USER MOD reduce.3.24.130724 H: found=0, std=0, add=622, rem=0, adj=4 USER MOD reduce.3.24.130724 removed 618 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 Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 HIS : no HE2:sc= -8.17! C(o=-8.2!,f=-8.6!) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ -126:sc= 0 (180deg=-0.279) USER MOD Single : A 30 HIS : no HD1:sc= -0.52 X(o=-0.52,f=-0.055) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 26 HIS : no HE2:sc= -8.08! C(o=-8.1!,f=-8.6!) USER MOD Single : B 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 28 LYS NZ :NH3+ -126:sc=-0.00668 (180deg=-0.269) USER MOD Single : B 30 HIS : no HD1:sc= -0.498 X(o=-0.5,f=-0.052) USER MOD Single : B 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 42.860 7.341 6.823 1.00 0.00 N ATOM 2 CA GLY A 1 41.834 6.448 7.430 1.00 0.00 C ATOM 3 C GLY A 1 41.851 5.094 6.718 1.00 0.00 C ATOM 4 O GLY A 1 42.884 4.470 6.578 1.00 0.00 O ATOM 0 H1 GLY A 1 42.849 8.262 7.307 1.00 0.00 H new ATOM 0 H2 GLY A 1 43.800 6.908 6.924 1.00 0.00 H new ATOM 0 H3 GLY A 1 42.648 7.478 5.814 1.00 0.00 H new ATOM 0 HA2 GLY A 1 42.036 6.315 8.493 1.00 0.00 H new ATOM 0 HA3 GLY A 1 40.847 6.902 7.347 1.00 0.00 H new ATOM 10 N GLU A 2 40.715 4.634 6.268 1.00 0.00 N ATOM 11 CA GLU A 2 40.674 3.318 5.568 1.00 0.00 C ATOM 12 C GLU A 2 39.507 3.272 4.576 1.00 0.00 C ATOM 13 O GLU A 2 39.079 2.214 4.159 1.00 0.00 O ATOM 14 CB GLU A 2 40.476 2.287 6.680 1.00 0.00 C ATOM 15 CG GLU A 2 41.835 1.913 7.278 1.00 0.00 C ATOM 16 CD GLU A 2 41.857 0.418 7.603 1.00 0.00 C ATOM 17 OE1 GLU A 2 41.373 -0.353 6.791 1.00 0.00 O ATOM 18 OE2 GLU A 2 42.360 0.069 8.659 1.00 0.00 O ATOM 0 H GLU A 2 39.817 5.110 6.354 1.00 0.00 H new ATOM 0 HA GLU A 2 41.580 3.131 4.992 1.00 0.00 H new ATOM 0 HB2 GLU A 2 39.825 2.692 7.455 1.00 0.00 H new ATOM 0 HB3 GLU A 2 39.984 1.399 6.283 1.00 0.00 H new ATOM 0 HG2 GLU A 2 42.632 2.155 6.575 1.00 0.00 H new ATOM 0 HG3 GLU A 2 42.019 2.495 8.181 1.00 0.00 H new ATOM 25 N VAL A 3 38.988 4.408 4.189 1.00 0.00 N ATOM 26 CA VAL A 3 37.852 4.414 3.219 1.00 0.00 C ATOM 27 C VAL A 3 38.342 3.997 1.831 1.00 0.00 C ATOM 28 O VAL A 3 37.597 3.462 1.034 1.00 0.00 O ATOM 29 CB VAL A 3 37.343 5.857 3.200 1.00 0.00 C ATOM 30 CG1 VAL A 3 38.449 6.786 2.693 1.00 0.00 C ATOM 31 CG2 VAL A 3 36.129 5.956 2.273 1.00 0.00 C ATOM 0 H VAL A 3 39.299 5.328 4.501 1.00 0.00 H new ATOM 0 HA VAL A 3 37.066 3.714 3.503 1.00 0.00 H new ATOM 0 HB VAL A 3 37.057 6.153 4.209 1.00 0.00 H new ATOM 0 HG11 VAL A 3 38.084 7.813 2.680 1.00 0.00 H new ATOM 0 HG12 VAL A 3 39.314 6.716 3.353 1.00 0.00 H new ATOM 0 HG13 VAL A 3 38.738 6.491 1.684 1.00 0.00 H new ATOM 0 HG21 VAL A 3 35.765 6.983 2.258 1.00 0.00 H new ATOM 0 HG22 VAL A 3 36.416 5.658 1.264 1.00 0.00 H new ATOM 0 HG23 VAL A 3 35.340 5.297 2.635 1.00 0.00 H new ATOM 41 N GLU A 4 39.589 4.237 1.536 1.00 0.00 N ATOM 42 CA GLU A 4 40.126 3.852 0.200 1.00 0.00 C ATOM 43 C GLU A 4 40.147 2.328 0.057 1.00 0.00 C ATOM 44 O GLU A 4 40.188 1.799 -1.036 1.00 0.00 O ATOM 45 CB GLU A 4 41.549 4.407 0.172 1.00 0.00 C ATOM 46 CG GLU A 4 41.722 5.304 -1.055 1.00 0.00 C ATOM 47 CD GLU A 4 43.184 5.742 -1.166 1.00 0.00 C ATOM 48 OE1 GLU A 4 43.535 6.730 -0.542 1.00 0.00 O ATOM 49 OE2 GLU A 4 43.928 5.082 -1.873 1.00 0.00 O ATOM 0 H GLU A 4 40.260 4.683 2.162 1.00 0.00 H new ATOM 0 HA GLU A 4 39.517 4.241 -0.616 1.00 0.00 H new ATOM 0 HB2 GLU A 4 41.748 4.974 1.081 1.00 0.00 H new ATOM 0 HB3 GLU A 4 42.269 3.589 0.143 1.00 0.00 H new ATOM 0 HG2 GLU A 4 41.423 4.768 -1.956 1.00 0.00 H new ATOM 0 HG3 GLU A 4 41.075 6.177 -0.974 1.00 0.00 H new ATOM 56 N GLU A 5 40.121 1.617 1.151 1.00 0.00 N ATOM 57 CA GLU A 5 40.144 0.129 1.072 1.00 0.00 C ATOM 58 C GLU A 5 38.772 -0.400 0.654 1.00 0.00 C ATOM 59 O GLU A 5 38.645 -1.138 -0.303 1.00 0.00 O ATOM 60 CB GLU A 5 40.491 -0.339 2.486 1.00 0.00 C ATOM 61 CG GLU A 5 42.003 -0.243 2.700 1.00 0.00 C ATOM 62 CD GLU A 5 42.673 -1.518 2.184 1.00 0.00 C ATOM 63 OE1 GLU A 5 42.593 -1.765 0.992 1.00 0.00 O ATOM 64 OE2 GLU A 5 43.253 -2.226 2.990 1.00 0.00 O ATOM 0 H GLU A 5 40.085 2.002 2.095 1.00 0.00 H new ATOM 0 HA GLU A 5 40.861 -0.233 0.336 1.00 0.00 H new ATOM 0 HB2 GLU A 5 39.970 0.274 3.221 1.00 0.00 H new ATOM 0 HB3 GLU A 5 40.157 -1.366 2.633 1.00 0.00 H new ATOM 0 HG2 GLU A 5 42.401 0.627 2.177 1.00 0.00 H new ATOM 0 HG3 GLU A 5 42.223 -0.107 3.759 1.00 0.00 H new ATOM 71 N LEU A 6 37.742 -0.028 1.363 1.00 0.00 N ATOM 72 CA LEU A 6 36.383 -0.514 0.999 1.00 0.00 C ATOM 73 C LEU A 6 35.994 0.036 -0.381 1.00 0.00 C ATOM 74 O LEU A 6 35.261 -0.586 -1.121 1.00 0.00 O ATOM 75 CB LEU A 6 35.461 -0.017 2.144 1.00 0.00 C ATOM 76 CG LEU A 6 34.627 1.213 1.738 1.00 0.00 C ATOM 77 CD1 LEU A 6 33.459 0.771 0.855 1.00 0.00 C ATOM 78 CD2 LEU A 6 34.072 1.895 2.991 1.00 0.00 C ATOM 0 H LEU A 6 37.783 0.588 2.175 1.00 0.00 H new ATOM 0 HA LEU A 6 36.312 -1.598 0.909 1.00 0.00 H new ATOM 0 HB2 LEU A 6 34.791 -0.823 2.443 1.00 0.00 H new ATOM 0 HB3 LEU A 6 36.069 0.231 3.014 1.00 0.00 H new ATOM 0 HG LEU A 6 35.262 1.910 1.190 1.00 0.00 H new ATOM 0 HD11 LEU A 6 32.870 1.642 0.568 1.00 0.00 H new ATOM 0 HD12 LEU A 6 33.844 0.283 -0.040 1.00 0.00 H new ATOM 0 HD13 LEU A 6 32.830 0.073 1.407 1.00 0.00 H new ATOM 0 HD21 LEU A 6 33.482 2.765 2.701 1.00 0.00 H new ATOM 0 HD22 LEU A 6 33.440 1.194 3.537 1.00 0.00 H new ATOM 0 HD23 LEU A 6 34.897 2.212 3.628 1.00 0.00 H new ATOM 90 N GLU A 7 36.489 1.194 -0.727 1.00 0.00 N ATOM 91 CA GLU A 7 36.157 1.787 -2.056 1.00 0.00 C ATOM 92 C GLU A 7 36.787 0.961 -3.178 1.00 0.00 C ATOM 93 O GLU A 7 36.134 0.599 -4.140 1.00 0.00 O ATOM 94 CB GLU A 7 36.760 3.191 -2.024 1.00 0.00 C ATOM 95 CG GLU A 7 35.948 4.120 -2.930 1.00 0.00 C ATOM 96 CD GLU A 7 36.439 5.560 -2.761 1.00 0.00 C ATOM 97 OE1 GLU A 7 37.541 5.736 -2.268 1.00 0.00 O ATOM 98 OE2 GLU A 7 35.705 6.462 -3.128 1.00 0.00 O ATOM 0 H GLU A 7 37.110 1.756 -0.146 1.00 0.00 H new ATOM 0 HA GLU A 7 35.083 1.807 -2.241 1.00 0.00 H new ATOM 0 HB2 GLU A 7 36.763 3.573 -1.003 1.00 0.00 H new ATOM 0 HB3 GLU A 7 37.798 3.159 -2.355 1.00 0.00 H new ATOM 0 HG2 GLU A 7 36.050 3.810 -3.970 1.00 0.00 H new ATOM 0 HG3 GLU A 7 34.889 4.054 -2.680 1.00 0.00 H new ATOM 105 N LYS A 8 38.053 0.661 -3.069 1.00 0.00 N ATOM 106 CA LYS A 8 38.714 -0.140 -4.136 1.00 0.00 C ATOM 107 C LYS A 8 38.018 -1.489 -4.272 1.00 0.00 C ATOM 108 O LYS A 8 37.647 -1.894 -5.352 1.00 0.00 O ATOM 109 CB LYS A 8 40.162 -0.317 -3.678 1.00 0.00 C ATOM 110 CG LYS A 8 40.828 1.053 -3.545 1.00 0.00 C ATOM 111 CD LYS A 8 41.701 1.318 -4.772 1.00 0.00 C ATOM 112 CE LYS A 8 41.512 2.765 -5.230 1.00 0.00 C ATOM 113 NZ LYS A 8 41.916 2.766 -6.665 1.00 0.00 N ATOM 0 H LYS A 8 38.654 0.934 -2.292 1.00 0.00 H new ATOM 0 HA LYS A 8 38.665 0.347 -5.110 1.00 0.00 H new ATOM 0 HB2 LYS A 8 40.191 -0.841 -2.723 1.00 0.00 H new ATOM 0 HB3 LYS A 8 40.708 -0.930 -4.394 1.00 0.00 H new ATOM 0 HG2 LYS A 8 40.069 1.830 -3.451 1.00 0.00 H new ATOM 0 HG3 LYS A 8 41.434 1.088 -2.640 1.00 0.00 H new ATOM 0 HD2 LYS A 8 42.749 1.135 -4.532 1.00 0.00 H new ATOM 0 HD3 LYS A 8 41.434 0.633 -5.577 1.00 0.00 H new ATOM 0 HE2 LYS A 8 40.477 3.086 -5.110 1.00 0.00 H new ATOM 0 HE3 LYS A 8 42.127 3.449 -4.645 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 41.815 3.725 -7.054 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 42.907 2.462 -6.747 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 41.308 2.111 -7.197 1.00 0.00 H new ATOM 127 N LYS A 9 37.818 -2.178 -3.188 1.00 0.00 N ATOM 128 CA LYS A 9 37.118 -3.487 -3.271 1.00 0.00 C ATOM 129 C LYS A 9 35.706 -3.262 -3.823 1.00 0.00 C ATOM 130 O LYS A 9 35.079 -4.158 -4.353 1.00 0.00 O ATOM 131 CB LYS A 9 37.064 -3.995 -1.831 1.00 0.00 C ATOM 132 CG LYS A 9 38.488 -4.185 -1.300 1.00 0.00 C ATOM 133 CD LYS A 9 38.841 -5.674 -1.306 1.00 0.00 C ATOM 134 CE LYS A 9 39.943 -5.933 -2.335 1.00 0.00 C ATOM 135 NZ LYS A 9 41.212 -5.606 -1.626 1.00 0.00 N ATOM 0 H LYS A 9 38.107 -1.894 -2.252 1.00 0.00 H new ATOM 0 HA LYS A 9 37.617 -4.201 -3.927 1.00 0.00 H new ATOM 0 HB2 LYS A 9 36.523 -3.286 -1.205 1.00 0.00 H new ATOM 0 HB3 LYS A 9 36.520 -4.938 -1.788 1.00 0.00 H new ATOM 0 HG2 LYS A 9 39.195 -3.630 -1.917 1.00 0.00 H new ATOM 0 HG3 LYS A 9 38.567 -3.786 -0.289 1.00 0.00 H new ATOM 0 HD2 LYS A 9 39.174 -5.984 -0.315 1.00 0.00 H new ATOM 0 HD3 LYS A 9 37.958 -6.267 -1.546 1.00 0.00 H new ATOM 0 HE2 LYS A 9 39.934 -6.970 -2.671 1.00 0.00 H new ATOM 0 HE3 LYS A 9 39.812 -5.310 -3.220 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 42.017 -5.759 -2.267 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 41.194 -4.611 -1.323 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 41.312 -6.220 -0.792 1.00 0.00 H new ATOM 149 N PHE A 10 35.208 -2.059 -3.696 1.00 0.00 N ATOM 150 CA PHE A 10 33.843 -1.738 -4.202 1.00 0.00 C ATOM 151 C PHE A 10 33.777 -1.881 -5.725 1.00 0.00 C ATOM 152 O PHE A 10 33.084 -2.734 -6.249 1.00 0.00 O ATOM 153 CB PHE A 10 33.627 -0.275 -3.799 1.00 0.00 C ATOM 154 CG PHE A 10 32.161 0.011 -3.597 1.00 0.00 C ATOM 155 CD1 PHE A 10 31.484 -0.510 -2.472 1.00 0.00 C ATOM 156 CD2 PHE A 10 31.471 0.824 -4.523 1.00 0.00 C ATOM 157 CE1 PHE A 10 30.115 -0.222 -2.277 1.00 0.00 C ATOM 158 CE2 PHE A 10 30.104 1.118 -4.325 1.00 0.00 C ATOM 159 CZ PHE A 10 29.427 0.593 -3.203 1.00 0.00 C ATOM 0 H PHE A 10 35.696 -1.278 -3.258 1.00 0.00 H new ATOM 0 HA PHE A 10 33.085 -2.407 -3.795 1.00 0.00 H new ATOM 0 HB2 PHE A 10 34.174 -0.061 -2.881 1.00 0.00 H new ATOM 0 HB3 PHE A 10 34.028 0.383 -4.570 1.00 0.00 H new ATOM 0 HD1 PHE A 10 32.013 -1.128 -1.762 1.00 0.00 H new ATOM 0 HD2 PHE A 10 31.989 1.221 -5.383 1.00 0.00 H new ATOM 0 HE1 PHE A 10 29.595 -0.625 -1.421 1.00 0.00 H new ATOM 0 HE2 PHE A 10 29.577 1.743 -5.031 1.00 0.00 H new ATOM 0 HZ PHE A 10 28.381 0.815 -3.052 1.00 0.00 H new ATOM 169 N LYS A 11 34.482 -1.049 -6.444 1.00 0.00 N ATOM 170 CA LYS A 11 34.432 -1.137 -7.933 1.00 0.00 C ATOM 171 C LYS A 11 35.045 -2.450 -8.416 1.00 0.00 C ATOM 172 O LYS A 11 34.660 -2.993 -9.434 1.00 0.00 O ATOM 173 CB LYS A 11 35.249 0.052 -8.426 1.00 0.00 C ATOM 174 CG LYS A 11 35.166 0.126 -9.952 1.00 0.00 C ATOM 175 CD LYS A 11 33.835 0.764 -10.357 1.00 0.00 C ATOM 176 CE LYS A 11 33.756 0.857 -11.882 1.00 0.00 C ATOM 177 NZ LYS A 11 33.727 2.318 -12.172 1.00 0.00 N ATOM 0 H LYS A 11 35.086 -0.318 -6.069 1.00 0.00 H new ATOM 0 HA LYS A 11 33.410 -1.115 -8.310 1.00 0.00 H new ATOM 0 HB2 LYS A 11 34.872 0.975 -7.985 1.00 0.00 H new ATOM 0 HB3 LYS A 11 36.288 -0.051 -8.112 1.00 0.00 H new ATOM 0 HG2 LYS A 11 35.997 0.712 -10.345 1.00 0.00 H new ATOM 0 HG3 LYS A 11 35.249 -0.873 -10.381 1.00 0.00 H new ATOM 0 HD2 LYS A 11 33.004 0.171 -9.975 1.00 0.00 H new ATOM 0 HD3 LYS A 11 33.747 1.757 -9.917 1.00 0.00 H new ATOM 0 HE2 LYS A 11 34.614 0.377 -12.353 1.00 0.00 H new ATOM 0 HE3 LYS A 11 32.864 0.360 -12.263 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 33.673 2.467 -13.200 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 32.896 2.746 -11.716 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 34.592 2.762 -11.803 1.00 0.00 H new ATOM 191 N GLU A 12 35.993 -2.964 -7.693 1.00 0.00 N ATOM 192 CA GLU A 12 36.635 -4.241 -8.103 1.00 0.00 C ATOM 193 C GLU A 12 35.671 -5.403 -7.880 1.00 0.00 C ATOM 194 O GLU A 12 35.777 -6.439 -8.506 1.00 0.00 O ATOM 195 CB GLU A 12 37.861 -4.375 -7.201 1.00 0.00 C ATOM 196 CG GLU A 12 39.067 -3.726 -7.880 1.00 0.00 C ATOM 197 CD GLU A 12 39.884 -4.799 -8.603 1.00 0.00 C ATOM 198 OE1 GLU A 12 40.017 -5.882 -8.058 1.00 0.00 O ATOM 199 OE2 GLU A 12 40.362 -4.519 -9.690 1.00 0.00 O ATOM 0 H GLU A 12 36.354 -2.554 -6.831 1.00 0.00 H new ATOM 0 HA GLU A 12 36.907 -4.251 -9.158 1.00 0.00 H new ATOM 0 HB2 GLU A 12 37.672 -3.898 -6.239 1.00 0.00 H new ATOM 0 HB3 GLU A 12 38.065 -5.427 -7.001 1.00 0.00 H new ATOM 0 HG2 GLU A 12 38.734 -2.968 -8.589 1.00 0.00 H new ATOM 0 HG3 GLU A 12 39.686 -3.220 -7.139 1.00 0.00 H new ATOM 206 N LEU A 13 34.726 -5.241 -6.995 1.00 0.00 N ATOM 207 CA LEU A 13 33.758 -6.341 -6.744 1.00 0.00 C ATOM 208 C LEU A 13 32.692 -6.354 -7.843 1.00 0.00 C ATOM 209 O LEU A 13 32.269 -7.399 -8.295 1.00 0.00 O ATOM 210 CB LEU A 13 33.147 -6.028 -5.381 1.00 0.00 C ATOM 211 CG LEU A 13 33.929 -6.775 -4.299 1.00 0.00 C ATOM 212 CD1 LEU A 13 33.481 -6.293 -2.922 1.00 0.00 C ATOM 213 CD2 LEU A 13 33.661 -8.276 -4.417 1.00 0.00 C ATOM 0 H LEU A 13 34.584 -4.398 -6.438 1.00 0.00 H new ATOM 0 HA LEU A 13 34.226 -7.325 -6.751 1.00 0.00 H new ATOM 0 HB2 LEU A 13 33.177 -4.955 -5.193 1.00 0.00 H new ATOM 0 HB3 LEU A 13 32.099 -6.326 -5.361 1.00 0.00 H new ATOM 0 HG LEU A 13 34.994 -6.582 -4.427 1.00 0.00 H new ATOM 0 HD11 LEU A 13 34.038 -6.825 -2.151 1.00 0.00 H new ATOM 0 HD12 LEU A 13 33.669 -5.223 -2.832 1.00 0.00 H new ATOM 0 HD13 LEU A 13 32.415 -6.486 -2.798 1.00 0.00 H new ATOM 0 HD21 LEU A 13 34.219 -8.807 -3.646 1.00 0.00 H new ATOM 0 HD22 LEU A 13 32.595 -8.466 -4.290 1.00 0.00 H new ATOM 0 HD23 LEU A 13 33.978 -8.626 -5.399 1.00 0.00 H new ATOM 225 N TRP A 14 32.265 -5.202 -8.291 1.00 0.00 N ATOM 226 CA TRP A 14 31.238 -5.166 -9.375 1.00 0.00 C ATOM 227 C TRP A 14 31.814 -5.772 -10.650 1.00 0.00 C ATOM 228 O TRP A 14 31.194 -6.589 -11.302 1.00 0.00 O ATOM 229 CB TRP A 14 30.930 -3.687 -9.599 1.00 0.00 C ATOM 230 CG TRP A 14 29.573 -3.382 -9.070 1.00 0.00 C ATOM 231 CD1 TRP A 14 28.395 -3.668 -9.682 1.00 0.00 C ATOM 232 CD2 TRP A 14 29.236 -2.732 -7.826 1.00 0.00 C ATOM 233 NE1 TRP A 14 27.360 -3.239 -8.881 1.00 0.00 N ATOM 234 CE2 TRP A 14 27.824 -2.655 -7.729 1.00 0.00 C ATOM 235 CE3 TRP A 14 30.012 -2.201 -6.771 1.00 0.00 C ATOM 236 CZ2 TRP A 14 27.204 -2.075 -6.626 1.00 0.00 C ATOM 237 CZ3 TRP A 14 29.392 -1.612 -5.654 1.00 0.00 C ATOM 238 CH2 TRP A 14 27.990 -1.550 -5.579 1.00 0.00 C ATOM 0 H TRP A 14 32.580 -4.291 -7.957 1.00 0.00 H new ATOM 0 HA TRP A 14 30.345 -5.731 -9.109 1.00 0.00 H new ATOM 0 HB2 TRP A 14 31.675 -3.069 -9.099 1.00 0.00 H new ATOM 0 HB3 TRP A 14 30.980 -3.450 -10.662 1.00 0.00 H new ATOM 0 HD1 TRP A 14 28.287 -4.153 -10.641 1.00 0.00 H new ATOM 0 HE1 TRP A 14 26.373 -3.342 -9.115 1.00 0.00 H new ATOM 0 HE3 TRP A 14 31.090 -2.248 -6.823 1.00 0.00 H new ATOM 0 HZ2 TRP A 14 26.126 -2.027 -6.572 1.00 0.00 H new ATOM 0 HZ3 TRP A 14 29.994 -1.207 -4.854 1.00 0.00 H new ATOM 0 HH2 TRP A 14 27.514 -1.100 -4.720 1.00 0.00 H new ATOM 249 N LYS A 15 32.999 -5.373 -11.011 1.00 0.00 N ATOM 250 CA LYS A 15 33.623 -5.917 -12.244 1.00 0.00 C ATOM 251 C LYS A 15 34.684 -6.955 -11.872 1.00 0.00 C ATOM 252 O LYS A 15 35.859 -6.659 -11.776 1.00 0.00 O ATOM 253 CB LYS A 15 34.245 -4.698 -12.922 1.00 0.00 C ATOM 254 CG LYS A 15 35.070 -5.146 -14.131 1.00 0.00 C ATOM 255 CD LYS A 15 34.130 -5.614 -15.245 1.00 0.00 C ATOM 256 CE LYS A 15 34.730 -5.253 -16.605 1.00 0.00 C ATOM 257 NZ LYS A 15 34.141 -6.238 -17.556 1.00 0.00 N ATOM 0 H LYS A 15 33.563 -4.692 -10.503 1.00 0.00 H new ATOM 0 HA LYS A 15 32.914 -6.423 -12.899 1.00 0.00 H new ATOM 0 HB2 LYS A 15 33.463 -4.007 -13.239 1.00 0.00 H new ATOM 0 HB3 LYS A 15 34.878 -4.161 -12.216 1.00 0.00 H new ATOM 0 HG2 LYS A 15 35.691 -4.323 -14.486 1.00 0.00 H new ATOM 0 HG3 LYS A 15 35.744 -5.954 -13.846 1.00 0.00 H new ATOM 0 HD2 LYS A 15 33.977 -6.691 -15.178 1.00 0.00 H new ATOM 0 HD3 LYS A 15 33.152 -5.146 -15.131 1.00 0.00 H new ATOM 0 HE2 LYS A 15 34.479 -4.231 -16.889 1.00 0.00 H new ATOM 0 HE3 LYS A 15 35.818 -5.322 -16.588 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 34.504 -6.056 -18.513 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 34.402 -7.201 -17.264 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 33.105 -6.145 -17.555 1.00 0.00 H new ATOM 271 N GLY A 16 34.267 -8.171 -11.651 1.00 0.00 N ATOM 272 CA GLY A 16 35.228 -9.244 -11.271 1.00 0.00 C ATOM 273 C GLY A 16 34.452 -10.391 -10.614 1.00 0.00 C ATOM 274 O GLY A 16 33.972 -11.280 -11.289 1.00 0.00 O ATOM 0 H GLY A 16 33.294 -8.469 -11.718 1.00 0.00 H new ATOM 0 HA2 GLY A 16 35.760 -9.604 -12.152 1.00 0.00 H new ATOM 0 HA3 GLY A 16 35.978 -8.853 -10.583 1.00 0.00 H new ATOM 278 N PRO A 17 34.346 -10.327 -9.311 1.00 0.00 N ATOM 279 CA PRO A 17 33.610 -11.368 -8.558 1.00 0.00 C ATOM 280 C PRO A 17 32.100 -11.140 -8.710 1.00 0.00 C ATOM 281 O PRO A 17 31.658 -10.511 -9.651 1.00 0.00 O ATOM 282 CB PRO A 17 34.064 -11.150 -7.115 1.00 0.00 C ATOM 283 CG PRO A 17 34.479 -9.713 -7.045 1.00 0.00 C ATOM 284 CD PRO A 17 34.899 -9.291 -8.431 1.00 0.00 C ATOM 0 HA PRO A 17 33.804 -12.384 -8.902 1.00 0.00 H new ATOM 0 HB2 PRO A 17 33.258 -11.361 -6.413 1.00 0.00 H new ATOM 0 HB3 PRO A 17 34.892 -11.811 -6.859 1.00 0.00 H new ATOM 0 HG2 PRO A 17 33.656 -9.094 -6.689 1.00 0.00 H new ATOM 0 HG3 PRO A 17 35.301 -9.586 -6.341 1.00 0.00 H new ATOM 0 HD2 PRO A 17 34.507 -8.305 -8.682 1.00 0.00 H new ATOM 0 HD3 PRO A 17 35.984 -9.234 -8.517 1.00 0.00 H new ATOM 292 N ARG A 18 31.305 -11.644 -7.802 1.00 0.00 N ATOM 293 CA ARG A 18 29.827 -11.447 -7.908 1.00 0.00 C ATOM 294 C ARG A 18 29.497 -9.970 -8.178 1.00 0.00 C ATOM 295 O ARG A 18 30.362 -9.117 -8.163 1.00 0.00 O ATOM 296 CB ARG A 18 29.260 -11.920 -6.552 1.00 0.00 C ATOM 297 CG ARG A 18 29.360 -10.814 -5.483 1.00 0.00 C ATOM 298 CD ARG A 18 30.828 -10.532 -5.159 1.00 0.00 C ATOM 299 NE ARG A 18 31.374 -11.835 -4.676 1.00 0.00 N ATOM 300 CZ ARG A 18 30.900 -12.381 -3.586 1.00 0.00 C ATOM 301 NH1 ARG A 18 30.793 -11.672 -2.495 1.00 0.00 N ATOM 302 NH2 ARG A 18 30.534 -13.633 -3.588 1.00 0.00 N ATOM 0 H ARG A 18 31.614 -12.183 -6.993 1.00 0.00 H new ATOM 0 HA ARG A 18 29.392 -12.006 -8.736 1.00 0.00 H new ATOM 0 HB2 ARG A 18 28.218 -12.216 -6.675 1.00 0.00 H new ATOM 0 HB3 ARG A 18 29.804 -12.803 -6.216 1.00 0.00 H new ATOM 0 HG2 ARG A 18 28.877 -9.905 -5.842 1.00 0.00 H new ATOM 0 HG3 ARG A 18 28.832 -11.120 -4.580 1.00 0.00 H new ATOM 0 HD2 ARG A 18 31.366 -10.181 -6.039 1.00 0.00 H new ATOM 0 HD3 ARG A 18 30.923 -9.758 -4.398 1.00 0.00 H new ATOM 0 HE ARG A 18 32.118 -12.300 -5.197 1.00 0.00 H new ATOM 0 HH11 ARG A 18 31.079 -10.693 -2.493 1.00 0.00 H new ATOM 0 HH12 ARG A 18 30.423 -12.097 -1.645 1.00 0.00 H new ATOM 0 HH21 ARG A 18 30.617 -14.187 -4.440 1.00 0.00 H new ATOM 0 HH22 ARG A 18 30.165 -14.058 -2.737 1.00 0.00 H new ATOM 316 N ARG A 19 28.253 -9.664 -8.412 1.00 0.00 N ATOM 317 CA ARG A 19 27.877 -8.247 -8.670 1.00 0.00 C ATOM 318 C ARG A 19 26.543 -7.920 -7.993 1.00 0.00 C ATOM 319 O ARG A 19 26.369 -6.860 -7.426 1.00 0.00 O ATOM 320 CB ARG A 19 27.750 -8.136 -10.189 1.00 0.00 C ATOM 321 CG ARG A 19 27.405 -6.694 -10.566 1.00 0.00 C ATOM 322 CD ARG A 19 26.827 -6.661 -11.982 1.00 0.00 C ATOM 323 NE ARG A 19 27.929 -7.153 -12.855 1.00 0.00 N ATOM 324 CZ ARG A 19 27.978 -6.793 -14.109 1.00 0.00 C ATOM 325 NH1 ARG A 19 28.304 -5.570 -14.426 1.00 0.00 N ATOM 326 NH2 ARG A 19 27.701 -7.658 -15.047 1.00 0.00 N ATOM 0 H ARG A 19 27.482 -10.331 -8.436 1.00 0.00 H new ATOM 0 HA ARG A 19 28.613 -7.548 -8.273 1.00 0.00 H new ATOM 0 HB2 ARG A 19 28.684 -8.435 -10.666 1.00 0.00 H new ATOM 0 HB3 ARG A 19 26.976 -8.813 -10.551 1.00 0.00 H new ATOM 0 HG2 ARG A 19 26.685 -6.284 -9.858 1.00 0.00 H new ATOM 0 HG3 ARG A 19 28.297 -6.069 -10.511 1.00 0.00 H new ATOM 0 HD2 ARG A 19 25.944 -7.295 -12.064 1.00 0.00 H new ATOM 0 HD3 ARG A 19 26.522 -5.653 -12.261 1.00 0.00 H new ATOM 0 HE ARG A 19 28.645 -7.771 -12.473 1.00 0.00 H new ATOM 0 HH11 ARG A 19 28.521 -4.894 -13.694 1.00 0.00 H new ATOM 0 HH12 ARG A 19 28.342 -5.290 -15.406 1.00 0.00 H new ATOM 0 HH21 ARG A 19 27.446 -8.614 -14.800 1.00 0.00 H new ATOM 0 HH22 ARG A 19 27.739 -7.377 -16.027 1.00 0.00 H new ATOM 340 N GLY A 20 25.599 -8.820 -8.047 1.00 0.00 N ATOM 341 CA GLY A 20 24.281 -8.554 -7.405 1.00 0.00 C ATOM 342 C GLY A 20 24.461 -8.457 -5.888 1.00 0.00 C ATOM 343 O GLY A 20 23.777 -7.707 -5.220 1.00 0.00 O ATOM 0 H GLY A 20 25.684 -9.726 -8.507 1.00 0.00 H new ATOM 0 HA2 GLY A 20 23.857 -7.627 -7.791 1.00 0.00 H new ATOM 0 HA3 GLY A 20 23.579 -9.351 -7.648 1.00 0.00 H new ATOM 347 N GLU A 21 25.376 -9.209 -5.339 1.00 0.00 N ATOM 348 CA GLU A 21 25.598 -9.159 -3.865 1.00 0.00 C ATOM 349 C GLU A 21 26.311 -7.860 -3.482 1.00 0.00 C ATOM 350 O GLU A 21 26.154 -7.354 -2.389 1.00 0.00 O ATOM 351 CB GLU A 21 26.480 -10.369 -3.556 1.00 0.00 C ATOM 352 CG GLU A 21 25.624 -11.476 -2.937 1.00 0.00 C ATOM 353 CD GLU A 21 26.450 -12.759 -2.828 1.00 0.00 C ATOM 354 OE1 GLU A 21 27.252 -13.002 -3.715 1.00 0.00 O ATOM 355 OE2 GLU A 21 26.267 -13.478 -1.859 1.00 0.00 O ATOM 0 H GLU A 21 25.979 -9.856 -5.847 1.00 0.00 H new ATOM 0 HA GLU A 21 24.663 -9.184 -3.305 1.00 0.00 H new ATOM 0 HB2 GLU A 21 26.956 -10.729 -4.468 1.00 0.00 H new ATOM 0 HB3 GLU A 21 27.279 -10.085 -2.871 1.00 0.00 H new ATOM 0 HG2 GLU A 21 25.274 -11.171 -1.951 1.00 0.00 H new ATOM 0 HG3 GLU A 21 24.739 -11.651 -3.549 1.00 0.00 H new ATOM 362 N ILE A 22 27.087 -7.314 -4.377 1.00 0.00 N ATOM 363 CA ILE A 22 27.805 -6.042 -4.067 1.00 0.00 C ATOM 364 C ILE A 22 26.808 -4.885 -4.062 1.00 0.00 C ATOM 365 O ILE A 22 26.707 -4.138 -3.110 1.00 0.00 O ATOM 366 CB ILE A 22 28.829 -5.875 -5.193 1.00 0.00 C ATOM 367 CG1 ILE A 22 29.684 -7.141 -5.308 1.00 0.00 C ATOM 368 CG2 ILE A 22 29.732 -4.676 -4.893 1.00 0.00 C ATOM 369 CD1 ILE A 22 30.320 -7.464 -3.952 1.00 0.00 C ATOM 0 H ILE A 22 27.256 -7.692 -5.309 1.00 0.00 H new ATOM 0 HA ILE A 22 28.288 -6.057 -3.090 1.00 0.00 H new ATOM 0 HB ILE A 22 28.303 -5.708 -6.133 1.00 0.00 H new ATOM 0 HG12 ILE A 22 29.069 -7.977 -5.640 1.00 0.00 H new ATOM 0 HG13 ILE A 22 30.461 -6.999 -6.059 1.00 0.00 H new ATOM 0 HG21 ILE A 22 30.460 -4.559 -5.696 1.00 0.00 H new ATOM 0 HG22 ILE A 22 29.126 -3.773 -4.819 1.00 0.00 H new ATOM 0 HG23 ILE A 22 30.254 -4.841 -3.951 1.00 0.00 H new ATOM 0 HD11 ILE A 22 30.927 -8.365 -4.040 1.00 0.00 H new ATOM 0 HD12 ILE A 22 30.950 -6.632 -3.638 1.00 0.00 H new ATOM 0 HD13 ILE A 22 29.536 -7.625 -3.212 1.00 0.00 H new ATOM 381 N GLU A 23 26.055 -4.743 -5.112 1.00 0.00 N ATOM 382 CA GLU A 23 25.051 -3.657 -5.157 1.00 0.00 C ATOM 383 C GLU A 23 24.030 -3.890 -4.047 1.00 0.00 C ATOM 384 O GLU A 23 23.437 -2.964 -3.525 1.00 0.00 O ATOM 385 CB GLU A 23 24.442 -3.763 -6.559 1.00 0.00 C ATOM 386 CG GLU A 23 23.428 -2.647 -6.777 1.00 0.00 C ATOM 387 CD GLU A 23 22.043 -3.252 -7.013 1.00 0.00 C ATOM 388 OE1 GLU A 23 21.377 -3.557 -6.038 1.00 0.00 O ATOM 389 OE2 GLU A 23 21.672 -3.402 -8.166 1.00 0.00 O ATOM 0 H GLU A 23 26.094 -5.335 -5.942 1.00 0.00 H new ATOM 0 HA GLU A 23 25.456 -2.659 -4.993 1.00 0.00 H new ATOM 0 HB2 GLU A 23 25.229 -3.702 -7.311 1.00 0.00 H new ATOM 0 HB3 GLU A 23 23.959 -4.732 -6.681 1.00 0.00 H new ATOM 0 HG2 GLU A 23 23.405 -1.988 -5.909 1.00 0.00 H new ATOM 0 HG3 GLU A 23 23.721 -2.038 -7.632 1.00 0.00 H new ATOM 396 N GLU A 24 23.859 -5.118 -3.641 1.00 0.00 N ATOM 397 CA GLU A 24 22.923 -5.395 -2.523 1.00 0.00 C ATOM 398 C GLU A 24 23.550 -4.836 -1.248 1.00 0.00 C ATOM 399 O GLU A 24 22.877 -4.319 -0.378 1.00 0.00 O ATOM 400 CB GLU A 24 22.808 -6.918 -2.454 1.00 0.00 C ATOM 401 CG GLU A 24 21.921 -7.307 -1.268 1.00 0.00 C ATOM 402 CD GLU A 24 20.617 -7.917 -1.786 1.00 0.00 C ATOM 403 OE1 GLU A 24 20.691 -8.882 -2.528 1.00 0.00 O ATOM 404 OE2 GLU A 24 19.567 -7.409 -1.430 1.00 0.00 O ATOM 0 H GLU A 24 24.325 -5.935 -4.034 1.00 0.00 H new ATOM 0 HA GLU A 24 21.939 -4.944 -2.652 1.00 0.00 H new ATOM 0 HB2 GLU A 24 22.385 -7.304 -3.381 1.00 0.00 H new ATOM 0 HB3 GLU A 24 23.797 -7.364 -2.345 1.00 0.00 H new ATOM 0 HG2 GLU A 24 22.441 -8.021 -0.630 1.00 0.00 H new ATOM 0 HG3 GLU A 24 21.707 -6.430 -0.657 1.00 0.00 H new ATOM 411 N LEU A 25 24.852 -4.918 -1.157 1.00 0.00 N ATOM 412 CA LEU A 25 25.561 -4.373 0.035 1.00 0.00 C ATOM 413 C LEU A 25 25.355 -2.863 0.087 1.00 0.00 C ATOM 414 O LEU A 25 25.300 -2.270 1.143 1.00 0.00 O ATOM 415 CB LEU A 25 27.041 -4.693 -0.186 1.00 0.00 C ATOM 416 CG LEU A 25 27.850 -4.224 1.026 1.00 0.00 C ATOM 417 CD1 LEU A 25 27.696 -5.226 2.173 1.00 0.00 C ATOM 418 CD2 LEU A 25 29.327 -4.111 0.638 1.00 0.00 C ATOM 0 H LEU A 25 25.456 -5.341 -1.861 1.00 0.00 H new ATOM 0 HA LEU A 25 25.195 -4.799 0.969 1.00 0.00 H new ATOM 0 HB2 LEU A 25 27.174 -5.765 -0.333 1.00 0.00 H new ATOM 0 HB3 LEU A 25 27.400 -4.200 -1.089 1.00 0.00 H new ATOM 0 HG LEU A 25 27.482 -3.251 1.351 1.00 0.00 H new ATOM 0 HD11 LEU A 25 28.274 -4.887 3.033 1.00 0.00 H new ATOM 0 HD12 LEU A 25 26.645 -5.303 2.450 1.00 0.00 H new ATOM 0 HD13 LEU A 25 28.060 -6.203 1.854 1.00 0.00 H new ATOM 0 HD21 LEU A 25 29.905 -3.777 1.500 1.00 0.00 H new ATOM 0 HD22 LEU A 25 29.693 -5.084 0.311 1.00 0.00 H new ATOM 0 HD23 LEU A 25 29.436 -3.391 -0.173 1.00 0.00 H new ATOM 430 N HIS A 26 25.236 -2.237 -1.054 1.00 0.00 N ATOM 431 CA HIS A 26 25.022 -0.764 -1.077 1.00 0.00 C ATOM 432 C HIS A 26 23.596 -0.451 -0.620 1.00 0.00 C ATOM 433 O HIS A 26 23.340 0.560 0.003 1.00 0.00 O ATOM 434 CB HIS A 26 25.237 -0.345 -2.531 1.00 0.00 C ATOM 435 CG HIS A 26 24.921 1.118 -2.677 1.00 0.00 C ATOM 436 ND1 HIS A 26 25.776 2.114 -2.228 1.00 0.00 N ATOM 437 CD2 HIS A 26 23.839 1.767 -3.210 1.00 0.00 C ATOM 438 CE1 HIS A 26 25.194 3.299 -2.500 1.00 0.00 C ATOM 439 NE2 HIS A 26 24.011 3.142 -3.097 1.00 0.00 N ATOM 0 H HIS A 26 25.278 -2.684 -1.970 1.00 0.00 H new ATOM 0 HA HIS A 26 25.699 -0.230 -0.411 1.00 0.00 H new ATOM 0 HB2 HIS A 26 26.268 -0.538 -2.829 1.00 0.00 H new ATOM 0 HB3 HIS A 26 24.599 -0.934 -3.190 1.00 0.00 H new ATOM 0 HD1 HIS A 26 26.679 1.975 -1.775 1.00 0.00 H new ATOM 0 HD2 HIS A 26 22.981 1.283 -3.652 1.00 0.00 H new ATOM 0 HE1 HIS A 26 25.631 4.258 -2.264 1.00 0.00 H new ATOM 447 N LYS A 27 22.664 -1.319 -0.910 1.00 0.00 N ATOM 448 CA LYS A 27 21.265 -1.067 -0.466 1.00 0.00 C ATOM 449 C LYS A 27 21.231 -1.025 1.062 1.00 0.00 C ATOM 450 O LYS A 27 20.766 -0.074 1.661 1.00 0.00 O ATOM 451 CB LYS A 27 20.453 -2.249 -0.996 1.00 0.00 C ATOM 452 CG LYS A 27 19.430 -1.746 -2.016 1.00 0.00 C ATOM 453 CD LYS A 27 20.006 -1.891 -3.425 1.00 0.00 C ATOM 454 CE LYS A 27 20.622 -0.561 -3.863 1.00 0.00 C ATOM 455 NZ LYS A 27 19.567 0.096 -4.685 1.00 0.00 N ATOM 0 H LYS A 27 22.810 -2.184 -1.431 1.00 0.00 H new ATOM 0 HA LYS A 27 20.866 -0.121 -0.833 1.00 0.00 H new ATOM 0 HB2 LYS A 27 21.115 -2.981 -1.459 1.00 0.00 H new ATOM 0 HB3 LYS A 27 19.945 -2.754 -0.174 1.00 0.00 H new ATOM 0 HG2 LYS A 27 18.504 -2.314 -1.929 1.00 0.00 H new ATOM 0 HG3 LYS A 27 19.184 -0.703 -1.817 1.00 0.00 H new ATOM 0 HD2 LYS A 27 20.761 -2.677 -3.442 1.00 0.00 H new ATOM 0 HD3 LYS A 27 19.222 -2.188 -4.121 1.00 0.00 H new ATOM 0 HE2 LYS A 27 20.892 0.052 -3.003 1.00 0.00 H new ATOM 0 HE3 LYS A 27 21.533 -0.718 -4.441 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 19.914 1.016 -5.024 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 19.335 -0.508 -5.500 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 18.715 0.239 -4.106 1.00 0.00 H new ATOM 469 N LYS A 28 21.744 -2.043 1.700 1.00 0.00 N ATOM 470 CA LYS A 28 21.763 -2.046 3.187 1.00 0.00 C ATOM 471 C LYS A 28 22.570 -0.841 3.672 1.00 0.00 C ATOM 472 O LYS A 28 22.213 -0.184 4.627 1.00 0.00 O ATOM 473 CB LYS A 28 22.448 -3.356 3.578 1.00 0.00 C ATOM 474 CG LYS A 28 21.385 -4.405 3.910 1.00 0.00 C ATOM 475 CD LYS A 28 21.274 -5.402 2.755 1.00 0.00 C ATOM 476 CE LYS A 28 20.193 -6.436 3.077 1.00 0.00 C ATOM 477 NZ LYS A 28 18.905 -5.736 2.811 1.00 0.00 N ATOM 0 H LYS A 28 22.148 -2.868 1.256 1.00 0.00 H new ATOM 0 HA LYS A 28 20.769 -1.977 3.628 1.00 0.00 H new ATOM 0 HB2 LYS A 28 23.079 -3.707 2.762 1.00 0.00 H new ATOM 0 HB3 LYS A 28 23.099 -3.197 4.438 1.00 0.00 H new ATOM 0 HG2 LYS A 28 21.648 -4.926 4.830 1.00 0.00 H new ATOM 0 HG3 LYS A 28 20.423 -3.922 4.081 1.00 0.00 H new ATOM 0 HD2 LYS A 28 21.028 -4.879 1.831 1.00 0.00 H new ATOM 0 HD3 LYS A 28 22.231 -5.898 2.595 1.00 0.00 H new ATOM 0 HE2 LYS A 28 20.297 -7.324 2.453 1.00 0.00 H new ATOM 0 HE3 LYS A 28 20.257 -6.766 4.114 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 18.298 -5.794 3.653 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 19.092 -4.738 2.588 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 18.425 -6.187 2.006 1.00 0.00 H new ATOM 491 N PHE A 29 23.645 -0.538 2.993 1.00 0.00 N ATOM 492 CA PHE A 29 24.480 0.637 3.376 1.00 0.00 C ATOM 493 C PHE A 29 23.595 1.880 3.437 1.00 0.00 C ATOM 494 O PHE A 29 23.768 2.742 4.277 1.00 0.00 O ATOM 495 CB PHE A 29 25.522 0.757 2.258 1.00 0.00 C ATOM 496 CG PHE A 29 26.682 -0.204 2.483 1.00 0.00 C ATOM 497 CD1 PHE A 29 26.640 -1.183 3.512 1.00 0.00 C ATOM 498 CD2 PHE A 29 27.819 -0.116 1.649 1.00 0.00 C ATOM 499 CE1 PHE A 29 27.730 -2.060 3.699 1.00 0.00 C ATOM 500 CE2 PHE A 29 28.908 -0.995 1.839 1.00 0.00 C ATOM 501 CZ PHE A 29 28.863 -1.966 2.864 1.00 0.00 C ATOM 0 H PHE A 29 23.982 -1.059 2.183 1.00 0.00 H new ATOM 0 HA PHE A 29 24.954 0.529 4.352 1.00 0.00 H new ATOM 0 HB2 PHE A 29 25.054 0.547 1.296 1.00 0.00 H new ATOM 0 HB3 PHE A 29 25.896 1.780 2.214 1.00 0.00 H new ATOM 0 HD1 PHE A 29 25.773 -1.256 4.152 1.00 0.00 H new ATOM 0 HD2 PHE A 29 27.855 0.625 0.864 1.00 0.00 H new ATOM 0 HE1 PHE A 29 27.697 -2.803 4.482 1.00 0.00 H new ATOM 0 HE2 PHE A 29 29.776 -0.925 1.200 1.00 0.00 H new ATOM 0 HZ PHE A 29 29.697 -2.637 3.008 1.00 0.00 H new ATOM 511 N HIS A 30 22.629 1.964 2.564 1.00 0.00 N ATOM 512 CA HIS A 30 21.713 3.134 2.583 1.00 0.00 C ATOM 513 C HIS A 30 20.845 3.056 3.837 1.00 0.00 C ATOM 514 O HIS A 30 20.571 4.049 4.478 1.00 0.00 O ATOM 515 CB HIS A 30 20.871 3.000 1.314 1.00 0.00 C ATOM 516 CG HIS A 30 19.894 4.140 1.233 1.00 0.00 C ATOM 517 ND1 HIS A 30 20.059 5.192 0.346 1.00 0.00 N ATOM 518 CD2 HIS A 30 18.737 4.409 1.921 1.00 0.00 C ATOM 519 CE1 HIS A 30 19.027 6.037 0.521 1.00 0.00 C ATOM 520 NE2 HIS A 30 18.191 5.607 1.470 1.00 0.00 N ATOM 0 H HIS A 30 22.436 1.272 1.840 1.00 0.00 H new ATOM 0 HA HIS A 30 22.233 4.092 2.605 1.00 0.00 H new ATOM 0 HB2 HIS A 30 21.517 2.998 0.436 1.00 0.00 H new ATOM 0 HB3 HIS A 30 20.337 2.050 1.319 1.00 0.00 H new ATOM 0 HD2 HIS A 30 18.314 3.785 2.695 1.00 0.00 H new ATOM 0 HE1 HIS A 30 18.891 6.951 -0.038 1.00 0.00 H new ATOM 0 HE2 HIS A 30 17.336 6.059 1.794 1.00 0.00 H new ATOM 528 N GLU A 31 20.441 1.874 4.210 1.00 0.00 N ATOM 529 CA GLU A 31 19.630 1.728 5.450 1.00 0.00 C ATOM 530 C GLU A 31 20.574 1.559 6.652 1.00 0.00 C ATOM 531 O GLU A 31 20.146 1.360 7.772 1.00 0.00 O ATOM 532 CB GLU A 31 18.794 0.466 5.237 1.00 0.00 C ATOM 533 CG GLU A 31 17.603 0.791 4.334 1.00 0.00 C ATOM 534 CD GLU A 31 17.299 -0.412 3.439 1.00 0.00 C ATOM 535 OE1 GLU A 31 17.400 -1.527 3.925 1.00 0.00 O ATOM 536 OE2 GLU A 31 16.969 -0.198 2.284 1.00 0.00 O ATOM 0 H GLU A 31 20.636 1.006 3.712 1.00 0.00 H new ATOM 0 HA GLU A 31 18.998 2.594 5.647 1.00 0.00 H new ATOM 0 HB2 GLU A 31 19.404 -0.316 4.785 1.00 0.00 H new ATOM 0 HB3 GLU A 31 18.444 0.083 6.195 1.00 0.00 H new ATOM 0 HG2 GLU A 31 16.731 1.037 4.939 1.00 0.00 H new ATOM 0 HG3 GLU A 31 17.824 1.666 3.723 1.00 0.00 H new ATOM 543 N LEU A 32 21.862 1.643 6.417 1.00 0.00 N ATOM 544 CA LEU A 32 22.856 1.497 7.517 1.00 0.00 C ATOM 545 C LEU A 32 23.204 2.875 8.073 1.00 0.00 C ATOM 546 O LEU A 32 23.416 3.052 9.256 1.00 0.00 O ATOM 547 CB LEU A 32 24.086 0.896 6.825 1.00 0.00 C ATOM 548 CG LEU A 32 24.979 0.154 7.827 1.00 0.00 C ATOM 549 CD1 LEU A 32 26.027 -0.647 7.052 1.00 0.00 C ATOM 550 CD2 LEU A 32 25.698 1.153 8.737 1.00 0.00 C ATOM 0 H LEU A 32 22.268 1.809 5.496 1.00 0.00 H new ATOM 0 HA LEU A 32 22.493 0.887 8.344 1.00 0.00 H new ATOM 0 HB2 LEU A 32 23.766 0.210 6.041 1.00 0.00 H new ATOM 0 HB3 LEU A 32 24.658 1.688 6.341 1.00 0.00 H new ATOM 0 HG LEU A 32 24.362 -0.506 8.436 1.00 0.00 H new ATOM 0 HD11 LEU A 32 26.669 -1.180 7.753 1.00 0.00 H new ATOM 0 HD12 LEU A 32 25.528 -1.364 6.400 1.00 0.00 H new ATOM 0 HD13 LEU A 32 26.631 0.031 6.450 1.00 0.00 H new ATOM 0 HD21 LEU A 32 26.329 0.613 9.443 1.00 0.00 H new ATOM 0 HD22 LEU A 32 26.316 1.816 8.132 1.00 0.00 H new ATOM 0 HD23 LEU A 32 24.962 1.742 9.284 1.00 0.00 H new ATOM 562 N ILE A 33 23.294 3.849 7.212 1.00 0.00 N ATOM 563 CA ILE A 33 23.671 5.215 7.672 1.00 0.00 C ATOM 564 C ILE A 33 22.548 6.214 7.366 1.00 0.00 C ATOM 565 O ILE A 33 22.465 7.272 7.958 1.00 0.00 O ATOM 566 CB ILE A 33 24.944 5.539 6.879 1.00 0.00 C ATOM 567 CG1 ILE A 33 24.587 5.687 5.391 1.00 0.00 C ATOM 568 CG2 ILE A 33 25.957 4.399 7.068 1.00 0.00 C ATOM 569 CD1 ILE A 33 25.838 5.999 4.575 1.00 0.00 C ATOM 0 H ILE A 33 23.123 3.759 6.210 1.00 0.00 H new ATOM 0 HA ILE A 33 23.834 5.272 8.748 1.00 0.00 H new ATOM 0 HB ILE A 33 25.382 6.471 7.236 1.00 0.00 H new ATOM 0 HG12 ILE A 33 24.127 4.768 5.027 1.00 0.00 H new ATOM 0 HG13 ILE A 33 23.853 6.483 5.263 1.00 0.00 H new ATOM 0 HG21 ILE A 33 26.865 4.622 6.507 1.00 0.00 H new ATOM 0 HG22 ILE A 33 26.199 4.299 8.126 1.00 0.00 H new ATOM 0 HG23 ILE A 33 25.526 3.466 6.705 1.00 0.00 H new ATOM 0 HD11 ILE A 33 25.570 6.101 3.523 1.00 0.00 H new ATOM 0 HD12 ILE A 33 26.280 6.930 4.929 1.00 0.00 H new ATOM 0 HD13 ILE A 33 26.558 5.189 4.689 1.00 0.00 H new ATOM 581 N LYS A 34 21.683 5.881 6.447 1.00 0.00 N ATOM 582 CA LYS A 34 20.563 6.803 6.099 1.00 0.00 C ATOM 583 C LYS A 34 21.103 8.201 5.781 1.00 0.00 C ATOM 584 O LYS A 34 22.291 8.446 5.841 1.00 0.00 O ATOM 585 CB LYS A 34 19.680 6.838 7.346 1.00 0.00 C ATOM 586 CG LYS A 34 18.631 5.726 7.259 1.00 0.00 C ATOM 587 CD LYS A 34 17.431 6.222 6.451 1.00 0.00 C ATOM 588 CE LYS A 34 16.320 6.662 7.407 1.00 0.00 C ATOM 589 NZ LYS A 34 15.158 6.970 6.526 1.00 0.00 N ATOM 0 H LYS A 34 21.703 5.008 5.920 1.00 0.00 H new ATOM 0 HA LYS A 34 20.013 6.471 5.218 1.00 0.00 H new ATOM 0 HB2 LYS A 34 20.290 6.709 8.240 1.00 0.00 H new ATOM 0 HB3 LYS A 34 19.191 7.808 7.431 1.00 0.00 H new ATOM 0 HG2 LYS A 34 19.060 4.842 6.788 1.00 0.00 H new ATOM 0 HG3 LYS A 34 18.313 5.432 8.259 1.00 0.00 H new ATOM 0 HD2 LYS A 34 17.728 7.055 5.813 1.00 0.00 H new ATOM 0 HD3 LYS A 34 17.069 5.431 5.795 1.00 0.00 H new ATOM 0 HE2 LYS A 34 16.077 5.874 8.120 1.00 0.00 H new ATOM 0 HE3 LYS A 34 16.620 7.535 7.986 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 14.354 7.280 7.108 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 15.417 7.727 5.862 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 14.892 6.118 5.992 1.00 0.00 H new ATOM 603 N GLY A 35 20.238 9.118 5.443 1.00 0.00 N ATOM 604 CA GLY A 35 20.702 10.497 5.121 1.00 0.00 C ATOM 605 C GLY A 35 19.509 11.455 5.141 1.00 0.00 C ATOM 606 O GLY A 35 18.915 11.608 6.196 1.00 0.00 O ATOM 607 OXT GLY A 35 19.209 12.020 4.102 1.00 0.00 O ATOM 0 H GLY A 35 19.231 8.972 5.376 1.00 0.00 H new ATOM 0 HA2 GLY A 35 21.452 10.818 5.844 1.00 0.00 H new ATOM 0 HA3 GLY A 35 21.178 10.512 4.140 1.00 0.00 H new TER 611 GLY A 35 ATOM 612 N GLY B 1 33.806 -14.341 -2.200 1.00 0.00 N ATOM 613 CA GLY B 1 34.189 -13.117 -2.959 1.00 0.00 C ATOM 614 C GLY B 1 35.001 -12.191 -2.053 1.00 0.00 C ATOM 615 O GLY B 1 35.974 -12.597 -1.449 1.00 0.00 O ATOM 0 H1 GLY B 1 33.254 -14.972 -2.815 1.00 0.00 H new ATOM 0 H2 GLY B 1 34.664 -14.834 -1.880 1.00 0.00 H new ATOM 0 H3 GLY B 1 33.233 -14.073 -1.375 1.00 0.00 H new ATOM 0 HA2 GLY B 1 34.774 -13.389 -3.838 1.00 0.00 H new ATOM 0 HA3 GLY B 1 33.297 -12.603 -3.317 1.00 0.00 H new ATOM 621 N GLU B 2 34.613 -10.948 -1.954 1.00 0.00 N ATOM 622 CA GLU B 2 35.371 -10.002 -1.085 1.00 0.00 C ATOM 623 C GLU B 2 34.453 -8.884 -0.577 1.00 0.00 C ATOM 624 O GLU B 2 34.910 -7.839 -0.157 1.00 0.00 O ATOM 625 CB GLU B 2 36.466 -9.430 -1.986 1.00 0.00 C ATOM 626 CG GLU B 2 37.670 -10.375 -1.985 1.00 0.00 C ATOM 627 CD GLU B 2 38.963 -9.557 -2.010 1.00 0.00 C ATOM 628 OE1 GLU B 2 39.029 -8.570 -1.297 1.00 0.00 O ATOM 629 OE2 GLU B 2 39.864 -9.932 -2.742 1.00 0.00 O ATOM 0 H GLU B 2 33.807 -10.548 -2.435 1.00 0.00 H new ATOM 0 HA GLU B 2 35.781 -10.494 -0.203 1.00 0.00 H new ATOM 0 HB2 GLU B 2 36.089 -9.305 -3.001 1.00 0.00 H new ATOM 0 HB3 GLU B 2 36.764 -8.443 -1.633 1.00 0.00 H new ATOM 0 HG2 GLU B 2 37.646 -11.010 -1.099 1.00 0.00 H new ATOM 0 HG3 GLU B 2 37.628 -11.035 -2.852 1.00 0.00 H new ATOM 636 N VAL B 3 33.164 -9.093 -0.606 1.00 0.00 N ATOM 637 CA VAL B 3 32.230 -8.036 -0.117 1.00 0.00 C ATOM 638 C VAL B 3 32.320 -7.918 1.405 1.00 0.00 C ATOM 639 O VAL B 3 32.074 -6.873 1.972 1.00 0.00 O ATOM 640 CB VAL B 3 30.834 -8.500 -0.540 1.00 0.00 C ATOM 641 CG1 VAL B 3 30.503 -9.826 0.148 1.00 0.00 C ATOM 642 CG2 VAL B 3 29.804 -7.443 -0.132 1.00 0.00 C ATOM 0 H VAL B 3 32.718 -9.945 -0.945 1.00 0.00 H new ATOM 0 HA VAL B 3 32.469 -7.055 -0.528 1.00 0.00 H new ATOM 0 HB VAL B 3 30.809 -8.638 -1.621 1.00 0.00 H new ATOM 0 HG11 VAL B 3 29.509 -10.155 -0.154 1.00 0.00 H new ATOM 0 HG12 VAL B 3 31.237 -10.579 -0.140 1.00 0.00 H new ATOM 0 HG13 VAL B 3 30.527 -9.691 1.229 1.00 0.00 H new ATOM 0 HG21 VAL B 3 28.808 -7.770 -0.432 1.00 0.00 H new ATOM 0 HG22 VAL B 3 29.831 -7.307 0.949 1.00 0.00 H new ATOM 0 HG23 VAL B 3 30.038 -6.498 -0.623 1.00 0.00 H new ATOM 652 N GLU B 4 32.674 -8.982 2.071 1.00 0.00 N ATOM 653 CA GLU B 4 32.782 -8.929 3.555 1.00 0.00 C ATOM 654 C GLU B 4 33.931 -8.006 3.970 1.00 0.00 C ATOM 655 O GLU B 4 33.980 -7.523 5.083 1.00 0.00 O ATOM 656 CB GLU B 4 33.076 -10.367 3.979 1.00 0.00 C ATOM 657 CG GLU B 4 32.034 -10.818 5.004 1.00 0.00 C ATOM 658 CD GLU B 4 32.412 -12.198 5.544 1.00 0.00 C ATOM 659 OE1 GLU B 4 32.044 -13.179 4.918 1.00 0.00 O ATOM 660 OE2 GLU B 4 33.065 -12.251 6.573 1.00 0.00 O ATOM 0 H GLU B 4 32.893 -9.886 1.651 1.00 0.00 H new ATOM 0 HA GLU B 4 31.877 -8.540 4.021 1.00 0.00 H new ATOM 0 HB2 GLU B 4 33.056 -11.025 3.110 1.00 0.00 H new ATOM 0 HB3 GLU B 4 34.076 -10.434 4.407 1.00 0.00 H new ATOM 0 HG2 GLU B 4 31.978 -10.099 5.821 1.00 0.00 H new ATOM 0 HG3 GLU B 4 31.047 -10.854 4.543 1.00 0.00 H new ATOM 667 N GLU B 5 34.857 -7.758 3.085 1.00 0.00 N ATOM 668 CA GLU B 5 36.000 -6.869 3.436 1.00 0.00 C ATOM 669 C GLU B 5 35.555 -5.406 3.431 1.00 0.00 C ATOM 670 O GLU B 5 35.727 -4.692 4.400 1.00 0.00 O ATOM 671 CB GLU B 5 37.043 -7.115 2.346 1.00 0.00 C ATOM 672 CG GLU B 5 37.823 -8.391 2.666 1.00 0.00 C ATOM 673 CD GLU B 5 38.984 -8.056 3.605 1.00 0.00 C ATOM 674 OE1 GLU B 5 38.716 -7.633 4.717 1.00 0.00 O ATOM 675 OE2 GLU B 5 40.120 -8.229 3.196 1.00 0.00 O ATOM 0 H GLU B 5 34.872 -8.132 2.136 1.00 0.00 H new ATOM 0 HA GLU B 5 36.393 -7.077 4.431 1.00 0.00 H new ATOM 0 HB2 GLU B 5 36.556 -7.208 1.375 1.00 0.00 H new ATOM 0 HB3 GLU B 5 37.724 -6.266 2.281 1.00 0.00 H new ATOM 0 HG2 GLU B 5 37.165 -9.125 3.131 1.00 0.00 H new ATOM 0 HG3 GLU B 5 38.202 -8.839 1.747 1.00 0.00 H new ATOM 682 N LEU B 6 34.984 -4.953 2.350 1.00 0.00 N ATOM 683 CA LEU B 6 34.532 -3.536 2.295 1.00 0.00 C ATOM 684 C LEU B 6 33.415 -3.312 3.326 1.00 0.00 C ATOM 685 O LEU B 6 33.262 -2.234 3.862 1.00 0.00 O ATOM 686 CB LEU B 6 34.070 -3.319 0.829 1.00 0.00 C ATOM 687 CG LEU B 6 32.536 -3.328 0.687 1.00 0.00 C ATOM 688 CD1 LEU B 6 31.969 -1.990 1.167 1.00 0.00 C ATOM 689 CD2 LEU B 6 32.158 -3.532 -0.783 1.00 0.00 C ATOM 0 H LEU B 6 34.812 -5.500 1.506 1.00 0.00 H new ATOM 0 HA LEU B 6 35.310 -2.817 2.550 1.00 0.00 H new ATOM 0 HB2 LEU B 6 34.460 -2.368 0.465 1.00 0.00 H new ATOM 0 HB3 LEU B 6 34.495 -4.100 0.198 1.00 0.00 H new ATOM 0 HG LEU B 6 32.125 -4.139 1.288 1.00 0.00 H new ATOM 0 HD11 LEU B 6 30.884 -1.998 1.066 1.00 0.00 H new ATOM 0 HD12 LEU B 6 32.235 -1.836 2.213 1.00 0.00 H new ATOM 0 HD13 LEU B 6 32.384 -1.182 0.564 1.00 0.00 H new ATOM 0 HD21 LEU B 6 31.073 -3.538 -0.882 1.00 0.00 H new ATOM 0 HD22 LEU B 6 32.572 -2.721 -1.381 1.00 0.00 H new ATOM 0 HD23 LEU B 6 32.560 -4.483 -1.133 1.00 0.00 H new ATOM 701 N GLU B 7 32.646 -4.329 3.607 1.00 0.00 N ATOM 702 CA GLU B 7 31.544 -4.186 4.604 1.00 0.00 C ATOM 703 C GLU B 7 32.120 -3.980 6.008 1.00 0.00 C ATOM 704 O GLU B 7 31.727 -3.079 6.726 1.00 0.00 O ATOM 705 CB GLU B 7 30.774 -5.505 4.532 1.00 0.00 C ATOM 706 CG GLU B 7 29.309 -5.264 4.908 1.00 0.00 C ATOM 707 CD GLU B 7 28.502 -6.542 4.668 1.00 0.00 C ATOM 708 OE1 GLU B 7 29.109 -7.596 4.575 1.00 0.00 O ATOM 709 OE2 GLU B 7 27.288 -6.445 4.581 1.00 0.00 O ATOM 0 H GLU B 7 32.733 -5.255 3.189 1.00 0.00 H new ATOM 0 HA GLU B 7 30.907 -3.327 4.393 1.00 0.00 H new ATOM 0 HB2 GLU B 7 30.838 -5.921 3.527 1.00 0.00 H new ATOM 0 HB3 GLU B 7 31.219 -6.235 5.208 1.00 0.00 H new ATOM 0 HG2 GLU B 7 29.235 -4.966 5.954 1.00 0.00 H new ATOM 0 HG3 GLU B 7 28.900 -4.446 4.314 1.00 0.00 H new ATOM 716 N LYS B 8 33.046 -4.808 6.408 1.00 0.00 N ATOM 717 CA LYS B 8 33.637 -4.650 7.766 1.00 0.00 C ATOM 718 C LYS B 8 34.280 -3.274 7.889 1.00 0.00 C ATOM 719 O LYS B 8 34.024 -2.546 8.823 1.00 0.00 O ATOM 720 CB LYS B 8 34.685 -5.756 7.887 1.00 0.00 C ATOM 721 CG LYS B 8 34.007 -7.121 7.748 1.00 0.00 C ATOM 722 CD LYS B 8 33.818 -7.739 9.135 1.00 0.00 C ATOM 723 CE LYS B 8 32.429 -8.374 9.225 1.00 0.00 C ATOM 724 NZ LYS B 8 32.133 -8.440 10.684 1.00 0.00 N ATOM 0 H LYS B 8 33.417 -5.582 5.857 1.00 0.00 H new ATOM 0 HA LYS B 8 32.890 -4.727 8.556 1.00 0.00 H new ATOM 0 HB2 LYS B 8 35.446 -5.636 7.116 1.00 0.00 H new ATOM 0 HB3 LYS B 8 35.193 -5.687 8.849 1.00 0.00 H new ATOM 0 HG2 LYS B 8 33.042 -7.011 7.252 1.00 0.00 H new ATOM 0 HG3 LYS B 8 34.613 -7.778 7.124 1.00 0.00 H new ATOM 0 HD2 LYS B 8 34.586 -8.491 9.318 1.00 0.00 H new ATOM 0 HD3 LYS B 8 33.931 -6.975 9.904 1.00 0.00 H new ATOM 0 HE2 LYS B 8 31.686 -7.776 8.698 1.00 0.00 H new ATOM 0 HE3 LYS B 8 32.418 -9.366 8.774 1.00 0.00 H new ATOM 0 HZ1 LYS B 8 31.195 -8.865 10.829 1.00 0.00 H new ATOM 0 HZ2 LYS B 8 32.853 -9.021 11.158 1.00 0.00 H new ATOM 0 HZ3 LYS B 8 32.144 -7.480 11.084 1.00 0.00 H new ATOM 738 N LYS B 9 35.095 -2.900 6.947 1.00 0.00 N ATOM 739 CA LYS B 9 35.723 -1.555 7.013 1.00 0.00 C ATOM 740 C LYS B 9 34.621 -0.490 6.982 1.00 0.00 C ATOM 741 O LYS B 9 34.806 0.631 7.413 1.00 0.00 O ATOM 742 CB LYS B 9 36.598 -1.469 5.763 1.00 0.00 C ATOM 743 CG LYS B 9 37.667 -2.563 5.814 1.00 0.00 C ATOM 744 CD LYS B 9 39.010 -1.947 6.210 1.00 0.00 C ATOM 745 CE LYS B 9 39.422 -2.463 7.590 1.00 0.00 C ATOM 746 NZ LYS B 9 40.065 -3.781 7.327 1.00 0.00 N ATOM 0 H LYS B 9 35.353 -3.464 6.137 1.00 0.00 H new ATOM 0 HA LYS B 9 36.307 -1.397 7.919 1.00 0.00 H new ATOM 0 HB2 LYS B 9 35.986 -1.585 4.869 1.00 0.00 H new ATOM 0 HB3 LYS B 9 37.069 -0.488 5.702 1.00 0.00 H new ATOM 0 HG2 LYS B 9 37.382 -3.332 6.532 1.00 0.00 H new ATOM 0 HG3 LYS B 9 37.751 -3.050 4.842 1.00 0.00 H new ATOM 0 HD2 LYS B 9 39.771 -2.203 5.473 1.00 0.00 H new ATOM 0 HD3 LYS B 9 38.933 -0.860 6.225 1.00 0.00 H new ATOM 0 HE2 LYS B 9 40.113 -1.776 8.079 1.00 0.00 H new ATOM 0 HE3 LYS B 9 38.559 -2.568 8.247 1.00 0.00 H new ATOM 0 HZ1 LYS B 9 40.376 -4.201 8.226 1.00 0.00 H new ATOM 0 HZ2 LYS B 9 39.381 -4.415 6.867 1.00 0.00 H new ATOM 0 HZ3 LYS B 9 40.887 -3.648 6.704 1.00 0.00 H new ATOM 760 N PHE B 10 33.472 -0.847 6.470 1.00 0.00 N ATOM 761 CA PHE B 10 32.337 0.116 6.396 1.00 0.00 C ATOM 762 C PHE B 10 31.878 0.530 7.798 1.00 0.00 C ATOM 763 O PHE B 10 31.998 1.676 8.189 1.00 0.00 O ATOM 764 CB PHE B 10 31.225 -0.665 5.685 1.00 0.00 C ATOM 765 CG PHE B 10 30.316 0.273 4.933 1.00 0.00 C ATOM 766 CD1 PHE B 10 30.768 0.910 3.756 1.00 0.00 C ATOM 767 CD2 PHE B 10 29.000 0.494 5.396 1.00 0.00 C ATOM 768 CE1 PHE B 10 29.904 1.772 3.045 1.00 0.00 C ATOM 769 CE2 PHE B 10 28.134 1.350 4.682 1.00 0.00 C ATOM 770 CZ PHE B 10 28.587 1.990 3.508 1.00 0.00 C ATOM 0 H PHE B 10 33.271 -1.775 6.097 1.00 0.00 H new ATOM 0 HA PHE B 10 32.610 1.034 5.876 1.00 0.00 H new ATOM 0 HB2 PHE B 10 31.663 -1.386 4.995 1.00 0.00 H new ATOM 0 HB3 PHE B 10 30.648 -1.232 6.415 1.00 0.00 H new ATOM 0 HD1 PHE B 10 31.773 0.738 3.400 1.00 0.00 H new ATOM 0 HD2 PHE B 10 28.656 0.008 6.297 1.00 0.00 H new ATOM 0 HE1 PHE B 10 30.250 2.264 2.148 1.00 0.00 H new ATOM 0 HE2 PHE B 10 27.126 1.515 5.033 1.00 0.00 H new ATOM 0 HZ PHE B 10 27.926 2.647 2.963 1.00 0.00 H new ATOM 780 N LYS B 11 31.343 -0.389 8.557 1.00 0.00 N ATOM 781 CA LYS B 11 30.862 -0.027 9.923 1.00 0.00 C ATOM 782 C LYS B 11 32.033 0.368 10.821 1.00 0.00 C ATOM 783 O LYS B 11 31.898 1.178 11.718 1.00 0.00 O ATOM 784 CB LYS B 11 30.180 -1.287 10.448 1.00 0.00 C ATOM 785 CG LYS B 11 29.544 -0.992 11.807 1.00 0.00 C ATOM 786 CD LYS B 11 28.215 -0.265 11.596 1.00 0.00 C ATOM 787 CE LYS B 11 27.565 0.017 12.951 1.00 0.00 C ATOM 788 NZ LYS B 11 26.305 -0.778 12.942 1.00 0.00 N ATOM 0 H LYS B 11 31.219 -1.367 8.294 1.00 0.00 H new ATOM 0 HA LYS B 11 30.185 0.827 9.905 1.00 0.00 H new ATOM 0 HB2 LYS B 11 29.419 -1.622 9.743 1.00 0.00 H new ATOM 0 HB3 LYS B 11 30.906 -2.095 10.542 1.00 0.00 H new ATOM 0 HG2 LYS B 11 29.381 -1.920 12.354 1.00 0.00 H new ATOM 0 HG3 LYS B 11 30.215 -0.380 12.410 1.00 0.00 H new ATOM 0 HD2 LYS B 11 28.381 0.669 11.059 1.00 0.00 H new ATOM 0 HD3 LYS B 11 27.550 -0.872 10.981 1.00 0.00 H new ATOM 0 HE2 LYS B 11 28.216 -0.283 13.772 1.00 0.00 H new ATOM 0 HE3 LYS B 11 27.361 1.080 13.078 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 25.800 -0.638 13.840 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 25.703 -0.466 12.154 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 26.532 -1.786 12.826 1.00 0.00 H new ATOM 802 N GLU B 12 33.178 -0.194 10.584 1.00 0.00 N ATOM 803 CA GLU B 12 34.361 0.145 11.418 1.00 0.00 C ATOM 804 C GLU B 12 34.845 1.553 11.084 1.00 0.00 C ATOM 805 O GLU B 12 35.485 2.206 11.884 1.00 0.00 O ATOM 806 CB GLU B 12 35.418 -0.894 11.044 1.00 0.00 C ATOM 807 CG GLU B 12 35.297 -2.100 11.977 1.00 0.00 C ATOM 808 CD GLU B 12 36.306 -1.966 13.119 1.00 0.00 C ATOM 809 OE1 GLU B 12 37.407 -1.509 12.860 1.00 0.00 O ATOM 810 OE2 GLU B 12 35.960 -2.321 14.233 1.00 0.00 O ATOM 0 H GLU B 12 33.349 -0.877 9.846 1.00 0.00 H new ATOM 0 HA GLU B 12 34.139 0.129 12.485 1.00 0.00 H new ATOM 0 HB2 GLU B 12 35.286 -1.207 10.008 1.00 0.00 H new ATOM 0 HB3 GLU B 12 36.415 -0.459 11.121 1.00 0.00 H new ATOM 0 HG2 GLU B 12 34.285 -2.163 12.377 1.00 0.00 H new ATOM 0 HG3 GLU B 12 35.479 -3.021 11.423 1.00 0.00 H new ATOM 817 N LEU B 13 34.543 2.031 9.909 1.00 0.00 N ATOM 818 CA LEU B 13 34.988 3.400 9.538 1.00 0.00 C ATOM 819 C LEU B 13 34.060 4.437 10.174 1.00 0.00 C ATOM 820 O LEU B 13 34.497 5.475 10.631 1.00 0.00 O ATOM 821 CB LEU B 13 34.909 3.443 8.014 1.00 0.00 C ATOM 822 CG LEU B 13 36.277 3.086 7.430 1.00 0.00 C ATOM 823 CD1 LEU B 13 36.152 2.899 5.921 1.00 0.00 C ATOM 824 CD2 LEU B 13 37.268 4.216 7.717 1.00 0.00 C ATOM 0 H LEU B 13 34.010 1.535 9.194 1.00 0.00 H new ATOM 0 HA LEU B 13 35.995 3.626 9.888 1.00 0.00 H new ATOM 0 HB2 LEU B 13 34.154 2.743 7.657 1.00 0.00 H new ATOM 0 HB3 LEU B 13 34.606 4.436 7.681 1.00 0.00 H new ATOM 0 HG LEU B 13 36.634 2.163 7.886 1.00 0.00 H new ATOM 0 HD11 LEU B 13 37.126 2.645 5.504 1.00 0.00 H new ATOM 0 HD12 LEU B 13 35.446 2.095 5.711 1.00 0.00 H new ATOM 0 HD13 LEU B 13 35.794 3.824 5.468 1.00 0.00 H new ATOM 0 HD21 LEU B 13 38.242 3.960 7.300 1.00 0.00 H new ATOM 0 HD22 LEU B 13 36.909 5.139 7.261 1.00 0.00 H new ATOM 0 HD23 LEU B 13 37.359 4.355 8.794 1.00 0.00 H new ATOM 836 N TRP B 14 32.782 4.162 10.224 1.00 0.00 N ATOM 837 CA TRP B 14 31.841 5.138 10.852 1.00 0.00 C ATOM 838 C TRP B 14 32.163 5.283 12.335 1.00 0.00 C ATOM 839 O TRP B 14 32.247 6.374 12.863 1.00 0.00 O ATOM 840 CB TRP B 14 30.450 4.532 10.683 1.00 0.00 C ATOM 841 CG TRP B 14 29.694 5.312 9.664 1.00 0.00 C ATOM 842 CD1 TRP B 14 29.092 6.513 9.864 1.00 0.00 C ATOM 843 CD2 TRP B 14 29.451 4.963 8.285 1.00 0.00 C ATOM 844 NE1 TRP B 14 28.504 6.919 8.688 1.00 0.00 N ATOM 845 CE2 TRP B 14 28.696 6.001 7.686 1.00 0.00 C ATOM 846 CE3 TRP B 14 29.812 3.850 7.491 1.00 0.00 C ATOM 847 CZ2 TRP B 14 28.311 5.940 6.349 1.00 0.00 C ATOM 848 CZ3 TRP B 14 29.426 3.781 6.140 1.00 0.00 C ATOM 849 CH2 TRP B 14 28.678 4.825 5.567 1.00 0.00 C ATOM 0 H TRP B 14 32.352 3.312 9.861 1.00 0.00 H new ATOM 0 HA TRP B 14 31.913 6.125 10.395 1.00 0.00 H new ATOM 0 HB2 TRP B 14 30.530 3.490 10.374 1.00 0.00 H new ATOM 0 HB3 TRP B 14 29.918 4.543 11.634 1.00 0.00 H new ATOM 0 HD1 TRP B 14 29.077 7.060 10.795 1.00 0.00 H new ATOM 0 HE1 TRP B 14 27.990 7.793 8.575 1.00 0.00 H new ATOM 0 HE3 TRP B 14 30.389 3.047 7.925 1.00 0.00 H new ATOM 0 HZ2 TRP B 14 27.734 6.742 5.913 1.00 0.00 H new ATOM 0 HZ3 TRP B 14 29.704 2.926 5.542 1.00 0.00 H new ATOM 0 HH2 TRP B 14 28.385 4.773 4.529 1.00 0.00 H new ATOM 860 N LYS B 15 32.339 4.184 13.012 1.00 0.00 N ATOM 861 CA LYS B 15 32.650 4.246 14.463 1.00 0.00 C ATOM 862 C LYS B 15 34.140 3.974 14.687 1.00 0.00 C ATOM 863 O LYS B 15 34.549 2.865 14.966 1.00 0.00 O ATOM 864 CB LYS B 15 31.782 3.154 15.082 1.00 0.00 C ATOM 865 CG LYS B 15 32.128 2.996 16.564 1.00 0.00 C ATOM 866 CD LYS B 15 31.616 4.212 17.340 1.00 0.00 C ATOM 867 CE LYS B 15 31.164 3.774 18.734 1.00 0.00 C ATOM 868 NZ LYS B 15 31.294 4.995 19.579 1.00 0.00 N ATOM 0 H LYS B 15 32.280 3.244 12.621 1.00 0.00 H new ATOM 0 HA LYS B 15 32.447 5.221 14.906 1.00 0.00 H new ATOM 0 HB2 LYS B 15 30.728 3.407 14.970 1.00 0.00 H new ATOM 0 HB3 LYS B 15 31.940 2.211 14.559 1.00 0.00 H new ATOM 0 HG2 LYS B 15 31.679 2.084 16.958 1.00 0.00 H new ATOM 0 HG3 LYS B 15 33.207 2.900 16.688 1.00 0.00 H new ATOM 0 HD2 LYS B 15 32.402 4.963 17.420 1.00 0.00 H new ATOM 0 HD3 LYS B 15 30.786 4.675 16.806 1.00 0.00 H new ATOM 0 HE2 LYS B 15 30.137 3.410 18.720 1.00 0.00 H new ATOM 0 HE3 LYS B 15 31.784 2.962 19.114 1.00 0.00 H new ATOM 0 HZ1 LYS B 15 31.002 4.776 20.553 1.00 0.00 H new ATOM 0 HZ2 LYS B 15 32.284 5.314 19.578 1.00 0.00 H new ATOM 0 HZ3 LYS B 15 30.687 5.748 19.197 1.00 0.00 H new ATOM 882 N GLY B 16 34.951 4.987 14.551 1.00 0.00 N ATOM 883 CA GLY B 16 36.418 4.811 14.738 1.00 0.00 C ATOM 884 C GLY B 16 37.143 5.984 14.070 1.00 0.00 C ATOM 885 O GLY B 16 37.352 7.012 14.683 1.00 0.00 O ATOM 0 H GLY B 16 34.658 5.935 14.317 1.00 0.00 H new ATOM 0 HA2 GLY B 16 36.661 4.772 15.800 1.00 0.00 H new ATOM 0 HA3 GLY B 16 36.744 3.867 14.301 1.00 0.00 H new ATOM 889 N PRO B 17 37.494 5.793 12.824 1.00 0.00 N ATOM 890 CA PRO B 17 38.190 6.854 12.062 1.00 0.00 C ATOM 891 C PRO B 17 37.178 7.925 11.630 1.00 0.00 C ATOM 892 O PRO B 17 36.127 8.063 12.224 1.00 0.00 O ATOM 893 CB PRO B 17 38.762 6.109 10.857 1.00 0.00 C ATOM 894 CG PRO B 17 37.880 4.912 10.678 1.00 0.00 C ATOM 895 CD PRO B 17 37.279 4.583 12.022 1.00 0.00 C ATOM 0 HA PRO B 17 38.962 7.373 12.630 1.00 0.00 H new ATOM 0 HB2 PRO B 17 38.757 6.738 9.967 1.00 0.00 H new ATOM 0 HB3 PRO B 17 39.796 5.813 11.032 1.00 0.00 H new ATOM 0 HG2 PRO B 17 37.097 5.119 9.949 1.00 0.00 H new ATOM 0 HG3 PRO B 17 38.454 4.067 10.298 1.00 0.00 H new ATOM 0 HD2 PRO B 17 36.218 4.347 11.936 1.00 0.00 H new ATOM 0 HD3 PRO B 17 37.763 3.716 12.472 1.00 0.00 H new ATOM 903 N ARG B 18 37.480 8.684 10.608 1.00 0.00 N ATOM 904 CA ARG B 18 36.526 9.739 10.151 1.00 0.00 C ATOM 905 C ARG B 18 35.108 9.161 10.012 1.00 0.00 C ATOM 906 O ARG B 18 34.896 7.972 10.147 1.00 0.00 O ATOM 907 CB ARG B 18 37.080 10.220 8.792 1.00 0.00 C ATOM 908 CG ARG B 18 36.645 9.288 7.644 1.00 0.00 C ATOM 909 CD ARG B 18 37.300 7.915 7.809 1.00 0.00 C ATOM 910 NE ARG B 18 38.769 8.184 7.793 1.00 0.00 N ATOM 911 CZ ARG B 18 39.332 8.684 6.724 1.00 0.00 C ATOM 912 NH1 ARG B 18 39.107 8.147 5.556 1.00 0.00 N ATOM 913 NH2 ARG B 18 40.120 9.719 6.824 1.00 0.00 N ATOM 0 H ARG B 18 38.345 8.619 10.071 1.00 0.00 H new ATOM 0 HA ARG B 18 36.446 10.562 10.861 1.00 0.00 H new ATOM 0 HB2 ARG B 18 36.730 11.233 8.593 1.00 0.00 H new ATOM 0 HB3 ARG B 18 38.168 10.262 8.836 1.00 0.00 H new ATOM 0 HG2 ARG B 18 35.560 9.184 7.640 1.00 0.00 H new ATOM 0 HG3 ARG B 18 36.928 9.722 6.685 1.00 0.00 H new ATOM 0 HD2 ARG B 18 36.995 7.442 8.743 1.00 0.00 H new ATOM 0 HD3 ARG B 18 37.013 7.241 7.002 1.00 0.00 H new ATOM 0 HE ARG B 18 39.334 7.977 8.617 1.00 0.00 H new ATOM 0 HH11 ARG B 18 38.492 7.337 5.477 1.00 0.00 H new ATOM 0 HH12 ARG B 18 39.546 8.537 4.722 1.00 0.00 H new ATOM 0 HH21 ARG B 18 40.297 10.139 7.737 1.00 0.00 H new ATOM 0 HH22 ARG B 18 40.559 10.108 5.990 1.00 0.00 H new ATOM 927 N ARG B 19 34.144 9.991 9.733 1.00 0.00 N ATOM 928 CA ARG B 19 32.753 9.481 9.579 1.00 0.00 C ATOM 929 C ARG B 19 32.047 10.204 8.429 1.00 0.00 C ATOM 930 O ARG B 19 31.330 9.603 7.655 1.00 0.00 O ATOM 931 CB ARG B 19 32.066 9.787 10.909 1.00 0.00 C ATOM 932 CG ARG B 19 30.630 9.261 10.872 1.00 0.00 C ATOM 933 CD ARG B 19 29.806 9.947 11.962 1.00 0.00 C ATOM 934 NE ARG B 19 30.450 9.538 13.241 1.00 0.00 N ATOM 935 CZ ARG B 19 29.752 9.511 14.343 1.00 0.00 C ATOM 936 NH1 ARG B 19 28.855 8.581 14.524 1.00 0.00 N ATOM 937 NH2 ARG B 19 29.951 10.414 15.264 1.00 0.00 N ATOM 0 H ARG B 19 34.257 10.997 9.605 1.00 0.00 H new ATOM 0 HA ARG B 19 32.729 8.417 9.345 1.00 0.00 H new ATOM 0 HB2 ARG B 19 32.614 9.323 11.729 1.00 0.00 H new ATOM 0 HB3 ARG B 19 32.067 10.861 11.093 1.00 0.00 H new ATOM 0 HG2 ARG B 19 30.188 9.450 9.894 1.00 0.00 H new ATOM 0 HG3 ARG B 19 30.623 8.181 11.022 1.00 0.00 H new ATOM 0 HD2 ARG B 19 29.817 11.030 11.843 1.00 0.00 H new ATOM 0 HD3 ARG B 19 28.763 9.632 11.926 1.00 0.00 H new ATOM 0 HE ARG B 19 31.436 9.279 13.255 1.00 0.00 H new ATOM 0 HH11 ARG B 19 28.700 7.875 13.804 1.00 0.00 H new ATOM 0 HH12 ARG B 19 28.309 8.560 15.385 1.00 0.00 H new ATOM 0 HH21 ARG B 19 30.652 11.141 15.122 1.00 0.00 H new ATOM 0 HH22 ARG B 19 29.405 10.393 16.125 1.00 0.00 H new ATOM 951 N GLY B 20 32.243 11.488 8.311 1.00 0.00 N ATOM 952 CA GLY B 20 31.581 12.244 7.210 1.00 0.00 C ATOM 953 C GLY B 20 32.131 11.771 5.862 1.00 0.00 C ATOM 954 O GLY B 20 31.427 11.733 4.873 1.00 0.00 O ATOM 0 H GLY B 20 32.832 12.046 8.928 1.00 0.00 H new ATOM 0 HA2 GLY B 20 30.502 12.092 7.248 1.00 0.00 H new ATOM 0 HA3 GLY B 20 31.757 13.313 7.332 1.00 0.00 H new ATOM 958 N GLU B 21 33.384 11.408 5.815 1.00 0.00 N ATOM 959 CA GLU B 21 33.977 10.937 4.530 1.00 0.00 C ATOM 960 C GLU B 21 33.467 9.533 4.195 1.00 0.00 C ATOM 961 O GLU B 21 33.374 9.153 3.045 1.00 0.00 O ATOM 962 CB GLU B 21 35.485 10.918 4.775 1.00 0.00 C ATOM 963 CG GLU B 21 36.123 12.142 4.116 1.00 0.00 C ATOM 964 CD GLU B 21 37.591 12.243 4.535 1.00 0.00 C ATOM 965 OE1 GLU B 21 37.883 11.929 5.677 1.00 0.00 O ATOM 966 OE2 GLU B 21 38.398 12.633 3.707 1.00 0.00 O ATOM 0 H GLU B 21 34.023 11.417 6.610 1.00 0.00 H new ATOM 0 HA GLU B 21 33.709 11.579 3.691 1.00 0.00 H new ATOM 0 HB2 GLU B 21 35.691 10.919 5.845 1.00 0.00 H new ATOM 0 HB3 GLU B 21 35.919 10.005 4.368 1.00 0.00 H new ATOM 0 HG2 GLU B 21 36.048 12.064 3.031 1.00 0.00 H new ATOM 0 HG3 GLU B 21 35.588 13.045 4.408 1.00 0.00 H new ATOM 973 N ILE B 22 33.128 8.760 5.191 1.00 0.00 N ATOM 974 CA ILE B 22 32.617 7.383 4.929 1.00 0.00 C ATOM 975 C ILE B 22 31.201 7.467 4.363 1.00 0.00 C ATOM 976 O ILE B 22 30.901 6.929 3.317 1.00 0.00 O ATOM 977 CB ILE B 22 32.621 6.688 6.294 1.00 0.00 C ATOM 978 CG1 ILE B 22 34.011 6.801 6.929 1.00 0.00 C ATOM 979 CG2 ILE B 22 32.259 5.211 6.121 1.00 0.00 C ATOM 980 CD1 ILE B 22 35.070 6.256 5.964 1.00 0.00 C ATOM 0 H ILE B 22 33.183 9.022 6.175 1.00 0.00 H new ATOM 0 HA ILE B 22 33.222 6.838 4.205 1.00 0.00 H new ATOM 0 HB ILE B 22 31.888 7.168 6.942 1.00 0.00 H new ATOM 0 HG12 ILE B 22 34.227 7.842 7.170 1.00 0.00 H new ATOM 0 HG13 ILE B 22 34.039 6.245 7.866 1.00 0.00 H new ATOM 0 HG21 ILE B 22 32.263 4.719 7.094 1.00 0.00 H new ATOM 0 HG22 ILE B 22 31.267 5.129 5.677 1.00 0.00 H new ATOM 0 HG23 ILE B 22 32.989 4.731 5.469 1.00 0.00 H new ATOM 0 HD11 ILE B 22 36.056 6.339 6.421 1.00 0.00 H new ATOM 0 HD12 ILE B 22 34.859 5.209 5.745 1.00 0.00 H new ATOM 0 HD13 ILE B 22 35.050 6.832 5.039 1.00 0.00 H new ATOM 992 N GLU B 23 30.331 8.157 5.039 1.00 0.00 N ATOM 993 CA GLU B 23 28.948 8.299 4.529 1.00 0.00 C ATOM 994 C GLU B 23 28.993 9.035 3.192 1.00 0.00 C ATOM 995 O GLU B 23 28.148 8.850 2.337 1.00 0.00 O ATOM 996 CB GLU B 23 28.224 9.093 5.620 1.00 0.00 C ATOM 997 CG GLU B 23 26.752 9.253 5.262 1.00 0.00 C ATOM 998 CD GLU B 23 26.421 10.738 5.105 1.00 0.00 C ATOM 999 OE1 GLU B 23 26.655 11.267 4.031 1.00 0.00 O ATOM 1000 OE2 GLU B 23 25.938 11.321 6.062 1.00 0.00 O ATOM 0 H GLU B 23 30.520 8.629 5.923 1.00 0.00 H new ATOM 0 HA GLU B 23 28.436 7.355 4.340 1.00 0.00 H new ATOM 0 HB2 GLU B 23 28.320 8.581 6.577 1.00 0.00 H new ATOM 0 HB3 GLU B 23 28.687 10.073 5.735 1.00 0.00 H new ATOM 0 HG2 GLU B 23 26.533 8.721 4.336 1.00 0.00 H new ATOM 0 HG3 GLU B 23 26.128 8.811 6.039 1.00 0.00 H new ATOM 1007 N GLU B 24 30.008 9.829 2.981 1.00 0.00 N ATOM 1008 CA GLU B 24 30.135 10.523 1.675 1.00 0.00 C ATOM 1009 C GLU B 24 30.472 9.469 0.622 1.00 0.00 C ATOM 1010 O GLU B 24 30.028 9.529 -0.508 1.00 0.00 O ATOM 1011 CB GLU B 24 31.288 11.512 1.848 1.00 0.00 C ATOM 1012 CG GLU B 24 31.548 12.225 0.521 1.00 0.00 C ATOM 1013 CD GLU B 24 31.164 13.700 0.650 1.00 0.00 C ATOM 1014 OE1 GLU B 24 31.693 14.355 1.533 1.00 0.00 O ATOM 1015 OE2 GLU B 24 30.346 14.150 -0.135 1.00 0.00 O ATOM 0 H GLU B 24 30.749 10.024 3.654 1.00 0.00 H new ATOM 0 HA GLU B 24 29.229 11.043 1.366 1.00 0.00 H new ATOM 0 HB2 GLU B 24 31.045 12.239 2.623 1.00 0.00 H new ATOM 0 HB3 GLU B 24 32.186 10.987 2.174 1.00 0.00 H new ATOM 0 HG2 GLU B 24 32.599 12.135 0.247 1.00 0.00 H new ATOM 0 HG3 GLU B 24 30.970 11.756 -0.275 1.00 0.00 H new ATOM 1022 N LEU B 25 31.239 8.484 1.012 1.00 0.00 N ATOM 1023 CA LEU B 25 31.600 7.390 0.068 1.00 0.00 C ATOM 1024 C LEU B 25 30.333 6.637 -0.325 1.00 0.00 C ATOM 1025 O LEU B 25 30.212 6.136 -1.422 1.00 0.00 O ATOM 1026 CB LEU B 25 32.538 6.466 0.850 1.00 0.00 C ATOM 1027 CG LEU B 25 33.017 5.334 -0.062 1.00 0.00 C ATOM 1028 CD1 LEU B 25 34.122 5.846 -0.988 1.00 0.00 C ATOM 1029 CD2 LEU B 25 33.557 4.184 0.792 1.00 0.00 C ATOM 0 H LEU B 25 31.632 8.392 1.949 1.00 0.00 H new ATOM 0 HA LEU B 25 32.072 7.762 -0.841 1.00 0.00 H new ATOM 0 HB2 LEU B 25 33.391 7.030 1.226 1.00 0.00 H new ATOM 0 HB3 LEU B 25 32.021 6.055 1.717 1.00 0.00 H new ATOM 0 HG LEU B 25 32.180 4.979 -0.664 1.00 0.00 H new ATOM 0 HD11 LEU B 25 34.459 5.036 -1.635 1.00 0.00 H new ATOM 0 HD12 LEU B 25 33.736 6.662 -1.599 1.00 0.00 H new ATOM 0 HD13 LEU B 25 34.960 6.206 -0.391 1.00 0.00 H new ATOM 0 HD21 LEU B 25 33.898 3.378 0.143 1.00 0.00 H new ATOM 0 HD22 LEU B 25 34.391 4.540 1.397 1.00 0.00 H new ATOM 0 HD23 LEU B 25 32.767 3.814 1.445 1.00 0.00 H new ATOM 1041 N HIS B 26 29.382 6.562 0.569 1.00 0.00 N ATOM 1042 CA HIS B 26 28.113 5.852 0.247 1.00 0.00 C ATOM 1043 C HIS B 26 27.293 6.697 -0.731 1.00 0.00 C ATOM 1044 O HIS B 26 26.592 6.179 -1.577 1.00 0.00 O ATOM 1045 CB HIS B 26 27.385 5.697 1.581 1.00 0.00 C ATOM 1046 CG HIS B 26 26.029 5.091 1.338 1.00 0.00 C ATOM 1047 ND1 HIS B 26 25.854 3.747 1.047 1.00 0.00 N ATOM 1048 CD2 HIS B 26 24.775 5.641 1.332 1.00 0.00 C ATOM 1049 CE1 HIS B 26 24.534 3.538 0.879 1.00 0.00 C ATOM 1050 NE2 HIS B 26 23.832 4.662 1.041 1.00 0.00 N ATOM 0 H HIS B 26 29.431 6.962 1.506 1.00 0.00 H new ATOM 0 HA HIS B 26 28.280 4.883 -0.224 1.00 0.00 H new ATOM 0 HB2 HIS B 26 27.964 5.064 2.253 1.00 0.00 H new ATOM 0 HB3 HIS B 26 27.281 6.667 2.067 1.00 0.00 H new ATOM 0 HD1 HIS B 26 26.590 3.045 0.974 1.00 0.00 H new ATOM 0 HD2 HIS B 26 24.552 6.680 1.525 1.00 0.00 H new ATOM 0 HE1 HIS B 26 24.097 2.579 0.642 1.00 0.00 H new ATOM 1058 N LYS B 27 27.385 7.996 -0.635 1.00 0.00 N ATOM 1059 CA LYS B 27 26.620 8.856 -1.581 1.00 0.00 C ATOM 1060 C LYS B 27 27.108 8.581 -3.003 1.00 0.00 C ATOM 1061 O LYS B 27 26.336 8.267 -3.889 1.00 0.00 O ATOM 1062 CB LYS B 27 26.934 10.293 -1.166 1.00 0.00 C ATOM 1063 CG LYS B 27 25.654 10.973 -0.677 1.00 0.00 C ATOM 1064 CD LYS B 27 25.570 10.864 0.846 1.00 0.00 C ATOM 1065 CE LYS B 27 24.698 9.665 1.223 1.00 0.00 C ATOM 1066 NZ LYS B 27 23.349 10.241 1.486 1.00 0.00 N ATOM 0 H LYS B 27 27.951 8.495 0.051 1.00 0.00 H new ATOM 0 HA LYS B 27 25.547 8.667 -1.556 1.00 0.00 H new ATOM 0 HB2 LYS B 27 27.686 10.299 -0.377 1.00 0.00 H new ATOM 0 HB3 LYS B 27 27.352 10.843 -2.009 1.00 0.00 H new ATOM 0 HG2 LYS B 27 25.648 12.020 -0.978 1.00 0.00 H new ATOM 0 HG3 LYS B 27 24.783 10.504 -1.135 1.00 0.00 H new ATOM 0 HD2 LYS B 27 26.568 10.749 1.269 1.00 0.00 H new ATOM 0 HD3 LYS B 27 25.150 11.779 1.264 1.00 0.00 H new ATOM 0 HE2 LYS B 27 24.664 8.932 0.417 1.00 0.00 H new ATOM 0 HE3 LYS B 27 25.088 9.154 2.103 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 22.692 9.480 1.751 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 23.411 10.931 2.262 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 23.001 10.715 0.628 1.00 0.00 H new ATOM 1080 N LYS B 28 28.392 8.674 -3.224 1.00 0.00 N ATOM 1081 CA LYS B 28 28.926 8.392 -4.584 1.00 0.00 C ATOM 1082 C LYS B 28 28.577 6.952 -4.961 1.00 0.00 C ATOM 1083 O LYS B 28 28.220 6.662 -6.083 1.00 0.00 O ATOM 1084 CB LYS B 28 30.440 8.571 -4.465 1.00 0.00 C ATOM 1085 CG LYS B 28 30.829 9.966 -4.958 1.00 0.00 C ATOM 1086 CD LYS B 28 31.147 10.860 -3.758 1.00 0.00 C ATOM 1087 CE LYS B 28 31.506 12.264 -4.248 1.00 0.00 C ATOM 1088 NZ LYS B 28 30.198 12.899 -4.575 1.00 0.00 N ATOM 0 H LYS B 28 29.089 8.932 -2.525 1.00 0.00 H new ATOM 0 HA LYS B 28 28.511 9.046 -5.351 1.00 0.00 H new ATOM 0 HB2 LYS B 28 30.752 8.440 -3.429 1.00 0.00 H new ATOM 0 HB3 LYS B 28 30.954 7.810 -5.052 1.00 0.00 H new ATOM 0 HG2 LYS B 28 31.695 9.902 -5.617 1.00 0.00 H new ATOM 0 HG3 LYS B 28 30.015 10.397 -5.541 1.00 0.00 H new ATOM 0 HD2 LYS B 28 30.289 10.906 -3.088 1.00 0.00 H new ATOM 0 HD3 LYS B 28 31.975 10.440 -3.187 1.00 0.00 H new ATOM 0 HE2 LYS B 28 32.038 12.827 -3.481 1.00 0.00 H new ATOM 0 HE3 LYS B 28 32.156 12.224 -5.122 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 30.220 13.256 -5.552 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 29.438 12.196 -4.480 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 30.022 13.689 -3.921 1.00 0.00 H new ATOM 1102 N PHE B 29 28.657 6.056 -4.012 1.00 0.00 N ATOM 1103 CA PHE B 29 28.311 4.631 -4.281 1.00 0.00 C ATOM 1104 C PHE B 29 26.907 4.561 -4.875 1.00 0.00 C ATOM 1105 O PHE B 29 26.623 3.755 -5.739 1.00 0.00 O ATOM 1106 CB PHE B 29 28.364 3.952 -2.906 1.00 0.00 C ATOM 1107 CG PHE B 29 29.793 3.581 -2.533 1.00 0.00 C ATOM 1108 CD1 PHE B 29 30.897 4.019 -3.314 1.00 0.00 C ATOM 1109 CD2 PHE B 29 30.021 2.784 -1.389 1.00 0.00 C ATOM 1110 CE1 PHE B 29 32.211 3.658 -2.947 1.00 0.00 C ATOM 1111 CE2 PHE B 29 31.337 2.425 -1.025 1.00 0.00 C ATOM 1112 CZ PHE B 29 32.431 2.862 -1.804 1.00 0.00 C ATOM 0 H PHE B 29 28.950 6.253 -3.055 1.00 0.00 H new ATOM 0 HA PHE B 29 28.985 4.149 -4.990 1.00 0.00 H new ATOM 0 HB2 PHE B 29 27.949 4.620 -2.151 1.00 0.00 H new ATOM 0 HB3 PHE B 29 27.743 3.056 -2.915 1.00 0.00 H new ATOM 0 HD1 PHE B 29 30.730 4.629 -4.189 1.00 0.00 H new ATOM 0 HD2 PHE B 29 29.186 2.448 -0.791 1.00 0.00 H new ATOM 0 HE1 PHE B 29 33.048 3.992 -3.542 1.00 0.00 H new ATOM 0 HE2 PHE B 29 31.507 1.815 -0.150 1.00 0.00 H new ATOM 0 HZ PHE B 29 33.437 2.586 -1.524 1.00 0.00 H new ATOM 1122 N HIS B 30 26.031 5.421 -4.432 1.00 0.00 N ATOM 1123 CA HIS B 30 24.651 5.429 -4.986 1.00 0.00 C ATOM 1124 C HIS B 30 24.705 5.926 -6.428 1.00 0.00 C ATOM 1125 O HIS B 30 24.013 5.430 -7.293 1.00 0.00 O ATOM 1126 CB HIS B 30 23.874 6.397 -4.093 1.00 0.00 C ATOM 1127 CG HIS B 30 22.451 6.493 -4.570 1.00 0.00 C ATOM 1128 ND1 HIS B 30 21.402 5.893 -3.890 1.00 0.00 N ATOM 1129 CD2 HIS B 30 21.886 7.115 -5.656 1.00 0.00 C ATOM 1130 CE1 HIS B 30 20.272 6.164 -4.568 1.00 0.00 C ATOM 1131 NE2 HIS B 30 20.510 6.906 -5.652 1.00 0.00 N ATOM 0 H HIS B 30 26.213 6.118 -3.710 1.00 0.00 H new ATOM 0 HA HIS B 30 24.181 4.445 -4.998 1.00 0.00 H new ATOM 0 HB2 HIS B 30 23.899 6.053 -3.059 1.00 0.00 H new ATOM 0 HB3 HIS B 30 24.342 7.381 -4.113 1.00 0.00 H new ATOM 0 HD2 HIS B 30 22.427 7.680 -6.400 1.00 0.00 H new ATOM 0 HE1 HIS B 30 19.291 5.823 -4.271 1.00 0.00 H new ATOM 0 HE2 HIS B 30 19.830 7.247 -6.331 1.00 0.00 H new ATOM 1139 N GLU B 31 25.549 6.882 -6.698 1.00 0.00 N ATOM 1140 CA GLU B 31 25.680 7.381 -8.095 1.00 0.00 C ATOM 1141 C GLU B 31 26.724 6.530 -8.837 1.00 0.00 C ATOM 1142 O GLU B 31 27.050 6.782 -9.980 1.00 0.00 O ATOM 1143 CB GLU B 31 26.155 8.828 -7.961 1.00 0.00 C ATOM 1144 CG GLU B 31 24.967 9.724 -7.606 1.00 0.00 C ATOM 1145 CD GLU B 31 25.433 10.844 -6.674 1.00 0.00 C ATOM 1146 OE1 GLU B 31 26.523 11.350 -6.886 1.00 0.00 O ATOM 1147 OE2 GLU B 31 24.693 11.176 -5.763 1.00 0.00 O ATOM 0 H GLU B 31 26.152 7.338 -6.014 1.00 0.00 H new ATOM 0 HA GLU B 31 24.748 7.321 -8.657 1.00 0.00 H new ATOM 0 HB2 GLU B 31 26.922 8.900 -7.190 1.00 0.00 H new ATOM 0 HB3 GLU B 31 26.609 9.161 -8.894 1.00 0.00 H new ATOM 0 HG2 GLU B 31 24.534 10.147 -8.512 1.00 0.00 H new ATOM 0 HG3 GLU B 31 24.186 9.136 -7.124 1.00 0.00 H new ATOM 1154 N LEU B 32 27.243 5.518 -8.184 1.00 0.00 N ATOM 1155 CA LEU B 32 28.258 4.632 -8.818 1.00 0.00 C ATOM 1156 C LEU B 32 27.561 3.434 -9.455 1.00 0.00 C ATOM 1157 O LEU B 32 27.949 2.949 -10.499 1.00 0.00 O ATOM 1158 CB LEU B 32 29.122 4.160 -7.642 1.00 0.00 C ATOM 1159 CG LEU B 32 30.513 3.725 -8.114 1.00 0.00 C ATOM 1160 CD1 LEU B 32 31.411 3.527 -6.889 1.00 0.00 C ATOM 1161 CD2 LEU B 32 30.425 2.401 -8.877 1.00 0.00 C ATOM 0 H LEU B 32 27.000 5.269 -7.225 1.00 0.00 H new ATOM 0 HA LEU B 32 28.835 5.132 -9.596 1.00 0.00 H new ATOM 0 HB2 LEU B 32 29.218 4.964 -6.912 1.00 0.00 H new ATOM 0 HB3 LEU B 32 28.630 3.329 -7.137 1.00 0.00 H new ATOM 0 HG LEU B 32 30.922 4.492 -8.772 1.00 0.00 H new ATOM 0 HD11 LEU B 32 32.405 3.217 -7.213 1.00 0.00 H new ATOM 0 HD12 LEU B 32 31.485 4.464 -6.337 1.00 0.00 H new ATOM 0 HD13 LEU B 32 30.983 2.759 -6.245 1.00 0.00 H new ATOM 0 HD21 LEU B 32 31.421 2.104 -9.206 1.00 0.00 H new ATOM 0 HD22 LEU B 32 30.014 1.631 -8.224 1.00 0.00 H new ATOM 0 HD23 LEU B 32 29.777 2.524 -9.745 1.00 0.00 H new ATOM 1173 N ILE B 33 26.545 2.935 -8.810 1.00 0.00 N ATOM 1174 CA ILE B 33 25.837 1.739 -9.347 1.00 0.00 C ATOM 1175 C ILE B 33 24.369 2.072 -9.643 1.00 0.00 C ATOM 1176 O ILE B 33 23.710 1.397 -10.408 1.00 0.00 O ATOM 1177 CB ILE B 33 25.963 0.696 -8.230 1.00 0.00 C ATOM 1178 CG1 ILE B 33 25.141 1.156 -7.015 1.00 0.00 C ATOM 1179 CG2 ILE B 33 27.442 0.554 -7.840 1.00 0.00 C ATOM 1180 CD1 ILE B 33 25.252 0.139 -5.883 1.00 0.00 C ATOM 0 H ILE B 33 26.174 3.303 -7.934 1.00 0.00 H new ATOM 0 HA ILE B 33 26.257 1.382 -10.288 1.00 0.00 H new ATOM 0 HB ILE B 33 25.587 -0.268 -8.573 1.00 0.00 H new ATOM 0 HG12 ILE B 33 25.496 2.129 -6.675 1.00 0.00 H new ATOM 0 HG13 ILE B 33 24.096 1.280 -7.300 1.00 0.00 H new ATOM 0 HG21 ILE B 33 27.539 -0.186 -7.046 1.00 0.00 H new ATOM 0 HG22 ILE B 33 28.018 0.233 -8.708 1.00 0.00 H new ATOM 0 HG23 ILE B 33 27.820 1.514 -7.489 1.00 0.00 H new ATOM 0 HD11 ILE B 33 24.665 0.479 -5.030 1.00 0.00 H new ATOM 0 HD12 ILE B 33 24.875 -0.826 -6.222 1.00 0.00 H new ATOM 0 HD13 ILE B 33 26.296 0.036 -5.587 1.00 0.00 H new ATOM 1192 N LYS B 34 23.857 3.110 -9.040 1.00 0.00 N ATOM 1193 CA LYS B 34 22.436 3.494 -9.282 1.00 0.00 C ATOM 1194 C LYS B 34 21.513 2.293 -9.053 1.00 0.00 C ATOM 1195 O LYS B 34 21.958 1.209 -8.733 1.00 0.00 O ATOM 1196 CB LYS B 34 22.391 3.940 -10.743 1.00 0.00 C ATOM 1197 CG LYS B 34 22.684 5.440 -10.825 1.00 0.00 C ATOM 1198 CD LYS B 34 21.391 6.225 -10.596 1.00 0.00 C ATOM 1199 CE LYS B 34 20.811 6.656 -11.945 1.00 0.00 C ATOM 1200 NZ LYS B 34 19.661 7.539 -11.602 1.00 0.00 N ATOM 0 H LYS B 34 24.362 3.710 -8.388 1.00 0.00 H new ATOM 0 HA LYS B 34 22.100 4.280 -8.606 1.00 0.00 H new ATOM 0 HB2 LYS B 34 23.123 3.383 -11.328 1.00 0.00 H new ATOM 0 HB3 LYS B 34 21.411 3.726 -11.170 1.00 0.00 H new ATOM 0 HG2 LYS B 34 23.428 5.718 -10.078 1.00 0.00 H new ATOM 0 HG3 LYS B 34 23.104 5.687 -11.800 1.00 0.00 H new ATOM 0 HD2 LYS B 34 20.670 5.610 -10.058 1.00 0.00 H new ATOM 0 HD3 LYS B 34 21.589 7.100 -9.977 1.00 0.00 H new ATOM 0 HE2 LYS B 34 21.552 7.187 -12.543 1.00 0.00 H new ATOM 0 HE3 LYS B 34 20.488 5.795 -12.530 1.00 0.00 H new ATOM 0 HZ1 LYS B 34 19.209 7.876 -12.476 1.00 0.00 H new ATOM 0 HZ2 LYS B 34 18.969 7.005 -11.039 1.00 0.00 H new ATOM 0 HZ3 LYS B 34 20.001 8.353 -11.051 1.00 0.00 H new ATOM 1214 N GLY B 35 20.231 2.480 -9.212 1.00 0.00 N ATOM 1215 CA GLY B 35 19.283 1.350 -9.001 1.00 0.00 C ATOM 1216 C GLY B 35 17.925 1.701 -9.613 1.00 0.00 C ATOM 1217 O GLY B 35 17.871 1.893 -10.816 1.00 0.00 O ATOM 1218 OXT GLY B 35 16.961 1.770 -8.868 1.00 0.00 O ATOM 0 H GLY B 35 19.800 3.365 -9.479 1.00 0.00 H new ATOM 0 HA2 GLY B 35 19.676 0.442 -9.458 1.00 0.00 H new ATOM 0 HA3 GLY B 35 19.172 1.148 -7.936 1.00 0.00 H new TER 1222 GLY B 35