USER MOD reduce.3.24.130724 H: found=0, std=0, add=1092, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 1090 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 47 CYS SG : rot -98:sc= 1.09 USER MOD Set 1.2: A 49 THR OG1 : rot 180:sc= 0.955 USER MOD Single : A 5 LYS NZ :NH3+ -177:sc=0.000299 (180deg=0) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 23 GLN : amide:sc= -0.047 K(o=-0.047,f=-0.95) USER MOD Single : A 28 TYR OH : rot 110:sc= -1.01 USER MOD Single : A 31 LYS NZ :NH3+ 154:sc= -0.0129 (180deg=-0.48) USER MOD Single : A 45 HIS : no HD1:sc= -0.168 K(o=-0.17,f=-0.85) USER MOD Single : A 48 GLN : amide:sc= -0.12 K(o=-0.12,f=-0.96) USER MOD Single : A 54 HIS : no HD1:sc= 0.131 K(o=0.13,f=-6.5!) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 TYR OH : rot 30:sc= -0.284 USER MOD Single : A 67 HIS : no HD1:sc= -0.86 K(o=-0.86,f=-2.2!) USER MOD Single : A 74 THR OG1 : rot -29:sc= 0.257 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 102 TYR OH : rot 180:sc= -3.67! USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 112 THR OG1 : rot 180:sc= -1.05 USER MOD Single : A 127 GLN :FLIP amide:sc= -6.11! C(o=-8.1!,f=-6.1!) USER MOD Single : A 129 GLN : amide:sc= -0.377 X(o=-0.38,f=-0.045) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 THR OG1 : rot 180:sc= 0 USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 18 N VAL A 2 11.000 -3.939 5.872 1.00 0.00 N ATOM 19 CA VAL A 2 10.213 -3.437 4.759 1.00 0.00 C ATOM 20 C VAL A 2 10.703 -4.083 3.461 1.00 0.00 C ATOM 21 O VAL A 2 11.903 -4.273 3.273 1.00 0.00 O ATOM 22 CB VAL A 2 10.270 -1.908 4.724 1.00 0.00 C ATOM 23 CG1 VAL A 2 9.294 -1.347 3.688 1.00 0.00 C ATOM 24 CG2 VAL A 2 9.999 -1.318 6.109 1.00 0.00 C ATOM 0 HA VAL A 2 9.164 -3.707 4.881 1.00 0.00 H new ATOM 0 HB VAL A 2 11.277 -1.616 4.427 1.00 0.00 H new ATOM 0 HG11 VAL A 2 9.354 -0.259 3.683 1.00 0.00 H new ATOM 0 HG12 VAL A 2 9.552 -1.729 2.700 1.00 0.00 H new ATOM 0 HG13 VAL A 2 8.279 -1.653 3.941 1.00 0.00 H new ATOM 0 HG21 VAL A 2 10.045 -0.230 6.057 1.00 0.00 H new ATOM 0 HG22 VAL A 2 9.009 -1.623 6.447 1.00 0.00 H new ATOM 0 HG23 VAL A 2 10.750 -1.680 6.812 1.00 0.00 H new ATOM 34 N PRO A 3 9.723 -4.411 2.577 1.00 0.00 N ATOM 35 CA PRO A 3 10.042 -5.032 1.302 1.00 0.00 C ATOM 36 C PRO A 3 10.629 -4.010 0.327 1.00 0.00 C ATOM 37 O PRO A 3 10.687 -2.819 0.629 1.00 0.00 O ATOM 38 CB PRO A 3 8.733 -5.632 0.818 1.00 0.00 C ATOM 39 CG PRO A 3 7.637 -4.930 1.604 1.00 0.00 C ATOM 40 CD PRO A 3 8.291 -4.200 2.766 1.00 0.00 C ATOM 0 HA PRO A 3 10.809 -5.802 1.389 1.00 0.00 H new ATOM 0 HB2 PRO A 3 8.605 -5.478 -0.253 1.00 0.00 H new ATOM 0 HB3 PRO A 3 8.709 -6.708 0.990 1.00 0.00 H new ATOM 0 HG2 PRO A 3 7.100 -4.228 0.966 1.00 0.00 H new ATOM 0 HG3 PRO A 3 6.907 -5.652 1.969 1.00 0.00 H new ATOM 0 HD2 PRO A 3 8.043 -3.139 2.757 1.00 0.00 H new ATOM 0 HD3 PRO A 3 7.955 -4.598 3.723 1.00 0.00 H new ATOM 48 N PRO A 4 11.060 -4.526 -0.856 1.00 0.00 N ATOM 49 CA PRO A 4 11.641 -3.672 -1.878 1.00 0.00 C ATOM 50 C PRO A 4 10.559 -2.856 -2.589 1.00 0.00 C ATOM 51 O PRO A 4 10.597 -1.626 -2.579 1.00 0.00 O ATOM 52 CB PRO A 4 12.379 -4.619 -2.809 1.00 0.00 C ATOM 53 CG PRO A 4 11.802 -6.000 -2.542 1.00 0.00 C ATOM 54 CD PRO A 4 11.008 -5.931 -1.249 1.00 0.00 C ATOM 0 HA PRO A 4 12.323 -2.928 -1.467 1.00 0.00 H new ATOM 0 HB2 PRO A 4 12.238 -4.331 -3.851 1.00 0.00 H new ATOM 0 HB3 PRO A 4 13.452 -4.600 -2.616 1.00 0.00 H new ATOM 0 HG2 PRO A 4 11.162 -6.312 -3.367 1.00 0.00 H new ATOM 0 HG3 PRO A 4 12.600 -6.738 -2.461 1.00 0.00 H new ATOM 0 HD2 PRO A 4 9.980 -6.263 -1.397 1.00 0.00 H new ATOM 0 HD3 PRO A 4 11.443 -6.573 -0.483 1.00 0.00 H new ATOM 62 N LYS A 5 9.621 -3.573 -3.190 1.00 0.00 N ATOM 63 CA LYS A 5 8.531 -2.931 -3.904 1.00 0.00 C ATOM 64 C LYS A 5 8.126 -1.653 -3.167 1.00 0.00 C ATOM 65 O LYS A 5 7.758 -0.661 -3.793 1.00 0.00 O ATOM 66 CB LYS A 5 7.376 -3.912 -4.114 1.00 0.00 C ATOM 67 CG LYS A 5 7.345 -4.423 -5.556 1.00 0.00 C ATOM 68 CD LYS A 5 7.150 -5.940 -5.597 1.00 0.00 C ATOM 69 CE LYS A 5 5.940 -6.314 -6.454 1.00 0.00 C ATOM 70 NZ LYS A 5 5.861 -7.782 -6.627 1.00 0.00 N ATOM 0 H LYS A 5 9.593 -4.593 -3.197 1.00 0.00 H new ATOM 0 HA LYS A 5 8.853 -2.635 -4.903 1.00 0.00 H new ATOM 0 HB2 LYS A 5 7.480 -4.753 -3.429 1.00 0.00 H new ATOM 0 HB3 LYS A 5 6.431 -3.423 -3.878 1.00 0.00 H new ATOM 0 HG2 LYS A 5 6.538 -3.934 -6.101 1.00 0.00 H new ATOM 0 HG3 LYS A 5 8.275 -4.159 -6.059 1.00 0.00 H new ATOM 0 HD2 LYS A 5 8.045 -6.415 -5.999 1.00 0.00 H new ATOM 0 HD3 LYS A 5 7.015 -6.320 -4.585 1.00 0.00 H new ATOM 0 HE2 LYS A 5 5.027 -5.948 -5.984 1.00 0.00 H new ATOM 0 HE3 LYS A 5 6.013 -5.831 -7.428 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 5.064 -8.015 -7.253 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 6.746 -8.130 -7.049 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 5.718 -8.233 -5.701 1.00 0.00 H new ATOM 84 N LEU A 6 8.207 -1.719 -1.846 1.00 0.00 N ATOM 85 CA LEU A 6 7.854 -0.580 -1.016 1.00 0.00 C ATOM 86 C LEU A 6 9.078 0.323 -0.849 1.00 0.00 C ATOM 87 O LEU A 6 9.083 1.461 -1.315 1.00 0.00 O ATOM 88 CB LEU A 6 7.249 -1.049 0.308 1.00 0.00 C ATOM 89 CG LEU A 6 6.334 -0.050 1.019 1.00 0.00 C ATOM 90 CD1 LEU A 6 6.996 0.497 2.285 1.00 0.00 C ATOM 91 CD2 LEU A 6 5.902 1.069 0.069 1.00 0.00 C ATOM 0 H LEU A 6 8.512 -2.544 -1.330 1.00 0.00 H new ATOM 0 HA LEU A 6 7.081 0.018 -1.498 1.00 0.00 H new ATOM 0 HB2 LEU A 6 6.683 -1.962 0.123 1.00 0.00 H new ATOM 0 HB3 LEU A 6 8.063 -1.311 0.984 1.00 0.00 H new ATOM 0 HG LEU A 6 5.431 -0.576 1.330 1.00 0.00 H new ATOM 0 HD11 LEU A 6 6.324 1.205 2.770 1.00 0.00 H new ATOM 0 HD12 LEU A 6 7.212 -0.325 2.967 1.00 0.00 H new ATOM 0 HD13 LEU A 6 7.925 1.002 2.021 1.00 0.00 H new ATOM 0 HD21 LEU A 6 5.252 1.766 0.599 1.00 0.00 H new ATOM 0 HD22 LEU A 6 6.783 1.599 -0.294 1.00 0.00 H new ATOM 0 HD23 LEU A 6 5.363 0.641 -0.776 1.00 0.00 H new ATOM 103 N LYS A 7 10.086 -0.219 -0.181 1.00 0.00 N ATOM 104 CA LYS A 7 11.313 0.523 0.054 1.00 0.00 C ATOM 105 C LYS A 7 11.672 1.317 -1.203 1.00 0.00 C ATOM 106 O LYS A 7 12.253 2.398 -1.114 1.00 0.00 O ATOM 107 CB LYS A 7 12.424 -0.416 0.528 1.00 0.00 C ATOM 108 CG LYS A 7 13.631 0.375 1.037 1.00 0.00 C ATOM 109 CD LYS A 7 13.939 0.027 2.494 1.00 0.00 C ATOM 110 CE LYS A 7 15.390 0.367 2.844 1.00 0.00 C ATOM 111 NZ LYS A 7 16.138 -0.860 3.201 1.00 0.00 N ATOM 0 H LYS A 7 10.078 -1.163 0.205 1.00 0.00 H new ATOM 0 HA LYS A 7 11.174 1.245 0.858 1.00 0.00 H new ATOM 0 HB2 LYS A 7 12.046 -1.061 1.322 1.00 0.00 H new ATOM 0 HB3 LYS A 7 12.730 -1.066 -0.292 1.00 0.00 H new ATOM 0 HG2 LYS A 7 14.500 0.159 0.416 1.00 0.00 H new ATOM 0 HG3 LYS A 7 13.434 1.443 0.948 1.00 0.00 H new ATOM 0 HD2 LYS A 7 13.264 0.574 3.153 1.00 0.00 H new ATOM 0 HD3 LYS A 7 13.759 -1.035 2.664 1.00 0.00 H new ATOM 0 HE2 LYS A 7 15.869 0.859 1.997 1.00 0.00 H new ATOM 0 HE3 LYS A 7 15.414 1.070 3.676 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 17.120 -0.612 3.436 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 15.690 -1.313 4.023 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 16.130 -1.518 2.396 1.00 0.00 H new ATOM 125 N GLN A 8 11.313 0.750 -2.345 1.00 0.00 N ATOM 126 CA GLN A 8 11.590 1.392 -3.619 1.00 0.00 C ATOM 127 C GLN A 8 10.913 2.762 -3.682 1.00 0.00 C ATOM 128 O GLN A 8 11.576 3.778 -3.883 1.00 0.00 O ATOM 129 CB GLN A 8 11.148 0.507 -4.786 1.00 0.00 C ATOM 130 CG GLN A 8 12.261 0.379 -5.829 1.00 0.00 C ATOM 131 CD GLN A 8 11.819 0.955 -7.175 1.00 0.00 C ATOM 132 OE1 GLN A 8 11.813 2.156 -7.394 1.00 0.00 O ATOM 133 NE2 GLN A 8 11.452 0.036 -8.064 1.00 0.00 N ATOM 0 H GLN A 8 10.833 -0.147 -2.415 1.00 0.00 H new ATOM 0 HA GLN A 8 12.667 1.537 -3.704 1.00 0.00 H new ATOM 0 HB2 GLN A 8 10.877 -0.481 -4.415 1.00 0.00 H new ATOM 0 HB3 GLN A 8 10.257 0.929 -5.250 1.00 0.00 H new ATOM 0 HG2 GLN A 8 13.152 0.901 -5.481 1.00 0.00 H new ATOM 0 HG3 GLN A 8 12.533 -0.670 -5.950 1.00 0.00 H new ATOM 0 HE21 GLN A 8 11.481 -0.953 -7.816 1.00 0.00 H new ATOM 0 HE22 GLN A 8 11.142 0.320 -8.993 1.00 0.00 H new ATOM 142 N ALA A 9 9.600 2.746 -3.505 1.00 0.00 N ATOM 143 CA ALA A 9 8.825 3.975 -3.539 1.00 0.00 C ATOM 144 C ALA A 9 9.449 4.993 -2.583 1.00 0.00 C ATOM 145 O ALA A 9 9.968 6.020 -3.017 1.00 0.00 O ATOM 146 CB ALA A 9 7.366 3.669 -3.194 1.00 0.00 C ATOM 0 H ALA A 9 9.053 1.901 -3.338 1.00 0.00 H new ATOM 0 HA ALA A 9 8.839 4.410 -4.538 1.00 0.00 H new ATOM 0 HB1 ALA A 9 6.785 4.591 -3.220 1.00 0.00 H new ATOM 0 HB2 ALA A 9 6.961 2.964 -3.920 1.00 0.00 H new ATOM 0 HB3 ALA A 9 7.312 3.233 -2.196 1.00 0.00 H new ATOM 152 N LEU A 10 9.378 4.673 -1.300 1.00 0.00 N ATOM 153 CA LEU A 10 9.930 5.547 -0.279 1.00 0.00 C ATOM 154 C LEU A 10 11.286 6.079 -0.747 1.00 0.00 C ATOM 155 O LEU A 10 11.447 7.281 -0.955 1.00 0.00 O ATOM 156 CB LEU A 10 9.985 4.827 1.070 1.00 0.00 C ATOM 157 CG LEU A 10 8.635 4.476 1.699 1.00 0.00 C ATOM 158 CD1 LEU A 10 8.823 3.691 2.998 1.00 0.00 C ATOM 159 CD2 LEU A 10 7.784 5.730 1.905 1.00 0.00 C ATOM 0 H LEU A 10 8.946 3.820 -0.944 1.00 0.00 H new ATOM 0 HA LEU A 10 9.283 6.411 -0.128 1.00 0.00 H new ATOM 0 HB2 LEU A 10 10.555 3.907 0.945 1.00 0.00 H new ATOM 0 HB3 LEU A 10 10.538 5.452 1.771 1.00 0.00 H new ATOM 0 HG LEU A 10 8.094 3.830 1.008 1.00 0.00 H new ATOM 0 HD11 LEU A 10 7.848 3.454 3.424 1.00 0.00 H new ATOM 0 HD12 LEU A 10 9.362 2.767 2.790 1.00 0.00 H new ATOM 0 HD13 LEU A 10 9.393 4.292 3.707 1.00 0.00 H new ATOM 0 HD21 LEU A 10 6.830 5.453 2.353 1.00 0.00 H new ATOM 0 HD22 LEU A 10 8.308 6.421 2.565 1.00 0.00 H new ATOM 0 HD23 LEU A 10 7.607 6.211 0.943 1.00 0.00 H new ATOM 171 N GLU A 11 12.227 5.158 -0.900 1.00 0.00 N ATOM 172 CA GLU A 11 13.563 5.520 -1.341 1.00 0.00 C ATOM 173 C GLU A 11 13.489 6.528 -2.489 1.00 0.00 C ATOM 174 O GLU A 11 14.163 7.557 -2.461 1.00 0.00 O ATOM 175 CB GLU A 11 14.360 4.279 -1.751 1.00 0.00 C ATOM 176 CG GLU A 11 14.995 3.608 -0.532 1.00 0.00 C ATOM 177 CD GLU A 11 16.368 3.029 -0.879 1.00 0.00 C ATOM 178 OE1 GLU A 11 16.390 1.893 -1.399 1.00 0.00 O ATOM 179 OE2 GLU A 11 17.365 3.735 -0.615 1.00 0.00 O ATOM 0 H GLU A 11 12.090 4.162 -0.726 1.00 0.00 H new ATOM 0 HA GLU A 11 14.085 5.988 -0.507 1.00 0.00 H new ATOM 0 HB2 GLU A 11 13.704 3.572 -2.259 1.00 0.00 H new ATOM 0 HB3 GLU A 11 15.137 4.560 -2.462 1.00 0.00 H new ATOM 0 HG2 GLU A 11 15.096 4.333 0.276 1.00 0.00 H new ATOM 0 HG3 GLU A 11 14.343 2.814 -0.168 1.00 0.00 H new ATOM 186 N LEU A 12 12.664 6.198 -3.472 1.00 0.00 N ATOM 187 CA LEU A 12 12.493 7.062 -4.627 1.00 0.00 C ATOM 188 C LEU A 12 11.922 8.407 -4.173 1.00 0.00 C ATOM 189 O LEU A 12 12.266 9.450 -4.727 1.00 0.00 O ATOM 190 CB LEU A 12 11.650 6.366 -5.697 1.00 0.00 C ATOM 191 CG LEU A 12 11.130 7.257 -6.827 1.00 0.00 C ATOM 192 CD1 LEU A 12 12.226 7.529 -7.859 1.00 0.00 C ATOM 193 CD2 LEU A 12 9.877 6.656 -7.467 1.00 0.00 C ATOM 0 H LEU A 12 12.107 5.344 -3.492 1.00 0.00 H new ATOM 0 HA LEU A 12 13.456 7.266 -5.095 1.00 0.00 H new ATOM 0 HB2 LEU A 12 12.246 5.566 -6.137 1.00 0.00 H new ATOM 0 HB3 LEU A 12 10.796 5.896 -5.209 1.00 0.00 H new ATOM 0 HG LEU A 12 10.844 8.218 -6.400 1.00 0.00 H new ATOM 0 HD11 LEU A 12 11.830 8.164 -8.651 1.00 0.00 H new ATOM 0 HD12 LEU A 12 13.064 8.031 -7.376 1.00 0.00 H new ATOM 0 HD13 LEU A 12 12.566 6.586 -8.286 1.00 0.00 H new ATOM 0 HD21 LEU A 12 9.528 7.309 -8.267 1.00 0.00 H new ATOM 0 HD22 LEU A 12 10.113 5.674 -7.877 1.00 0.00 H new ATOM 0 HD23 LEU A 12 9.096 6.556 -6.713 1.00 0.00 H new ATOM 205 N PHE A 13 11.059 8.339 -3.170 1.00 0.00 N ATOM 206 CA PHE A 13 10.437 9.538 -2.635 1.00 0.00 C ATOM 207 C PHE A 13 11.490 10.513 -2.105 1.00 0.00 C ATOM 208 O PHE A 13 11.649 11.610 -2.637 1.00 0.00 O ATOM 209 CB PHE A 13 9.539 9.098 -1.478 1.00 0.00 C ATOM 210 CG PHE A 13 8.371 10.047 -1.200 1.00 0.00 C ATOM 211 CD1 PHE A 13 7.455 10.301 -2.173 1.00 0.00 C ATOM 212 CD2 PHE A 13 8.249 10.637 0.019 1.00 0.00 C ATOM 213 CE1 PHE A 13 6.372 11.182 -1.915 1.00 0.00 C ATOM 214 CE2 PHE A 13 7.166 11.518 0.277 1.00 0.00 C ATOM 215 CZ PHE A 13 6.250 11.771 -0.696 1.00 0.00 C ATOM 0 H PHE A 13 10.776 7.472 -2.714 1.00 0.00 H new ATOM 0 HA PHE A 13 9.873 10.045 -3.418 1.00 0.00 H new ATOM 0 HB2 PHE A 13 9.144 8.106 -1.696 1.00 0.00 H new ATOM 0 HB3 PHE A 13 10.144 9.009 -0.576 1.00 0.00 H new ATOM 0 HD1 PHE A 13 7.552 9.833 -3.141 1.00 0.00 H new ATOM 0 HD2 PHE A 13 8.976 10.435 0.791 1.00 0.00 H new ATOM 0 HE1 PHE A 13 5.645 11.384 -2.687 1.00 0.00 H new ATOM 0 HE2 PHE A 13 7.070 11.987 1.245 1.00 0.00 H new ATOM 0 HZ PHE A 13 5.425 12.440 -0.500 1.00 0.00 H new ATOM 225 N LYS A 14 12.184 10.076 -1.064 1.00 0.00 N ATOM 226 CA LYS A 14 13.218 10.897 -0.456 1.00 0.00 C ATOM 227 C LYS A 14 14.266 11.253 -1.512 1.00 0.00 C ATOM 228 O LYS A 14 15.033 12.198 -1.336 1.00 0.00 O ATOM 229 CB LYS A 14 13.798 10.200 0.776 1.00 0.00 C ATOM 230 CG LYS A 14 14.776 11.117 1.514 1.00 0.00 C ATOM 231 CD LYS A 14 15.333 10.433 2.764 1.00 0.00 C ATOM 232 CE LYS A 14 16.863 10.477 2.777 1.00 0.00 C ATOM 233 NZ LYS A 14 17.352 11.125 4.014 1.00 0.00 N ATOM 0 H LYS A 14 12.051 9.164 -0.626 1.00 0.00 H new ATOM 0 HA LYS A 14 12.798 11.836 -0.095 1.00 0.00 H new ATOM 0 HB2 LYS A 14 12.990 9.908 1.447 1.00 0.00 H new ATOM 0 HB3 LYS A 14 14.308 9.285 0.474 1.00 0.00 H new ATOM 0 HG2 LYS A 14 15.595 11.391 0.849 1.00 0.00 H new ATOM 0 HG3 LYS A 14 14.271 12.041 1.795 1.00 0.00 H new ATOM 0 HD2 LYS A 14 14.944 10.924 3.656 1.00 0.00 H new ATOM 0 HD3 LYS A 14 14.995 9.397 2.797 1.00 0.00 H new ATOM 0 HE2 LYS A 14 17.262 9.465 2.707 1.00 0.00 H new ATOM 0 HE3 LYS A 14 17.224 11.023 1.906 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 18.392 11.147 4.007 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 16.986 12.097 4.065 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 17.023 10.587 4.841 1.00 0.00 H new ATOM 247 N SER A 15 14.264 10.478 -2.587 1.00 0.00 N ATOM 248 CA SER A 15 15.206 10.701 -3.671 1.00 0.00 C ATOM 249 C SER A 15 14.654 11.752 -4.636 1.00 0.00 C ATOM 250 O SER A 15 15.402 12.581 -5.150 1.00 0.00 O ATOM 251 CB SER A 15 15.503 9.399 -4.418 1.00 0.00 C ATOM 252 OG SER A 15 16.382 9.605 -5.521 1.00 0.00 O ATOM 0 H SER A 15 13.626 9.696 -2.730 1.00 0.00 H new ATOM 0 HA SER A 15 16.140 11.065 -3.243 1.00 0.00 H new ATOM 0 HB2 SER A 15 15.947 8.679 -3.730 1.00 0.00 H new ATOM 0 HB3 SER A 15 14.569 8.965 -4.775 1.00 0.00 H new ATOM 0 HG SER A 15 16.548 8.750 -5.971 1.00 0.00 H new ATOM 258 N LEU A 16 13.348 11.684 -4.852 1.00 0.00 N ATOM 259 CA LEU A 16 12.687 12.619 -5.745 1.00 0.00 C ATOM 260 C LEU A 16 12.668 14.007 -5.101 1.00 0.00 C ATOM 261 O LEU A 16 12.801 14.132 -3.884 1.00 0.00 O ATOM 262 CB LEU A 16 11.300 12.102 -6.133 1.00 0.00 C ATOM 263 CG LEU A 16 11.266 11.016 -7.210 1.00 0.00 C ATOM 264 CD1 LEU A 16 9.831 10.562 -7.486 1.00 0.00 C ATOM 265 CD2 LEU A 16 11.975 11.484 -8.483 1.00 0.00 C ATOM 0 H LEU A 16 12.730 10.995 -4.423 1.00 0.00 H new ATOM 0 HA LEU A 16 13.241 12.708 -6.680 1.00 0.00 H new ATOM 0 HB2 LEU A 16 10.816 11.713 -5.237 1.00 0.00 H new ATOM 0 HB3 LEU A 16 10.703 12.946 -6.477 1.00 0.00 H new ATOM 0 HG LEU A 16 11.812 10.149 -6.838 1.00 0.00 H new ATOM 0 HD11 LEU A 16 9.835 9.790 -8.255 1.00 0.00 H new ATOM 0 HD12 LEU A 16 9.394 10.161 -6.572 1.00 0.00 H new ATOM 0 HD13 LEU A 16 9.240 11.412 -7.828 1.00 0.00 H new ATOM 0 HD21 LEU A 16 11.937 10.693 -9.232 1.00 0.00 H new ATOM 0 HD22 LEU A 16 11.479 12.375 -8.869 1.00 0.00 H new ATOM 0 HD23 LEU A 16 13.015 11.718 -8.255 1.00 0.00 H new ATOM 277 N PRO A 17 12.498 15.041 -5.967 1.00 0.00 N ATOM 278 CA PRO A 17 12.460 16.415 -5.495 1.00 0.00 C ATOM 279 C PRO A 17 11.126 16.723 -4.811 1.00 0.00 C ATOM 280 O PRO A 17 10.067 16.345 -5.310 1.00 0.00 O ATOM 281 CB PRO A 17 12.702 17.263 -6.733 1.00 0.00 C ATOM 282 CG PRO A 17 12.405 16.362 -7.921 1.00 0.00 C ATOM 283 CD PRO A 17 12.338 14.930 -7.414 1.00 0.00 C ATOM 0 HA PRO A 17 13.214 16.620 -4.735 1.00 0.00 H new ATOM 0 HB2 PRO A 17 12.056 18.141 -6.737 1.00 0.00 H new ATOM 0 HB3 PRO A 17 13.730 17.624 -6.764 1.00 0.00 H new ATOM 0 HG2 PRO A 17 11.462 16.646 -8.389 1.00 0.00 H new ATOM 0 HG3 PRO A 17 13.181 16.463 -8.680 1.00 0.00 H new ATOM 0 HD2 PRO A 17 11.388 14.462 -7.673 1.00 0.00 H new ATOM 0 HD3 PRO A 17 13.125 14.317 -7.854 1.00 0.00 H new ATOM 291 N LYS A 18 11.221 17.405 -3.680 1.00 0.00 N ATOM 292 CA LYS A 18 10.036 17.768 -2.923 1.00 0.00 C ATOM 293 C LYS A 18 8.889 18.067 -3.891 1.00 0.00 C ATOM 294 O LYS A 18 7.919 17.314 -3.961 1.00 0.00 O ATOM 295 CB LYS A 18 10.345 18.918 -1.962 1.00 0.00 C ATOM 296 CG LYS A 18 9.145 19.217 -1.061 1.00 0.00 C ATOM 297 CD LYS A 18 9.599 19.578 0.355 1.00 0.00 C ATOM 298 CE LYS A 18 9.079 20.958 0.762 1.00 0.00 C ATOM 299 NZ LYS A 18 7.615 20.918 0.975 1.00 0.00 N ATOM 0 H LYS A 18 12.101 17.716 -3.269 1.00 0.00 H new ATOM 0 HA LYS A 18 9.716 16.936 -2.296 1.00 0.00 H new ATOM 0 HB2 LYS A 18 11.210 18.662 -1.349 1.00 0.00 H new ATOM 0 HB3 LYS A 18 10.609 19.810 -2.530 1.00 0.00 H new ATOM 0 HG2 LYS A 18 8.566 20.039 -1.482 1.00 0.00 H new ATOM 0 HG3 LYS A 18 8.487 18.349 -1.026 1.00 0.00 H new ATOM 0 HD2 LYS A 18 9.239 18.828 1.059 1.00 0.00 H new ATOM 0 HD3 LYS A 18 10.688 19.566 0.406 1.00 0.00 H new ATOM 0 HE2 LYS A 18 9.576 21.286 1.675 1.00 0.00 H new ATOM 0 HE3 LYS A 18 9.320 21.687 -0.012 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 7.278 21.863 1.251 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 7.144 20.626 0.095 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 7.392 20.237 1.729 1.00 0.00 H new ATOM 313 N GLU A 19 9.039 19.168 -4.613 1.00 0.00 N ATOM 314 CA GLU A 19 8.028 19.575 -5.574 1.00 0.00 C ATOM 315 C GLU A 19 7.374 18.347 -6.210 1.00 0.00 C ATOM 316 O GLU A 19 6.158 18.177 -6.132 1.00 0.00 O ATOM 317 CB GLU A 19 8.625 20.493 -6.642 1.00 0.00 C ATOM 318 CG GLU A 19 10.100 20.164 -6.886 1.00 0.00 C ATOM 319 CD GLU A 19 11.010 21.197 -6.218 1.00 0.00 C ATOM 320 OE1 GLU A 19 11.269 21.026 -5.007 1.00 0.00 O ATOM 321 OE2 GLU A 19 11.425 22.134 -6.933 1.00 0.00 O ATOM 0 H GLU A 19 9.845 19.790 -4.552 1.00 0.00 H new ATOM 0 HA GLU A 19 7.259 20.139 -5.046 1.00 0.00 H new ATOM 0 HB2 GLU A 19 8.066 20.386 -7.572 1.00 0.00 H new ATOM 0 HB3 GLU A 19 8.528 21.533 -6.329 1.00 0.00 H new ATOM 0 HG2 GLU A 19 10.324 19.171 -6.497 1.00 0.00 H new ATOM 0 HG3 GLU A 19 10.298 20.138 -7.958 1.00 0.00 H new ATOM 328 N LEU A 20 8.209 17.522 -6.823 1.00 0.00 N ATOM 329 CA LEU A 20 7.728 16.315 -7.472 1.00 0.00 C ATOM 330 C LEU A 20 6.998 15.446 -6.446 1.00 0.00 C ATOM 331 O LEU A 20 5.827 15.115 -6.628 1.00 0.00 O ATOM 332 CB LEU A 20 8.875 15.594 -8.182 1.00 0.00 C ATOM 333 CG LEU A 20 9.291 16.167 -9.538 1.00 0.00 C ATOM 334 CD1 LEU A 20 10.280 15.240 -10.247 1.00 0.00 C ATOM 335 CD2 LEU A 20 8.066 16.468 -10.405 1.00 0.00 C ATOM 0 H LEU A 20 9.217 17.666 -6.884 1.00 0.00 H new ATOM 0 HA LEU A 20 7.008 16.564 -8.251 1.00 0.00 H new ATOM 0 HB2 LEU A 20 9.744 15.601 -7.525 1.00 0.00 H new ATOM 0 HB3 LEU A 20 8.591 14.551 -8.322 1.00 0.00 H new ATOM 0 HG LEU A 20 9.805 17.113 -9.365 1.00 0.00 H new ATOM 0 HD11 LEU A 20 10.559 15.672 -11.208 1.00 0.00 H new ATOM 0 HD12 LEU A 20 11.171 15.120 -9.631 1.00 0.00 H new ATOM 0 HD13 LEU A 20 9.816 14.267 -10.407 1.00 0.00 H new ATOM 0 HD21 LEU A 20 8.389 16.874 -11.363 1.00 0.00 H new ATOM 0 HD22 LEU A 20 7.504 15.549 -10.572 1.00 0.00 H new ATOM 0 HD23 LEU A 20 7.431 17.195 -9.898 1.00 0.00 H new ATOM 347 N ARG A 21 7.719 15.102 -5.389 1.00 0.00 N ATOM 348 CA ARG A 21 7.154 14.278 -4.333 1.00 0.00 C ATOM 349 C ARG A 21 5.684 14.638 -4.109 1.00 0.00 C ATOM 350 O ARG A 21 4.852 13.757 -3.893 1.00 0.00 O ATOM 351 CB ARG A 21 7.922 14.460 -3.023 1.00 0.00 C ATOM 352 CG ARG A 21 9.379 14.019 -3.175 1.00 0.00 C ATOM 353 CD ARG A 21 10.053 13.869 -1.810 1.00 0.00 C ATOM 354 NE ARG A 21 11.404 14.471 -1.843 1.00 0.00 N ATOM 355 CZ ARG A 21 12.095 14.827 -0.751 1.00 0.00 C ATOM 356 NH1 ARG A 21 11.565 14.643 0.466 1.00 0.00 N ATOM 357 NH2 ARG A 21 13.315 15.367 -0.876 1.00 0.00 N ATOM 0 H ARG A 21 8.690 15.379 -5.241 1.00 0.00 H new ATOM 0 HA ARG A 21 7.233 13.237 -4.646 1.00 0.00 H new ATOM 0 HB2 ARG A 21 7.885 15.506 -2.718 1.00 0.00 H new ATOM 0 HB3 ARG A 21 7.444 13.881 -2.233 1.00 0.00 H new ATOM 0 HG2 ARG A 21 9.421 13.071 -3.711 1.00 0.00 H new ATOM 0 HG3 ARG A 21 9.923 14.749 -3.775 1.00 0.00 H new ATOM 0 HD2 ARG A 21 9.449 14.353 -1.042 1.00 0.00 H new ATOM 0 HD3 ARG A 21 10.122 12.814 -1.544 1.00 0.00 H new ATOM 0 HE ARG A 21 11.837 14.625 -2.754 1.00 0.00 H new ATOM 0 HH11 ARG A 21 10.636 14.232 0.561 1.00 0.00 H new ATOM 0 HH12 ARG A 21 12.090 14.914 1.297 1.00 0.00 H new ATOM 0 HH21 ARG A 21 13.718 15.507 -1.802 1.00 0.00 H new ATOM 0 HH22 ARG A 21 13.840 15.638 -0.045 1.00 0.00 H new ATOM 371 N SER A 22 5.409 15.932 -4.168 1.00 0.00 N ATOM 372 CA SER A 22 4.053 16.419 -3.974 1.00 0.00 C ATOM 373 C SER A 22 3.110 15.756 -4.980 1.00 0.00 C ATOM 374 O SER A 22 2.110 15.152 -4.595 1.00 0.00 O ATOM 375 CB SER A 22 3.990 17.941 -4.110 1.00 0.00 C ATOM 376 OG SER A 22 2.793 18.477 -3.553 1.00 0.00 O ATOM 0 H SER A 22 6.102 16.659 -4.347 1.00 0.00 H new ATOM 0 HA SER A 22 3.737 16.159 -2.964 1.00 0.00 H new ATOM 0 HB2 SER A 22 4.852 18.386 -3.613 1.00 0.00 H new ATOM 0 HB3 SER A 22 4.054 18.214 -5.163 1.00 0.00 H new ATOM 0 HG SER A 22 2.791 19.451 -3.658 1.00 0.00 H new ATOM 382 N GLN A 23 3.462 15.892 -6.251 1.00 0.00 N ATOM 383 CA GLN A 23 2.660 15.314 -7.315 1.00 0.00 C ATOM 384 C GLN A 23 2.704 13.786 -7.244 1.00 0.00 C ATOM 385 O GLN A 23 1.699 13.120 -7.490 1.00 0.00 O ATOM 386 CB GLN A 23 3.125 15.812 -8.685 1.00 0.00 C ATOM 387 CG GLN A 23 4.143 14.850 -9.301 1.00 0.00 C ATOM 388 CD GLN A 23 4.642 15.371 -10.651 1.00 0.00 C ATOM 389 OE1 GLN A 23 4.497 16.534 -10.989 1.00 0.00 O ATOM 390 NE2 GLN A 23 5.236 14.447 -11.401 1.00 0.00 N ATOM 0 H GLN A 23 4.292 16.394 -6.567 1.00 0.00 H new ATOM 0 HA GLN A 23 1.627 15.635 -7.179 1.00 0.00 H new ATOM 0 HB2 GLN A 23 2.267 15.914 -9.349 1.00 0.00 H new ATOM 0 HB3 GLN A 23 3.569 16.802 -8.584 1.00 0.00 H new ATOM 0 HG2 GLN A 23 4.986 14.723 -8.622 1.00 0.00 H new ATOM 0 HG3 GLN A 23 3.688 13.868 -9.432 1.00 0.00 H new ATOM 0 HE21 GLN A 23 5.324 13.491 -11.057 1.00 0.00 H new ATOM 0 HE22 GLN A 23 5.603 14.695 -12.320 1.00 0.00 H new ATOM 399 N VAL A 24 3.878 13.275 -6.905 1.00 0.00 N ATOM 400 CA VAL A 24 4.066 11.838 -6.798 1.00 0.00 C ATOM 401 C VAL A 24 2.946 11.244 -5.941 1.00 0.00 C ATOM 402 O VAL A 24 2.214 10.365 -6.393 1.00 0.00 O ATOM 403 CB VAL A 24 5.462 11.533 -6.252 1.00 0.00 C ATOM 404 CG1 VAL A 24 5.633 10.035 -5.989 1.00 0.00 C ATOM 405 CG2 VAL A 24 6.547 12.050 -7.198 1.00 0.00 C ATOM 0 H VAL A 24 4.709 13.830 -6.701 1.00 0.00 H new ATOM 0 HA VAL A 24 4.006 11.370 -7.781 1.00 0.00 H new ATOM 0 HB VAL A 24 5.570 12.055 -5.301 1.00 0.00 H new ATOM 0 HG11 VAL A 24 6.634 9.846 -5.601 1.00 0.00 H new ATOM 0 HG12 VAL A 24 4.893 9.707 -5.259 1.00 0.00 H new ATOM 0 HG13 VAL A 24 5.494 9.484 -6.919 1.00 0.00 H new ATOM 0 HG21 VAL A 24 7.529 11.820 -6.785 1.00 0.00 H new ATOM 0 HG22 VAL A 24 6.440 11.570 -8.171 1.00 0.00 H new ATOM 0 HG23 VAL A 24 6.446 13.129 -7.313 1.00 0.00 H new ATOM 415 N LEU A 25 2.848 11.748 -4.720 1.00 0.00 N ATOM 416 CA LEU A 25 1.829 11.278 -3.796 1.00 0.00 C ATOM 417 C LEU A 25 0.466 11.304 -4.491 1.00 0.00 C ATOM 418 O LEU A 25 -0.327 10.376 -4.343 1.00 0.00 O ATOM 419 CB LEU A 25 1.873 12.083 -2.496 1.00 0.00 C ATOM 420 CG LEU A 25 3.108 11.872 -1.617 1.00 0.00 C ATOM 421 CD1 LEU A 25 2.962 12.604 -0.282 1.00 0.00 C ATOM 422 CD2 LEU A 25 3.396 10.382 -1.426 1.00 0.00 C ATOM 0 H LEU A 25 3.457 12.477 -4.349 1.00 0.00 H new ATOM 0 HA LEU A 25 2.021 10.244 -3.510 1.00 0.00 H new ATOM 0 HB2 LEU A 25 1.806 13.142 -2.745 1.00 0.00 H new ATOM 0 HB3 LEU A 25 0.988 11.837 -1.909 1.00 0.00 H new ATOM 0 HG LEU A 25 3.969 12.303 -2.128 1.00 0.00 H new ATOM 0 HD11 LEU A 25 3.853 12.438 0.323 1.00 0.00 H new ATOM 0 HD12 LEU A 25 2.841 13.672 -0.464 1.00 0.00 H new ATOM 0 HD13 LEU A 25 2.088 12.225 0.247 1.00 0.00 H new ATOM 0 HD21 LEU A 25 4.278 10.260 -0.798 1.00 0.00 H new ATOM 0 HD22 LEU A 25 2.541 9.905 -0.948 1.00 0.00 H new ATOM 0 HD23 LEU A 25 3.574 9.919 -2.396 1.00 0.00 H new ATOM 434 N LEU A 26 0.236 12.378 -5.232 1.00 0.00 N ATOM 435 CA LEU A 26 -1.017 12.537 -5.950 1.00 0.00 C ATOM 436 C LEU A 26 -1.170 11.399 -6.960 1.00 0.00 C ATOM 437 O LEU A 26 -2.272 10.896 -7.173 1.00 0.00 O ATOM 438 CB LEU A 26 -1.103 13.931 -6.576 1.00 0.00 C ATOM 439 CG LEU A 26 -1.648 15.039 -5.673 1.00 0.00 C ATOM 440 CD1 LEU A 26 -1.103 16.406 -6.093 1.00 0.00 C ATOM 441 CD2 LEU A 26 -3.177 15.017 -5.639 1.00 0.00 C ATOM 0 H LEU A 26 0.896 13.146 -5.351 1.00 0.00 H new ATOM 0 HA LEU A 26 -1.860 12.469 -5.263 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -0.107 14.219 -6.911 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -1.732 13.871 -7.464 1.00 0.00 H new ATOM 0 HG LEU A 26 -1.301 14.853 -4.657 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -1.506 17.176 -5.435 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -0.015 16.401 -6.023 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -1.399 16.616 -7.121 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -3.538 15.815 -4.990 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -3.566 15.165 -6.647 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -3.519 14.055 -5.256 1.00 0.00 H new ATOM 453 N GLU A 27 -0.047 11.025 -7.556 1.00 0.00 N ATOM 454 CA GLU A 27 -0.042 9.955 -8.539 1.00 0.00 C ATOM 455 C GLU A 27 -0.386 8.621 -7.874 1.00 0.00 C ATOM 456 O GLU A 27 -1.188 7.850 -8.399 1.00 0.00 O ATOM 457 CB GLU A 27 1.306 9.877 -9.259 1.00 0.00 C ATOM 458 CG GLU A 27 1.690 11.234 -9.851 1.00 0.00 C ATOM 459 CD GLU A 27 2.078 11.099 -11.325 1.00 0.00 C ATOM 460 OE1 GLU A 27 2.954 10.252 -11.606 1.00 0.00 O ATOM 461 OE2 GLU A 27 1.491 11.845 -12.138 1.00 0.00 O ATOM 0 H GLU A 27 0.866 11.444 -7.377 1.00 0.00 H new ATOM 0 HA GLU A 27 -0.804 10.173 -9.287 1.00 0.00 H new ATOM 0 HB2 GLU A 27 2.077 9.549 -8.561 1.00 0.00 H new ATOM 0 HB3 GLU A 27 1.256 9.131 -10.052 1.00 0.00 H new ATOM 0 HG2 GLU A 27 0.854 11.927 -9.753 1.00 0.00 H new ATOM 0 HG3 GLU A 27 2.523 11.657 -9.289 1.00 0.00 H new ATOM 468 N TYR A 28 0.238 8.389 -6.728 1.00 0.00 N ATOM 469 CA TYR A 28 0.008 7.162 -5.986 1.00 0.00 C ATOM 470 C TYR A 28 -1.486 6.946 -5.732 1.00 0.00 C ATOM 471 O TYR A 28 -1.928 5.816 -5.535 1.00 0.00 O ATOM 472 CB TYR A 28 0.720 7.341 -4.644 1.00 0.00 C ATOM 473 CG TYR A 28 2.212 7.003 -4.681 1.00 0.00 C ATOM 474 CD1 TYR A 28 2.994 7.445 -5.729 1.00 0.00 C ATOM 475 CD2 TYR A 28 2.776 6.256 -3.667 1.00 0.00 C ATOM 476 CE1 TYR A 28 4.398 7.127 -5.764 1.00 0.00 C ATOM 477 CE2 TYR A 28 4.180 5.938 -3.702 1.00 0.00 C ATOM 478 CZ TYR A 28 4.921 6.389 -4.749 1.00 0.00 C ATOM 479 OH TYR A 28 6.247 6.088 -4.782 1.00 0.00 O ATOM 0 H TYR A 28 0.903 9.031 -6.296 1.00 0.00 H new ATOM 0 HA TYR A 28 0.377 6.302 -6.544 1.00 0.00 H new ATOM 0 HB2 TYR A 28 0.600 8.373 -4.316 1.00 0.00 H new ATOM 0 HB3 TYR A 28 0.234 6.711 -3.899 1.00 0.00 H new ATOM 0 HD1 TYR A 28 2.553 8.029 -6.523 1.00 0.00 H new ATOM 0 HD2 TYR A 28 2.164 5.910 -2.847 1.00 0.00 H new ATOM 0 HE1 TYR A 28 5.021 7.467 -6.578 1.00 0.00 H new ATOM 0 HE2 TYR A 28 4.634 5.355 -2.915 1.00 0.00 H new ATOM 0 HH TYR A 28 6.713 6.587 -4.079 1.00 0.00 H new ATOM 489 N ALA A 29 -2.221 8.048 -5.745 1.00 0.00 N ATOM 490 CA ALA A 29 -3.655 7.994 -5.519 1.00 0.00 C ATOM 491 C ALA A 29 -4.370 7.789 -6.856 1.00 0.00 C ATOM 492 O ALA A 29 -5.467 7.234 -6.898 1.00 0.00 O ATOM 493 CB ALA A 29 -4.108 9.270 -4.805 1.00 0.00 C ATOM 0 H ALA A 29 -1.850 8.984 -5.909 1.00 0.00 H new ATOM 0 HA ALA A 29 -3.911 7.152 -4.876 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -5.184 9.230 -4.635 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -3.593 9.354 -3.848 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -3.870 10.136 -5.422 1.00 0.00 H new ATOM 499 N ALA A 30 -3.720 8.247 -7.915 1.00 0.00 N ATOM 500 CA ALA A 30 -4.280 8.120 -9.250 1.00 0.00 C ATOM 501 C ALA A 30 -4.164 6.666 -9.711 1.00 0.00 C ATOM 502 O ALA A 30 -4.868 6.243 -10.627 1.00 0.00 O ATOM 503 CB ALA A 30 -3.570 9.090 -10.196 1.00 0.00 C ATOM 0 H ALA A 30 -2.810 8.707 -7.876 1.00 0.00 H new ATOM 0 HA ALA A 30 -5.338 8.382 -9.249 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -3.990 8.995 -11.197 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -3.708 10.111 -9.840 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -2.506 8.856 -10.225 1.00 0.00 H new ATOM 509 N LYS A 31 -3.270 5.940 -9.056 1.00 0.00 N ATOM 510 CA LYS A 31 -3.052 4.542 -9.387 1.00 0.00 C ATOM 511 C LYS A 31 -4.013 3.674 -8.572 1.00 0.00 C ATOM 512 O LYS A 31 -4.452 2.623 -9.037 1.00 0.00 O ATOM 513 CB LYS A 31 -1.580 4.171 -9.202 1.00 0.00 C ATOM 514 CG LYS A 31 -0.733 4.691 -10.365 1.00 0.00 C ATOM 515 CD LYS A 31 -0.008 5.982 -9.981 1.00 0.00 C ATOM 516 CE LYS A 31 1.408 6.010 -10.561 1.00 0.00 C ATOM 517 NZ LYS A 31 1.384 5.677 -12.003 1.00 0.00 N ATOM 0 H LYS A 31 -2.688 6.294 -8.297 1.00 0.00 H new ATOM 0 HA LYS A 31 -3.272 4.360 -10.439 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -1.211 4.587 -8.264 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -1.480 3.088 -9.131 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -0.005 3.934 -10.656 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -1.370 4.871 -11.231 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -0.571 6.841 -10.345 1.00 0.00 H new ATOM 0 HD3 LYS A 31 0.038 6.068 -8.895 1.00 0.00 H new ATOM 0 HE2 LYS A 31 1.847 6.997 -10.417 1.00 0.00 H new ATOM 0 HE3 LYS A 31 2.040 5.299 -10.028 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 2.207 6.107 -12.472 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 1.418 4.644 -12.121 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 0.510 6.046 -12.430 1.00 0.00 H new ATOM 531 N VAL A 32 -4.311 4.146 -7.370 1.00 0.00 N ATOM 532 CA VAL A 32 -5.212 3.425 -6.486 1.00 0.00 C ATOM 533 C VAL A 32 -6.426 2.946 -7.283 1.00 0.00 C ATOM 534 O VAL A 32 -7.321 3.732 -7.591 1.00 0.00 O ATOM 535 CB VAL A 32 -5.589 4.306 -5.293 1.00 0.00 C ATOM 536 CG1 VAL A 32 -6.798 3.734 -4.550 1.00 0.00 C ATOM 537 CG2 VAL A 32 -4.399 4.487 -4.348 1.00 0.00 C ATOM 0 H VAL A 32 -3.945 5.018 -6.988 1.00 0.00 H new ATOM 0 HA VAL A 32 -4.722 2.541 -6.078 1.00 0.00 H new ATOM 0 HB VAL A 32 -5.865 5.289 -5.675 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -7.045 4.379 -3.707 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -7.650 3.681 -5.228 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -6.561 2.734 -4.185 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -4.693 5.117 -3.509 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -4.078 3.514 -3.976 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -3.576 4.959 -4.885 1.00 0.00 H new ATOM 547 N PRO A 33 -6.419 1.624 -7.602 1.00 0.00 N ATOM 548 CA PRO A 33 -7.509 1.030 -8.357 1.00 0.00 C ATOM 549 C PRO A 33 -8.748 0.847 -7.479 1.00 0.00 C ATOM 550 O PRO A 33 -8.648 0.829 -6.253 1.00 0.00 O ATOM 551 CB PRO A 33 -6.954 -0.283 -8.883 1.00 0.00 C ATOM 552 CG PRO A 33 -5.740 -0.596 -8.024 1.00 0.00 C ATOM 553 CD PRO A 33 -5.376 0.663 -7.254 1.00 0.00 C ATOM 0 HA PRO A 33 -7.845 1.662 -9.179 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -7.697 -1.077 -8.813 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -6.677 -0.197 -9.934 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -5.959 -1.413 -7.337 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -4.905 -0.918 -8.646 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -5.351 0.477 -6.180 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -4.389 1.029 -7.537 1.00 0.00 H new ATOM 561 N PRO A 34 -9.919 0.712 -8.157 1.00 0.00 N ATOM 562 CA PRO A 34 -11.177 0.530 -7.452 1.00 0.00 C ATOM 563 C PRO A 34 -11.294 -0.891 -6.897 1.00 0.00 C ATOM 564 O PRO A 34 -10.731 -1.829 -7.460 1.00 0.00 O ATOM 565 CB PRO A 34 -12.252 0.860 -8.474 1.00 0.00 C ATOM 566 CG PRO A 34 -11.580 0.761 -9.833 1.00 0.00 C ATOM 567 CD PRO A 34 -10.077 0.728 -9.609 1.00 0.00 C ATOM 0 HA PRO A 34 -11.267 1.175 -6.578 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -13.088 0.164 -8.400 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -12.654 1.860 -8.309 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -11.908 -0.137 -10.356 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -11.854 1.611 -10.457 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -9.628 -0.154 -10.066 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -9.592 1.598 -10.051 1.00 0.00 H new ATOM 575 N PRO A 35 -12.048 -1.009 -5.772 1.00 0.00 N ATOM 576 CA PRO A 35 -12.246 -2.299 -5.135 1.00 0.00 C ATOM 577 C PRO A 35 -13.235 -3.156 -5.928 1.00 0.00 C ATOM 578 O PRO A 35 -14.113 -2.627 -6.609 1.00 0.00 O ATOM 579 CB PRO A 35 -12.733 -1.976 -3.732 1.00 0.00 C ATOM 580 CG PRO A 35 -13.233 -0.541 -3.785 1.00 0.00 C ATOM 581 CD PRO A 35 -12.729 0.080 -5.078 1.00 0.00 C ATOM 0 HA PRO A 35 -11.333 -2.893 -5.098 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -13.529 -2.656 -3.429 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -11.928 -2.083 -3.005 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -14.322 -0.514 -3.748 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -12.871 0.022 -2.925 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -13.551 0.476 -5.674 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -12.050 0.909 -4.880 1.00 0.00 H new ATOM 589 N PRO A 36 -13.056 -4.499 -5.811 1.00 0.00 N ATOM 590 CA PRO A 36 -13.922 -5.434 -6.509 1.00 0.00 C ATOM 591 C PRO A 36 -15.291 -5.523 -5.832 1.00 0.00 C ATOM 592 O PRO A 36 -15.415 -5.262 -4.636 1.00 0.00 O ATOM 593 CB PRO A 36 -13.167 -6.753 -6.498 1.00 0.00 C ATOM 594 CG PRO A 36 -12.125 -6.628 -5.398 1.00 0.00 C ATOM 595 CD PRO A 36 -12.027 -5.161 -5.013 1.00 0.00 C ATOM 0 HA PRO A 36 -14.139 -5.124 -7.531 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -13.841 -7.587 -6.304 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -12.696 -6.941 -7.463 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -12.407 -7.231 -4.535 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -11.159 -6.997 -5.743 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -12.201 -5.019 -3.946 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -11.037 -4.760 -5.231 1.00 0.00 H new ATOM 603 N PRO A 37 -16.312 -5.901 -6.647 1.00 0.00 N ATOM 604 CA PRO A 37 -17.667 -6.028 -6.140 1.00 0.00 C ATOM 605 C PRO A 37 -17.822 -7.297 -5.300 1.00 0.00 C ATOM 606 O PRO A 37 -17.520 -8.395 -5.765 1.00 0.00 O ATOM 607 CB PRO A 37 -18.552 -6.022 -7.376 1.00 0.00 C ATOM 608 CG PRO A 37 -17.639 -6.360 -8.544 1.00 0.00 C ATOM 609 CD PRO A 37 -16.202 -6.217 -8.068 1.00 0.00 C ATOM 0 HA PRO A 37 -17.941 -5.216 -5.466 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -19.356 -6.753 -7.284 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -19.021 -5.048 -7.516 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -17.826 -7.375 -8.894 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -17.831 -5.693 -9.384 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -15.639 -7.137 -8.227 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -15.682 -5.427 -8.610 1.00 0.00 H new ATOM 617 N GLY A 38 -18.293 -7.104 -4.076 1.00 0.00 N ATOM 618 CA GLY A 38 -18.491 -8.220 -3.167 1.00 0.00 C ATOM 619 C GLY A 38 -17.496 -8.165 -2.006 1.00 0.00 C ATOM 620 O GLY A 38 -17.731 -8.755 -0.953 1.00 0.00 O ATOM 0 H GLY A 38 -18.543 -6.192 -3.693 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -19.509 -8.201 -2.779 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -18.373 -9.159 -3.707 1.00 0.00 H new ATOM 624 N VAL A 39 -16.404 -7.452 -2.239 1.00 0.00 N ATOM 625 CA VAL A 39 -15.371 -7.312 -1.226 1.00 0.00 C ATOM 626 C VAL A 39 -15.834 -6.310 -0.167 1.00 0.00 C ATOM 627 O VAL A 39 -16.332 -5.235 -0.500 1.00 0.00 O ATOM 628 CB VAL A 39 -14.045 -6.921 -1.881 1.00 0.00 C ATOM 629 CG1 VAL A 39 -13.103 -6.270 -0.866 1.00 0.00 C ATOM 630 CG2 VAL A 39 -13.384 -8.130 -2.546 1.00 0.00 C ATOM 0 H VAL A 39 -16.212 -6.965 -3.114 1.00 0.00 H new ATOM 0 HA VAL A 39 -15.200 -8.263 -0.721 1.00 0.00 H new ATOM 0 HB VAL A 39 -14.259 -6.187 -2.658 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -12.168 -6.002 -1.357 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -13.570 -5.373 -0.460 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -12.899 -6.971 -0.057 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -12.443 -7.824 -3.004 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -13.190 -8.897 -1.796 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -14.047 -8.531 -3.312 1.00 0.00 H new ATOM 640 N GLU A 40 -15.653 -6.696 1.087 1.00 0.00 N ATOM 641 CA GLU A 40 -16.045 -5.845 2.197 1.00 0.00 C ATOM 642 C GLU A 40 -14.830 -5.096 2.748 1.00 0.00 C ATOM 643 O GLU A 40 -13.777 -5.692 2.970 1.00 0.00 O ATOM 644 CB GLU A 40 -16.732 -6.658 3.296 1.00 0.00 C ATOM 645 CG GLU A 40 -17.074 -5.776 4.498 1.00 0.00 C ATOM 646 CD GLU A 40 -18.518 -6.002 4.951 1.00 0.00 C ATOM 647 OE1 GLU A 40 -19.414 -5.836 4.096 1.00 0.00 O ATOM 648 OE2 GLU A 40 -18.693 -6.336 6.143 1.00 0.00 O ATOM 0 H GLU A 40 -15.240 -7.588 1.359 1.00 0.00 H new ATOM 0 HA GLU A 40 -16.763 -5.112 1.830 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -17.642 -7.112 2.903 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -16.080 -7.473 3.612 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -16.393 -5.995 5.320 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -16.931 -4.728 4.237 1.00 0.00 H new ATOM 655 N LEU A 41 -15.016 -3.800 2.952 1.00 0.00 N ATOM 656 CA LEU A 41 -13.947 -2.964 3.472 1.00 0.00 C ATOM 657 C LEU A 41 -14.374 -2.378 4.819 1.00 0.00 C ATOM 658 O LEU A 41 -15.554 -2.106 5.036 1.00 0.00 O ATOM 659 CB LEU A 41 -13.544 -1.907 2.442 1.00 0.00 C ATOM 660 CG LEU A 41 -12.971 -2.437 1.126 1.00 0.00 C ATOM 661 CD1 LEU A 41 -13.991 -2.309 -0.007 1.00 0.00 C ATOM 662 CD2 LEU A 41 -11.648 -1.748 0.787 1.00 0.00 C ATOM 0 H LEU A 41 -15.890 -3.309 2.767 1.00 0.00 H new ATOM 0 HA LEU A 41 -13.051 -3.559 3.651 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -14.419 -1.297 2.215 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -12.805 -1.248 2.897 1.00 0.00 H new ATOM 0 HG LEU A 41 -12.758 -3.499 1.249 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -13.559 -2.693 -0.931 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -14.884 -2.882 0.241 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -14.258 -1.261 -0.139 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -11.262 -2.143 -0.153 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -11.811 -0.675 0.690 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -10.926 -1.935 1.582 1.00 0.00 H new ATOM 674 N GLU A 42 -13.391 -2.201 5.690 1.00 0.00 N ATOM 675 CA GLU A 42 -13.650 -1.653 7.010 1.00 0.00 C ATOM 676 C GLU A 42 -13.279 -0.169 7.051 1.00 0.00 C ATOM 677 O GLU A 42 -12.324 0.254 6.400 1.00 0.00 O ATOM 678 CB GLU A 42 -12.897 -2.436 8.087 1.00 0.00 C ATOM 679 CG GLU A 42 -13.851 -2.926 9.178 1.00 0.00 C ATOM 680 CD GLU A 42 -13.164 -3.943 10.091 1.00 0.00 C ATOM 681 OE1 GLU A 42 -12.897 -5.060 9.597 1.00 0.00 O ATOM 682 OE2 GLU A 42 -12.922 -3.581 11.263 1.00 0.00 O ATOM 0 H GLU A 42 -12.414 -2.428 5.507 1.00 0.00 H new ATOM 0 HA GLU A 42 -14.716 -1.747 7.218 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -12.389 -3.287 7.634 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -12.127 -1.804 8.529 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -14.199 -2.079 9.769 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -14.731 -3.379 8.720 1.00 0.00 H new ATOM 689 N ARG A 43 -14.054 0.581 7.821 1.00 0.00 N ATOM 690 CA ARG A 43 -13.818 2.009 7.955 1.00 0.00 C ATOM 691 C ARG A 43 -12.699 2.270 8.965 1.00 0.00 C ATOM 692 O ARG A 43 -12.550 1.530 9.936 1.00 0.00 O ATOM 693 CB ARG A 43 -15.086 2.736 8.408 1.00 0.00 C ATOM 694 CG ARG A 43 -14.769 4.165 8.852 1.00 0.00 C ATOM 695 CD ARG A 43 -15.939 5.104 8.553 1.00 0.00 C ATOM 696 NE ARG A 43 -17.067 4.813 9.465 1.00 0.00 N ATOM 697 CZ ARG A 43 -18.198 5.530 9.515 1.00 0.00 C ATOM 698 NH1 ARG A 43 -18.358 6.586 8.706 1.00 0.00 N ATOM 699 NH2 ARG A 43 -19.169 5.192 10.375 1.00 0.00 N ATOM 0 H ARG A 43 -14.845 0.227 8.358 1.00 0.00 H new ATOM 0 HA ARG A 43 -13.524 2.390 6.977 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -15.809 2.757 7.592 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -15.549 2.190 9.230 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -14.551 4.178 9.920 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -13.874 4.519 8.340 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -15.623 6.141 8.671 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -16.257 4.983 7.518 1.00 0.00 H new ATOM 0 HE ARG A 43 -16.978 4.016 10.096 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -17.619 6.844 8.052 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -19.219 7.132 8.744 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -19.047 4.389 10.992 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -20.030 5.738 10.413 1.00 0.00 H new ATOM 713 N VAL A 44 -11.941 3.324 8.701 1.00 0.00 N ATOM 714 CA VAL A 44 -10.840 3.692 9.575 1.00 0.00 C ATOM 715 C VAL A 44 -11.277 4.846 10.480 1.00 0.00 C ATOM 716 O VAL A 44 -11.128 6.012 10.119 1.00 0.00 O ATOM 717 CB VAL A 44 -9.599 4.021 8.743 1.00 0.00 C ATOM 718 CG1 VAL A 44 -8.494 4.614 9.619 1.00 0.00 C ATOM 719 CG2 VAL A 44 -9.100 2.786 7.991 1.00 0.00 C ATOM 0 H VAL A 44 -12.068 3.935 7.894 1.00 0.00 H new ATOM 0 HA VAL A 44 -10.569 2.857 10.221 1.00 0.00 H new ATOM 0 HB VAL A 44 -9.880 4.772 8.004 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -7.623 4.839 9.003 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -8.854 5.530 10.088 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -8.217 3.896 10.391 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -8.217 3.047 7.407 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -8.844 2.004 8.706 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -9.883 2.426 7.323 1.00 0.00 H new ATOM 729 N HIS A 45 -11.807 4.480 11.638 1.00 0.00 N ATOM 730 CA HIS A 45 -12.266 5.470 12.597 1.00 0.00 C ATOM 731 C HIS A 45 -11.136 6.458 12.895 1.00 0.00 C ATOM 732 O HIS A 45 -11.386 7.636 13.143 1.00 0.00 O ATOM 733 CB HIS A 45 -12.810 4.794 13.857 1.00 0.00 C ATOM 734 CG HIS A 45 -14.207 4.241 13.702 1.00 0.00 C ATOM 735 ND1 HIS A 45 -14.986 4.474 12.582 1.00 0.00 N ATOM 736 CD2 HIS A 45 -14.955 3.464 14.537 1.00 0.00 C ATOM 737 CE1 HIS A 45 -16.148 3.860 12.746 1.00 0.00 C ATOM 738 NE2 HIS A 45 -16.128 3.235 13.959 1.00 0.00 N ATOM 0 H HIS A 45 -11.929 3.511 11.934 1.00 0.00 H new ATOM 0 HA HIS A 45 -13.095 6.037 12.172 1.00 0.00 H new ATOM 0 HB2 HIS A 45 -12.139 3.984 14.141 1.00 0.00 H new ATOM 0 HB3 HIS A 45 -12.804 5.514 14.675 1.00 0.00 H new ATOM 0 HD2 HIS A 45 -14.645 3.097 15.504 1.00 0.00 H new ATOM 0 HE1 HIS A 45 -16.968 3.855 12.043 1.00 0.00 H new ATOM 0 HE2 HIS A 45 -16.889 2.683 14.356 1.00 0.00 H new ATOM 746 N GLU A 46 -9.917 5.941 12.861 1.00 0.00 N ATOM 747 CA GLU A 46 -8.748 6.763 13.124 1.00 0.00 C ATOM 748 C GLU A 46 -8.734 7.979 12.196 1.00 0.00 C ATOM 749 O GLU A 46 -8.137 9.005 12.519 1.00 0.00 O ATOM 750 CB GLU A 46 -7.461 5.948 12.980 1.00 0.00 C ATOM 751 CG GLU A 46 -6.523 6.190 14.165 1.00 0.00 C ATOM 752 CD GLU A 46 -7.145 5.686 15.469 1.00 0.00 C ATOM 753 OE1 GLU A 46 -7.272 4.449 15.596 1.00 0.00 O ATOM 754 OE2 GLU A 46 -7.481 6.549 16.308 1.00 0.00 O ATOM 0 H GLU A 46 -9.713 4.963 12.655 1.00 0.00 H new ATOM 0 HA GLU A 46 -8.801 7.117 14.153 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -7.703 4.887 12.914 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -6.957 6.218 12.052 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -5.574 5.683 13.991 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -6.305 7.255 14.250 1.00 0.00 H new ATOM 761 N CYS A 47 -9.398 7.824 11.060 1.00 0.00 N ATOM 762 CA CYS A 47 -9.469 8.896 10.083 1.00 0.00 C ATOM 763 C CYS A 47 -10.922 9.369 9.993 1.00 0.00 C ATOM 764 O CYS A 47 -11.815 8.584 9.679 1.00 0.00 O ATOM 765 CB CYS A 47 -8.927 8.458 8.721 1.00 0.00 C ATOM 766 SG CYS A 47 -8.300 9.909 7.799 1.00 0.00 S ATOM 0 H CYS A 47 -9.892 6.972 10.795 1.00 0.00 H new ATOM 0 HA CYS A 47 -8.837 9.724 10.403 1.00 0.00 H new ATOM 0 HB2 CYS A 47 -8.127 7.730 8.856 1.00 0.00 H new ATOM 0 HB3 CYS A 47 -9.713 7.966 8.149 1.00 0.00 H new ATOM 0 HG CYS A 47 -9.208 10.318 6.964 1.00 0.00 H new ATOM 772 N GLN A 48 -11.112 10.650 10.275 1.00 0.00 N ATOM 773 CA GLN A 48 -12.441 11.236 10.230 1.00 0.00 C ATOM 774 C GLN A 48 -13.121 10.909 8.899 1.00 0.00 C ATOM 775 O GLN A 48 -14.271 10.471 8.877 1.00 0.00 O ATOM 776 CB GLN A 48 -12.381 12.748 10.457 1.00 0.00 C ATOM 777 CG GLN A 48 -11.458 13.090 11.629 1.00 0.00 C ATOM 778 CD GLN A 48 -12.103 14.129 12.549 1.00 0.00 C ATOM 779 OE1 GLN A 48 -12.953 14.907 12.150 1.00 0.00 O ATOM 780 NE2 GLN A 48 -11.651 14.098 13.800 1.00 0.00 N ATOM 0 H GLN A 48 -10.368 11.298 10.535 1.00 0.00 H new ATOM 0 HA GLN A 48 -13.035 10.803 11.035 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -12.025 13.241 9.553 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -13.383 13.130 10.655 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -11.234 12.186 12.196 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -10.510 13.472 11.251 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -10.937 13.420 14.068 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -12.018 14.752 14.491 1.00 0.00 H new ATOM 789 N THR A 49 -12.382 11.133 7.822 1.00 0.00 N ATOM 790 CA THR A 49 -12.900 10.867 6.491 1.00 0.00 C ATOM 791 C THR A 49 -13.296 9.395 6.357 1.00 0.00 C ATOM 792 O THR A 49 -12.782 8.542 7.079 1.00 0.00 O ATOM 793 CB THR A 49 -11.843 11.306 5.476 1.00 0.00 C ATOM 794 OG1 THR A 49 -10.652 10.657 5.912 1.00 0.00 O ATOM 795 CG2 THR A 49 -11.514 12.797 5.581 1.00 0.00 C ATOM 0 H THR A 49 -11.429 11.496 7.844 1.00 0.00 H new ATOM 0 HA THR A 49 -13.811 11.435 6.300 1.00 0.00 H new ATOM 0 HB THR A 49 -12.192 11.081 4.468 1.00 0.00 H new ATOM 0 HG1 THR A 49 -9.915 10.886 5.308 1.00 0.00 H new ATOM 0 HG21 THR A 49 -10.759 13.056 4.839 1.00 0.00 H new ATOM 0 HG22 THR A 49 -12.416 13.382 5.401 1.00 0.00 H new ATOM 0 HG23 THR A 49 -11.133 13.016 6.578 1.00 0.00 H new ATOM 803 N PRO A 50 -14.230 9.136 5.403 1.00 0.00 N ATOM 804 CA PRO A 50 -14.701 7.782 5.165 1.00 0.00 C ATOM 805 C PRO A 50 -13.653 6.962 4.411 1.00 0.00 C ATOM 806 O PRO A 50 -13.819 6.674 3.226 1.00 0.00 O ATOM 807 CB PRO A 50 -15.997 7.947 4.389 1.00 0.00 C ATOM 808 CG PRO A 50 -15.965 9.356 3.819 1.00 0.00 C ATOM 809 CD PRO A 50 -14.860 10.121 4.529 1.00 0.00 C ATOM 0 HA PRO A 50 -14.873 7.228 6.088 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -16.073 7.206 3.594 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -16.861 7.808 5.038 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -15.781 9.329 2.745 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -16.926 9.849 3.966 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -14.145 10.534 3.818 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -15.262 10.958 5.100 1.00 0.00 H new ATOM 817 N PHE A 51 -12.596 6.609 5.128 1.00 0.00 N ATOM 818 CA PHE A 51 -11.521 5.827 4.541 1.00 0.00 C ATOM 819 C PHE A 51 -11.686 4.340 4.860 1.00 0.00 C ATOM 820 O PHE A 51 -11.595 3.936 6.018 1.00 0.00 O ATOM 821 CB PHE A 51 -10.214 6.327 5.161 1.00 0.00 C ATOM 822 CG PHE A 51 -8.969 5.584 4.673 1.00 0.00 C ATOM 823 CD1 PHE A 51 -8.960 5.007 3.441 1.00 0.00 C ATOM 824 CD2 PHE A 51 -7.871 5.499 5.471 1.00 0.00 C ATOM 825 CE1 PHE A 51 -7.805 4.317 2.988 1.00 0.00 C ATOM 826 CE2 PHE A 51 -6.716 4.809 5.018 1.00 0.00 C ATOM 827 CZ PHE A 51 -6.707 4.233 3.786 1.00 0.00 C ATOM 0 H PHE A 51 -12.461 6.850 6.110 1.00 0.00 H new ATOM 0 HA PHE A 51 -11.528 5.941 3.457 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -10.101 7.388 4.939 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -10.279 6.233 6.245 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -9.832 5.074 2.807 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -7.878 5.956 6.449 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -7.798 3.859 2.010 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -5.844 4.741 5.652 1.00 0.00 H new ATOM 0 HZ PHE A 51 -5.828 3.709 3.441 1.00 0.00 H new ATOM 837 N PHE A 52 -11.927 3.566 3.812 1.00 0.00 N ATOM 838 CA PHE A 52 -12.106 2.132 3.966 1.00 0.00 C ATOM 839 C PHE A 52 -10.861 1.371 3.508 1.00 0.00 C ATOM 840 O PHE A 52 -10.198 1.776 2.553 1.00 0.00 O ATOM 841 CB PHE A 52 -13.289 1.731 3.082 1.00 0.00 C ATOM 842 CG PHE A 52 -14.544 2.579 3.299 1.00 0.00 C ATOM 843 CD1 PHE A 52 -15.160 2.584 4.512 1.00 0.00 C ATOM 844 CD2 PHE A 52 -15.043 3.329 2.280 1.00 0.00 C ATOM 845 CE1 PHE A 52 -16.325 3.371 4.713 1.00 0.00 C ATOM 846 CE2 PHE A 52 -16.208 4.116 2.481 1.00 0.00 C ATOM 847 CZ PHE A 52 -16.824 4.120 3.694 1.00 0.00 C ATOM 0 H PHE A 52 -12.003 3.905 2.853 1.00 0.00 H new ATOM 0 HA PHE A 52 -12.281 1.890 5.014 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -12.989 1.805 2.037 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -13.532 0.685 3.271 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -14.763 1.990 5.322 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -14.553 3.326 1.318 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -16.815 3.374 5.676 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -16.605 4.711 1.672 1.00 0.00 H new ATOM 0 HZ PHE A 52 -17.710 4.718 3.848 1.00 0.00 H new ATOM 857 N VAL A 53 -10.580 0.282 4.208 1.00 0.00 N ATOM 858 CA VAL A 53 -9.426 -0.539 3.885 1.00 0.00 C ATOM 859 C VAL A 53 -9.767 -2.010 4.130 1.00 0.00 C ATOM 860 O VAL A 53 -10.747 -2.319 4.805 1.00 0.00 O ATOM 861 CB VAL A 53 -8.208 -0.067 4.682 1.00 0.00 C ATOM 862 CG1 VAL A 53 -8.154 1.461 4.748 1.00 0.00 C ATOM 863 CG2 VAL A 53 -8.201 -0.677 6.085 1.00 0.00 C ATOM 0 H VAL A 53 -11.132 -0.051 4.998 1.00 0.00 H new ATOM 0 HA VAL A 53 -9.168 -0.436 2.831 1.00 0.00 H new ATOM 0 HB VAL A 53 -7.314 -0.411 4.162 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -7.279 1.770 5.320 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -8.089 1.867 3.738 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -9.055 1.836 5.233 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -7.325 -0.325 6.630 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -9.104 -0.377 6.617 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -8.169 -1.764 6.009 1.00 0.00 H new ATOM 873 N HIS A 54 -8.939 -2.878 3.568 1.00 0.00 N ATOM 874 CA HIS A 54 -9.140 -4.309 3.716 1.00 0.00 C ATOM 875 C HIS A 54 -7.872 -5.053 3.293 1.00 0.00 C ATOM 876 O HIS A 54 -7.395 -4.885 2.172 1.00 0.00 O ATOM 877 CB HIS A 54 -10.381 -4.766 2.946 1.00 0.00 C ATOM 878 CG HIS A 54 -10.722 -6.224 3.140 1.00 0.00 C ATOM 879 ND1 HIS A 54 -11.487 -6.681 4.198 1.00 0.00 N ATOM 880 CD2 HIS A 54 -10.394 -7.322 2.399 1.00 0.00 C ATOM 881 CE1 HIS A 54 -11.607 -7.996 4.090 1.00 0.00 C ATOM 882 NE2 HIS A 54 -10.929 -8.391 2.974 1.00 0.00 N ATOM 0 H HIS A 54 -8.127 -2.617 3.009 1.00 0.00 H new ATOM 0 HA HIS A 54 -9.326 -4.547 4.763 1.00 0.00 H new ATOM 0 HB2 HIS A 54 -11.232 -4.160 3.256 1.00 0.00 H new ATOM 0 HB3 HIS A 54 -10.226 -4.578 1.884 1.00 0.00 H new ATOM 0 HD2 HIS A 54 -9.800 -7.321 1.497 1.00 0.00 H new ATOM 0 HE1 HIS A 54 -12.147 -8.642 4.767 1.00 0.00 H new ATOM 0 HE2 HIS A 54 -10.847 -9.350 2.637 1.00 0.00 H new ATOM 890 N ALA A 55 -7.363 -5.859 4.212 1.00 0.00 N ATOM 891 CA ALA A 55 -6.159 -6.630 3.948 1.00 0.00 C ATOM 892 C ALA A 55 -6.494 -8.122 3.995 1.00 0.00 C ATOM 893 O ALA A 55 -7.248 -8.566 4.859 1.00 0.00 O ATOM 894 CB ALA A 55 -5.075 -6.243 4.956 1.00 0.00 C ATOM 0 H ALA A 55 -7.762 -5.996 5.141 1.00 0.00 H new ATOM 0 HA ALA A 55 -5.772 -6.411 2.953 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -4.172 -6.821 4.759 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -4.854 -5.180 4.862 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -5.426 -6.452 5.966 1.00 0.00 H new ATOM 900 N ASP A 56 -5.916 -8.855 3.055 1.00 0.00 N ATOM 901 CA ASP A 56 -6.143 -10.288 2.978 1.00 0.00 C ATOM 902 C ASP A 56 -5.082 -10.921 2.075 1.00 0.00 C ATOM 903 O ASP A 56 -4.310 -10.214 1.429 1.00 0.00 O ATOM 904 CB ASP A 56 -7.517 -10.597 2.381 1.00 0.00 C ATOM 905 CG ASP A 56 -8.648 -10.740 3.401 1.00 0.00 C ATOM 906 OD1 ASP A 56 -8.319 -10.969 4.585 1.00 0.00 O ATOM 907 OD2 ASP A 56 -9.816 -10.618 2.974 1.00 0.00 O ATOM 0 H ASP A 56 -5.291 -8.483 2.340 1.00 0.00 H new ATOM 0 HA ASP A 56 -6.090 -10.692 3.989 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -7.778 -9.804 1.680 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -7.447 -11.521 1.806 1.00 0.00 H new ATOM 912 N VAL A 57 -5.077 -12.245 2.060 1.00 0.00 N ATOM 913 CA VAL A 57 -4.124 -12.981 1.247 1.00 0.00 C ATOM 914 C VAL A 57 -4.845 -14.126 0.534 1.00 0.00 C ATOM 915 O VAL A 57 -5.448 -14.982 1.179 1.00 0.00 O ATOM 916 CB VAL A 57 -2.955 -13.457 2.112 1.00 0.00 C ATOM 917 CG1 VAL A 57 -3.435 -13.855 3.510 1.00 0.00 C ATOM 918 CG2 VAL A 57 -2.209 -14.611 1.440 1.00 0.00 C ATOM 0 H VAL A 57 -5.718 -12.828 2.598 1.00 0.00 H new ATOM 0 HA VAL A 57 -3.700 -12.335 0.478 1.00 0.00 H new ATOM 0 HB VAL A 57 -2.258 -12.626 2.220 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -2.585 -14.190 4.105 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -3.900 -12.996 3.993 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -4.162 -14.663 3.429 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -1.383 -14.930 2.076 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -2.893 -15.446 1.287 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -1.819 -14.281 0.477 1.00 0.00 H new ATOM 928 N GLU A 58 -4.759 -14.106 -0.788 1.00 0.00 N ATOM 929 CA GLU A 58 -5.396 -15.132 -1.596 1.00 0.00 C ATOM 930 C GLU A 58 -4.340 -16.040 -2.230 1.00 0.00 C ATOM 931 O GLU A 58 -3.621 -15.622 -3.137 1.00 0.00 O ATOM 932 CB GLU A 58 -6.296 -14.508 -2.665 1.00 0.00 C ATOM 933 CG GLU A 58 -7.735 -14.378 -2.161 1.00 0.00 C ATOM 934 CD GLU A 58 -8.722 -14.989 -3.158 1.00 0.00 C ATOM 935 OE1 GLU A 58 -8.718 -16.234 -3.270 1.00 0.00 O ATOM 936 OE2 GLU A 58 -9.458 -14.197 -3.785 1.00 0.00 O ATOM 0 H GLU A 58 -4.257 -13.395 -1.320 1.00 0.00 H new ATOM 0 HA GLU A 58 -6.026 -15.739 -0.946 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -5.913 -13.525 -2.940 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -6.276 -15.121 -3.566 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -7.833 -14.875 -1.196 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -7.975 -13.327 -2.004 1.00 0.00 H new ATOM 943 N GLY A 59 -4.280 -17.264 -1.729 1.00 0.00 N ATOM 944 CA GLY A 59 -3.324 -18.235 -2.235 1.00 0.00 C ATOM 945 C GLY A 59 -1.974 -18.094 -1.528 1.00 0.00 C ATOM 946 O GLY A 59 -1.682 -18.831 -0.588 1.00 0.00 O ATOM 0 H GLY A 59 -4.878 -17.607 -0.977 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -3.712 -19.243 -2.089 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -3.193 -18.097 -3.308 1.00 0.00 H new ATOM 950 N GLY A 60 -1.187 -17.143 -2.009 1.00 0.00 N ATOM 951 CA GLY A 60 0.125 -16.897 -1.436 1.00 0.00 C ATOM 952 C GLY A 60 0.545 -15.439 -1.634 1.00 0.00 C ATOM 953 O GLY A 60 1.732 -15.118 -1.579 1.00 0.00 O ATOM 0 H GLY A 60 -1.433 -16.534 -2.789 1.00 0.00 H new ATOM 0 HA2 GLY A 60 0.111 -17.134 -0.372 1.00 0.00 H new ATOM 0 HA3 GLY A 60 0.858 -17.557 -1.900 1.00 0.00 H new ATOM 957 N LYS A 61 -0.450 -14.595 -1.861 1.00 0.00 N ATOM 958 CA LYS A 61 -0.199 -13.179 -2.068 1.00 0.00 C ATOM 959 C LYS A 61 -1.224 -12.363 -1.277 1.00 0.00 C ATOM 960 O LYS A 61 -2.336 -12.826 -1.032 1.00 0.00 O ATOM 961 CB LYS A 61 -0.173 -12.852 -3.562 1.00 0.00 C ATOM 962 CG LYS A 61 1.037 -13.494 -4.243 1.00 0.00 C ATOM 963 CD LYS A 61 0.977 -13.306 -5.760 1.00 0.00 C ATOM 964 CE LYS A 61 0.889 -14.655 -6.477 1.00 0.00 C ATOM 965 NZ LYS A 61 2.205 -15.029 -7.040 1.00 0.00 N ATOM 0 H LYS A 61 -1.433 -14.865 -1.906 1.00 0.00 H new ATOM 0 HA LYS A 61 0.786 -12.907 -1.689 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -1.090 -13.208 -4.032 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -0.142 -11.771 -3.701 1.00 0.00 H new ATOM 0 HG2 LYS A 61 1.954 -13.052 -3.854 1.00 0.00 H new ATOM 0 HG3 LYS A 61 1.070 -14.557 -4.006 1.00 0.00 H new ATOM 0 HD2 LYS A 61 0.113 -12.695 -6.020 1.00 0.00 H new ATOM 0 HD3 LYS A 61 1.862 -12.767 -6.099 1.00 0.00 H new ATOM 0 HE2 LYS A 61 0.554 -15.423 -5.780 1.00 0.00 H new ATOM 0 HE3 LYS A 61 0.147 -14.602 -7.274 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 2.128 -15.947 -7.523 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 2.510 -14.304 -7.720 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 2.904 -15.099 -6.273 1.00 0.00 H new ATOM 979 N VAL A 62 -0.812 -11.161 -0.900 1.00 0.00 N ATOM 980 CA VAL A 62 -1.680 -10.276 -0.142 1.00 0.00 C ATOM 981 C VAL A 62 -2.549 -9.471 -1.110 1.00 0.00 C ATOM 982 O VAL A 62 -2.175 -9.267 -2.264 1.00 0.00 O ATOM 983 CB VAL A 62 -0.844 -9.393 0.787 1.00 0.00 C ATOM 984 CG1 VAL A 62 -1.726 -8.713 1.836 1.00 0.00 C ATOM 985 CG2 VAL A 62 0.274 -10.200 1.451 1.00 0.00 C ATOM 0 H VAL A 62 0.111 -10.780 -1.105 1.00 0.00 H new ATOM 0 HA VAL A 62 -2.351 -10.852 0.496 1.00 0.00 H new ATOM 0 HB VAL A 62 -0.381 -8.614 0.182 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -1.108 -8.091 2.484 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -2.470 -8.091 1.338 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -2.230 -9.472 2.435 1.00 0.00 H new ATOM 0 HG21 VAL A 62 0.853 -9.549 2.106 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -0.161 -11.010 2.037 1.00 0.00 H new ATOM 0 HG23 VAL A 62 0.927 -10.617 0.684 1.00 0.00 H new ATOM 995 N ARG A 63 -3.693 -9.033 -0.603 1.00 0.00 N ATOM 996 CA ARG A 63 -4.618 -8.255 -1.408 1.00 0.00 C ATOM 997 C ARG A 63 -5.074 -7.012 -0.641 1.00 0.00 C ATOM 998 O ARG A 63 -5.744 -7.123 0.385 1.00 0.00 O ATOM 999 CB ARG A 63 -5.844 -9.084 -1.796 1.00 0.00 C ATOM 1000 CG ARG A 63 -5.476 -10.163 -2.816 1.00 0.00 C ATOM 1001 CD ARG A 63 -5.027 -9.537 -4.138 1.00 0.00 C ATOM 1002 NE ARG A 63 -5.551 -10.326 -5.276 1.00 0.00 N ATOM 1003 CZ ARG A 63 -5.192 -10.133 -6.552 1.00 0.00 C ATOM 1004 NH1 ARG A 63 -4.306 -9.177 -6.862 1.00 0.00 N ATOM 1005 NH2 ARG A 63 -5.720 -10.896 -7.519 1.00 0.00 N ATOM 0 H ARG A 63 -3.999 -9.203 0.355 1.00 0.00 H new ATOM 0 HA ARG A 63 -4.095 -7.955 -2.316 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -6.269 -9.549 -0.907 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -6.612 -8.432 -2.212 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -4.678 -10.789 -2.417 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -6.334 -10.812 -2.990 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -5.384 -8.509 -4.203 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -3.938 -9.500 -4.181 1.00 0.00 H new ATOM 0 HE ARG A 63 -6.228 -11.063 -5.076 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -3.905 -8.596 -6.126 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -4.033 -9.030 -7.834 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -6.395 -11.623 -7.283 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -5.447 -10.749 -8.491 1.00 0.00 H new ATOM 1019 N LEU A 64 -4.693 -5.857 -1.167 1.00 0.00 N ATOM 1020 CA LEU A 64 -5.054 -4.595 -0.544 1.00 0.00 C ATOM 1021 C LEU A 64 -6.276 -4.011 -1.256 1.00 0.00 C ATOM 1022 O LEU A 64 -6.483 -4.257 -2.443 1.00 0.00 O ATOM 1023 CB LEU A 64 -3.851 -3.651 -0.511 1.00 0.00 C ATOM 1024 CG LEU A 64 -2.668 -4.101 0.348 1.00 0.00 C ATOM 1025 CD1 LEU A 64 -1.577 -3.028 0.384 1.00 0.00 C ATOM 1026 CD2 LEU A 64 -3.129 -4.496 1.753 1.00 0.00 C ATOM 0 H LEU A 64 -4.138 -5.769 -2.018 1.00 0.00 H new ATOM 0 HA LEU A 64 -5.336 -4.750 0.497 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -3.499 -3.508 -1.533 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -4.187 -2.679 -0.150 1.00 0.00 H new ATOM 0 HG LEU A 64 -2.232 -4.989 -0.110 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -0.748 -3.373 1.001 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -1.221 -2.837 -0.628 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -1.985 -2.109 0.805 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -2.269 -4.812 2.343 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -3.604 -3.641 2.234 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -3.843 -5.317 1.684 1.00 0.00 H new ATOM 1038 N TYR A 65 -7.052 -3.248 -0.500 1.00 0.00 N ATOM 1039 CA TYR A 65 -8.248 -2.627 -1.044 1.00 0.00 C ATOM 1040 C TYR A 65 -8.604 -1.355 -0.272 1.00 0.00 C ATOM 1041 O TYR A 65 -8.842 -1.402 0.934 1.00 0.00 O ATOM 1042 CB TYR A 65 -9.372 -3.649 -0.866 1.00 0.00 C ATOM 1043 CG TYR A 65 -9.131 -4.973 -1.595 1.00 0.00 C ATOM 1044 CD1 TYR A 65 -9.198 -5.024 -2.972 1.00 0.00 C ATOM 1045 CD2 TYR A 65 -8.847 -6.115 -0.875 1.00 0.00 C ATOM 1046 CE1 TYR A 65 -8.971 -6.270 -3.658 1.00 0.00 C ATOM 1047 CE2 TYR A 65 -8.620 -7.361 -1.560 1.00 0.00 C ATOM 1048 CZ TYR A 65 -8.693 -7.377 -2.918 1.00 0.00 C ATOM 1049 OH TYR A 65 -8.479 -8.554 -3.566 1.00 0.00 O ATOM 0 H TYR A 65 -6.876 -3.046 0.484 1.00 0.00 H new ATOM 0 HA TYR A 65 -8.096 -2.350 -2.087 1.00 0.00 H new ATOM 0 HB2 TYR A 65 -9.501 -3.850 0.197 1.00 0.00 H new ATOM 0 HB3 TYR A 65 -10.305 -3.214 -1.224 1.00 0.00 H new ATOM 0 HD1 TYR A 65 -9.421 -4.130 -3.535 1.00 0.00 H new ATOM 0 HD2 TYR A 65 -8.795 -6.074 0.203 1.00 0.00 H new ATOM 0 HE1 TYR A 65 -9.020 -6.324 -4.736 1.00 0.00 H new ATOM 0 HE2 TYR A 65 -8.397 -8.262 -1.008 1.00 0.00 H new ATOM 0 HH TYR A 65 -8.095 -8.376 -4.450 1.00 0.00 H new ATOM 1059 N PHE A 66 -8.630 -0.248 -1.000 1.00 0.00 N ATOM 1060 CA PHE A 66 -8.954 1.035 -0.398 1.00 0.00 C ATOM 1061 C PHE A 66 -10.099 1.719 -1.148 1.00 0.00 C ATOM 1062 O PHE A 66 -10.116 1.739 -2.378 1.00 0.00 O ATOM 1063 CB PHE A 66 -7.700 1.906 -0.502 1.00 0.00 C ATOM 1064 CG PHE A 66 -6.502 1.368 0.282 1.00 0.00 C ATOM 1065 CD1 PHE A 66 -6.473 1.474 1.638 1.00 0.00 C ATOM 1066 CD2 PHE A 66 -5.465 0.784 -0.376 1.00 0.00 C ATOM 1067 CE1 PHE A 66 -5.361 0.974 2.366 1.00 0.00 C ATOM 1068 CE2 PHE A 66 -4.353 0.284 0.352 1.00 0.00 C ATOM 1069 CZ PHE A 66 -4.324 0.390 1.707 1.00 0.00 C ATOM 0 H PHE A 66 -8.432 -0.213 -2.000 1.00 0.00 H new ATOM 0 HA PHE A 66 -9.267 0.893 0.636 1.00 0.00 H new ATOM 0 HB2 PHE A 66 -7.422 2.000 -1.552 1.00 0.00 H new ATOM 0 HB3 PHE A 66 -7.935 2.908 -0.144 1.00 0.00 H new ATOM 0 HD1 PHE A 66 -7.296 1.939 2.161 1.00 0.00 H new ATOM 0 HD2 PHE A 66 -5.487 0.700 -1.453 1.00 0.00 H new ATOM 0 HE1 PHE A 66 -5.339 1.057 3.443 1.00 0.00 H new ATOM 0 HE2 PHE A 66 -3.530 -0.181 -0.171 1.00 0.00 H new ATOM 0 HZ PHE A 66 -3.478 0.011 2.260 1.00 0.00 H new ATOM 1079 N HIS A 67 -11.028 2.262 -0.376 1.00 0.00 N ATOM 1080 CA HIS A 67 -12.174 2.945 -0.951 1.00 0.00 C ATOM 1081 C HIS A 67 -12.368 4.295 -0.258 1.00 0.00 C ATOM 1082 O HIS A 67 -12.601 4.350 0.948 1.00 0.00 O ATOM 1083 CB HIS A 67 -13.422 2.061 -0.887 1.00 0.00 C ATOM 1084 CG HIS A 67 -14.608 2.618 -1.637 1.00 0.00 C ATOM 1085 ND1 HIS A 67 -15.014 3.936 -1.525 1.00 0.00 N ATOM 1086 CD2 HIS A 67 -15.470 2.022 -2.511 1.00 0.00 C ATOM 1087 CE1 HIS A 67 -16.074 4.115 -2.300 1.00 0.00 C ATOM 1088 NE2 HIS A 67 -16.356 2.927 -2.909 1.00 0.00 N ATOM 0 H HIS A 67 -11.011 2.243 0.644 1.00 0.00 H new ATOM 0 HA HIS A 67 -11.992 3.141 -2.008 1.00 0.00 H new ATOM 0 HB2 HIS A 67 -13.179 1.078 -1.290 1.00 0.00 H new ATOM 0 HB3 HIS A 67 -13.700 1.918 0.157 1.00 0.00 H new ATOM 0 HD2 HIS A 67 -15.437 0.989 -2.826 1.00 0.00 H new ATOM 0 HE1 HIS A 67 -16.619 5.039 -2.427 1.00 0.00 H new ATOM 0 HE2 HIS A 67 -17.122 2.761 -3.562 1.00 0.00 H new ATOM 1096 N VAL A 68 -12.265 5.351 -1.052 1.00 0.00 N ATOM 1097 CA VAL A 68 -12.426 6.698 -0.530 1.00 0.00 C ATOM 1098 C VAL A 68 -13.249 7.527 -1.518 1.00 0.00 C ATOM 1099 O VAL A 68 -12.821 7.760 -2.647 1.00 0.00 O ATOM 1100 CB VAL A 68 -11.057 7.310 -0.230 1.00 0.00 C ATOM 1101 CG1 VAL A 68 -9.930 6.384 -0.692 1.00 0.00 C ATOM 1102 CG2 VAL A 68 -10.924 8.695 -0.867 1.00 0.00 C ATOM 0 H VAL A 68 -12.072 5.301 -2.052 1.00 0.00 H new ATOM 0 HA VAL A 68 -12.972 6.680 0.413 1.00 0.00 H new ATOM 0 HB VAL A 68 -10.972 7.429 0.850 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -8.967 6.843 -0.467 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -10.007 5.429 -0.172 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -10.011 6.220 -1.766 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -9.941 9.108 -0.638 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -11.040 8.611 -1.948 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -11.696 9.354 -0.469 1.00 0.00 H new ATOM 1112 N PRO A 69 -14.448 7.962 -1.044 1.00 0.00 N ATOM 1113 CA PRO A 69 -15.335 8.761 -1.873 1.00 0.00 C ATOM 1114 C PRO A 69 -14.823 10.198 -1.996 1.00 0.00 C ATOM 1115 O PRO A 69 -14.725 10.733 -3.100 1.00 0.00 O ATOM 1116 CB PRO A 69 -16.693 8.671 -1.196 1.00 0.00 C ATOM 1117 CG PRO A 69 -16.420 8.214 0.228 1.00 0.00 C ATOM 1118 CD PRO A 69 -14.988 7.706 0.288 1.00 0.00 C ATOM 0 HA PRO A 69 -15.391 8.399 -2.900 1.00 0.00 H new ATOM 0 HB2 PRO A 69 -17.199 9.636 -1.206 1.00 0.00 H new ATOM 0 HB3 PRO A 69 -17.342 7.966 -1.715 1.00 0.00 H new ATOM 0 HG2 PRO A 69 -16.562 9.038 0.927 1.00 0.00 H new ATOM 0 HG3 PRO A 69 -17.117 7.427 0.517 1.00 0.00 H new ATOM 0 HD2 PRO A 69 -14.415 8.227 1.055 1.00 0.00 H new ATOM 0 HD3 PRO A 69 -14.954 6.644 0.532 1.00 0.00 H new ATOM 1126 N ASP A 70 -14.510 10.782 -0.849 1.00 0.00 N ATOM 1127 CA ASP A 70 -14.011 12.146 -0.815 1.00 0.00 C ATOM 1128 C ASP A 70 -12.871 12.293 -1.825 1.00 0.00 C ATOM 1129 O ASP A 70 -12.512 13.407 -2.203 1.00 0.00 O ATOM 1130 CB ASP A 70 -13.463 12.498 0.570 1.00 0.00 C ATOM 1131 CG ASP A 70 -13.733 13.933 1.026 1.00 0.00 C ATOM 1132 OD1 ASP A 70 -14.043 14.761 0.143 1.00 0.00 O ATOM 1133 OD2 ASP A 70 -13.622 14.169 2.249 1.00 0.00 O ATOM 0 H ASP A 70 -14.592 10.335 0.064 1.00 0.00 H new ATOM 0 HA ASP A 70 -14.838 12.813 -1.056 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -13.895 11.813 1.300 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -12.386 12.328 0.572 1.00 0.00 H new ATOM 1138 N GLU A 71 -12.335 11.152 -2.235 1.00 0.00 N ATOM 1139 CA GLU A 71 -11.244 11.140 -3.194 1.00 0.00 C ATOM 1140 C GLU A 71 -10.148 12.117 -2.764 1.00 0.00 C ATOM 1141 O GLU A 71 -9.572 12.815 -3.597 1.00 0.00 O ATOM 1142 CB GLU A 71 -11.748 11.466 -4.602 1.00 0.00 C ATOM 1143 CG GLU A 71 -12.228 12.916 -4.690 1.00 0.00 C ATOM 1144 CD GLU A 71 -12.280 13.389 -6.145 1.00 0.00 C ATOM 1145 OE1 GLU A 71 -12.464 12.515 -7.019 1.00 0.00 O ATOM 1146 OE2 GLU A 71 -12.134 14.613 -6.349 1.00 0.00 O ATOM 0 H GLU A 71 -12.636 10.230 -1.920 1.00 0.00 H new ATOM 0 HA GLU A 71 -10.819 10.136 -3.219 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -10.950 11.299 -5.326 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -12.564 10.792 -4.865 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -13.217 13.003 -4.240 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -11.559 13.560 -4.118 1.00 0.00 H new ATOM 1153 N ALA A 72 -9.893 12.136 -1.464 1.00 0.00 N ATOM 1154 CA ALA A 72 -8.877 13.016 -0.914 1.00 0.00 C ATOM 1155 C ALA A 72 -7.510 12.630 -1.484 1.00 0.00 C ATOM 1156 O ALA A 72 -7.116 11.466 -1.426 1.00 0.00 O ATOM 1157 CB ALA A 72 -8.912 12.944 0.614 1.00 0.00 C ATOM 0 H ALA A 72 -10.373 11.556 -0.776 1.00 0.00 H new ATOM 0 HA ALA A 72 -9.072 14.050 -1.197 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -8.149 13.604 1.027 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -9.894 13.256 0.971 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -8.718 11.920 0.935 1.00 0.00 H new ATOM 1163 N PRO A 73 -6.808 13.655 -2.037 1.00 0.00 N ATOM 1164 CA PRO A 73 -5.494 13.434 -2.618 1.00 0.00 C ATOM 1165 C PRO A 73 -4.437 13.251 -1.527 1.00 0.00 C ATOM 1166 O PRO A 73 -3.347 12.746 -1.793 1.00 0.00 O ATOM 1167 CB PRO A 73 -5.241 14.651 -3.492 1.00 0.00 C ATOM 1168 CG PRO A 73 -6.209 15.719 -3.010 1.00 0.00 C ATOM 1169 CD PRO A 73 -7.244 15.045 -2.124 1.00 0.00 C ATOM 0 HA PRO A 73 -5.443 12.519 -3.208 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -4.209 14.990 -3.401 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -5.408 14.418 -4.544 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -5.678 16.493 -2.456 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -6.691 16.207 -3.857 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -7.285 15.510 -1.139 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -8.243 15.121 -2.554 1.00 0.00 H new ATOM 1177 N THR A 74 -4.795 13.672 -0.323 1.00 0.00 N ATOM 1178 CA THR A 74 -3.891 13.561 0.809 1.00 0.00 C ATOM 1179 C THR A 74 -4.210 12.308 1.626 1.00 0.00 C ATOM 1180 O THR A 74 -3.392 11.860 2.428 1.00 0.00 O ATOM 1181 CB THR A 74 -3.986 14.855 1.619 1.00 0.00 C ATOM 1182 OG1 THR A 74 -2.799 14.859 2.408 1.00 0.00 O ATOM 1183 CG2 THR A 74 -5.118 14.820 2.648 1.00 0.00 C ATOM 0 H THR A 74 -5.699 14.091 -0.107 1.00 0.00 H new ATOM 0 HA THR A 74 -2.859 13.442 0.480 1.00 0.00 H new ATOM 0 HB THR A 74 -4.137 15.696 0.942 1.00 0.00 H new ATOM 0 HG1 THR A 74 -2.521 13.936 2.586 1.00 0.00 H new ATOM 0 HG21 THR A 74 -5.141 15.762 3.195 1.00 0.00 H new ATOM 0 HG22 THR A 74 -6.070 14.673 2.137 1.00 0.00 H new ATOM 0 HG23 THR A 74 -4.950 13.999 3.345 1.00 0.00 H new ATOM 1191 N VAL A 75 -5.401 11.776 1.393 1.00 0.00 N ATOM 1192 CA VAL A 75 -5.839 10.583 2.098 1.00 0.00 C ATOM 1193 C VAL A 75 -5.517 9.350 1.252 1.00 0.00 C ATOM 1194 O VAL A 75 -4.952 8.379 1.753 1.00 0.00 O ATOM 1195 CB VAL A 75 -7.324 10.697 2.448 1.00 0.00 C ATOM 1196 CG1 VAL A 75 -7.818 9.436 3.159 1.00 0.00 C ATOM 1197 CG2 VAL A 75 -7.594 11.944 3.293 1.00 0.00 C ATOM 0 H VAL A 75 -6.076 12.149 0.726 1.00 0.00 H new ATOM 0 HA VAL A 75 -5.304 10.479 3.042 1.00 0.00 H new ATOM 0 HB VAL A 75 -7.881 10.796 1.516 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -8.876 9.543 3.397 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -7.678 8.573 2.508 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -7.252 9.292 4.080 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -8.657 12.001 3.528 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -7.020 11.888 4.218 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -7.297 12.832 2.736 1.00 0.00 H new ATOM 1207 N LYS A 76 -5.892 9.427 -0.017 1.00 0.00 N ATOM 1208 CA LYS A 76 -5.651 8.329 -0.937 1.00 0.00 C ATOM 1209 C LYS A 76 -4.143 8.119 -1.089 1.00 0.00 C ATOM 1210 O LYS A 76 -3.667 6.985 -1.084 1.00 0.00 O ATOM 1211 CB LYS A 76 -6.375 8.572 -2.263 1.00 0.00 C ATOM 1212 CG LYS A 76 -7.321 7.415 -2.591 1.00 0.00 C ATOM 1213 CD LYS A 76 -8.447 7.874 -3.519 1.00 0.00 C ATOM 1214 CE LYS A 76 -8.655 6.879 -4.663 1.00 0.00 C ATOM 1215 NZ LYS A 76 -10.086 6.522 -4.786 1.00 0.00 N ATOM 0 H LYS A 76 -6.361 10.233 -0.429 1.00 0.00 H new ATOM 0 HA LYS A 76 -6.064 7.402 -0.540 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -6.939 9.503 -2.208 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -5.645 8.688 -3.064 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -6.763 6.607 -3.063 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -7.744 7.014 -1.670 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -9.371 7.979 -2.951 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -8.210 8.857 -3.926 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -8.301 7.312 -5.598 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -8.064 5.981 -4.483 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -10.209 5.846 -5.567 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -10.413 6.089 -3.899 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -10.642 7.379 -4.979 1.00 0.00 H new ATOM 1229 N ALA A 77 -3.433 9.230 -1.222 1.00 0.00 N ATOM 1230 CA ALA A 77 -1.990 9.182 -1.375 1.00 0.00 C ATOM 1231 C ALA A 77 -1.425 8.060 -0.502 1.00 0.00 C ATOM 1232 O ALA A 77 -0.924 7.061 -1.016 1.00 0.00 O ATOM 1233 CB ALA A 77 -1.393 10.548 -1.027 1.00 0.00 C ATOM 0 H ALA A 77 -3.831 10.169 -1.227 1.00 0.00 H new ATOM 0 HA ALA A 77 -1.722 8.962 -2.408 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -0.310 10.512 -1.142 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -1.804 11.305 -1.695 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -1.640 10.801 0.004 1.00 0.00 H new ATOM 1239 N PHE A 78 -1.526 8.262 0.804 1.00 0.00 N ATOM 1240 CA PHE A 78 -1.031 7.280 1.753 1.00 0.00 C ATOM 1241 C PHE A 78 -1.514 5.874 1.389 1.00 0.00 C ATOM 1242 O PHE A 78 -0.706 4.965 1.203 1.00 0.00 O ATOM 1243 CB PHE A 78 -1.595 7.660 3.124 1.00 0.00 C ATOM 1244 CG PHE A 78 -0.711 7.235 4.299 1.00 0.00 C ATOM 1245 CD1 PHE A 78 0.438 7.911 4.565 1.00 0.00 C ATOM 1246 CD2 PHE A 78 -1.076 6.181 5.078 1.00 0.00 C ATOM 1247 CE1 PHE A 78 1.258 7.517 5.656 1.00 0.00 C ATOM 1248 CE2 PHE A 78 -0.257 5.787 6.168 1.00 0.00 C ATOM 1249 CZ PHE A 78 0.893 6.463 6.434 1.00 0.00 C ATOM 0 H PHE A 78 -1.943 9.091 1.227 1.00 0.00 H new ATOM 0 HA PHE A 78 0.059 7.274 1.748 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -1.736 8.740 3.161 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -2.579 7.206 3.240 1.00 0.00 H new ATOM 0 HD1 PHE A 78 0.728 8.748 3.947 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -1.989 5.644 4.867 1.00 0.00 H new ATOM 0 HE1 PHE A 78 2.171 8.054 5.867 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -0.547 4.950 6.786 1.00 0.00 H new ATOM 0 HZ PHE A 78 1.516 6.163 7.263 1.00 0.00 H new ATOM 1259 N ALA A 79 -2.829 5.739 1.298 1.00 0.00 N ATOM 1260 CA ALA A 79 -3.428 4.460 0.959 1.00 0.00 C ATOM 1261 C ALA A 79 -2.706 3.868 -0.253 1.00 0.00 C ATOM 1262 O ALA A 79 -2.199 2.749 -0.193 1.00 0.00 O ATOM 1263 CB ALA A 79 -4.926 4.647 0.711 1.00 0.00 C ATOM 0 H ALA A 79 -3.496 6.495 1.453 1.00 0.00 H new ATOM 0 HA ALA A 79 -3.320 3.756 1.784 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -5.375 3.687 0.457 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -5.397 5.041 1.611 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -5.074 5.346 -0.112 1.00 0.00 H new ATOM 1269 N GLY A 80 -2.682 4.646 -1.325 1.00 0.00 N ATOM 1270 CA GLY A 80 -2.030 4.213 -2.549 1.00 0.00 C ATOM 1271 C GLY A 80 -0.589 3.777 -2.279 1.00 0.00 C ATOM 1272 O GLY A 80 -0.076 2.872 -2.935 1.00 0.00 O ATOM 0 H GLY A 80 -3.104 5.574 -1.371 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -2.587 3.386 -2.989 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -2.038 5.025 -3.276 1.00 0.00 H new ATOM 1276 N LEU A 81 0.025 4.442 -1.311 1.00 0.00 N ATOM 1277 CA LEU A 81 1.397 4.134 -0.945 1.00 0.00 C ATOM 1278 C LEU A 81 1.487 2.673 -0.500 1.00 0.00 C ATOM 1279 O LEU A 81 2.308 1.914 -1.012 1.00 0.00 O ATOM 1280 CB LEU A 81 1.909 5.128 0.100 1.00 0.00 C ATOM 1281 CG LEU A 81 3.429 5.266 0.207 1.00 0.00 C ATOM 1282 CD1 LEU A 81 3.811 6.505 1.019 1.00 0.00 C ATOM 1283 CD2 LEU A 81 4.056 3.992 0.776 1.00 0.00 C ATOM 0 H LEU A 81 -0.403 5.193 -0.769 1.00 0.00 H new ATOM 0 HA LEU A 81 2.055 4.246 -1.807 1.00 0.00 H new ATOM 0 HB2 LEU A 81 1.490 6.109 -0.125 1.00 0.00 H new ATOM 0 HB3 LEU A 81 1.522 4.832 1.075 1.00 0.00 H new ATOM 0 HG LEU A 81 3.831 5.402 -0.797 1.00 0.00 H new ATOM 0 HD11 LEU A 81 4.897 6.580 1.080 1.00 0.00 H new ATOM 0 HD12 LEU A 81 3.413 7.396 0.533 1.00 0.00 H new ATOM 0 HD13 LEU A 81 3.396 6.424 2.024 1.00 0.00 H new ATOM 0 HD21 LEU A 81 5.137 4.116 0.842 1.00 0.00 H new ATOM 0 HD22 LEU A 81 3.652 3.800 1.770 1.00 0.00 H new ATOM 0 HD23 LEU A 81 3.827 3.150 0.122 1.00 0.00 H new ATOM 1295 N LEU A 82 0.630 2.323 0.448 1.00 0.00 N ATOM 1296 CA LEU A 82 0.603 0.967 0.968 1.00 0.00 C ATOM 1297 C LEU A 82 0.489 -0.019 -0.197 1.00 0.00 C ATOM 1298 O LEU A 82 1.315 -0.920 -0.335 1.00 0.00 O ATOM 1299 CB LEU A 82 -0.506 0.815 2.011 1.00 0.00 C ATOM 1300 CG LEU A 82 -0.355 1.661 3.278 1.00 0.00 C ATOM 1301 CD1 LEU A 82 1.063 1.555 3.842 1.00 0.00 C ATOM 1302 CD2 LEU A 82 -0.761 3.113 3.018 1.00 0.00 C ATOM 0 H LEU A 82 -0.051 2.955 0.869 1.00 0.00 H new ATOM 0 HA LEU A 82 1.533 0.741 1.489 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -1.457 1.067 1.541 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -0.562 -0.234 2.303 1.00 0.00 H new ATOM 0 HG LEU A 82 -1.033 1.267 4.035 1.00 0.00 H new ATOM 0 HD11 LEU A 82 1.143 2.165 4.742 1.00 0.00 H new ATOM 0 HD12 LEU A 82 1.280 0.516 4.088 1.00 0.00 H new ATOM 0 HD13 LEU A 82 1.778 1.909 3.099 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -0.645 3.693 3.934 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -0.126 3.534 2.239 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -1.802 3.148 2.696 1.00 0.00 H new ATOM 1314 N ARG A 83 -0.540 0.186 -1.006 1.00 0.00 N ATOM 1315 CA ARG A 83 -0.772 -0.673 -2.154 1.00 0.00 C ATOM 1316 C ARG A 83 0.333 -0.479 -3.194 1.00 0.00 C ATOM 1317 O ARG A 83 0.450 -1.264 -4.134 1.00 0.00 O ATOM 1318 CB ARG A 83 -2.128 -0.376 -2.799 1.00 0.00 C ATOM 1319 CG ARG A 83 -2.436 -1.378 -3.914 1.00 0.00 C ATOM 1320 CD ARG A 83 -2.952 -0.664 -5.165 1.00 0.00 C ATOM 1321 NE ARG A 83 -2.524 -1.396 -6.378 1.00 0.00 N ATOM 1322 CZ ARG A 83 -1.315 -1.275 -6.941 1.00 0.00 C ATOM 1323 NH1 ARG A 83 -0.406 -0.449 -6.405 1.00 0.00 N ATOM 1324 NH2 ARG A 83 -1.014 -1.978 -8.041 1.00 0.00 N ATOM 0 H ARG A 83 -1.223 0.935 -0.889 1.00 0.00 H new ATOM 0 HA ARG A 83 -0.768 -1.705 -1.802 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -2.911 -0.416 -2.042 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -2.128 0.636 -3.204 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -1.537 -1.943 -4.158 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -3.180 -2.096 -3.568 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -4.040 -0.599 -5.134 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -2.572 0.357 -5.194 1.00 0.00 H new ATOM 0 HE ARG A 83 -3.192 -2.033 -6.813 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -0.635 0.087 -5.568 1.00 0.00 H new ATOM 0 HH12 ARG A 83 0.515 -0.357 -6.834 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -1.706 -2.606 -8.450 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -0.093 -1.885 -8.469 1.00 0.00 H new ATOM 1338 N GLU A 84 1.116 0.570 -2.990 1.00 0.00 N ATOM 1339 CA GLU A 84 2.208 0.877 -3.898 1.00 0.00 C ATOM 1340 C GLU A 84 3.290 -0.202 -3.811 1.00 0.00 C ATOM 1341 O GLU A 84 3.897 -0.560 -4.819 1.00 0.00 O ATOM 1342 CB GLU A 84 2.790 2.262 -3.608 1.00 0.00 C ATOM 1343 CG GLU A 84 4.097 2.154 -2.821 1.00 0.00 C ATOM 1344 CD GLU A 84 5.253 1.736 -3.733 1.00 0.00 C ATOM 1345 OE1 GLU A 84 5.321 2.288 -4.852 1.00 0.00 O ATOM 1346 OE2 GLU A 84 6.042 0.874 -3.290 1.00 0.00 O ATOM 0 H GLU A 84 1.016 1.218 -2.209 1.00 0.00 H new ATOM 0 HA GLU A 84 1.816 0.890 -4.915 1.00 0.00 H new ATOM 0 HB2 GLU A 84 2.968 2.789 -4.545 1.00 0.00 H new ATOM 0 HB3 GLU A 84 2.069 2.852 -3.043 1.00 0.00 H new ATOM 0 HG2 GLU A 84 4.325 3.112 -2.355 1.00 0.00 H new ATOM 0 HG3 GLU A 84 3.982 1.427 -2.017 1.00 0.00 H new ATOM 1353 N GLY A 85 3.498 -0.689 -2.597 1.00 0.00 N ATOM 1354 CA GLY A 85 4.496 -1.719 -2.365 1.00 0.00 C ATOM 1355 C GLY A 85 4.053 -2.670 -1.252 1.00 0.00 C ATOM 1356 O GLY A 85 4.778 -2.872 -0.278 1.00 0.00 O ATOM 0 H GLY A 85 2.992 -0.389 -1.763 1.00 0.00 H new ATOM 0 HA2 GLY A 85 4.664 -2.281 -3.284 1.00 0.00 H new ATOM 0 HA3 GLY A 85 5.446 -1.256 -2.096 1.00 0.00 H new ATOM 1360 N LEU A 86 2.866 -3.230 -1.432 1.00 0.00 N ATOM 1361 CA LEU A 86 2.318 -4.155 -0.455 1.00 0.00 C ATOM 1362 C LEU A 86 1.294 -5.064 -1.138 1.00 0.00 C ATOM 1363 O LEU A 86 1.321 -6.281 -0.957 1.00 0.00 O ATOM 1364 CB LEU A 86 1.759 -3.394 0.748 1.00 0.00 C ATOM 1365 CG LEU A 86 2.737 -2.462 1.466 1.00 0.00 C ATOM 1366 CD1 LEU A 86 2.011 -1.594 2.496 1.00 0.00 C ATOM 1367 CD2 LEU A 86 3.888 -3.252 2.092 1.00 0.00 C ATOM 0 H LEU A 86 2.268 -3.061 -2.241 1.00 0.00 H new ATOM 0 HA LEU A 86 3.102 -4.800 -0.059 1.00 0.00 H new ATOM 0 HB2 LEU A 86 0.905 -2.805 0.415 1.00 0.00 H new ATOM 0 HB3 LEU A 86 1.384 -4.120 1.469 1.00 0.00 H new ATOM 0 HG LEU A 86 3.173 -1.789 0.727 1.00 0.00 H new ATOM 0 HD11 LEU A 86 2.729 -0.941 2.992 1.00 0.00 H new ATOM 0 HD12 LEU A 86 1.256 -0.989 1.994 1.00 0.00 H new ATOM 0 HD13 LEU A 86 1.530 -2.233 3.236 1.00 0.00 H new ATOM 0 HD21 LEU A 86 4.569 -2.566 2.596 1.00 0.00 H new ATOM 0 HD22 LEU A 86 3.490 -3.964 2.815 1.00 0.00 H new ATOM 0 HD23 LEU A 86 4.427 -3.790 1.312 1.00 0.00 H new ATOM 1379 N GLU A 87 0.417 -4.439 -1.909 1.00 0.00 N ATOM 1380 CA GLU A 87 -0.614 -5.176 -2.620 1.00 0.00 C ATOM 1381 C GLU A 87 0.017 -6.270 -3.484 1.00 0.00 C ATOM 1382 O GLU A 87 0.755 -5.976 -4.423 1.00 0.00 O ATOM 1383 CB GLU A 87 -1.475 -4.237 -3.467 1.00 0.00 C ATOM 1384 CG GLU A 87 -2.663 -4.983 -4.077 1.00 0.00 C ATOM 1385 CD GLU A 87 -2.542 -5.057 -5.600 1.00 0.00 C ATOM 1386 OE1 GLU A 87 -2.799 -4.015 -6.241 1.00 0.00 O ATOM 1387 OE2 GLU A 87 -2.193 -6.153 -6.089 1.00 0.00 O ATOM 0 H GLU A 87 0.399 -3.430 -2.057 1.00 0.00 H new ATOM 0 HA GLU A 87 -1.266 -5.650 -1.886 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -1.836 -3.414 -2.851 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -0.869 -3.799 -4.261 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -2.715 -5.990 -3.664 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -3.591 -4.479 -3.807 1.00 0.00 H new ATOM 1394 N GLY A 88 -0.297 -7.510 -3.136 1.00 0.00 N ATOM 1395 CA GLY A 88 0.229 -8.649 -3.868 1.00 0.00 C ATOM 1396 C GLY A 88 1.397 -9.291 -3.117 1.00 0.00 C ATOM 1397 O GLY A 88 1.710 -10.461 -3.331 1.00 0.00 O ATOM 0 H GLY A 88 -0.909 -7.750 -2.356 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -0.560 -9.386 -4.018 1.00 0.00 H new ATOM 0 HA3 GLY A 88 0.559 -8.330 -4.857 1.00 0.00 H new ATOM 1401 N GLU A 89 2.011 -8.497 -2.252 1.00 0.00 N ATOM 1402 CA GLU A 89 3.138 -8.973 -1.468 1.00 0.00 C ATOM 1403 C GLU A 89 2.717 -10.163 -0.603 1.00 0.00 C ATOM 1404 O GLU A 89 1.604 -10.669 -0.735 1.00 0.00 O ATOM 1405 CB GLU A 89 3.721 -7.850 -0.608 1.00 0.00 C ATOM 1406 CG GLU A 89 4.353 -6.764 -1.480 1.00 0.00 C ATOM 1407 CD GLU A 89 5.583 -7.299 -2.218 1.00 0.00 C ATOM 1408 OE1 GLU A 89 6.616 -7.482 -1.539 1.00 0.00 O ATOM 1409 OE2 GLU A 89 5.461 -7.513 -3.443 1.00 0.00 O ATOM 0 H GLU A 89 1.749 -7.527 -2.077 1.00 0.00 H new ATOM 0 HA GLU A 89 3.918 -9.304 -2.153 1.00 0.00 H new ATOM 0 HB2 GLU A 89 2.935 -7.414 0.009 1.00 0.00 H new ATOM 0 HB3 GLU A 89 4.470 -8.258 0.071 1.00 0.00 H new ATOM 0 HG2 GLU A 89 3.621 -6.400 -2.201 1.00 0.00 H new ATOM 0 HG3 GLU A 89 4.638 -5.914 -0.859 1.00 0.00 H new ATOM 1416 N SER A 90 3.631 -10.577 0.263 1.00 0.00 N ATOM 1417 CA SER A 90 3.369 -11.698 1.149 1.00 0.00 C ATOM 1418 C SER A 90 2.690 -11.206 2.429 1.00 0.00 C ATOM 1419 O SER A 90 2.751 -10.020 2.752 1.00 0.00 O ATOM 1420 CB SER A 90 4.660 -12.446 1.487 1.00 0.00 C ATOM 1421 OG SER A 90 5.544 -12.515 0.372 1.00 0.00 O ATOM 0 H SER A 90 4.554 -10.156 0.370 1.00 0.00 H new ATOM 0 HA SER A 90 2.703 -12.391 0.635 1.00 0.00 H new ATOM 0 HB2 SER A 90 5.161 -11.948 2.317 1.00 0.00 H new ATOM 0 HB3 SER A 90 4.418 -13.455 1.821 1.00 0.00 H new ATOM 0 HG SER A 90 6.357 -12.998 0.629 1.00 0.00 H new ATOM 1427 N PRO A 91 2.043 -12.166 3.143 1.00 0.00 N ATOM 1428 CA PRO A 91 1.354 -11.843 4.380 1.00 0.00 C ATOM 1429 C PRO A 91 2.350 -11.619 5.520 1.00 0.00 C ATOM 1430 O PRO A 91 1.992 -11.074 6.564 1.00 0.00 O ATOM 1431 CB PRO A 91 0.421 -13.016 4.629 1.00 0.00 C ATOM 1432 CG PRO A 91 0.953 -14.159 3.781 1.00 0.00 C ATOM 1433 CD PRO A 91 1.951 -13.580 2.791 1.00 0.00 C ATOM 0 HA PRO A 91 0.792 -10.911 4.317 1.00 0.00 H new ATOM 0 HB2 PRO A 91 0.407 -13.287 5.685 1.00 0.00 H new ATOM 0 HB3 PRO A 91 -0.603 -12.767 4.350 1.00 0.00 H new ATOM 0 HG2 PRO A 91 1.431 -14.910 4.410 1.00 0.00 H new ATOM 0 HG3 PRO A 91 0.138 -14.656 3.255 1.00 0.00 H new ATOM 0 HD2 PRO A 91 2.920 -14.072 2.872 1.00 0.00 H new ATOM 0 HD3 PRO A 91 1.611 -13.711 1.764 1.00 0.00 H new ATOM 1441 N GLU A 92 3.580 -12.050 5.282 1.00 0.00 N ATOM 1442 CA GLU A 92 4.630 -11.903 6.275 1.00 0.00 C ATOM 1443 C GLU A 92 5.455 -10.646 5.993 1.00 0.00 C ATOM 1444 O GLU A 92 5.889 -9.963 6.920 1.00 0.00 O ATOM 1445 CB GLU A 92 5.521 -13.146 6.318 1.00 0.00 C ATOM 1446 CG GLU A 92 4.680 -14.423 6.371 1.00 0.00 C ATOM 1447 CD GLU A 92 4.940 -15.199 7.663 1.00 0.00 C ATOM 1448 OE1 GLU A 92 4.676 -14.617 8.738 1.00 0.00 O ATOM 1449 OE2 GLU A 92 5.398 -16.356 7.548 1.00 0.00 O ATOM 0 H GLU A 92 3.873 -12.501 4.415 1.00 0.00 H new ATOM 0 HA GLU A 92 4.165 -11.796 7.255 1.00 0.00 H new ATOM 0 HB2 GLU A 92 6.165 -13.167 5.439 1.00 0.00 H new ATOM 0 HB3 GLU A 92 6.174 -13.100 7.190 1.00 0.00 H new ATOM 0 HG2 GLU A 92 3.622 -14.169 6.302 1.00 0.00 H new ATOM 0 HG3 GLU A 92 4.913 -15.052 5.512 1.00 0.00 H new ATOM 1456 N ALA A 93 5.648 -10.378 4.710 1.00 0.00 N ATOM 1457 CA ALA A 93 6.413 -9.215 4.295 1.00 0.00 C ATOM 1458 C ALA A 93 5.649 -7.945 4.674 1.00 0.00 C ATOM 1459 O ALA A 93 6.255 -6.933 5.022 1.00 0.00 O ATOM 1460 CB ALA A 93 6.696 -9.300 2.793 1.00 0.00 C ATOM 0 H ALA A 93 5.288 -10.947 3.944 1.00 0.00 H new ATOM 0 HA ALA A 93 7.375 -9.185 4.807 1.00 0.00 H new ATOM 0 HB1 ALA A 93 7.270 -8.428 2.481 1.00 0.00 H new ATOM 0 HB2 ALA A 93 7.266 -10.204 2.581 1.00 0.00 H new ATOM 0 HB3 ALA A 93 5.753 -9.329 2.246 1.00 0.00 H new ATOM 1466 N VAL A 94 4.330 -8.040 4.592 1.00 0.00 N ATOM 1467 CA VAL A 94 3.477 -6.911 4.922 1.00 0.00 C ATOM 1468 C VAL A 94 3.554 -6.641 6.426 1.00 0.00 C ATOM 1469 O VAL A 94 3.894 -5.536 6.846 1.00 0.00 O ATOM 1470 CB VAL A 94 2.051 -7.172 4.434 1.00 0.00 C ATOM 1471 CG1 VAL A 94 1.035 -6.381 5.261 1.00 0.00 C ATOM 1472 CG2 VAL A 94 1.914 -6.852 2.944 1.00 0.00 C ATOM 0 H VAL A 94 3.831 -8.881 4.302 1.00 0.00 H new ATOM 0 HA VAL A 94 3.821 -6.011 4.412 1.00 0.00 H new ATOM 0 HB VAL A 94 1.839 -8.233 4.569 1.00 0.00 H new ATOM 0 HG11 VAL A 94 0.029 -6.585 4.893 1.00 0.00 H new ATOM 0 HG12 VAL A 94 1.106 -6.679 6.307 1.00 0.00 H new ATOM 0 HG13 VAL A 94 1.245 -5.315 5.172 1.00 0.00 H new ATOM 0 HG21 VAL A 94 0.891 -7.046 2.623 1.00 0.00 H new ATOM 0 HG22 VAL A 94 2.155 -5.803 2.774 1.00 0.00 H new ATOM 0 HG23 VAL A 94 2.599 -7.479 2.373 1.00 0.00 H new ATOM 1482 N LEU A 95 3.234 -7.671 7.197 1.00 0.00 N ATOM 1483 CA LEU A 95 3.263 -7.559 8.645 1.00 0.00 C ATOM 1484 C LEU A 95 4.628 -7.026 9.084 1.00 0.00 C ATOM 1485 O LEU A 95 4.727 -6.300 10.072 1.00 0.00 O ATOM 1486 CB LEU A 95 2.886 -8.893 9.293 1.00 0.00 C ATOM 1487 CG LEU A 95 1.394 -9.116 9.549 1.00 0.00 C ATOM 1488 CD1 LEU A 95 0.864 -8.132 10.593 1.00 0.00 C ATOM 1489 CD2 LEU A 95 0.598 -9.051 8.244 1.00 0.00 C ATOM 0 H LEU A 95 2.953 -8.587 6.846 1.00 0.00 H new ATOM 0 HA LEU A 95 2.516 -6.843 8.987 1.00 0.00 H new ATOM 0 HB2 LEU A 95 3.250 -9.699 8.656 1.00 0.00 H new ATOM 0 HB3 LEU A 95 3.414 -8.975 10.243 1.00 0.00 H new ATOM 0 HG LEU A 95 1.263 -10.119 9.956 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -0.199 -8.312 10.756 1.00 0.00 H new ATOM 0 HD12 LEU A 95 1.404 -8.270 11.530 1.00 0.00 H new ATOM 0 HD13 LEU A 95 1.009 -7.112 10.238 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -0.459 -9.213 8.454 1.00 0.00 H new ATOM 0 HD22 LEU A 95 0.731 -8.071 7.785 1.00 0.00 H new ATOM 0 HD23 LEU A 95 0.954 -9.823 7.562 1.00 0.00 H new ATOM 1501 N GLU A 96 5.648 -7.408 8.328 1.00 0.00 N ATOM 1502 CA GLU A 96 7.003 -6.978 8.627 1.00 0.00 C ATOM 1503 C GLU A 96 7.101 -5.452 8.566 1.00 0.00 C ATOM 1504 O GLU A 96 8.085 -4.871 9.022 1.00 0.00 O ATOM 1505 CB GLU A 96 8.008 -7.631 7.676 1.00 0.00 C ATOM 1506 CG GLU A 96 8.301 -9.073 8.094 1.00 0.00 C ATOM 1507 CD GLU A 96 9.646 -9.171 8.819 1.00 0.00 C ATOM 1508 OE1 GLU A 96 9.837 -8.381 9.769 1.00 0.00 O ATOM 1509 OE2 GLU A 96 10.451 -10.033 8.406 1.00 0.00 O ATOM 0 H GLU A 96 5.562 -8.010 7.509 1.00 0.00 H new ATOM 0 HA GLU A 96 7.250 -7.298 9.639 1.00 0.00 H new ATOM 0 HB2 GLU A 96 7.615 -7.616 6.659 1.00 0.00 H new ATOM 0 HB3 GLU A 96 8.934 -7.056 7.668 1.00 0.00 H new ATOM 0 HG2 GLU A 96 7.506 -9.436 8.745 1.00 0.00 H new ATOM 0 HG3 GLU A 96 8.310 -9.716 7.214 1.00 0.00 H new ATOM 1516 N VAL A 97 6.069 -4.847 7.998 1.00 0.00 N ATOM 1517 CA VAL A 97 6.026 -3.400 7.871 1.00 0.00 C ATOM 1518 C VAL A 97 5.564 -2.789 9.196 1.00 0.00 C ATOM 1519 O VAL A 97 4.483 -3.110 9.688 1.00 0.00 O ATOM 1520 CB VAL A 97 5.140 -3.004 6.689 1.00 0.00 C ATOM 1521 CG1 VAL A 97 5.078 -1.483 6.535 1.00 0.00 C ATOM 1522 CG2 VAL A 97 5.621 -3.667 5.397 1.00 0.00 C ATOM 0 H VAL A 97 5.255 -5.332 7.620 1.00 0.00 H new ATOM 0 HA VAL A 97 7.020 -3.006 7.661 1.00 0.00 H new ATOM 0 HB VAL A 97 4.131 -3.361 6.893 1.00 0.00 H new ATOM 0 HG11 VAL A 97 4.442 -1.229 5.687 1.00 0.00 H new ATOM 0 HG12 VAL A 97 4.667 -1.042 7.443 1.00 0.00 H new ATOM 0 HG13 VAL A 97 6.082 -1.093 6.365 1.00 0.00 H new ATOM 0 HG21 VAL A 97 4.974 -3.369 4.572 1.00 0.00 H new ATOM 0 HG22 VAL A 97 6.644 -3.355 5.187 1.00 0.00 H new ATOM 0 HG23 VAL A 97 5.588 -4.751 5.510 1.00 0.00 H new ATOM 1532 N PRO A 98 6.428 -1.897 9.750 1.00 0.00 N ATOM 1533 CA PRO A 98 6.119 -1.239 11.008 1.00 0.00 C ATOM 1534 C PRO A 98 5.064 -0.148 10.811 1.00 0.00 C ATOM 1535 O PRO A 98 4.703 0.176 9.681 1.00 0.00 O ATOM 1536 CB PRO A 98 7.449 -0.696 11.505 1.00 0.00 C ATOM 1537 CG PRO A 98 8.365 -0.663 10.292 1.00 0.00 C ATOM 1538 CD PRO A 98 7.716 -1.493 9.196 1.00 0.00 C ATOM 0 HA PRO A 98 5.682 -1.917 11.741 1.00 0.00 H new ATOM 0 HB2 PRO A 98 7.329 0.300 11.931 1.00 0.00 H new ATOM 0 HB3 PRO A 98 7.862 -1.331 12.289 1.00 0.00 H new ATOM 0 HG2 PRO A 98 8.516 0.363 9.955 1.00 0.00 H new ATOM 0 HG3 PRO A 98 9.347 -1.064 10.544 1.00 0.00 H new ATOM 0 HD2 PRO A 98 7.589 -0.912 8.282 1.00 0.00 H new ATOM 0 HD3 PRO A 98 8.327 -2.359 8.941 1.00 0.00 H new ATOM 1546 N PRO A 99 4.586 0.403 11.959 1.00 0.00 N ATOM 1547 CA PRO A 99 3.579 1.450 11.924 1.00 0.00 C ATOM 1548 C PRO A 99 4.192 2.786 11.498 1.00 0.00 C ATOM 1549 O PRO A 99 3.472 3.745 11.226 1.00 0.00 O ATOM 1550 CB PRO A 99 2.998 1.485 13.329 1.00 0.00 C ATOM 1551 CG PRO A 99 4.013 0.783 14.217 1.00 0.00 C ATOM 1552 CD PRO A 99 4.989 0.044 13.316 1.00 0.00 C ATOM 0 HA PRO A 99 2.798 1.257 11.189 1.00 0.00 H new ATOM 0 HB2 PRO A 99 2.834 2.511 13.659 1.00 0.00 H new ATOM 0 HB3 PRO A 99 2.032 0.981 13.365 1.00 0.00 H new ATOM 0 HG2 PRO A 99 4.540 1.506 14.839 1.00 0.00 H new ATOM 0 HG3 PRO A 99 3.514 0.087 14.891 1.00 0.00 H new ATOM 0 HD2 PRO A 99 6.018 0.344 13.516 1.00 0.00 H new ATOM 0 HD3 PRO A 99 4.935 -1.033 13.473 1.00 0.00 H new ATOM 1560 N GLY A 100 5.516 2.805 11.453 1.00 0.00 N ATOM 1561 CA GLY A 100 6.235 4.007 11.065 1.00 0.00 C ATOM 1562 C GLY A 100 7.345 3.683 10.063 1.00 0.00 C ATOM 1563 O GLY A 100 8.517 3.952 10.321 1.00 0.00 O ATOM 0 H GLY A 100 6.110 2.007 11.679 1.00 0.00 H new ATOM 0 HA2 GLY A 100 5.541 4.724 10.626 1.00 0.00 H new ATOM 0 HA3 GLY A 100 6.664 4.479 11.949 1.00 0.00 H new ATOM 1567 N PHE A 101 6.936 3.109 8.941 1.00 0.00 N ATOM 1568 CA PHE A 101 7.881 2.745 7.899 1.00 0.00 C ATOM 1569 C PHE A 101 8.108 3.909 6.933 1.00 0.00 C ATOM 1570 O PHE A 101 8.894 3.797 5.994 1.00 0.00 O ATOM 1571 CB PHE A 101 7.270 1.572 7.130 1.00 0.00 C ATOM 1572 CG PHE A 101 6.145 1.973 6.174 1.00 0.00 C ATOM 1573 CD1 PHE A 101 6.442 2.546 4.977 1.00 0.00 C ATOM 1574 CD2 PHE A 101 4.848 1.758 6.522 1.00 0.00 C ATOM 1575 CE1 PHE A 101 5.398 2.918 4.089 1.00 0.00 C ATOM 1576 CE2 PHE A 101 3.804 2.131 5.634 1.00 0.00 C ATOM 1577 CZ PHE A 101 4.101 2.703 4.437 1.00 0.00 C ATOM 0 H PHE A 101 5.963 2.887 8.731 1.00 0.00 H new ATOM 0 HA PHE A 101 8.841 2.484 8.343 1.00 0.00 H new ATOM 0 HB2 PHE A 101 8.056 1.075 6.562 1.00 0.00 H new ATOM 0 HB3 PHE A 101 6.884 0.844 7.844 1.00 0.00 H new ATOM 0 HD1 PHE A 101 7.472 2.718 4.702 1.00 0.00 H new ATOM 0 HD2 PHE A 101 4.612 1.304 7.473 1.00 0.00 H new ATOM 0 HE1 PHE A 101 5.634 3.371 3.138 1.00 0.00 H new ATOM 0 HE2 PHE A 101 2.774 1.960 5.910 1.00 0.00 H new ATOM 0 HZ PHE A 101 3.307 2.987 3.762 1.00 0.00 H new ATOM 1587 N TYR A 102 7.406 5.001 7.198 1.00 0.00 N ATOM 1588 CA TYR A 102 7.521 6.185 6.364 1.00 0.00 C ATOM 1589 C TYR A 102 8.185 7.332 7.129 1.00 0.00 C ATOM 1590 O TYR A 102 9.069 8.005 6.601 1.00 0.00 O ATOM 1591 CB TYR A 102 6.089 6.589 6.006 1.00 0.00 C ATOM 1592 CG TYR A 102 5.210 6.905 7.217 1.00 0.00 C ATOM 1593 CD1 TYR A 102 4.599 5.881 7.913 1.00 0.00 C ATOM 1594 CD2 TYR A 102 5.027 8.214 7.614 1.00 0.00 C ATOM 1595 CE1 TYR A 102 3.772 6.179 9.053 1.00 0.00 C ATOM 1596 CE2 TYR A 102 4.199 8.512 8.754 1.00 0.00 C ATOM 1597 CZ TYR A 102 3.613 7.479 9.418 1.00 0.00 C ATOM 1598 OH TYR A 102 2.831 7.760 10.495 1.00 0.00 O ATOM 0 H TYR A 102 6.756 5.091 7.979 1.00 0.00 H new ATOM 0 HA TYR A 102 8.130 5.977 5.484 1.00 0.00 H new ATOM 0 HB2 TYR A 102 6.121 7.463 5.355 1.00 0.00 H new ATOM 0 HB3 TYR A 102 5.627 5.783 5.435 1.00 0.00 H new ATOM 0 HD1 TYR A 102 4.741 4.857 7.602 1.00 0.00 H new ATOM 0 HD2 TYR A 102 5.505 9.015 7.070 1.00 0.00 H new ATOM 0 HE1 TYR A 102 3.289 5.387 9.606 1.00 0.00 H new ATOM 0 HE2 TYR A 102 4.047 9.532 9.075 1.00 0.00 H new ATOM 0 HH TYR A 102 2.809 8.729 10.639 1.00 0.00 H new ATOM 1608 N ARG A 103 7.733 7.520 8.360 1.00 0.00 N ATOM 1609 CA ARG A 103 8.273 8.573 9.203 1.00 0.00 C ATOM 1610 C ARG A 103 9.794 8.647 9.052 1.00 0.00 C ATOM 1611 O ARG A 103 10.515 7.800 9.576 1.00 0.00 O ATOM 1612 CB ARG A 103 7.924 8.335 10.673 1.00 0.00 C ATOM 1613 CG ARG A 103 6.409 8.321 10.882 1.00 0.00 C ATOM 1614 CD ARG A 103 6.053 8.618 12.340 1.00 0.00 C ATOM 1615 NE ARG A 103 6.493 7.501 13.206 1.00 0.00 N ATOM 1616 CZ ARG A 103 6.589 7.578 14.541 1.00 0.00 C ATOM 1617 NH1 ARG A 103 6.277 8.719 15.170 1.00 0.00 N ATOM 1618 NH2 ARG A 103 6.997 6.514 15.245 1.00 0.00 N ATOM 0 H ARG A 103 6.999 6.961 8.794 1.00 0.00 H new ATOM 0 HA ARG A 103 7.827 9.515 8.884 1.00 0.00 H new ATOM 0 HB2 ARG A 103 8.349 7.387 11.002 1.00 0.00 H new ATOM 0 HB3 ARG A 103 8.372 9.116 11.288 1.00 0.00 H new ATOM 0 HG2 ARG A 103 5.942 9.061 10.232 1.00 0.00 H new ATOM 0 HG3 ARG A 103 6.008 7.348 10.597 1.00 0.00 H new ATOM 0 HD2 ARG A 103 6.530 9.545 12.658 1.00 0.00 H new ATOM 0 HD3 ARG A 103 4.977 8.763 12.438 1.00 0.00 H new ATOM 0 HE ARG A 103 6.738 6.618 12.759 1.00 0.00 H new ATOM 0 HH11 ARG A 103 5.966 9.529 14.633 1.00 0.00 H new ATOM 0 HH12 ARG A 103 6.350 8.778 16.186 1.00 0.00 H new ATOM 0 HH21 ARG A 103 7.235 5.646 14.765 1.00 0.00 H new ATOM 0 HH22 ARG A 103 7.070 6.572 16.261 1.00 0.00 H new ATOM 1632 N GLY A 104 10.236 9.668 8.333 1.00 0.00 N ATOM 1633 CA GLY A 104 11.658 9.864 8.106 1.00 0.00 C ATOM 1634 C GLY A 104 11.916 10.456 6.719 1.00 0.00 C ATOM 1635 O GLY A 104 12.311 11.615 6.599 1.00 0.00 O ATOM 0 H GLY A 104 9.634 10.369 7.900 1.00 0.00 H new ATOM 0 HA2 GLY A 104 12.064 10.528 8.870 1.00 0.00 H new ATOM 0 HA3 GLY A 104 12.180 8.912 8.202 1.00 0.00 H new ATOM 1639 N TYR A 105 11.682 9.634 5.707 1.00 0.00 N ATOM 1640 CA TYR A 105 11.884 10.062 4.333 1.00 0.00 C ATOM 1641 C TYR A 105 11.461 11.521 4.146 1.00 0.00 C ATOM 1642 O TYR A 105 12.301 12.390 3.919 1.00 0.00 O ATOM 1643 CB TYR A 105 10.985 9.169 3.477 1.00 0.00 C ATOM 1644 CG TYR A 105 11.400 7.696 3.466 1.00 0.00 C ATOM 1645 CD1 TYR A 105 12.504 7.296 2.741 1.00 0.00 C ATOM 1646 CD2 TYR A 105 10.670 6.768 4.181 1.00 0.00 C ATOM 1647 CE1 TYR A 105 12.894 5.910 2.731 1.00 0.00 C ATOM 1648 CE2 TYR A 105 11.060 5.382 4.171 1.00 0.00 C ATOM 1649 CZ TYR A 105 12.153 5.021 3.446 1.00 0.00 C ATOM 1650 OH TYR A 105 12.522 3.712 3.437 1.00 0.00 O ATOM 0 H TYR A 105 11.354 8.674 5.811 1.00 0.00 H new ATOM 0 HA TYR A 105 12.936 9.984 4.057 1.00 0.00 H new ATOM 0 HB2 TYR A 105 9.961 9.245 3.843 1.00 0.00 H new ATOM 0 HB3 TYR A 105 10.986 9.544 2.454 1.00 0.00 H new ATOM 0 HD1 TYR A 105 13.075 8.022 2.181 1.00 0.00 H new ATOM 0 HD2 TYR A 105 9.806 7.082 4.748 1.00 0.00 H new ATOM 0 HE1 TYR A 105 13.756 5.583 2.168 1.00 0.00 H new ATOM 0 HE2 TYR A 105 10.498 4.646 4.726 1.00 0.00 H new ATOM 0 HH TYR A 105 11.902 3.194 3.992 1.00 0.00 H new ATOM 1660 N GLY A 106 10.159 11.743 4.247 1.00 0.00 N ATOM 1661 CA GLY A 106 9.614 13.081 4.091 1.00 0.00 C ATOM 1662 C GLY A 106 8.141 13.029 3.681 1.00 0.00 C ATOM 1663 O GLY A 106 7.765 13.553 2.634 1.00 0.00 O ATOM 0 H GLY A 106 9.465 11.019 4.435 1.00 0.00 H new ATOM 0 HA2 GLY A 106 9.715 13.630 5.027 1.00 0.00 H new ATOM 0 HA3 GLY A 106 10.185 13.625 3.339 1.00 0.00 H new ATOM 1667 N LEU A 107 7.346 12.393 4.529 1.00 0.00 N ATOM 1668 CA LEU A 107 5.922 12.266 4.268 1.00 0.00 C ATOM 1669 C LEU A 107 5.161 13.296 5.104 1.00 0.00 C ATOM 1670 O LEU A 107 4.052 13.693 4.748 1.00 0.00 O ATOM 1671 CB LEU A 107 5.462 10.825 4.499 1.00 0.00 C ATOM 1672 CG LEU A 107 5.699 9.852 3.342 1.00 0.00 C ATOM 1673 CD1 LEU A 107 6.887 8.933 3.633 1.00 0.00 C ATOM 1674 CD2 LEU A 107 4.428 9.061 3.022 1.00 0.00 C ATOM 0 H LEU A 107 7.661 11.960 5.397 1.00 0.00 H new ATOM 0 HA LEU A 107 5.705 12.482 3.222 1.00 0.00 H new ATOM 0 HB2 LEU A 107 5.971 10.439 5.382 1.00 0.00 H new ATOM 0 HB3 LEU A 107 4.396 10.837 4.725 1.00 0.00 H new ATOM 0 HG LEU A 107 5.950 10.432 2.454 1.00 0.00 H new ATOM 0 HD11 LEU A 107 7.034 8.252 2.795 1.00 0.00 H new ATOM 0 HD12 LEU A 107 7.786 9.534 3.774 1.00 0.00 H new ATOM 0 HD13 LEU A 107 6.689 8.358 4.538 1.00 0.00 H new ATOM 0 HD21 LEU A 107 4.623 8.377 2.196 1.00 0.00 H new ATOM 0 HD22 LEU A 107 4.123 8.492 3.900 1.00 0.00 H new ATOM 0 HD23 LEU A 107 3.632 9.750 2.741 1.00 0.00 H new ATOM 1686 N GLU A 108 5.786 13.700 6.200 1.00 0.00 N ATOM 1687 CA GLU A 108 5.181 14.676 7.090 1.00 0.00 C ATOM 1688 C GLU A 108 5.036 16.024 6.380 1.00 0.00 C ATOM 1689 O GLU A 108 3.962 16.623 6.390 1.00 0.00 O ATOM 1690 CB GLU A 108 5.992 14.820 8.379 1.00 0.00 C ATOM 1691 CG GLU A 108 6.216 13.459 9.041 1.00 0.00 C ATOM 1692 CD GLU A 108 7.469 13.476 9.920 1.00 0.00 C ATOM 1693 OE1 GLU A 108 8.573 13.450 9.335 1.00 0.00 O ATOM 1694 OE2 GLU A 108 7.293 13.515 11.157 1.00 0.00 O ATOM 0 H GLU A 108 6.706 13.369 6.492 1.00 0.00 H new ATOM 0 HA GLU A 108 4.187 14.322 7.363 1.00 0.00 H new ATOM 0 HB2 GLU A 108 6.953 15.284 8.158 1.00 0.00 H new ATOM 0 HB3 GLU A 108 5.470 15.483 9.069 1.00 0.00 H new ATOM 0 HG2 GLU A 108 5.347 13.197 9.645 1.00 0.00 H new ATOM 0 HG3 GLU A 108 6.315 12.690 8.275 1.00 0.00 H new ATOM 1701 N GLU A 109 6.134 16.461 5.780 1.00 0.00 N ATOM 1702 CA GLU A 109 6.143 17.727 5.066 1.00 0.00 C ATOM 1703 C GLU A 109 4.845 17.899 4.274 1.00 0.00 C ATOM 1704 O GLU A 109 4.397 19.021 4.046 1.00 0.00 O ATOM 1705 CB GLU A 109 7.362 17.830 4.149 1.00 0.00 C ATOM 1706 CG GLU A 109 8.633 18.106 4.955 1.00 0.00 C ATOM 1707 CD GLU A 109 9.010 19.588 4.895 1.00 0.00 C ATOM 1708 OE1 GLU A 109 8.165 20.406 5.318 1.00 0.00 O ATOM 1709 OE2 GLU A 109 10.135 19.869 4.428 1.00 0.00 O ATOM 0 H GLU A 109 7.023 15.961 5.774 1.00 0.00 H new ATOM 0 HA GLU A 109 6.210 18.533 5.796 1.00 0.00 H new ATOM 0 HB2 GLU A 109 7.478 16.903 3.587 1.00 0.00 H new ATOM 0 HB3 GLU A 109 7.208 18.627 3.422 1.00 0.00 H new ATOM 0 HG2 GLU A 109 8.482 17.807 5.992 1.00 0.00 H new ATOM 0 HG3 GLU A 109 9.453 17.503 4.566 1.00 0.00 H new ATOM 1716 N PHE A 110 4.278 16.769 3.877 1.00 0.00 N ATOM 1717 CA PHE A 110 3.040 16.781 3.116 1.00 0.00 C ATOM 1718 C PHE A 110 1.851 16.393 3.996 1.00 0.00 C ATOM 1719 O PHE A 110 0.808 17.045 3.961 1.00 0.00 O ATOM 1720 CB PHE A 110 3.192 15.746 1.999 1.00 0.00 C ATOM 1721 CG PHE A 110 4.471 15.904 1.174 1.00 0.00 C ATOM 1722 CD1 PHE A 110 4.803 17.119 0.661 1.00 0.00 C ATOM 1723 CD2 PHE A 110 5.275 14.830 0.953 1.00 0.00 C ATOM 1724 CE1 PHE A 110 5.989 17.266 -0.105 1.00 0.00 C ATOM 1725 CE2 PHE A 110 6.462 14.977 0.187 1.00 0.00 C ATOM 1726 CZ PHE A 110 6.794 16.192 -0.326 1.00 0.00 C ATOM 0 H PHE A 110 4.653 15.840 4.068 1.00 0.00 H new ATOM 0 HA PHE A 110 2.855 17.781 2.723 1.00 0.00 H new ATOM 0 HB2 PHE A 110 3.176 14.748 2.438 1.00 0.00 H new ATOM 0 HB3 PHE A 110 2.332 15.816 1.333 1.00 0.00 H new ATOM 0 HD1 PHE A 110 4.164 17.972 0.836 1.00 0.00 H new ATOM 0 HD2 PHE A 110 5.011 13.865 1.360 1.00 0.00 H new ATOM 0 HE1 PHE A 110 6.252 18.231 -0.512 1.00 0.00 H new ATOM 0 HE2 PHE A 110 7.101 14.124 0.012 1.00 0.00 H new ATOM 0 HZ PHE A 110 7.696 16.304 -0.909 1.00 0.00 H new ATOM 1736 N PHE A 111 2.046 15.332 4.766 1.00 0.00 N ATOM 1737 CA PHE A 111 1.003 14.849 5.654 1.00 0.00 C ATOM 1738 C PHE A 111 1.231 15.338 7.085 1.00 0.00 C ATOM 1739 O PHE A 111 2.132 14.860 7.773 1.00 0.00 O ATOM 1740 CB PHE A 111 1.070 13.321 5.634 1.00 0.00 C ATOM 1741 CG PHE A 111 0.817 12.705 4.256 1.00 0.00 C ATOM 1742 CD1 PHE A 111 -0.260 13.096 3.523 1.00 0.00 C ATOM 1743 CD2 PHE A 111 1.670 11.766 3.764 1.00 0.00 C ATOM 1744 CE1 PHE A 111 -0.494 12.525 2.245 1.00 0.00 C ATOM 1745 CE2 PHE A 111 1.435 11.195 2.485 1.00 0.00 C ATOM 1746 CZ PHE A 111 0.358 11.586 1.753 1.00 0.00 C ATOM 0 H PHE A 111 2.912 14.793 4.793 1.00 0.00 H new ATOM 0 HA PHE A 111 0.033 15.218 5.322 1.00 0.00 H new ATOM 0 HB2 PHE A 111 2.052 13.006 5.987 1.00 0.00 H new ATOM 0 HB3 PHE A 111 0.337 12.926 6.337 1.00 0.00 H new ATOM 0 HD1 PHE A 111 -0.937 13.841 3.914 1.00 0.00 H new ATOM 0 HD2 PHE A 111 2.525 11.455 4.346 1.00 0.00 H new ATOM 0 HE1 PHE A 111 -1.349 12.836 1.663 1.00 0.00 H new ATOM 0 HE2 PHE A 111 2.112 10.450 2.094 1.00 0.00 H new ATOM 0 HZ PHE A 111 0.179 11.151 0.781 1.00 0.00 H new ATOM 1756 N THR A 112 0.400 16.286 7.492 1.00 0.00 N ATOM 1757 CA THR A 112 0.500 16.846 8.829 1.00 0.00 C ATOM 1758 C THR A 112 0.807 15.745 9.847 1.00 0.00 C ATOM 1759 O THR A 112 0.568 14.568 9.584 1.00 0.00 O ATOM 1760 CB THR A 112 -0.798 17.601 9.124 1.00 0.00 C ATOM 1761 OG1 THR A 112 -1.816 16.615 8.972 1.00 0.00 O ATOM 1762 CG2 THR A 112 -1.126 18.643 8.053 1.00 0.00 C ATOM 0 H THR A 112 -0.346 16.681 6.919 1.00 0.00 H new ATOM 0 HA THR A 112 1.327 17.552 8.901 1.00 0.00 H new ATOM 0 HB THR A 112 -0.720 18.091 10.095 1.00 0.00 H new ATOM 0 HG1 THR A 112 -2.691 17.019 9.147 1.00 0.00 H new ATOM 0 HG21 THR A 112 -2.056 19.149 8.311 1.00 0.00 H new ATOM 0 HG22 THR A 112 -0.319 19.373 7.997 1.00 0.00 H new ATOM 0 HG23 THR A 112 -1.237 18.150 7.087 1.00 0.00 H new ATOM 1770 N PRO A 113 1.345 16.179 11.018 1.00 0.00 N ATOM 1771 CA PRO A 113 1.687 15.244 12.076 1.00 0.00 C ATOM 1772 C PRO A 113 0.432 14.748 12.797 1.00 0.00 C ATOM 1773 O PRO A 113 0.507 13.853 13.638 1.00 0.00 O ATOM 1774 CB PRO A 113 2.632 16.010 12.988 1.00 0.00 C ATOM 1775 CG PRO A 113 2.419 17.481 12.667 1.00 0.00 C ATOM 1776 CD PRO A 113 1.641 17.566 11.365 1.00 0.00 C ATOM 0 HA PRO A 113 2.164 14.339 11.699 1.00 0.00 H new ATOM 0 HB2 PRO A 113 2.416 15.804 14.036 1.00 0.00 H new ATOM 0 HB3 PRO A 113 3.667 15.718 12.812 1.00 0.00 H new ATOM 0 HG2 PRO A 113 1.871 17.972 13.472 1.00 0.00 H new ATOM 0 HG3 PRO A 113 3.376 17.994 12.574 1.00 0.00 H new ATOM 0 HD2 PRO A 113 0.727 18.147 11.487 1.00 0.00 H new ATOM 0 HD3 PRO A 113 2.226 18.053 10.585 1.00 0.00 H new ATOM 1784 N LEU A 114 -0.693 15.351 12.441 1.00 0.00 N ATOM 1785 CA LEU A 114 -1.963 14.981 13.043 1.00 0.00 C ATOM 1786 C LEU A 114 -2.631 13.900 12.192 1.00 0.00 C ATOM 1787 O LEU A 114 -2.838 12.780 12.656 1.00 0.00 O ATOM 1788 CB LEU A 114 -2.834 16.221 13.258 1.00 0.00 C ATOM 1789 CG LEU A 114 -3.305 16.469 14.692 1.00 0.00 C ATOM 1790 CD1 LEU A 114 -4.124 15.286 15.213 1.00 0.00 C ATOM 1791 CD2 LEU A 114 -2.124 16.796 15.608 1.00 0.00 C ATOM 0 H LEU A 114 -0.752 16.093 11.744 1.00 0.00 H new ATOM 0 HA LEU A 114 -1.805 14.554 14.033 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -2.275 17.095 12.924 1.00 0.00 H new ATOM 0 HB3 LEU A 114 -3.712 16.139 12.617 1.00 0.00 H new ATOM 0 HG LEU A 114 -3.962 17.339 14.690 1.00 0.00 H new ATOM 0 HD11 LEU A 114 -4.446 15.488 16.234 1.00 0.00 H new ATOM 0 HD12 LEU A 114 -4.998 15.141 14.578 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -3.511 14.385 15.198 1.00 0.00 H new ATOM 0 HD21 LEU A 114 -2.486 16.968 16.622 1.00 0.00 H new ATOM 0 HD22 LEU A 114 -1.423 15.961 15.610 1.00 0.00 H new ATOM 0 HD23 LEU A 114 -1.620 17.692 15.246 1.00 0.00 H new ATOM 1803 N ARG A 115 -2.948 14.273 10.961 1.00 0.00 N ATOM 1804 CA ARG A 115 -3.589 13.349 10.040 1.00 0.00 C ATOM 1805 C ARG A 115 -2.768 12.063 9.923 1.00 0.00 C ATOM 1806 O ARG A 115 -3.325 10.981 9.742 1.00 0.00 O ATOM 1807 CB ARG A 115 -3.746 13.973 8.653 1.00 0.00 C ATOM 1808 CG ARG A 115 -5.202 14.362 8.388 1.00 0.00 C ATOM 1809 CD ARG A 115 -5.424 14.681 6.908 1.00 0.00 C ATOM 1810 NE ARG A 115 -5.698 16.125 6.737 1.00 0.00 N ATOM 1811 CZ ARG A 115 -6.831 16.726 7.127 1.00 0.00 C ATOM 1812 NH1 ARG A 115 -7.801 16.011 7.712 1.00 0.00 N ATOM 1813 NH2 ARG A 115 -6.993 18.042 6.932 1.00 0.00 N ATOM 0 H ARG A 115 -2.773 15.203 10.579 1.00 0.00 H new ATOM 0 HA ARG A 115 -4.578 13.119 10.436 1.00 0.00 H new ATOM 0 HB2 ARG A 115 -3.110 14.855 8.573 1.00 0.00 H new ATOM 0 HB3 ARG A 115 -3.410 13.268 7.893 1.00 0.00 H new ATOM 0 HG2 ARG A 115 -5.860 13.548 8.691 1.00 0.00 H new ATOM 0 HG3 ARG A 115 -5.467 15.228 8.994 1.00 0.00 H new ATOM 0 HD2 ARG A 115 -4.544 14.399 6.331 1.00 0.00 H new ATOM 0 HD3 ARG A 115 -6.259 14.096 6.523 1.00 0.00 H new ATOM 0 HE ARG A 115 -4.980 16.699 6.295 1.00 0.00 H new ATOM 0 HH11 ARG A 115 -7.677 15.009 7.861 1.00 0.00 H new ATOM 0 HH12 ARG A 115 -8.663 16.468 8.009 1.00 0.00 H new ATOM 0 HH21 ARG A 115 -6.254 18.586 6.487 1.00 0.00 H new ATOM 0 HH22 ARG A 115 -7.855 18.499 7.229 1.00 0.00 H new ATOM 1827 N LEU A 116 -1.457 12.223 10.031 1.00 0.00 N ATOM 1828 CA LEU A 116 -0.554 11.088 9.940 1.00 0.00 C ATOM 1829 C LEU A 116 -1.043 9.977 10.871 1.00 0.00 C ATOM 1830 O LEU A 116 -1.176 8.827 10.454 1.00 0.00 O ATOM 1831 CB LEU A 116 0.887 11.527 10.209 1.00 0.00 C ATOM 1832 CG LEU A 116 1.721 11.884 8.977 1.00 0.00 C ATOM 1833 CD1 LEU A 116 3.112 12.376 9.380 1.00 0.00 C ATOM 1834 CD2 LEU A 116 1.789 10.707 8.002 1.00 0.00 C ATOM 0 H LEU A 116 -0.998 13.122 10.181 1.00 0.00 H new ATOM 0 HA LEU A 116 -0.555 10.680 8.929 1.00 0.00 H new ATOM 0 HB2 LEU A 116 0.864 12.393 10.871 1.00 0.00 H new ATOM 0 HB3 LEU A 116 1.395 10.727 10.748 1.00 0.00 H new ATOM 0 HG LEU A 116 1.228 12.705 8.457 1.00 0.00 H new ATOM 0 HD11 LEU A 116 3.684 12.623 8.486 1.00 0.00 H new ATOM 0 HD12 LEU A 116 3.017 13.263 10.006 1.00 0.00 H new ATOM 0 HD13 LEU A 116 3.628 11.593 9.936 1.00 0.00 H new ATOM 0 HD21 LEU A 116 2.387 10.987 7.135 1.00 0.00 H new ATOM 0 HD22 LEU A 116 2.246 9.850 8.497 1.00 0.00 H new ATOM 0 HD23 LEU A 116 0.782 10.444 7.678 1.00 0.00 H new ATOM 1846 N ARG A 117 -1.296 10.359 12.114 1.00 0.00 N ATOM 1847 CA ARG A 117 -1.767 9.409 13.107 1.00 0.00 C ATOM 1848 C ARG A 117 -2.765 8.434 12.479 1.00 0.00 C ATOM 1849 O ARG A 117 -2.572 7.220 12.535 1.00 0.00 O ATOM 1850 CB ARG A 117 -2.437 10.126 14.282 1.00 0.00 C ATOM 1851 CG ARG A 117 -1.394 10.774 15.195 1.00 0.00 C ATOM 1852 CD ARG A 117 -1.513 12.299 15.167 1.00 0.00 C ATOM 1853 NE ARG A 117 -0.610 12.896 16.177 1.00 0.00 N ATOM 1854 CZ ARG A 117 -0.816 12.833 17.499 1.00 0.00 C ATOM 1855 NH1 ARG A 117 -1.895 12.201 17.980 1.00 0.00 N ATOM 1856 NH2 ARG A 117 0.057 13.404 18.341 1.00 0.00 N ATOM 0 H ARG A 117 -1.184 11.313 12.456 1.00 0.00 H new ATOM 0 HA ARG A 117 -0.901 8.860 13.476 1.00 0.00 H new ATOM 0 HB2 ARG A 117 -3.120 10.888 13.906 1.00 0.00 H new ATOM 0 HB3 ARG A 117 -3.035 9.416 14.853 1.00 0.00 H new ATOM 0 HG2 ARG A 117 -1.525 10.414 16.216 1.00 0.00 H new ATOM 0 HG3 ARG A 117 -0.394 10.478 14.878 1.00 0.00 H new ATOM 0 HD2 ARG A 117 -1.261 12.674 14.175 1.00 0.00 H new ATOM 0 HD3 ARG A 117 -2.543 12.595 15.367 1.00 0.00 H new ATOM 0 HE ARG A 117 0.221 13.386 15.845 1.00 0.00 H new ATOM 0 HH11 ARG A 117 -2.560 11.768 17.339 1.00 0.00 H new ATOM 0 HH12 ARG A 117 -2.051 12.153 18.987 1.00 0.00 H new ATOM 0 HH21 ARG A 117 0.878 13.886 17.975 1.00 0.00 H new ATOM 0 HH22 ARG A 117 -0.100 13.356 19.348 1.00 0.00 H new ATOM 1870 N GLY A 118 -3.810 9.001 11.894 1.00 0.00 N ATOM 1871 CA GLY A 118 -4.838 8.197 11.255 1.00 0.00 C ATOM 1872 C GLY A 118 -4.263 7.404 10.080 1.00 0.00 C ATOM 1873 O GLY A 118 -4.498 6.203 9.963 1.00 0.00 O ATOM 0 H GLY A 118 -3.967 10.008 11.849 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -5.273 7.512 11.982 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -5.643 8.842 10.904 1.00 0.00 H new ATOM 1877 N LEU A 119 -3.520 8.109 9.239 1.00 0.00 N ATOM 1878 CA LEU A 119 -2.909 7.487 8.077 1.00 0.00 C ATOM 1879 C LEU A 119 -2.347 6.120 8.473 1.00 0.00 C ATOM 1880 O LEU A 119 -2.532 5.138 7.755 1.00 0.00 O ATOM 1881 CB LEU A 119 -1.871 8.421 7.452 1.00 0.00 C ATOM 1882 CG LEU A 119 -2.407 9.442 6.446 1.00 0.00 C ATOM 1883 CD1 LEU A 119 -1.264 10.226 5.799 1.00 0.00 C ATOM 1884 CD2 LEU A 119 -3.301 8.767 5.404 1.00 0.00 C ATOM 0 H LEU A 119 -3.327 9.106 9.340 1.00 0.00 H new ATOM 0 HA LEU A 119 -3.655 7.314 7.301 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -1.367 8.961 8.254 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -1.116 7.812 6.954 1.00 0.00 H new ATOM 0 HG LEU A 119 -3.025 10.160 6.984 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -1.672 10.945 5.088 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -0.704 10.756 6.570 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -0.600 9.537 5.277 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -3.669 9.515 4.701 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -2.727 8.014 4.865 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -4.145 8.291 5.903 1.00 0.00 H new ATOM 1896 N GLU A 120 -1.673 6.100 9.613 1.00 0.00 N ATOM 1897 CA GLU A 120 -1.083 4.870 10.113 1.00 0.00 C ATOM 1898 C GLU A 120 -2.169 3.817 10.347 1.00 0.00 C ATOM 1899 O GLU A 120 -2.062 2.692 9.863 1.00 0.00 O ATOM 1900 CB GLU A 120 -0.282 5.125 11.391 1.00 0.00 C ATOM 1901 CG GLU A 120 0.835 6.141 11.144 1.00 0.00 C ATOM 1902 CD GLU A 120 1.121 6.959 12.405 1.00 0.00 C ATOM 1903 OE1 GLU A 120 1.485 6.327 13.421 1.00 0.00 O ATOM 1904 OE2 GLU A 120 0.970 8.197 12.325 1.00 0.00 O ATOM 0 H GLU A 120 -1.522 6.917 10.205 1.00 0.00 H new ATOM 0 HA GLU A 120 -0.392 4.490 9.361 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -0.946 5.492 12.174 1.00 0.00 H new ATOM 0 HB3 GLU A 120 0.146 4.189 11.749 1.00 0.00 H new ATOM 0 HG2 GLU A 120 1.741 5.622 10.830 1.00 0.00 H new ATOM 0 HG3 GLU A 120 0.551 6.808 10.330 1.00 0.00 H new ATOM 1911 N ALA A 121 -3.189 4.221 11.090 1.00 0.00 N ATOM 1912 CA ALA A 121 -4.293 3.327 11.394 1.00 0.00 C ATOM 1913 C ALA A 121 -4.546 2.409 10.197 1.00 0.00 C ATOM 1914 O ALA A 121 -4.837 1.226 10.367 1.00 0.00 O ATOM 1915 CB ALA A 121 -5.528 4.150 11.769 1.00 0.00 C ATOM 0 H ALA A 121 -3.274 5.155 11.490 1.00 0.00 H new ATOM 0 HA ALA A 121 -4.050 2.695 12.248 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -6.357 3.479 11.997 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -5.306 4.762 12.643 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -5.803 4.795 10.934 1.00 0.00 H new ATOM 1921 N ALA A 122 -4.425 2.989 9.011 1.00 0.00 N ATOM 1922 CA ALA A 122 -4.636 2.237 7.786 1.00 0.00 C ATOM 1923 C ALA A 122 -3.794 0.961 7.824 1.00 0.00 C ATOM 1924 O ALA A 122 -4.329 -0.143 7.735 1.00 0.00 O ATOM 1925 CB ALA A 122 -4.303 3.120 6.581 1.00 0.00 C ATOM 0 H ALA A 122 -4.184 3.970 8.873 1.00 0.00 H new ATOM 0 HA ALA A 122 -5.681 1.940 7.694 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -4.461 2.556 5.662 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -4.949 3.998 6.584 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -3.261 3.436 6.638 1.00 0.00 H new ATOM 1931 N LEU A 123 -2.490 1.154 7.956 1.00 0.00 N ATOM 1932 CA LEU A 123 -1.569 0.031 8.007 1.00 0.00 C ATOM 1933 C LEU A 123 -1.824 -0.775 9.281 1.00 0.00 C ATOM 1934 O LEU A 123 -2.075 -1.978 9.219 1.00 0.00 O ATOM 1935 CB LEU A 123 -0.124 0.517 7.865 1.00 0.00 C ATOM 1936 CG LEU A 123 0.946 -0.574 7.798 1.00 0.00 C ATOM 1937 CD1 LEU A 123 1.637 -0.749 9.152 1.00 0.00 C ATOM 1938 CD2 LEU A 123 0.358 -1.889 7.281 1.00 0.00 C ATOM 0 H LEU A 123 -2.049 2.071 8.029 1.00 0.00 H new ATOM 0 HA LEU A 123 -1.740 -0.641 7.166 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -0.053 1.124 6.963 1.00 0.00 H new ATOM 0 HB3 LEU A 123 0.103 1.170 8.708 1.00 0.00 H new ATOM 0 HG LEU A 123 1.709 -0.260 7.085 1.00 0.00 H new ATOM 0 HD11 LEU A 123 2.393 -1.531 9.076 1.00 0.00 H new ATOM 0 HD12 LEU A 123 2.112 0.188 9.442 1.00 0.00 H new ATOM 0 HD13 LEU A 123 0.899 -1.030 9.904 1.00 0.00 H new ATOM 0 HD21 LEU A 123 1.140 -2.647 7.243 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -0.437 -2.220 7.950 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -0.049 -1.737 6.281 1.00 0.00 H new ATOM 1950 N LEU A 124 -1.750 -0.081 10.407 1.00 0.00 N ATOM 1951 CA LEU A 124 -1.970 -0.718 11.695 1.00 0.00 C ATOM 1952 C LEU A 124 -3.130 -1.709 11.577 1.00 0.00 C ATOM 1953 O LEU A 124 -3.049 -2.827 12.084 1.00 0.00 O ATOM 1954 CB LEU A 124 -2.170 0.336 12.786 1.00 0.00 C ATOM 1955 CG LEU A 124 -0.905 1.046 13.272 1.00 0.00 C ATOM 1956 CD1 LEU A 124 -0.059 0.121 14.148 1.00 0.00 C ATOM 1957 CD2 LEU A 124 -0.106 1.610 12.095 1.00 0.00 C ATOM 0 H LEU A 124 -1.541 0.916 10.455 1.00 0.00 H new ATOM 0 HA LEU A 124 -1.091 -1.289 11.993 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -2.865 1.089 12.413 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -2.646 -0.142 13.642 1.00 0.00 H new ATOM 0 HG LEU A 124 -1.205 1.891 13.892 1.00 0.00 H new ATOM 0 HD11 LEU A 124 0.834 0.651 14.480 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -0.640 -0.190 15.016 1.00 0.00 H new ATOM 0 HD13 LEU A 124 0.233 -0.758 13.573 1.00 0.00 H new ATOM 0 HD21 LEU A 124 0.788 2.110 12.468 1.00 0.00 H new ATOM 0 HD22 LEU A 124 0.184 0.797 11.429 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -0.720 2.326 11.548 1.00 0.00 H new ATOM 1969 N ARG A 125 -4.182 -1.263 10.906 1.00 0.00 N ATOM 1970 CA ARG A 125 -5.356 -2.097 10.716 1.00 0.00 C ATOM 1971 C ARG A 125 -5.055 -3.219 9.721 1.00 0.00 C ATOM 1972 O ARG A 125 -5.310 -4.389 10.004 1.00 0.00 O ATOM 1973 CB ARG A 125 -6.539 -1.273 10.201 1.00 0.00 C ATOM 1974 CG ARG A 125 -6.961 -0.220 11.228 1.00 0.00 C ATOM 1975 CD ARG A 125 -7.655 0.962 10.547 1.00 0.00 C ATOM 1976 NE ARG A 125 -8.816 1.400 11.353 1.00 0.00 N ATOM 1977 CZ ARG A 125 -9.990 0.755 11.392 1.00 0.00 C ATOM 1978 NH1 ARG A 125 -10.165 -0.361 10.671 1.00 0.00 N ATOM 1979 NH2 ARG A 125 -10.988 1.226 12.152 1.00 0.00 N ATOM 0 H ARG A 125 -4.246 -0.335 10.487 1.00 0.00 H new ATOM 0 HA ARG A 125 -5.618 -2.525 11.683 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -6.267 -0.785 9.265 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -7.379 -1.932 9.984 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -7.633 -0.669 11.959 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -6.086 0.133 11.774 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -6.953 1.787 10.428 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -7.983 0.675 9.548 1.00 0.00 H new ATOM 0 HE ARG A 125 -8.717 2.246 11.914 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -9.405 -0.719 10.093 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -11.058 -0.852 10.700 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -10.854 2.075 12.701 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -11.882 0.735 12.182 1.00 0.00 H new ATOM 1993 N LEU A 126 -4.516 -2.824 8.577 1.00 0.00 N ATOM 1994 CA LEU A 126 -4.177 -3.783 7.539 1.00 0.00 C ATOM 1995 C LEU A 126 -3.461 -4.979 8.170 1.00 0.00 C ATOM 1996 O LEU A 126 -3.842 -6.126 7.941 1.00 0.00 O ATOM 1997 CB LEU A 126 -3.377 -3.105 6.425 1.00 0.00 C ATOM 1998 CG LEU A 126 -4.148 -2.110 5.555 1.00 0.00 C ATOM 1999 CD1 LEU A 126 -4.007 -2.456 4.071 1.00 0.00 C ATOM 2000 CD2 LEU A 126 -5.613 -2.025 5.987 1.00 0.00 C ATOM 0 H LEU A 126 -4.306 -1.853 8.346 1.00 0.00 H new ATOM 0 HA LEU A 126 -5.080 -4.166 7.064 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -2.533 -2.584 6.877 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -2.965 -3.879 5.778 1.00 0.00 H new ATOM 0 HG LEU A 126 -3.712 -1.121 5.698 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -4.564 -1.734 3.474 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -2.955 -2.425 3.789 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -4.402 -3.456 3.891 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -6.139 -1.311 5.353 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -6.078 -3.006 5.891 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -5.668 -1.697 7.025 1.00 0.00 H new ATOM 2012 N GLN A 127 -2.437 -4.670 8.951 1.00 0.00 N ATOM 2013 CA GLN A 127 -1.665 -5.706 9.617 1.00 0.00 C ATOM 2014 C GLN A 127 -2.567 -6.536 10.532 1.00 0.00 C ATOM 2015 O GLN A 127 -2.313 -7.718 10.754 1.00 0.00 O ATOM 2016 CB GLN A 127 -0.497 -5.102 10.399 1.00 0.00 C ATOM 2017 CG GLN A 127 0.419 -4.292 9.479 1.00 0.00 C ATOM 2018 CD GLN A 127 1.887 -4.665 9.700 1.00 0.00 C ATOM 2019 OE1 GLN A 127 2.673 -4.409 8.659 1.00 0.00 O flip ATOM 2020 NE2 GLN A 127 2.279 -5.153 10.748 1.00 0.00 N flip ATOM 0 H GLN A 127 -2.124 -3.718 9.138 1.00 0.00 H new ATOM 0 HA GLN A 127 -1.248 -6.366 8.856 1.00 0.00 H new ATOM 0 HB2 GLN A 127 -0.879 -4.461 11.193 1.00 0.00 H new ATOM 0 HB3 GLN A 127 0.074 -5.897 10.878 1.00 0.00 H new ATOM 0 HG2 GLN A 127 0.147 -4.472 8.439 1.00 0.00 H new ATOM 0 HG3 GLN A 127 0.278 -3.227 9.666 1.00 0.00 H new ATOM 0 HE21 GLN A 127 1.621 -5.324 11.509 1.00 0.00 H new ATOM 0 HE22 GLN A 127 3.264 -5.390 10.863 1.00 0.00 H new ATOM 2029 N ALA A 128 -3.603 -5.883 11.038 1.00 0.00 N ATOM 2030 CA ALA A 128 -4.545 -6.545 11.925 1.00 0.00 C ATOM 2031 C ALA A 128 -5.550 -7.342 11.090 1.00 0.00 C ATOM 2032 O ALA A 128 -6.260 -8.197 11.617 1.00 0.00 O ATOM 2033 CB ALA A 128 -5.223 -5.506 12.819 1.00 0.00 C ATOM 0 H ALA A 128 -3.811 -4.902 10.851 1.00 0.00 H new ATOM 0 HA ALA A 128 -4.028 -7.248 12.579 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -5.929 -6.003 13.484 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -4.469 -4.989 13.412 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -5.755 -4.784 12.199 1.00 0.00 H new ATOM 2039 N GLN A 129 -5.579 -7.032 9.802 1.00 0.00 N ATOM 2040 CA GLN A 129 -6.485 -7.708 8.890 1.00 0.00 C ATOM 2041 C GLN A 129 -5.795 -8.916 8.254 1.00 0.00 C ATOM 2042 O GLN A 129 -6.421 -9.955 8.047 1.00 0.00 O ATOM 2043 CB GLN A 129 -7.003 -6.746 7.819 1.00 0.00 C ATOM 2044 CG GLN A 129 -8.064 -5.805 8.394 1.00 0.00 C ATOM 2045 CD GLN A 129 -9.404 -5.985 7.677 1.00 0.00 C ATOM 2046 OE1 GLN A 129 -9.935 -7.078 7.565 1.00 0.00 O ATOM 2047 NE2 GLN A 129 -9.918 -4.856 7.200 1.00 0.00 N ATOM 0 H GLN A 129 -4.989 -6.321 9.369 1.00 0.00 H new ATOM 0 HA GLN A 129 -7.344 -8.063 9.459 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -6.174 -6.163 7.417 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -7.426 -7.313 6.990 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -8.189 -5.999 9.459 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -7.731 -4.772 8.295 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -9.421 -3.975 7.329 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -10.810 -4.871 6.705 1.00 0.00 H new ATOM 2056 N VAL A 130 -4.515 -8.741 7.963 1.00 0.00 N ATOM 2057 CA VAL A 130 -3.733 -9.804 7.355 1.00 0.00 C ATOM 2058 C VAL A 130 -3.483 -10.902 8.390 1.00 0.00 C ATOM 2059 O VAL A 130 -3.705 -12.081 8.116 1.00 0.00 O ATOM 2060 CB VAL A 130 -2.442 -9.233 6.765 1.00 0.00 C ATOM 2061 CG1 VAL A 130 -1.626 -10.325 6.071 1.00 0.00 C ATOM 2062 CG2 VAL A 130 -2.741 -8.078 5.806 1.00 0.00 C ATOM 0 H VAL A 130 -3.999 -7.878 8.137 1.00 0.00 H new ATOM 0 HA VAL A 130 -4.280 -10.255 6.527 1.00 0.00 H new ATOM 0 HB VAL A 130 -1.844 -8.840 7.587 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -0.714 -9.892 5.661 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -1.367 -11.100 6.793 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -2.215 -10.762 5.265 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -1.806 -7.690 5.401 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -3.369 -8.436 4.990 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -3.260 -7.284 6.343 1.00 0.00 H new ATOM 2072 N ARG A 131 -3.024 -10.477 9.558 1.00 0.00 N ATOM 2073 CA ARG A 131 -2.741 -11.410 10.635 1.00 0.00 C ATOM 2074 C ARG A 131 -3.855 -12.453 10.741 1.00 0.00 C ATOM 2075 O ARG A 131 -3.611 -13.589 11.143 1.00 0.00 O ATOM 2076 CB ARG A 131 -2.605 -10.681 11.973 1.00 0.00 C ATOM 2077 CG ARG A 131 -1.191 -10.124 12.153 1.00 0.00 C ATOM 2078 CD ARG A 131 -1.141 -9.115 13.303 1.00 0.00 C ATOM 2079 NE ARG A 131 -0.416 -9.697 14.454 1.00 0.00 N ATOM 2080 CZ ARG A 131 0.131 -8.973 15.440 1.00 0.00 C ATOM 2081 NH1 ARG A 131 0.039 -7.636 15.421 1.00 0.00 N ATOM 2082 NH2 ARG A 131 0.771 -9.585 16.446 1.00 0.00 N ATOM 0 H ARG A 131 -2.841 -9.499 9.782 1.00 0.00 H new ATOM 0 HA ARG A 131 -1.797 -11.904 10.406 1.00 0.00 H new ATOM 0 HB2 ARG A 131 -3.329 -9.868 12.023 1.00 0.00 H new ATOM 0 HB3 ARG A 131 -2.837 -11.365 12.789 1.00 0.00 H new ATOM 0 HG2 ARG A 131 -0.497 -10.941 12.351 1.00 0.00 H new ATOM 0 HG3 ARG A 131 -0.865 -9.645 11.230 1.00 0.00 H new ATOM 0 HD2 ARG A 131 -0.646 -8.201 12.975 1.00 0.00 H new ATOM 0 HD3 ARG A 131 -2.153 -8.840 13.601 1.00 0.00 H new ATOM 0 HE ARG A 131 -0.327 -10.712 14.500 1.00 0.00 H new ATOM 0 HH11 ARG A 131 -0.448 -7.169 14.656 1.00 0.00 H new ATOM 0 HH12 ARG A 131 0.456 -7.085 16.172 1.00 0.00 H new ATOM 0 HH21 ARG A 131 0.842 -10.602 16.461 1.00 0.00 H new ATOM 0 HH22 ARG A 131 1.187 -9.033 17.196 1.00 0.00 H new ATOM 2096 N LYS A 132 -5.056 -12.029 10.373 1.00 0.00 N ATOM 2097 CA LYS A 132 -6.209 -12.912 10.422 1.00 0.00 C ATOM 2098 C LYS A 132 -6.047 -14.013 9.373 1.00 0.00 C ATOM 2099 O LYS A 132 -6.281 -15.186 9.658 1.00 0.00 O ATOM 2100 CB LYS A 132 -7.504 -12.110 10.277 1.00 0.00 C ATOM 2101 CG LYS A 132 -7.456 -10.834 11.120 1.00 0.00 C ATOM 2102 CD LYS A 132 -6.970 -11.133 12.540 1.00 0.00 C ATOM 2103 CE LYS A 132 -7.975 -12.010 13.290 1.00 0.00 C ATOM 2104 NZ LYS A 132 -9.073 -11.186 13.841 1.00 0.00 N ATOM 0 H LYS A 132 -5.255 -11.086 10.040 1.00 0.00 H new ATOM 0 HA LYS A 132 -6.272 -13.403 11.393 1.00 0.00 H new ATOM 0 HB2 LYS A 132 -7.661 -11.852 9.230 1.00 0.00 H new ATOM 0 HB3 LYS A 132 -8.352 -12.722 10.585 1.00 0.00 H new ATOM 0 HG2 LYS A 132 -6.792 -10.108 10.650 1.00 0.00 H new ATOM 0 HG3 LYS A 132 -8.447 -10.382 11.159 1.00 0.00 H new ATOM 0 HD2 LYS A 132 -6.003 -11.635 12.499 1.00 0.00 H new ATOM 0 HD3 LYS A 132 -6.822 -10.199 13.082 1.00 0.00 H new ATOM 0 HE2 LYS A 132 -8.382 -12.765 12.617 1.00 0.00 H new ATOM 0 HE3 LYS A 132 -7.471 -12.542 14.097 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 -9.746 -11.797 14.347 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 -8.682 -10.482 14.499 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 -9.564 -10.698 13.065 1.00 0.00 H new ATOM 2118 N ALA A 133 -5.647 -13.596 8.180 1.00 0.00 N ATOM 2119 CA ALA A 133 -5.451 -14.533 7.087 1.00 0.00 C ATOM 2120 C ALA A 133 -4.499 -15.643 7.537 1.00 0.00 C ATOM 2121 O ALA A 133 -4.756 -16.822 7.296 1.00 0.00 O ATOM 2122 CB ALA A 133 -4.933 -13.783 5.858 1.00 0.00 C ATOM 0 H ALA A 133 -5.453 -12.622 7.947 1.00 0.00 H new ATOM 0 HA ALA A 133 -6.395 -15.001 6.809 1.00 0.00 H new ATOM 0 HB1 ALA A 133 -4.786 -14.486 5.038 1.00 0.00 H new ATOM 0 HB2 ALA A 133 -5.659 -13.026 5.561 1.00 0.00 H new ATOM 0 HB3 ALA A 133 -3.985 -13.302 6.098 1.00 0.00 H new ATOM 2128 N LEU A 134 -3.419 -15.227 8.182 1.00 0.00 N ATOM 2129 CA LEU A 134 -2.427 -16.172 8.668 1.00 0.00 C ATOM 2130 C LEU A 134 -3.135 -17.326 9.381 1.00 0.00 C ATOM 2131 O LEU A 134 -2.665 -18.462 9.348 1.00 0.00 O ATOM 2132 CB LEU A 134 -1.387 -15.458 9.534 1.00 0.00 C ATOM 2133 CG LEU A 134 -0.381 -14.581 8.788 1.00 0.00 C ATOM 2134 CD1 LEU A 134 -1.084 -13.426 8.073 1.00 0.00 C ATOM 2135 CD2 LEU A 134 0.720 -14.087 9.729 1.00 0.00 C ATOM 0 H LEU A 134 -3.209 -14.249 8.379 1.00 0.00 H new ATOM 0 HA LEU A 134 -1.872 -16.604 7.836 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -1.912 -14.837 10.260 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -0.835 -16.210 10.098 1.00 0.00 H new ATOM 0 HG LEU A 134 0.099 -15.189 8.022 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -0.345 -12.818 7.550 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -1.800 -13.825 7.354 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -1.609 -12.811 8.804 1.00 0.00 H new ATOM 0 HD21 LEU A 134 1.422 -13.466 9.173 1.00 0.00 H new ATOM 0 HD22 LEU A 134 0.275 -13.501 10.534 1.00 0.00 H new ATOM 0 HD23 LEU A 134 1.248 -14.942 10.152 1.00 0.00 H new ATOM 2147 N THR A 135 -4.253 -16.994 10.010 1.00 0.00 N ATOM 2148 CA THR A 135 -5.030 -17.989 10.730 1.00 0.00 C ATOM 2149 C THR A 135 -6.256 -18.401 9.914 1.00 0.00 C ATOM 2150 O THR A 135 -6.832 -19.464 10.144 1.00 0.00 O ATOM 2151 CB THR A 135 -5.379 -17.412 12.103 1.00 0.00 C ATOM 2152 OG1 THR A 135 -6.071 -18.472 12.759 1.00 0.00 O ATOM 2153 CG2 THR A 135 -6.413 -16.287 12.020 1.00 0.00 C ATOM 0 H THR A 135 -4.639 -16.050 10.036 1.00 0.00 H new ATOM 0 HA THR A 135 -4.458 -18.904 10.882 1.00 0.00 H new ATOM 0 HB THR A 135 -4.473 -17.038 12.580 1.00 0.00 H new ATOM 0 HG1 THR A 135 -6.333 -18.184 13.658 1.00 0.00 H new ATOM 0 HG21 THR A 135 -6.625 -15.913 13.022 1.00 0.00 H new ATOM 0 HG22 THR A 135 -6.021 -15.477 11.406 1.00 0.00 H new ATOM 0 HG23 THR A 135 -7.331 -16.669 11.574 1.00 0.00 H new ATOM 2161 N SER A 136 -6.621 -17.538 8.976 1.00 0.00 N ATOM 2162 CA SER A 136 -7.769 -17.799 8.124 1.00 0.00 C ATOM 2163 C SER A 136 -7.338 -17.815 6.656 1.00 0.00 C ATOM 2164 O SER A 136 -8.157 -17.601 5.763 1.00 0.00 O ATOM 2165 CB SER A 136 -8.866 -16.757 8.345 1.00 0.00 C ATOM 2166 OG SER A 136 -10.167 -17.337 8.315 1.00 0.00 O ATOM 0 H SER A 136 -6.142 -16.658 8.788 1.00 0.00 H new ATOM 0 HA SER A 136 -8.176 -18.776 8.387 1.00 0.00 H new ATOM 0 HB2 SER A 136 -8.711 -16.265 9.305 1.00 0.00 H new ATOM 0 HB3 SER A 136 -8.795 -15.987 7.577 1.00 0.00 H new ATOM 0 HG SER A 136 -10.840 -16.639 8.462 1.00 0.00 H new