USER MOD reduce.3.24.130724 H: found=0, std=0, add=529, rem=0, adj=8 USER MOD reduce.3.24.130724 removed 531 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 144 MET CE :methyl 153:sc= -0.215 (180deg=-1.15) USER MOD Single : A 146 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 147 GLN : amide:sc= 0 K(o=0,f=-2!) USER MOD Single : A 149 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 158 LYS NZ :NH3+ -165:sc= 0 (180deg=-0.218) USER MOD Single : A 163 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0295) USER MOD Single : A 164 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 167 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 168 SER OG : rot 62:sc= 0.89 USER MOD Single : A 169 GLN : amide:sc= -0.751 K(o=-0.75,f=-1.5!) USER MOD Single : B 216 THR OG1 : rot -58:sc= 0.553 USER MOD Single : B 222 LYS NZ :NH3+ -161:sc= -0.0575 (180deg=-0.531) USER MOD Single : B 223 GLN : amide:sc= -7.06! C(o=-7.1!,f=-11!) USER MOD Single : B 228 GLN : amide:sc=-0.00473 K(o=-0.0047,f=-1.2) USER MOD Single : B 229 GLN : amide:sc= -0.203 X(o=-0.2,f=-0.34) USER MOD Single : B 232 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 233 LYS NZ :NH3+ -165:sc=-0.00834 (180deg=-0.196) USER MOD Single : B 239 MET CE :methyl -151:sc= -0.23 (180deg=-1.51!) USER MOD ----------------------------------------------------------------- ATOM 35 N GLU A 139 22.953 -3.962 -15.022 1.00 0.00 N ATOM 36 CA GLU A 139 22.678 -3.439 -13.688 1.00 0.00 C ATOM 37 C GLU A 139 23.829 -3.759 -12.740 1.00 0.00 C ATOM 38 O GLU A 139 24.103 -3.008 -11.803 1.00 0.00 O ATOM 39 CB GLU A 139 21.383 -4.044 -13.145 1.00 0.00 C ATOM 40 CG GLU A 139 21.060 -3.424 -11.784 1.00 0.00 C ATOM 41 CD GLU A 139 19.730 -3.962 -11.268 1.00 0.00 C ATOM 42 OE1 GLU A 139 19.238 -4.920 -11.843 1.00 0.00 O ATOM 43 OE2 GLU A 139 19.223 -3.409 -10.306 1.00 0.00 O ATOM 0 HA GLU A 139 22.570 -2.357 -13.758 1.00 0.00 H new ATOM 0 HB2 GLU A 139 20.565 -3.863 -13.842 1.00 0.00 H new ATOM 0 HB3 GLU A 139 21.487 -5.125 -13.049 1.00 0.00 H new ATOM 0 HG2 GLU A 139 21.854 -3.652 -11.073 1.00 0.00 H new ATOM 0 HG3 GLU A 139 21.013 -2.339 -11.872 1.00 0.00 H new ATOM 50 N GLU A 140 24.502 -4.877 -12.991 1.00 0.00 N ATOM 51 CA GLU A 140 25.621 -5.289 -12.152 1.00 0.00 C ATOM 52 C GLU A 140 26.724 -4.236 -12.175 1.00 0.00 C ATOM 53 O GLU A 140 27.307 -3.910 -11.142 1.00 0.00 O ATOM 54 CB GLU A 140 26.179 -6.626 -12.643 1.00 0.00 C ATOM 55 CG GLU A 140 25.122 -7.716 -12.468 1.00 0.00 C ATOM 56 CD GLU A 140 24.804 -7.903 -10.988 1.00 0.00 C ATOM 57 OE1 GLU A 140 25.612 -7.487 -10.173 1.00 0.00 O ATOM 58 OE2 GLU A 140 23.760 -8.458 -10.691 1.00 0.00 O ATOM 0 H GLU A 140 24.294 -5.510 -13.763 1.00 0.00 H new ATOM 0 HA GLU A 140 25.261 -5.400 -11.129 1.00 0.00 H new ATOM 0 HB2 GLU A 140 26.467 -6.549 -13.692 1.00 0.00 H new ATOM 0 HB3 GLU A 140 27.078 -6.884 -12.084 1.00 0.00 H new ATOM 0 HG2 GLU A 140 24.216 -7.446 -13.012 1.00 0.00 H new ATOM 0 HG3 GLU A 140 25.481 -8.654 -12.892 1.00 0.00 H new ATOM 65 N ARG A 141 27.003 -3.706 -13.362 1.00 0.00 N ATOM 66 CA ARG A 141 28.036 -2.687 -13.509 1.00 0.00 C ATOM 67 C ARG A 141 27.641 -1.413 -12.772 1.00 0.00 C ATOM 68 O ARG A 141 28.477 -0.758 -12.150 1.00 0.00 O ATOM 69 CB ARG A 141 28.255 -2.375 -14.991 1.00 0.00 C ATOM 70 CG ARG A 141 28.932 -3.567 -15.670 1.00 0.00 C ATOM 71 CD ARG A 141 29.351 -3.177 -17.089 1.00 0.00 C ATOM 72 NE ARG A 141 28.179 -2.827 -17.882 1.00 0.00 N ATOM 73 CZ ARG A 141 27.490 -3.756 -18.537 1.00 0.00 C ATOM 74 NH1 ARG A 141 27.858 -5.007 -18.475 1.00 0.00 N ATOM 75 NH2 ARG A 141 26.445 -3.418 -19.242 1.00 0.00 N ATOM 0 H ARG A 141 26.532 -3.963 -14.230 1.00 0.00 H new ATOM 0 HA ARG A 141 28.961 -3.070 -13.078 1.00 0.00 H new ATOM 0 HB2 ARG A 141 27.301 -2.162 -15.473 1.00 0.00 H new ATOM 0 HB3 ARG A 141 28.872 -1.483 -15.098 1.00 0.00 H new ATOM 0 HG2 ARG A 141 29.804 -3.879 -15.095 1.00 0.00 H new ATOM 0 HG3 ARG A 141 28.250 -4.417 -15.702 1.00 0.00 H new ATOM 0 HD2 ARG A 141 30.040 -2.333 -17.054 1.00 0.00 H new ATOM 0 HD3 ARG A 141 29.883 -4.004 -17.559 1.00 0.00 H new ATOM 0 HE ARG A 141 27.883 -1.852 -17.935 1.00 0.00 H new ATOM 0 HH11 ARG A 141 28.674 -5.272 -17.924 1.00 0.00 H new ATOM 0 HH12 ARG A 141 27.329 -5.720 -18.978 1.00 0.00 H new ATOM 0 HH21 ARG A 141 26.157 -2.441 -19.290 1.00 0.00 H new ATOM 0 HH22 ARG A 141 25.916 -4.131 -19.745 1.00 0.00 H new ATOM 89 N GLU A 142 26.360 -1.065 -12.846 1.00 0.00 N ATOM 90 CA GLU A 142 25.864 0.133 -12.179 1.00 0.00 C ATOM 91 C GLU A 142 26.104 0.050 -10.676 1.00 0.00 C ATOM 92 O GLU A 142 26.468 1.039 -10.040 1.00 0.00 O ATOM 93 CB GLU A 142 24.367 0.298 -12.450 1.00 0.00 C ATOM 94 CG GLU A 142 24.140 0.527 -13.945 1.00 0.00 C ATOM 95 CD GLU A 142 24.809 1.826 -14.382 1.00 0.00 C ATOM 96 OE1 GLU A 142 25.070 2.651 -13.523 1.00 0.00 O ATOM 97 OE2 GLU A 142 25.050 1.975 -15.569 1.00 0.00 O ATOM 0 H GLU A 142 25.651 -1.591 -13.357 1.00 0.00 H new ATOM 0 HA GLU A 142 26.403 0.995 -12.573 1.00 0.00 H new ATOM 0 HB2 GLU A 142 23.827 -0.590 -12.122 1.00 0.00 H new ATOM 0 HB3 GLU A 142 23.974 1.139 -11.879 1.00 0.00 H new ATOM 0 HG2 GLU A 142 24.545 -0.309 -14.515 1.00 0.00 H new ATOM 0 HG3 GLU A 142 23.072 0.570 -14.157 1.00 0.00 H new ATOM 104 N ARG A 143 25.899 -1.137 -10.114 1.00 0.00 N ATOM 105 CA ARG A 143 26.101 -1.339 -8.684 1.00 0.00 C ATOM 106 C ARG A 143 27.540 -1.016 -8.294 1.00 0.00 C ATOM 107 O ARG A 143 27.784 -0.300 -7.323 1.00 0.00 O ATOM 108 CB ARG A 143 25.781 -2.788 -8.310 1.00 0.00 C ATOM 109 CG ARG A 143 24.265 -2.995 -8.323 1.00 0.00 C ATOM 110 CD ARG A 143 23.945 -4.451 -7.980 1.00 0.00 C ATOM 111 NE ARG A 143 22.502 -4.645 -7.899 1.00 0.00 N ATOM 112 CZ ARG A 143 21.978 -5.859 -7.770 1.00 0.00 C ATOM 113 NH1 ARG A 143 22.758 -6.903 -7.711 1.00 0.00 N ATOM 114 NH2 ARG A 143 20.684 -6.008 -7.701 1.00 0.00 N ATOM 0 H ARG A 143 25.595 -1.968 -10.622 1.00 0.00 H new ATOM 0 HA ARG A 143 25.432 -0.669 -8.144 1.00 0.00 H new ATOM 0 HB2 ARG A 143 26.258 -3.470 -9.014 1.00 0.00 H new ATOM 0 HB3 ARG A 143 26.182 -3.017 -7.323 1.00 0.00 H new ATOM 0 HG2 ARG A 143 23.790 -2.328 -7.603 1.00 0.00 H new ATOM 0 HG3 ARG A 143 23.862 -2.744 -9.304 1.00 0.00 H new ATOM 0 HD2 ARG A 143 24.366 -5.112 -8.738 1.00 0.00 H new ATOM 0 HD3 ARG A 143 24.409 -4.719 -7.031 1.00 0.00 H new ATOM 0 HE ARG A 143 21.884 -3.835 -7.942 1.00 0.00 H new ATOM 0 HH11 ARG A 143 23.770 -6.787 -7.764 1.00 0.00 H new ATOM 0 HH12 ARG A 143 22.356 -7.835 -7.612 1.00 0.00 H new ATOM 0 HH21 ARG A 143 20.074 -5.192 -7.746 1.00 0.00 H new ATOM 0 HH22 ARG A 143 20.283 -6.940 -7.602 1.00 0.00 H new ATOM 128 N MET A 144 28.488 -1.548 -9.058 1.00 0.00 N ATOM 129 CA MET A 144 29.900 -1.290 -8.795 1.00 0.00 C ATOM 130 C MET A 144 30.131 0.193 -8.528 1.00 0.00 C ATOM 131 O MET A 144 30.816 0.563 -7.574 1.00 0.00 O ATOM 132 CB MET A 144 30.744 -1.734 -9.990 1.00 0.00 C ATOM 133 CG MET A 144 32.226 -1.509 -9.680 1.00 0.00 C ATOM 134 SD MET A 144 33.231 -2.139 -11.048 1.00 0.00 S ATOM 135 CE MET A 144 32.697 -0.938 -12.293 1.00 0.00 C ATOM 0 H MET A 144 28.308 -2.155 -9.857 1.00 0.00 H new ATOM 0 HA MET A 144 30.196 -1.857 -7.913 1.00 0.00 H new ATOM 0 HB2 MET A 144 30.562 -2.787 -10.206 1.00 0.00 H new ATOM 0 HB3 MET A 144 30.458 -1.172 -10.879 1.00 0.00 H new ATOM 0 HG2 MET A 144 32.420 -0.447 -9.531 1.00 0.00 H new ATOM 0 HG3 MET A 144 32.496 -2.015 -8.753 1.00 0.00 H new ATOM 0 HE1 MET A 144 33.484 -0.810 -13.036 1.00 0.00 H new ATOM 0 HE2 MET A 144 31.792 -1.298 -12.782 1.00 0.00 H new ATOM 0 HE3 MET A 144 32.493 0.019 -11.812 1.00 0.00 H new ATOM 145 N ILE A 145 29.554 1.039 -9.375 1.00 0.00 N ATOM 146 CA ILE A 145 29.693 2.482 -9.212 1.00 0.00 C ATOM 147 C ILE A 145 29.022 2.940 -7.921 1.00 0.00 C ATOM 148 O ILE A 145 29.552 3.785 -7.200 1.00 0.00 O ATOM 149 CB ILE A 145 29.062 3.205 -10.402 1.00 0.00 C ATOM 150 CG1 ILE A 145 29.688 2.691 -11.700 1.00 0.00 C ATOM 151 CG2 ILE A 145 29.314 4.709 -10.277 1.00 0.00 C ATOM 152 CD1 ILE A 145 31.207 2.860 -11.637 1.00 0.00 C ATOM 0 H ILE A 145 28.990 0.754 -10.175 1.00 0.00 H new ATOM 0 HA ILE A 145 30.755 2.724 -9.163 1.00 0.00 H new ATOM 0 HB ILE A 145 27.989 3.016 -10.415 1.00 0.00 H new ATOM 0 HG12 ILE A 145 29.434 1.641 -11.848 1.00 0.00 H new ATOM 0 HG13 ILE A 145 29.286 3.239 -12.552 1.00 0.00 H new ATOM 0 HG21 ILE A 145 28.864 5.225 -11.125 1.00 0.00 H new ATOM 0 HG22 ILE A 145 28.870 5.077 -9.352 1.00 0.00 H new ATOM 0 HG23 ILE A 145 30.387 4.898 -10.265 1.00 0.00 H new ATOM 0 HD11 ILE A 145 31.653 2.494 -12.562 1.00 0.00 H new ATOM 0 HD12 ILE A 145 31.451 3.915 -11.510 1.00 0.00 H new ATOM 0 HD13 ILE A 145 31.602 2.292 -10.794 1.00 0.00 H new ATOM 164 N LYS A 146 27.854 2.374 -7.634 1.00 0.00 N ATOM 165 CA LYS A 146 27.112 2.744 -6.434 1.00 0.00 C ATOM 166 C LYS A 146 27.885 2.337 -5.183 1.00 0.00 C ATOM 167 O LYS A 146 27.964 3.095 -4.217 1.00 0.00 O ATOM 168 CB LYS A 146 25.743 2.062 -6.434 1.00 0.00 C ATOM 169 CG LYS A 146 24.959 2.491 -5.192 1.00 0.00 C ATOM 170 CD LYS A 146 23.554 1.888 -5.242 1.00 0.00 C ATOM 171 CE LYS A 146 22.755 2.351 -4.021 1.00 0.00 C ATOM 172 NZ LYS A 146 21.377 1.789 -4.086 1.00 0.00 N ATOM 0 H LYS A 146 27.404 1.663 -8.211 1.00 0.00 H new ATOM 0 HA LYS A 146 26.977 3.826 -6.431 1.00 0.00 H new ATOM 0 HB2 LYS A 146 25.192 2.329 -7.335 1.00 0.00 H new ATOM 0 HB3 LYS A 146 25.864 0.979 -6.444 1.00 0.00 H new ATOM 0 HG2 LYS A 146 25.476 2.161 -4.291 1.00 0.00 H new ATOM 0 HG3 LYS A 146 24.898 3.578 -5.145 1.00 0.00 H new ATOM 0 HD2 LYS A 146 23.048 2.194 -6.158 1.00 0.00 H new ATOM 0 HD3 LYS A 146 23.614 0.800 -5.259 1.00 0.00 H new ATOM 0 HE2 LYS A 146 23.249 2.026 -3.105 1.00 0.00 H new ATOM 0 HE3 LYS A 146 22.714 3.440 -3.992 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 20.834 2.104 -3.256 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 20.908 2.120 -4.953 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 21.426 0.750 -4.094 1.00 0.00 H new ATOM 186 N GLN A 147 28.454 1.137 -5.208 1.00 0.00 N ATOM 187 CA GLN A 147 29.213 0.637 -4.068 1.00 0.00 C ATOM 188 C GLN A 147 30.384 1.564 -3.759 1.00 0.00 C ATOM 189 O GLN A 147 30.708 1.804 -2.596 1.00 0.00 O ATOM 190 CB GLN A 147 29.736 -0.770 -4.364 1.00 0.00 C ATOM 191 CG GLN A 147 28.561 -1.747 -4.440 1.00 0.00 C ATOM 192 CD GLN A 147 29.066 -3.145 -4.777 1.00 0.00 C ATOM 193 OE1 GLN A 147 29.655 -3.354 -5.838 1.00 0.00 O ATOM 194 NE2 GLN A 147 28.870 -4.121 -3.933 1.00 0.00 N ATOM 0 H GLN A 147 28.405 0.496 -6.000 1.00 0.00 H new ATOM 0 HA GLN A 147 28.553 0.602 -3.202 1.00 0.00 H new ATOM 0 HB2 GLN A 147 30.287 -0.774 -5.304 1.00 0.00 H new ATOM 0 HB3 GLN A 147 30.432 -1.082 -3.585 1.00 0.00 H new ATOM 0 HG2 GLN A 147 28.029 -1.763 -3.489 1.00 0.00 H new ATOM 0 HG3 GLN A 147 27.850 -1.416 -5.197 1.00 0.00 H new ATOM 0 HE21 GLN A 147 28.382 -3.945 -3.055 1.00 0.00 H new ATOM 0 HE22 GLN A 147 29.205 -5.059 -4.152 1.00 0.00 H new ATOM 203 N LEU A 148 31.014 2.082 -4.808 1.00 0.00 N ATOM 204 CA LEU A 148 32.151 2.978 -4.638 1.00 0.00 C ATOM 205 C LEU A 148 31.726 4.244 -3.901 1.00 0.00 C ATOM 206 O LEU A 148 32.468 4.770 -3.071 1.00 0.00 O ATOM 207 CB LEU A 148 32.732 3.351 -6.003 1.00 0.00 C ATOM 208 CG LEU A 148 33.419 2.130 -6.616 1.00 0.00 C ATOM 209 CD1 LEU A 148 33.853 2.453 -8.047 1.00 0.00 C ATOM 210 CD2 LEU A 148 34.649 1.765 -5.782 1.00 0.00 C ATOM 0 H LEU A 148 30.759 1.898 -5.778 1.00 0.00 H new ATOM 0 HA LEU A 148 32.911 2.464 -4.049 1.00 0.00 H new ATOM 0 HB2 LEU A 148 31.940 3.705 -6.663 1.00 0.00 H new ATOM 0 HB3 LEU A 148 33.446 4.167 -5.895 1.00 0.00 H new ATOM 0 HG LEU A 148 32.724 1.290 -6.627 1.00 0.00 H new ATOM 0 HD11 LEU A 148 34.343 1.583 -8.484 1.00 0.00 H new ATOM 0 HD12 LEU A 148 32.978 2.714 -8.642 1.00 0.00 H new ATOM 0 HD13 LEU A 148 34.548 3.293 -8.036 1.00 0.00 H new ATOM 0 HD21 LEU A 148 35.139 0.895 -6.218 1.00 0.00 H new ATOM 0 HD22 LEU A 148 35.343 2.605 -5.771 1.00 0.00 H new ATOM 0 HD23 LEU A 148 34.342 1.535 -4.762 1.00 0.00 H new ATOM 222 N LYS A 149 30.526 4.727 -4.209 1.00 0.00 N ATOM 223 CA LYS A 149 30.014 5.935 -3.575 1.00 0.00 C ATOM 224 C LYS A 149 29.843 5.718 -2.074 1.00 0.00 C ATOM 225 O LYS A 149 29.965 6.654 -1.284 1.00 0.00 O ATOM 226 CB LYS A 149 28.669 6.320 -4.193 1.00 0.00 C ATOM 227 CG LYS A 149 28.884 6.784 -5.635 1.00 0.00 C ATOM 228 CD LYS A 149 27.545 7.209 -6.240 1.00 0.00 C ATOM 229 CE LYS A 149 27.763 7.693 -7.674 1.00 0.00 C ATOM 230 NZ LYS A 149 26.463 8.136 -8.252 1.00 0.00 N ATOM 0 H LYS A 149 29.895 4.303 -4.889 1.00 0.00 H new ATOM 0 HA LYS A 149 30.731 6.740 -3.737 1.00 0.00 H new ATOM 0 HB2 LYS A 149 27.990 5.468 -4.171 1.00 0.00 H new ATOM 0 HB3 LYS A 149 28.203 7.114 -3.610 1.00 0.00 H new ATOM 0 HG2 LYS A 149 29.587 7.617 -5.659 1.00 0.00 H new ATOM 0 HG3 LYS A 149 29.323 5.980 -6.225 1.00 0.00 H new ATOM 0 HD2 LYS A 149 26.847 6.372 -6.230 1.00 0.00 H new ATOM 0 HD3 LYS A 149 27.099 8.003 -5.641 1.00 0.00 H new ATOM 0 HE2 LYS A 149 28.478 8.516 -7.687 1.00 0.00 H new ATOM 0 HE3 LYS A 149 28.188 6.892 -8.279 1.00 0.00 H new ATOM 0 HZ1 LYS A 149 26.611 8.465 -9.227 1.00 0.00 H new ATOM 0 HZ2 LYS A 149 25.794 7.340 -8.253 1.00 0.00 H new ATOM 0 HZ3 LYS A 149 26.075 8.913 -7.679 1.00 0.00 H new ATOM 244 N GLU A 150 29.562 4.477 -1.690 1.00 0.00 N ATOM 245 CA GLU A 150 29.362 4.152 -0.283 1.00 0.00 C ATOM 246 C GLU A 150 30.664 4.318 0.494 1.00 0.00 C ATOM 247 O GLU A 150 30.695 4.967 1.540 1.00 0.00 O ATOM 248 CB GLU A 150 28.863 2.712 -0.145 1.00 0.00 C ATOM 249 CG GLU A 150 28.543 2.420 1.322 1.00 0.00 C ATOM 250 CD GLU A 150 27.354 3.261 1.773 1.00 0.00 C ATOM 251 OE1 GLU A 150 26.723 3.865 0.922 1.00 0.00 O ATOM 252 OE2 GLU A 150 27.092 3.290 2.965 1.00 0.00 O ATOM 0 H GLU A 150 29.468 3.686 -2.327 1.00 0.00 H new ATOM 0 HA GLU A 150 28.617 4.835 0.127 1.00 0.00 H new ATOM 0 HB2 GLU A 150 27.974 2.564 -0.758 1.00 0.00 H new ATOM 0 HB3 GLU A 150 29.620 2.017 -0.508 1.00 0.00 H new ATOM 0 HG2 GLU A 150 28.320 1.361 1.450 1.00 0.00 H new ATOM 0 HG3 GLU A 150 29.411 2.640 1.943 1.00 0.00 H new ATOM 259 N GLU A 151 31.735 3.730 -0.026 1.00 0.00 N ATOM 260 CA GLU A 151 33.037 3.826 0.623 1.00 0.00 C ATOM 261 C GLU A 151 33.571 5.252 0.539 1.00 0.00 C ATOM 262 O GLU A 151 34.338 5.690 1.397 1.00 0.00 O ATOM 263 CB GLU A 151 34.026 2.868 -0.045 1.00 0.00 C ATOM 264 CG GLU A 151 33.623 1.424 0.259 1.00 0.00 C ATOM 265 CD GLU A 151 34.555 0.459 -0.466 1.00 0.00 C ATOM 266 OE1 GLU A 151 35.398 0.929 -1.213 1.00 0.00 O ATOM 267 OE2 GLU A 151 34.413 -0.736 -0.262 1.00 0.00 O ATOM 0 H GLU A 151 31.729 3.186 -0.889 1.00 0.00 H new ATOM 0 HA GLU A 151 32.921 3.554 1.672 1.00 0.00 H new ATOM 0 HB2 GLU A 151 34.038 3.034 -1.122 1.00 0.00 H new ATOM 0 HB3 GLU A 151 35.036 3.059 0.319 1.00 0.00 H new ATOM 0 HG2 GLU A 151 33.665 1.245 1.333 1.00 0.00 H new ATOM 0 HG3 GLU A 151 32.593 1.252 -0.053 1.00 0.00 H new ATOM 274 N LEU A 152 33.160 5.972 -0.499 1.00 0.00 N ATOM 275 CA LEU A 152 33.610 7.345 -0.691 1.00 0.00 C ATOM 276 C LEU A 152 33.164 8.222 0.475 1.00 0.00 C ATOM 277 O LEU A 152 33.929 9.050 0.970 1.00 0.00 O ATOM 278 CB LEU A 152 33.046 7.904 -1.998 1.00 0.00 C ATOM 279 CG LEU A 152 33.514 9.348 -2.181 1.00 0.00 C ATOM 280 CD1 LEU A 152 35.043 9.393 -2.181 1.00 0.00 C ATOM 281 CD2 LEU A 152 32.990 9.888 -3.514 1.00 0.00 C ATOM 0 H LEU A 152 32.520 5.630 -1.216 1.00 0.00 H new ATOM 0 HA LEU A 152 34.699 7.347 -0.737 1.00 0.00 H new ATOM 0 HB2 LEU A 152 33.377 7.294 -2.839 1.00 0.00 H new ATOM 0 HB3 LEU A 152 31.957 7.863 -1.983 1.00 0.00 H new ATOM 0 HG LEU A 152 33.132 9.960 -1.364 1.00 0.00 H new ATOM 0 HD11 LEU A 152 35.377 10.422 -2.311 1.00 0.00 H new ATOM 0 HD12 LEU A 152 35.418 9.007 -1.233 1.00 0.00 H new ATOM 0 HD13 LEU A 152 35.425 8.781 -2.998 1.00 0.00 H new ATOM 0 HD21 LEU A 152 33.323 10.918 -3.646 1.00 0.00 H new ATOM 0 HD22 LEU A 152 33.373 9.276 -4.330 1.00 0.00 H new ATOM 0 HD23 LEU A 152 31.900 9.856 -3.516 1.00 0.00 H new ATOM 293 N ARG A 153 31.922 8.033 0.909 1.00 0.00 N ATOM 294 CA ARG A 153 31.381 8.821 2.010 1.00 0.00 C ATOM 295 C ARG A 153 32.152 8.542 3.296 1.00 0.00 C ATOM 296 O ARG A 153 32.502 9.462 4.034 1.00 0.00 O ATOM 297 CB ARG A 153 29.903 8.485 2.216 1.00 0.00 C ATOM 298 CG ARG A 153 29.082 9.057 1.059 1.00 0.00 C ATOM 299 CD ARG A 153 27.618 8.643 1.216 1.00 0.00 C ATOM 300 NE ARG A 153 27.053 9.238 2.422 1.00 0.00 N ATOM 301 CZ ARG A 153 25.813 8.959 2.809 1.00 0.00 C ATOM 302 NH1 ARG A 153 25.078 8.140 2.106 1.00 0.00 N ATOM 303 NH2 ARG A 153 25.328 9.504 3.892 1.00 0.00 N ATOM 0 H ARG A 153 31.276 7.347 0.519 1.00 0.00 H new ATOM 0 HA ARG A 153 31.481 9.877 1.761 1.00 0.00 H new ATOM 0 HB2 ARG A 153 29.769 7.405 2.271 1.00 0.00 H new ATOM 0 HB3 ARG A 153 29.554 8.898 3.162 1.00 0.00 H new ATOM 0 HG2 ARG A 153 29.164 10.144 1.044 1.00 0.00 H new ATOM 0 HG3 ARG A 153 29.473 8.695 0.108 1.00 0.00 H new ATOM 0 HD2 ARG A 153 27.047 8.960 0.343 1.00 0.00 H new ATOM 0 HD3 ARG A 153 27.543 7.557 1.268 1.00 0.00 H new ATOM 0 HE ARG A 153 27.619 9.879 2.978 1.00 0.00 H new ATOM 0 HH11 ARG A 153 25.456 7.714 1.260 1.00 0.00 H new ATOM 0 HH12 ARG A 153 24.126 7.926 2.403 1.00 0.00 H new ATOM 0 HH21 ARG A 153 25.901 10.144 4.441 1.00 0.00 H new ATOM 0 HH22 ARG A 153 24.376 9.289 4.189 1.00 0.00 H new ATOM 317 N LEU A 154 32.415 7.265 3.557 1.00 0.00 N ATOM 318 CA LEU A 154 33.149 6.876 4.755 1.00 0.00 C ATOM 319 C LEU A 154 34.603 7.325 4.660 1.00 0.00 C ATOM 320 O LEU A 154 35.190 7.773 5.645 1.00 0.00 O ATOM 321 CB LEU A 154 33.092 5.357 4.932 1.00 0.00 C ATOM 322 CG LEU A 154 31.661 4.935 5.268 1.00 0.00 C ATOM 323 CD1 LEU A 154 31.573 3.408 5.297 1.00 0.00 C ATOM 324 CD2 LEU A 154 31.275 5.493 6.639 1.00 0.00 C ATOM 0 H LEU A 154 32.133 6.488 2.960 1.00 0.00 H new ATOM 0 HA LEU A 154 32.687 7.359 5.616 1.00 0.00 H new ATOM 0 HB2 LEU A 154 33.424 4.861 4.020 1.00 0.00 H new ATOM 0 HB3 LEU A 154 33.770 5.047 5.727 1.00 0.00 H new ATOM 0 HG LEU A 154 30.980 5.324 4.511 1.00 0.00 H new ATOM 0 HD11 LEU A 154 30.553 3.107 5.536 1.00 0.00 H new ATOM 0 HD12 LEU A 154 31.850 3.009 4.321 1.00 0.00 H new ATOM 0 HD13 LEU A 154 32.254 3.019 6.054 1.00 0.00 H new ATOM 0 HD21 LEU A 154 30.255 5.193 6.880 1.00 0.00 H new ATOM 0 HD22 LEU A 154 31.956 5.103 7.395 1.00 0.00 H new ATOM 0 HD23 LEU A 154 31.338 6.581 6.620 1.00 0.00 H new ATOM 336 N GLU A 155 35.177 7.204 3.468 1.00 0.00 N ATOM 337 CA GLU A 155 36.568 7.589 3.258 1.00 0.00 C ATOM 338 C GLU A 155 36.756 9.078 3.531 1.00 0.00 C ATOM 339 O GLU A 155 37.742 9.488 4.143 1.00 0.00 O ATOM 340 CB GLU A 155 36.986 7.274 1.821 1.00 0.00 C ATOM 341 CG GLU A 155 38.485 7.534 1.656 1.00 0.00 C ATOM 342 CD GLU A 155 39.282 6.531 2.482 1.00 0.00 C ATOM 343 OE1 GLU A 155 38.682 5.589 2.974 1.00 0.00 O ATOM 344 OE2 GLU A 155 40.480 6.718 2.612 1.00 0.00 O ATOM 0 H GLU A 155 34.705 6.845 2.638 1.00 0.00 H new ATOM 0 HA GLU A 155 37.192 7.022 3.949 1.00 0.00 H new ATOM 0 HB2 GLU A 155 36.758 6.235 1.584 1.00 0.00 H new ATOM 0 HB3 GLU A 155 36.420 7.891 1.123 1.00 0.00 H new ATOM 0 HG2 GLU A 155 38.763 7.454 0.605 1.00 0.00 H new ATOM 0 HG3 GLU A 155 38.723 8.549 1.973 1.00 0.00 H new ATOM 351 N GLU A 156 35.802 9.882 3.072 1.00 0.00 N ATOM 352 CA GLU A 156 35.875 11.325 3.267 1.00 0.00 C ATOM 353 C GLU A 156 35.626 11.679 4.730 1.00 0.00 C ATOM 354 O GLU A 156 36.272 12.571 5.281 1.00 0.00 O ATOM 355 CB GLU A 156 34.837 12.025 2.387 1.00 0.00 C ATOM 356 CG GLU A 156 35.227 11.872 0.916 1.00 0.00 C ATOM 357 CD GLU A 156 34.161 12.500 0.025 1.00 0.00 C ATOM 358 OE1 GLU A 156 33.205 13.033 0.565 1.00 0.00 O ATOM 359 OE2 GLU A 156 34.316 12.440 -1.183 1.00 0.00 O ATOM 0 H GLU A 156 34.976 9.562 2.567 1.00 0.00 H new ATOM 0 HA GLU A 156 36.873 11.661 2.987 1.00 0.00 H new ATOM 0 HB2 GLU A 156 33.850 11.595 2.559 1.00 0.00 H new ATOM 0 HB3 GLU A 156 34.775 13.081 2.650 1.00 0.00 H new ATOM 0 HG2 GLU A 156 36.190 12.349 0.735 1.00 0.00 H new ATOM 0 HG3 GLU A 156 35.343 10.816 0.670 1.00 0.00 H new ATOM 366 N ALA A 157 34.688 10.974 5.352 1.00 0.00 N ATOM 367 CA ALA A 157 34.360 11.224 6.751 1.00 0.00 C ATOM 368 C ALA A 157 35.629 11.270 7.597 1.00 0.00 C ATOM 369 O ALA A 157 35.838 12.206 8.370 1.00 0.00 O ATOM 370 CB ALA A 157 33.434 10.125 7.275 1.00 0.00 C ATOM 0 H ALA A 157 34.145 10.230 4.914 1.00 0.00 H new ATOM 0 HA ALA A 157 33.855 12.187 6.821 1.00 0.00 H new ATOM 0 HB1 ALA A 157 33.194 10.319 8.320 1.00 0.00 H new ATOM 0 HB2 ALA A 157 32.516 10.113 6.688 1.00 0.00 H new ATOM 0 HB3 ALA A 157 33.932 9.159 7.191 1.00 0.00 H new ATOM 376 N LYS A 158 36.473 10.254 7.445 1.00 0.00 N ATOM 377 CA LYS A 158 37.715 10.185 8.205 1.00 0.00 C ATOM 378 C LYS A 158 38.581 11.409 7.921 1.00 0.00 C ATOM 379 O LYS A 158 39.162 11.994 8.835 1.00 0.00 O ATOM 380 CB LYS A 158 38.484 8.916 7.836 1.00 0.00 C ATOM 381 CG LYS A 158 37.719 7.690 8.341 1.00 0.00 C ATOM 382 CD LYS A 158 38.497 6.421 7.988 1.00 0.00 C ATOM 383 CE LYS A 158 37.716 5.194 8.461 1.00 0.00 C ATOM 384 NZ LYS A 158 37.735 5.138 9.951 1.00 0.00 N ATOM 0 H LYS A 158 36.321 9.473 6.807 1.00 0.00 H new ATOM 0 HA LYS A 158 37.471 10.163 9.267 1.00 0.00 H new ATOM 0 HB2 LYS A 158 38.613 8.858 6.755 1.00 0.00 H new ATOM 0 HB3 LYS A 158 39.481 8.942 8.275 1.00 0.00 H new ATOM 0 HG2 LYS A 158 37.579 7.755 9.420 1.00 0.00 H new ATOM 0 HG3 LYS A 158 36.726 7.657 7.892 1.00 0.00 H new ATOM 0 HD2 LYS A 158 38.659 6.369 6.911 1.00 0.00 H new ATOM 0 HD3 LYS A 158 39.480 6.442 8.458 1.00 0.00 H new ATOM 0 HE2 LYS A 158 36.688 5.243 8.101 1.00 0.00 H new ATOM 0 HE3 LYS A 158 38.156 4.287 8.046 1.00 0.00 H new ATOM 0 HZ1 LYS A 158 37.435 4.194 10.267 1.00 0.00 H new ATOM 0 HZ2 LYS A 158 38.699 5.328 10.293 1.00 0.00 H new ATOM 0 HZ3 LYS A 158 37.085 5.854 10.334 1.00 0.00 H new ATOM 398 N LEU A 159 38.663 11.788 6.651 1.00 0.00 N ATOM 399 CA LEU A 159 39.463 12.942 6.259 1.00 0.00 C ATOM 400 C LEU A 159 38.982 14.196 6.982 1.00 0.00 C ATOM 401 O LEU A 159 39.784 14.958 7.523 1.00 0.00 O ATOM 402 CB LEU A 159 39.368 13.156 4.747 1.00 0.00 C ATOM 403 CG LEU A 159 40.475 12.365 4.049 1.00 0.00 C ATOM 404 CD1 LEU A 159 41.824 13.038 4.306 1.00 0.00 C ATOM 405 CD2 LEU A 159 40.505 10.937 4.599 1.00 0.00 C ATOM 0 H LEU A 159 38.189 11.317 5.880 1.00 0.00 H new ATOM 0 HA LEU A 159 40.500 12.751 6.534 1.00 0.00 H new ATOM 0 HB2 LEU A 159 38.392 12.834 4.384 1.00 0.00 H new ATOM 0 HB3 LEU A 159 39.461 14.216 4.513 1.00 0.00 H new ATOM 0 HG LEU A 159 40.281 12.338 2.977 1.00 0.00 H new ATOM 0 HD11 LEU A 159 42.613 12.474 3.808 1.00 0.00 H new ATOM 0 HD12 LEU A 159 41.803 14.055 3.915 1.00 0.00 H new ATOM 0 HD13 LEU A 159 42.019 13.065 5.378 1.00 0.00 H new ATOM 0 HD21 LEU A 159 41.294 10.372 4.102 1.00 0.00 H new ATOM 0 HD22 LEU A 159 40.699 10.964 5.671 1.00 0.00 H new ATOM 0 HD23 LEU A 159 39.544 10.456 4.416 1.00 0.00 H new ATOM 417 N VAL A 160 37.669 14.403 6.989 1.00 0.00 N ATOM 418 CA VAL A 160 37.090 15.552 7.674 1.00 0.00 C ATOM 419 C VAL A 160 37.407 15.502 9.165 1.00 0.00 C ATOM 420 O VAL A 160 37.759 16.514 9.769 1.00 0.00 O ATOM 421 CB VAL A 160 35.574 15.572 7.472 1.00 0.00 C ATOM 422 CG1 VAL A 160 34.956 16.656 8.356 1.00 0.00 C ATOM 423 CG2 VAL A 160 35.260 15.873 6.004 1.00 0.00 C ATOM 0 H VAL A 160 36.990 13.794 6.531 1.00 0.00 H new ATOM 0 HA VAL A 160 37.523 16.459 7.252 1.00 0.00 H new ATOM 0 HB VAL A 160 35.159 14.601 7.742 1.00 0.00 H new ATOM 0 HG11 VAL A 160 33.876 16.671 8.212 1.00 0.00 H new ATOM 0 HG12 VAL A 160 35.180 16.444 9.402 1.00 0.00 H new ATOM 0 HG13 VAL A 160 35.371 17.627 8.085 1.00 0.00 H new ATOM 0 HG21 VAL A 160 34.180 15.888 5.859 1.00 0.00 H new ATOM 0 HG22 VAL A 160 35.676 16.844 5.735 1.00 0.00 H new ATOM 0 HG23 VAL A 160 35.701 15.102 5.372 1.00 0.00 H new ATOM 433 N LEU A 161 37.280 14.315 9.750 1.00 0.00 N ATOM 434 CA LEU A 161 37.555 14.144 11.173 1.00 0.00 C ATOM 435 C LEU A 161 39.017 14.453 11.475 1.00 0.00 C ATOM 436 O LEU A 161 39.330 15.110 12.467 1.00 0.00 O ATOM 437 CB LEU A 161 37.236 12.709 11.597 1.00 0.00 C ATOM 438 CG LEU A 161 37.562 12.530 13.080 1.00 0.00 C ATOM 439 CD1 LEU A 161 36.761 13.540 13.904 1.00 0.00 C ATOM 440 CD2 LEU A 161 37.191 11.111 13.515 1.00 0.00 C ATOM 0 H LEU A 161 36.991 13.465 9.267 1.00 0.00 H new ATOM 0 HA LEU A 161 36.926 14.836 11.733 1.00 0.00 H new ATOM 0 HB2 LEU A 161 36.183 12.491 11.416 1.00 0.00 H new ATOM 0 HB3 LEU A 161 37.815 12.005 10.999 1.00 0.00 H new ATOM 0 HG LEU A 161 38.628 12.694 13.240 1.00 0.00 H new ATOM 0 HD11 LEU A 161 36.993 13.413 14.961 1.00 0.00 H new ATOM 0 HD12 LEU A 161 37.023 14.552 13.594 1.00 0.00 H new ATOM 0 HD13 LEU A 161 35.695 13.376 13.744 1.00 0.00 H new ATOM 0 HD21 LEU A 161 37.423 10.982 14.572 1.00 0.00 H new ATOM 0 HD22 LEU A 161 36.125 10.948 13.355 1.00 0.00 H new ATOM 0 HD23 LEU A 161 37.760 10.390 12.928 1.00 0.00 H new ATOM 452 N LEU A 162 39.907 13.978 10.611 1.00 0.00 N ATOM 453 CA LEU A 162 41.335 14.208 10.796 1.00 0.00 C ATOM 454 C LEU A 162 41.643 15.701 10.769 1.00 0.00 C ATOM 455 O LEU A 162 42.480 16.187 11.529 1.00 0.00 O ATOM 456 CB LEU A 162 42.126 13.502 9.693 1.00 0.00 C ATOM 457 CG LEU A 162 42.061 11.989 9.906 1.00 0.00 C ATOM 458 CD1 LEU A 162 42.623 11.275 8.676 1.00 0.00 C ATOM 459 CD2 LEU A 162 42.892 11.613 11.135 1.00 0.00 C ATOM 0 H LEU A 162 39.668 13.435 9.781 1.00 0.00 H new ATOM 0 HA LEU A 162 41.627 13.805 11.766 1.00 0.00 H new ATOM 0 HB2 LEU A 162 41.717 13.760 8.716 1.00 0.00 H new ATOM 0 HB3 LEU A 162 43.163 13.837 9.703 1.00 0.00 H new ATOM 0 HG LEU A 162 41.025 11.688 10.059 1.00 0.00 H new ATOM 0 HD11 LEU A 162 42.576 10.197 8.828 1.00 0.00 H new ATOM 0 HD12 LEU A 162 42.034 11.543 7.799 1.00 0.00 H new ATOM 0 HD13 LEU A 162 43.660 11.575 8.523 1.00 0.00 H new ATOM 0 HD21 LEU A 162 42.847 10.535 11.289 1.00 0.00 H new ATOM 0 HD22 LEU A 162 43.928 11.915 10.980 1.00 0.00 H new ATOM 0 HD23 LEU A 162 42.494 12.122 12.013 1.00 0.00 H new ATOM 471 N LYS A 163 40.958 16.424 9.888 1.00 0.00 N ATOM 472 CA LYS A 163 41.163 17.863 9.772 1.00 0.00 C ATOM 473 C LYS A 163 40.850 18.555 11.095 1.00 0.00 C ATOM 474 O LYS A 163 41.619 19.394 11.565 1.00 0.00 O ATOM 475 CB LYS A 163 40.265 18.431 8.672 1.00 0.00 C ATOM 476 CG LYS A 163 40.813 18.025 7.304 1.00 0.00 C ATOM 477 CD LYS A 163 41.887 19.024 6.867 1.00 0.00 C ATOM 478 CE LYS A 163 42.412 18.637 5.483 1.00 0.00 C ATOM 479 NZ LYS A 163 43.443 19.622 5.050 1.00 0.00 N ATOM 0 H LYS A 163 40.262 16.040 9.249 1.00 0.00 H new ATOM 0 HA LYS A 163 42.207 18.044 9.517 1.00 0.00 H new ATOM 0 HB2 LYS A 163 39.247 18.061 8.792 1.00 0.00 H new ATOM 0 HB3 LYS A 163 40.220 19.517 8.750 1.00 0.00 H new ATOM 0 HG2 LYS A 163 41.234 17.021 7.353 1.00 0.00 H new ATOM 0 HG3 LYS A 163 40.007 17.998 6.571 1.00 0.00 H new ATOM 0 HD2 LYS A 163 41.472 20.032 6.842 1.00 0.00 H new ATOM 0 HD3 LYS A 163 42.704 19.034 7.588 1.00 0.00 H new ATOM 0 HE2 LYS A 163 42.840 17.635 5.512 1.00 0.00 H new ATOM 0 HE3 LYS A 163 41.592 18.613 4.765 1.00 0.00 H new ATOM 0 HZ1 LYS A 163 43.727 19.420 4.070 1.00 0.00 H new ATOM 0 HZ2 LYS A 163 43.050 20.583 5.105 1.00 0.00 H new ATOM 0 HZ3 LYS A 163 44.273 19.552 5.672 1.00 0.00 H new ATOM 493 N LYS A 164 39.717 18.198 11.690 1.00 0.00 N ATOM 494 CA LYS A 164 39.312 18.791 12.960 1.00 0.00 C ATOM 495 C LYS A 164 40.306 18.432 14.059 1.00 0.00 C ATOM 496 O LYS A 164 40.681 19.278 14.872 1.00 0.00 O ATOM 497 CB LYS A 164 37.918 18.295 13.346 1.00 0.00 C ATOM 498 CG LYS A 164 36.956 18.509 12.176 1.00 0.00 C ATOM 499 CD LYS A 164 36.579 19.989 12.088 1.00 0.00 C ATOM 500 CE LYS A 164 35.912 20.267 10.739 1.00 0.00 C ATOM 501 NZ LYS A 164 35.479 21.692 10.684 1.00 0.00 N ATOM 0 H LYS A 164 39.067 17.506 11.317 1.00 0.00 H new ATOM 0 HA LYS A 164 39.292 19.875 12.845 1.00 0.00 H new ATOM 0 HB2 LYS A 164 37.957 17.238 13.610 1.00 0.00 H new ATOM 0 HB3 LYS A 164 37.561 18.830 14.226 1.00 0.00 H new ATOM 0 HG2 LYS A 164 37.422 18.186 11.245 1.00 0.00 H new ATOM 0 HG3 LYS A 164 36.061 17.902 12.312 1.00 0.00 H new ATOM 0 HD2 LYS A 164 35.902 20.252 12.901 1.00 0.00 H new ATOM 0 HD3 LYS A 164 37.468 20.609 12.200 1.00 0.00 H new ATOM 0 HE2 LYS A 164 36.607 20.055 9.927 1.00 0.00 H new ATOM 0 HE3 LYS A 164 35.054 19.609 10.603 1.00 0.00 H new ATOM 0 HZ1 LYS A 164 35.026 21.882 9.768 1.00 0.00 H new ATOM 0 HZ2 LYS A 164 34.802 21.879 11.451 1.00 0.00 H new ATOM 0 HZ3 LYS A 164 36.307 22.311 10.795 1.00 0.00 H new ATOM 515 N LEU A 165 40.731 17.172 14.077 1.00 0.00 N ATOM 516 CA LEU A 165 41.689 16.713 15.076 1.00 0.00 C ATOM 517 C LEU A 165 43.009 17.465 14.936 1.00 0.00 C ATOM 518 O LEU A 165 43.588 17.912 15.925 1.00 0.00 O ATOM 519 CB LEU A 165 41.934 15.212 14.914 1.00 0.00 C ATOM 520 CG LEU A 165 42.942 14.742 15.964 1.00 0.00 C ATOM 521 CD1 LEU A 165 42.393 15.027 17.362 1.00 0.00 C ATOM 522 CD2 LEU A 165 43.178 13.239 15.806 1.00 0.00 C ATOM 0 H LEU A 165 40.430 16.456 13.416 1.00 0.00 H new ATOM 0 HA LEU A 165 41.276 16.908 16.066 1.00 0.00 H new ATOM 0 HB2 LEU A 165 40.997 14.666 15.024 1.00 0.00 H new ATOM 0 HB3 LEU A 165 42.310 15.000 13.913 1.00 0.00 H new ATOM 0 HG LEU A 165 43.883 15.275 15.828 1.00 0.00 H new ATOM 0 HD11 LEU A 165 43.111 14.692 18.110 1.00 0.00 H new ATOM 0 HD12 LEU A 165 42.224 16.098 17.475 1.00 0.00 H new ATOM 0 HD13 LEU A 165 41.452 14.495 17.499 1.00 0.00 H new ATOM 0 HD21 LEU A 165 43.896 12.903 16.554 1.00 0.00 H new ATOM 0 HD22 LEU A 165 42.237 12.707 15.942 1.00 0.00 H new ATOM 0 HD23 LEU A 165 43.570 13.035 14.809 1.00 0.00 H new ATOM 534 N ARG A 166 43.477 17.600 13.699 1.00 0.00 N ATOM 535 CA ARG A 166 44.725 18.305 13.438 1.00 0.00 C ATOM 536 C ARG A 166 44.618 19.763 13.872 1.00 0.00 C ATOM 537 O ARG A 166 45.536 20.308 14.484 1.00 0.00 O ATOM 538 CB ARG A 166 45.060 18.238 11.947 1.00 0.00 C ATOM 539 CG ARG A 166 46.427 18.880 11.699 1.00 0.00 C ATOM 540 CD ARG A 166 46.234 20.280 11.116 1.00 0.00 C ATOM 541 NE ARG A 166 45.649 20.197 9.783 1.00 0.00 N ATOM 542 CZ ARG A 166 45.217 21.284 9.153 1.00 0.00 C ATOM 543 NH1 ARG A 166 45.311 22.452 9.728 1.00 0.00 N ATOM 544 NH2 ARG A 166 44.697 21.184 7.960 1.00 0.00 N ATOM 0 H ARG A 166 43.014 17.233 12.868 1.00 0.00 H new ATOM 0 HA ARG A 166 45.518 17.825 14.011 1.00 0.00 H new ATOM 0 HB2 ARG A 166 45.068 17.201 11.612 1.00 0.00 H new ATOM 0 HB3 ARG A 166 44.294 18.754 11.368 1.00 0.00 H new ATOM 0 HG2 ARG A 166 46.989 18.937 12.631 1.00 0.00 H new ATOM 0 HG3 ARG A 166 47.010 18.266 11.013 1.00 0.00 H new ATOM 0 HD2 ARG A 166 45.587 20.867 11.768 1.00 0.00 H new ATOM 0 HD3 ARG A 166 47.193 20.797 11.068 1.00 0.00 H new ATOM 0 HE ARG A 166 45.570 19.288 9.326 1.00 0.00 H new ATOM 0 HH11 ARG A 166 45.716 22.530 10.661 1.00 0.00 H new ATOM 0 HH12 ARG A 166 44.979 23.287 9.244 1.00 0.00 H new ATOM 0 HH21 ARG A 166 44.622 20.271 7.511 1.00 0.00 H new ATOM 0 HH22 ARG A 166 44.365 22.019 7.477 1.00 0.00 H new ATOM 558 N GLN A 167 43.489 20.388 13.553 1.00 0.00 N ATOM 559 CA GLN A 167 43.269 21.782 13.921 1.00 0.00 C ATOM 560 C GLN A 167 43.198 21.931 15.437 1.00 0.00 C ATOM 561 O GLN A 167 43.474 23.001 15.979 1.00 0.00 O ATOM 562 CB GLN A 167 41.968 22.289 13.294 1.00 0.00 C ATOM 563 CG GLN A 167 42.158 22.447 11.784 1.00 0.00 C ATOM 564 CD GLN A 167 40.845 22.875 11.136 1.00 0.00 C ATOM 565 OE1 GLN A 167 40.356 22.209 10.224 1.00 0.00 O ATOM 566 NE2 GLN A 167 40.241 23.953 11.557 1.00 0.00 N ATOM 0 H GLN A 167 42.718 19.955 13.044 1.00 0.00 H new ATOM 0 HA GLN A 167 44.106 22.373 13.548 1.00 0.00 H new ATOM 0 HB2 GLN A 167 41.157 21.590 13.498 1.00 0.00 H new ATOM 0 HB3 GLN A 167 41.686 23.244 13.738 1.00 0.00 H new ATOM 0 HG2 GLN A 167 42.932 23.188 11.582 1.00 0.00 H new ATOM 0 HG3 GLN A 167 42.497 21.506 11.351 1.00 0.00 H new ATOM 0 HE21 GLN A 167 40.648 24.503 12.313 1.00 0.00 H new ATOM 0 HE22 GLN A 167 39.362 24.245 11.130 1.00 0.00 H new ATOM 575 N SER A 168 42.826 20.850 16.116 1.00 0.00 N ATOM 576 CA SER A 168 42.716 20.875 17.570 1.00 0.00 C ATOM 577 C SER A 168 44.069 21.188 18.203 1.00 0.00 C ATOM 578 O SER A 168 44.161 21.997 19.126 1.00 0.00 O ATOM 579 CB SER A 168 42.214 19.523 18.079 1.00 0.00 C ATOM 580 OG SER A 168 41.037 19.162 17.368 1.00 0.00 O ATOM 0 H SER A 168 42.597 19.953 15.687 1.00 0.00 H new ATOM 0 HA SER A 168 42.007 21.654 17.849 1.00 0.00 H new ATOM 0 HB2 SER A 168 42.983 18.762 17.943 1.00 0.00 H new ATOM 0 HB3 SER A 168 42.005 19.578 19.147 1.00 0.00 H new ATOM 0 HG SER A 168 41.247 19.063 16.416 1.00 0.00 H new ATOM 586 N GLN A 169 45.116 20.542 17.700 1.00 0.00 N ATOM 587 CA GLN A 169 46.460 20.767 18.216 1.00 0.00 C ATOM 588 C GLN A 169 46.798 22.255 18.200 1.00 0.00 C ATOM 589 O GLN A 169 47.831 22.672 18.720 1.00 0.00 O ATOM 590 CB GLN A 169 47.480 20.001 17.373 1.00 0.00 C ATOM 591 CG GLN A 169 47.234 18.498 17.515 1.00 0.00 C ATOM 592 CD GLN A 169 47.458 18.067 18.960 1.00 0.00 C ATOM 593 OE1 GLN A 169 46.556 18.180 19.789 1.00 0.00 O ATOM 594 NE2 GLN A 169 48.615 17.576 19.313 1.00 0.00 N ATOM 0 H GLN A 169 45.060 19.863 16.941 1.00 0.00 H new ATOM 0 HA GLN A 169 46.498 20.408 19.244 1.00 0.00 H new ATOM 0 HB2 GLN A 169 47.398 20.296 16.327 1.00 0.00 H new ATOM 0 HB3 GLN A 169 48.492 20.247 17.695 1.00 0.00 H new ATOM 0 HG2 GLN A 169 46.216 18.257 17.209 1.00 0.00 H new ATOM 0 HG3 GLN A 169 47.904 17.948 16.855 1.00 0.00 H new ATOM 0 HE21 GLN A 169 49.361 17.483 18.624 1.00 0.00 H new ATOM 0 HE22 GLN A 169 48.773 17.285 20.278 1.00 0.00 H new ATOM 823 N ILE B 214 49.612 11.914 17.283 1.00 0.00 N ATOM 824 CA ILE B 214 49.699 13.214 16.629 1.00 0.00 C ATOM 825 C ILE B 214 49.392 13.087 15.141 1.00 0.00 C ATOM 826 O ILE B 214 49.636 12.043 14.535 1.00 0.00 O ATOM 827 CB ILE B 214 51.100 13.799 16.816 1.00 0.00 C ATOM 828 CG1 ILE B 214 51.349 14.056 18.304 1.00 0.00 C ATOM 829 CG2 ILE B 214 51.211 15.117 16.047 1.00 0.00 C ATOM 830 CD1 ILE B 214 52.821 14.414 18.521 1.00 0.00 C ATOM 0 HA ILE B 214 48.964 13.879 17.083 1.00 0.00 H new ATOM 0 HB ILE B 214 51.841 13.095 16.438 1.00 0.00 H new ATOM 0 HG12 ILE B 214 50.711 14.867 18.656 1.00 0.00 H new ATOM 0 HG13 ILE B 214 51.089 13.171 18.885 1.00 0.00 H new ATOM 0 HG21 ILE B 214 52.209 15.533 16.181 1.00 0.00 H new ATOM 0 HG22 ILE B 214 51.032 14.936 14.987 1.00 0.00 H new ATOM 0 HG23 ILE B 214 50.470 15.822 16.425 1.00 0.00 H new ATOM 0 HD11 ILE B 214 52.999 14.597 19.581 1.00 0.00 H new ATOM 0 HD12 ILE B 214 53.449 13.589 18.185 1.00 0.00 H new ATOM 0 HD13 ILE B 214 53.065 15.311 17.952 1.00 0.00 H new ATOM 842 N VAL B 215 48.857 14.155 14.559 1.00 0.00 N ATOM 843 CA VAL B 215 48.524 14.152 13.139 1.00 0.00 C ATOM 844 C VAL B 215 49.542 14.963 12.346 1.00 0.00 C ATOM 845 O VAL B 215 49.949 16.047 12.766 1.00 0.00 O ATOM 846 CB VAL B 215 47.127 14.739 12.930 1.00 0.00 C ATOM 847 CG1 VAL B 215 46.896 14.989 11.439 1.00 0.00 C ATOM 848 CG2 VAL B 215 46.078 13.753 13.449 1.00 0.00 C ATOM 0 H VAL B 215 48.646 15.027 15.044 1.00 0.00 H new ATOM 0 HA VAL B 215 48.543 13.122 12.784 1.00 0.00 H new ATOM 0 HB VAL B 215 47.043 15.680 13.473 1.00 0.00 H new ATOM 0 HG11 VAL B 215 45.901 15.407 11.290 1.00 0.00 H new ATOM 0 HG12 VAL B 215 47.643 15.690 11.068 1.00 0.00 H new ATOM 0 HG13 VAL B 215 46.979 14.048 10.895 1.00 0.00 H new ATOM 0 HG21 VAL B 215 45.082 14.170 13.301 1.00 0.00 H new ATOM 0 HG22 VAL B 215 46.162 12.812 12.905 1.00 0.00 H new ATOM 0 HG23 VAL B 215 46.242 13.573 14.512 1.00 0.00 H new ATOM 858 N THR B 216 49.950 14.432 11.198 1.00 0.00 N ATOM 859 CA THR B 216 50.924 15.117 10.355 1.00 0.00 C ATOM 860 C THR B 216 50.429 15.187 8.913 1.00 0.00 C ATOM 861 O THR B 216 49.542 14.432 8.514 1.00 0.00 O ATOM 862 CB THR B 216 52.264 14.378 10.400 1.00 0.00 C ATOM 863 OG1 THR B 216 52.110 13.085 9.832 1.00 0.00 O ATOM 864 CG2 THR B 216 52.728 14.247 11.852 1.00 0.00 C ATOM 0 H THR B 216 49.625 13.537 10.832 1.00 0.00 H new ATOM 0 HA THR B 216 51.055 16.131 10.733 1.00 0.00 H new ATOM 0 HB THR B 216 53.007 14.938 9.832 1.00 0.00 H new ATOM 0 HG1 THR B 216 51.416 12.594 10.320 1.00 0.00 H new ATOM 0 HG21 THR B 216 53.682 13.721 11.883 1.00 0.00 H new ATOM 0 HG22 THR B 216 52.847 15.239 12.287 1.00 0.00 H new ATOM 0 HG23 THR B 216 51.986 13.687 12.422 1.00 0.00 H new ATOM 872 N ASP B 217 51.007 16.098 8.139 1.00 0.00 N ATOM 873 CA ASP B 217 50.607 16.265 6.746 1.00 0.00 C ATOM 874 C ASP B 217 50.774 14.957 5.980 1.00 0.00 C ATOM 875 O ASP B 217 49.806 14.403 5.459 1.00 0.00 O ATOM 876 CB ASP B 217 51.453 17.357 6.087 1.00 0.00 C ATOM 877 CG ASP B 217 51.045 17.522 4.627 1.00 0.00 C ATOM 878 OD1 ASP B 217 49.896 17.854 4.388 1.00 0.00 O ATOM 879 OD2 ASP B 217 51.888 17.315 3.769 1.00 0.00 O ATOM 0 H ASP B 217 51.748 16.728 8.448 1.00 0.00 H new ATOM 0 HA ASP B 217 49.557 16.555 6.721 1.00 0.00 H new ATOM 0 HB2 ASP B 217 51.323 18.300 6.618 1.00 0.00 H new ATOM 0 HB3 ASP B 217 52.510 17.098 6.151 1.00 0.00 H new ATOM 884 N GLU B 218 52.008 14.467 5.916 1.00 0.00 N ATOM 885 CA GLU B 218 52.289 13.219 5.215 1.00 0.00 C ATOM 886 C GLU B 218 51.123 12.247 5.362 1.00 0.00 C ATOM 887 O GLU B 218 50.807 11.498 4.438 1.00 0.00 O ATOM 888 CB GLU B 218 53.561 12.581 5.776 1.00 0.00 C ATOM 889 CG GLU B 218 54.771 13.439 5.403 1.00 0.00 C ATOM 890 CD GLU B 218 56.040 12.834 5.992 1.00 0.00 C ATOM 891 OE1 GLU B 218 55.982 12.355 7.112 1.00 0.00 O ATOM 892 OE2 GLU B 218 57.054 12.859 5.314 1.00 0.00 O ATOM 0 H GLU B 218 52.824 14.911 6.338 1.00 0.00 H new ATOM 0 HA GLU B 218 52.430 13.442 4.157 1.00 0.00 H new ATOM 0 HB2 GLU B 218 53.487 12.490 6.860 1.00 0.00 H new ATOM 0 HB3 GLU B 218 53.680 11.573 5.379 1.00 0.00 H new ATOM 0 HG2 GLU B 218 54.859 13.506 4.319 1.00 0.00 H new ATOM 0 HG3 GLU B 218 54.636 14.455 5.775 1.00 0.00 H new ATOM 899 N ASP B 219 50.486 12.266 6.529 1.00 0.00 N ATOM 900 CA ASP B 219 49.367 11.369 6.792 1.00 0.00 C ATOM 901 C ASP B 219 48.110 11.858 6.078 1.00 0.00 C ATOM 902 O ASP B 219 47.357 11.064 5.513 1.00 0.00 O ATOM 903 CB ASP B 219 49.103 11.290 8.296 1.00 0.00 C ATOM 904 CG ASP B 219 50.282 10.622 8.996 1.00 0.00 C ATOM 905 OD1 ASP B 219 50.998 9.886 8.337 1.00 0.00 O ATOM 906 OD2 ASP B 219 50.450 10.855 10.182 1.00 0.00 O ATOM 0 H ASP B 219 50.723 12.888 7.302 1.00 0.00 H new ATOM 0 HA ASP B 219 49.623 10.378 6.416 1.00 0.00 H new ATOM 0 HB2 ASP B 219 48.949 12.291 8.700 1.00 0.00 H new ATOM 0 HB3 ASP B 219 48.190 10.726 8.485 1.00 0.00 H new ATOM 911 N ILE B 220 47.888 13.168 6.111 1.00 0.00 N ATOM 912 CA ILE B 220 46.716 13.751 5.466 1.00 0.00 C ATOM 913 C ILE B 220 46.807 13.602 3.951 1.00 0.00 C ATOM 914 O ILE B 220 45.824 13.262 3.292 1.00 0.00 O ATOM 915 CB ILE B 220 46.603 15.232 5.829 1.00 0.00 C ATOM 916 CG1 ILE B 220 46.586 15.383 7.352 1.00 0.00 C ATOM 917 CG2 ILE B 220 45.311 15.805 5.246 1.00 0.00 C ATOM 918 CD1 ILE B 220 45.457 14.532 7.937 1.00 0.00 C ATOM 0 H ILE B 220 48.498 13.842 6.573 1.00 0.00 H new ATOM 0 HA ILE B 220 45.831 13.222 5.818 1.00 0.00 H new ATOM 0 HB ILE B 220 47.456 15.772 5.419 1.00 0.00 H new ATOM 0 HG12 ILE B 220 47.544 15.072 7.770 1.00 0.00 H new ATOM 0 HG13 ILE B 220 46.445 16.429 7.623 1.00 0.00 H new ATOM 0 HG21 ILE B 220 45.232 16.861 5.505 1.00 0.00 H new ATOM 0 HG22 ILE B 220 45.322 15.698 4.161 1.00 0.00 H new ATOM 0 HG23 ILE B 220 44.457 15.266 5.655 1.00 0.00 H new ATOM 0 HD11 ILE B 220 45.445 14.639 9.022 1.00 0.00 H new ATOM 0 HD12 ILE B 220 44.502 14.864 7.529 1.00 0.00 H new ATOM 0 HD13 ILE B 220 45.618 13.486 7.678 1.00 0.00 H new ATOM 930 N ARG B 221 47.992 13.857 3.406 1.00 0.00 N ATOM 931 CA ARG B 221 48.195 13.760 1.965 1.00 0.00 C ATOM 932 C ARG B 221 47.811 12.373 1.460 1.00 0.00 C ATOM 933 O ARG B 221 46.912 12.231 0.631 1.00 0.00 O ATOM 934 CB ARG B 221 49.660 14.041 1.624 1.00 0.00 C ATOM 935 CG ARG B 221 49.842 14.037 0.105 1.00 0.00 C ATOM 936 CD ARG B 221 51.325 14.198 -0.233 1.00 0.00 C ATOM 937 NE ARG B 221 51.798 15.513 0.186 1.00 0.00 N ATOM 938 CZ ARG B 221 51.666 16.574 -0.603 1.00 0.00 C ATOM 939 NH1 ARG B 221 51.105 16.451 -1.774 1.00 0.00 N ATOM 940 NH2 ARG B 221 52.098 17.740 -0.206 1.00 0.00 N ATOM 0 H ARG B 221 48.820 14.130 3.935 1.00 0.00 H new ATOM 0 HA ARG B 221 47.559 14.500 1.478 1.00 0.00 H new ATOM 0 HB2 ARG B 221 49.961 15.005 2.034 1.00 0.00 H new ATOM 0 HB3 ARG B 221 50.301 13.286 2.079 1.00 0.00 H new ATOM 0 HG2 ARG B 221 49.462 13.106 -0.315 1.00 0.00 H new ATOM 0 HG3 ARG B 221 49.266 14.847 -0.343 1.00 0.00 H new ATOM 0 HD2 ARG B 221 51.905 13.420 0.263 1.00 0.00 H new ATOM 0 HD3 ARG B 221 51.477 14.074 -1.305 1.00 0.00 H new ATOM 0 HE ARG B 221 52.238 15.620 1.100 1.00 0.00 H new ATOM 0 HH11 ARG B 221 50.767 15.540 -2.085 1.00 0.00 H new ATOM 0 HH12 ARG B 221 51.004 17.266 -2.379 1.00 0.00 H new ATOM 0 HH21 ARG B 221 52.537 17.837 0.710 1.00 0.00 H new ATOM 0 HH22 ARG B 221 51.997 18.555 -0.811 1.00 0.00 H new ATOM 954 N LYS B 222 48.499 11.353 1.964 1.00 0.00 N ATOM 955 CA LYS B 222 48.224 9.981 1.549 1.00 0.00 C ATOM 956 C LYS B 222 46.728 9.690 1.608 1.00 0.00 C ATOM 957 O LYS B 222 46.188 8.989 0.753 1.00 0.00 O ATOM 958 CB LYS B 222 48.973 9.001 2.456 1.00 0.00 C ATOM 959 CG LYS B 222 49.071 7.640 1.764 1.00 0.00 C ATOM 960 CD LYS B 222 49.962 6.710 2.590 1.00 0.00 C ATOM 961 CE LYS B 222 50.116 5.373 1.863 1.00 0.00 C ATOM 962 NZ LYS B 222 48.780 4.728 1.720 1.00 0.00 N ATOM 0 H LYS B 222 49.244 11.448 2.654 1.00 0.00 H new ATOM 0 HA LYS B 222 48.565 9.858 0.521 1.00 0.00 H new ATOM 0 HB2 LYS B 222 49.970 9.382 2.676 1.00 0.00 H new ATOM 0 HB3 LYS B 222 48.453 8.900 3.409 1.00 0.00 H new ATOM 0 HG2 LYS B 222 48.078 7.205 1.652 1.00 0.00 H new ATOM 0 HG3 LYS B 222 49.482 7.759 0.761 1.00 0.00 H new ATOM 0 HD2 LYS B 222 50.939 7.167 2.744 1.00 0.00 H new ATOM 0 HD3 LYS B 222 49.525 6.552 3.576 1.00 0.00 H new ATOM 0 HE2 LYS B 222 50.563 5.530 0.881 1.00 0.00 H new ATOM 0 HE3 LYS B 222 50.789 4.720 2.419 1.00 0.00 H new ATOM 0 HZ1 LYS B 222 48.903 3.713 1.531 1.00 0.00 H new ATOM 0 HZ2 LYS B 222 48.238 4.853 2.599 1.00 0.00 H new ATOM 0 HZ3 LYS B 222 48.265 5.167 0.930 1.00 0.00 H new ATOM 976 N GLN B 223 46.065 10.234 2.624 1.00 0.00 N ATOM 977 CA GLN B 223 44.631 10.020 2.788 1.00 0.00 C ATOM 978 C GLN B 223 43.854 10.716 1.675 1.00 0.00 C ATOM 979 O GLN B 223 42.897 10.163 1.134 1.00 0.00 O ATOM 980 CB GLN B 223 44.175 10.557 4.145 1.00 0.00 C ATOM 981 CG GLN B 223 44.694 9.644 5.257 1.00 0.00 C ATOM 982 CD GLN B 223 44.008 8.284 5.178 1.00 0.00 C ATOM 983 OE1 GLN B 223 42.791 8.210 5.010 1.00 0.00 O ATOM 984 NE2 GLN B 223 44.721 7.196 5.290 1.00 0.00 N ATOM 0 H GLN B 223 46.493 10.821 3.340 1.00 0.00 H new ATOM 0 HA GLN B 223 44.434 8.949 2.737 1.00 0.00 H new ATOM 0 HB2 GLN B 223 44.547 11.571 4.290 1.00 0.00 H new ATOM 0 HB3 GLN B 223 43.087 10.608 4.180 1.00 0.00 H new ATOM 0 HG2 GLN B 223 45.773 9.522 5.165 1.00 0.00 H new ATOM 0 HG3 GLN B 223 44.507 10.099 6.230 1.00 0.00 H new ATOM 0 HE21 GLN B 223 45.729 7.259 5.429 1.00 0.00 H new ATOM 0 HE22 GLN B 223 44.270 6.283 5.238 1.00 0.00 H new ATOM 993 N GLU B 224 44.271 11.932 1.340 1.00 0.00 N ATOM 994 CA GLU B 224 43.605 12.696 0.291 1.00 0.00 C ATOM 995 C GLU B 224 43.884 12.084 -1.078 1.00 0.00 C ATOM 996 O GLU B 224 43.058 12.168 -1.987 1.00 0.00 O ATOM 997 CB GLU B 224 44.091 14.146 0.312 1.00 0.00 C ATOM 998 CG GLU B 224 43.303 14.964 -0.714 1.00 0.00 C ATOM 999 CD GLU B 224 43.713 16.431 -0.637 1.00 0.00 C ATOM 1000 OE1 GLU B 224 44.688 16.719 0.038 1.00 0.00 O ATOM 1001 OE2 GLU B 224 43.044 17.245 -1.252 1.00 0.00 O ATOM 0 H GLU B 224 45.061 12.407 1.776 1.00 0.00 H new ATOM 0 HA GLU B 224 42.531 12.670 0.476 1.00 0.00 H new ATOM 0 HB2 GLU B 224 43.961 14.570 1.308 1.00 0.00 H new ATOM 0 HB3 GLU B 224 45.156 14.187 0.085 1.00 0.00 H new ATOM 0 HG2 GLU B 224 43.487 14.579 -1.717 1.00 0.00 H new ATOM 0 HG3 GLU B 224 42.234 14.866 -0.526 1.00 0.00 H new ATOM 1008 N GLU B 225 45.054 11.468 -1.218 1.00 0.00 N ATOM 1009 CA GLU B 225 45.436 10.854 -2.485 1.00 0.00 C ATOM 1010 C GLU B 225 44.488 9.711 -2.834 1.00 0.00 C ATOM 1011 O GLU B 225 44.066 9.572 -3.982 1.00 0.00 O ATOM 1012 CB GLU B 225 46.868 10.324 -2.398 1.00 0.00 C ATOM 1013 CG GLU B 225 47.846 11.500 -2.349 1.00 0.00 C ATOM 1014 CD GLU B 225 49.268 10.987 -2.142 1.00 0.00 C ATOM 1015 OE1 GLU B 225 49.437 9.780 -2.081 1.00 0.00 O ATOM 1016 OE2 GLU B 225 50.164 11.808 -2.048 1.00 0.00 O ATOM 0 H GLU B 225 45.749 11.381 -0.476 1.00 0.00 H new ATOM 0 HA GLU B 225 45.377 11.611 -3.267 1.00 0.00 H new ATOM 0 HB2 GLU B 225 46.984 9.704 -1.509 1.00 0.00 H new ATOM 0 HB3 GLU B 225 47.086 9.692 -3.259 1.00 0.00 H new ATOM 0 HG2 GLU B 225 47.788 12.071 -3.276 1.00 0.00 H new ATOM 0 HG3 GLU B 225 47.573 12.177 -1.540 1.00 0.00 H new ATOM 1023 N ARG B 226 44.160 8.895 -1.838 1.00 0.00 N ATOM 1024 CA ARG B 226 43.268 7.762 -2.054 1.00 0.00 C ATOM 1025 C ARG B 226 41.890 8.243 -2.500 1.00 0.00 C ATOM 1026 O ARG B 226 41.283 7.666 -3.401 1.00 0.00 O ATOM 1027 CB ARG B 226 43.135 6.950 -0.765 1.00 0.00 C ATOM 1028 CG ARG B 226 44.465 6.261 -0.456 1.00 0.00 C ATOM 1029 CD ARG B 226 44.268 5.257 0.682 1.00 0.00 C ATOM 1030 NE ARG B 226 43.827 5.943 1.890 1.00 0.00 N ATOM 1031 CZ ARG B 226 43.403 5.264 2.951 1.00 0.00 C ATOM 1032 NH1 ARG B 226 43.377 3.959 2.922 1.00 0.00 N ATOM 1033 NH2 ARG B 226 43.013 5.902 4.021 1.00 0.00 N ATOM 0 H ARG B 226 44.496 8.996 -0.880 1.00 0.00 H new ATOM 0 HA ARG B 226 43.692 7.133 -2.837 1.00 0.00 H new ATOM 0 HB2 ARG B 226 42.851 7.603 0.061 1.00 0.00 H new ATOM 0 HB3 ARG B 226 42.344 6.207 -0.871 1.00 0.00 H new ATOM 0 HG2 ARG B 226 44.838 5.751 -1.344 1.00 0.00 H new ATOM 0 HG3 ARG B 226 45.214 7.002 -0.176 1.00 0.00 H new ATOM 0 HD2 ARG B 226 43.532 4.508 0.392 1.00 0.00 H new ATOM 0 HD3 ARG B 226 45.201 4.729 0.876 1.00 0.00 H new ATOM 0 HE ARG B 226 43.844 6.962 1.922 1.00 0.00 H new ATOM 0 HH11 ARG B 226 43.682 3.461 2.086 1.00 0.00 H new ATOM 0 HH12 ARG B 226 43.052 3.437 3.736 1.00 0.00 H new ATOM 0 HH21 ARG B 226 43.034 6.922 4.043 1.00 0.00 H new ATOM 0 HH22 ARG B 226 42.688 5.381 4.835 1.00 0.00 H new ATOM 1047 N VAL B 227 41.403 9.302 -1.861 1.00 0.00 N ATOM 1048 CA VAL B 227 40.099 9.856 -2.206 1.00 0.00 C ATOM 1049 C VAL B 227 40.122 10.449 -3.612 1.00 0.00 C ATOM 1050 O VAL B 227 39.177 10.279 -4.383 1.00 0.00 O ATOM 1051 CB VAL B 227 39.711 10.941 -1.199 1.00 0.00 C ATOM 1052 CG1 VAL B 227 38.456 11.665 -1.688 1.00 0.00 C ATOM 1053 CG2 VAL B 227 39.429 10.295 0.159 1.00 0.00 C ATOM 0 H VAL B 227 41.887 9.790 -1.108 1.00 0.00 H new ATOM 0 HA VAL B 227 39.364 9.052 -2.176 1.00 0.00 H new ATOM 0 HB VAL B 227 40.528 11.656 -1.101 1.00 0.00 H new ATOM 0 HG11 VAL B 227 38.179 12.438 -0.971 1.00 0.00 H new ATOM 0 HG12 VAL B 227 38.654 12.123 -2.657 1.00 0.00 H new ATOM 0 HG13 VAL B 227 37.638 10.951 -1.785 1.00 0.00 H new ATOM 0 HG21 VAL B 227 39.152 11.066 0.878 1.00 0.00 H new ATOM 0 HG22 VAL B 227 38.611 9.581 0.060 1.00 0.00 H new ATOM 0 HG23 VAL B 227 40.322 9.777 0.508 1.00 0.00 H new ATOM 1063 N GLN B 228 41.206 11.143 -3.938 1.00 0.00 N ATOM 1064 CA GLN B 228 41.333 11.773 -5.247 1.00 0.00 C ATOM 1065 C GLN B 228 41.203 10.734 -6.357 1.00 0.00 C ATOM 1066 O GLN B 228 40.556 10.977 -7.375 1.00 0.00 O ATOM 1067 CB GLN B 228 42.687 12.476 -5.360 1.00 0.00 C ATOM 1068 CG GLN B 228 42.769 13.215 -6.698 1.00 0.00 C ATOM 1069 CD GLN B 228 44.089 13.971 -6.795 1.00 0.00 C ATOM 1070 OE1 GLN B 228 44.729 14.239 -5.778 1.00 0.00 O ATOM 1071 NE2 GLN B 228 44.537 14.336 -7.965 1.00 0.00 N ATOM 0 H GLN B 228 42.005 11.283 -3.319 1.00 0.00 H new ATOM 0 HA GLN B 228 40.533 12.506 -5.355 1.00 0.00 H new ATOM 0 HB2 GLN B 228 42.814 13.178 -4.536 1.00 0.00 H new ATOM 0 HB3 GLN B 228 43.494 11.747 -5.285 1.00 0.00 H new ATOM 0 HG2 GLN B 228 42.686 12.505 -7.521 1.00 0.00 H new ATOM 0 HG3 GLN B 228 41.935 13.910 -6.791 1.00 0.00 H new ATOM 0 HE21 GLN B 228 44.006 14.113 -8.807 1.00 0.00 H new ATOM 0 HE22 GLN B 228 45.418 14.844 -8.038 1.00 0.00 H new ATOM 1080 N GLN B 229 41.823 9.576 -6.151 1.00 0.00 N ATOM 1081 CA GLN B 229 41.776 8.509 -7.144 1.00 0.00 C ATOM 1082 C GLN B 229 40.346 8.009 -7.327 1.00 0.00 C ATOM 1083 O GLN B 229 39.912 7.736 -8.446 1.00 0.00 O ATOM 1084 CB GLN B 229 42.673 7.349 -6.708 1.00 0.00 C ATOM 1085 CG GLN B 229 44.135 7.798 -6.730 1.00 0.00 C ATOM 1086 CD GLN B 229 44.562 8.114 -8.160 1.00 0.00 C ATOM 1087 OE1 GLN B 229 44.366 7.299 -9.062 1.00 0.00 O ATOM 1088 NE2 GLN B 229 45.138 9.255 -8.423 1.00 0.00 N ATOM 0 H GLN B 229 42.360 9.354 -5.313 1.00 0.00 H new ATOM 0 HA GLN B 229 42.134 8.907 -8.094 1.00 0.00 H new ATOM 0 HB2 GLN B 229 42.398 7.019 -5.706 1.00 0.00 H new ATOM 0 HB3 GLN B 229 42.533 6.497 -7.374 1.00 0.00 H new ATOM 0 HG2 GLN B 229 44.263 8.679 -6.100 1.00 0.00 H new ATOM 0 HG3 GLN B 229 44.771 7.015 -6.316 1.00 0.00 H new ATOM 0 HE21 GLN B 229 45.300 9.929 -7.675 1.00 0.00 H new ATOM 0 HE22 GLN B 229 45.427 9.473 -9.377 1.00 0.00 H new ATOM 1097 N VAL B 230 39.620 7.891 -6.220 1.00 0.00 N ATOM 1098 CA VAL B 230 38.238 7.428 -6.271 1.00 0.00 C ATOM 1099 C VAL B 230 37.389 8.370 -7.118 1.00 0.00 C ATOM 1100 O VAL B 230 36.593 7.928 -7.946 1.00 0.00 O ATOM 1101 CB VAL B 230 37.661 7.349 -4.856 1.00 0.00 C ATOM 1102 CG1 VAL B 230 36.154 7.101 -4.933 1.00 0.00 C ATOM 1103 CG2 VAL B 230 38.329 6.199 -4.099 1.00 0.00 C ATOM 0 H VAL B 230 39.962 8.108 -5.284 1.00 0.00 H new ATOM 0 HA VAL B 230 38.223 6.437 -6.724 1.00 0.00 H new ATOM 0 HB VAL B 230 37.848 8.287 -4.333 1.00 0.00 H new ATOM 0 HG11 VAL B 230 35.743 7.045 -3.925 1.00 0.00 H new ATOM 0 HG12 VAL B 230 35.678 7.919 -5.474 1.00 0.00 H new ATOM 0 HG13 VAL B 230 35.966 6.163 -5.455 1.00 0.00 H new ATOM 0 HG21 VAL B 230 37.919 6.141 -3.091 1.00 0.00 H new ATOM 0 HG22 VAL B 230 38.141 5.261 -4.622 1.00 0.00 H new ATOM 0 HG23 VAL B 230 39.403 6.375 -4.045 1.00 0.00 H new ATOM 1113 N ARG B 231 37.562 9.670 -6.903 1.00 0.00 N ATOM 1114 CA ARG B 231 36.809 10.665 -7.658 1.00 0.00 C ATOM 1115 C ARG B 231 37.216 10.644 -9.127 1.00 0.00 C ATOM 1116 O ARG B 231 36.382 10.817 -10.015 1.00 0.00 O ATOM 1117 CB ARG B 231 37.057 12.059 -7.077 1.00 0.00 C ATOM 1118 CG ARG B 231 36.395 12.166 -5.702 1.00 0.00 C ATOM 1119 CD ARG B 231 36.705 13.533 -5.090 1.00 0.00 C ATOM 1120 NE ARG B 231 36.101 13.642 -3.767 1.00 0.00 N ATOM 1121 CZ ARG B 231 36.368 14.673 -2.973 1.00 0.00 C ATOM 1122 NH1 ARG B 231 37.179 15.613 -3.374 1.00 0.00 N ATOM 1123 NH2 ARG B 231 35.817 14.748 -1.792 1.00 0.00 N ATOM 0 H ARG B 231 38.211 10.057 -6.218 1.00 0.00 H new ATOM 0 HA ARG B 231 35.749 10.424 -7.584 1.00 0.00 H new ATOM 0 HB2 ARG B 231 38.128 12.243 -6.992 1.00 0.00 H new ATOM 0 HB3 ARG B 231 36.655 12.820 -7.746 1.00 0.00 H new ATOM 0 HG2 ARG B 231 35.317 12.033 -5.795 1.00 0.00 H new ATOM 0 HG3 ARG B 231 36.759 11.373 -5.049 1.00 0.00 H new ATOM 0 HD2 ARG B 231 37.784 13.671 -5.018 1.00 0.00 H new ATOM 0 HD3 ARG B 231 36.325 14.324 -5.737 1.00 0.00 H new ATOM 0 HE ARG B 231 35.463 12.914 -3.446 1.00 0.00 H new ATOM 0 HH11 ARG B 231 37.608 15.556 -4.298 1.00 0.00 H new ATOM 0 HH12 ARG B 231 37.384 16.404 -2.764 1.00 0.00 H new ATOM 0 HH21 ARG B 231 35.181 14.015 -1.478 1.00 0.00 H new ATOM 0 HH22 ARG B 231 36.022 15.540 -1.183 1.00 0.00 H new ATOM 1137 N LYS B 232 38.505 10.431 -9.376 1.00 0.00 N ATOM 1138 CA LYS B 232 39.014 10.398 -10.742 1.00 0.00 C ATOM 1139 C LYS B 232 38.267 9.354 -11.566 1.00 0.00 C ATOM 1140 O LYS B 232 37.769 9.647 -12.653 1.00 0.00 O ATOM 1141 CB LYS B 232 40.508 10.072 -10.736 1.00 0.00 C ATOM 1142 CG LYS B 232 41.053 10.144 -12.164 1.00 0.00 C ATOM 1143 CD LYS B 232 42.564 9.904 -12.146 1.00 0.00 C ATOM 1144 CE LYS B 232 43.109 9.983 -13.574 1.00 0.00 C ATOM 1145 NZ LYS B 232 44.588 9.797 -13.551 1.00 0.00 N ATOM 0 H LYS B 232 39.211 10.280 -8.655 1.00 0.00 H new ATOM 0 HA LYS B 232 38.859 11.379 -11.191 1.00 0.00 H new ATOM 0 HB2 LYS B 232 41.042 10.775 -10.096 1.00 0.00 H new ATOM 0 HB3 LYS B 232 40.672 9.077 -10.323 1.00 0.00 H new ATOM 0 HG2 LYS B 232 40.563 9.398 -12.790 1.00 0.00 H new ATOM 0 HG3 LYS B 232 40.834 11.119 -12.600 1.00 0.00 H new ATOM 0 HD2 LYS B 232 43.054 10.647 -11.517 1.00 0.00 H new ATOM 0 HD3 LYS B 232 42.783 8.927 -11.715 1.00 0.00 H new ATOM 0 HE2 LYS B 232 42.645 9.217 -14.195 1.00 0.00 H new ATOM 0 HE3 LYS B 232 42.860 10.947 -14.017 1.00 0.00 H new ATOM 0 HZ1 LYS B 232 44.960 9.850 -14.521 1.00 0.00 H new ATOM 0 HZ2 LYS B 232 45.023 10.543 -12.972 1.00 0.00 H new ATOM 0 HZ3 LYS B 232 44.815 8.867 -13.144 1.00 0.00 H new ATOM 1159 N LYS B 233 38.191 8.136 -11.040 1.00 0.00 N ATOM 1160 CA LYS B 233 37.494 7.058 -11.732 1.00 0.00 C ATOM 1161 C LYS B 233 35.984 7.247 -11.632 1.00 0.00 C ATOM 1162 O LYS B 233 35.287 7.298 -12.645 1.00 0.00 O ATOM 1163 CB LYS B 233 37.883 5.709 -11.123 1.00 0.00 C ATOM 1164 CG LYS B 233 39.348 5.408 -11.441 1.00 0.00 C ATOM 1165 CD LYS B 233 39.751 4.084 -10.789 1.00 0.00 C ATOM 1166 CE LYS B 233 41.226 3.799 -11.080 1.00 0.00 C ATOM 1167 NZ LYS B 233 41.390 3.450 -12.519 1.00 0.00 N ATOM 0 H LYS B 233 38.600 7.872 -10.144 1.00 0.00 H new ATOM 0 HA LYS B 233 37.783 7.079 -12.783 1.00 0.00 H new ATOM 0 HB2 LYS B 233 37.731 5.728 -10.044 1.00 0.00 H new ATOM 0 HB3 LYS B 233 37.244 4.921 -11.521 1.00 0.00 H new ATOM 0 HG2 LYS B 233 39.493 5.353 -12.520 1.00 0.00 H new ATOM 0 HG3 LYS B 233 39.984 6.214 -11.075 1.00 0.00 H new ATOM 0 HD2 LYS B 233 39.584 4.131 -9.713 1.00 0.00 H new ATOM 0 HD3 LYS B 233 39.131 3.274 -11.173 1.00 0.00 H new ATOM 0 HE2 LYS B 233 41.831 4.672 -10.835 1.00 0.00 H new ATOM 0 HE3 LYS B 233 41.580 2.980 -10.454 1.00 0.00 H new ATOM 0 HZ1 LYS B 233 42.323 3.015 -12.667 1.00 0.00 H new ATOM 0 HZ2 LYS B 233 40.647 2.779 -12.800 1.00 0.00 H new ATOM 0 HZ3 LYS B 233 41.315 4.312 -13.096 1.00 0.00 H new ATOM 1181 N LEU B 234 35.486 7.351 -10.405 1.00 0.00 N ATOM 1182 CA LEU B 234 34.057 7.541 -10.185 1.00 0.00 C ATOM 1183 C LEU B 234 33.472 8.473 -11.242 1.00 0.00 C ATOM 1184 O LEU B 234 32.499 8.132 -11.913 1.00 0.00 O ATOM 1185 CB LEU B 234 33.816 8.130 -8.794 1.00 0.00 C ATOM 1186 CG LEU B 234 32.318 8.363 -8.590 1.00 0.00 C ATOM 1187 CD1 LEU B 234 31.567 7.041 -8.758 1.00 0.00 C ATOM 1188 CD2 LEU B 234 32.075 8.911 -7.182 1.00 0.00 C ATOM 0 H LEU B 234 36.046 7.307 -9.553 1.00 0.00 H new ATOM 0 HA LEU B 234 33.565 6.571 -10.259 1.00 0.00 H new ATOM 0 HB2 LEU B 234 34.197 7.452 -8.030 1.00 0.00 H new ATOM 0 HB3 LEU B 234 34.359 9.069 -8.686 1.00 0.00 H new ATOM 0 HG LEU B 234 31.959 9.081 -9.328 1.00 0.00 H new ATOM 0 HD11 LEU B 234 30.500 7.208 -8.612 1.00 0.00 H new ATOM 0 HD12 LEU B 234 31.740 6.649 -9.760 1.00 0.00 H new ATOM 0 HD13 LEU B 234 31.926 6.323 -8.021 1.00 0.00 H new ATOM 0 HD21 LEU B 234 31.008 9.077 -7.036 1.00 0.00 H new ATOM 0 HD22 LEU B 234 32.435 8.193 -6.445 1.00 0.00 H new ATOM 0 HD23 LEU B 234 32.609 9.853 -7.061 1.00 0.00 H new ATOM 1200 N GLU B 235 34.073 9.650 -11.384 1.00 0.00 N ATOM 1201 CA GLU B 235 33.607 10.620 -12.368 1.00 0.00 C ATOM 1202 C GLU B 235 33.801 10.082 -13.781 1.00 0.00 C ATOM 1203 O GLU B 235 32.954 10.277 -14.653 1.00 0.00 O ATOM 1204 CB GLU B 235 34.375 11.934 -12.210 1.00 0.00 C ATOM 1205 CG GLU B 235 33.817 12.971 -13.186 1.00 0.00 C ATOM 1206 CD GLU B 235 32.392 13.345 -12.793 1.00 0.00 C ATOM 1207 OE1 GLU B 235 31.964 12.928 -11.730 1.00 0.00 O ATOM 1208 OE2 GLU B 235 31.751 14.043 -13.561 1.00 0.00 O ATOM 0 H GLU B 235 34.877 9.953 -10.835 1.00 0.00 H new ATOM 0 HA GLU B 235 32.545 10.798 -12.201 1.00 0.00 H new ATOM 0 HB2 GLU B 235 34.287 12.298 -11.186 1.00 0.00 H new ATOM 0 HB3 GLU B 235 35.436 11.773 -12.401 1.00 0.00 H new ATOM 0 HG2 GLU B 235 34.448 13.860 -13.185 1.00 0.00 H new ATOM 0 HG3 GLU B 235 33.830 12.572 -14.200 1.00 0.00 H new ATOM 1215 N GLU B 236 34.922 9.403 -14.001 1.00 0.00 N ATOM 1216 CA GLU B 236 35.219 8.841 -15.314 1.00 0.00 C ATOM 1217 C GLU B 236 34.108 7.893 -15.753 1.00 0.00 C ATOM 1218 O GLU B 236 33.631 7.964 -16.887 1.00 0.00 O ATOM 1219 CB GLU B 236 36.548 8.086 -15.270 1.00 0.00 C ATOM 1220 CG GLU B 236 36.902 7.591 -16.674 1.00 0.00 C ATOM 1221 CD GLU B 236 37.154 8.779 -17.597 1.00 0.00 C ATOM 1222 OE1 GLU B 236 37.418 9.854 -17.087 1.00 0.00 O ATOM 1223 OE2 GLU B 236 37.078 8.595 -18.800 1.00 0.00 O ATOM 0 H GLU B 236 35.635 9.229 -13.293 1.00 0.00 H new ATOM 0 HA GLU B 236 35.290 9.658 -16.032 1.00 0.00 H new ATOM 0 HB2 GLU B 236 37.336 8.738 -14.893 1.00 0.00 H new ATOM 0 HB3 GLU B 236 36.477 7.243 -14.583 1.00 0.00 H new ATOM 0 HG2 GLU B 236 37.788 6.957 -16.633 1.00 0.00 H new ATOM 0 HG3 GLU B 236 36.091 6.979 -17.068 1.00 0.00 H new ATOM 1230 N ALA B 237 33.699 7.008 -14.851 1.00 0.00 N ATOM 1231 CA ALA B 237 32.641 6.051 -15.158 1.00 0.00 C ATOM 1232 C ALA B 237 31.337 6.779 -15.467 1.00 0.00 C ATOM 1233 O ALA B 237 30.461 6.242 -16.145 1.00 0.00 O ATOM 1234 CB ALA B 237 32.433 5.104 -13.975 1.00 0.00 C ATOM 0 H ALA B 237 34.080 6.933 -13.908 1.00 0.00 H new ATOM 0 HA ALA B 237 32.939 5.475 -16.034 1.00 0.00 H new ATOM 0 HB1 ALA B 237 31.642 4.393 -14.213 1.00 0.00 H new ATOM 0 HB2 ALA B 237 33.358 4.564 -13.775 1.00 0.00 H new ATOM 0 HB3 ALA B 237 32.151 5.680 -13.093 1.00 0.00 H new ATOM 1240 N LEU B 238 31.215 8.003 -14.964 1.00 0.00 N ATOM 1241 CA LEU B 238 30.011 8.794 -15.187 1.00 0.00 C ATOM 1242 C LEU B 238 30.104 9.546 -16.510 1.00 0.00 C ATOM 1243 O LEU B 238 29.093 9.787 -17.171 1.00 0.00 O ATOM 1244 CB LEU B 238 29.820 9.791 -14.043 1.00 0.00 C ATOM 1245 CG LEU B 238 29.559 9.031 -12.742 1.00 0.00 C ATOM 1246 CD1 LEU B 238 29.541 10.014 -11.570 1.00 0.00 C ATOM 1247 CD2 LEU B 238 28.205 8.321 -12.831 1.00 0.00 C ATOM 0 H LEU B 238 31.930 8.466 -14.403 1.00 0.00 H new ATOM 0 HA LEU B 238 29.156 8.118 -15.224 1.00 0.00 H new ATOM 0 HB2 LEU B 238 30.707 10.416 -13.940 1.00 0.00 H new ATOM 0 HB3 LEU B 238 28.985 10.456 -14.262 1.00 0.00 H new ATOM 0 HG LEU B 238 30.348 8.295 -12.587 1.00 0.00 H new ATOM 0 HD11 LEU B 238 29.355 9.472 -10.643 1.00 0.00 H new ATOM 0 HD12 LEU B 238 30.503 10.522 -11.506 1.00 0.00 H new ATOM 0 HD13 LEU B 238 28.752 10.750 -11.724 1.00 0.00 H new ATOM 0 HD21 LEU B 238 28.017 7.779 -11.904 1.00 0.00 H new ATOM 0 HD22 LEU B 238 27.417 9.058 -12.986 1.00 0.00 H new ATOM 0 HD23 LEU B 238 28.216 7.620 -13.666 1.00 0.00 H new ATOM 1259 N MET B 239 31.322 9.914 -16.891 1.00 0.00 N ATOM 1260 CA MET B 239 31.536 10.642 -18.137 1.00 0.00 C ATOM 1261 C MET B 239 31.058 9.817 -19.327 1.00 0.00 C ATOM 1262 O MET B 239 30.450 10.346 -20.257 1.00 0.00 O ATOM 1263 CB MET B 239 33.022 10.968 -18.302 1.00 0.00 C ATOM 1264 CG MET B 239 33.402 12.114 -17.362 1.00 0.00 C ATOM 1265 SD MET B 239 32.543 13.623 -17.873 1.00 0.00 S ATOM 1266 CE MET B 239 33.389 13.839 -19.458 1.00 0.00 C ATOM 0 H MET B 239 32.171 9.722 -16.360 1.00 0.00 H new ATOM 0 HA MET B 239 30.963 11.569 -18.099 1.00 0.00 H new ATOM 0 HB2 MET B 239 33.625 10.087 -18.081 1.00 0.00 H new ATOM 0 HB3 MET B 239 33.231 11.246 -19.335 1.00 0.00 H new ATOM 0 HG2 MET B 239 33.135 11.861 -16.336 1.00 0.00 H new ATOM 0 HG3 MET B 239 34.480 12.272 -17.381 1.00 0.00 H new ATOM 0 HE1 MET B 239 33.426 14.899 -19.709 1.00 0.00 H new ATOM 0 HE2 MET B 239 34.404 13.448 -19.385 1.00 0.00 H new ATOM 0 HE3 MET B 239 32.847 13.301 -20.236 1.00 0.00 H new