USER MOD reduce.3.24.130724 H: found=0, std=0, add=512, rem=0, adj=8 USER MOD reduce.3.24.130724 removed 512 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 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 145 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 146 TYR OH : rot 180:sc= 0 USER MOD Single : A 151 GLN : amide:sc= -3.02 K(o=-3,f=-6.6!) USER MOD Single : A 156 LYS NZ :NH3+ -177:sc= 0.623 (180deg=0.614) USER MOD Single : A 166 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 167 ASN : amide:sc= -0.483 K(o=-0.48,f=-3.3!) USER MOD Single : A 175 THR OG1 : rot 180:sc= 0 USER MOD Single : A 178 THR OG1 : rot 180:sc= -1.22 USER MOD Single : A 186 TYR OH : rot 180:sc= 0 USER MOD Single : A 193 MET CE :methyl -164:sc= -2.12 (180deg=-3.91!) USER MOD Single : A 196 SER OG : rot 180:sc= 0 USER MOD Single : A 201 ASN :FLIP amide:sc= -3.09! C(o=-8.4!,f=-3.1!) USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 144 7.349 -8.000 -9.938 1.00 0.00 N ATOM 2 CA LYS A 144 8.253 -6.822 -10.060 1.00 0.00 C ATOM 3 C LYS A 144 7.482 -5.549 -9.708 1.00 0.00 C ATOM 4 O LYS A 144 6.422 -5.288 -10.242 1.00 0.00 O ATOM 5 CB LYS A 144 8.772 -6.724 -11.495 1.00 0.00 C ATOM 6 CG LYS A 144 9.991 -7.633 -11.659 1.00 0.00 C ATOM 7 CD LYS A 144 11.179 -6.807 -12.156 1.00 0.00 C ATOM 8 CE LYS A 144 12.479 -7.568 -11.891 1.00 0.00 C ATOM 9 NZ LYS A 144 13.547 -6.606 -11.503 1.00 0.00 N ATOM 0 HA LYS A 144 9.094 -6.937 -9.377 1.00 0.00 H new ATOM 0 HB2 LYS A 144 7.990 -7.016 -12.197 1.00 0.00 H new ATOM 0 HB3 LYS A 144 9.040 -5.693 -11.727 1.00 0.00 H new ATOM 0 HG2 LYS A 144 10.236 -8.106 -10.708 1.00 0.00 H new ATOM 0 HG3 LYS A 144 9.769 -8.433 -12.366 1.00 0.00 H new ATOM 0 HD2 LYS A 144 11.074 -6.606 -13.222 1.00 0.00 H new ATOM 0 HD3 LYS A 144 11.201 -5.842 -11.650 1.00 0.00 H new ATOM 0 HE2 LYS A 144 12.329 -8.300 -11.098 1.00 0.00 H new ATOM 0 HE3 LYS A 144 12.778 -8.120 -12.782 1.00 0.00 H new ATOM 0 HZ1 LYS A 144 14.431 -7.123 -11.323 1.00 0.00 H new ATOM 0 HZ2 LYS A 144 13.696 -5.923 -12.273 1.00 0.00 H new ATOM 0 HZ3 LYS A 144 13.261 -6.099 -10.641 1.00 0.00 H new ATOM 23 N HIS A 145 8.003 -4.755 -8.813 1.00 0.00 N ATOM 24 CA HIS A 145 7.296 -3.500 -8.430 1.00 0.00 C ATOM 25 C HIS A 145 5.939 -3.850 -7.812 1.00 0.00 C ATOM 26 O HIS A 145 5.222 -4.697 -8.306 1.00 0.00 O ATOM 27 CB HIS A 145 7.084 -2.633 -9.672 1.00 0.00 C ATOM 28 CG HIS A 145 8.019 -1.457 -9.628 1.00 0.00 C ATOM 29 ND1 HIS A 145 7.566 -0.160 -9.436 1.00 0.00 N ATOM 30 CD2 HIS A 145 9.384 -1.363 -9.749 1.00 0.00 C ATOM 31 CE1 HIS A 145 8.641 0.649 -9.447 1.00 0.00 C ATOM 32 NE2 HIS A 145 9.774 -0.033 -9.634 1.00 0.00 N ATOM 0 H HIS A 145 8.886 -4.921 -8.331 1.00 0.00 H new ATOM 0 HA HIS A 145 7.896 -2.951 -7.704 1.00 0.00 H new ATOM 0 HB2 HIS A 145 7.263 -3.220 -10.573 1.00 0.00 H new ATOM 0 HB3 HIS A 145 6.051 -2.288 -9.716 1.00 0.00 H new ATOM 0 HD2 HIS A 145 10.053 -2.196 -9.909 1.00 0.00 H new ATOM 0 HE1 HIS A 145 8.593 1.720 -9.320 1.00 0.00 H new ATOM 0 HE2 HIS A 145 10.722 0.341 -9.682 1.00 0.00 H new ATOM 40 N TYR A 146 5.583 -3.205 -6.734 1.00 0.00 N ATOM 41 CA TYR A 146 4.275 -3.505 -6.087 1.00 0.00 C ATOM 42 C TYR A 146 3.288 -2.369 -6.368 1.00 0.00 C ATOM 43 O TYR A 146 3.642 -1.208 -6.341 1.00 0.00 O ATOM 44 CB TYR A 146 4.467 -3.627 -4.572 1.00 0.00 C ATOM 45 CG TYR A 146 5.278 -4.855 -4.246 1.00 0.00 C ATOM 46 CD1 TYR A 146 5.074 -6.043 -4.962 1.00 0.00 C ATOM 47 CD2 TYR A 146 6.225 -4.813 -3.212 1.00 0.00 C ATOM 48 CE1 TYR A 146 5.815 -7.186 -4.644 1.00 0.00 C ATOM 49 CE2 TYR A 146 6.965 -5.956 -2.896 1.00 0.00 C ATOM 50 CZ TYR A 146 6.760 -7.145 -3.611 1.00 0.00 C ATOM 51 OH TYR A 146 7.491 -8.272 -3.297 1.00 0.00 O ATOM 0 H TYR A 146 6.141 -2.485 -6.275 1.00 0.00 H new ATOM 0 HA TYR A 146 3.887 -4.441 -6.489 1.00 0.00 H new ATOM 0 HB2 TYR A 146 4.969 -2.739 -4.189 1.00 0.00 H new ATOM 0 HB3 TYR A 146 3.497 -3.682 -4.079 1.00 0.00 H new ATOM 0 HD1 TYR A 146 4.345 -6.076 -5.758 1.00 0.00 H new ATOM 0 HD2 TYR A 146 6.382 -3.898 -2.660 1.00 0.00 H new ATOM 0 HE1 TYR A 146 5.658 -8.101 -5.196 1.00 0.00 H new ATOM 0 HE2 TYR A 146 7.695 -5.923 -2.101 1.00 0.00 H new ATOM 0 HH TYR A 146 8.102 -8.070 -2.557 1.00 0.00 H new ATOM 61 N ARG A 147 2.048 -2.693 -6.624 1.00 0.00 N ATOM 62 CA ARG A 147 1.044 -1.625 -6.890 1.00 0.00 C ATOM 63 C ARG A 147 0.735 -0.904 -5.578 1.00 0.00 C ATOM 64 O ARG A 147 -0.176 -1.265 -4.858 1.00 0.00 O ATOM 65 CB ARG A 147 -0.240 -2.246 -7.446 1.00 0.00 C ATOM 66 CG ARG A 147 0.008 -2.742 -8.870 1.00 0.00 C ATOM 67 CD ARG A 147 0.268 -4.249 -8.846 1.00 0.00 C ATOM 68 NE ARG A 147 0.190 -4.788 -10.232 1.00 0.00 N ATOM 69 CZ ARG A 147 1.270 -5.203 -10.831 1.00 0.00 C ATOM 70 NH1 ARG A 147 1.691 -6.424 -10.646 1.00 0.00 N ATOM 71 NH2 ARG A 147 1.934 -4.395 -11.614 1.00 0.00 N ATOM 0 H ARG A 147 1.689 -3.647 -6.660 1.00 0.00 H new ATOM 0 HA ARG A 147 1.442 -0.920 -7.620 1.00 0.00 H new ATOM 0 HB2 ARG A 147 -0.560 -3.073 -6.812 1.00 0.00 H new ATOM 0 HB3 ARG A 147 -1.044 -1.510 -7.441 1.00 0.00 H new ATOM 0 HG2 ARG A 147 -0.854 -2.521 -9.499 1.00 0.00 H new ATOM 0 HG3 ARG A 147 0.862 -2.222 -9.304 1.00 0.00 H new ATOM 0 HD2 ARG A 147 1.250 -4.453 -8.420 1.00 0.00 H new ATOM 0 HD3 ARG A 147 -0.465 -4.745 -8.210 1.00 0.00 H new ATOM 0 HE ARG A 147 -0.709 -4.832 -10.712 1.00 0.00 H new ATOM 0 HH11 ARG A 147 1.175 -7.054 -10.032 1.00 0.00 H new ATOM 0 HH12 ARG A 147 2.537 -6.748 -11.115 1.00 0.00 H new ATOM 0 HH21 ARG A 147 1.607 -3.439 -11.756 1.00 0.00 H new ATOM 0 HH22 ARG A 147 2.780 -4.720 -12.083 1.00 0.00 H new ATOM 85 N GLY A 148 1.492 0.107 -5.258 1.00 0.00 N ATOM 86 CA GLY A 148 1.251 0.848 -3.988 1.00 0.00 C ATOM 87 C GLY A 148 2.538 0.869 -3.159 1.00 0.00 C ATOM 88 O GLY A 148 2.506 0.974 -1.950 1.00 0.00 O ATOM 0 H GLY A 148 2.269 0.453 -5.821 1.00 0.00 H new ATOM 0 HA2 GLY A 148 0.928 1.866 -4.204 1.00 0.00 H new ATOM 0 HA3 GLY A 148 0.449 0.372 -3.423 1.00 0.00 H new ATOM 92 N VAL A 149 3.670 0.772 -3.802 1.00 0.00 N ATOM 93 CA VAL A 149 4.958 0.791 -3.055 1.00 0.00 C ATOM 94 C VAL A 149 5.979 1.611 -3.842 1.00 0.00 C ATOM 95 O VAL A 149 6.449 1.203 -4.885 1.00 0.00 O ATOM 96 CB VAL A 149 5.479 -0.637 -2.885 1.00 0.00 C ATOM 97 CG1 VAL A 149 6.793 -0.611 -2.105 1.00 0.00 C ATOM 98 CG2 VAL A 149 4.450 -1.468 -2.116 1.00 0.00 C ATOM 0 H VAL A 149 3.757 0.680 -4.814 1.00 0.00 H new ATOM 0 HA VAL A 149 4.802 1.236 -2.072 1.00 0.00 H new ATOM 0 HB VAL A 149 5.646 -1.080 -3.867 1.00 0.00 H new ATOM 0 HG11 VAL A 149 7.164 -1.629 -1.984 1.00 0.00 H new ATOM 0 HG12 VAL A 149 7.528 -0.019 -2.650 1.00 0.00 H new ATOM 0 HG13 VAL A 149 6.625 -0.167 -1.124 1.00 0.00 H new ATOM 0 HG21 VAL A 149 4.821 -2.486 -1.995 1.00 0.00 H new ATOM 0 HG22 VAL A 149 4.283 -1.023 -1.135 1.00 0.00 H new ATOM 0 HG23 VAL A 149 3.511 -1.488 -2.670 1.00 0.00 H new ATOM 108 N ARG A 150 6.325 2.766 -3.350 1.00 0.00 N ATOM 109 CA ARG A 150 7.314 3.614 -4.068 1.00 0.00 C ATOM 110 C ARG A 150 8.705 3.367 -3.486 1.00 0.00 C ATOM 111 O ARG A 150 9.099 3.976 -2.512 1.00 0.00 O ATOM 112 CB ARG A 150 6.941 5.088 -3.899 1.00 0.00 C ATOM 113 CG ARG A 150 5.538 5.327 -4.461 1.00 0.00 C ATOM 114 CD ARG A 150 5.300 6.830 -4.618 1.00 0.00 C ATOM 115 NE ARG A 150 4.441 7.074 -5.811 1.00 0.00 N ATOM 116 CZ ARG A 150 4.988 7.245 -6.984 1.00 0.00 C ATOM 117 NH1 ARG A 150 6.217 6.858 -7.195 1.00 0.00 N ATOM 118 NH2 ARG A 150 4.306 7.802 -7.947 1.00 0.00 N ATOM 0 H ARG A 150 5.965 3.160 -2.481 1.00 0.00 H new ATOM 0 HA ARG A 150 7.312 3.362 -5.128 1.00 0.00 H new ATOM 0 HB2 ARG A 150 6.974 5.364 -2.845 1.00 0.00 H new ATOM 0 HB3 ARG A 150 7.664 5.719 -4.416 1.00 0.00 H new ATOM 0 HG2 ARG A 150 5.431 4.829 -5.424 1.00 0.00 H new ATOM 0 HG3 ARG A 150 4.790 4.897 -3.795 1.00 0.00 H new ATOM 0 HD2 ARG A 150 4.821 7.229 -3.724 1.00 0.00 H new ATOM 0 HD3 ARG A 150 6.251 7.350 -4.729 1.00 0.00 H new ATOM 0 HE ARG A 150 3.426 7.107 -5.711 1.00 0.00 H new ATOM 0 HH11 ARG A 150 6.750 6.422 -6.443 1.00 0.00 H new ATOM 0 HH12 ARG A 150 6.644 6.992 -8.112 1.00 0.00 H new ATOM 0 HH21 ARG A 150 3.346 8.104 -7.783 1.00 0.00 H new ATOM 0 HH22 ARG A 150 4.733 7.936 -8.863 1.00 0.00 H new ATOM 132 N GLN A 151 9.452 2.473 -4.072 1.00 0.00 N ATOM 133 CA GLN A 151 10.815 2.186 -3.550 1.00 0.00 C ATOM 134 C GLN A 151 11.593 3.492 -3.411 1.00 0.00 C ATOM 135 O GLN A 151 11.191 4.526 -3.907 1.00 0.00 O ATOM 136 CB GLN A 151 11.553 1.264 -4.520 1.00 0.00 C ATOM 137 CG GLN A 151 12.919 0.890 -3.940 1.00 0.00 C ATOM 138 CD GLN A 151 13.495 -0.295 -4.718 1.00 0.00 C ATOM 139 OE1 GLN A 151 12.770 -1.186 -5.113 1.00 0.00 O ATOM 140 NE2 GLN A 151 14.777 -0.343 -4.958 1.00 0.00 N ATOM 0 H GLN A 151 9.176 1.929 -4.890 1.00 0.00 H new ATOM 0 HA GLN A 151 10.732 1.702 -2.577 1.00 0.00 H new ATOM 0 HB2 GLN A 151 10.965 0.364 -4.700 1.00 0.00 H new ATOM 0 HB3 GLN A 151 11.679 1.760 -5.483 1.00 0.00 H new ATOM 0 HG2 GLN A 151 13.597 1.742 -3.999 1.00 0.00 H new ATOM 0 HG3 GLN A 151 12.820 0.633 -2.885 1.00 0.00 H new ATOM 0 HE21 GLN A 151 15.386 0.405 -4.627 1.00 0.00 H new ATOM 0 HE22 GLN A 151 15.170 -1.128 -5.477 1.00 0.00 H new ATOM 149 N ARG A 152 12.708 3.447 -2.745 1.00 0.00 N ATOM 150 CA ARG A 152 13.526 4.679 -2.572 1.00 0.00 C ATOM 151 C ARG A 152 14.977 4.384 -2.966 1.00 0.00 C ATOM 152 O ARG A 152 15.394 3.243 -2.978 1.00 0.00 O ATOM 153 CB ARG A 152 13.475 5.125 -1.110 1.00 0.00 C ATOM 154 CG ARG A 152 12.124 5.786 -0.826 1.00 0.00 C ATOM 155 CD ARG A 152 12.350 7.163 -0.201 1.00 0.00 C ATOM 156 NE ARG A 152 11.934 8.221 -1.164 1.00 0.00 N ATOM 157 CZ ARG A 152 10.825 8.883 -0.969 1.00 0.00 C ATOM 158 NH1 ARG A 152 9.677 8.323 -1.231 1.00 0.00 N ATOM 159 NH2 ARG A 152 10.865 10.105 -0.512 1.00 0.00 N ATOM 0 H ARG A 152 13.092 2.608 -2.310 1.00 0.00 H new ATOM 0 HA ARG A 152 13.129 5.472 -3.206 1.00 0.00 H new ATOM 0 HB2 ARG A 152 13.618 4.268 -0.452 1.00 0.00 H new ATOM 0 HB3 ARG A 152 14.285 5.825 -0.903 1.00 0.00 H new ATOM 0 HG2 ARG A 152 11.554 5.884 -1.750 1.00 0.00 H new ATOM 0 HG3 ARG A 152 11.536 5.162 -0.153 1.00 0.00 H new ATOM 0 HD2 ARG A 152 11.779 7.253 0.723 1.00 0.00 H new ATOM 0 HD3 ARG A 152 13.401 7.287 0.060 1.00 0.00 H new ATOM 0 HE ARG A 152 12.515 8.428 -1.976 1.00 0.00 H new ATOM 0 HH11 ARG A 152 9.645 7.368 -1.588 1.00 0.00 H new ATOM 0 HH12 ARG A 152 8.811 8.840 -1.079 1.00 0.00 H new ATOM 0 HH21 ARG A 152 11.763 10.544 -0.307 1.00 0.00 H new ATOM 0 HH22 ARG A 152 9.999 10.621 -0.360 1.00 0.00 H new ATOM 173 N PRO A 153 15.703 5.427 -3.277 1.00 0.00 N ATOM 174 CA PRO A 153 17.117 5.320 -3.676 1.00 0.00 C ATOM 175 C PRO A 153 18.003 5.104 -2.446 1.00 0.00 C ATOM 176 O PRO A 153 19.213 5.065 -2.540 1.00 0.00 O ATOM 177 CB PRO A 153 17.409 6.673 -4.330 1.00 0.00 C ATOM 178 CG PRO A 153 16.356 7.662 -3.774 1.00 0.00 C ATOM 179 CD PRO A 153 15.182 6.810 -3.257 1.00 0.00 C ATOM 0 HA PRO A 153 17.313 4.480 -4.342 1.00 0.00 H new ATOM 0 HB2 PRO A 153 18.419 7.008 -4.095 1.00 0.00 H new ATOM 0 HB3 PRO A 153 17.341 6.603 -5.416 1.00 0.00 H new ATOM 0 HG2 PRO A 153 16.778 8.267 -2.972 1.00 0.00 H new ATOM 0 HG3 PRO A 153 16.023 8.350 -4.551 1.00 0.00 H new ATOM 0 HD2 PRO A 153 14.885 7.109 -2.252 1.00 0.00 H new ATOM 0 HD3 PRO A 153 14.303 6.914 -3.894 1.00 0.00 H new ATOM 187 N TRP A 154 17.407 4.962 -1.294 1.00 0.00 N ATOM 188 CA TRP A 154 18.211 4.747 -0.057 1.00 0.00 C ATOM 189 C TRP A 154 17.949 3.338 0.481 1.00 0.00 C ATOM 190 O TRP A 154 18.598 2.885 1.402 1.00 0.00 O ATOM 191 CB TRP A 154 17.808 5.780 0.997 1.00 0.00 C ATOM 192 CG TRP A 154 18.682 5.635 2.203 1.00 0.00 C ATOM 193 CD1 TRP A 154 18.442 4.799 3.240 1.00 0.00 C ATOM 194 CD2 TRP A 154 19.924 6.329 2.517 1.00 0.00 C ATOM 195 NE1 TRP A 154 19.458 4.935 4.169 1.00 0.00 N ATOM 196 CE2 TRP A 154 20.395 5.865 3.769 1.00 0.00 C ATOM 197 CE3 TRP A 154 20.682 7.305 1.842 1.00 0.00 C ATOM 198 CZ2 TRP A 154 21.574 6.355 4.332 1.00 0.00 C ATOM 199 CZ3 TRP A 154 21.871 7.800 2.406 1.00 0.00 C ATOM 200 CH2 TRP A 154 22.315 7.326 3.649 1.00 0.00 C ATOM 0 H TRP A 154 16.397 4.986 -1.155 1.00 0.00 H new ATOM 0 HA TRP A 154 19.271 4.857 -0.286 1.00 0.00 H new ATOM 0 HB2 TRP A 154 17.900 6.786 0.588 1.00 0.00 H new ATOM 0 HB3 TRP A 154 16.763 5.643 1.274 1.00 0.00 H new ATOM 0 HD1 TRP A 154 17.595 4.134 3.328 1.00 0.00 H new ATOM 0 HE1 TRP A 154 19.508 4.412 5.043 1.00 0.00 H new ATOM 0 HE3 TRP A 154 20.348 7.676 0.884 1.00 0.00 H new ATOM 0 HZ2 TRP A 154 21.913 5.987 5.289 1.00 0.00 H new ATOM 0 HZ3 TRP A 154 22.445 8.548 1.880 1.00 0.00 H new ATOM 0 HH2 TRP A 154 23.228 7.710 4.079 1.00 0.00 H new ATOM 211 N GLY A 155 17.002 2.641 -0.088 1.00 0.00 N ATOM 212 CA GLY A 155 16.699 1.262 0.391 1.00 0.00 C ATOM 213 C GLY A 155 15.396 1.271 1.192 1.00 0.00 C ATOM 214 O GLY A 155 15.149 0.401 2.004 1.00 0.00 O ATOM 0 H GLY A 155 16.425 2.967 -0.864 1.00 0.00 H new ATOM 0 HA2 GLY A 155 16.612 0.583 -0.457 1.00 0.00 H new ATOM 0 HA3 GLY A 155 17.516 0.894 1.011 1.00 0.00 H new ATOM 218 N LYS A 156 14.559 2.247 0.970 1.00 0.00 N ATOM 219 CA LYS A 156 13.273 2.310 1.719 1.00 0.00 C ATOM 220 C LYS A 156 12.104 2.137 0.747 1.00 0.00 C ATOM 221 O LYS A 156 12.284 2.083 -0.454 1.00 0.00 O ATOM 222 CB LYS A 156 13.155 3.668 2.416 1.00 0.00 C ATOM 223 CG LYS A 156 13.917 3.631 3.743 1.00 0.00 C ATOM 224 CD LYS A 156 14.683 4.942 3.929 1.00 0.00 C ATOM 225 CE LYS A 156 15.171 5.050 5.376 1.00 0.00 C ATOM 226 NZ LYS A 156 16.261 6.063 5.459 1.00 0.00 N ATOM 0 H LYS A 156 14.710 3.003 0.302 1.00 0.00 H new ATOM 0 HA LYS A 156 13.249 1.513 2.463 1.00 0.00 H new ATOM 0 HB2 LYS A 156 13.557 4.453 1.776 1.00 0.00 H new ATOM 0 HB3 LYS A 156 12.107 3.907 2.593 1.00 0.00 H new ATOM 0 HG2 LYS A 156 13.222 3.483 4.570 1.00 0.00 H new ATOM 0 HG3 LYS A 156 14.609 2.789 3.754 1.00 0.00 H new ATOM 0 HD2 LYS A 156 15.531 4.980 3.245 1.00 0.00 H new ATOM 0 HD3 LYS A 156 14.040 5.788 3.687 1.00 0.00 H new ATOM 0 HE2 LYS A 156 14.346 5.334 6.029 1.00 0.00 H new ATOM 0 HE3 LYS A 156 15.533 4.082 5.722 1.00 0.00 H new ATOM 0 HZ1 LYS A 156 16.627 6.100 6.432 1.00 0.00 H new ATOM 0 HZ2 LYS A 156 17.029 5.800 4.809 1.00 0.00 H new ATOM 0 HZ3 LYS A 156 15.888 6.997 5.194 1.00 0.00 H new ATOM 240 N PHE A 157 10.907 2.049 1.259 1.00 0.00 N ATOM 241 CA PHE A 157 9.722 1.882 0.371 1.00 0.00 C ATOM 242 C PHE A 157 8.522 2.596 1.000 1.00 0.00 C ATOM 243 O PHE A 157 8.445 2.744 2.203 1.00 0.00 O ATOM 244 CB PHE A 157 9.401 0.391 0.226 1.00 0.00 C ATOM 245 CG PHE A 157 10.477 -0.287 -0.588 1.00 0.00 C ATOM 246 CD1 PHE A 157 11.667 -0.697 0.027 1.00 0.00 C ATOM 247 CD2 PHE A 157 10.282 -0.511 -1.957 1.00 0.00 C ATOM 248 CE1 PHE A 157 12.663 -1.331 -0.728 1.00 0.00 C ATOM 249 CE2 PHE A 157 11.278 -1.144 -2.712 1.00 0.00 C ATOM 250 CZ PHE A 157 12.468 -1.555 -2.098 1.00 0.00 C ATOM 0 H PHE A 157 10.698 2.086 2.257 1.00 0.00 H new ATOM 0 HA PHE A 157 9.935 2.307 -0.610 1.00 0.00 H new ATOM 0 HB2 PHE A 157 9.330 -0.073 1.210 1.00 0.00 H new ATOM 0 HB3 PHE A 157 8.432 0.263 -0.257 1.00 0.00 H new ATOM 0 HD1 PHE A 157 11.817 -0.525 1.083 1.00 0.00 H new ATOM 0 HD2 PHE A 157 9.364 -0.196 -2.430 1.00 0.00 H new ATOM 0 HE1 PHE A 157 13.581 -1.647 -0.254 1.00 0.00 H new ATOM 0 HE2 PHE A 157 11.128 -1.315 -3.768 1.00 0.00 H new ATOM 0 HZ PHE A 157 13.235 -2.044 -2.680 1.00 0.00 H new ATOM 260 N ALA A 158 7.582 3.036 0.210 1.00 0.00 N ATOM 261 CA ALA A 158 6.397 3.731 0.792 1.00 0.00 C ATOM 262 C ALA A 158 5.120 2.993 0.391 1.00 0.00 C ATOM 263 O ALA A 158 4.788 2.891 -0.772 1.00 0.00 O ATOM 264 CB ALA A 158 6.336 5.171 0.280 1.00 0.00 C ATOM 0 H ALA A 158 7.581 2.946 -0.806 1.00 0.00 H new ATOM 0 HA ALA A 158 6.486 3.739 1.878 1.00 0.00 H new ATOM 0 HB1 ALA A 158 5.469 5.673 0.709 1.00 0.00 H new ATOM 0 HB2 ALA A 158 7.243 5.700 0.573 1.00 0.00 H new ATOM 0 HB3 ALA A 158 6.253 5.168 -0.807 1.00 0.00 H new ATOM 270 N ALA A 159 4.401 2.477 1.349 1.00 0.00 N ATOM 271 CA ALA A 159 3.146 1.746 1.026 1.00 0.00 C ATOM 272 C ALA A 159 1.965 2.717 1.066 1.00 0.00 C ATOM 273 O ALA A 159 1.582 3.199 2.113 1.00 0.00 O ATOM 274 CB ALA A 159 2.926 0.634 2.053 1.00 0.00 C ATOM 0 H ALA A 159 4.629 2.531 2.342 1.00 0.00 H new ATOM 0 HA ALA A 159 3.225 1.311 0.030 1.00 0.00 H new ATOM 0 HB1 ALA A 159 2.007 0.098 1.817 1.00 0.00 H new ATOM 0 HB2 ALA A 159 3.767 -0.058 2.025 1.00 0.00 H new ATOM 0 HB3 ALA A 159 2.847 1.069 3.049 1.00 0.00 H new ATOM 280 N GLU A 160 1.386 3.005 -0.067 1.00 0.00 N ATOM 281 CA GLU A 160 0.226 3.941 -0.100 1.00 0.00 C ATOM 282 C GLU A 160 -0.910 3.301 -0.901 1.00 0.00 C ATOM 283 O GLU A 160 -0.678 2.579 -1.851 1.00 0.00 O ATOM 284 CB GLU A 160 0.646 5.255 -0.766 1.00 0.00 C ATOM 285 CG GLU A 160 2.064 5.626 -0.322 1.00 0.00 C ATOM 286 CD GLU A 160 2.996 5.612 -1.534 1.00 0.00 C ATOM 287 OE1 GLU A 160 2.544 5.976 -2.609 1.00 0.00 O ATOM 288 OE2 GLU A 160 4.145 5.239 -1.370 1.00 0.00 O ATOM 0 H GLU A 160 1.667 2.632 -0.974 1.00 0.00 H new ATOM 0 HA GLU A 160 -0.110 4.145 0.916 1.00 0.00 H new ATOM 0 HB2 GLU A 160 0.609 5.153 -1.851 1.00 0.00 H new ATOM 0 HB3 GLU A 160 -0.050 6.050 -0.497 1.00 0.00 H new ATOM 0 HG2 GLU A 160 2.066 6.613 0.140 1.00 0.00 H new ATOM 0 HG3 GLU A 160 2.417 4.921 0.430 1.00 0.00 H new ATOM 295 N ILE A 161 -2.134 3.552 -0.526 1.00 0.00 N ATOM 296 CA ILE A 161 -3.277 2.948 -1.270 1.00 0.00 C ATOM 297 C ILE A 161 -4.220 4.052 -1.753 1.00 0.00 C ATOM 298 O ILE A 161 -4.283 5.122 -1.182 1.00 0.00 O ATOM 299 CB ILE A 161 -4.039 1.995 -0.345 1.00 0.00 C ATOM 300 CG1 ILE A 161 -5.178 1.331 -1.124 1.00 0.00 C ATOM 301 CG2 ILE A 161 -4.618 2.783 0.831 1.00 0.00 C ATOM 302 CD1 ILE A 161 -5.873 0.298 -0.234 1.00 0.00 C ATOM 0 H ILE A 161 -2.393 4.147 0.261 1.00 0.00 H new ATOM 0 HA ILE A 161 -2.897 2.397 -2.130 1.00 0.00 H new ATOM 0 HB ILE A 161 -3.359 1.229 0.029 1.00 0.00 H new ATOM 0 HG12 ILE A 161 -5.895 2.084 -1.453 1.00 0.00 H new ATOM 0 HG13 ILE A 161 -4.787 0.850 -2.020 1.00 0.00 H new ATOM 0 HG21 ILE A 161 -5.161 2.106 1.491 1.00 0.00 H new ATOM 0 HG22 ILE A 161 -3.808 3.257 1.385 1.00 0.00 H new ATOM 0 HG23 ILE A 161 -5.298 3.548 0.457 1.00 0.00 H new ATOM 0 HD11 ILE A 161 -6.684 -0.174 -0.789 1.00 0.00 H new ATOM 0 HD12 ILE A 161 -5.153 -0.461 0.073 1.00 0.00 H new ATOM 0 HD13 ILE A 161 -6.278 0.792 0.649 1.00 0.00 H new ATOM 314 N ARG A 162 -4.954 3.797 -2.801 1.00 0.00 N ATOM 315 CA ARG A 162 -5.897 4.826 -3.325 1.00 0.00 C ATOM 316 C ARG A 162 -7.198 4.779 -2.521 1.00 0.00 C ATOM 317 O ARG A 162 -7.722 3.721 -2.233 1.00 0.00 O ATOM 318 CB ARG A 162 -6.197 4.535 -4.796 1.00 0.00 C ATOM 319 CG ARG A 162 -6.872 5.752 -5.433 1.00 0.00 C ATOM 320 CD ARG A 162 -7.177 5.455 -6.903 1.00 0.00 C ATOM 321 NE ARG A 162 -6.833 6.644 -7.732 1.00 0.00 N ATOM 322 CZ ARG A 162 -7.714 7.144 -8.553 1.00 0.00 C ATOM 323 NH1 ARG A 162 -7.905 6.592 -9.720 1.00 0.00 N ATOM 324 NH2 ARG A 162 -8.406 8.196 -8.208 1.00 0.00 N ATOM 0 H ARG A 162 -4.942 2.918 -3.319 1.00 0.00 H new ATOM 0 HA ARG A 162 -5.448 5.815 -3.233 1.00 0.00 H new ATOM 0 HB2 ARG A 162 -5.274 4.299 -5.326 1.00 0.00 H new ATOM 0 HB3 ARG A 162 -6.844 3.662 -4.880 1.00 0.00 H new ATOM 0 HG2 ARG A 162 -7.793 5.991 -4.901 1.00 0.00 H new ATOM 0 HG3 ARG A 162 -6.223 6.624 -5.354 1.00 0.00 H new ATOM 0 HD2 ARG A 162 -6.606 4.589 -7.236 1.00 0.00 H new ATOM 0 HD3 ARG A 162 -8.232 5.207 -7.024 1.00 0.00 H new ATOM 0 HE ARG A 162 -5.908 7.067 -7.657 1.00 0.00 H new ATOM 0 HH11 ARG A 162 -7.365 5.770 -9.990 1.00 0.00 H new ATOM 0 HH12 ARG A 162 -8.594 6.983 -10.362 1.00 0.00 H new ATOM 0 HH21 ARG A 162 -8.258 8.627 -7.296 1.00 0.00 H new ATOM 0 HH22 ARG A 162 -9.095 8.587 -8.851 1.00 0.00 H new ATOM 338 N ASP A 163 -7.725 5.915 -2.156 1.00 0.00 N ATOM 339 CA ASP A 163 -8.991 5.928 -1.371 1.00 0.00 C ATOM 340 C ASP A 163 -9.825 7.153 -1.758 1.00 0.00 C ATOM 341 O ASP A 163 -9.654 8.218 -1.198 1.00 0.00 O ATOM 342 CB ASP A 163 -8.666 5.984 0.123 1.00 0.00 C ATOM 343 CG ASP A 163 -9.929 5.680 0.930 1.00 0.00 C ATOM 344 OD1 ASP A 163 -11.009 5.853 0.388 1.00 0.00 O ATOM 345 OD2 ASP A 163 -9.795 5.277 2.073 1.00 0.00 O ATOM 0 H ASP A 163 -7.334 6.833 -2.367 1.00 0.00 H new ATOM 0 HA ASP A 163 -9.558 5.022 -1.586 1.00 0.00 H new ATOM 0 HB2 ASP A 163 -7.885 5.263 0.364 1.00 0.00 H new ATOM 0 HB3 ASP A 163 -8.282 6.969 0.386 1.00 0.00 H new ATOM 350 N PRO A 164 -10.708 6.963 -2.704 1.00 0.00 N ATOM 351 CA PRO A 164 -11.594 8.035 -3.191 1.00 0.00 C ATOM 352 C PRO A 164 -12.750 8.256 -2.209 1.00 0.00 C ATOM 353 O PRO A 164 -13.346 9.314 -2.164 1.00 0.00 O ATOM 354 CB PRO A 164 -12.108 7.497 -4.529 1.00 0.00 C ATOM 355 CG PRO A 164 -11.955 5.957 -4.467 1.00 0.00 C ATOM 356 CD PRO A 164 -10.905 5.664 -3.379 1.00 0.00 C ATOM 0 HA PRO A 164 -11.091 8.997 -3.291 1.00 0.00 H new ATOM 0 HB2 PRO A 164 -13.149 7.778 -4.687 1.00 0.00 H new ATOM 0 HB3 PRO A 164 -11.537 7.911 -5.360 1.00 0.00 H new ATOM 0 HG2 PRO A 164 -12.906 5.482 -4.226 1.00 0.00 H new ATOM 0 HG3 PRO A 164 -11.636 5.560 -5.431 1.00 0.00 H new ATOM 0 HD2 PRO A 164 -11.256 4.903 -2.682 1.00 0.00 H new ATOM 0 HD3 PRO A 164 -9.975 5.296 -3.812 1.00 0.00 H new ATOM 364 N ALA A 165 -13.069 7.262 -1.425 1.00 0.00 N ATOM 365 CA ALA A 165 -14.183 7.410 -0.448 1.00 0.00 C ATOM 366 C ALA A 165 -13.831 8.495 0.572 1.00 0.00 C ATOM 367 O ALA A 165 -14.666 8.932 1.339 1.00 0.00 O ATOM 368 CB ALA A 165 -14.404 6.080 0.276 1.00 0.00 C ATOM 0 H ALA A 165 -12.605 6.354 -1.420 1.00 0.00 H new ATOM 0 HA ALA A 165 -15.093 7.693 -0.976 1.00 0.00 H new ATOM 0 HB1 ALA A 165 -15.219 6.186 0.992 1.00 0.00 H new ATOM 0 HB2 ALA A 165 -14.657 5.308 -0.451 1.00 0.00 H new ATOM 0 HB3 ALA A 165 -13.493 5.797 0.803 1.00 0.00 H new ATOM 374 N LYS A 166 -12.600 8.932 0.591 1.00 0.00 N ATOM 375 CA LYS A 166 -12.199 9.987 1.564 1.00 0.00 C ATOM 376 C LYS A 166 -12.148 11.344 0.856 1.00 0.00 C ATOM 377 O LYS A 166 -11.313 12.176 1.151 1.00 0.00 O ATOM 378 CB LYS A 166 -10.816 9.658 2.132 1.00 0.00 C ATOM 379 CG LYS A 166 -10.880 8.334 2.896 1.00 0.00 C ATOM 380 CD LYS A 166 -9.930 8.389 4.094 1.00 0.00 C ATOM 381 CE LYS A 166 -10.621 9.096 5.262 1.00 0.00 C ATOM 382 NZ LYS A 166 -9.920 8.759 6.532 1.00 0.00 N ATOM 0 H LYS A 166 -11.856 8.604 -0.025 1.00 0.00 H new ATOM 0 HA LYS A 166 -12.926 10.027 2.375 1.00 0.00 H new ATOM 0 HB2 LYS A 166 -10.087 9.590 1.325 1.00 0.00 H new ATOM 0 HB3 LYS A 166 -10.484 10.457 2.795 1.00 0.00 H new ATOM 0 HG2 LYS A 166 -11.899 8.146 3.235 1.00 0.00 H new ATOM 0 HG3 LYS A 166 -10.606 7.509 2.239 1.00 0.00 H new ATOM 0 HD2 LYS A 166 -9.638 7.380 4.387 1.00 0.00 H new ATOM 0 HD3 LYS A 166 -9.017 8.919 3.823 1.00 0.00 H new ATOM 0 HE2 LYS A 166 -10.612 10.175 5.105 1.00 0.00 H new ATOM 0 HE3 LYS A 166 -11.666 8.791 5.319 1.00 0.00 H new ATOM 0 HZ1 LYS A 166 -10.390 9.240 7.326 1.00 0.00 H new ATOM 0 HZ2 LYS A 166 -9.950 7.730 6.683 1.00 0.00 H new ATOM 0 HZ3 LYS A 166 -8.930 9.071 6.475 1.00 0.00 H new ATOM 396 N ASN A 167 -13.033 11.573 -0.074 1.00 0.00 N ATOM 397 CA ASN A 167 -13.034 12.876 -0.796 1.00 0.00 C ATOM 398 C ASN A 167 -11.811 12.954 -1.711 1.00 0.00 C ATOM 399 O ASN A 167 -11.104 13.943 -1.735 1.00 0.00 O ATOM 400 CB ASN A 167 -12.984 14.020 0.219 1.00 0.00 C ATOM 401 CG ASN A 167 -14.095 15.024 -0.091 1.00 0.00 C ATOM 402 OD1 ASN A 167 -14.727 14.948 -1.126 1.00 0.00 O ATOM 403 ND2 ASN A 167 -14.361 15.970 0.766 1.00 0.00 N ATOM 0 H ASN A 167 -13.755 10.914 -0.365 1.00 0.00 H new ATOM 0 HA ASN A 167 -13.941 12.959 -1.395 1.00 0.00 H new ATOM 0 HB2 ASN A 167 -13.103 13.629 1.230 1.00 0.00 H new ATOM 0 HB3 ASN A 167 -12.012 14.513 0.180 1.00 0.00 H new ATOM 0 HD21 ASN A 167 -15.099 16.645 0.567 1.00 0.00 H new ATOM 0 HD22 ASN A 167 -13.831 16.035 1.635 1.00 0.00 H new ATOM 410 N GLY A 168 -11.553 11.922 -2.465 1.00 0.00 N ATOM 411 CA GLY A 168 -10.375 11.941 -3.377 1.00 0.00 C ATOM 412 C GLY A 168 -9.109 12.235 -2.570 1.00 0.00 C ATOM 413 O GLY A 168 -8.717 13.373 -2.405 1.00 0.00 O ATOM 0 H GLY A 168 -12.107 11.066 -2.489 1.00 0.00 H new ATOM 0 HA2 GLY A 168 -10.280 10.982 -3.886 1.00 0.00 H new ATOM 0 HA3 GLY A 168 -10.511 12.699 -4.149 1.00 0.00 H new ATOM 417 N ALA A 169 -8.468 11.218 -2.065 1.00 0.00 N ATOM 418 CA ALA A 169 -7.229 11.439 -1.268 1.00 0.00 C ATOM 419 C ALA A 169 -6.462 10.121 -1.141 1.00 0.00 C ATOM 420 O ALA A 169 -7.036 9.080 -0.887 1.00 0.00 O ATOM 421 CB ALA A 169 -7.602 11.950 0.125 1.00 0.00 C ATOM 0 H ALA A 169 -8.749 10.243 -2.170 1.00 0.00 H new ATOM 0 HA ALA A 169 -6.602 12.177 -1.769 1.00 0.00 H new ATOM 0 HB1 ALA A 169 -6.695 12.112 0.708 1.00 0.00 H new ATOM 0 HB2 ALA A 169 -8.147 12.889 0.034 1.00 0.00 H new ATOM 0 HB3 ALA A 169 -8.230 11.213 0.627 1.00 0.00 H new ATOM 427 N ARG A 170 -5.169 10.155 -1.315 1.00 0.00 N ATOM 428 CA ARG A 170 -4.369 8.903 -1.204 1.00 0.00 C ATOM 429 C ARG A 170 -4.295 8.471 0.261 1.00 0.00 C ATOM 430 O ARG A 170 -4.818 9.126 1.140 1.00 0.00 O ATOM 431 CB ARG A 170 -2.956 9.151 -1.734 1.00 0.00 C ATOM 432 CG ARG A 170 -2.996 9.260 -3.259 1.00 0.00 C ATOM 433 CD ARG A 170 -1.567 9.293 -3.804 1.00 0.00 C ATOM 434 NE ARG A 170 -1.506 10.209 -4.978 1.00 0.00 N ATOM 435 CZ ARG A 170 -0.512 10.126 -5.817 1.00 0.00 C ATOM 436 NH1 ARG A 170 0.703 10.382 -5.417 1.00 0.00 N ATOM 437 NH2 ARG A 170 -0.731 9.785 -7.057 1.00 0.00 N ATOM 0 H ARG A 170 -4.632 10.996 -1.529 1.00 0.00 H new ATOM 0 HA ARG A 170 -4.844 8.117 -1.790 1.00 0.00 H new ATOM 0 HB2 ARG A 170 -2.550 10.067 -1.304 1.00 0.00 H new ATOM 0 HB3 ARG A 170 -2.295 8.338 -1.434 1.00 0.00 H new ATOM 0 HG2 ARG A 170 -3.538 8.414 -3.681 1.00 0.00 H new ATOM 0 HG3 ARG A 170 -3.531 10.162 -3.556 1.00 0.00 H new ATOM 0 HD2 ARG A 170 -0.878 9.630 -3.029 1.00 0.00 H new ATOM 0 HD3 ARG A 170 -1.254 8.290 -4.094 1.00 0.00 H new ATOM 0 HE ARG A 170 -2.242 10.900 -5.125 1.00 0.00 H new ATOM 0 HH11 ARG A 170 0.875 10.647 -4.447 1.00 0.00 H new ATOM 0 HH12 ARG A 170 1.481 10.317 -6.074 1.00 0.00 H new ATOM 0 HH21 ARG A 170 -1.680 9.583 -7.370 1.00 0.00 H new ATOM 0 HH22 ARG A 170 0.047 9.720 -7.713 1.00 0.00 H new ATOM 451 N VAL A 171 -3.648 7.370 0.531 1.00 0.00 N ATOM 452 CA VAL A 171 -3.539 6.894 1.939 1.00 0.00 C ATOM 453 C VAL A 171 -2.119 6.379 2.190 1.00 0.00 C ATOM 454 O VAL A 171 -1.859 5.193 2.143 1.00 0.00 O ATOM 455 CB VAL A 171 -4.553 5.769 2.171 1.00 0.00 C ATOM 456 CG1 VAL A 171 -4.192 4.994 3.441 1.00 0.00 C ATOM 457 CG2 VAL A 171 -5.948 6.377 2.328 1.00 0.00 C ATOM 0 H VAL A 171 -3.190 6.779 -0.163 1.00 0.00 H new ATOM 0 HA VAL A 171 -3.749 7.714 2.626 1.00 0.00 H new ATOM 0 HB VAL A 171 -4.537 5.088 1.320 1.00 0.00 H new ATOM 0 HG11 VAL A 171 -4.918 4.196 3.599 1.00 0.00 H new ATOM 0 HG12 VAL A 171 -3.196 4.563 3.334 1.00 0.00 H new ATOM 0 HG13 VAL A 171 -4.205 5.670 4.296 1.00 0.00 H new ATOM 0 HG21 VAL A 171 -6.675 5.582 2.493 1.00 0.00 H new ATOM 0 HG22 VAL A 171 -5.955 7.058 3.179 1.00 0.00 H new ATOM 0 HG23 VAL A 171 -6.210 6.925 1.423 1.00 0.00 H new ATOM 467 N TRP A 172 -1.200 7.265 2.459 1.00 0.00 N ATOM 468 CA TRP A 172 0.202 6.830 2.715 1.00 0.00 C ATOM 469 C TRP A 172 0.233 5.926 3.950 1.00 0.00 C ATOM 470 O TRP A 172 0.381 6.386 5.065 1.00 0.00 O ATOM 471 CB TRP A 172 1.084 8.060 2.956 1.00 0.00 C ATOM 472 CG TRP A 172 2.512 7.638 3.113 1.00 0.00 C ATOM 473 CD1 TRP A 172 3.008 6.949 4.167 1.00 0.00 C ATOM 474 CD2 TRP A 172 3.636 7.864 2.212 1.00 0.00 C ATOM 475 NE1 TRP A 172 4.359 6.742 3.972 1.00 0.00 N ATOM 476 CE2 TRP A 172 4.794 7.283 2.785 1.00 0.00 C ATOM 477 CE3 TRP A 172 3.765 8.510 0.968 1.00 0.00 C ATOM 478 CZ2 TRP A 172 6.031 7.340 2.149 1.00 0.00 C ATOM 479 CZ3 TRP A 172 5.012 8.568 0.322 1.00 0.00 C ATOM 480 CH2 TRP A 172 6.145 7.984 0.912 1.00 0.00 C ATOM 0 H TRP A 172 -1.359 8.271 2.513 1.00 0.00 H new ATOM 0 HA TRP A 172 0.578 6.281 1.852 1.00 0.00 H new ATOM 0 HB2 TRP A 172 0.990 8.755 2.122 1.00 0.00 H new ATOM 0 HB3 TRP A 172 0.751 8.588 3.850 1.00 0.00 H new ATOM 0 HD1 TRP A 172 2.439 6.615 5.022 1.00 0.00 H new ATOM 0 HE1 TRP A 172 4.962 6.247 4.629 1.00 0.00 H new ATOM 0 HE3 TRP A 172 2.900 8.964 0.507 1.00 0.00 H new ATOM 0 HZ2 TRP A 172 6.898 6.889 2.608 1.00 0.00 H new ATOM 0 HZ3 TRP A 172 5.099 9.064 -0.633 1.00 0.00 H new ATOM 0 HH2 TRP A 172 7.101 8.032 0.412 1.00 0.00 H new ATOM 491 N LEU A 173 0.094 4.643 3.761 1.00 0.00 N ATOM 492 CA LEU A 173 0.118 3.712 4.923 1.00 0.00 C ATOM 493 C LEU A 173 1.369 3.987 5.760 1.00 0.00 C ATOM 494 O LEU A 173 1.356 3.880 6.970 1.00 0.00 O ATOM 495 CB LEU A 173 0.149 2.264 4.424 1.00 0.00 C ATOM 496 CG LEU A 173 -1.096 1.988 3.579 1.00 0.00 C ATOM 497 CD1 LEU A 173 -0.863 0.743 2.721 1.00 0.00 C ATOM 498 CD2 LEU A 173 -2.295 1.754 4.501 1.00 0.00 C ATOM 0 H LEU A 173 -0.035 4.199 2.852 1.00 0.00 H new ATOM 0 HA LEU A 173 -0.774 3.864 5.530 1.00 0.00 H new ATOM 0 HB2 LEU A 173 1.048 2.091 3.833 1.00 0.00 H new ATOM 0 HB3 LEU A 173 0.187 1.578 5.270 1.00 0.00 H new ATOM 0 HG LEU A 173 -1.295 2.843 2.933 1.00 0.00 H new ATOM 0 HD11 LEU A 173 -1.750 0.545 2.118 1.00 0.00 H new ATOM 0 HD12 LEU A 173 -0.008 0.908 2.065 1.00 0.00 H new ATOM 0 HD13 LEU A 173 -0.665 -0.112 3.367 1.00 0.00 H new ATOM 0 HD21 LEU A 173 -3.183 1.557 3.900 1.00 0.00 H new ATOM 0 HD22 LEU A 173 -2.096 0.898 5.146 1.00 0.00 H new ATOM 0 HD23 LEU A 173 -2.461 2.640 5.114 1.00 0.00 H new ATOM 510 N GLY A 174 2.450 4.342 5.121 1.00 0.00 N ATOM 511 CA GLY A 174 3.703 4.627 5.878 1.00 0.00 C ATOM 512 C GLY A 174 4.892 4.003 5.149 1.00 0.00 C ATOM 513 O GLY A 174 4.752 3.051 4.409 1.00 0.00 O ATOM 0 H GLY A 174 2.520 4.447 4.109 1.00 0.00 H new ATOM 0 HA2 GLY A 174 3.846 5.703 5.974 1.00 0.00 H new ATOM 0 HA3 GLY A 174 3.630 4.224 6.888 1.00 0.00 H new ATOM 517 N THR A 175 6.065 4.535 5.355 1.00 0.00 N ATOM 518 CA THR A 175 7.265 3.979 4.674 1.00 0.00 C ATOM 519 C THR A 175 7.566 2.587 5.232 1.00 0.00 C ATOM 520 O THR A 175 6.844 2.069 6.059 1.00 0.00 O ATOM 521 CB THR A 175 8.461 4.904 4.915 1.00 0.00 C ATOM 522 OG1 THR A 175 9.001 4.654 6.204 1.00 0.00 O ATOM 523 CG2 THR A 175 8.008 6.362 4.822 1.00 0.00 C ATOM 0 H THR A 175 6.243 5.332 5.966 1.00 0.00 H new ATOM 0 HA THR A 175 7.078 3.905 3.603 1.00 0.00 H new ATOM 0 HB THR A 175 9.224 4.715 4.160 1.00 0.00 H new ATOM 0 HG1 THR A 175 9.768 5.245 6.358 1.00 0.00 H new ATOM 0 HG21 THR A 175 8.860 7.019 4.994 1.00 0.00 H new ATOM 0 HG22 THR A 175 7.597 6.553 3.831 1.00 0.00 H new ATOM 0 HG23 THR A 175 7.244 6.554 5.575 1.00 0.00 H new ATOM 531 N PHE A 176 8.626 1.975 4.781 1.00 0.00 N ATOM 532 CA PHE A 176 8.969 0.615 5.281 1.00 0.00 C ATOM 533 C PHE A 176 10.462 0.354 5.065 1.00 0.00 C ATOM 534 O PHE A 176 11.172 1.177 4.523 1.00 0.00 O ATOM 535 CB PHE A 176 8.152 -0.427 4.514 1.00 0.00 C ATOM 536 CG PHE A 176 6.719 -0.376 4.982 1.00 0.00 C ATOM 537 CD1 PHE A 176 6.308 -1.169 6.060 1.00 0.00 C ATOM 538 CD2 PHE A 176 5.802 0.467 4.340 1.00 0.00 C ATOM 539 CE1 PHE A 176 4.978 -1.121 6.497 1.00 0.00 C ATOM 540 CE2 PHE A 176 4.472 0.515 4.777 1.00 0.00 C ATOM 541 CZ PHE A 176 4.060 -0.279 5.857 1.00 0.00 C ATOM 0 H PHE A 176 9.269 2.358 4.088 1.00 0.00 H new ATOM 0 HA PHE A 176 8.740 0.548 6.344 1.00 0.00 H new ATOM 0 HB2 PHE A 176 8.205 -0.231 3.443 1.00 0.00 H new ATOM 0 HB3 PHE A 176 8.565 -1.422 4.677 1.00 0.00 H new ATOM 0 HD1 PHE A 176 7.016 -1.817 6.554 1.00 0.00 H new ATOM 0 HD2 PHE A 176 6.120 1.079 3.509 1.00 0.00 H new ATOM 0 HE1 PHE A 176 4.660 -1.734 7.328 1.00 0.00 H new ATOM 0 HE2 PHE A 176 3.764 1.163 4.282 1.00 0.00 H new ATOM 0 HZ PHE A 176 3.035 -0.241 6.195 1.00 0.00 H new ATOM 551 N GLU A 177 10.941 -0.783 5.487 1.00 0.00 N ATOM 552 CA GLU A 177 12.387 -1.094 5.306 1.00 0.00 C ATOM 553 C GLU A 177 12.602 -1.772 3.951 1.00 0.00 C ATOM 554 O GLU A 177 13.665 -1.690 3.369 1.00 0.00 O ATOM 555 CB GLU A 177 12.851 -2.029 6.425 1.00 0.00 C ATOM 556 CG GLU A 177 14.380 -2.106 6.424 1.00 0.00 C ATOM 557 CD GLU A 177 14.835 -3.202 7.389 1.00 0.00 C ATOM 558 OE1 GLU A 177 14.488 -3.119 8.556 1.00 0.00 O ATOM 559 OE2 GLU A 177 15.523 -4.106 6.945 1.00 0.00 O ATOM 0 H GLU A 177 10.395 -1.510 5.949 1.00 0.00 H new ATOM 0 HA GLU A 177 12.963 -0.169 5.342 1.00 0.00 H new ATOM 0 HB2 GLU A 177 12.495 -1.665 7.389 1.00 0.00 H new ATOM 0 HB3 GLU A 177 12.426 -3.023 6.283 1.00 0.00 H new ATOM 0 HG2 GLU A 177 14.744 -2.318 5.418 1.00 0.00 H new ATOM 0 HG3 GLU A 177 14.803 -1.146 6.721 1.00 0.00 H new ATOM 566 N THR A 178 11.603 -2.444 3.443 1.00 0.00 N ATOM 567 CA THR A 178 11.760 -3.127 2.126 1.00 0.00 C ATOM 568 C THR A 178 10.473 -2.982 1.310 1.00 0.00 C ATOM 569 O THR A 178 9.484 -2.455 1.779 1.00 0.00 O ATOM 570 CB THR A 178 12.052 -4.611 2.354 1.00 0.00 C ATOM 571 OG1 THR A 178 10.828 -5.308 2.549 1.00 0.00 O ATOM 572 CG2 THR A 178 12.939 -4.777 3.589 1.00 0.00 C ATOM 0 H THR A 178 10.688 -2.549 3.881 1.00 0.00 H new ATOM 0 HA THR A 178 12.586 -2.670 1.581 1.00 0.00 H new ATOM 0 HB THR A 178 12.568 -5.017 1.484 1.00 0.00 H new ATOM 0 HG1 THR A 178 11.013 -6.259 2.694 1.00 0.00 H new ATOM 0 HG21 THR A 178 13.145 -5.835 3.749 1.00 0.00 H new ATOM 0 HG22 THR A 178 13.877 -4.243 3.438 1.00 0.00 H new ATOM 0 HG23 THR A 178 12.427 -4.371 4.462 1.00 0.00 H new ATOM 580 N ALA A 179 10.478 -3.451 0.092 1.00 0.00 N ATOM 581 CA ALA A 179 9.261 -3.349 -0.756 1.00 0.00 C ATOM 582 C ALA A 179 8.293 -4.465 -0.380 1.00 0.00 C ATOM 583 O ALA A 179 7.114 -4.389 -0.647 1.00 0.00 O ATOM 584 CB ALA A 179 9.653 -3.501 -2.224 1.00 0.00 C ATOM 0 H ALA A 179 11.278 -3.902 -0.352 1.00 0.00 H new ATOM 0 HA ALA A 179 8.787 -2.380 -0.601 1.00 0.00 H new ATOM 0 HB1 ALA A 179 8.762 -3.427 -2.848 1.00 0.00 H new ATOM 0 HB2 ALA A 179 10.354 -2.712 -2.497 1.00 0.00 H new ATOM 0 HB3 ALA A 179 10.123 -4.473 -2.376 1.00 0.00 H new ATOM 590 N GLU A 180 8.786 -5.505 0.229 1.00 0.00 N ATOM 591 CA GLU A 180 7.895 -6.634 0.620 1.00 0.00 C ATOM 592 C GLU A 180 7.087 -6.245 1.858 1.00 0.00 C ATOM 593 O GLU A 180 5.929 -6.589 1.987 1.00 0.00 O ATOM 594 CB GLU A 180 8.741 -7.870 0.930 1.00 0.00 C ATOM 595 CG GLU A 180 7.824 -9.054 1.250 1.00 0.00 C ATOM 596 CD GLU A 180 8.672 -10.264 1.645 1.00 0.00 C ATOM 597 OE1 GLU A 180 9.862 -10.240 1.380 1.00 0.00 O ATOM 598 OE2 GLU A 180 8.117 -11.194 2.207 1.00 0.00 O ATOM 0 H GLU A 180 9.769 -5.624 0.474 1.00 0.00 H new ATOM 0 HA GLU A 180 7.214 -6.857 -0.201 1.00 0.00 H new ATOM 0 HB2 GLU A 180 9.378 -8.110 0.078 1.00 0.00 H new ATOM 0 HB3 GLU A 180 9.400 -7.669 1.774 1.00 0.00 H new ATOM 0 HG2 GLU A 180 7.144 -8.792 2.061 1.00 0.00 H new ATOM 0 HG3 GLU A 180 7.208 -9.295 0.384 1.00 0.00 H new ATOM 605 N ASP A 181 7.684 -5.530 2.770 1.00 0.00 N ATOM 606 CA ASP A 181 6.945 -5.120 3.993 1.00 0.00 C ATOM 607 C ASP A 181 5.964 -4.003 3.632 1.00 0.00 C ATOM 608 O ASP A 181 4.873 -3.929 4.159 1.00 0.00 O ATOM 609 CB ASP A 181 7.931 -4.614 5.046 1.00 0.00 C ATOM 610 CG ASP A 181 9.270 -5.341 4.896 1.00 0.00 C ATOM 611 OD1 ASP A 181 9.251 -6.549 4.734 1.00 0.00 O ATOM 612 OD2 ASP A 181 10.292 -4.676 4.947 1.00 0.00 O ATOM 0 H ASP A 181 8.652 -5.212 2.720 1.00 0.00 H new ATOM 0 HA ASP A 181 6.400 -5.974 4.395 1.00 0.00 H new ATOM 0 HB2 ASP A 181 8.076 -3.539 4.935 1.00 0.00 H new ATOM 0 HB3 ASP A 181 7.527 -4.779 6.045 1.00 0.00 H new ATOM 617 N ALA A 182 6.344 -3.136 2.733 1.00 0.00 N ATOM 618 CA ALA A 182 5.430 -2.031 2.334 1.00 0.00 C ATOM 619 C ALA A 182 4.299 -2.603 1.483 1.00 0.00 C ATOM 620 O ALA A 182 3.153 -2.221 1.610 1.00 0.00 O ATOM 621 CB ALA A 182 6.207 -0.992 1.522 1.00 0.00 C ATOM 0 H ALA A 182 7.247 -3.146 2.259 1.00 0.00 H new ATOM 0 HA ALA A 182 5.017 -1.556 3.224 1.00 0.00 H new ATOM 0 HB1 ALA A 182 5.537 -0.183 1.230 1.00 0.00 H new ATOM 0 HB2 ALA A 182 7.019 -0.590 2.128 1.00 0.00 H new ATOM 0 HB3 ALA A 182 6.619 -1.462 0.629 1.00 0.00 H new ATOM 627 N ALA A 183 4.612 -3.528 0.621 1.00 0.00 N ATOM 628 CA ALA A 183 3.559 -4.138 -0.233 1.00 0.00 C ATOM 629 C ALA A 183 2.603 -4.929 0.657 1.00 0.00 C ATOM 630 O ALA A 183 1.403 -4.915 0.464 1.00 0.00 O ATOM 631 CB ALA A 183 4.202 -5.074 -1.260 1.00 0.00 C ATOM 0 H ALA A 183 5.554 -3.888 0.471 1.00 0.00 H new ATOM 0 HA ALA A 183 3.013 -3.357 -0.762 1.00 0.00 H new ATOM 0 HB1 ALA A 183 3.426 -5.518 -1.883 1.00 0.00 H new ATOM 0 HB2 ALA A 183 4.891 -4.508 -1.887 1.00 0.00 H new ATOM 0 HB3 ALA A 183 4.747 -5.863 -0.742 1.00 0.00 H new ATOM 637 N LEU A 184 3.131 -5.609 1.638 1.00 0.00 N ATOM 638 CA LEU A 184 2.263 -6.394 2.557 1.00 0.00 C ATOM 639 C LEU A 184 1.363 -5.429 3.324 1.00 0.00 C ATOM 640 O LEU A 184 0.183 -5.662 3.497 1.00 0.00 O ATOM 641 CB LEU A 184 3.134 -7.176 3.544 1.00 0.00 C ATOM 642 CG LEU A 184 2.273 -8.184 4.304 1.00 0.00 C ATOM 643 CD1 LEU A 184 1.911 -9.348 3.380 1.00 0.00 C ATOM 644 CD2 LEU A 184 3.054 -8.713 5.509 1.00 0.00 C ATOM 0 H LEU A 184 4.129 -5.654 1.842 1.00 0.00 H new ATOM 0 HA LEU A 184 1.655 -7.095 1.985 1.00 0.00 H new ATOM 0 HB2 LEU A 184 3.931 -7.694 3.010 1.00 0.00 H new ATOM 0 HB3 LEU A 184 3.612 -6.491 4.244 1.00 0.00 H new ATOM 0 HG LEU A 184 1.360 -7.697 4.646 1.00 0.00 H new ATOM 0 HD11 LEU A 184 1.297 -10.066 3.923 1.00 0.00 H new ATOM 0 HD12 LEU A 184 1.355 -8.972 2.521 1.00 0.00 H new ATOM 0 HD13 LEU A 184 2.823 -9.837 3.036 1.00 0.00 H new ATOM 0 HD21 LEU A 184 2.441 -9.432 6.052 1.00 0.00 H new ATOM 0 HD22 LEU A 184 3.967 -9.200 5.166 1.00 0.00 H new ATOM 0 HD23 LEU A 184 3.311 -7.884 6.168 1.00 0.00 H new ATOM 656 N ALA A 185 1.915 -4.338 3.775 1.00 0.00 N ATOM 657 CA ALA A 185 1.098 -3.343 4.520 1.00 0.00 C ATOM 658 C ALA A 185 0.030 -2.791 3.579 1.00 0.00 C ATOM 659 O ALA A 185 -1.009 -2.324 4.002 1.00 0.00 O ATOM 660 CB ALA A 185 1.997 -2.202 5.006 1.00 0.00 C ATOM 0 H ALA A 185 2.898 -4.093 3.659 1.00 0.00 H new ATOM 0 HA ALA A 185 0.627 -3.815 5.383 1.00 0.00 H new ATOM 0 HB1 ALA A 185 1.397 -1.474 5.552 1.00 0.00 H new ATOM 0 HB2 ALA A 185 2.769 -2.602 5.663 1.00 0.00 H new ATOM 0 HB3 ALA A 185 2.465 -1.718 4.149 1.00 0.00 H new ATOM 666 N TYR A 186 0.279 -2.851 2.300 1.00 0.00 N ATOM 667 CA TYR A 186 -0.716 -2.344 1.319 1.00 0.00 C ATOM 668 C TYR A 186 -1.855 -3.355 1.195 1.00 0.00 C ATOM 669 O TYR A 186 -2.979 -3.004 0.900 1.00 0.00 O ATOM 670 CB TYR A 186 -0.041 -2.160 -0.043 1.00 0.00 C ATOM 671 CG TYR A 186 -1.094 -1.976 -1.108 1.00 0.00 C ATOM 672 CD1 TYR A 186 -1.753 -3.093 -1.638 1.00 0.00 C ATOM 673 CD2 TYR A 186 -1.414 -0.691 -1.565 1.00 0.00 C ATOM 674 CE1 TYR A 186 -2.732 -2.926 -2.626 1.00 0.00 C ATOM 675 CE2 TYR A 186 -2.394 -0.523 -2.552 1.00 0.00 C ATOM 676 CZ TYR A 186 -3.053 -1.641 -3.083 1.00 0.00 C ATOM 677 OH TYR A 186 -4.017 -1.475 -4.056 1.00 0.00 O ATOM 0 H TYR A 186 1.133 -3.231 1.892 1.00 0.00 H new ATOM 0 HA TYR A 186 -1.112 -1.386 1.656 1.00 0.00 H new ATOM 0 HB2 TYR A 186 0.621 -1.294 -0.018 1.00 0.00 H new ATOM 0 HB3 TYR A 186 0.577 -3.028 -0.274 1.00 0.00 H new ATOM 0 HD1 TYR A 186 -1.506 -4.083 -1.285 1.00 0.00 H new ATOM 0 HD2 TYR A 186 -0.905 0.170 -1.157 1.00 0.00 H new ATOM 0 HE1 TYR A 186 -3.239 -3.787 -3.035 1.00 0.00 H new ATOM 0 HE2 TYR A 186 -2.642 0.468 -2.904 1.00 0.00 H new ATOM 0 HH TYR A 186 -4.118 -0.521 -4.257 1.00 0.00 H new ATOM 687 N ASP A 187 -1.572 -4.609 1.415 1.00 0.00 N ATOM 688 CA ASP A 187 -2.631 -5.643 1.312 1.00 0.00 C ATOM 689 C ASP A 187 -3.546 -5.554 2.532 1.00 0.00 C ATOM 690 O ASP A 187 -4.756 -5.553 2.417 1.00 0.00 O ATOM 691 CB ASP A 187 -1.978 -7.023 1.263 1.00 0.00 C ATOM 692 CG ASP A 187 -1.087 -7.126 0.023 1.00 0.00 C ATOM 693 OD1 ASP A 187 -1.221 -6.285 -0.850 1.00 0.00 O ATOM 694 OD2 ASP A 187 -0.285 -8.044 -0.031 1.00 0.00 O ATOM 0 H ASP A 187 -0.647 -4.960 1.663 1.00 0.00 H new ATOM 0 HA ASP A 187 -3.218 -5.483 0.408 1.00 0.00 H new ATOM 0 HB2 ASP A 187 -1.386 -7.188 2.163 1.00 0.00 H new ATOM 0 HB3 ASP A 187 -2.744 -7.798 1.238 1.00 0.00 H new ATOM 699 N ARG A 188 -2.975 -5.480 3.698 1.00 0.00 N ATOM 700 CA ARG A 188 -3.804 -5.392 4.932 1.00 0.00 C ATOM 701 C ARG A 188 -4.633 -4.106 4.896 1.00 0.00 C ATOM 702 O ARG A 188 -5.734 -4.051 5.407 1.00 0.00 O ATOM 703 CB ARG A 188 -2.893 -5.382 6.161 1.00 0.00 C ATOM 704 CG ARG A 188 -2.589 -6.822 6.578 1.00 0.00 C ATOM 705 CD ARG A 188 -2.553 -6.916 8.105 1.00 0.00 C ATOM 706 NE ARG A 188 -1.308 -7.614 8.529 1.00 0.00 N ATOM 707 CZ ARG A 188 -1.354 -8.865 8.897 1.00 0.00 C ATOM 708 NH1 ARG A 188 -1.909 -9.753 8.120 1.00 0.00 N ATOM 709 NH2 ARG A 188 -0.842 -9.227 10.040 1.00 0.00 N ATOM 0 H ARG A 188 -1.967 -5.477 3.852 1.00 0.00 H new ATOM 0 HA ARG A 188 -4.471 -6.253 4.985 1.00 0.00 H new ATOM 0 HB2 ARG A 188 -1.967 -4.853 5.937 1.00 0.00 H new ATOM 0 HB3 ARG A 188 -3.375 -4.848 6.980 1.00 0.00 H new ATOM 0 HG2 ARG A 188 -3.348 -7.495 6.180 1.00 0.00 H new ATOM 0 HG3 ARG A 188 -1.633 -7.138 6.161 1.00 0.00 H new ATOM 0 HD2 ARG A 188 -2.591 -5.918 8.543 1.00 0.00 H new ATOM 0 HD3 ARG A 188 -3.427 -7.456 8.468 1.00 0.00 H new ATOM 0 HE ARG A 188 -0.419 -7.114 8.532 1.00 0.00 H new ATOM 0 HH11 ARG A 188 -2.307 -9.470 7.225 1.00 0.00 H new ATOM 0 HH12 ARG A 188 -1.945 -10.731 8.408 1.00 0.00 H new ATOM 0 HH21 ARG A 188 -0.406 -8.532 10.646 1.00 0.00 H new ATOM 0 HH22 ARG A 188 -0.878 -10.205 10.328 1.00 0.00 H new ATOM 723 N ALA A 189 -4.116 -3.074 4.288 1.00 0.00 N ATOM 724 CA ALA A 189 -4.878 -1.797 4.211 1.00 0.00 C ATOM 725 C ALA A 189 -5.759 -1.817 2.962 1.00 0.00 C ATOM 726 O ALA A 189 -6.731 -1.093 2.861 1.00 0.00 O ATOM 727 CB ALA A 189 -3.900 -0.623 4.128 1.00 0.00 C ATOM 0 H ALA A 189 -3.199 -3.060 3.841 1.00 0.00 H new ATOM 0 HA ALA A 189 -5.500 -1.685 5.099 1.00 0.00 H new ATOM 0 HB1 ALA A 189 -4.458 0.312 4.072 1.00 0.00 H new ATOM 0 HB2 ALA A 189 -3.266 -0.614 5.015 1.00 0.00 H new ATOM 0 HB3 ALA A 189 -3.279 -0.729 3.239 1.00 0.00 H new ATOM 733 N ALA A 190 -5.427 -2.647 2.014 1.00 0.00 N ATOM 734 CA ALA A 190 -6.241 -2.725 0.770 1.00 0.00 C ATOM 735 C ALA A 190 -7.340 -3.772 0.950 1.00 0.00 C ATOM 736 O ALA A 190 -8.158 -3.982 0.077 1.00 0.00 O ATOM 737 CB ALA A 190 -5.343 -3.124 -0.403 1.00 0.00 C ATOM 0 H ALA A 190 -4.625 -3.276 2.047 1.00 0.00 H new ATOM 0 HA ALA A 190 -6.692 -1.754 0.567 1.00 0.00 H new ATOM 0 HB1 ALA A 190 -5.939 -3.181 -1.314 1.00 0.00 H new ATOM 0 HB2 ALA A 190 -4.557 -2.379 -0.529 1.00 0.00 H new ATOM 0 HB3 ALA A 190 -4.893 -4.096 -0.202 1.00 0.00 H new ATOM 743 N PHE A 191 -7.371 -4.427 2.079 1.00 0.00 N ATOM 744 CA PHE A 191 -8.423 -5.455 2.317 1.00 0.00 C ATOM 745 C PHE A 191 -9.423 -4.913 3.337 1.00 0.00 C ATOM 746 O PHE A 191 -10.608 -5.167 3.257 1.00 0.00 O ATOM 747 CB PHE A 191 -7.779 -6.732 2.857 1.00 0.00 C ATOM 748 CG PHE A 191 -8.611 -7.925 2.458 1.00 0.00 C ATOM 749 CD1 PHE A 191 -9.794 -8.214 3.150 1.00 0.00 C ATOM 750 CD2 PHE A 191 -8.199 -8.745 1.400 1.00 0.00 C ATOM 751 CE1 PHE A 191 -10.567 -9.322 2.783 1.00 0.00 C ATOM 752 CE2 PHE A 191 -8.973 -9.855 1.033 1.00 0.00 C ATOM 753 CZ PHE A 191 -10.157 -10.144 1.724 1.00 0.00 C ATOM 0 H PHE A 191 -6.713 -4.294 2.847 1.00 0.00 H new ATOM 0 HA PHE A 191 -8.936 -5.682 1.383 1.00 0.00 H new ATOM 0 HB2 PHE A 191 -6.767 -6.834 2.466 1.00 0.00 H new ATOM 0 HB3 PHE A 191 -7.697 -6.679 3.943 1.00 0.00 H new ATOM 0 HD1 PHE A 191 -10.110 -7.582 3.967 1.00 0.00 H new ATOM 0 HD2 PHE A 191 -7.286 -8.523 0.867 1.00 0.00 H new ATOM 0 HE1 PHE A 191 -11.480 -9.544 3.316 1.00 0.00 H new ATOM 0 HE2 PHE A 191 -8.656 -10.488 0.217 1.00 0.00 H new ATOM 0 HZ PHE A 191 -10.753 -10.999 1.441 1.00 0.00 H new ATOM 763 N ARG A 192 -8.952 -4.159 4.289 1.00 0.00 N ATOM 764 CA ARG A 192 -9.872 -3.585 5.307 1.00 0.00 C ATOM 765 C ARG A 192 -10.615 -2.407 4.685 1.00 0.00 C ATOM 766 O ARG A 192 -11.793 -2.207 4.907 1.00 0.00 O ATOM 767 CB ARG A 192 -9.060 -3.095 6.507 1.00 0.00 C ATOM 768 CG ARG A 192 -8.471 -4.293 7.255 1.00 0.00 C ATOM 769 CD ARG A 192 -9.232 -4.504 8.565 1.00 0.00 C ATOM 770 NE ARG A 192 -8.375 -5.262 9.522 1.00 0.00 N ATOM 771 CZ ARG A 192 -8.351 -4.929 10.784 1.00 0.00 C ATOM 772 NH1 ARG A 192 -9.440 -4.510 11.368 1.00 0.00 N ATOM 773 NH2 ARG A 192 -7.238 -5.013 11.460 1.00 0.00 N ATOM 0 H ARG A 192 -7.968 -3.915 4.406 1.00 0.00 H new ATOM 0 HA ARG A 192 -10.582 -4.343 5.637 1.00 0.00 H new ATOM 0 HB2 ARG A 192 -8.260 -2.434 6.172 1.00 0.00 H new ATOM 0 HB3 ARG A 192 -9.695 -2.513 7.175 1.00 0.00 H new ATOM 0 HG2 ARG A 192 -8.536 -5.188 6.637 1.00 0.00 H new ATOM 0 HG3 ARG A 192 -7.414 -4.123 7.460 1.00 0.00 H new ATOM 0 HD2 ARG A 192 -9.512 -3.542 8.994 1.00 0.00 H new ATOM 0 HD3 ARG A 192 -10.156 -5.050 8.377 1.00 0.00 H new ATOM 0 HE ARG A 192 -7.807 -6.041 9.190 1.00 0.00 H new ATOM 0 HH11 ARG A 192 -10.309 -4.443 10.838 1.00 0.00 H new ATOM 0 HH12 ARG A 192 -9.422 -4.250 12.354 1.00 0.00 H new ATOM 0 HH21 ARG A 192 -6.387 -5.339 11.002 1.00 0.00 H new ATOM 0 HH22 ARG A 192 -7.219 -4.753 12.446 1.00 0.00 H new ATOM 787 N MET A 193 -9.924 -1.625 3.904 1.00 0.00 N ATOM 788 CA MET A 193 -10.566 -0.448 3.255 1.00 0.00 C ATOM 789 C MET A 193 -11.425 -0.906 2.074 1.00 0.00 C ATOM 790 O MET A 193 -12.480 -0.361 1.816 1.00 0.00 O ATOM 791 CB MET A 193 -9.484 0.506 2.752 1.00 0.00 C ATOM 792 CG MET A 193 -10.137 1.760 2.170 1.00 0.00 C ATOM 793 SD MET A 193 -9.022 2.516 0.961 1.00 0.00 S ATOM 794 CE MET A 193 -7.653 2.857 2.095 1.00 0.00 C ATOM 0 H MET A 193 -8.936 -1.751 3.686 1.00 0.00 H new ATOM 0 HA MET A 193 -11.198 0.061 3.983 1.00 0.00 H new ATOM 0 HB2 MET A 193 -8.816 0.777 3.569 1.00 0.00 H new ATOM 0 HB3 MET A 193 -8.876 0.014 1.993 1.00 0.00 H new ATOM 0 HG2 MET A 193 -11.084 1.503 1.696 1.00 0.00 H new ATOM 0 HG3 MET A 193 -10.361 2.469 2.967 1.00 0.00 H new ATOM 0 HE1 MET A 193 -6.970 3.572 1.636 1.00 0.00 H new ATOM 0 HE2 MET A 193 -8.045 3.273 3.023 1.00 0.00 H new ATOM 0 HE3 MET A 193 -7.119 1.931 2.309 1.00 0.00 H new ATOM 804 N ARG A 194 -10.984 -1.899 1.352 1.00 0.00 N ATOM 805 CA ARG A 194 -11.783 -2.380 0.189 1.00 0.00 C ATOM 806 C ARG A 194 -12.940 -3.240 0.696 1.00 0.00 C ATOM 807 O ARG A 194 -13.911 -3.468 0.003 1.00 0.00 O ATOM 808 CB ARG A 194 -10.895 -3.208 -0.740 1.00 0.00 C ATOM 809 CG ARG A 194 -10.090 -2.271 -1.643 1.00 0.00 C ATOM 810 CD ARG A 194 -10.447 -2.541 -3.106 1.00 0.00 C ATOM 811 NE ARG A 194 -10.970 -1.292 -3.728 1.00 0.00 N ATOM 812 CZ ARG A 194 -10.594 -0.957 -4.932 1.00 0.00 C ATOM 813 NH1 ARG A 194 -10.174 -1.872 -5.761 1.00 0.00 N ATOM 814 NH2 ARG A 194 -10.638 0.292 -5.305 1.00 0.00 N ATOM 0 H ARG A 194 -10.109 -2.397 1.516 1.00 0.00 H new ATOM 0 HA ARG A 194 -12.176 -1.526 -0.362 1.00 0.00 H new ATOM 0 HB2 ARG A 194 -10.222 -3.834 -0.155 1.00 0.00 H new ATOM 0 HB3 ARG A 194 -11.507 -3.877 -1.345 1.00 0.00 H new ATOM 0 HG2 ARG A 194 -10.305 -1.232 -1.391 1.00 0.00 H new ATOM 0 HG3 ARG A 194 -9.023 -2.424 -1.484 1.00 0.00 H new ATOM 0 HD2 ARG A 194 -9.568 -2.889 -3.648 1.00 0.00 H new ATOM 0 HD3 ARG A 194 -11.194 -3.332 -3.169 1.00 0.00 H new ATOM 0 HE ARG A 194 -11.621 -0.699 -3.213 1.00 0.00 H new ATOM 0 HH11 ARG A 194 -10.140 -2.848 -5.468 1.00 0.00 H new ATOM 0 HH12 ARG A 194 -9.880 -1.611 -6.702 1.00 0.00 H new ATOM 0 HH21 ARG A 194 -10.966 1.007 -4.656 1.00 0.00 H new ATOM 0 HH22 ARG A 194 -10.344 0.554 -6.246 1.00 0.00 H new ATOM 828 N GLY A 195 -12.846 -3.713 1.909 1.00 0.00 N ATOM 829 CA GLY A 195 -13.943 -4.552 2.469 1.00 0.00 C ATOM 830 C GLY A 195 -13.612 -6.036 2.291 1.00 0.00 C ATOM 831 O GLY A 195 -12.554 -6.497 2.674 1.00 0.00 O ATOM 0 H GLY A 195 -12.057 -3.555 2.536 1.00 0.00 H new ATOM 0 HA2 GLY A 195 -14.081 -4.326 3.526 1.00 0.00 H new ATOM 0 HA3 GLY A 195 -14.882 -4.318 1.968 1.00 0.00 H new ATOM 835 N SER A 196 -14.514 -6.788 1.721 1.00 0.00 N ATOM 836 CA SER A 196 -14.264 -8.245 1.524 1.00 0.00 C ATOM 837 C SER A 196 -13.084 -8.451 0.570 1.00 0.00 C ATOM 838 O SER A 196 -12.161 -7.663 0.530 1.00 0.00 O ATOM 839 CB SER A 196 -15.517 -8.895 0.936 1.00 0.00 C ATOM 840 OG SER A 196 -16.649 -8.521 1.710 1.00 0.00 O ATOM 0 H SER A 196 -15.417 -6.455 1.382 1.00 0.00 H new ATOM 0 HA SER A 196 -14.027 -8.703 2.484 1.00 0.00 H new ATOM 0 HB2 SER A 196 -15.651 -8.582 -0.099 1.00 0.00 H new ATOM 0 HB3 SER A 196 -15.409 -9.980 0.930 1.00 0.00 H new ATOM 0 HG SER A 196 -17.454 -8.935 1.334 1.00 0.00 H new ATOM 846 N ARG A 197 -13.110 -9.513 -0.193 1.00 0.00 N ATOM 847 CA ARG A 197 -11.996 -9.791 -1.146 1.00 0.00 C ATOM 848 C ARG A 197 -11.533 -8.490 -1.805 1.00 0.00 C ATOM 849 O ARG A 197 -12.329 -7.643 -2.159 1.00 0.00 O ATOM 850 CB ARG A 197 -12.485 -10.762 -2.225 1.00 0.00 C ATOM 851 CG ARG A 197 -11.286 -11.464 -2.866 1.00 0.00 C ATOM 852 CD ARG A 197 -11.559 -11.686 -4.356 1.00 0.00 C ATOM 853 NE ARG A 197 -12.308 -12.961 -4.540 1.00 0.00 N ATOM 854 CZ ARG A 197 -12.215 -13.614 -5.667 1.00 0.00 C ATOM 855 NH1 ARG A 197 -12.763 -13.130 -6.748 1.00 0.00 N ATOM 856 NH2 ARG A 197 -11.574 -14.750 -5.712 1.00 0.00 N ATOM 0 H ARG A 197 -13.861 -10.204 -0.196 1.00 0.00 H new ATOM 0 HA ARG A 197 -11.160 -10.232 -0.602 1.00 0.00 H new ATOM 0 HB2 ARG A 197 -13.159 -11.498 -1.787 1.00 0.00 H new ATOM 0 HB3 ARG A 197 -13.052 -10.223 -2.984 1.00 0.00 H new ATOM 0 HG2 ARG A 197 -10.387 -10.862 -2.736 1.00 0.00 H new ATOM 0 HG3 ARG A 197 -11.104 -12.419 -2.373 1.00 0.00 H new ATOM 0 HD2 ARG A 197 -12.134 -10.853 -4.759 1.00 0.00 H new ATOM 0 HD3 ARG A 197 -10.619 -11.721 -4.907 1.00 0.00 H new ATOM 0 HE ARG A 197 -12.893 -13.323 -3.787 1.00 0.00 H new ATOM 0 HH11 ARG A 197 -13.264 -12.242 -6.712 1.00 0.00 H new ATOM 0 HH12 ARG A 197 -12.691 -13.640 -7.629 1.00 0.00 H new ATOM 0 HH21 ARG A 197 -11.146 -15.128 -4.867 1.00 0.00 H new ATOM 0 HH22 ARG A 197 -11.501 -15.260 -6.592 1.00 0.00 H new ATOM 870 N ALA A 198 -10.248 -8.328 -1.974 1.00 0.00 N ATOM 871 CA ALA A 198 -9.728 -7.086 -2.611 1.00 0.00 C ATOM 872 C ALA A 198 -8.487 -7.428 -3.438 1.00 0.00 C ATOM 873 O ALA A 198 -8.109 -8.576 -3.561 1.00 0.00 O ATOM 874 CB ALA A 198 -9.356 -6.072 -1.527 1.00 0.00 C ATOM 0 H ALA A 198 -9.536 -9.004 -1.698 1.00 0.00 H new ATOM 0 HA ALA A 198 -10.494 -6.657 -3.258 1.00 0.00 H new ATOM 0 HB1 ALA A 198 -8.976 -5.163 -1.994 1.00 0.00 H new ATOM 0 HB2 ALA A 198 -10.239 -5.833 -0.934 1.00 0.00 H new ATOM 0 HB3 ALA A 198 -8.588 -6.496 -0.880 1.00 0.00 H new ATOM 880 N LEU A 199 -7.847 -6.443 -4.004 1.00 0.00 N ATOM 881 CA LEU A 199 -6.630 -6.717 -4.820 1.00 0.00 C ATOM 882 C LEU A 199 -5.385 -6.324 -4.020 1.00 0.00 C ATOM 883 O LEU A 199 -5.232 -5.190 -3.612 1.00 0.00 O ATOM 884 CB LEU A 199 -6.686 -5.901 -6.112 1.00 0.00 C ATOM 885 CG LEU A 199 -5.878 -6.613 -7.199 1.00 0.00 C ATOM 886 CD1 LEU A 199 -6.815 -7.058 -8.323 1.00 0.00 C ATOM 887 CD2 LEU A 199 -4.826 -5.653 -7.762 1.00 0.00 C ATOM 0 H LEU A 199 -8.113 -5.461 -3.937 1.00 0.00 H new ATOM 0 HA LEU A 199 -6.586 -7.778 -5.065 1.00 0.00 H new ATOM 0 HB2 LEU A 199 -7.720 -5.779 -6.433 1.00 0.00 H new ATOM 0 HB3 LEU A 199 -6.285 -4.902 -5.942 1.00 0.00 H new ATOM 0 HG LEU A 199 -5.384 -7.486 -6.772 1.00 0.00 H new ATOM 0 HD11 LEU A 199 -6.239 -7.565 -9.097 1.00 0.00 H new ATOM 0 HD12 LEU A 199 -7.565 -7.740 -7.923 1.00 0.00 H new ATOM 0 HD13 LEU A 199 -7.309 -6.186 -8.751 1.00 0.00 H new ATOM 0 HD21 LEU A 199 -4.249 -6.159 -8.537 1.00 0.00 H new ATOM 0 HD22 LEU A 199 -5.321 -4.781 -8.189 1.00 0.00 H new ATOM 0 HD23 LEU A 199 -4.158 -5.335 -6.962 1.00 0.00 H new ATOM 899 N LEU A 200 -4.498 -7.253 -3.788 1.00 0.00 N ATOM 900 CA LEU A 200 -3.269 -6.931 -3.009 1.00 0.00 C ATOM 901 C LEU A 200 -2.042 -7.468 -3.745 1.00 0.00 C ATOM 902 O LEU A 200 -2.116 -8.443 -4.466 1.00 0.00 O ATOM 903 CB LEU A 200 -3.333 -7.581 -1.618 1.00 0.00 C ATOM 904 CG LEU A 200 -4.635 -8.369 -1.456 1.00 0.00 C ATOM 905 CD1 LEU A 200 -4.553 -9.244 -0.204 1.00 0.00 C ATOM 906 CD2 LEU A 200 -5.805 -7.393 -1.319 1.00 0.00 C ATOM 0 H LEU A 200 -4.571 -8.220 -4.104 1.00 0.00 H new ATOM 0 HA LEU A 200 -3.200 -5.849 -2.901 1.00 0.00 H new ATOM 0 HB2 LEU A 200 -2.479 -8.245 -1.480 1.00 0.00 H new ATOM 0 HB3 LEU A 200 -3.267 -6.813 -0.847 1.00 0.00 H new ATOM 0 HG LEU A 200 -4.787 -9.002 -2.330 1.00 0.00 H new ATOM 0 HD11 LEU A 200 -5.481 -9.804 -0.090 1.00 0.00 H new ATOM 0 HD12 LEU A 200 -3.719 -9.939 -0.300 1.00 0.00 H new ATOM 0 HD13 LEU A 200 -4.401 -8.613 0.672 1.00 0.00 H new ATOM 0 HD21 LEU A 200 -6.734 -7.952 -1.204 1.00 0.00 H new ATOM 0 HD22 LEU A 200 -5.651 -6.761 -0.445 1.00 0.00 H new ATOM 0 HD23 LEU A 200 -5.865 -6.770 -2.211 1.00 0.00 H new ATOM 918 N ASN A 201 -0.906 -6.854 -3.556 1.00 0.00 N ATOM 919 CA ASN A 201 0.323 -7.355 -4.237 1.00 0.00 C ATOM 920 C ASN A 201 0.490 -8.829 -3.875 1.00 0.00 C ATOM 921 O ASN A 201 0.965 -9.629 -4.654 1.00 0.00 O ATOM 922 CB ASN A 201 1.560 -6.581 -3.762 1.00 0.00 C ATOM 923 CG ASN A 201 1.173 -5.159 -3.352 1.00 0.00 C ATOM 924 OD1 ASN A 201 1.443 -4.756 -2.141 1.00 0.00 O flip ATOM 925 ND2 ASN A 201 0.627 -4.410 -4.138 1.00 0.00 N flip ATOM 0 H ASN A 201 -0.775 -6.033 -2.964 1.00 0.00 H new ATOM 0 HA ASN A 201 0.225 -7.221 -5.314 1.00 0.00 H new ATOM 0 HB2 ASN A 201 2.019 -7.098 -2.919 1.00 0.00 H new ATOM 0 HB3 ASN A 201 2.304 -6.547 -4.558 1.00 0.00 H new ATOM 0 HD21 ASN A 201 0.417 -4.728 -5.084 1.00 0.00 H new ATOM 0 HD22 ASN A 201 0.378 -3.463 -3.852 1.00 0.00 H new ATOM 932 N PHE A 202 0.089 -9.185 -2.686 1.00 0.00 N ATOM 933 CA PHE A 202 0.202 -10.599 -2.241 1.00 0.00 C ATOM 934 C PHE A 202 -1.202 -11.146 -1.972 1.00 0.00 C ATOM 935 O PHE A 202 -1.732 -10.976 -0.893 1.00 0.00 O ATOM 936 CB PHE A 202 1.031 -10.657 -0.955 1.00 0.00 C ATOM 937 CG PHE A 202 2.262 -9.801 -1.109 1.00 0.00 C ATOM 938 CD1 PHE A 202 2.892 -9.701 -2.355 1.00 0.00 C ATOM 939 CD2 PHE A 202 2.780 -9.113 -0.005 1.00 0.00 C ATOM 940 CE1 PHE A 202 4.039 -8.912 -2.499 1.00 0.00 C ATOM 941 CE2 PHE A 202 3.928 -8.324 -0.147 1.00 0.00 C ATOM 942 CZ PHE A 202 4.558 -8.223 -1.395 1.00 0.00 C ATOM 0 H PHE A 202 -0.316 -8.549 -1.999 1.00 0.00 H new ATOM 0 HA PHE A 202 0.688 -11.197 -3.012 1.00 0.00 H new ATOM 0 HB2 PHE A 202 0.436 -10.308 -0.111 1.00 0.00 H new ATOM 0 HB3 PHE A 202 1.316 -11.687 -0.740 1.00 0.00 H new ATOM 0 HD1 PHE A 202 2.493 -10.233 -3.206 1.00 0.00 H new ATOM 0 HD2 PHE A 202 2.294 -9.191 0.956 1.00 0.00 H new ATOM 0 HE1 PHE A 202 4.524 -8.834 -3.461 1.00 0.00 H new ATOM 0 HE2 PHE A 202 4.328 -7.794 0.705 1.00 0.00 H new ATOM 0 HZ PHE A 202 5.443 -7.614 -1.506 1.00 0.00 H new ATOM 952 N PRO A 203 -1.766 -11.783 -2.966 1.00 0.00 N ATOM 953 CA PRO A 203 -3.118 -12.363 -2.868 1.00 0.00 C ATOM 954 C PRO A 203 -3.087 -13.649 -2.041 1.00 0.00 C ATOM 955 O PRO A 203 -3.104 -14.743 -2.572 1.00 0.00 O ATOM 956 CB PRO A 203 -3.495 -12.648 -4.325 1.00 0.00 C ATOM 957 CG PRO A 203 -2.164 -12.743 -5.110 1.00 0.00 C ATOM 958 CD PRO A 203 -1.109 -11.992 -4.274 1.00 0.00 C ATOM 0 HA PRO A 203 -3.834 -11.706 -2.374 1.00 0.00 H new ATOM 0 HB2 PRO A 203 -4.060 -13.576 -4.405 1.00 0.00 H new ATOM 0 HB3 PRO A 203 -4.126 -11.855 -4.725 1.00 0.00 H new ATOM 0 HG2 PRO A 203 -1.874 -13.783 -5.257 1.00 0.00 H new ATOM 0 HG3 PRO A 203 -2.264 -12.297 -6.099 1.00 0.00 H new ATOM 0 HD2 PRO A 203 -0.193 -12.575 -4.171 1.00 0.00 H new ATOM 0 HD3 PRO A 203 -0.834 -11.045 -4.738 1.00 0.00 H new ATOM 966 N LEU A 204 -3.038 -13.526 -0.743 1.00 0.00 N ATOM 967 CA LEU A 204 -3.003 -14.738 0.123 1.00 0.00 C ATOM 968 C LEU A 204 -4.251 -15.584 -0.136 1.00 0.00 C ATOM 969 O LEU A 204 -5.365 -15.109 -0.049 1.00 0.00 O ATOM 970 CB LEU A 204 -2.971 -14.311 1.592 1.00 0.00 C ATOM 971 CG LEU A 204 -2.414 -15.454 2.443 1.00 0.00 C ATOM 972 CD1 LEU A 204 -0.901 -15.288 2.596 1.00 0.00 C ATOM 973 CD2 LEU A 204 -3.073 -15.426 3.824 1.00 0.00 C ATOM 0 H LEU A 204 -3.021 -12.637 -0.244 1.00 0.00 H new ATOM 0 HA LEU A 204 -2.113 -15.325 -0.105 1.00 0.00 H new ATOM 0 HB2 LEU A 204 -2.353 -13.421 1.710 1.00 0.00 H new ATOM 0 HB3 LEU A 204 -3.974 -14.049 1.928 1.00 0.00 H new ATOM 0 HG LEU A 204 -2.626 -16.406 1.957 1.00 0.00 H new ATOM 0 HD11 LEU A 204 -0.505 -16.103 3.202 1.00 0.00 H new ATOM 0 HD12 LEU A 204 -0.432 -15.306 1.612 1.00 0.00 H new ATOM 0 HD13 LEU A 204 -0.687 -14.336 3.082 1.00 0.00 H new ATOM 0 HD21 LEU A 204 -2.678 -16.240 4.432 1.00 0.00 H new ATOM 0 HD22 LEU A 204 -2.860 -14.474 4.309 1.00 0.00 H new ATOM 0 HD23 LEU A 204 -4.151 -15.545 3.715 1.00 0.00 H new ATOM 985 N ARG A 205 -4.071 -16.837 -0.453 1.00 0.00 N ATOM 986 CA ARG A 205 -5.244 -17.716 -0.717 1.00 0.00 C ATOM 987 C ARG A 205 -4.994 -19.094 -0.105 1.00 0.00 C ATOM 988 O ARG A 205 -5.015 -20.099 -0.786 1.00 0.00 O ATOM 989 CB ARG A 205 -5.442 -17.862 -2.227 1.00 0.00 C ATOM 990 CG ARG A 205 -4.086 -18.096 -2.897 1.00 0.00 C ATOM 991 CD ARG A 205 -4.185 -19.294 -3.844 1.00 0.00 C ATOM 992 NE ARG A 205 -4.852 -18.873 -5.109 1.00 0.00 N ATOM 993 CZ ARG A 205 -5.608 -19.716 -5.758 1.00 0.00 C ATOM 994 NH1 ARG A 205 -6.541 -20.376 -5.128 1.00 0.00 N ATOM 995 NH2 ARG A 205 -5.431 -19.900 -7.038 1.00 0.00 N ATOM 0 H ARG A 205 -3.161 -17.290 -0.541 1.00 0.00 H new ATOM 0 HA ARG A 205 -6.136 -17.274 -0.273 1.00 0.00 H new ATOM 0 HB2 ARG A 205 -6.113 -18.695 -2.438 1.00 0.00 H new ATOM 0 HB3 ARG A 205 -5.910 -16.965 -2.632 1.00 0.00 H new ATOM 0 HG2 ARG A 205 -3.783 -17.206 -3.449 1.00 0.00 H new ATOM 0 HG3 ARG A 205 -3.322 -18.278 -2.142 1.00 0.00 H new ATOM 0 HD2 ARG A 205 -3.190 -19.686 -4.058 1.00 0.00 H new ATOM 0 HD3 ARG A 205 -4.750 -20.098 -3.373 1.00 0.00 H new ATOM 0 HE ARG A 205 -4.718 -17.927 -5.467 1.00 0.00 H new ATOM 0 HH11 ARG A 205 -6.680 -20.233 -4.128 1.00 0.00 H new ATOM 0 HH12 ARG A 205 -7.131 -21.035 -5.636 1.00 0.00 H new ATOM 0 HH21 ARG A 205 -4.702 -19.385 -7.531 1.00 0.00 H new ATOM 0 HH22 ARG A 205 -6.022 -20.559 -7.545 1.00 0.00 H new ATOM 1009 N VAL A 206 -4.755 -19.151 1.176 1.00 0.00 N ATOM 1010 CA VAL A 206 -4.503 -20.467 1.824 1.00 0.00 C ATOM 1011 C VAL A 206 -3.188 -21.047 1.301 1.00 0.00 C ATOM 1012 O VAL A 206 -2.192 -20.928 1.995 1.00 0.00 O ATOM 1013 CB VAL A 206 -5.650 -21.421 1.492 1.00 0.00 C ATOM 1014 CG1 VAL A 206 -5.687 -22.556 2.518 1.00 0.00 C ATOM 1015 CG2 VAL A 206 -6.974 -20.656 1.533 1.00 0.00 C ATOM 0 H VAL A 206 -4.723 -18.345 1.800 1.00 0.00 H new ATOM 0 HA VAL A 206 -4.438 -20.337 2.904 1.00 0.00 H new ATOM 0 HB VAL A 206 -5.498 -21.838 0.496 1.00 0.00 H new ATOM 0 HG11 VAL A 206 -6.505 -23.235 2.280 1.00 0.00 H new ATOM 0 HG12 VAL A 206 -4.744 -23.101 2.492 1.00 0.00 H new ATOM 0 HG13 VAL A 206 -5.838 -22.141 3.514 1.00 0.00 H new ATOM 0 HG21 VAL A 206 -7.794 -21.334 1.296 1.00 0.00 H new ATOM 0 HG22 VAL A 206 -7.123 -20.240 2.529 1.00 0.00 H new ATOM 0 HG23 VAL A 206 -6.950 -19.848 0.802 1.00 0.00 H new TER 1025 VAL A 206