATOM 694 C THR A 43 3.480 9.765 -0.730 1.00 0.00 C ATOM 695 O THR A 43 3.595 9.102 -1.761 1.00 0.00 O ATOM 696 CB THR A 43 3.542 12.340 -0.789 1.00 0.00 C ATOM 697 OG1 THR A 43 4.346 13.368 -1.345 1.00 0.00 O ATOM 698 CG2 THR A 43 2.871 12.904 0.464 1.00 0.00 C ATOM 0 H THR A 43 5.188 10.859 -2.440 1.00 0.00 H new ATOM 0 HA THR A 43 4.634 11.092 0.497 1.00 0.00 H new ATOM 0 HB THR A 43 2.773 12.043 -1.502 1.00 0.00 H new ATOM 0 HG1 THR A 43 4.290 13.334 -2.323 1.00 0.00 H new ATOM 0 HG21 THR A 43 2.344 13.824 0.212 1.00 0.00 H new ATOM 0 HG22 THR A 43 2.161 12.176 0.856 1.00 0.00 H new ATOM 0 HG23 THR A 43 3.629 13.115 1.219 1.00 0.00 H new ATOM 706 N ILE A 44 2.584 9.472 0.207 1.00 0.00 N ATOM 707 CA ILE A 44 1.710 8.310 0.255 1.00 0.00 C ATOM 708 C ILE A 44 0.294 8.784 0.534 1.00 0.00 C ATOM 709 O ILE A 44 0.067 9.272 1.631 1.00 0.00 O ATOM 710 CB ILE A 44 2.191 7.397 1.411 1.00 0.00 C ATOM 711 CG1 ILE A 44 3.677 7.021 1.300 1.00 0.00 C ATOM 712 CG2 ILE A 44 1.330 6.141 1.524 1.00 0.00 C ATOM 713 CD1 ILE A 44 4.035 6.192 0.064 1.00 0.00 C ATOM 0 H ILE A 44 2.441 10.086 1.009 1.00 0.00 H new ATOM 0 HA ILE A 44 1.732 7.762 -0.687 1.00 0.00 H new ATOM 0 HB ILE A 44 2.077 7.983 2.323 1.00 0.00 H new ATOM 0 HG12 ILE A 44 4.270 7.936 1.292 1.00 0.00 H new ATOM 0 HG13 ILE A 44 3.964 6.463 2.191 1.00 0.00 H new ATOM 0 HG21 ILE A 44 1.694 5.523 2.344 1.00 0.00 H new ATOM 0 HG22 ILE A 44 0.295 6.425 1.716 1.00 0.00 H new ATOM 0 HG23 ILE A 44 1.385 5.577 0.593 1.00 0.00 H new ATOM 0 HD11 ILE A 44 5.103 5.974 0.069 1.00 0.00 H new ATOM 0 HD12 ILE A 44 3.474 5.258 0.077 1.00 0.00 H new ATOM 0 HD13 ILE A 44 3.784 6.753 -0.836 1.00 0.00 H new ATOM 725 N ALA A 45 -0.618 8.735 -0.434 1.00 0.00 N ATOM 726 CA ALA A 45 -2.011 9.145 -0.298 1.00 0.00 C ATOM 727 C ALA A 45 -2.864 7.899 -0.083 1.00 0.00 C ATOM 728 O ALA A 45 -2.804 6.964 -0.882 1.00 0.00 O ATOM 729 CB ALA A 45 -2.431 9.965 -1.517 1.00 0.00 C ATOM 0 H ALA A 45 -0.397 8.395 -1.370 1.00 0.00 H new ATOM 0 HA ALA A 45 -2.151 9.793 0.567 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -3.472 10.269 -1.410 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -1.801 10.851 -1.594 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -2.320 9.361 -2.418 1.00 0.00 H new ATOM 735 N LEU A 46 -3.633 7.889 1.005 1.00 0.00 N ATOM 736 CA LEU A 46 -4.517 6.813 1.425 1.00 0.00 C ATOM 737 C LEU A 46 -5.948 7.327 1.422 1.00 0.00 C ATOM 738 O LEU A 46 -6.195 8.453 1.850 1.00 0.00 O ATOM 739 CB LEU A 46 -4.072 6.363 2.822 1.00 0.00 C ATOM 740 CG LEU A 46 -4.919 5.225 3.433 1.00 0.00 C ATOM 741 CD1 LEU A 46 -4.013 4.343 4.301 1.00 0.00 C ATOM 742 CD2 LEU A 46 -6.068 5.707 4.326 1.00 0.00 C ATOM 0 H LEU A 46 -3.654 8.678 1.651 1.00 0.00 H new ATOM 0 HA LEU A 46 -4.470 5.959 0.750 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -3.033 6.037 2.770 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -4.104 7.222 3.493 1.00 0.00 H new ATOM 0 HG LEU A 46 -5.356 4.691 2.589 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -4.601 3.536 4.738 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -3.218 3.921 3.686 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -3.575 4.944 5.097 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -6.612 4.846 4.715 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -5.665 6.287 5.156 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -6.745 6.331 3.743 1.00 0.00 H new ATOM 754 N ILE A 47 -6.871 6.502 0.933 1.00 0.00 N ATOM 755 CA ILE A 47 -8.304 6.762 0.836 1.00 0.00 C ATOM 756 C ILE A 47 -9.048 5.466 1.146 1.00 0.00 C ATOM 757 O ILE A 47 -8.595 4.348 0.886 1.00 0.00 O ATOM 758 CB ILE A 47 -8.695 7.340 -0.564 1.00 0.00 C ATOM 759 CG1 ILE A 47 -7.700 8.407 -1.081 1.00 0.00 C ATOM 760 CG2 ILE A 47 -10.111 7.945 -0.496 1.00 0.00 C ATOM 761 CD1 ILE A 47 -8.088 9.113 -2.384 1.00 0.00 C ATOM 0 H ILE A 47 -6.623 5.580 0.573 1.00 0.00 H new ATOM 0 HA ILE A 47 -8.587 7.525 1.561 1.00 0.00 H new ATOM 0 HB ILE A 47 -8.665 6.510 -1.269 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -7.573 9.163 -0.306 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -6.730 7.931 -1.224 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -10.382 8.347 -1.472 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -10.824 7.171 -0.212 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -10.130 8.745 0.244 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -7.318 9.838 -2.648 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -8.183 8.377 -3.182 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -9.040 9.627 -2.250 1.00 0.00 H new ATOM 773 N SER A 48 -10.202 5.623 1.771 1.00 0.00 N ATOM 774 CA SER A 48 -11.053 4.521 2.133 1.00 0.00 C ATOM 775 C SER A 48 -11.915 4.159 0.929 1.00 0.00 C ATOM 776 O SER A 48 -12.321 5.019 0.148 1.00 0.00 O ATOM 777 CB SER A 48 -11.861 4.899 3.368 1.00 0.00 C ATOM 778 OG SER A 48 -12.191 6.270 3.473 1.00 0.00 O ATOM 0 H SER A 48 -10.572 6.534 2.041 1.00 0.00 H new ATOM 0 HA SER A 48 -10.477 3.634 2.397 1.00 0.00 H new ATOM 0 HB2 SER A 48 -12.783 4.318 3.371 1.00 0.00 H new ATOM 0 HB3 SER A 48 -11.298 4.608 4.255 1.00 0.00 H new ATOM 0 HG SER A 48 -12.463 6.609 2.595 1.00 0.00 H new ATOM 784 N CYS A 49 -12.196 2.869 0.774 1.00 0.00 N ATOM 785 CA CYS A 49 -13.001 2.386 -0.329 1.00 0.00 C ATOM 786 C CYS A 49 -14.443 2.893 -0.186 1.00 0.00 C ATOM 787 O CYS A 49 -15.193 2.399 0.657 1.00 0.00 O ATOM 788 CB CYS A 49 -12.948 0.855 -0.316 1.00 0.00 C ATOM 789 SG CYS A 49 -11.360 0.262 -0.943 1.00 0.00 S ATOM 0 H CYS A 49 -11.872 2.138 1.408 1.00 0.00 H new ATOM 0 HA CYS A 49 -12.617 2.756 -1.280 1.00 0.00 H new ATOM 0 HB2 CYS A 49 -13.102 0.490 0.699 1.00 0.00 H new ATOM 0 HB3 CYS A 49 -13.758 0.453 -0.926 1.00 0.00 H new ATOM 0 HG CYS A 49 -11.163 -0.958 -0.541 1.00 0.00 H new ATOM 795 N ARG A 50 -14.883 3.842 -1.012 1.00 0.00 N ATOM 796 CA ARG A 50 -16.266 4.343 -0.954 1.00 0.00 C ATOM 797 C ARG A 50 -17.240 3.401 -1.684 1.00 0.00 C ATOM 798 O ARG A 50 -18.408 3.731 -1.832 1.00 0.00 O ATOM 799 CB ARG A 50 -16.342 5.772 -1.514 1.00 0.00 C ATOM 800 CG ARG A 50 -16.143 5.867 -3.047 1.00 0.00 C ATOM 801 CD ARG A 50 -17.271 6.601 -3.788 1.00 0.00 C ATOM 802 NE ARG A 50 -18.605 6.047 -3.495 1.00 0.00 N ATOM 803 CZ ARG A 50 -19.746 6.730 -3.590 1.00 0.00 C ATOM 804 NH1 ARG A 50 -19.812 7.881 -4.252 1.00 0.00 N ATOM 805 NH2 ARG A 50 -20.836 6.268 -2.994 1.00 0.00 N ATOM 0 H ARG A 50 -14.307 4.282 -1.730 1.00 0.00 H new ATOM 0 HA ARG A 50 -16.572 4.370 0.092 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -17.312 6.199 -1.258 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -15.585 6.383 -1.023 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -15.201 6.377 -3.248 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -16.053 4.859 -3.453 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -17.253 7.656 -3.514 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -17.089 6.548 -4.861 1.00 0.00 H new ATOM 0 HE ARG A 50 -18.659 5.072 -3.199 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -18.978 8.260 -4.701 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -20.697 8.385 -4.311 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -20.798 5.395 -2.467 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -21.713 6.785 -3.062 1.00 0.00 H new ATOM 819 N HIS A 51 -16.784 2.225 -2.116 1.00 0.00 N ATOM 820 CA HIS A 51 -17.519 1.203 -2.866 1.00 0.00 C ATOM 821 C HIS A 51 -17.400 -0.217 -2.260 1.00 0.00 C ATOM 822 O HIS A 51 -17.376 -1.213 -2.984 1.00 0.00 O ATOM 823 CB HIS A 51 -16.984 1.288 -4.311 1.00 0.00 C ATOM 824 CG HIS A 51 -15.469 1.232 -4.432 1.00 0.00 C ATOM 825 ND1 HIS A 51 -14.605 0.645 -3.524 1.00 0.00 N ATOM 826 CD2 HIS A 51 -14.704 1.804 -5.422 1.00 0.00 C ATOM 827 CE1 HIS A 51 -13.352 0.846 -3.961 1.00 0.00 C ATOM 828 NE2 HIS A 51 -13.367 1.534 -5.107 1.00 0.00 N ATOM 0 H HIS A 51 -15.821 1.940 -1.938 1.00 0.00 H new ATOM 0 HA HIS A 51 -18.591 1.394 -2.828 1.00 0.00 H new ATOM 0 HB2 HIS A 51 -17.412 0.470 -4.891 1.00 0.00 H new ATOM 0 HB3 HIS A 51 -17.337 2.216 -4.761 1.00 0.00 H new ATOM 0 HD1 HIS A 51 -14.873 0.148 -2.674 1.00 0.00 H new ATOM 0 HD2 HIS A 51 -15.065 2.355 -6.278 1.00 0.00 H new ATOM 0 HE1 HIS A 51 -12.460 0.501 -3.459 1.00 0.00 H new ATOM 836 N VAL A 52 -17.222 -0.343 -0.941 1.00 0.00 N ATOM 837 CA VAL A 52 -17.095 -1.638 -0.247 1.00 0.00 C ATOM 838 C VAL A 52 -18.366 -2.478 -0.249 1.00 0.00 C ATOM 839 O VAL A 52 -18.300 -3.635 0.157 1.00 0.00 O ATOM 840 CB VAL A 52 -16.630 -1.491 1.218 1.00 0.00 C ATOM 841 CG1 VAL A 52 -15.241 -0.880 1.250 1.00 0.00 C ATOM 842 CG2 VAL A 52 -17.610 -0.688 2.094 1.00 0.00 C ATOM 0 H VAL A 52 -17.161 0.459 -0.313 1.00 0.00 H new ATOM 0 HA VAL A 52 -16.335 -2.156 -0.832 1.00 0.00 H new ATOM 0 HB VAL A 52 -16.603 -2.491 1.651 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -14.913 -0.776 2.284 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -14.547 -1.526 0.712 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -15.264 0.102 0.777 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -17.221 -0.624 3.110 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -17.725 0.316 1.685 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -18.579 -1.187 2.107 1.00 0.00 H new ATOM 852 N GLU A 53 -19.497 -1.953 -0.707 1.00 0.00 N ATOM 853 CA GLU A 53 -20.762 -2.669 -0.737 1.00 0.00 C ATOM 854 C GLU A 53 -20.631 -4.071 -1.343 1.00 0.00 C ATOM 855 O GLU A 53 -20.996 -5.044 -0.684 1.00 0.00 O ATOM 856 CB GLU A 53 -21.784 -1.791 -1.448 1.00 0.00 C ATOM 857 CG GLU A 53 -23.207 -2.311 -1.218 1.00 0.00 C ATOM 858 CD GLU A 53 -24.162 -1.387 -1.955 1.00 0.00 C ATOM 859 OE1 GLU A 53 -24.677 -1.788 -3.033 1.00 0.00 O ATOM 860 OE2 GLU A 53 -24.256 -0.214 -1.554 1.00 0.00 O ATOM 0 H GLU A 53 -19.559 -1.003 -1.073 1.00 0.00 H new ATOM 0 HA GLU A 53 -21.106 -2.855 0.280 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -21.704 -0.766 -1.085 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -21.569 -1.768 -2.516 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -23.305 -3.333 -1.585 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -23.439 -2.331 -0.153 1.00 0.00 H new ATOM 867 N THR A 54 -20.034 -4.185 -2.532 1.00 0.00 N ATOM 868 CA THR A 54 -19.840 -5.446 -3.250 1.00 0.00 C ATOM 869 C THR A 54 -18.604 -6.225 -2.755 1.00 0.00 C ATOM 870 O THR A 54 -18.259 -7.280 -3.293 1.00 0.00 O ATOM 871 CB THR A 54 -19.848 -5.129 -4.770 1.00 0.00 C ATOM 872 OG1 THR A 54 -20.092 -6.252 -5.584 1.00 0.00 O ATOM 873 CG2 THR A 54 -18.562 -4.461 -5.265 1.00 0.00 C ATOM 0 H THR A 54 -19.662 -3.380 -3.035 1.00 0.00 H new ATOM 0 HA THR A 54 -20.658 -6.137 -3.044 1.00 0.00 H new ATOM 0 HB THR A 54 -20.679 -4.430 -4.866 1.00 0.00 H new ATOM 0 HG1 THR A 54 -19.640 -7.035 -5.206 1.00 0.00 H new ATOM 0 HG21 THR A 54 -18.640 -4.270 -6.335 1.00 0.00 H new ATOM 0 HG22 THR A 54 -18.415 -3.518 -4.738 1.00 0.00 H new ATOM 0 HG23 THR A 54 -17.714 -5.119 -5.075 1.00 0.00 H new ATOM 881 N LEU A 55 -17.902 -5.727 -1.735 1.00 0.00 N ATOM 882 CA LEU A 55 -16.707 -6.341 -1.168 1.00 0.00 C ATOM 883 C LEU A 55 -16.990 -7.014 0.165 1.00 0.00 C ATOM 884 O LEU A 55 -18.112 -6.977 0.677 1.00 0.00 O ATOM 885 CB LEU A 55 -15.610 -5.289 -0.962 1.00 0.00 C ATOM 886 CG LEU A 55 -15.167 -4.565 -2.236 1.00 0.00 C ATOM 887 CD1 LEU A 55 -14.083 -3.529 -1.913 1.00 0.00 C ATOM 888 CD2 LEU A 55 -14.698 -5.529 -3.332 1.00 0.00 C ATOM 0 H LEU A 55 -18.161 -4.858 -1.268 1.00 0.00 H new ATOM 0 HA LEU A 55 -16.376 -7.099 -1.878 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -15.966 -4.549 -0.246 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -14.741 -5.773 -0.515 1.00 0.00 H new ATOM 0 HG LEU A 55 -16.042 -4.049 -2.633 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -13.779 -3.023 -2.829 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -14.478 -2.797 -1.208 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -13.221 -4.030 -1.472 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -14.396 -4.961 -4.212 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -13.851 -6.110 -2.967 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -15.513 -6.202 -3.597 1.00 0.00 H new ATOM 900 N GLU A 56 -15.963 -7.664 0.703 1.00 0.00 N ATOM 901 CA GLU A 56 -16.030 -8.361 1.972 1.00 0.00 C ATOM 902 C GLU A 56 -15.579 -7.430 3.091 1.00 0.00 C ATOM 903 O GLU A 56 -14.775 -6.522 2.876 1.00 0.00 O ATOM 904 CB GLU A 56 -15.134 -9.608 1.941 1.00 0.00 C ATOM 905 CG GLU A 56 -15.478 -10.658 0.879 1.00 0.00 C ATOM 906 CD GLU A 56 -16.773 -11.407 1.178 1.00 0.00 C ATOM 907 OE1 GLU A 56 -17.714 -10.849 1.801 1.00 0.00 O ATOM 908 OE2 GLU A 56 -16.914 -12.567 0.767 1.00 0.00 O ATOM 0 H GLU A 56 -15.047 -7.719 0.257 1.00 0.00 H new ATOM 0 HA GLU A 56 -17.059 -8.672 2.152 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -14.104 -9.287 1.785 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -15.175 -10.084 2.921 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -15.563 -10.170 -0.092 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -14.659 -11.374 0.805 1.00 0.00 H new ATOM 915 N LYS A 57 -16.100 -7.663 4.295 1.00 0.00 N ATOM 916 CA LYS A 57 -15.796 -6.893 5.500 1.00 0.00 C ATOM 917 C LYS A 57 -15.289 -7.820 6.597 1.00 0.00 C ATOM 918 O LYS A 57 -14.489 -7.388 7.423 1.00 0.00 O ATOM 919 CB LYS A 57 -17.012 -6.103 6.021 1.00 0.00 C ATOM 920 CG LYS A 57 -18.115 -5.703 5.029 1.00 0.00 C ATOM 921 CD LYS A 57 -17.668 -4.755 3.906 1.00 0.00 C ATOM 922 CE LYS A 57 -18.872 -4.248 3.105 1.00 0.00 C ATOM 923 NZ LYS A 57 -19.583 -5.316 2.364 1.00 0.00 N ATOM 0 H LYS A 57 -16.766 -8.417 4.464 1.00 0.00 H new ATOM 0 HA LYS A 57 -15.026 -6.171 5.229 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -17.476 -6.694 6.810 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -16.638 -5.190 6.485 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -18.523 -6.608 4.579 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -18.926 -5.229 5.582 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -17.128 -3.910 4.332 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -16.976 -5.273 3.242 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -19.571 -3.761 3.785 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -18.535 -3.490 2.398 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -20.213 -4.887 1.656 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -18.890 -5.927 1.886 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -20.146 -5.884 3.029 1.00 0.00 H new ATOM 937 N ASP A 58 -15.666 -9.102 6.554 1.00 0.00 N ATOM 938 CA ASP A 58 -15.244 -10.101 7.540 1.00 0.00 C ATOM 939 C ASP A 58 -13.725 -10.276 7.529 1.00 0.00 C ATOM 940 O ASP A 58 -13.149 -10.747 8.508 1.00 0.00 O ATOM 941 CB ASP A 58 -15.987 -11.429 7.315 1.00 0.00 C ATOM 942 CG ASP A 58 -15.912 -12.380 8.518 1.00 0.00 C ATOM 943 OD1 ASP A 58 -15.035 -13.283 8.538 1.00 0.00 O ATOM 944 OD2 ASP A 58 -16.773 -12.289 9.415 1.00 0.00 O ATOM 0 H ASP A 58 -16.277 -9.478 5.829 1.00 0.00 H new ATOM 0 HA ASP A 58 -15.512 -9.744 8.535 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -17.033 -11.219 7.092 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -15.569 -11.927 6.440 1.00 0.00 H new ATOM 949 N ARG A 59 -13.062 -9.885 6.432 1.00 0.00 N ATOM 950 CA ARG A 59 -11.607 -9.959 6.281 1.00 0.00 C ATOM 951 C ARG A 59 -10.909 -8.839 7.073 1.00 0.00 C ATOM 952 O ARG A 59 -9.705 -8.934 7.311 1.00 0.00 O ATOM 953 CB ARG A 59 -11.193 -9.834 4.803 1.00 0.00 C ATOM 954 CG ARG A 59 -12.069 -10.505 3.733 1.00 0.00 C ATOM 955 CD ARG A 59 -12.291 -12.014 3.829 1.00 0.00 C ATOM 956 NE ARG A 59 -11.010 -12.750 3.866 1.00 0.00 N ATOM 957 CZ ARG A 59 -10.819 -14.047 4.125 1.00 0.00 C ATOM 958 NH1 ARG A 59 -11.845 -14.893 4.236 1.00 0.00 N ATOM 959 NH2 ARG A 59 -9.571 -14.477 4.271 1.00 0.00 N ATOM 0 H ARG A 59 -13.532 -9.502 5.612 1.00 0.00 H new ATOM 0 HA ARG A 59 -11.300 -10.931 6.668 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -11.135 -8.772 4.565 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -10.185 -10.238 4.706 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -13.046 -10.022 3.751 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -11.627 -10.294 2.759 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -12.868 -12.241 4.725 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -12.881 -12.351 2.976 1.00 0.00 H new ATOM 0 HE ARG A 59 -10.172 -12.203 3.671 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -12.800 -14.554 4.123 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -11.674 -15.879 4.434 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -8.793 -13.823 4.185 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -9.391 -15.461 4.469 1.00 0.00 H new ATOM 973 N GLY A 60 -11.607 -7.749 7.421 1.00 0.00 N ATOM 974 CA GLY A 60 -11.097 -6.611 8.172 1.00 0.00 C ATOM 975 C GLY A 60 -11.601 -5.289 7.599 1.00 0.00 C ATOM 976 O GLY A 60 -12.761 -4.920 7.798 1.00 0.00 O ATOM 0 H GLY A 60 -12.590 -7.639 7.171 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -11.402 -6.696 9.215 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -10.007 -6.623 8.157 1.00 0.00 H new ATOM 980 N ASN A 61 -10.752 -4.564 6.863 1.00 0.00 N ATOM 981 CA ASN A 61 -11.111 -3.266 6.282 1.00 0.00 C ATOM 982 C ASN A 61 -10.465 -3.027 4.907 1.00 0.00 C ATOM 983 O ASN A 61 -9.288 -2.674 4.869 1.00 0.00 O ATOM 984 CB ASN A 61 -10.680 -2.158 7.258 1.00 0.00 C ATOM 985 CG ASN A 61 -10.830 -0.767 6.649 1.00 0.00 C ATOM 986 OD1 ASN A 61 -11.656 -0.523 5.777 1.00 0.00 O ATOM 987 ND2 ASN A 61 -10.002 0.176 7.067 1.00 0.00 N ATOM 0 H ASN A 61 -9.799 -4.860 6.654 1.00 0.00 H new ATOM 0 HA ASN A 61 -12.190 -3.255 6.126 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -11.279 -2.222 8.166 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -9.642 -2.316 7.549 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -10.049 1.112 6.663 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -9.316 -0.032 7.793 1.00 0.00 H new ATOM 994 N PRO A 62 -11.157 -3.233 3.776 1.00 0.00 N ATOM 995 CA PRO A 62 -10.583 -2.991 2.450 1.00 0.00 C ATOM 996 C PRO A 62 -10.430 -1.481 2.191 1.00 0.00 C ATOM 997 O PRO A 62 -11.381 -0.722 2.392 1.00 0.00 O ATOM 998 CB PRO A 62 -11.568 -3.634 1.478 1.00 0.00 C ATOM 999 CG PRO A 62 -12.910 -3.562 2.204 1.00 0.00 C ATOM 1000 CD PRO A 62 -12.546 -3.665 3.681 1.00 0.00 C ATOM 0 HA PRO A 62 -9.583 -3.411 2.343 1.00 0.00 H new ATOM 0 HB2 PRO A 62 -11.599 -3.098 0.529 1.00 0.00 H new ATOM 0 HB3 PRO A 62 -11.291 -4.664 1.253 1.00 0.00 H new ATOM 0 HG2 PRO A 62 -13.430 -2.629 1.987 1.00 0.00 H new ATOM 0 HG3 PRO A 62 -13.571 -4.374 1.900 1.00 0.00 H new ATOM 0 HD2 PRO A 62 -13.195 -3.034 4.289 1.00 0.00 H new ATOM 0 HD3 PRO A 62 -12.664 -4.686 4.043 1.00 0.00 H new ATOM 1008 N ILE A 63 -9.256 -1.036 1.728 1.00 0.00 N ATOM 1009 CA ILE A 63 -8.971 0.380 1.445 1.00 0.00 C ATOM 1010 C ILE A 63 -8.073 0.477 0.205 1.00 0.00 C ATOM 1011 O ILE A 63 -7.718 -0.559 -0.378 1.00 0.00 O ATOM 1012 CB ILE A 63 -8.323 1.091 2.659 1.00 0.00 C ATOM 1013 CG1 ILE A 63 -6.928 0.526 3.006 1.00 0.00 C ATOM 1014 CG2 ILE A 63 -9.218 1.099 3.910 1.00 0.00 C ATOM 1015 CD1 ILE A 63 -5.952 1.635 3.389 1.00 0.00 C ATOM 0 H ILE A 63 -8.467 -1.654 1.536 1.00 0.00 H new ATOM 0 HA ILE A 63 -9.913 0.892 1.250 1.00 0.00 H new ATOM 0 HB ILE A 63 -8.201 2.125 2.338 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -7.016 -0.182 3.830 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -6.536 -0.026 2.152 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -8.703 1.612 4.722 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -10.151 1.617 3.687 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -9.435 0.073 4.209 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -4.981 1.199 3.627 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -5.844 2.329 2.555 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -6.332 2.170 4.259 1.00 0.00 H new ATOM 1027 N TYR A 64 -7.695 1.703 -0.180 1.00 0.00 N ATOM 1028 CA TYR A 64 -6.834 1.966 -1.314 1.00 0.00 C ATOM 1029 C TYR A 64 -5.792 3.027 -0.948 1.00 0.00 C ATOM 1030 O TYR A 64 -6.091 4.047 -0.329 1.00 0.00 O ATOM 1031 CB TYR A 64 -7.674 2.359 -2.546 1.00 0.00 C ATOM 1032 CG TYR A 64 -6.918 2.271 -3.865 1.00 0.00 C ATOM 1033 CD1 TYR A 64 -7.113 3.226 -4.874 1.00 0.00 C ATOM 1034 CD2 TYR A 64 -6.043 1.203 -4.115 1.00 0.00 C ATOM 1035 CE1 TYR A 64 -6.480 3.082 -6.128 1.00 0.00 C ATOM 1036 CE2 TYR A 64 -5.280 1.146 -5.292 1.00 0.00 C ATOM 1037 CZ TYR A 64 -5.556 2.045 -6.336 1.00 0.00 C ATOM 1038 OH TYR A 64 -5.006 1.873 -7.565 1.00 0.00 O ATOM 0 H TYR A 64 -7.992 2.549 0.306 1.00 0.00 H new ATOM 0 HA TYR A 64 -6.290 1.059 -1.578 1.00 0.00 H new ATOM 0 HB2 TYR A 64 -8.550 1.712 -2.597 1.00 0.00 H new ATOM 0 HB3 TYR A 64 -8.038 3.378 -2.415 1.00 0.00 H new ATOM 0 HD1 TYR A 64 -7.752 4.077 -4.690 1.00 0.00 H new ATOM 0 HD2 TYR A 64 -5.955 0.409 -3.388 1.00 0.00 H new ATOM 0 HE1 TYR A 64 -6.707 3.771 -6.929 1.00 0.00 H new ATOM 0 HE2 TYR A 64 -4.489 0.418 -5.394 1.00 0.00 H new ATOM 0 HH TYR A 64 -5.510 1.192 -8.057 1.00 0.00 H new ATOM 1048 N LEU A 65 -4.540 2.787 -1.319 1.00 0.00 N ATOM 1049 CA LEU A 65 -3.413 3.671 -1.071 1.00 0.00 C ATOM 1050 C LEU A 65 -2.532 3.720 -2.312 1.00 0.00 C ATOM 1051 O LEU A 65 -2.473 2.752 -3.086 1.00 0.00 O ATOM 1052 CB LEU A 65 -2.675 3.172 0.187 1.00 0.00 C ATOM 1053 CG LEU A 65 -1.290 3.805 0.449 1.00 0.00 C ATOM 1054 CD1 LEU A 65 -0.972 3.838 1.952 1.00 0.00 C ATOM 1055 CD2 LEU A 65 -0.158 3.069 -0.281 1.00 0.00 C ATOM 0 H LEU A 65 -4.274 1.939 -1.819 1.00 0.00 H new ATOM 0 HA LEU A 65 -3.734 4.695 -0.878 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -3.308 3.358 1.054 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -2.551 2.092 0.108 1.00 0.00 H new ATOM 0 HG LEU A 65 -1.346 4.821 0.059 1.00 0.00 H new ATOM 0 HD11 LEU A 65 0.008 4.288 2.107 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -1.728 4.427 2.471 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -0.971 2.822 2.346 1.00 0.00 H new ATOM 0 HD21 LEU A 65 0.793 3.555 -0.062 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -0.121 2.033 0.055 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -0.340 3.095 -1.355 1.00 0.00 H new ATOM 1067 N GLY A 66 -1.834 4.843 -2.490 1.00 0.00 N ATOM 1068 CA GLY A 66 -0.933 5.059 -3.596 1.00 0.00 C ATOM 1069 C GLY A 66 0.119 6.095 -3.237 1.00 0.00 C ATOM 1070 O GLY A 66 0.137 6.626 -2.127 1.00 0.00 O ATOM 0 H GLY A 66 -1.888 5.636 -1.851 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -0.449 4.120 -3.866 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -1.494 5.391 -4.469 1.00 0.00 H new ATOM 1074 N LEU A 67 1.074 6.296 -4.137 1.00 0.00 N ATOM 1075 CA LEU A 67 2.150 7.260 -3.980 1.00 0.00 C ATOM 1076 C LEU A 67 1.596 8.567 -4.557 1.00 0.00 C ATOM 1077 O LEU A 67 0.868 8.550 -5.556 1.00 0.00 O ATOM 1078 CB LEU A 67 3.442 6.829 -4.697 1.00 0.00 C ATOM 1079 CG LEU A 67 3.830 5.350 -4.671 1.00 0.00 C ATOM 1080 CD1 LEU A 67 5.168 5.232 -5.412 1.00 0.00 C ATOM 1081 CD2 LEU A 67 3.941 4.782 -3.251 1.00 0.00 C ATOM 0 H LEU A 67 1.121 5.780 -5.016 1.00 0.00 H new ATOM 0 HA LEU A 67 2.439 7.360 -2.934 1.00 0.00 H new ATOM 0 HB2 LEU A 67 3.359 7.132 -5.741 1.00 0.00 H new ATOM 0 HB3 LEU A 67 4.266 7.396 -4.265 1.00 0.00 H new ATOM 0 HG LEU A 67 3.049 4.762 -5.153 1.00 0.00 H new ATOM 0 HD11 LEU A 67 5.489 4.190 -5.421 1.00 0.00 H new ATOM 0 HD12 LEU A 67 5.049 5.583 -6.437 1.00 0.00 H new ATOM 0 HD13 LEU A 67 5.919 5.839 -4.906 1.00 0.00 H new ATOM 0 HD21 LEU A 67 4.219 3.729 -3.301 1.00 0.00 H new ATOM 0 HD22 LEU A 67 4.702 5.332 -2.697 1.00 0.00 H new ATOM 0 HD23 LEU A 67 2.981 4.880 -2.744 1.00 0.00 H new ATOM 1093 N ASN A 68 1.869 9.694 -3.904 1.00 0.00 N ATOM 1094 CA ASN A 68 1.386 10.997 -4.340 1.00 0.00 C ATOM 1095 C ASN A 68 2.603 11.752 -4.850 1.00 0.00 C ATOM 1096 O ASN A 68 3.418 12.230 -4.052 1.00 0.00 O ATOM 1097 CB ASN A 68 0.562 11.706 -3.243 1.00 0.00 C ATOM 1098 CG ASN A 68 -0.544 12.610 -3.780 1.00 0.00 C ATOM 1099 OD1 ASN A 68 -1.018 12.464 -4.903 1.00 0.00 O ATOM 1100 ND2 ASN A 68 -0.997 13.549 -2.973 1.00 0.00 N ATOM 0 H ASN A 68 2.433 9.727 -3.055 1.00 0.00 H new ATOM 0 HA ASN A 68 0.664 10.923 -5.153 1.00 0.00 H new ATOM 0 HB2 ASN A 68 0.117 10.952 -2.594 1.00 0.00 H new ATOM 0 HB3 ASN A 68 1.235 12.301 -2.626 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -1.750 14.165 -3.279 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -0.594 13.660 -2.042 1.00 0.00 H new ATOM 1107 N GLY A 69 2.751 11.818 -6.171 1.00 0.00 N ATOM 1108 CA GLY A 69 3.866 12.477 -6.838 1.00 0.00 C ATOM 1109 C GLY A 69 3.896 12.237 -8.348 1.00 0.00 C ATOM 1110 O GLY A 69 4.438 13.085 -9.056 1.00 0.00 O ATOM 0 H GLY A 69 2.082 11.404 -6.821 1.00 0.00 H new ATOM 0 HA2 GLY A 69 3.811 13.549 -6.649 1.00 0.00 H new ATOM 0 HA3 GLY A 69 4.801 12.124 -6.402 1.00 0.00 H new ATOM 1114 N LEU A 70 3.338 11.123 -8.856 1.00 0.00 N ATOM 1115 CA LEU A 70 3.325 10.814 -10.295 1.00 0.00 C ATOM 1116 C LEU A 70 2.153 9.922 -10.744 1.00 0.00 C ATOM 1117 O LEU A 70 2.238 9.280 -11.780 1.00 0.00 O ATOM 1118 CB LEU A 70 4.688 10.252 -10.749 1.00 0.00 C ATOM 1119 CG LEU A 70 5.185 10.806 -12.102 1.00 0.00 C ATOM 1120 CD1 LEU A 70 6.702 10.908 -12.009 1.00 0.00 C ATOM 1121 CD2 LEU A 70 4.889 9.911 -13.317 1.00 0.00 C ATOM 0 H LEU A 70 2.884 10.414 -8.280 1.00 0.00 H new ATOM 0 HA LEU A 70 3.155 11.764 -10.802 1.00 0.00 H new ATOM 0 HB2 LEU A 70 5.432 10.473 -9.984 1.00 0.00 H new ATOM 0 HB3 LEU A 70 4.615 9.167 -10.819 1.00 0.00 H new ATOM 0 HG LEU A 70 4.665 11.750 -12.261 1.00 0.00 H new ATOM 0 HD11 LEU A 70 7.099 11.297 -12.947 1.00 0.00 H new ATOM 0 HD12 LEU A 70 6.972 11.580 -11.194 1.00 0.00 H new ATOM 0 HD13 LEU A 70 7.122 9.920 -11.819 1.00 0.00 H new ATOM 0 HD21 LEU A 70 5.276 10.384 -14.220 1.00 0.00 H new ATOM 0 HD22 LEU A 70 5.369 8.942 -13.181 1.00 0.00 H new ATOM 0 HD23 LEU A 70 3.812 9.772 -13.413 1.00 0.00 H new ATOM 1133 N ASN A 71 1.068 9.830 -9.970 1.00 0.00 N ATOM 1134 CA ASN A 71 -0.141 9.049 -10.285 1.00 0.00 C ATOM 1135 C ASN A 71 0.184 7.558 -10.389 1.00 0.00 C ATOM 1136 O ASN A 71 0.045 6.912 -11.432 1.00 0.00 O ATOM 1137 CB ASN A 71 -0.834 9.652 -11.527 1.00 0.00 C ATOM 1138 CG ASN A 71 -0.899 11.173 -11.419 1.00 0.00 C ATOM 1139 OD1 ASN A 71 -0.231 11.902 -12.149 1.00 0.00 O ATOM 1140 ND2 ASN A 71 -1.587 11.706 -10.429 1.00 0.00 N ATOM 0 H ASN A 71 1.001 10.313 -9.074 1.00 0.00 H new ATOM 0 HA ASN A 71 -0.863 9.116 -9.471 1.00 0.00 H new ATOM 0 HB2 ASN A 71 -0.289 9.369 -12.428 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -1.841 9.245 -11.622 1.00 0.00 H new ATOM 0 HD21 ASN A 71 -1.562 12.714 -10.275 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -2.145 11.110 -9.817 1.00 0.00 H new ATOM 1147 N LEU A 72 0.650 7.007 -9.264 1.00 0.00 N ATOM 1148 CA LEU A 72 1.064 5.619 -9.130 1.00 0.00 C ATOM 1149 C LEU A 72 0.512 5.054 -7.835 1.00 0.00 C ATOM 1150 O LEU A 72 0.684 5.670 -6.793 1.00 0.00 O ATOM 1151 CB LEU A 72 2.610 5.497 -9.102 1.00 0.00 C ATOM 1152 CG LEU A 72 3.451 6.716 -9.561 1.00 0.00 C ATOM 1153 CD1 LEU A 72 3.654 7.698 -8.404 1.00 0.00 C ATOM 1154 CD2 LEU A 72 4.850 6.305 -10.013 1.00 0.00 C ATOM 0 H LEU A 72 0.750 7.537 -8.398 1.00 0.00 H new ATOM 0 HA LEU A 72 0.681 5.066 -9.987 1.00 0.00 H new ATOM 0 HB2 LEU A 72 2.906 5.254 -8.082 1.00 0.00 H new ATOM 0 HB3 LEU A 72 2.888 4.647 -9.726 1.00 0.00 H new ATOM 0 HG LEU A 72 2.899 7.168 -10.385 1.00 0.00 H new ATOM 0 HD11 LEU A 72 4.247 8.546 -8.747 1.00 0.00 H new ATOM 0 HD12 LEU A 72 2.685 8.051 -8.052 1.00 0.00 H new ATOM 0 HD13 LEU A 72 4.176 7.197 -7.589 1.00 0.00 H new ATOM 0 HD21 LEU A 72 5.405 7.189 -10.326 1.00 0.00 H new ATOM 0 HD22 LEU A 72 5.372 5.822 -9.187 1.00 0.00 H new ATOM 0 HD23 LEU A 72 4.773 5.610 -10.849 1.00 0.00 H new ATOM 1166 N CYS A 73 -0.071 3.860 -7.858 1.00 0.00 N ATOM 1167 CA CYS A 73 -0.625 3.215 -6.658 1.00 0.00 C ATOM 1168 C CYS A 73 -0.268 1.737 -6.592 1.00 0.00 C ATOM 1169 O CYS A 73 0.325 1.217 -7.531 1.00 0.00 O ATOM 1170 CB CYS A 73 -2.150 3.345 -6.588 1.00 0.00 C ATOM 1171 SG CYS A 73 -2.737 5.006 -7.030 1.00 0.00 S ATOM 0 H CYS A 73 -0.176 3.306 -8.708 1.00 0.00 H new ATOM 0 HA CYS A 73 -0.178 3.736 -5.812 1.00 0.00 H new ATOM 0 HB2 CYS A 73 -2.603 2.614 -7.258 1.00 0.00 H new ATOM 0 HB3 CYS A 73 -2.485 3.103 -5.579 1.00 0.00 H new ATOM 0 HG CYS A 73 -4.031 4.989 -7.158 1.00 0.00 H new ATOM 1177 N LEU A 74 -0.617 1.057 -5.497 1.00 0.00 N ATOM 1178 CA LEU A 74 -0.322 -0.365 -5.320 1.00 0.00 C ATOM 1179 C LEU A 74 -1.066 -1.221 -6.347 1.00 0.00 C ATOM 1180 O LEU A 74 -2.149 -0.848 -6.796 1.00 0.00 O ATOM 1181 CB LEU A 74 -0.687 -0.810 -3.902 1.00 0.00 C ATOM 1182 CG LEU A 74 0.156 -0.199 -2.767 1.00 0.00 C ATOM 1183 CD1 LEU A 74 -0.626 -0.203 -1.454 1.00 0.00 C ATOM 1184 CD2 LEU A 74 1.460 -0.972 -2.551 1.00 0.00 C ATOM 0 H LEU A 74 -1.111 1.477 -4.710 1.00 0.00 H new ATOM 0 HA LEU A 74 0.748 -0.506 -5.475 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -1.734 -0.565 -3.723 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -0.600 -1.895 -3.849 1.00 0.00 H new ATOM 0 HG LEU A 74 0.390 0.823 -3.065 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -0.014 0.233 -0.664 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -1.537 0.383 -1.572 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -0.886 -1.228 -1.188 1.00 0.00 H new ATOM 0 HD21 LEU A 74 2.027 -0.511 -1.742 1.00 0.00 H new ATOM 0 HD22 LEU A 74 1.231 -2.005 -2.290 1.00 0.00 H new ATOM 0 HD23 LEU A 74 2.051 -0.951 -3.466 1.00 0.00 H new ATOM 1196 N MET A 75 -0.487 -2.368 -6.725 1.00 0.00 N ATOM 1197 CA MET A 75 -1.097 -3.264 -7.713 1.00 0.00 C ATOM 1198 C MET A 75 -0.474 -4.634 -7.568 1.00 0.00 C ATOM 1199 O MET A 75 0.730 -4.698 -7.321 1.00 0.00 O ATOM 1200 CB MET A 75 -0.750 -2.776 -9.126 1.00 0.00 C ATOM 1201 CG MET A 75 -1.845 -2.976 -10.166 1.00 0.00 C ATOM 1202 SD MET A 75 -2.437 -4.651 -10.475 1.00 0.00 S ATOM 1203 CE MET A 75 -1.293 -5.085 -11.786 1.00 0.00 C ATOM 0 H MET A 75 0.406 -2.697 -6.359 1.00 0.00 H new ATOM 0 HA MET A 75 -2.176 -3.287 -7.558 1.00 0.00 H new ATOM 0 HB2 MET A 75 -0.506 -1.715 -9.077 1.00 0.00 H new ATOM 0 HB3 MET A 75 0.148 -3.294 -9.462 1.00 0.00 H new ATOM 0 HG2 MET A 75 -2.701 -2.371 -9.868 1.00 0.00 H new ATOM 0 HG3 MET A 75 -1.483 -2.572 -11.111 1.00 0.00 H new ATOM 0 HE1 MET A 75 -1.529 -6.081 -12.160 1.00 0.00 H new ATOM 0 HE2 MET A 75 -1.379 -4.363 -12.598 1.00 0.00 H new ATOM 0 HE3 MET A 75 -0.274 -5.075 -11.398 1.00 0.00 H new ATOM 1213 N CYS A 76 -1.247 -5.694 -7.769 1.00 0.00 N ATOM 1214 CA CYS A 76 -0.767 -7.065 -7.668 1.00 0.00 C ATOM 1215 C CYS A 76 -0.746 -7.715 -9.045 1.00 0.00 C ATOM 1216 O CYS A 76 -1.790 -7.784 -9.697 1.00 0.00 O ATOM 1217 CB CYS A 76 -1.663 -7.868 -6.730 1.00 0.00 C ATOM 1218 SG CYS A 76 -1.557 -7.181 -5.065 1.00 0.00 S ATOM 0 H CYS A 76 -2.236 -5.624 -8.009 1.00 0.00 H new ATOM 0 HA CYS A 76 0.246 -7.052 -7.266 1.00 0.00 H new ATOM 0 HB2 CYS A 76 -2.694 -7.840 -7.082 1.00 0.00 H new ATOM 0 HB3 CYS A 76 -1.357 -8.914 -6.724 1.00 0.00 H new ATOM 0 HG CYS A 76 -2.228 -6.069 -5.011 1.00 0.00 H new ATOM 1224 N ALA A 77 0.418 -8.198 -9.486 1.00 0.00 N ATOM 1225 CA ALA A 77 0.594 -8.853 -10.775 1.00 0.00 C ATOM 1226 C ALA A 77 1.566 -10.022 -10.656 1.00 0.00 C ATOM 1227 O ALA A 77 2.629 -9.904 -10.040 1.00 0.00 O ATOM 1228 CB ALA A 77 1.153 -7.867 -11.796 1.00 0.00 C ATOM 0 H ALA A 77 1.279 -8.141 -8.942 1.00 0.00 H new ATOM 0 HA ALA A 77 -0.381 -9.217 -11.099 1.00 0.00 H new ATOM 0 HB1 ALA A 77 1.280 -8.369 -12.755 1.00 0.00 H new ATOM 0 HB2 ALA A 77 0.462 -7.032 -11.912 1.00 0.00 H new ATOM 0 HB3 ALA A 77 2.117 -7.494 -11.451 1.00 0.00 H new ATOM 1234 N LYS A 78 1.219 -11.156 -11.255 1.00 0.00 N ATOM 1235 CA LYS A 78 2.018 -12.363 -11.266 1.00 0.00 C ATOM 1236 C LYS A 78 3.230 -12.099 -12.143 1.00 0.00 C ATOM 1237 O LYS A 78 3.090 -11.783 -13.329 1.00 0.00 O ATOM 1238 CB LYS A 78 1.121 -13.526 -11.701 1.00 0.00 C ATOM 1239 CG LYS A 78 1.761 -14.898 -11.472 1.00 0.00 C ATOM 1240 CD LYS A 78 0.645 -15.962 -11.419 1.00 0.00 C ATOM 1241 CE LYS A 78 1.026 -17.342 -10.867 1.00 0.00 C ATOM 1242 NZ LYS A 78 1.678 -18.243 -11.847 1.00 0.00 N ATOM 0 H LYS A 78 0.340 -11.257 -11.763 1.00 0.00 H new ATOM 0 HA LYS A 78 2.407 -12.647 -10.288 1.00 0.00 H new ATOM 0 HB2 LYS A 78 0.180 -13.475 -11.154 1.00 0.00 H new ATOM 0 HB3 LYS A 78 0.881 -13.416 -12.759 1.00 0.00 H new ATOM 0 HG2 LYS A 78 2.463 -15.126 -12.274 1.00 0.00 H new ATOM 0 HG3 LYS A 78 2.329 -14.899 -10.542 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -0.171 -15.568 -10.813 1.00 0.00 H new ATOM 0 HD3 LYS A 78 0.256 -16.096 -12.428 1.00 0.00 H new ATOM 0 HE2 LYS A 78 1.695 -17.206 -10.018 1.00 0.00 H new ATOM 0 HE3 LYS A 78 0.126 -17.828 -10.489 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 2.182 -18.999 -11.341 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 0.956 -18.663 -12.467 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 2.354 -17.700 -12.421 1.00 0.00 H new ATOM 1256 N VAL A 79 4.426 -12.163 -11.561 1.00 0.00 N ATOM 1257 CA VAL A 79 5.640 -11.923 -12.334 1.00 0.00 C ATOM 1258 C VAL A 79 5.890 -13.063 -13.320 1.00 0.00 C ATOM 1259 O VAL A 79 6.533 -12.879 -14.346 1.00 0.00 O ATOM 1260 CB VAL A 79 6.833 -11.666 -11.390 1.00 0.00 C ATOM 1261 CG1 VAL A 79 7.297 -12.908 -10.613 1.00 0.00 C ATOM 1262 CG2 VAL A 79 8.015 -11.024 -12.126 1.00 0.00 C ATOM 0 H VAL A 79 4.579 -12.375 -10.575 1.00 0.00 H new ATOM 0 HA VAL A 79 5.513 -11.022 -12.935 1.00 0.00 H new ATOM 0 HB VAL A 79 6.454 -10.963 -10.648 1.00 0.00 H new ATOM 0 HG11 VAL A 79 8.138 -12.643 -9.973 1.00 0.00 H new ATOM 0 HG12 VAL A 79 6.477 -13.280 -9.999 1.00 0.00 H new ATOM 0 HG13 VAL A 79 7.605 -13.682 -11.315 1.00 0.00 H new ATOM 0 HG21 VAL A 79 8.834 -10.860 -11.426 1.00 0.00 H new ATOM 0 HG22 VAL A 79 8.349 -11.686 -12.925 1.00 0.00 H new ATOM 0 HG23 VAL A 79 7.704 -10.070 -12.551 1.00 0.00 H new ATOM 1272 N GLY A 80 5.352 -14.236 -13.017 1.00 0.00 N ATOM 1273 CA GLY A 80 5.489 -15.434 -13.811 1.00 0.00 C ATOM 1274 C GLY A 80 4.888 -16.541 -12.973 1.00 0.00 C ATOM 1275 O GLY A 80 3.755 -16.942 -13.230 1.00 0.00 O ATOM 0 H GLY A 80 4.788 -14.377 -12.179 1.00 0.00 H new ATOM 0 HA2 GLY A 80 4.969 -15.336 -14.764 1.00 0.00 H new ATOM 0 HA3 GLY A 80 6.535 -15.637 -14.039 1.00 0.00 H new ATOM 1279 N ASP A 81 5.559 -16.921 -11.881 1.00 0.00 N ATOM 1280 CA ASP A 81 5.078 -17.992 -11.006 1.00 0.00 C ATOM 1281 C ASP A 81 4.315 -17.535 -9.769 1.00 0.00 C ATOM 1282 O ASP A 81 3.447 -18.259 -9.287 1.00 0.00 O ATOM 1283 CB ASP A 81 6.223 -18.918 -10.599 1.00 0.00 C ATOM 1284 CG ASP A 81 5.665 -20.232 -10.049 1.00 0.00 C ATOM 1285 OD1 ASP A 81 6.036 -20.614 -8.926 1.00 0.00 O ATOM 1286 OD2 ASP A 81 4.876 -20.875 -10.796 1.00 0.00 O ATOM 0 H ASP A 81 6.439 -16.501 -11.582 1.00 0.00 H new ATOM 0 HA ASP A 81 4.349 -18.529 -11.613 1.00 0.00 H new ATOM 0 HB2 ASP A 81 6.863 -19.117 -11.458 1.00 0.00 H new ATOM 0 HB3 ASP A 81 6.843 -18.433 -9.845 1.00 0.00 H new ATOM 1291 N GLN A 82 4.523 -16.301 -9.310 1.00 0.00 N ATOM 1292 CA GLN A 82 3.873 -15.776 -8.108 1.00 0.00 C ATOM 1293 C GLN A 82 3.551 -14.278 -8.209 1.00 0.00 C ATOM 1294 O GLN A 82 4.157 -13.589 -9.036 1.00 0.00 O ATOM 1295 CB GLN A 82 4.815 -16.048 -6.919 1.00 0.00 C ATOM 1296 CG GLN A 82 6.310 -15.855 -7.232 1.00 0.00 C ATOM 1297 CD GLN A 82 7.094 -15.640 -5.940 1.00 0.00 C ATOM 1298 OE1 GLN A 82 7.282 -16.562 -5.150 1.00 0.00 O ATOM 1299 NE2 GLN A 82 7.504 -14.414 -5.666 1.00 0.00 N ATOM 0 H GLN A 82 5.149 -15.635 -9.762 1.00 0.00 H new ATOM 0 HA GLN A 82 2.913 -16.276 -7.977 1.00 0.00 H new ATOM 0 HB2 GLN A 82 4.541 -15.388 -6.096 1.00 0.00 H new ATOM 0 HB3 GLN A 82 4.658 -17.070 -6.574 1.00 0.00 H new ATOM 0 HG2 GLN A 82 6.695 -16.728 -7.759 1.00 0.00 H new ATOM 0 HG3 GLN A 82 6.443 -14.999 -7.894 1.00 0.00 H new ATOM 0 HE21 GLN A 82 7.340 -13.660 -6.333 1.00 0.00 H new ATOM 0 HE22 GLN A 82 7.985 -14.221 -4.787 1.00 0.00 H new ATOM 1308 N PRO A 83 2.610 -13.762 -7.395 1.00 0.00 N ATOM 1309 CA PRO A 83 2.226 -12.353 -7.396 1.00 0.00 C ATOM 1310 C PRO A 83 3.352 -11.459 -6.866 1.00 0.00 C ATOM 1311 O PRO A 83 4.125 -11.842 -5.990 1.00 0.00 O ATOM 1312 CB PRO A 83 0.965 -12.281 -6.542 1.00 0.00 C ATOM 1313 CG PRO A 83 1.152 -13.416 -5.545 1.00 0.00 C ATOM 1314 CD PRO A 83 1.831 -14.485 -6.392 1.00 0.00 C ATOM 0 HA PRO A 83 2.036 -11.982 -8.403 1.00 0.00 H new ATOM 0 HB2 PRO A 83 0.873 -11.317 -6.042 1.00 0.00 H new ATOM 0 HB3 PRO A 83 0.065 -12.416 -7.142 1.00 0.00 H new ATOM 0 HG2 PRO A 83 1.769 -13.116 -4.698 1.00 0.00 H new ATOM 0 HG3 PRO A 83 0.201 -13.762 -5.140 1.00 0.00 H new ATOM 0 HD2 PRO A 83 2.473 -15.119 -5.781 1.00 0.00 H new ATOM 0 HD3 PRO A 83 1.095 -15.137 -6.863 1.00 0.00 H new ATOM 1322 N THR A 84 3.421 -10.241 -7.395 1.00 0.00 N ATOM 1323 CA THR A 84 4.394 -9.216 -7.057 1.00 0.00 C ATOM 1324 C THR A 84 3.715 -7.846 -7.149 1.00 0.00 C ATOM 1325 O THR A 84 2.571 -7.745 -7.606 1.00 0.00 O ATOM 1326 CB THR A 84 5.601 -9.316 -8.011 1.00 0.00 C ATOM 1327 OG1 THR A 84 5.222 -9.062 -9.352 1.00 0.00 O ATOM 1328 CG2 THR A 84 6.305 -10.674 -7.956 1.00 0.00 C ATOM 0 H THR A 84 2.763 -9.929 -8.109 1.00 0.00 H new ATOM 0 HA THR A 84 4.762 -9.354 -6.040 1.00 0.00 H new ATOM 0 HB THR A 84 6.300 -8.555 -7.665 1.00 0.00 H new ATOM 0 HG1 THR A 84 4.275 -9.285 -9.472 1.00 0.00 H new ATOM 0 HG21 THR A 84 7.145 -10.677 -8.651 1.00 0.00 H new ATOM 0 HG22 THR A 84 6.670 -10.854 -6.945 1.00 0.00 H new ATOM 0 HG23 THR A 84 5.602 -11.460 -8.233 1.00 0.00 H new ATOM 1336 N LEU A 85 4.394 -6.792 -6.685 1.00 0.00 N ATOM 1337 CA LEU A 85 3.863 -5.436 -6.733 1.00 0.00 C ATOM 1338 C LEU A 85 4.129 -4.800 -8.097 1.00 0.00 C ATOM 1339 O LEU A 85 5.148 -5.086 -8.733 1.00 0.00 O ATOM 1340 CB LEU A 85 4.514 -4.559 -5.656 1.00 0.00 C ATOM 1341 CG LEU A 85 3.684 -4.397 -4.375 1.00 0.00 C ATOM 1342 CD1 LEU A 85 4.531 -3.661 -3.326 1.00 0.00 C ATOM 1343 CD2 LEU A 85 2.351 -3.678 -4.593 1.00 0.00 C ATOM 0 H LEU A 85 5.323 -6.859 -6.268 1.00 0.00 H new ATOM 0 HA LEU A 85 2.789 -5.500 -6.557 1.00 0.00 H new ATOM 0 HB2 LEU A 85 5.482 -4.987 -5.394 1.00 0.00 H new ATOM 0 HB3 LEU A 85 4.705 -3.572 -6.077 1.00 0.00 H new ATOM 0 HG LEU A 85 3.422 -5.396 -4.027 1.00 0.00 H new ATOM 0 HD11 LEU A 85 3.952 -3.540 -2.411 1.00 0.00 H new ATOM 0 HD12 LEU A 85 5.430 -4.240 -3.113 1.00 0.00 H new ATOM 0 HD13 LEU A 85 4.813 -2.680 -3.709 1.00 0.00 H new ATOM 0 HD21 LEU A 85 1.820 -3.600 -3.644 1.00 0.00 H new ATOM 0 HD22 LEU A 85 2.537 -2.679 -4.988 1.00 0.00 H new ATOM 0 HD23 LEU A 85 1.745 -4.242 -5.303 1.00 0.00 H new ATOM 1355 N GLN A 86 3.248 -3.882 -8.509 1.00 0.00 N ATOM 1356 CA GLN A 86 3.352 -3.154 -9.776 1.00 0.00 C ATOM 1357 C GLN A 86 2.838 -1.728 -9.603 1.00 0.00 C ATOM 1358 O GLN A 86 1.816 -1.337 -10.174 1.00 0.00 O ATOM 1359 CB GLN A 86 2.684 -3.933 -10.934 1.00 0.00 C ATOM 1360 CG GLN A 86 3.639 -4.969 -11.558 1.00 0.00 C ATOM 1361 CD GLN A 86 3.254 -5.315 -12.997 1.00 0.00 C ATOM 1362 OE1 GLN A 86 2.085 -5.365 -13.379 1.00 0.00 O ATOM 1363 NE2 GLN A 86 4.233 -5.482 -13.864 1.00 0.00 N ATOM 0 H GLN A 86 2.429 -3.620 -7.961 1.00 0.00 H new ATOM 0 HA GLN A 86 4.400 -3.072 -10.063 1.00 0.00 H new ATOM 0 HB2 GLN A 86 1.792 -4.439 -10.564 1.00 0.00 H new ATOM 0 HB3 GLN A 86 2.358 -3.232 -11.702 1.00 0.00 H new ATOM 0 HG2 GLN A 86 4.657 -4.580 -11.539 1.00 0.00 H new ATOM 0 HG3 GLN A 86 3.633 -5.876 -10.954 1.00 0.00 H new ATOM 0 HE21 GLN A 86 5.203 -5.441 -13.552 1.00 0.00 H new ATOM 0 HE22 GLN A 86 4.020 -5.652 -14.847 1.00 0.00 H new ATOM 1372 N LEU A 87 3.529 -0.946 -8.767 1.00 0.00 N ATOM 1373 CA LEU A 87 3.139 0.432 -8.535 1.00 0.00 C ATOM 1374 C LEU A 87 3.776 1.268 -9.605 1.00 0.00 C ATOM 1375 O LEU A 87 4.993 1.236 -9.713 1.00 0.00 O ATOM 1376 CB LEU A 87 3.545 1.033 -7.180 1.00 0.00 C ATOM 1377 CG LEU A 87 3.450 0.112 -5.962 1.00 0.00 C ATOM 1378 CD1 LEU A 87 4.735 -0.711 -5.781 1.00 0.00 C ATOM 1379 CD2 LEU A 87 3.095 0.961 -4.726 1.00 0.00 C ATOM 0 H LEU A 87 4.353 -1.248 -8.248 1.00 0.00 H new ATOM 0 HA LEU A 87 2.049 0.434 -8.544 1.00 0.00 H new ATOM 0 HB2 LEU A 87 4.573 1.387 -7.259 1.00 0.00 H new ATOM 0 HB3 LEU A 87 2.920 1.907 -6.995 1.00 0.00 H new ATOM 0 HG LEU A 87 2.657 -0.621 -6.109 1.00 0.00 H new ATOM 0 HD11 LEU A 87 4.635 -1.355 -4.907 1.00 0.00 H new ATOM 0 HD12 LEU A 87 4.902 -1.324 -6.666 1.00 0.00 H new ATOM 0 HD13 LEU A 87 5.581 -0.038 -5.641 1.00 0.00 H new ATOM 0 HD21 LEU A 87 3.024 0.316 -3.850 1.00 0.00 H new ATOM 0 HD22 LEU A 87 3.871 1.710 -4.564 1.00 0.00 H new ATOM 0 HD23 LEU A 87 2.139 1.458 -4.889 1.00 0.00 H new ATOM 1391 N LYS A 88 2.993 1.953 -10.429 1.00 0.00 N ATOM 1392 CA LYS A 88 3.588 2.809 -11.473 1.00 0.00 C ATOM 1393 C LYS A 88 2.547 3.664 -12.180 1.00 0.00 C ATOM 1394 O LYS A 88 2.757 4.861 -12.313 1.00 0.00 O ATOM 1395 CB LYS A 88 4.458 2.051 -12.500 1.00 0.00 C ATOM 1396 CG LYS A 88 3.865 0.782 -13.145 1.00 0.00 C ATOM 1397 CD LYS A 88 4.662 -0.469 -12.734 1.00 0.00 C ATOM 1398 CE LYS A 88 4.305 -1.738 -13.526 1.00 0.00 C ATOM 1399 NZ LYS A 88 4.721 -1.691 -14.946 1.00 0.00 N ATOM 0 H LYS A 88 1.973 1.942 -10.406 1.00 0.00 H new ATOM 0 HA LYS A 88 4.265 3.466 -10.928 1.00 0.00 H new ATOM 0 HB2 LYS A 88 4.714 2.746 -13.300 1.00 0.00 H new ATOM 0 HB3 LYS A 88 5.391 1.773 -12.009 1.00 0.00 H new ATOM 0 HG2 LYS A 88 2.823 0.669 -12.844 1.00 0.00 H new ATOM 0 HG3 LYS A 88 3.874 0.883 -14.230 1.00 0.00 H new ATOM 0 HD2 LYS A 88 5.725 -0.265 -12.859 1.00 0.00 H new ATOM 0 HD3 LYS A 88 4.496 -0.658 -11.674 1.00 0.00 H new ATOM 0 HE2 LYS A 88 4.774 -2.598 -13.048 1.00 0.00 H new ATOM 0 HE3 LYS A 88 3.227 -1.895 -13.477 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 4.360 -2.531 -15.441 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 4.336 -0.834 -15.392 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 5.759 -1.675 -15.003 1.00 0.00 H new ATOM 1413 N GLU A 89 1.396 3.087 -12.512 1.00 0.00 N ATOM 1414 CA GLU A 89 0.306 3.748 -13.227 1.00 0.00 C ATOM 1415 C GLU A 89 -1.021 3.433 -12.557 1.00 0.00 C ATOM 1416 O GLU A 89 -1.488 2.310 -12.696 1.00 0.00 O ATOM 1417 CB GLU A 89 0.327 3.227 -14.698 1.00 0.00 C ATOM 1418 CG GLU A 89 0.258 1.674 -14.827 1.00 0.00 C ATOM 1419 CD GLU A 89 0.964 1.063 -16.038 1.00 0.00 C ATOM 1420 OE1 GLU A 89 0.440 0.058 -16.549 1.00 0.00 O ATOM 1421 OE2 GLU A 89 2.125 1.462 -16.315 1.00 0.00 O ATOM 0 H GLU A 89 1.188 2.115 -12.284 1.00 0.00 H new ATOM 0 HA GLU A 89 0.430 4.831 -13.213 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -0.513 3.663 -15.238 1.00 0.00 H new ATOM 0 HB3 GLU A 89 1.236 3.581 -15.184 1.00 0.00 H new ATOM 0 HG2 GLU A 89 0.686 1.236 -13.925 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -0.791 1.379 -14.858 1.00 0.00 H new ATOM 1428 N LYS A 90 -1.612 4.327 -11.763 1.00 0.00 N ATOM 1429 CA LYS A 90 -2.898 4.027 -11.119 1.00 0.00 C ATOM 1430 C LYS A 90 -3.534 5.321 -10.613 1.00 0.00 C ATOM 1431 O LYS A 90 -2.859 6.346 -10.575 1.00 0.00 O ATOM 1432 CB LYS A 90 -2.663 3.026 -9.987 1.00 0.00 C ATOM 1433 CG LYS A 90 -3.136 1.592 -10.287 1.00 0.00 C ATOM 1434 CD LYS A 90 -2.160 0.598 -9.657 1.00 0.00 C ATOM 1435 CE LYS A 90 -0.767 0.547 -10.319 1.00 0.00 C ATOM 1436 NZ LYS A 90 -0.780 -0.082 -11.658 1.00 0.00 N ATOM 0 H LYS A 90 -1.232 5.249 -11.551 1.00 0.00 H new ATOM 0 HA LYS A 90 -3.589 3.580 -11.833 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -1.598 3.002 -9.757 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -3.174 3.383 -9.093 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -4.139 1.437 -9.890 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -3.192 1.432 -11.364 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -2.037 0.850 -8.604 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -2.602 -0.398 -9.697 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -0.375 1.561 -10.405 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -0.085 -0.005 -9.672 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 0.087 -0.642 -11.787 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -1.609 -0.704 -11.741 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -0.827 0.657 -12.388 1.00 0.00 H new ATOM 1450 N ASP A 91 -4.789 5.265 -10.156 1.00 0.00 N ATOM 1451 CA ASP A 91 -5.512 6.445 -9.683 1.00 0.00 C ATOM 1452 C ASP A 91 -6.412 6.184 -8.468 1.00 0.00 C ATOM 1453 O ASP A 91 -7.460 5.543 -8.580 1.00 0.00 O ATOM 1454 CB ASP A 91 -6.436 6.967 -10.795 1.00 0.00 C ATOM 1455 CG ASP A 91 -5.763 7.736 -11.913 1.00 0.00 C ATOM 1456 OD1 ASP A 91 -6.117 7.484 -13.101 1.00 0.00 O ATOM 1457 OD2 ASP A 91 -5.044 8.687 -11.599 1.00 0.00 O ATOM 0 H ASP A 91 -5.329 4.401 -10.104 1.00 0.00 H new ATOM 0 HA ASP A 91 -4.737 7.157 -9.398 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -6.962 6.118 -11.231 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -7.190 7.610 -10.341 1.00 0.00 H new ATOM 1462 N ILE A 92 -6.037 6.713 -7.298 1.00 0.00 N ATOM 1463 CA ILE A 92 -6.826 6.570 -6.064 1.00 0.00 C ATOM 1464 C ILE A 92 -8.117 7.399 -6.132 1.00 0.00 C ATOM 1465 O ILE A 92 -9.153 6.962 -5.626 1.00 0.00 O ATOM 1466 CB ILE A 92 -6.010 6.934 -4.789 1.00 0.00 C ATOM 1467 CG1 ILE A 92 -5.529 8.409 -4.820 1.00 0.00 C ATOM 1468 CG2 ILE A 92 -4.818 5.995 -4.540 1.00 0.00 C ATOM 1469 CD1 ILE A 92 -4.644 8.818 -3.647 1.00 0.00 C ATOM 0 H ILE A 92 -5.180 7.252 -7.177 1.00 0.00 H new ATOM 0 HA ILE A 92 -7.092 5.516 -5.987 1.00 0.00 H new ATOM 0 HB ILE A 92 -6.701 6.803 -3.956 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -4.981 8.578 -5.747 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -6.402 9.061 -4.843 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -4.293 6.305 -3.636 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -5.179 4.974 -4.418 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -4.136 6.040 -5.389 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -4.357 9.864 -3.755 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -5.192 8.686 -2.714 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -3.749 8.196 -3.632 1.00 0.00 H new ATOM 1481 N MET A 93 -8.066 8.586 -6.742 1.00 0.00 N ATOM 1482 CA MET A 93 -9.218 9.469 -6.863 1.00 0.00 C ATOM 1483 C MET A 93 -10.228 8.888 -7.836 1.00 0.00 C ATOM 1484 O MET A 93 -11.412 9.156 -7.672 1.00 0.00 O ATOM 1485 CB MET A 93 -8.825 10.894 -7.320 1.00 0.00 C ATOM 1486 CG MET A 93 -9.136 11.919 -6.233 1.00 0.00 C ATOM 1487 SD MET A 93 -8.150 11.706 -4.734 1.00 0.00 S ATOM 1488 CE MET A 93 -9.340 12.389 -3.553 1.00 0.00 C ATOM 0 H MET A 93 -7.217 8.959 -7.167 1.00 0.00 H new ATOM 0 HA MET A 93 -9.660 9.548 -5.870 1.00 0.00 H new ATOM 0 HB2 MET A 93 -7.762 10.923 -7.560 1.00 0.00 H new ATOM 0 HB3 MET A 93 -9.365 11.150 -8.232 1.00 0.00 H new ATOM 0 HG2 MET A 93 -8.967 12.920 -6.630 1.00 0.00 H new ATOM 0 HG3 MET A 93 -10.193 11.853 -5.975 1.00 0.00 H new ATOM 0 HE1 MET A 93 -9.046 12.114 -2.540 1.00 0.00 H new ATOM 0 HE2 MET A 93 -9.359 13.475 -3.643 1.00 0.00 H new ATOM 0 HE3 MET A 93 -10.332 11.990 -3.764 1.00 0.00 H new ATOM 1498 N ASP A 94 -9.786 8.111 -8.829 1.00 0.00 N ATOM 1499 CA ASP A 94 -10.687 7.523 -9.813 1.00 0.00 C ATOM 1500 C ASP A 94 -11.586 6.495 -9.140 1.00 0.00 C ATOM 1501 O ASP A 94 -12.808 6.587 -9.239 1.00 0.00 O ATOM 1502 CB ASP A 94 -9.896 6.931 -10.976 1.00 0.00 C ATOM 1503 CG ASP A 94 -10.844 6.666 -12.134 1.00 0.00 C ATOM 1504 OD1 ASP A 94 -11.106 5.481 -12.420 1.00 0.00 O ATOM 1505 OD2 ASP A 94 -11.364 7.654 -12.710 1.00 0.00 O ATOM 0 H ASP A 94 -8.803 7.876 -8.969 1.00 0.00 H new ATOM 0 HA ASP A 94 -11.329 8.299 -10.230 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -9.108 7.618 -11.284 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -9.409 6.005 -10.668 1.00 0.00 H new ATOM 1510 N LEU A 95 -10.989 5.574 -8.373 1.00 0.00 N ATOM 1511 CA LEU A 95 -11.753 4.551 -7.651 1.00 0.00 C ATOM 1512 C LEU A 95 -12.646 5.219 -6.604 1.00 0.00 C ATOM 1513 O LEU A 95 -13.697 4.702 -6.246 1.00 0.00 O ATOM 1514 CB LEU A 95 -10.824 3.573 -6.934 1.00 0.00 C ATOM 1515 CG LEU A 95 -9.839 2.788 -7.818 1.00 0.00 C ATOM 1516 CD1 LEU A 95 -9.238 1.648 -6.989 1.00 0.00 C ATOM 1517 CD2 LEU A 95 -10.451 2.172 -9.082 1.00 0.00 C ATOM 0 H LEU A 95 -9.980 5.517 -8.237 1.00 0.00 H new ATOM 0 HA LEU A 95 -12.354 4.007 -8.380 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -10.249 4.129 -6.193 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -11.438 2.857 -6.388 1.00 0.00 H new ATOM 0 HG LEU A 95 -9.099 3.515 -8.151 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -8.537 1.082 -7.603 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -8.714 2.062 -6.128 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -10.035 0.988 -6.646 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -9.679 1.640 -9.638 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -11.241 1.476 -8.801 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -10.869 2.962 -9.706 1.00 0.00 H new ATOM 1529 N TYR A 96 -12.209 6.357 -6.064 1.00 0.00 N ATOM 1530 CA TYR A 96 -13.012 7.087 -5.096 1.00 0.00 C ATOM 1531 C TYR A 96 -14.153 7.835 -5.819 1.00 0.00 C ATOM 1532 O TYR A 96 -15.195 8.093 -5.222 1.00 0.00 O ATOM 1533 CB TYR A 96 -12.145 8.055 -4.280 1.00 0.00 C ATOM 1534 CG TYR A 96 -12.913 8.687 -3.134 1.00 0.00 C ATOM 1535 CD1 TYR A 96 -13.075 7.983 -1.925 1.00 0.00 C ATOM 1536 CD2 TYR A 96 -13.549 9.932 -3.309 1.00 0.00 C ATOM 1537 CE1 TYR A 96 -13.843 8.530 -0.884 1.00 0.00 C ATOM 1538 CE2 TYR A 96 -14.366 10.457 -2.293 1.00 0.00 C ATOM 1539 CZ TYR A 96 -14.509 9.760 -1.069 1.00 0.00 C ATOM 1540 OH TYR A 96 -15.297 10.242 -0.072 1.00 0.00 O ATOM 0 H TYR A 96 -11.310 6.787 -6.281 1.00 0.00 H new ATOM 0 HA TYR A 96 -13.451 6.375 -4.397 1.00 0.00 H new ATOM 0 HB2 TYR A 96 -11.281 7.521 -3.885 1.00 0.00 H new ATOM 0 HB3 TYR A 96 -11.763 8.838 -4.935 1.00 0.00 H new ATOM 0 HD1 TYR A 96 -12.607 7.018 -1.798 1.00 0.00 H new ATOM 0 HD2 TYR A 96 -13.408 10.484 -4.226 1.00 0.00 H new ATOM 0 HE1 TYR A 96 -13.924 8.009 0.058 1.00 0.00 H new ATOM 0 HE2 TYR A 96 -14.885 11.392 -2.446 1.00 0.00 H new ATOM 0 HH TYR A 96 -15.687 11.098 -0.348 1.00 0.00 H new ATOM 1550 N ASN A 97 -13.982 8.195 -7.096 1.00 0.00 N ATOM 1551 CA ASN A 97 -14.986 8.923 -7.870 1.00 0.00 C ATOM 1552 C ASN A 97 -16.018 8.030 -8.556 1.00 0.00 C ATOM 1553 O ASN A 97 -17.144 8.493 -8.734 1.00 0.00 O ATOM 1554 CB ASN A 97 -14.308 9.809 -8.928 1.00 0.00 C ATOM 1555 CG ASN A 97 -15.288 10.801 -9.552 1.00 0.00 C ATOM 1556 OD1 ASN A 97 -16.013 11.481 -8.836 1.00 0.00 O ATOM 1557 ND2 ASN A 97 -15.279 10.980 -10.859 1.00 0.00 N ATOM 0 H ASN A 97 -13.134 7.986 -7.623 1.00 0.00 H new ATOM 0 HA ASN A 97 -15.527 9.529 -7.143 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -13.482 10.354 -8.470 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -13.881 9.180 -9.709 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -15.879 11.689 -11.281 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -14.672 10.409 -11.448 1.00 0.00 H new ATOM 1564 N GLN A 98 -15.716 6.779 -8.925 1.00 0.00 N ATOM 1565 CA GLN A 98 -16.660 5.898 -9.597 1.00 0.00 C ATOM 1566 C GLN A 98 -16.734 4.547 -8.892 1.00 0.00 C ATOM 1567 O GLN A 98 -15.904 4.262 -8.031 1.00 0.00 O ATOM 1568 CB GLN A 98 -16.290 5.753 -11.093 1.00 0.00 C ATOM 1569 CG GLN A 98 -14.847 6.013 -11.565 1.00 0.00 C ATOM 1570 CD GLN A 98 -14.763 6.104 -13.092 1.00 0.00 C ATOM 1571 OE1 GLN A 98 -15.611 5.627 -13.838 1.00 0.00 O ATOM 1572 NE2 GLN A 98 -13.829 6.858 -13.634 1.00 0.00 N ATOM 0 H GLN A 98 -14.803 6.354 -8.762 1.00 0.00 H new ATOM 0 HA GLN A 98 -17.655 6.341 -9.546 1.00 0.00 H new ATOM 0 HB2 GLN A 98 -16.550 4.738 -11.393 1.00 0.00 H new ATOM 0 HB3 GLN A 98 -16.939 6.426 -11.653 1.00 0.00 H new ATOM 0 HG2 GLN A 98 -14.480 6.940 -11.124 1.00 0.00 H new ATOM 0 HG3 GLN A 98 -14.198 5.212 -11.211 1.00 0.00 H new ATOM 0 HE21 GLN A 98 -13.105 7.274 -13.048 1.00 0.00 H new ATOM 0 HE22 GLN A 98 -13.830 7.026 -14.640 1.00 0.00 H new ATOM 1581 N PRO A 99 -17.759 3.726 -9.173 1.00 0.00 N ATOM 1582 CA PRO A 99 -17.848 2.415 -8.572 1.00 0.00 C ATOM 1583 C PRO A 99 -16.803 1.518 -9.279 1.00 0.00 C ATOM 1584 O PRO A 99 -15.863 1.972 -9.938 1.00 0.00 O ATOM 1585 CB PRO A 99 -19.314 2.001 -8.794 1.00 0.00 C ATOM 1586 CG PRO A 99 -19.659 2.637 -10.137 1.00 0.00 C ATOM 1587 CD PRO A 99 -18.832 3.918 -10.145 1.00 0.00 C ATOM 0 HA PRO A 99 -17.622 2.353 -7.507 1.00 0.00 H new ATOM 0 HB2 PRO A 99 -19.426 0.917 -8.822 1.00 0.00 H new ATOM 0 HB3 PRO A 99 -19.961 2.368 -7.997 1.00 0.00 H new ATOM 0 HG2 PRO A 99 -19.397 1.984 -10.970 1.00 0.00 H new ATOM 0 HG3 PRO A 99 -20.725 2.847 -10.220 1.00 0.00 H new ATOM 0 HD2 PRO A 99 -18.426 4.111 -11.138 1.00 0.00 H new ATOM 0 HD3 PRO A 99 -19.447 4.778 -9.879 1.00 0.00 H new ATOM 1595 N GLU A 100 -17.000 0.214 -9.131 1.00 0.00 N ATOM 1596 CA GLU A 100 -16.194 -0.868 -9.691 1.00 0.00 C ATOM 1597 C GLU A 100 -14.902 -1.036 -8.871 1.00 0.00 C ATOM 1598 O GLU A 100 -13.814 -0.701 -9.334 1.00 0.00 O ATOM 1599 CB GLU A 100 -15.979 -0.739 -11.220 1.00 0.00 C ATOM 1600 CG GLU A 100 -17.240 -0.296 -11.986 1.00 0.00 C ATOM 1601 CD GLU A 100 -17.488 -1.101 -13.274 1.00 0.00 C ATOM 1602 OE1 GLU A 100 -17.719 -2.338 -13.192 1.00 0.00 O ATOM 1603 OE2 GLU A 100 -17.580 -0.472 -14.356 1.00 0.00 O ATOM 0 H GLU A 100 -17.780 -0.142 -8.579 1.00 0.00 H new ATOM 0 HA GLU A 100 -16.750 -1.801 -9.599 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -15.180 -0.021 -11.407 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -15.644 -1.699 -11.613 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -18.107 -0.395 -11.332 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -17.150 0.761 -12.238 1.00 0.00 H new ATOM 1610 N PRO A 101 -14.994 -1.547 -7.625 1.00 0.00 N ATOM 1611 CA PRO A 101 -13.827 -1.758 -6.776 1.00 0.00 C ATOM 1612 C PRO A 101 -12.898 -2.785 -7.420 1.00 0.00 C ATOM 1613 O PRO A 101 -13.205 -3.984 -7.402 1.00 0.00 O ATOM 1614 CB PRO A 101 -14.368 -2.284 -5.454 1.00 0.00 C ATOM 1615 CG PRO A 101 -15.749 -2.831 -5.768 1.00 0.00 C ATOM 1616 CD PRO A 101 -16.209 -1.974 -6.942 1.00 0.00 C ATOM 0 HA PRO A 101 -13.253 -0.842 -6.634 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -13.721 -3.062 -5.047 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -14.421 -1.491 -4.708 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -15.712 -3.888 -6.032 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -16.421 -2.739 -4.915 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -16.854 -2.543 -7.612 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -16.785 -1.116 -6.597 1.00 0.00 H new ATOM 1624 N VAL A 102 -11.758 -2.342 -7.946 1.00 0.00 N ATOM 1625 CA VAL A 102 -10.810 -3.224 -8.600 1.00 0.00 C ATOM 1626 C VAL A 102 -9.979 -3.898 -7.514 1.00 0.00 C ATOM 1627 O VAL A 102 -8.969 -3.359 -7.059 1.00 0.00 O ATOM 1628 CB VAL A 102 -9.964 -2.461 -9.645 1.00 0.00 C ATOM 1629 CG1 VAL A 102 -9.150 -3.439 -10.501 1.00 0.00 C ATOM 1630 CG2 VAL A 102 -10.831 -1.611 -10.591 1.00 0.00 C ATOM 0 H VAL A 102 -11.471 -1.363 -7.928 1.00 0.00 H new ATOM 0 HA VAL A 102 -11.324 -3.997 -9.171 1.00 0.00 H new ATOM 0 HB VAL A 102 -9.305 -1.802 -9.080 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -8.562 -2.882 -11.230 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -8.483 -4.015 -9.860 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -9.826 -4.116 -11.022 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -10.191 -1.095 -11.306 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -11.526 -2.257 -11.127 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -11.391 -0.878 -10.011 1.00 0.00 H new ATOM 1640 N LYS A 103 -10.418 -5.074 -7.059 1.00 0.00 N ATOM 1641 CA LYS A 103 -9.771 -5.862 -6.020 1.00 0.00 C ATOM 1642 C LYS A 103 -8.276 -6.032 -6.248 1.00 0.00 C ATOM 1643 O LYS A 103 -7.556 -6.058 -5.258 1.00 0.00 O ATOM 1644 CB LYS A 103 -10.434 -7.235 -5.909 1.00 0.00 C ATOM 1645 CG LYS A 103 -11.912 -7.181 -5.502 1.00 0.00 C ATOM 1646 CD LYS A 103 -12.381 -8.506 -4.867 1.00 0.00 C ATOM 1647 CE LYS A 103 -13.646 -9.099 -5.490 1.00 0.00 C ATOM 1648 NZ LYS A 103 -14.836 -8.227 -5.406 1.00 0.00 N ATOM 0 H LYS A 103 -11.264 -5.515 -7.420 1.00 0.00 H new ATOM 0 HA LYS A 103 -9.894 -5.310 -5.088 1.00 0.00 H new ATOM 0 HB2 LYS A 103 -10.350 -7.747 -6.868 1.00 0.00 H new ATOM 0 HB3 LYS A 103 -9.888 -7.833 -5.179 1.00 0.00 H new ATOM 0 HG2 LYS A 103 -12.065 -6.365 -4.795 1.00 0.00 H new ATOM 0 HG3 LYS A 103 -12.522 -6.962 -6.378 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -11.576 -9.237 -4.947 1.00 0.00 H new ATOM 0 HD3 LYS A 103 -12.558 -8.341 -3.804 1.00 0.00 H new ATOM 0 HE2 LYS A 103 -13.449 -9.324 -6.538 1.00 0.00 H new ATOM 0 HE3 LYS A 103 -13.869 -10.046 -4.998 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 -15.598 -8.622 -5.993 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 -15.155 -8.169 -4.418 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 -14.594 -7.275 -5.748 1.00 0.00 H new ATOM 1662 N SER A 104 -7.809 -6.092 -7.497 1.00 0.00 N ATOM 1663 CA SER A 104 -6.400 -6.242 -7.842 1.00 0.00 C ATOM 1664 C SER A 104 -5.524 -5.071 -7.370 1.00 0.00 C ATOM 1665 O SER A 104 -4.293 -5.186 -7.386 1.00 0.00 O ATOM 1666 CB SER A 104 -6.273 -6.430 -9.356 1.00 0.00 C ATOM 1667 OG SER A 104 -7.098 -7.490 -9.812 1.00 0.00 O ATOM 0 H SER A 104 -8.418 -6.036 -8.314 1.00 0.00 H new ATOM 0 HA SER A 104 -6.029 -7.121 -7.315 1.00 0.00 H new ATOM 0 HB2 SER A 104 -6.549 -5.506 -9.864 1.00 0.00 H new ATOM 0 HB3 SER A 104 -5.234 -6.637 -9.614 1.00 0.00 H new ATOM 0 HG SER A 104 -6.999 -7.587 -10.782 1.00 0.00 H new ATOM 1673 N PHE A 105 -6.142 -3.948 -6.983 1.00 0.00 N ATOM 1674 CA PHE A 105 -5.479 -2.749 -6.493 1.00 0.00 C ATOM 1675 C PHE A 105 -5.847 -2.485 -5.026 1.00 0.00 C ATOM 1676 O PHE A 105 -5.124 -1.756 -4.348 1.00 0.00 O ATOM 1677 CB PHE A 105 -5.869 -1.520 -7.343 1.00 0.00 C ATOM 1678 CG PHE A 105 -5.938 -1.623 -8.859 1.00 0.00 C ATOM 1679 CD1 PHE A 105 -6.665 -0.647 -9.571 1.00 0.00 C ATOM 1680 CD2 PHE A 105 -5.247 -2.618 -9.577 1.00 0.00 C ATOM 1681 CE1 PHE A 105 -6.723 -0.682 -10.973 1.00 0.00 C ATOM 1682 CE2 PHE A 105 -5.342 -2.685 -10.974 1.00 0.00 C ATOM 1683 CZ PHE A 105 -6.065 -1.708 -11.669 1.00 0.00 C ATOM 0 H PHE A 105 -7.157 -3.854 -7.006 1.00 0.00 H new ATOM 0 HA PHE A 105 -4.404 -2.912 -6.571 1.00 0.00 H new ATOM 0 HB2 PHE A 105 -6.848 -1.187 -6.998 1.00 0.00 H new ATOM 0 HB3 PHE A 105 -5.160 -0.726 -7.106 1.00 0.00 H new ATOM 0 HD1 PHE A 105 -7.182 0.134 -9.033 1.00 0.00 H new ATOM 0 HD2 PHE A 105 -4.639 -3.336 -9.047 1.00 0.00 H new ATOM 0 HE1 PHE A 105 -7.271 0.076 -11.513 1.00 0.00 H new ATOM 0 HE2 PHE A 105 -4.859 -3.487 -11.512 1.00 0.00 H new ATOM 0 HZ PHE A 105 -6.117 -1.744 -12.747 1.00 0.00 H new ATOM 1693 N LEU A 106 -6.962 -3.037 -4.527 1.00 0.00 N ATOM 1694 CA LEU A 106 -7.421 -2.841 -3.154 1.00 0.00 C ATOM 1695 C LEU A 106 -6.679 -3.759 -2.185 1.00 0.00 C ATOM 1696 O LEU A 106 -6.238 -4.854 -2.558 1.00 0.00 O ATOM 1697 CB LEU A 106 -8.940 -3.059 -3.040 1.00 0.00 C ATOM 1698 CG LEU A 106 -9.834 -2.218 -3.971 1.00 0.00 C ATOM 1699 CD1 LEU A 106 -11.293 -2.412 -3.567 1.00 0.00 C ATOM 1700 CD2 LEU A 106 -9.479 -0.729 -3.967 1.00 0.00 C ATOM 0 H LEU A 106 -7.575 -3.639 -5.077 1.00 0.00 H new ATOM 0 HA LEU A 106 -7.201 -1.809 -2.882 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -9.147 -4.112 -3.230 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -9.236 -2.857 -2.011 1.00 0.00 H new ATOM 0 HG LEU A 106 -9.666 -2.568 -4.989 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -11.933 -1.820 -4.221 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -11.558 -3.465 -3.656 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -11.431 -2.089 -2.535 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -10.146 -0.194 -4.643 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -9.590 -0.331 -2.958 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -8.448 -0.600 -4.297 1.00 0.00 H new ATOM 1712 N PHE A 107 -6.594 -3.342 -0.915 1.00 0.00 N ATOM 1713 CA PHE A 107 -5.904 -4.111 0.122 1.00 0.00 C ATOM 1714 C PHE A 107 -6.646 -4.036 1.453 1.00 0.00 C ATOM 1715 O PHE A 107 -7.152 -2.976 1.823 1.00 0.00 O ATOM 1716 CB PHE A 107 -4.454 -3.626 0.281 1.00 0.00 C ATOM 1717 CG PHE A 107 -3.553 -3.909 -0.909 1.00 0.00 C ATOM 1718 CD1 PHE A 107 -3.579 -3.053 -2.020 1.00 0.00 C ATOM 1719 CD2 PHE A 107 -2.702 -5.028 -0.930 1.00 0.00 C ATOM 1720 CE1 PHE A 107 -2.800 -3.330 -3.155 1.00 0.00 C ATOM 1721 CE2 PHE A 107 -1.933 -5.316 -2.072 1.00 0.00 C ATOM 1722 CZ PHE A 107 -1.972 -4.458 -3.182 1.00 0.00 C ATOM 0 H PHE A 107 -7.000 -2.468 -0.582 1.00 0.00 H new ATOM 0 HA PHE A 107 -5.887 -5.155 -0.192 1.00 0.00 H new ATOM 0 HB2 PHE A 107 -4.463 -2.552 0.464 1.00 0.00 H new ATOM 0 HB3 PHE A 107 -4.023 -4.096 1.165 1.00 0.00 H new ATOM 0 HD1 PHE A 107 -4.204 -2.172 -2.002 1.00 0.00 H new ATOM 0 HD2 PHE A 107 -2.638 -5.670 -0.064 1.00 0.00 H new ATOM 0 HE1 PHE A 107 -2.840 -2.671 -4.010 1.00 0.00 H new ATOM 0 HE2 PHE A 107 -1.311 -6.199 -2.095 1.00 0.00 H new ATOM 0 HZ PHE A 107 -1.367 -4.667 -4.052 1.00 0.00 H new ATOM 1732 N TYR A 108 -6.739 -5.151 2.175 1.00 0.00 N ATOM 1733 CA TYR A 108 -7.383 -5.244 3.475 1.00 0.00 C ATOM 1734 C TYR A 108 -6.381 -4.752 4.504 1.00 0.00 C ATOM 1735 O TYR A 108 -5.207 -5.129 4.473 1.00 0.00 O ATOM 1736 CB TYR A 108 -7.797 -6.676 3.802 1.00 0.00 C ATOM 1737 CG TYR A 108 -8.970 -7.196 3.001 1.00 0.00 C ATOM 1738 CD1 TYR A 108 -8.778 -8.269 2.120 1.00 0.00 C ATOM 1739 CD2 TYR A 108 -10.255 -6.634 3.151 1.00 0.00 C ATOM 1740 CE1 TYR A 108 -9.848 -8.750 1.354 1.00 0.00 C ATOM 1741 CE2 TYR A 108 -11.333 -7.109 2.379 1.00 0.00 C ATOM 1742 CZ TYR A 108 -11.119 -8.158 1.457 1.00 0.00 C ATOM 1743 OH TYR A 108 -12.115 -8.573 0.632 1.00 0.00 O ATOM 0 H TYR A 108 -6.354 -6.041 1.857 1.00 0.00 H new ATOM 0 HA TYR A 108 -8.292 -4.643 3.477 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -6.943 -7.333 3.637 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -8.044 -6.735 4.862 1.00 0.00 H new ATOM 0 HD1 TYR A 108 -7.803 -8.726 2.031 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -10.413 -5.836 3.861 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -9.696 -9.580 0.680 1.00 0.00 H new ATOM 0 HE2 TYR A 108 -12.316 -6.675 2.491 1.00 0.00 H new ATOM 0 HH TYR A 108 -11.978 -9.516 0.402 1.00 0.00 H new ATOM 1753 N HIS A 109 -6.831 -3.861 5.375 1.00 0.00 N ATOM 1754 CA HIS A 109 -6.067 -3.262 6.441 1.00 0.00 C ATOM 1755 C HIS A 109 -6.271 -4.107 7.688 1.00 0.00 C ATOM 1756 O HIS A 109 -7.415 -4.264 8.124 1.00 0.00 O ATOM 1757 CB HIS A 109 -6.578 -1.831 6.707 1.00 0.00 C ATOM 1758 CG HIS A 109 -5.507 -0.808 6.900 1.00 0.00 C ATOM 1759 ND1 HIS A 109 -5.546 0.469 6.399 1.00 0.00 N ATOM 1760 CD2 HIS A 109 -4.395 -0.929 7.686 1.00 0.00 C ATOM 1761 CE1 HIS A 109 -4.458 1.100 6.845 1.00 0.00 C ATOM 1762 NE2 HIS A 109 -3.749 0.310 7.671 1.00 0.00 N ATOM 0 H HIS A 109 -7.793 -3.523 5.349 1.00 0.00 H new ATOM 0 HA HIS A 109 -5.012 -3.216 6.172 1.00 0.00 H new ATOM 0 HB2 HIS A 109 -7.207 -1.524 5.872 1.00 0.00 H new ATOM 0 HB3 HIS A 109 -7.211 -1.846 7.594 1.00 0.00 H new ATOM 0 HD2 HIS A 109 -4.076 -1.814 8.217 1.00 0.00 H new ATOM 0 HE1 HIS A 109 -4.183 2.110 6.578 1.00 0.00 H new ATOM 0 HE2 HIS A 109 -2.906 0.565 8.185 1.00 0.00 H new ATOM 1770 N SER A 110 -5.190 -4.655 8.232 1.00 0.00 N ATOM 1771 CA SER A 110 -5.223 -5.445 9.452 1.00 0.00 C ATOM 1772 C SER A 110 -4.268 -4.792 10.444 1.00 0.00 C ATOM 1773 O SER A 110 -3.846 -3.642 10.251 1.00 0.00 O ATOM 1774 CB SER A 110 -4.929 -6.930 9.207 1.00 0.00 C ATOM 1775 OG SER A 110 -5.564 -7.670 10.236 1.00 0.00 O ATOM 0 H SER A 110 -4.257 -4.561 7.832 1.00 0.00 H new ATOM 0 HA SER A 110 -6.230 -5.449 9.869 1.00 0.00 H new ATOM 0 HB2 SER A 110 -5.301 -7.237 8.230 1.00 0.00 H new ATOM 0 HB3 SER A 110 -3.854 -7.113 9.211 1.00 0.00 H new ATOM 0 HG SER A 110 -5.394 -8.626 10.104 1.00 0.00 H new ATOM 1781 N GLN A 111 -4.038 -5.462 11.567 1.00 0.00 N ATOM 1782 CA GLN A 111 -3.149 -5.015 12.613 1.00 0.00 C ATOM 1783 C GLN A 111 -2.650 -6.222 13.368 1.00 0.00 C ATOM 1784 O GLN A 111 -3.424 -7.104 13.762 1.00 0.00 O ATOM 1785 CB GLN A 111 -3.749 -3.950 13.538 1.00 0.00 C ATOM 1786 CG GLN A 111 -5.258 -4.105 13.772 1.00 0.00 C ATOM 1787 CD GLN A 111 -5.672 -3.318 15.005 1.00 0.00 C ATOM 1788 OE1 GLN A 111 -5.666 -2.093 15.008 1.00 0.00 O ATOM 1789 NE2 GLN A 111 -5.979 -3.980 16.104 1.00 0.00 N ATOM 0 H GLN A 111 -4.482 -6.357 11.773 1.00 0.00 H new ATOM 0 HA GLN A 111 -2.311 -4.501 12.143 1.00 0.00 H new ATOM 0 HB2 GLN A 111 -3.237 -3.988 14.499 1.00 0.00 H new ATOM 0 HB3 GLN A 111 -3.557 -2.965 13.113 1.00 0.00 H new ATOM 0 HG2 GLN A 111 -5.809 -3.750 12.901 1.00 0.00 H new ATOM 0 HG3 GLN A 111 -5.509 -5.158 13.900 1.00 0.00 H new ATOM 0 HE21 GLN A 111 -5.984 -5.000 16.100 1.00 0.00 H new ATOM 0 HE22 GLN A 111 -6.212 -3.472 16.957 1.00 0.00 H new ATOM 1798 N SER A 112 -1.357 -6.202 13.638 1.00 0.00 N ATOM 1799 CA SER A 112 -0.643 -7.266 14.294 1.00 0.00 C ATOM 1800 C SER A 112 0.292 -6.708 15.377 1.00 0.00 C ATOM 1801 O SER A 112 1.511 -6.721 15.252 1.00 0.00 O ATOM 1802 CB SER A 112 -0.009 -8.158 13.193 1.00 0.00 C ATOM 1803 OG SER A 112 -0.653 -8.093 11.912 1.00 0.00 O ATOM 0 H SER A 112 -0.760 -5.412 13.395 1.00 0.00 H new ATOM 0 HA SER A 112 -1.294 -7.925 14.868 1.00 0.00 H new ATOM 0 HB2 SER A 112 1.036 -7.872 13.072 1.00 0.00 H new ATOM 0 HB3 SER A 112 -0.019 -9.193 13.535 1.00 0.00 H new ATOM 0 HG SER A 112 -0.188 -8.682 11.282 1.00 0.00 H new ATOM 1809 N GLY A 113 -0.289 -6.192 16.466 1.00 0.00 N ATOM 1810 CA GLY A 113 0.462 -5.654 17.596 1.00 0.00 C ATOM 1811 C GLY A 113 0.870 -4.205 17.421 1.00 0.00 C ATOM 1812 O GLY A 113 2.057 -3.924 17.298 1.00 0.00 O ATOM 0 H GLY A 113 -1.301 -6.138 16.585 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -0.142 -5.746 18.499 1.00 0.00 H new ATOM 0 HA3 GLY A 113 1.356 -6.258 17.748 1.00 0.00 H new ATOM 1816 N ARG A 114 -0.096 -3.283 17.465 1.00 0.00 N ATOM 1817 CA ARG A 114 0.036 -1.823 17.319 1.00 0.00 C ATOM 1818 C ARG A 114 0.454 -1.403 15.923 1.00 0.00 C ATOM 1819 O ARG A 114 0.384 -0.220 15.589 1.00 0.00 O ATOM 1820 CB ARG A 114 0.970 -1.179 18.373 1.00 0.00 C ATOM 1821 CG ARG A 114 0.318 -1.058 19.758 1.00 0.00 C ATOM 1822 CD ARG A 114 0.907 -1.971 20.837 1.00 0.00 C ATOM 1823 NE ARG A 114 2.135 -1.413 21.423 1.00 0.00 N ATOM 1824 CZ ARG A 114 2.708 -1.821 22.563 1.00 0.00 C ATOM 1825 NH1 ARG A 114 2.182 -2.802 23.294 1.00 0.00 N ATOM 1826 NH2 ARG A 114 3.825 -1.245 22.982 1.00 0.00 N ATOM 0 H ARG A 114 -1.068 -3.555 17.615 1.00 0.00 H new ATOM 0 HA ARG A 114 -0.970 -1.443 17.498 1.00 0.00 H new ATOM 0 HB2 ARG A 114 1.879 -1.774 18.456 1.00 0.00 H new ATOM 0 HB3 ARG A 114 1.268 -0.188 18.030 1.00 0.00 H new ATOM 0 HG2 ARG A 114 0.403 -0.024 20.093 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -0.746 -1.275 19.662 1.00 0.00 H new ATOM 0 HD2 ARG A 114 0.168 -2.126 21.623 1.00 0.00 H new ATOM 0 HD3 ARG A 114 1.123 -2.949 20.406 1.00 0.00 H new ATOM 0 HE ARG A 114 2.589 -0.651 20.919 1.00 0.00 H new ATOM 0 HH11 ARG A 114 1.324 -3.261 22.989 1.00 0.00 H new ATOM 0 HH12 ARG A 114 2.638 -3.094 24.158 1.00 0.00 H new ATOM 0 HH21 ARG A 114 4.246 -0.493 22.437 1.00 0.00 H new ATOM 0 HH22 ARG A 114 4.264 -1.554 23.850 1.00 0.00 H new ATOM 1840 N ASN A 115 0.844 -2.364 15.107 1.00 0.00 N ATOM 1841 CA ASN A 115 1.290 -2.145 13.745 1.00 0.00 C ATOM 1842 C ASN A 115 0.216 -2.638 12.799 1.00 0.00 C ATOM 1843 O ASN A 115 -0.454 -3.613 13.128 1.00 0.00 O ATOM 1844 CB ASN A 115 2.649 -2.828 13.526 1.00 0.00 C ATOM 1845 CG ASN A 115 3.802 -2.029 14.131 1.00 0.00 C ATOM 1846 OD1 ASN A 115 4.591 -2.521 14.924 1.00 0.00 O ATOM 1847 ND2 ASN A 115 3.905 -0.744 13.834 1.00 0.00 N ATOM 0 H ASN A 115 0.859 -3.346 15.382 1.00 0.00 H new ATOM 0 HA ASN A 115 1.443 -1.084 13.547 1.00 0.00 H new ATOM 0 HB2 ASN A 115 2.628 -3.824 13.968 1.00 0.00 H new ATOM 0 HB3 ASN A 115 2.820 -2.957 12.457 1.00 0.00 H new ATOM 0 HD21 ASN A 115 4.636 -0.178 14.265 1.00 0.00 H new ATOM 0 HD22 ASN A 115 3.254 -0.319 13.174 1.00 0.00 H new ATOM 1854 N SER A 116 0.012 -1.965 11.665 1.00 0.00 N ATOM 1855 CA SER A 116 -0.989 -2.344 10.671 1.00 0.00 C ATOM 1856 C SER A 116 -0.342 -3.064 9.494 1.00 0.00 C ATOM 1857 O SER A 116 0.806 -2.779 9.154 1.00 0.00 O ATOM 1858 CB SER A 116 -1.818 -1.134 10.238 1.00 0.00 C ATOM 1859 OG SER A 116 -3.039 -1.122 10.958 1.00 0.00 O ATOM 0 H SER A 116 0.544 -1.133 11.410 1.00 0.00 H new ATOM 0 HA SER A 116 -1.682 -3.050 11.129 1.00 0.00 H new ATOM 0 HB2 SER A 116 -1.264 -0.214 10.423 1.00 0.00 H new ATOM 0 HB3 SER A 116 -2.014 -1.178 9.167 1.00 0.00 H new ATOM 0 HG SER A 116 -3.511 -1.969 10.816 1.00 0.00 H new ATOM 1865 N THR A 117 -1.119 -3.950 8.868 1.00 0.00 N ATOM 1866 CA THR A 117 -0.739 -4.794 7.740 1.00 0.00 C ATOM 1867 C THR A 117 -1.613 -4.474 6.525 1.00 0.00 C ATOM 1868 O THR A 117 -2.664 -3.831 6.658 1.00 0.00 O ATOM 1869 CB THR A 117 -0.823 -6.293 8.144 1.00 0.00 C ATOM 1870 OG1 THR A 117 -1.429 -6.498 9.421 1.00 0.00 O ATOM 1871 CG2 THR A 117 0.562 -6.938 8.127 1.00 0.00 C ATOM 0 H THR A 117 -2.086 -4.104 9.154 1.00 0.00 H new ATOM 0 HA THR A 117 0.294 -4.588 7.461 1.00 0.00 H new ATOM 0 HB THR A 117 -1.463 -6.768 7.401 1.00 0.00 H new ATOM 0 HG1 THR A 117 -0.871 -7.101 9.955 1.00 0.00 H new ATOM 0 HG21 THR A 117 0.479 -7.987 8.413 1.00 0.00 H new ATOM 0 HG22 THR A 117 0.984 -6.868 7.124 1.00 0.00 H new ATOM 0 HG23 THR A 117 1.213 -6.421 8.832 1.00 0.00 H new ATOM 1879 N PHE A 118 -1.211 -4.967 5.346 1.00 0.00 N ATOM 1880 CA PHE A 118 -1.886 -4.741 4.083 1.00 0.00 C ATOM 1881 C PHE A 118 -1.876 -6.049 3.315 1.00 0.00 C ATOM 1882 O PHE A 118 -0.790 -6.563 3.049 1.00 0.00 O ATOM 1883 CB PHE A 118 -1.130 -3.651 3.322 1.00 0.00 C ATOM 1884 CG PHE A 118 -0.802 -2.417 4.142 1.00 0.00 C ATOM 1885 CD1 PHE A 118 -1.762 -1.410 4.316 1.00 0.00 C ATOM 1886 CD2 PHE A 118 0.472 -2.274 4.729 1.00 0.00 C ATOM 1887 CE1 PHE A 118 -1.446 -0.249 5.036 1.00 0.00 C ATOM 1888 CE2 PHE A 118 0.802 -1.097 5.418 1.00 0.00 C ATOM 1889 CZ PHE A 118 -0.153 -0.077 5.555 1.00 0.00 C ATOM 0 H PHE A 118 -0.380 -5.551 5.254 1.00 0.00 H new ATOM 0 HA PHE A 118 -2.917 -4.415 4.225 1.00 0.00 H new ATOM 0 HB2 PHE A 118 -0.201 -4.073 2.938 1.00 0.00 H new ATOM 0 HB3 PHE A 118 -1.724 -3.350 2.459 1.00 0.00 H new ATOM 0 HD1 PHE A 118 -2.749 -1.529 3.894 1.00 0.00 H new ATOM 0 HD2 PHE A 118 1.195 -3.072 4.648 1.00 0.00 H new ATOM 0 HE1 PHE A 118 -2.196 0.512 5.191 1.00 0.00 H new ATOM 0 HE2 PHE A 118 1.788 -0.976 5.842 1.00 0.00 H new ATOM 0 HZ PHE A 118 0.107 0.841 6.060 1.00 0.00 H new ATOM 1899 N GLU A 119 -3.054 -6.601 3.013 1.00 0.00 N ATOM 1900 CA GLU A 119 -3.208 -7.863 2.296 1.00 0.00 C ATOM 1901 C GLU A 119 -4.004 -7.647 1.011 1.00 0.00 C ATOM 1902 O GLU A 119 -5.074 -7.042 1.042 1.00 0.00 O ATOM 1903 CB GLU A 119 -3.942 -8.885 3.174 1.00 0.00 C ATOM 1904 CG GLU A 119 -3.826 -10.303 2.595 1.00 0.00 C ATOM 1905 CD GLU A 119 -4.923 -11.241 3.088 1.00 0.00 C ATOM 1906 OE1 GLU A 119 -6.095 -11.027 2.671 1.00 0.00 O ATOM 1907 OE2 GLU A 119 -4.597 -12.253 3.729 1.00 0.00 O ATOM 0 H GLU A 119 -3.944 -6.172 3.267 1.00 0.00 H new ATOM 0 HA GLU A 119 -2.216 -8.240 2.050 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -3.527 -8.866 4.182 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -4.993 -8.608 3.257 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -3.864 -10.249 1.507 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -2.854 -10.719 2.860 1.00 0.00 H new ATOM 1914 N SER A 120 -3.491 -8.172 -0.098 1.00 0.00 N ATOM 1915 CA SER A 120 -4.085 -8.097 -1.436 1.00 0.00 C ATOM 1916 C SER A 120 -5.534 -8.590 -1.417 1.00 0.00 C ATOM 1917 O SER A 120 -5.750 -9.770 -1.136 1.00 0.00 O ATOM 1918 CB SER A 120 -3.224 -8.923 -2.407 1.00 0.00 C ATOM 1919 OG SER A 120 -3.798 -9.017 -3.701 1.00 0.00 O ATOM 0 H SER A 120 -2.610 -8.685 -0.092 1.00 0.00 H new ATOM 0 HA SER A 120 -4.106 -7.060 -1.771 1.00 0.00 H new ATOM 0 HB2 SER A 120 -2.235 -8.471 -2.484 1.00 0.00 H new ATOM 0 HB3 SER A 120 -3.086 -9.925 -2.001 1.00 0.00 H new ATOM 0 HG SER A 120 -3.258 -8.502 -4.337 1.00 0.00 H new ATOM 1925 N VAL A 121 -6.522 -7.735 -1.730 1.00 0.00 N ATOM 1926 CA VAL A 121 -7.936 -8.128 -1.740 1.00 0.00 C ATOM 1927 C VAL A 121 -8.198 -9.186 -2.811 1.00 0.00 C ATOM 1928 O VAL A 121 -8.902 -10.165 -2.559 1.00 0.00 O ATOM 1929 CB VAL A 121 -8.843 -6.892 -1.972 1.00 0.00 C ATOM 1930 CG1 VAL A 121 -10.304 -7.239 -2.258 1.00 0.00 C ATOM 1931 CG2 VAL A 121 -8.867 -5.969 -0.742 1.00 0.00 C ATOM 0 H VAL A 121 -6.362 -6.759 -1.981 1.00 0.00 H new ATOM 0 HA VAL A 121 -8.175 -8.558 -0.767 1.00 0.00 H new ATOM 0 HB VAL A 121 -8.402 -6.408 -2.843 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -10.873 -6.322 -2.409 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -10.363 -7.854 -3.156 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -10.719 -7.789 -1.414 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -9.513 -5.114 -0.941 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -9.249 -6.519 0.118 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -7.857 -5.619 -0.530 1.00 0.00 H new ATOM 1941 N ALA A 122 -7.672 -8.979 -4.021 1.00 0.00 N ATOM 1942 CA ALA A 122 -7.897 -9.924 -5.102 1.00 0.00 C ATOM 1943 C ALA A 122 -7.289 -11.293 -4.818 1.00 0.00 C ATOM 1944 O ALA A 122 -7.807 -12.278 -5.352 1.00 0.00 O ATOM 1945 CB ALA A 122 -7.320 -9.419 -6.422 1.00 0.00 C ATOM 0 H ALA A 122 -7.096 -8.175 -4.269 1.00 0.00 H new ATOM 0 HA ALA A 122 -8.980 -10.021 -5.178 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -7.508 -10.153 -7.206 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -7.794 -8.474 -6.688 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -6.246 -9.269 -6.316 1.00 0.00 H new ATOM 1951 N PHE A 123 -6.235 -11.382 -3.998 1.00 0.00 N ATOM 1952 CA PHE A 123 -5.557 -12.636 -3.700 1.00 0.00 C ATOM 1953 C PHE A 123 -5.033 -12.666 -2.254 1.00 0.00 C ATOM 1954 O PHE A 123 -3.855 -12.355 -2.023 1.00 0.00 O ATOM 1955 CB PHE A 123 -4.425 -12.801 -4.716 1.00 0.00 C ATOM 1956 CG PHE A 123 -4.843 -13.158 -6.129 1.00 0.00 C ATOM 1957 CD1 PHE A 123 -4.669 -12.246 -7.187 1.00 0.00 C ATOM 1958 CD2 PHE A 123 -5.320 -14.455 -6.397 1.00 0.00 C ATOM 1959 CE1 PHE A 123 -4.900 -12.659 -8.509 1.00 0.00 C ATOM 1960 CE2 PHE A 123 -5.534 -14.875 -7.722 1.00 0.00 C ATOM 1961 CZ PHE A 123 -5.309 -13.977 -8.778 1.00 0.00 C ATOM 0 H PHE A 123 -5.830 -10.576 -3.522 1.00 0.00 H new ATOM 0 HA PHE A 123 -6.255 -13.469 -3.781 1.00 0.00 H new ATOM 0 HB2 PHE A 123 -3.857 -11.871 -4.751 1.00 0.00 H new ATOM 0 HB3 PHE A 123 -3.748 -13.574 -4.353 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -4.359 -11.232 -6.983 1.00 0.00 H new ATOM 0 HD2 PHE A 123 -5.523 -15.132 -5.580 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -4.763 -11.962 -9.322 1.00 0.00 H new ATOM 0 HE2 PHE A 123 -5.869 -15.881 -7.926 1.00 0.00 H new ATOM 0 HZ PHE A 123 -5.450 -14.300 -9.799 1.00 0.00 H new ATOM 1971 N PRO A 124 -5.870 -13.095 -1.291 1.00 0.00 N ATOM 1972 CA PRO A 124 -5.505 -13.169 0.119 1.00 0.00 C ATOM 1973 C PRO A 124 -4.289 -14.052 0.402 1.00 0.00 C ATOM 1974 O PRO A 124 -3.869 -14.876 -0.422 1.00 0.00 O ATOM 1975 CB PRO A 124 -6.732 -13.704 0.869 1.00 0.00 C ATOM 1976 CG PRO A 124 -7.704 -14.157 -0.208 1.00 0.00 C ATOM 1977 CD PRO A 124 -7.265 -13.464 -1.484 1.00 0.00 C ATOM 0 HA PRO A 124 -5.215 -12.173 0.452 1.00 0.00 H new ATOM 0 HB2 PRO A 124 -6.461 -14.531 1.525 1.00 0.00 H new ATOM 0 HB3 PRO A 124 -7.175 -12.931 1.497 1.00 0.00 H new ATOM 0 HG2 PRO A 124 -7.681 -15.241 -0.324 1.00 0.00 H new ATOM 0 HG3 PRO A 124 -8.728 -13.886 0.051 1.00 0.00 H new ATOM 0 HD2 PRO A 124 -7.377 -14.125 -2.343 1.00 0.00 H new ATOM 0 HD3 PRO A 124 -7.877 -12.583 -1.678 1.00 0.00 H new ATOM 1985 N GLY A 125 -3.751 -13.930 1.611 1.00 0.00 N ATOM 1986 CA GLY A 125 -2.600 -14.678 2.079 1.00 0.00 C ATOM 1987 C GLY A 125 -1.257 -14.041 1.734 1.00 0.00 C ATOM 1988 O GLY A 125 -0.246 -14.592 2.153 1.00 0.00 O ATOM 0 H GLY A 125 -4.119 -13.286 2.311 1.00 0.00 H new ATOM 0 HA2 GLY A 125 -2.669 -14.790 3.161 1.00 0.00 H new ATOM 0 HA3 GLY A 125 -2.634 -15.680 1.652 1.00 0.00 H new ATOM 1992 N TRP A 126 -1.217 -12.935 0.980 1.00 0.00 N ATOM 1993 CA TRP A 126 0.011 -12.236 0.596 1.00 0.00 C ATOM 1994 C TRP A 126 -0.071 -10.817 1.139 1.00 0.00 C ATOM 1995 O TRP A 126 -1.064 -10.125 0.901 1.00 0.00 O ATOM 1996 CB TRP A 126 0.174 -12.212 -0.922 1.00 0.00 C ATOM 1997 CG TRP A 126 0.641 -13.488 -1.566 1.00 0.00 C ATOM 1998 CD1 TRP A 126 -0.098 -14.603 -1.776 1.00 0.00 C ATOM 1999 CD2 TRP A 126 1.976 -13.801 -2.069 1.00 0.00 C ATOM 2000 NE1 TRP A 126 0.682 -15.567 -2.398 1.00 0.00 N ATOM 2001 CE2 TRP A 126 1.978 -15.129 -2.581 1.00 0.00 C ATOM 2002 CE3 TRP A 126 3.192 -13.092 -2.144 1.00 0.00 C ATOM 2003 CZ2 TRP A 126 3.142 -15.725 -3.096 1.00 0.00 C ATOM 2004 CZ3 TRP A 126 4.353 -13.661 -2.701 1.00 0.00 C ATOM 2005 CH2 TRP A 126 4.332 -14.984 -3.168 1.00 0.00 C ATOM 0 H TRP A 126 -2.059 -12.493 0.612 1.00 0.00 H new ATOM 0 HA TRP A 126 0.876 -12.755 1.009 1.00 0.00 H new ATOM 0 HB2 TRP A 126 -0.784 -11.937 -1.364 1.00 0.00 H new ATOM 0 HB3 TRP A 126 0.881 -11.422 -1.177 1.00 0.00 H new ATOM 0 HD1 TRP A 126 -1.136 -14.723 -1.501 1.00 0.00 H new ATOM 0 HE1 TRP A 126 0.340 -16.485 -2.684 1.00 0.00 H new ATOM 0 HE3 TRP A 126 3.234 -12.082 -1.763 1.00 0.00 H new ATOM 0 HZ2 TRP A 126 3.121 -16.750 -3.435 1.00 0.00 H new ATOM 0 HZ3 TRP A 126 5.260 -13.079 -2.769 1.00 0.00 H new ATOM 0 HH2 TRP A 126 5.225 -15.429 -3.580 1.00 0.00 H new ATOM 2016 N PHE A 127 0.987 -10.359 1.805 1.00 0.00 N ATOM 2017 CA PHE A 127 1.104 -9.050 2.431 1.00 0.00 C ATOM 2018 C PHE A 127 2.175 -8.216 1.761 1.00 0.00 C ATOM 2019 O PHE A 127 3.175 -8.743 1.278 1.00 0.00 O ATOM 2020 CB PHE A 127 1.397 -9.229 3.926 1.00 0.00 C ATOM 2021 CG PHE A 127 0.226 -9.848 4.660 1.00 0.00 C ATOM 2022 CD1 PHE A 127 -0.053 -11.219 4.519 1.00 0.00 C ATOM 2023 CD2 PHE A 127 -0.637 -9.033 5.416 1.00 0.00 C ATOM 2024 CE1 PHE A 127 -1.225 -11.752 5.065 1.00 0.00 C ATOM 2025 CE2 PHE A 127 -1.767 -9.588 6.042 1.00 0.00 C ATOM 2026 CZ PHE A 127 -2.078 -10.947 5.835 1.00 0.00 C ATOM 0 H PHE A 127 1.828 -10.923 1.927 1.00 0.00 H new ATOM 0 HA PHE A 127 0.162 -8.515 2.314 1.00 0.00 H new ATOM 0 HB2 PHE A 127 2.278 -9.859 4.051 1.00 0.00 H new ATOM 0 HB3 PHE A 127 1.632 -8.261 4.368 1.00 0.00 H new ATOM 0 HD1 PHE A 127 0.637 -11.860 3.990 1.00 0.00 H new ATOM 0 HD2 PHE A 127 -0.431 -7.978 5.516 1.00 0.00 H new ATOM 0 HE1 PHE A 127 -1.475 -12.789 4.893 1.00 0.00 H new ATOM 0 HE2 PHE A 127 -2.392 -8.977 6.677 1.00 0.00 H new ATOM 0 HZ PHE A 127 -2.973 -11.369 6.269 1.00 0.00 H new ATOM 2036 N ILE A 128 1.917 -6.915 1.683 1.00 0.00 N ATOM 2037 CA ILE A 128 2.843 -5.958 1.081 1.00 0.00 C ATOM 2038 C ILE A 128 3.976 -5.679 2.073 1.00 0.00 C ATOM 2039 O ILE A 128 3.707 -5.243 3.196 1.00 0.00 O ATOM 2040 CB ILE A 128 2.144 -4.621 0.765 1.00 0.00 C ATOM 2041 CG1 ILE A 128 0.757 -4.790 0.103 1.00 0.00 C ATOM 2042 CG2 ILE A 128 3.069 -3.787 -0.142 1.00 0.00 C ATOM 2043 CD1 ILE A 128 0.029 -3.483 -0.225 1.00 0.00 C ATOM 0 H ILE A 128 1.059 -6.492 2.036 1.00 0.00 H new ATOM 0 HA ILE A 128 3.220 -6.387 0.153 1.00 0.00 H new ATOM 0 HB ILE A 128 1.961 -4.113 1.712 1.00 0.00 H new ATOM 0 HG12 ILE A 128 0.878 -5.361 -0.818 1.00 0.00 H new ATOM 0 HG13 ILE A 128 0.126 -5.383 0.765 1.00 0.00 H new ATOM 0 HG21 ILE A 128 2.589 -2.837 -0.376 1.00 0.00 H new ATOM 0 HG22 ILE A 128 4.012 -3.601 0.373 1.00 0.00 H new ATOM 0 HG23 ILE A 128 3.262 -4.333 -1.066 1.00 0.00 H new ATOM 0 HD11 ILE A 128 -0.933 -3.708 -0.686 1.00 0.00 H new ATOM 0 HD12 ILE A 128 -0.132 -2.916 0.692 1.00 0.00 H new ATOM 0 HD13 ILE A 128 0.633 -2.894 -0.915 1.00 0.00 H new ATOM 2055 N ALA A 129 5.230 -5.901 1.671 1.00 0.00 N ATOM 2056 CA ALA A 129 6.364 -5.646 2.535 1.00 0.00 C ATOM 2057 C ALA A 129 6.891 -4.225 2.328 1.00 0.00 C ATOM 2058 O ALA A 129 7.313 -3.851 1.234 1.00 0.00 O ATOM 2059 CB ALA A 129 7.467 -6.681 2.310 1.00 0.00 C ATOM 0 H ALA A 129 5.476 -6.258 0.748 1.00 0.00 H new ATOM 0 HA ALA A 129 6.031 -5.735 3.569 1.00 0.00 H new ATOM 0 HB1 ALA A 129 8.307 -6.467 2.971 1.00 0.00 H new ATOM 0 HB2 ALA A 129 7.081 -7.677 2.525 1.00 0.00 H new ATOM 0 HB3 ALA A 129 7.801 -6.638 1.273 1.00 0.00 H new ATOM 2065 N VAL A 130 6.871 -3.446 3.408 1.00 0.00 N ATOM 2066 CA VAL A 130 7.313 -2.065 3.530 1.00 0.00 C ATOM 2067 C VAL A 130 8.838 -1.961 3.400 1.00 0.00 C ATOM 2068 O VAL A 130 9.319 -0.919 2.986 1.00 0.00 O ATOM 2069 CB VAL A 130 6.859 -1.538 4.929 1.00 0.00 C ATOM 2070 CG1 VAL A 130 7.194 -0.062 5.195 1.00 0.00 C ATOM 2071 CG2 VAL A 130 5.352 -1.689 5.196 1.00 0.00 C ATOM 0 H VAL A 130 6.513 -3.800 4.295 1.00 0.00 H new ATOM 0 HA VAL A 130 6.874 -1.467 2.731 1.00 0.00 H new ATOM 0 HB VAL A 130 7.434 -2.178 5.598 1.00 0.00 H new ATOM 0 HG11 VAL A 130 6.843 0.218 6.188 1.00 0.00 H new ATOM 0 HG12 VAL A 130 8.273 0.082 5.138 1.00 0.00 H new ATOM 0 HG13 VAL A 130 6.704 0.563 4.448 1.00 0.00 H new ATOM 0 HG21 VAL A 130 5.117 -1.300 6.187 1.00 0.00 H new ATOM 0 HG22 VAL A 130 4.792 -1.131 4.445 1.00 0.00 H new ATOM 0 HG23 VAL A 130 5.077 -2.743 5.145 1.00 0.00 H new ATOM 2081 N SER A 131 9.602 -3.026 3.667 1.00 0.00 N ATOM 2082 CA SER A 131 11.074 -3.028 3.598 1.00 0.00 C ATOM 2083 C SER A 131 11.623 -2.009 4.594 1.00 0.00 C ATOM 2084 O SER A 131 11.925 -0.858 4.276 1.00 0.00 O ATOM 2085 CB SER A 131 11.645 -2.776 2.203 1.00 0.00 C ATOM 2086 OG SER A 131 10.817 -3.412 1.262 1.00 0.00 O ATOM 0 H SER A 131 9.212 -3.927 3.942 1.00 0.00 H new ATOM 0 HA SER A 131 11.396 -4.037 3.857 1.00 0.00 H new ATOM 0 HB2 SER A 131 11.695 -1.706 2.002 1.00 0.00 H new ATOM 0 HB3 SER A 131 12.662 -3.161 2.135 1.00 0.00 H new ATOM 0 HG SER A 131 11.354 -3.695 0.492 1.00 0.00 H new ATOM 2092 N SER A 132 11.805 -2.462 5.818 1.00 0.00 N ATOM 2093 CA SER A 132 12.292 -1.627 6.904 1.00 0.00 C ATOM 2094 C SER A 132 13.702 -1.986 7.331 1.00 0.00 C ATOM 2095 O SER A 132 14.241 -1.401 8.262 1.00 0.00 O ATOM 2096 CB SER A 132 11.275 -1.476 8.023 1.00 0.00 C ATOM 2097 OG SER A 132 9.969 -1.344 7.479 1.00 0.00 O ATOM 0 H SER A 132 11.619 -3.427 6.092 1.00 0.00 H new ATOM 0 HA SER A 132 12.398 -0.613 6.518 1.00 0.00 H new ATOM 0 HB2 SER A 132 11.317 -2.343 8.683 1.00 0.00 H new ATOM 0 HB3 SER A 132 11.516 -0.602 8.629 1.00 0.00 H new ATOM 0 HG SER A 132 9.328 -1.181 8.202 1.00 0.00 H new ATOM 2103 N GLU A 133 14.313 -2.923 6.624 1.00 0.00 N ATOM 2104 CA GLU A 133 15.670 -3.387 6.826 1.00 0.00 C ATOM 2105 C GLU A 133 16.448 -2.921 5.612 1.00 0.00 C ATOM 2106 O GLU A 133 15.827 -2.607 4.596 1.00 0.00 O ATOM 2107 CB GLU A 133 15.701 -4.902 6.950 1.00 0.00 C ATOM 2108 CG GLU A 133 14.871 -5.301 8.179 1.00 0.00 C ATOM 2109 CD GLU A 133 15.342 -6.578 8.860 1.00 0.00 C ATOM 2110 OE1 GLU A 133 14.477 -7.373 9.271 1.00 0.00 O ATOM 2111 OE2 GLU A 133 16.571 -6.686 9.103 1.00 0.00 O ATOM 0 H GLU A 133 13.848 -3.404 5.854 1.00 0.00 H new ATOM 0 HA GLU A 133 16.102 -2.992 7.746 1.00 0.00 H new ATOM 0 HB2 GLU A 133 15.295 -5.365 6.051 1.00 0.00 H new ATOM 0 HB3 GLU A 133 16.727 -5.254 7.054 1.00 0.00 H new ATOM 0 HG2 GLU A 133 14.897 -4.486 8.902 1.00 0.00 H new ATOM 0 HG3 GLU A 133 13.831 -5.426 7.877 1.00 0.00 H new ATOM 2118 N GLY A 134 17.774 -2.872 5.736 1.00 0.00 N ATOM 2119 CA GLY A 134 18.753 -2.458 4.742 1.00 0.00 C ATOM 2120 C GLY A 134 18.215 -1.493 3.691 1.00 0.00 C ATOM 2121 O GLY A 134 18.357 -0.279 3.830 1.00 0.00 O ATOM 0 H GLY A 134 18.225 -3.145 6.610 1.00 0.00 H new ATOM 0 HA2 GLY A 134 19.594 -1.988 5.252 1.00 0.00 H new ATOM 0 HA3 GLY A 134 19.140 -3.345 4.239 1.00 0.00 H new ATOM 2125 N GLY A 135 17.647 -2.023 2.609 1.00 0.00 N ATOM 2126 CA GLY A 135 17.062 -1.232 1.535 1.00 0.00 C ATOM 2127 C GLY A 135 16.452 -2.162 0.498 1.00 0.00 C ATOM 2128 O GLY A 135 16.963 -2.185 -0.627 1.00 0.00 O ATOM 0 H GLY A 135 17.581 -3.029 2.454 1.00 0.00 H new ATOM 0 HA2 GLY A 135 16.299 -0.564 1.934 1.00 0.00 H new ATOM 0 HA3 GLY A 135 17.825 -0.605 1.073 1.00 0.00 H new ATOM 2132 N CYS A 136 15.464 -2.993 0.858 1.00 0.00 N ATOM 2133 CA CYS A 136 14.880 -3.920 -0.107 1.00 0.00 C ATOM 2134 C CYS A 136 13.772 -3.285 -0.942 1.00 0.00 C ATOM 2135 O CYS A 136 13.239 -2.238 -0.565 1.00 0.00 O ATOM 2136 CB CYS A 136 14.368 -5.163 0.637 1.00 0.00 C ATOM 2137 SG CYS A 136 15.750 -6.323 0.797 1.00 0.00 S ATOM 0 H CYS A 136 15.062 -3.039 1.794 1.00 0.00 H new ATOM 0 HA CYS A 136 15.659 -4.206 -0.814 1.00 0.00 H new ATOM 0 HB2 CYS A 136 13.984 -4.889 1.620 1.00 0.00 H new ATOM 0 HB3 CYS A 136 13.545 -5.623 0.090 1.00 0.00 H new ATOM 0 HG CYS A 136 15.351 -7.389 1.426 1.00 0.00 H new ATOM 2143 N PRO A 137 13.435 -3.898 -2.090 1.00 0.00 N ATOM 2144 CA PRO A 137 12.373 -3.391 -2.925 1.00 0.00 C ATOM 2145 C PRO A 137 11.035 -3.758 -2.286 1.00 0.00 C ATOM 2146 O PRO A 137 10.924 -4.719 -1.520 1.00 0.00 O ATOM 2147 CB PRO A 137 12.553 -4.084 -4.274 1.00 0.00 C ATOM 2148 CG PRO A 137 13.140 -5.443 -3.893 1.00 0.00 C ATOM 2149 CD PRO A 137 13.990 -5.118 -2.669 1.00 0.00 C ATOM 0 HA PRO A 137 12.396 -2.308 -3.043 1.00 0.00 H new ATOM 0 HB2 PRO A 137 11.605 -4.189 -4.803 1.00 0.00 H new ATOM 0 HB3 PRO A 137 13.223 -3.525 -4.928 1.00 0.00 H new ATOM 0 HG2 PRO A 137 12.360 -6.169 -3.662 1.00 0.00 H new ATOM 0 HG3 PRO A 137 13.739 -5.865 -4.700 1.00 0.00 H new ATOM 0 HD2 PRO A 137 13.962 -5.936 -1.949 1.00 0.00 H new ATOM 0 HD3 PRO A 137 15.034 -4.975 -2.949 1.00 0.00 H new ATOM 2157 N LEU A 138 10.013 -2.981 -2.606 1.00 0.00 N ATOM 2158 CA LEU A 138 8.674 -3.174 -2.098 1.00 0.00 C ATOM 2159 C LEU A 138 8.020 -4.231 -2.970 1.00 0.00 C ATOM 2160 O LEU A 138 7.797 -4.005 -4.164 1.00 0.00 O ATOM 2161 CB LEU A 138 7.918 -1.850 -2.130 1.00 0.00 C ATOM 2162 CG LEU A 138 8.598 -0.695 -1.368 1.00 0.00 C ATOM 2163 CD1 LEU A 138 7.602 0.417 -1.096 1.00 0.00 C ATOM 2164 CD2 LEU A 138 9.243 -1.071 -0.042 1.00 0.00 C ATOM 0 H LEU A 138 10.097 -2.185 -3.238 1.00 0.00 H new ATOM 0 HA LEU A 138 8.674 -3.509 -1.061 1.00 0.00 H new ATOM 0 HB2 LEU A 138 7.783 -1.550 -3.169 1.00 0.00 H new ATOM 0 HB3 LEU A 138 6.924 -2.006 -1.712 1.00 0.00 H new ATOM 0 HG LEU A 138 9.403 -0.380 -2.033 1.00 0.00 H new ATOM 0 HD11 LEU A 138 8.097 1.225 -0.557 1.00 0.00 H new ATOM 0 HD12 LEU A 138 7.213 0.796 -2.041 1.00 0.00 H new ATOM 0 HD13 LEU A 138 6.780 0.030 -0.494 1.00 0.00 H new ATOM 0 HD21 LEU A 138 9.691 -0.185 0.409 1.00 0.00 H new ATOM 0 HD22 LEU A 138 8.486 -1.476 0.629 1.00 0.00 H new ATOM 0 HD23 LEU A 138 10.015 -1.821 -0.213 1.00 0.00 H new ATOM 2176 N ILE A 139 7.762 -5.395 -2.380 1.00 0.00 N ATOM 2177 CA ILE A 139 7.150 -6.556 -3.010 1.00 0.00 C ATOM 2178 C ILE A 139 6.128 -7.187 -2.057 1.00 0.00 C ATOM 2179 O ILE A 139 5.764 -6.582 -1.050 1.00 0.00 O ATOM 2180 CB ILE A 139 8.233 -7.551 -3.512 1.00 0.00 C ATOM 2181 CG1 ILE A 139 9.465 -7.759 -2.603 1.00 0.00 C ATOM 2182 CG2 ILE A 139 8.720 -7.116 -4.900 1.00 0.00 C ATOM 2183 CD1 ILE A 139 9.134 -8.174 -1.166 1.00 0.00 C ATOM 0 H ILE A 139 7.987 -5.560 -1.399 1.00 0.00 H new ATOM 0 HA ILE A 139 6.602 -6.247 -3.900 1.00 0.00 H new ATOM 0 HB ILE A 139 7.723 -8.514 -3.520 1.00 0.00 H new ATOM 0 HG12 ILE A 139 10.105 -8.520 -3.049 1.00 0.00 H new ATOM 0 HG13 ILE A 139 10.041 -6.834 -2.577 1.00 0.00 H new ATOM 0 HG21 ILE A 139 9.480 -7.813 -5.254 1.00 0.00 H new ATOM 0 HG22 ILE A 139 7.880 -7.111 -5.595 1.00 0.00 H new ATOM 0 HG23 ILE A 139 9.146 -6.115 -4.839 1.00 0.00 H new ATOM 0 HD11 ILE A 139 10.058 -8.297 -0.601 1.00 0.00 H new ATOM 0 HD12 ILE A 139 8.522 -7.404 -0.697 1.00 0.00 H new ATOM 0 HD13 ILE A 139 8.587 -9.116 -1.176 1.00 0.00 H new ATOM 2195 N LEU A 140 5.576 -8.346 -2.426 1.00 0.00 N ATOM 2196 CA LEU A 140 4.599 -9.084 -1.639 1.00 0.00 C ATOM 2197 C LEU A 140 5.276 -10.346 -1.095 1.00 0.00 C ATOM 2198 O LEU A 140 6.229 -10.848 -1.700 1.00 0.00 O ATOM 2199 CB LEU A 140 3.396 -9.496 -2.514 1.00 0.00 C ATOM 2200 CG LEU A 140 2.719 -8.402 -3.363 1.00 0.00 C ATOM 2201 CD1 LEU A 140 1.645 -9.024 -4.258 1.00 0.00 C ATOM 2202 CD2 LEU A 140 2.074 -7.331 -2.484 1.00 0.00 C ATOM 0 H LEU A 140 5.807 -8.805 -3.307 1.00 0.00 H new ATOM 0 HA LEU A 140 4.238 -8.454 -0.826 1.00 0.00 H new ATOM 0 HB2 LEU A 140 3.727 -10.287 -3.188 1.00 0.00 H new ATOM 0 HB3 LEU A 140 2.639 -9.930 -1.861 1.00 0.00 H new ATOM 0 HG LEU A 140 3.491 -7.933 -3.973 1.00 0.00 H new ATOM 0 HD11 LEU A 140 1.172 -8.244 -4.854 1.00 0.00 H new ATOM 0 HD12 LEU A 140 2.104 -9.759 -4.920 1.00 0.00 H new ATOM 0 HD13 LEU A 140 0.893 -9.513 -3.638 1.00 0.00 H new ATOM 0 HD21 LEU A 140 1.606 -6.576 -3.115 1.00 0.00 H new ATOM 0 HD22 LEU A 140 1.318 -7.790 -1.847 1.00 0.00 H new ATOM 0 HD23 LEU A 140 2.837 -6.862 -1.862 1.00 0.00 H new ATOM 2214 N THR A 141 4.748 -10.896 -0.008 1.00 0.00 N ATOM 2215 CA THR A 141 5.240 -12.109 0.639 1.00 0.00 C ATOM 2216 C THR A 141 4.037 -12.813 1.256 1.00 0.00 C ATOM 2217 O THR A 141 3.146 -12.171 1.814 1.00 0.00 O ATOM 2218 CB THR A 141 6.361 -11.790 1.650 1.00 0.00 C ATOM 2219 OG1 THR A 141 6.574 -12.858 2.547 1.00 0.00 O ATOM 2220 CG2 THR A 141 6.107 -10.539 2.501 1.00 0.00 C ATOM 0 H THR A 141 3.937 -10.497 0.465 1.00 0.00 H new ATOM 0 HA THR A 141 5.707 -12.781 -0.081 1.00 0.00 H new ATOM 0 HB THR A 141 7.233 -11.615 1.020 1.00 0.00 H new ATOM 0 HG1 THR A 141 7.535 -12.968 2.702 1.00 0.00 H new ATOM 0 HG21 THR A 141 6.943 -10.388 3.184 1.00 0.00 H new ATOM 0 HG22 THR A 141 6.008 -9.670 1.850 1.00 0.00 H new ATOM 0 HG23 THR A 141 5.189 -10.669 3.074 1.00 0.00 H new ATOM 2228 N GLN A 142 3.985 -14.133 1.088 1.00 0.00 N ATOM 2229 CA GLN A 142 2.924 -14.973 1.608 1.00 0.00 C ATOM 2230 C GLN A 142 3.158 -15.294 3.084 1.00 0.00 C ATOM 2231 O GLN A 142 2.221 -15.363 3.881 1.00 0.00 O ATOM 2232 CB GLN A 142 2.880 -16.267 0.775 1.00 0.00 C ATOM 2233 CG GLN A 142 1.830 -17.286 1.233 1.00 0.00 C ATOM 2234 CD GLN A 142 1.527 -18.342 0.166 1.00 0.00 C ATOM 2235 OE1 GLN A 142 2.370 -18.672 -0.669 1.00 0.00 O ATOM 2236 NE2 GLN A 142 0.314 -18.869 0.131 1.00 0.00 N ATOM 0 H GLN A 142 4.697 -14.653 0.575 1.00 0.00 H new ATOM 0 HA GLN A 142 1.971 -14.449 1.535 1.00 0.00 H new ATOM 0 HB2 GLN A 142 2.685 -16.007 -0.266 1.00 0.00 H new ATOM 0 HB3 GLN A 142 3.862 -16.738 0.807 1.00 0.00 H new ATOM 0 HG2 GLN A 142 2.181 -17.781 2.139 1.00 0.00 H new ATOM 0 HG3 GLN A 142 0.910 -16.762 1.492 1.00 0.00 H new ATOM 0 HE21 GLN A 142 -0.382 -18.594 0.824 1.00 0.00 H new ATOM 0 HE22 GLN A 142 0.075 -19.551 -0.589 1.00 0.00 H new ATOM 2245 N GLU A 143 4.418 -15.558 3.425 1.00 0.00 N ATOM 2246 CA GLU A 143 4.845 -15.918 4.764 1.00 0.00 C ATOM 2247 C GLU A 143 6.354 -15.677 4.851 1.00 0.00 C ATOM 2248 O GLU A 143 7.167 -16.440 4.310 1.00 0.00 O ATOM 2249 CB GLU A 143 4.412 -17.359 5.134 1.00 0.00 C ATOM 2250 CG GLU A 143 4.586 -18.450 4.057 1.00 0.00 C ATOM 2251 CD GLU A 143 4.120 -19.862 4.468 1.00 0.00 C ATOM 2252 OE1 GLU A 143 3.404 -20.037 5.482 1.00 0.00 O ATOM 2253 OE2 GLU A 143 4.419 -20.810 3.711 1.00 0.00 O ATOM 0 H GLU A 143 5.186 -15.525 2.755 1.00 0.00 H new ATOM 0 HA GLU A 143 4.354 -15.294 5.511 1.00 0.00 H new ATOM 0 HB2 GLU A 143 4.974 -17.664 6.017 1.00 0.00 H new ATOM 0 HB3 GLU A 143 3.360 -17.332 5.420 1.00 0.00 H new ATOM 0 HG2 GLU A 143 4.036 -18.149 3.166 1.00 0.00 H new ATOM 0 HG3 GLU A 143 5.639 -18.499 3.780 1.00 0.00 H new ATOM 2260 N LEU A 144 6.732 -14.555 5.454 1.00 0.00 N ATOM 2261 CA LEU A 144 8.123 -14.152 5.651 1.00 0.00 C ATOM 2262 C LEU A 144 8.744 -14.832 6.865 1.00 0.00 C ATOM 2263 O LEU A 144 8.050 -15.341 7.741 1.00 0.00 O ATOM 2264 CB LEU A 144 8.227 -12.626 5.760 1.00 0.00 C ATOM 2265 CG LEU A 144 7.358 -11.952 6.842 1.00 0.00 C ATOM 2266 CD1 LEU A 144 8.107 -11.618 8.135 1.00 0.00 C ATOM 2267 CD2 LEU A 144 6.835 -10.657 6.245 1.00 0.00 C ATOM 0 H LEU A 144 6.064 -13.882 5.830 1.00 0.00 H new ATOM 0 HA LEU A 144 8.690 -14.477 4.779 1.00 0.00 H new ATOM 0 HB2 LEU A 144 9.269 -12.368 5.950 1.00 0.00 H new ATOM 0 HB3 LEU A 144 7.963 -12.196 4.794 1.00 0.00 H new ATOM 0 HG LEU A 144 6.573 -12.655 7.119 1.00 0.00 H new ATOM 0 HD11 LEU A 144 7.423 -11.147 8.841 1.00 0.00 H new ATOM 0 HD12 LEU A 144 8.505 -12.534 8.572 1.00 0.00 H new ATOM 0 HD13 LEU A 144 8.927 -10.935 7.914 1.00 0.00 H new ATOM 0 HD21 LEU A 144 6.212 -10.144 6.978 1.00 0.00 H new ATOM 0 HD22 LEU A 144 7.674 -10.018 5.971 1.00 0.00 H new ATOM 0 HD23 LEU A 144 6.243 -10.879 5.357 1.00 0.00 H new ATOM 2279 N GLY A 145 10.075 -14.799 6.933 1.00 0.00 N ATOM 2280 CA GLY A 145 10.860 -15.392 8.007 1.00 0.00 C ATOM 2281 C GLY A 145 11.523 -14.314 8.851 1.00 0.00 C ATOM 2282 O GLY A 145 12.746 -14.302 8.986 1.00 0.00 O ATOM 0 H GLY A 145 10.649 -14.346 6.222 1.00 0.00 H new ATOM 0 HA2 GLY A 145 10.217 -16.008 8.636 1.00 0.00 H new ATOM 0 HA3 GLY A 145 11.621 -16.050 7.587 1.00 0.00 H new ATOM 2286 N LYS A 146 10.732 -13.374 9.384 1.00 0.00 N ATOM 2287 CA LYS A 146 11.181 -12.261 10.234 1.00 0.00 C ATOM 2288 C LYS A 146 12.318 -11.465 9.569 1.00 0.00 C ATOM 2289 O LYS A 146 13.208 -10.959 10.257 1.00 0.00 O ATOM 2290 CB LYS A 146 11.516 -12.818 11.642 1.00 0.00 C ATOM 2291 CG LYS A 146 11.075 -11.968 12.851 1.00 0.00 C ATOM 2292 CD LYS A 146 11.856 -10.678 13.145 1.00 0.00 C ATOM 2293 CE LYS A 146 11.395 -9.479 12.310 1.00 0.00 C ATOM 2294 NZ LYS A 146 11.198 -8.248 13.107 1.00 0.00 N ATOM 0 H LYS A 146 9.724 -13.366 9.230 1.00 0.00 H new ATOM 0 HA LYS A 146 10.385 -11.527 10.359 1.00 0.00 H new ATOM 0 HB2 LYS A 146 11.059 -13.803 11.735 1.00 0.00 H new ATOM 0 HB3 LYS A 146 12.595 -12.960 11.703 1.00 0.00 H new ATOM 0 HG2 LYS A 146 10.028 -11.700 12.708 1.00 0.00 H new ATOM 0 HG3 LYS A 146 11.124 -12.598 13.739 1.00 0.00 H new ATOM 0 HD2 LYS A 146 11.754 -10.434 14.203 1.00 0.00 H new ATOM 0 HD3 LYS A 146 12.915 -10.854 12.959 1.00 0.00 H new ATOM 0 HE2 LYS A 146 12.131 -9.284 11.530 1.00 0.00 H new ATOM 0 HE3 LYS A 146 10.460 -9.732 11.809 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 10.887 -7.476 12.483 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 10.475 -8.418 13.835 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 12.094 -7.983 13.564 1.00 0.00 H new ATOM 2308 N ALA A 147 12.293 -11.355 8.232 1.00 0.00 N ATOM 2309 CA ALA A 147 13.296 -10.626 7.454 1.00 0.00 C ATOM 2310 C ALA A 147 12.689 -9.517 6.590 1.00 0.00 C ATOM 2311 O ALA A 147 13.391 -8.569 6.218 1.00 0.00 O ATOM 2312 CB ALA A 147 14.135 -11.579 6.603 1.00 0.00 C ATOM 0 H ALA A 147 11.564 -11.777 7.657 1.00 0.00 H new ATOM 0 HA ALA A 147 13.950 -10.139 8.177 1.00 0.00 H new ATOM 0 HB1 ALA A 147 14.871 -11.009 6.037 1.00 0.00 H new ATOM 0 HB2 ALA A 147 14.647 -12.290 7.251 1.00 0.00 H new ATOM 0 HB3 ALA A 147 13.486 -12.119 5.914 1.00 0.00 H new ATOM 2318 N ASN A 148 11.401 -9.594 6.252 1.00 0.00 N ATOM 2319 CA ASN A 148 10.703 -8.586 5.470 1.00 0.00 C ATOM 2320 C ASN A 148 9.743 -7.953 6.473 1.00 0.00 C ATOM 2321 O ASN A 148 9.260 -8.625 7.382 1.00 0.00 O ATOM 2322 CB ASN A 148 10.065 -9.178 4.204 1.00 0.00 C ATOM 2323 CG ASN A 148 11.106 -9.284 3.083 1.00 0.00 C ATOM 2324 OD1 ASN A 148 12.081 -10.028 3.163 1.00 0.00 O ATOM 2325 ND2 ASN A 148 11.024 -8.475 2.041 1.00 0.00 N ATOM 0 H ASN A 148 10.806 -10.377 6.522 1.00 0.00 H new ATOM 0 HA ASN A 148 11.353 -7.822 5.043 1.00 0.00 H new ATOM 0 HB2 ASN A 148 9.654 -10.164 4.422 1.00 0.00 H new ATOM 0 HB3 ASN A 148 9.234 -8.551 3.880 1.00 0.00 H new ATOM 0 HD21 ASN A 148 11.757 -8.480 1.332 1.00 0.00 H new ATOM 0 HD22 ASN A 148 10.227 -7.845 1.946 1.00 0.00 H new ATOM 2332 N THR A 149 9.494 -6.655 6.343 1.00 0.00 N ATOM 2333 CA THR A 149 8.632 -5.915 7.255 1.00 0.00 C ATOM 2334 C THR A 149 7.268 -5.690 6.602 1.00 0.00 C ATOM 2335 O THR A 149 7.155 -4.828 5.736 1.00 0.00 O ATOM 2336 CB THR A 149 9.357 -4.627 7.692 1.00 0.00 C ATOM 2337 OG1 THR A 149 10.784 -4.736 7.608 1.00 0.00 O ATOM 2338 CG2 THR A 149 8.988 -4.273 9.131 1.00 0.00 C ATOM 0 H THR A 149 9.888 -6.083 5.596 1.00 0.00 H new ATOM 0 HA THR A 149 8.431 -6.478 8.167 1.00 0.00 H new ATOM 0 HB THR A 149 9.032 -3.847 7.003 1.00 0.00 H new ATOM 0 HG1 THR A 149 11.176 -4.594 8.495 1.00 0.00 H new ATOM 0 HG21 THR A 149 9.507 -3.361 9.426 1.00 0.00 H new ATOM 0 HG22 THR A 149 7.912 -4.117 9.203 1.00 0.00 H new ATOM 0 HG23 THR A 149 9.281 -5.088 9.793 1.00 0.00 H new ATOM 2346 N THR A 150 6.250 -6.479 6.943 1.00 0.00 N ATOM 2347 CA THR A 150 4.899 -6.348 6.390 1.00 0.00 C ATOM 2348 C THR A 150 3.963 -5.524 7.271 1.00 0.00 C ATOM 2349 O THR A 150 2.917 -5.082 6.794 1.00 0.00 O ATOM 2350 CB THR A 150 4.286 -7.744 6.222 1.00 0.00 C ATOM 2351 OG1 THR A 150 4.536 -8.528 7.370 1.00 0.00 O ATOM 2352 CG2 THR A 150 4.835 -8.401 4.956 1.00 0.00 C ATOM 0 H THR A 150 6.340 -7.237 7.619 1.00 0.00 H new ATOM 0 HA THR A 150 5.002 -5.829 5.437 1.00 0.00 H new ATOM 0 HB THR A 150 3.205 -7.658 6.113 1.00 0.00 H new ATOM 0 HG1 THR A 150 4.224 -9.444 7.215 1.00 0.00 H new ATOM 0 HG21 THR A 150 4.397 -9.392 4.841 1.00 0.00 H new ATOM 0 HG22 THR A 150 4.582 -7.790 4.090 1.00 0.00 H new ATOM 0 HG23 THR A 150 5.919 -8.490 5.033 1.00 0.00 H new ATOM 2360 N ASP A 151 4.321 -5.341 8.543 1.00 0.00 N ATOM 2361 CA ASP A 151 3.545 -4.608 9.531 1.00 0.00 C ATOM 2362 C ASP A 151 4.313 -3.379 9.988 1.00 0.00 C ATOM 2363 O ASP A 151 5.512 -3.474 10.264 1.00 0.00 O ATOM 2364 CB ASP A 151 3.192 -5.504 10.740 1.00 0.00 C ATOM 2365 CG ASP A 151 4.392 -5.901 11.604 1.00 0.00 C ATOM 2366 OD1 ASP A 151 4.728 -5.198 12.573 1.00 0.00 O ATOM 2367 OD2 ASP A 151 4.993 -6.968 11.314 1.00 0.00 O ATOM 0 H ASP A 151 5.191 -5.715 8.922 1.00 0.00 H new ATOM 0 HA ASP A 151 2.611 -4.291 9.066 1.00 0.00 H new ATOM 0 HB2 ASP A 151 2.467 -4.982 11.364 1.00 0.00 H new ATOM 0 HB3 ASP A 151 2.706 -6.409 10.376 1.00 0.00 H new ATOM 2372 N PHE A 152 3.647 -2.217 10.010 1.00 0.00 N ATOM 2373 CA PHE A 152 4.251 -0.972 10.469 1.00 0.00 C ATOM 2374 C PHE A 152 3.195 0.106 10.780 1.00 0.00 C ATOM 2375 O PHE A 152 2.244 -0.180 11.513 1.00 0.00 O ATOM 2376 CB PHE A 152 5.484 -0.533 9.633 1.00 0.00 C ATOM 2377 CG PHE A 152 6.741 -0.526 10.485 1.00 0.00 C ATOM 2378 CD1 PHE A 152 6.734 0.039 11.781 1.00 0.00 C ATOM 2379 CD2 PHE A 152 7.915 -1.126 10.001 1.00 0.00 C ATOM 2380 CE1 PHE A 152 7.887 -0.001 12.576 1.00 0.00 C ATOM 2381 CE2 PHE A 152 9.080 -1.124 10.788 1.00 0.00 C ATOM 2382 CZ PHE A 152 9.064 -0.566 12.070 1.00 0.00 C ATOM 0 H PHE A 152 2.677 -2.120 9.710 1.00 0.00 H new ATOM 0 HA PHE A 152 4.707 -1.163 11.440 1.00 0.00 H new ATOM 0 HB2 PHE A 152 5.616 -1.210 8.789 1.00 0.00 H new ATOM 0 HB3 PHE A 152 5.314 0.462 9.221 1.00 0.00 H new ATOM 0 HD1 PHE A 152 5.836 0.504 12.160 1.00 0.00 H new ATOM 0 HD2 PHE A 152 7.923 -1.589 9.025 1.00 0.00 H new ATOM 0 HE1 PHE A 152 7.868 0.403 13.577 1.00 0.00 H new ATOM 0 HE2 PHE A 152 9.991 -1.555 10.401 1.00 0.00 H new ATOM 0 HZ PHE A 152 9.961 -0.571 12.671 1.00 0.00 H new ATOM 2392 N GLY A 153 3.386 1.358 10.364 1.00 0.00 N ATOM 2393 CA GLY A 153 2.476 2.475 10.578 1.00 0.00 C ATOM 2394 C GLY A 153 2.538 3.415 9.378 1.00 0.00 C ATOM 2395 O GLY A 153 3.291 3.146 8.440 1.00 0.00 O ATOM 0 H GLY A 153 4.220 1.630 9.844 1.00 0.00 H new ATOM 0 HA2 GLY A 153 1.459 2.109 10.715 1.00 0.00 H new ATOM 0 HA3 GLY A 153 2.747 3.010 11.488 1.00 0.00 H new ATOM 2399 N LEU A 154 1.759 4.499 9.381 1.00 0.00 N ATOM 2400 CA LEU A 154 1.712 5.462 8.283 1.00 0.00 C ATOM 2401 C LEU A 154 1.656 6.890 8.819 1.00 0.00 C ATOM 2402 O LEU A 154 0.722 7.243 9.544 1.00 0.00 O ATOM 2403 CB LEU A 154 0.463 5.185 7.406 1.00 0.00 C ATOM 2404 CG LEU A 154 0.734 5.203 5.893 1.00 0.00 C ATOM 2405 CD1 LEU A 154 1.198 3.812 5.468 1.00 0.00 C ATOM 2406 CD2 LEU A 154 -0.501 5.541 5.038 1.00 0.00 C ATOM 0 H LEU A 154 1.137 4.734 10.155 1.00 0.00 H new ATOM 0 HA LEU A 154 2.616 5.353 7.683 1.00 0.00 H new ATOM 0 HB2 LEU A 154 0.051 4.213 7.678 1.00 0.00 H new ATOM 0 HB3 LEU A 154 -0.299 5.929 7.635 1.00 0.00 H new ATOM 0 HG LEU A 154 1.480 5.980 5.727 1.00 0.00 H new ATOM 0 HD11 LEU A 154 1.395 3.806 4.396 1.00 0.00 H new ATOM 0 HD12 LEU A 154 2.110 3.552 6.006 1.00 0.00 H new ATOM 0 HD13 LEU A 154 0.421 3.083 5.698 1.00 0.00 H new ATOM 0 HD21 LEU A 154 -0.226 5.533 3.983 1.00 0.00 H new ATOM 0 HD22 LEU A 154 -1.280 4.800 5.215 1.00 0.00 H new ATOM 0 HD23 LEU A 154 -0.872 6.529 5.309 1.00 0.00 H new ATOM 2418 N THR A 155 2.619 7.722 8.435 1.00 0.00 N ATOM 2419 CA THR A 155 2.719 9.131 8.799 1.00 0.00 C ATOM 2420 C THR A 155 1.749 9.929 7.893 1.00 0.00 C ATOM 2421 O THR A 155 2.097 10.991 7.387 1.00 0.00 O ATOM 2422 CB THR A 155 4.185 9.610 8.637 1.00 0.00 C ATOM 2423 OG1 THR A 155 5.137 8.596 8.939 1.00 0.00 O ATOM 2424 CG2 THR A 155 4.478 10.807 9.547 1.00 0.00 C ATOM 0 H THR A 155 3.386 7.418 7.834 1.00 0.00 H new ATOM 0 HA THR A 155 2.441 9.288 9.841 1.00 0.00 H new ATOM 0 HB THR A 155 4.283 9.887 7.587 1.00 0.00 H new ATOM 0 HG1 THR A 155 6.042 8.951 8.819 1.00 0.00 H new ATOM 0 HG21 THR A 155 5.513 11.122 9.412 1.00 0.00 H new ATOM 0 HG22 THR A 155 3.812 11.631 9.290 1.00 0.00 H new ATOM 0 HG23 THR A 155 4.318 10.521 10.587 1.00 0.00 H new ATOM 2432 N MET A 156 0.589 9.363 7.527 1.00 0.00 N ATOM 2433 CA MET A 156 -0.403 10.011 6.667 1.00 0.00 C ATOM 2434 C MET A 156 -0.910 11.263 7.401 1.00 0.00 C ATOM 2435 O MET A 156 -1.277 11.200 8.581 1.00 0.00 O ATOM 2436 CB MET A 156 -1.535 9.044 6.307 1.00 0.00 C ATOM 2437 CG MET A 156 -2.349 8.640 7.540 1.00 0.00 C ATOM 2438 SD MET A 156 -3.123 7.006 7.523 1.00 0.00 S ATOM 2439 CE MET A 156 -3.194 6.781 9.320 1.00 0.00 C ATOM 0 H MET A 156 0.313 8.428 7.827 1.00 0.00 H new ATOM 0 HA MET A 156 0.044 10.308 5.718 1.00 0.00 H new ATOM 0 HB2 MET A 156 -2.193 9.511 5.574 1.00 0.00 H new ATOM 0 HB3 MET A 156 -1.117 8.153 5.839 1.00 0.00 H new ATOM 0 HG2 MET A 156 -1.694 8.694 8.409 1.00 0.00 H new ATOM 0 HG3 MET A 156 -3.133 9.383 7.685 1.00 0.00 H new ATOM 0 HE1 MET A 156 -3.646 5.816 9.548 1.00 0.00 H new ATOM 0 HE2 MET A 156 -2.185 6.815 9.731 1.00 0.00 H new ATOM 0 HE3 MET A 156 -3.793 7.576 9.763 1.00 0.00 H new ATOM 2449 N LEU A 157 -0.951 12.392 6.706 1.00 0.00 N ATOM 2450 CA LEU A 157 -1.375 13.678 7.249 1.00 0.00 C ATOM 2451 C LEU A 157 -2.727 14.091 6.674 1.00 0.00 C ATOM 2452 O LEU A 157 -3.222 13.496 5.714 1.00 0.00 O ATOM 2453 CB LEU A 157 -0.313 14.757 6.968 1.00 0.00 C ATOM 2454 CG LEU A 157 1.150 14.388 7.280 1.00 0.00 C ATOM 2455 CD1 LEU A 157 2.065 15.570 6.941 1.00 0.00 C ATOM 2456 CD2 LEU A 157 1.369 13.981 8.744 1.00 0.00 C ATOM 0 H LEU A 157 -0.683 12.441 5.723 1.00 0.00 H new ATOM 0 HA LEU A 157 -1.484 13.574 8.328 1.00 0.00 H new ATOM 0 HB2 LEU A 157 -0.377 15.031 5.915 1.00 0.00 H new ATOM 0 HB3 LEU A 157 -0.570 15.645 7.545 1.00 0.00 H new ATOM 0 HG LEU A 157 1.394 13.522 6.665 1.00 0.00 H new ATOM 0 HD11 LEU A 157 3.099 15.305 7.163 1.00 0.00 H new ATOM 0 HD12 LEU A 157 1.971 15.811 5.882 1.00 0.00 H new ATOM 0 HD13 LEU A 157 1.776 16.436 7.537 1.00 0.00 H new ATOM 0 HD21 LEU A 157 2.419 13.733 8.900 1.00 0.00 H new ATOM 0 HD22 LEU A 157 1.091 14.808 9.397 1.00 0.00 H new ATOM 0 HD23 LEU A 157 0.753 13.112 8.976 1.00 0.00 H new ATOM 2468 N PHE A 158 -3.345 15.088 7.304 1.00 0.00 N ATOM 2469 CA PHE A 158 -4.635 15.676 6.966 1.00 0.00 C ATOM 2470 C PHE A 158 -4.607 17.142 7.404 1.00 0.00 C ATOM 2471 O PHE A 158 -3.503 17.690 7.637 1.00 0.00 O ATOM 2472 CB PHE A 158 -5.767 14.871 7.627 1.00 0.00 C ATOM 2473 CG PHE A 158 -5.871 14.907 9.139 1.00 0.00 C ATOM 2474 CD1 PHE A 158 -6.926 15.620 9.740 1.00 0.00 C ATOM 2475 CD2 PHE A 158 -4.984 14.163 9.943 1.00 0.00 C ATOM 2476 CE1 PHE A 158 -7.108 15.579 11.133 1.00 0.00 C ATOM 2477 CE2 PHE A 158 -5.161 14.128 11.337 1.00 0.00 C ATOM 2478 CZ PHE A 158 -6.226 14.830 11.929 1.00 0.00 C ATOM 0 H PHE A 158 -2.927 15.535 8.120 1.00 0.00 H new ATOM 0 HA PHE A 158 -4.825 15.641 5.893 1.00 0.00 H new ATOM 0 HB2 PHE A 158 -6.713 15.226 7.218 1.00 0.00 H new ATOM 0 HB3 PHE A 158 -5.659 13.830 7.324 1.00 0.00 H new ATOM 0 HD1 PHE A 158 -7.599 16.201 9.127 1.00 0.00 H new ATOM 0 HD2 PHE A 158 -4.169 13.620 9.488 1.00 0.00 H new ATOM 0 HE1 PHE A 158 -7.923 16.121 11.590 1.00 0.00 H new ATOM 0 HE2 PHE A 158 -4.479 13.562 11.954 1.00 0.00 H new ATOM 0 HZ PHE A 158 -6.366 14.793 12.999 1.00 0.00 H new TER 2488 PHE A 158