USER MOD reduce.3.24.130724 H: found=0, std=0, add=608, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 606 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 165 GLN : amide:sc= 0.505 K(o=0.97,f=-0.06) USER MOD Set 1.2: A 169 GLN : amide:sc= 0.468 K(o=0.97,f=-0.68) USER MOD Single : A 113 ASN : amide:sc= 0 X(o=0,f=-0.16) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 HIS : no HE2:sc= -0.972! C(o=-0.97!,f=-6.1!) USER MOD Single : A 123 ASN : amide:sc= -1.5 K(o=-1.5,f=-2.3!) USER MOD Single : A 124 CYS SG : rot 170:sc= -2.5 USER MOD Single : A 127 THR OG1 : rot 180:sc= 0 USER MOD Single : A 132 TYR OH : rot 165:sc= 0.212 USER MOD Single : A 134 LYS NZ :NH3+ -124:sc= -0.155 (180deg=-0.47) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 THR OG1 : rot 180:sc= 0.0112 USER MOD Single : A 144 MET CE :methyl -126:sc= -3.1 (180deg=-3.33!) USER MOD Single : A 146 TYR OH : rot 180:sc= 0 USER MOD Single : A 150 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 151 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 160 THR OG1 : rot 180:sc= 0 USER MOD Single : A 166 SER OG : rot 169:sc= -0.848 USER MOD Single : A 172 ASN : amide:sc= -0.542 K(o=-0.54,f=-3.2!) USER MOD Single : A 173 MET CE :methyl -127:sc= -0.425 (180deg=-4!) USER MOD Single : A 174 HIS : no HE2:sc= -2.31! C(o=-2.3!,f=-2.8!) USER MOD Single : A 176 HIS : no HD1:sc= -2.94 X(o=-2.9,f=-2.7) USER MOD Single : A 179 MET CE :methyl -126:sc= -3.51! (180deg=-12.2!) USER MOD Single : A 181 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 182 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 186 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 110 N ASN A 113 -5.481 -7.151 10.312 1.00 0.00 N ATOM 111 CA ASN A 113 -4.888 -8.291 9.622 1.00 0.00 C ATOM 112 C ASN A 113 -5.968 -9.174 9.004 1.00 0.00 C ATOM 113 O ASN A 113 -5.954 -10.395 9.164 1.00 0.00 O ATOM 114 CB ASN A 113 -4.033 -9.112 10.589 1.00 0.00 C ATOM 115 CG ASN A 113 -3.205 -8.240 11.512 1.00 0.00 C ATOM 116 OD1 ASN A 113 -2.526 -7.314 11.067 1.00 0.00 O ATOM 117 ND2 ASN A 113 -3.257 -8.531 12.807 1.00 0.00 N ATOM 0 HA ASN A 113 -4.253 -7.910 8.822 1.00 0.00 H new ATOM 0 HB2 ASN A 113 -4.680 -9.755 11.185 1.00 0.00 H new ATOM 0 HB3 ASN A 113 -3.371 -9.765 10.020 1.00 0.00 H new ATOM 0 HD21 ASN A 113 -2.721 -7.978 13.476 1.00 0.00 H new ATOM 0 HD22 ASN A 113 -3.833 -9.307 13.133 1.00 0.00 H new ATOM 124 N LYS A 114 -6.903 -8.549 8.296 1.00 0.00 N ATOM 125 CA LYS A 114 -7.990 -9.276 7.652 1.00 0.00 C ATOM 126 C LYS A 114 -7.707 -9.474 6.166 1.00 0.00 C ATOM 127 O LYS A 114 -7.246 -8.557 5.485 1.00 0.00 O ATOM 128 CB LYS A 114 -9.311 -8.527 7.835 1.00 0.00 C ATOM 129 CG LYS A 114 -10.530 -9.334 7.424 1.00 0.00 C ATOM 130 CD LYS A 114 -11.655 -8.437 6.937 1.00 0.00 C ATOM 131 CE LYS A 114 -12.433 -7.837 8.098 1.00 0.00 C ATOM 132 NZ LYS A 114 -13.372 -6.774 7.646 1.00 0.00 N ATOM 0 H LYS A 114 -6.929 -7.539 8.154 1.00 0.00 H new ATOM 0 HA LYS A 114 -8.067 -10.256 8.123 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -9.413 -8.238 8.881 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -9.281 -7.607 7.251 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -10.255 -10.034 6.635 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -10.877 -9.927 8.270 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -11.243 -7.637 6.322 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -12.331 -9.011 6.303 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -12.992 -8.623 8.606 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -11.736 -7.421 8.825 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -13.883 -6.390 8.467 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -12.837 -6.011 7.184 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -14.053 -7.177 6.971 1.00 0.00 H new ATOM 146 N ILE A 115 -7.986 -10.674 5.669 1.00 0.00 N ATOM 147 CA ILE A 115 -7.764 -10.989 4.264 1.00 0.00 C ATOM 148 C ILE A 115 -9.067 -11.384 3.576 1.00 0.00 C ATOM 149 O ILE A 115 -9.994 -11.879 4.217 1.00 0.00 O ATOM 150 CB ILE A 115 -6.742 -12.130 4.097 1.00 0.00 C ATOM 151 CG1 ILE A 115 -7.327 -13.447 4.611 1.00 0.00 C ATOM 152 CG2 ILE A 115 -5.452 -11.795 4.830 1.00 0.00 C ATOM 153 CD1 ILE A 115 -6.524 -14.663 4.207 1.00 0.00 C ATOM 0 H ILE A 115 -8.366 -11.444 6.219 1.00 0.00 H new ATOM 0 HA ILE A 115 -7.369 -10.087 3.797 1.00 0.00 H new ATOM 0 HB ILE A 115 -6.516 -12.244 3.037 1.00 0.00 H new ATOM 0 HG12 ILE A 115 -7.389 -13.408 5.699 1.00 0.00 H new ATOM 0 HG13 ILE A 115 -8.345 -13.553 4.237 1.00 0.00 H new ATOM 0 HG21 ILE A 115 -4.739 -12.610 4.703 1.00 0.00 H new ATOM 0 HG22 ILE A 115 -5.030 -10.877 4.422 1.00 0.00 H new ATOM 0 HG23 ILE A 115 -5.661 -11.658 5.891 1.00 0.00 H new ATOM 0 HD11 ILE A 115 -6.997 -15.560 4.606 1.00 0.00 H new ATOM 0 HD12 ILE A 115 -6.483 -14.727 3.120 1.00 0.00 H new ATOM 0 HD13 ILE A 115 -5.512 -14.579 4.604 1.00 0.00 H new ATOM 165 N PHE A 116 -9.129 -11.165 2.267 1.00 0.00 N ATOM 166 CA PHE A 116 -10.318 -11.499 1.492 1.00 0.00 C ATOM 167 C PHE A 116 -10.117 -12.801 0.722 1.00 0.00 C ATOM 168 O PHE A 116 -9.374 -12.848 -0.258 1.00 0.00 O ATOM 169 CB PHE A 116 -10.653 -10.366 0.520 1.00 0.00 C ATOM 170 CG PHE A 116 -11.564 -10.785 -0.598 1.00 0.00 C ATOM 171 CD1 PHE A 116 -12.928 -10.911 -0.388 1.00 0.00 C ATOM 172 CD2 PHE A 116 -11.057 -11.053 -1.860 1.00 0.00 C ATOM 173 CE1 PHE A 116 -13.768 -11.297 -1.415 1.00 0.00 C ATOM 174 CE2 PHE A 116 -11.893 -11.440 -2.891 1.00 0.00 C ATOM 175 CZ PHE A 116 -13.250 -11.561 -2.668 1.00 0.00 C ATOM 0 H PHE A 116 -8.370 -10.758 1.721 1.00 0.00 H new ATOM 0 HA PHE A 116 -11.148 -11.632 2.186 1.00 0.00 H new ATOM 0 HB2 PHE A 116 -11.120 -9.551 1.072 1.00 0.00 H new ATOM 0 HB3 PHE A 116 -9.727 -9.976 0.097 1.00 0.00 H new ATOM 0 HD1 PHE A 116 -13.339 -10.705 0.589 1.00 0.00 H new ATOM 0 HD2 PHE A 116 -9.996 -10.958 -2.040 1.00 0.00 H new ATOM 0 HE1 PHE A 116 -14.829 -11.392 -1.238 1.00 0.00 H new ATOM 0 HE2 PHE A 116 -11.485 -11.647 -3.869 1.00 0.00 H new ATOM 0 HZ PHE A 116 -13.906 -11.862 -3.472 1.00 0.00 H new ATOM 185 N VAL A 117 -10.785 -13.858 1.175 1.00 0.00 N ATOM 186 CA VAL A 117 -10.681 -15.161 0.530 1.00 0.00 C ATOM 187 C VAL A 117 -11.916 -15.457 -0.314 1.00 0.00 C ATOM 188 O VAL A 117 -13.028 -15.545 0.203 1.00 0.00 O ATOM 189 CB VAL A 117 -10.500 -16.287 1.566 1.00 0.00 C ATOM 190 CG1 VAL A 117 -10.513 -17.647 0.884 1.00 0.00 C ATOM 191 CG2 VAL A 117 -9.211 -16.087 2.350 1.00 0.00 C ATOM 0 H VAL A 117 -11.403 -13.837 1.986 1.00 0.00 H new ATOM 0 HA VAL A 117 -9.803 -15.125 -0.115 1.00 0.00 H new ATOM 0 HB VAL A 117 -11.334 -16.250 2.267 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -10.384 -18.430 1.631 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -11.465 -17.788 0.371 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -9.700 -17.699 0.160 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -9.099 -16.891 3.077 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -8.363 -16.097 1.665 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -9.246 -15.130 2.870 1.00 0.00 H new ATOM 201 N GLY A 118 -11.711 -15.609 -1.619 1.00 0.00 N ATOM 202 CA GLY A 118 -12.816 -15.893 -2.515 1.00 0.00 C ATOM 203 C GLY A 118 -12.602 -17.162 -3.316 1.00 0.00 C ATOM 204 O GLY A 118 -11.602 -17.856 -3.138 1.00 0.00 O ATOM 0 H GLY A 118 -10.799 -15.540 -2.071 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -13.735 -15.983 -1.936 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -12.951 -15.054 -3.198 1.00 0.00 H new ATOM 208 N GLY A 119 -13.545 -17.468 -4.202 1.00 0.00 N ATOM 209 CA GLY A 119 -13.437 -18.662 -5.019 1.00 0.00 C ATOM 210 C GLY A 119 -13.413 -19.931 -4.190 1.00 0.00 C ATOM 211 O GLY A 119 -13.075 -21.003 -4.694 1.00 0.00 O ATOM 0 H GLY A 119 -14.382 -16.910 -4.368 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -14.277 -18.701 -5.713 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -12.529 -18.607 -5.620 1.00 0.00 H new ATOM 215 N ILE A 120 -13.771 -19.811 -2.916 1.00 0.00 N ATOM 216 CA ILE A 120 -13.789 -20.957 -2.016 1.00 0.00 C ATOM 217 C ILE A 120 -14.778 -22.016 -2.493 1.00 0.00 C ATOM 218 O ILE A 120 -15.895 -21.713 -2.913 1.00 0.00 O ATOM 219 CB ILE A 120 -14.154 -20.540 -0.580 1.00 0.00 C ATOM 220 CG1 ILE A 120 -13.226 -19.423 -0.099 1.00 0.00 C ATOM 221 CG2 ILE A 120 -14.078 -21.738 0.355 1.00 0.00 C ATOM 222 CD1 ILE A 120 -13.767 -18.656 1.088 1.00 0.00 C ATOM 0 H ILE A 120 -14.053 -18.931 -2.484 1.00 0.00 H new ATOM 0 HA ILE A 120 -12.783 -21.376 -2.019 1.00 0.00 H new ATOM 0 HB ILE A 120 -15.177 -20.164 -0.575 1.00 0.00 H new ATOM 0 HG12 ILE A 120 -12.260 -19.853 0.166 1.00 0.00 H new ATOM 0 HG13 ILE A 120 -13.051 -18.729 -0.921 1.00 0.00 H new ATOM 0 HG21 ILE A 120 -14.339 -21.427 1.367 1.00 0.00 H new ATOM 0 HG22 ILE A 120 -14.776 -22.506 0.020 1.00 0.00 H new ATOM 0 HG23 ILE A 120 -13.065 -22.141 0.349 1.00 0.00 H new ATOM 0 HD11 ILE A 120 -13.057 -17.880 1.374 1.00 0.00 H new ATOM 0 HD12 ILE A 120 -14.719 -18.196 0.821 1.00 0.00 H new ATOM 0 HD13 ILE A 120 -13.916 -19.338 1.925 1.00 0.00 H new ATOM 234 N PRO A 121 -14.360 -23.288 -2.427 1.00 0.00 N ATOM 235 CA PRO A 121 -15.195 -24.418 -2.845 1.00 0.00 C ATOM 236 C PRO A 121 -16.371 -24.651 -1.902 1.00 0.00 C ATOM 237 O PRO A 121 -16.371 -24.178 -0.765 1.00 0.00 O ATOM 238 CB PRO A 121 -14.231 -25.607 -2.802 1.00 0.00 C ATOM 239 CG PRO A 121 -13.190 -25.214 -1.812 1.00 0.00 C ATOM 240 CD PRO A 121 -13.041 -23.723 -1.937 1.00 0.00 C ATOM 0 HA PRO A 121 -15.645 -24.252 -3.824 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -14.742 -26.520 -2.498 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -13.794 -25.798 -3.782 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -13.488 -25.493 -0.801 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -12.246 -25.719 -2.017 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -12.796 -23.262 -0.980 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -12.246 -23.456 -2.633 1.00 0.00 H new ATOM 248 N HIS A 122 -17.371 -25.384 -2.380 1.00 0.00 N ATOM 249 CA HIS A 122 -18.553 -25.681 -1.578 1.00 0.00 C ATOM 250 C HIS A 122 -18.260 -26.784 -0.566 1.00 0.00 C ATOM 251 O HIS A 122 -19.166 -27.290 0.095 1.00 0.00 O ATOM 252 CB HIS A 122 -19.716 -26.095 -2.480 1.00 0.00 C ATOM 253 CG HIS A 122 -19.707 -27.549 -2.839 1.00 0.00 C ATOM 254 ND1 HIS A 122 -19.943 -28.552 -1.923 1.00 0.00 N ATOM 255 CD2 HIS A 122 -19.490 -28.167 -4.024 1.00 0.00 C ATOM 256 CE1 HIS A 122 -19.870 -29.724 -2.528 1.00 0.00 C ATOM 257 NE2 HIS A 122 -19.596 -29.518 -3.804 1.00 0.00 N ATOM 0 H HIS A 122 -17.387 -25.783 -3.318 1.00 0.00 H new ATOM 0 HA HIS A 122 -18.829 -24.778 -1.034 1.00 0.00 H new ATOM 0 HB2 HIS A 122 -20.655 -25.858 -1.980 1.00 0.00 H new ATOM 0 HB3 HIS A 122 -19.684 -25.503 -3.395 1.00 0.00 H new ATOM 0 HD1 HIS A 122 -20.143 -28.411 -0.933 1.00 0.00 H new ATOM 0 HD2 HIS A 122 -19.274 -27.687 -4.967 1.00 0.00 H new ATOM 0 HE1 HIS A 122 -20.010 -30.687 -2.059 1.00 0.00 H new ATOM 265 N ASN A 123 -16.988 -27.153 -0.452 1.00 0.00 N ATOM 266 CA ASN A 123 -16.576 -28.198 0.478 1.00 0.00 C ATOM 267 C ASN A 123 -15.634 -27.640 1.540 1.00 0.00 C ATOM 268 O ASN A 123 -15.393 -28.276 2.567 1.00 0.00 O ATOM 269 CB ASN A 123 -15.893 -29.341 -0.276 1.00 0.00 C ATOM 270 CG ASN A 123 -15.873 -30.630 0.522 1.00 0.00 C ATOM 271 OD1 ASN A 123 -16.652 -30.805 1.460 1.00 0.00 O ATOM 272 ND2 ASN A 123 -14.980 -31.541 0.153 1.00 0.00 N ATOM 0 H ASN A 123 -16.225 -26.744 -0.992 1.00 0.00 H new ATOM 0 HA ASN A 123 -17.468 -28.581 0.974 1.00 0.00 H new ATOM 0 HB2 ASN A 123 -16.410 -29.510 -1.220 1.00 0.00 H new ATOM 0 HB3 ASN A 123 -14.871 -29.052 -0.520 1.00 0.00 H new ATOM 0 HD21 ASN A 123 -14.920 -32.428 0.653 1.00 0.00 H new ATOM 0 HD22 ASN A 123 -14.354 -31.354 -0.630 1.00 0.00 H new ATOM 279 N CYS A 124 -15.105 -26.448 1.287 1.00 0.00 N ATOM 280 CA CYS A 124 -14.189 -25.804 2.221 1.00 0.00 C ATOM 281 C CYS A 124 -14.956 -25.066 3.313 1.00 0.00 C ATOM 282 O CYS A 124 -16.092 -24.640 3.109 1.00 0.00 O ATOM 283 CB CYS A 124 -13.272 -24.831 1.479 1.00 0.00 C ATOM 284 SG CYS A 124 -12.457 -23.622 2.549 1.00 0.00 S ATOM 0 H CYS A 124 -15.295 -25.908 0.443 1.00 0.00 H new ATOM 0 HA CYS A 124 -13.582 -26.579 2.689 1.00 0.00 H new ATOM 0 HB2 CYS A 124 -12.510 -25.401 0.947 1.00 0.00 H new ATOM 0 HB3 CYS A 124 -13.856 -24.300 0.727 1.00 0.00 H new ATOM 0 HG CYS A 124 -11.547 -22.987 1.872 1.00 0.00 H new ATOM 290 N GLY A 125 -14.327 -24.919 4.476 1.00 0.00 N ATOM 291 CA GLY A 125 -14.966 -24.234 5.584 1.00 0.00 C ATOM 292 C GLY A 125 -13.968 -23.722 6.603 1.00 0.00 C ATOM 293 O GLY A 125 -12.786 -24.062 6.547 1.00 0.00 O ATOM 0 H GLY A 125 -13.386 -25.262 4.670 1.00 0.00 H new ATOM 0 HA2 GLY A 125 -15.551 -23.398 5.201 1.00 0.00 H new ATOM 0 HA3 GLY A 125 -15.664 -24.914 6.073 1.00 0.00 H new ATOM 297 N GLU A 126 -14.443 -22.902 7.535 1.00 0.00 N ATOM 298 CA GLU A 126 -13.581 -22.340 8.568 1.00 0.00 C ATOM 299 C GLU A 126 -12.520 -23.349 9.000 1.00 0.00 C ATOM 300 O GLU A 126 -11.321 -23.093 8.887 1.00 0.00 O ATOM 301 CB GLU A 126 -14.413 -21.910 9.778 1.00 0.00 C ATOM 302 CG GLU A 126 -13.576 -21.528 10.987 1.00 0.00 C ATOM 303 CD GLU A 126 -13.278 -22.711 11.888 1.00 0.00 C ATOM 304 OE1 GLU A 126 -14.158 -23.079 12.694 1.00 0.00 O ATOM 305 OE2 GLU A 126 -12.165 -23.268 11.788 1.00 0.00 O ATOM 0 H GLU A 126 -15.419 -22.612 7.596 1.00 0.00 H new ATOM 0 HA GLU A 126 -13.079 -21.467 8.151 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -15.037 -21.062 9.496 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -15.085 -22.723 10.054 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -12.638 -21.087 10.650 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -14.100 -20.763 11.560 1.00 0.00 H new ATOM 312 N THR A 127 -12.971 -24.498 9.495 1.00 0.00 N ATOM 313 CA THR A 127 -12.063 -25.545 9.945 1.00 0.00 C ATOM 314 C THR A 127 -10.903 -25.722 8.972 1.00 0.00 C ATOM 315 O THR A 127 -9.738 -25.667 9.364 1.00 0.00 O ATOM 316 CB THR A 127 -12.793 -26.891 10.107 1.00 0.00 C ATOM 317 OG1 THR A 127 -13.769 -26.797 11.151 1.00 0.00 O ATOM 318 CG2 THR A 127 -11.809 -28.006 10.425 1.00 0.00 C ATOM 0 H THR A 127 -13.960 -24.726 9.594 1.00 0.00 H new ATOM 0 HA THR A 127 -11.676 -25.232 10.915 1.00 0.00 H new ATOM 0 HB THR A 127 -13.290 -27.125 9.165 1.00 0.00 H new ATOM 0 HG1 THR A 127 -14.230 -27.657 11.246 1.00 0.00 H new ATOM 0 HG21 THR A 127 -12.348 -28.947 10.535 1.00 0.00 H new ATOM 0 HG22 THR A 127 -11.086 -28.095 9.615 1.00 0.00 H new ATOM 0 HG23 THR A 127 -11.287 -27.777 11.354 1.00 0.00 H new ATOM 326 N GLU A 128 -11.230 -25.935 7.701 1.00 0.00 N ATOM 327 CA GLU A 128 -10.214 -26.121 6.672 1.00 0.00 C ATOM 328 C GLU A 128 -9.394 -24.849 6.482 1.00 0.00 C ATOM 329 O GLU A 128 -8.167 -24.865 6.591 1.00 0.00 O ATOM 330 CB GLU A 128 -10.865 -26.524 5.347 1.00 0.00 C ATOM 331 CG GLU A 128 -11.014 -28.026 5.175 1.00 0.00 C ATOM 332 CD GLU A 128 -9.698 -28.711 4.861 1.00 0.00 C ATOM 333 OE1 GLU A 128 -8.693 -28.400 5.535 1.00 0.00 O ATOM 334 OE2 GLU A 128 -9.672 -29.556 3.942 1.00 0.00 O ATOM 0 H GLU A 128 -12.190 -25.983 7.360 1.00 0.00 H new ATOM 0 HA GLU A 128 -9.546 -26.919 6.997 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -11.849 -26.060 5.279 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -10.269 -26.130 4.524 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -11.433 -28.452 6.087 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -11.724 -28.227 4.373 1.00 0.00 H new ATOM 341 N LEU A 129 -10.079 -23.747 6.195 1.00 0.00 N ATOM 342 CA LEU A 129 -9.415 -22.465 5.988 1.00 0.00 C ATOM 343 C LEU A 129 -8.319 -22.245 7.026 1.00 0.00 C ATOM 344 O LEU A 129 -7.150 -22.071 6.682 1.00 0.00 O ATOM 345 CB LEU A 129 -10.433 -21.325 6.056 1.00 0.00 C ATOM 346 CG LEU A 129 -11.456 -21.270 4.920 1.00 0.00 C ATOM 347 CD1 LEU A 129 -12.620 -20.365 5.293 1.00 0.00 C ATOM 348 CD2 LEU A 129 -10.798 -20.793 3.633 1.00 0.00 C ATOM 0 H LEU A 129 -11.094 -23.716 6.100 1.00 0.00 H new ATOM 0 HA LEU A 129 -8.956 -22.477 4.999 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -10.972 -21.402 7.000 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -9.890 -20.380 6.075 1.00 0.00 H new ATOM 0 HG LEU A 129 -11.843 -22.276 4.756 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -13.337 -20.338 4.473 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -13.107 -20.750 6.189 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -12.251 -19.358 5.485 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -11.540 -20.760 2.835 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -10.383 -19.796 3.784 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -9.999 -21.481 3.356 1.00 0.00 H new ATOM 360 N ARG A 130 -8.705 -22.257 8.298 1.00 0.00 N ATOM 361 CA ARG A 130 -7.755 -22.060 9.386 1.00 0.00 C ATOM 362 C ARG A 130 -6.602 -23.054 9.287 1.00 0.00 C ATOM 363 O ARG A 130 -5.437 -22.663 9.228 1.00 0.00 O ATOM 364 CB ARG A 130 -8.457 -22.210 10.738 1.00 0.00 C ATOM 365 CG ARG A 130 -9.656 -21.291 10.906 1.00 0.00 C ATOM 366 CD ARG A 130 -10.234 -21.382 12.310 1.00 0.00 C ATOM 367 NE ARG A 130 -9.440 -20.630 13.278 1.00 0.00 N ATOM 368 CZ ARG A 130 -9.741 -20.548 14.569 1.00 0.00 C ATOM 369 NH1 ARG A 130 -10.812 -21.167 15.045 1.00 0.00 N ATOM 370 NH2 ARG A 130 -8.969 -19.845 15.388 1.00 0.00 N ATOM 0 H ARG A 130 -9.669 -22.401 8.600 1.00 0.00 H new ATOM 0 HA ARG A 130 -7.351 -21.051 9.304 1.00 0.00 H new ATOM 0 HB2 ARG A 130 -8.782 -23.244 10.856 1.00 0.00 H new ATOM 0 HB3 ARG A 130 -7.741 -22.008 11.534 1.00 0.00 H new ATOM 0 HG2 ARG A 130 -9.360 -20.263 10.699 1.00 0.00 H new ATOM 0 HG3 ARG A 130 -10.423 -21.554 10.178 1.00 0.00 H new ATOM 0 HD2 ARG A 130 -11.256 -21.003 12.307 1.00 0.00 H new ATOM 0 HD3 ARG A 130 -10.283 -22.427 12.615 1.00 0.00 H new ATOM 0 HE ARG A 130 -8.609 -20.141 12.944 1.00 0.00 H new ATOM 0 HH11 ARG A 130 -11.408 -21.709 14.419 1.00 0.00 H new ATOM 0 HH12 ARG A 130 -11.040 -21.102 16.037 1.00 0.00 H new ATOM 0 HH21 ARG A 130 -8.144 -19.367 15.026 1.00 0.00 H new ATOM 0 HH22 ARG A 130 -9.201 -19.783 16.379 1.00 0.00 H new ATOM 384 N GLU A 131 -6.935 -24.341 9.272 1.00 0.00 N ATOM 385 CA GLU A 131 -5.927 -25.390 9.181 1.00 0.00 C ATOM 386 C GLU A 131 -4.971 -25.127 8.021 1.00 0.00 C ATOM 387 O GLU A 131 -3.785 -25.452 8.093 1.00 0.00 O ATOM 388 CB GLU A 131 -6.593 -26.756 9.008 1.00 0.00 C ATOM 389 CG GLU A 131 -6.901 -27.455 10.321 1.00 0.00 C ATOM 390 CD GLU A 131 -5.759 -28.330 10.798 1.00 0.00 C ATOM 391 OE1 GLU A 131 -5.566 -29.420 10.219 1.00 0.00 O ATOM 392 OE2 GLU A 131 -5.058 -27.926 11.750 1.00 0.00 O ATOM 0 H GLU A 131 -7.895 -24.682 9.322 1.00 0.00 H new ATOM 0 HA GLU A 131 -5.354 -25.389 10.109 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -7.519 -26.630 8.447 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -5.943 -27.395 8.410 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -7.124 -26.708 11.083 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -7.796 -28.065 10.202 1.00 0.00 H new ATOM 399 N TYR A 132 -5.495 -24.538 6.953 1.00 0.00 N ATOM 400 CA TYR A 132 -4.690 -24.234 5.775 1.00 0.00 C ATOM 401 C TYR A 132 -4.063 -22.847 5.887 1.00 0.00 C ATOM 402 O TYR A 132 -3.083 -22.540 5.209 1.00 0.00 O ATOM 403 CB TYR A 132 -5.546 -24.318 4.511 1.00 0.00 C ATOM 404 CG TYR A 132 -4.744 -24.248 3.231 1.00 0.00 C ATOM 405 CD1 TYR A 132 -4.185 -23.051 2.803 1.00 0.00 C ATOM 406 CD2 TYR A 132 -4.545 -25.380 2.450 1.00 0.00 C ATOM 407 CE1 TYR A 132 -3.452 -22.982 1.634 1.00 0.00 C ATOM 408 CE2 TYR A 132 -3.813 -25.321 1.280 1.00 0.00 C ATOM 409 CZ TYR A 132 -3.269 -24.120 0.876 1.00 0.00 C ATOM 410 OH TYR A 132 -2.538 -24.056 -0.289 1.00 0.00 O ATOM 0 H TYR A 132 -6.474 -24.261 6.878 1.00 0.00 H new ATOM 0 HA TYR A 132 -3.889 -24.971 5.713 1.00 0.00 H new ATOM 0 HB2 TYR A 132 -6.110 -25.250 4.526 1.00 0.00 H new ATOM 0 HB3 TYR A 132 -6.273 -23.505 4.520 1.00 0.00 H new ATOM 0 HD1 TYR A 132 -4.326 -22.158 3.394 1.00 0.00 H new ATOM 0 HD2 TYR A 132 -4.970 -26.322 2.763 1.00 0.00 H new ATOM 0 HE1 TYR A 132 -3.025 -22.043 1.315 1.00 0.00 H new ATOM 0 HE2 TYR A 132 -3.668 -26.211 0.685 1.00 0.00 H new ATOM 0 HH TYR A 132 -2.299 -24.962 -0.575 1.00 0.00 H new ATOM 420 N PHE A 133 -4.637 -22.013 6.748 1.00 0.00 N ATOM 421 CA PHE A 133 -4.137 -20.659 6.950 1.00 0.00 C ATOM 422 C PHE A 133 -3.389 -20.547 8.276 1.00 0.00 C ATOM 423 O PHE A 133 -3.174 -19.449 8.790 1.00 0.00 O ATOM 424 CB PHE A 133 -5.291 -19.655 6.916 1.00 0.00 C ATOM 425 CG PHE A 133 -5.756 -19.323 5.527 1.00 0.00 C ATOM 426 CD1 PHE A 133 -4.842 -19.026 4.529 1.00 0.00 C ATOM 427 CD2 PHE A 133 -7.107 -19.306 5.220 1.00 0.00 C ATOM 428 CE1 PHE A 133 -5.266 -18.720 3.250 1.00 0.00 C ATOM 429 CE2 PHE A 133 -7.537 -19.001 3.942 1.00 0.00 C ATOM 430 CZ PHE A 133 -6.616 -18.706 2.956 1.00 0.00 C ATOM 0 H PHE A 133 -5.449 -22.252 7.317 1.00 0.00 H new ATOM 0 HA PHE A 133 -3.443 -20.431 6.141 1.00 0.00 H new ATOM 0 HB2 PHE A 133 -6.129 -20.058 7.485 1.00 0.00 H new ATOM 0 HB3 PHE A 133 -4.979 -18.738 7.415 1.00 0.00 H new ATOM 0 HD1 PHE A 133 -3.786 -19.034 4.753 1.00 0.00 H new ATOM 0 HD2 PHE A 133 -7.832 -19.533 5.987 1.00 0.00 H new ATOM 0 HE1 PHE A 133 -4.543 -18.492 2.481 1.00 0.00 H new ATOM 0 HE2 PHE A 133 -8.593 -18.993 3.715 1.00 0.00 H new ATOM 0 HZ PHE A 133 -6.950 -18.465 1.958 1.00 0.00 H new ATOM 440 N LYS A 134 -2.997 -21.691 8.825 1.00 0.00 N ATOM 441 CA LYS A 134 -2.273 -21.725 10.090 1.00 0.00 C ATOM 442 C LYS A 134 -0.766 -21.717 9.855 1.00 0.00 C ATOM 443 O LYS A 134 -0.017 -21.067 10.585 1.00 0.00 O ATOM 444 CB LYS A 134 -2.668 -22.965 10.895 1.00 0.00 C ATOM 445 CG LYS A 134 -2.041 -24.249 10.379 1.00 0.00 C ATOM 446 CD LYS A 134 -2.527 -25.459 11.160 1.00 0.00 C ATOM 447 CE LYS A 134 -2.614 -25.163 12.649 1.00 0.00 C ATOM 448 NZ LYS A 134 -1.296 -24.756 13.212 1.00 0.00 N ATOM 0 H LYS A 134 -3.169 -22.608 8.413 1.00 0.00 H new ATOM 0 HA LYS A 134 -2.539 -20.832 10.656 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -2.377 -22.821 11.935 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -3.753 -23.068 10.879 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -2.283 -24.375 9.324 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -0.956 -24.180 10.451 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -3.507 -25.762 10.790 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -1.850 -26.297 10.993 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -3.342 -24.370 12.820 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -2.976 -26.047 13.174 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -1.048 -25.384 14.003 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -0.567 -24.824 12.473 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -1.352 -23.775 13.553 1.00 0.00 H new ATOM 462 N LYS A 135 -0.327 -22.441 8.831 1.00 0.00 N ATOM 463 CA LYS A 135 1.090 -22.516 8.497 1.00 0.00 C ATOM 464 C LYS A 135 1.661 -21.126 8.236 1.00 0.00 C ATOM 465 O LYS A 135 2.837 -20.868 8.495 1.00 0.00 O ATOM 466 CB LYS A 135 1.300 -23.404 7.269 1.00 0.00 C ATOM 467 CG LYS A 135 0.294 -23.154 6.158 1.00 0.00 C ATOM 468 CD LYS A 135 0.819 -23.627 4.814 1.00 0.00 C ATOM 469 CE LYS A 135 0.463 -25.083 4.557 1.00 0.00 C ATOM 470 NZ LYS A 135 1.470 -25.757 3.691 1.00 0.00 N ATOM 0 H LYS A 135 -0.933 -22.985 8.217 1.00 0.00 H new ATOM 0 HA LYS A 135 1.615 -22.952 9.347 1.00 0.00 H new ATOM 0 HB2 LYS A 135 2.305 -23.241 6.881 1.00 0.00 H new ATOM 0 HB3 LYS A 135 1.241 -24.449 7.573 1.00 0.00 H new ATOM 0 HG2 LYS A 135 -0.638 -23.670 6.387 1.00 0.00 H new ATOM 0 HG3 LYS A 135 0.065 -22.090 6.106 1.00 0.00 H new ATOM 0 HD2 LYS A 135 0.404 -23.005 4.021 1.00 0.00 H new ATOM 0 HD3 LYS A 135 1.902 -23.505 4.782 1.00 0.00 H new ATOM 0 HE2 LYS A 135 0.390 -25.612 5.507 1.00 0.00 H new ATOM 0 HE3 LYS A 135 -0.518 -25.139 4.084 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 1.191 -26.747 3.540 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 1.522 -25.268 2.774 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 2.401 -25.727 4.153 1.00 0.00 H new ATOM 484 N PHE A 136 0.822 -20.233 7.722 1.00 0.00 N ATOM 485 CA PHE A 136 1.243 -18.869 7.426 1.00 0.00 C ATOM 486 C PHE A 136 1.399 -18.057 8.709 1.00 0.00 C ATOM 487 O PHE A 136 2.245 -17.168 8.796 1.00 0.00 O ATOM 488 CB PHE A 136 0.233 -18.190 6.499 1.00 0.00 C ATOM 489 CG PHE A 136 0.229 -18.749 5.105 1.00 0.00 C ATOM 490 CD1 PHE A 136 1.328 -18.586 4.276 1.00 0.00 C ATOM 491 CD2 PHE A 136 -0.872 -19.438 4.623 1.00 0.00 C ATOM 492 CE1 PHE A 136 1.326 -19.099 2.992 1.00 0.00 C ATOM 493 CE2 PHE A 136 -0.879 -19.953 3.341 1.00 0.00 C ATOM 494 CZ PHE A 136 0.222 -19.785 2.525 1.00 0.00 C ATOM 0 H PHE A 136 -0.154 -20.430 7.502 1.00 0.00 H new ATOM 0 HA PHE A 136 2.210 -18.915 6.926 1.00 0.00 H new ATOM 0 HB2 PHE A 136 -0.765 -18.291 6.925 1.00 0.00 H new ATOM 0 HB3 PHE A 136 0.453 -17.123 6.454 1.00 0.00 H new ATOM 0 HD1 PHE A 136 2.195 -18.053 4.637 1.00 0.00 H new ATOM 0 HD2 PHE A 136 -1.735 -19.574 5.257 1.00 0.00 H new ATOM 0 HE1 PHE A 136 2.187 -18.963 2.355 1.00 0.00 H new ATOM 0 HE2 PHE A 136 -1.745 -20.486 2.978 1.00 0.00 H new ATOM 0 HZ PHE A 136 0.220 -20.189 1.524 1.00 0.00 H new ATOM 504 N GLY A 137 0.573 -18.369 9.703 1.00 0.00 N ATOM 505 CA GLY A 137 0.634 -17.660 10.968 1.00 0.00 C ATOM 506 C GLY A 137 -0.314 -18.236 12.002 1.00 0.00 C ATOM 507 O GLY A 137 -0.195 -19.401 12.383 1.00 0.00 O ATOM 0 H GLY A 137 -0.137 -19.100 9.655 1.00 0.00 H new ATOM 0 HA2 GLY A 137 1.653 -17.697 11.353 1.00 0.00 H new ATOM 0 HA3 GLY A 137 0.393 -16.610 10.804 1.00 0.00 H new ATOM 511 N VAL A 138 -1.257 -17.418 12.458 1.00 0.00 N ATOM 512 CA VAL A 138 -2.229 -17.852 13.455 1.00 0.00 C ATOM 513 C VAL A 138 -3.588 -17.205 13.215 1.00 0.00 C ATOM 514 O VAL A 138 -3.778 -16.018 13.478 1.00 0.00 O ATOM 515 CB VAL A 138 -1.757 -17.517 14.882 1.00 0.00 C ATOM 516 CG1 VAL A 138 -2.870 -17.773 15.886 1.00 0.00 C ATOM 517 CG2 VAL A 138 -0.514 -18.320 15.235 1.00 0.00 C ATOM 0 H VAL A 138 -1.369 -16.451 12.153 1.00 0.00 H new ATOM 0 HA VAL A 138 -2.323 -18.933 13.356 1.00 0.00 H new ATOM 0 HB VAL A 138 -1.500 -16.458 14.922 1.00 0.00 H new ATOM 0 HG11 VAL A 138 -2.518 -17.531 16.889 1.00 0.00 H new ATOM 0 HG12 VAL A 138 -3.730 -17.149 15.643 1.00 0.00 H new ATOM 0 HG13 VAL A 138 -3.161 -18.823 15.847 1.00 0.00 H new ATOM 0 HG21 VAL A 138 -0.195 -18.070 16.247 1.00 0.00 H new ATOM 0 HG22 VAL A 138 -0.740 -19.385 15.178 1.00 0.00 H new ATOM 0 HG23 VAL A 138 0.285 -18.081 14.533 1.00 0.00 H new ATOM 527 N VAL A 139 -4.533 -17.995 12.714 1.00 0.00 N ATOM 528 CA VAL A 139 -5.877 -17.500 12.440 1.00 0.00 C ATOM 529 C VAL A 139 -6.618 -17.178 13.733 1.00 0.00 C ATOM 530 O VAL A 139 -7.007 -18.077 14.480 1.00 0.00 O ATOM 531 CB VAL A 139 -6.698 -18.522 11.632 1.00 0.00 C ATOM 532 CG1 VAL A 139 -8.018 -17.913 11.185 1.00 0.00 C ATOM 533 CG2 VAL A 139 -5.899 -19.019 10.436 1.00 0.00 C ATOM 0 H VAL A 139 -4.392 -18.980 12.490 1.00 0.00 H new ATOM 0 HA VAL A 139 -5.765 -16.589 11.852 1.00 0.00 H new ATOM 0 HB VAL A 139 -6.918 -19.375 12.274 1.00 0.00 H new ATOM 0 HG11 VAL A 139 -8.584 -18.650 10.616 1.00 0.00 H new ATOM 0 HG12 VAL A 139 -8.594 -17.610 12.060 1.00 0.00 H new ATOM 0 HG13 VAL A 139 -7.823 -17.042 10.559 1.00 0.00 H new ATOM 0 HG21 VAL A 139 -6.494 -19.741 9.876 1.00 0.00 H new ATOM 0 HG22 VAL A 139 -5.648 -18.177 9.791 1.00 0.00 H new ATOM 0 HG23 VAL A 139 -4.983 -19.496 10.783 1.00 0.00 H new ATOM 543 N THR A 140 -6.812 -15.888 13.993 1.00 0.00 N ATOM 544 CA THR A 140 -7.506 -15.447 15.196 1.00 0.00 C ATOM 545 C THR A 140 -9.015 -15.420 14.981 1.00 0.00 C ATOM 546 O THR A 140 -9.785 -15.763 15.878 1.00 0.00 O ATOM 547 CB THR A 140 -7.037 -14.047 15.633 1.00 0.00 C ATOM 548 OG1 THR A 140 -7.001 -13.167 14.504 1.00 0.00 O ATOM 549 CG2 THR A 140 -5.658 -14.114 16.274 1.00 0.00 C ATOM 0 H THR A 140 -6.498 -15.131 13.386 1.00 0.00 H new ATOM 0 HA THR A 140 -7.266 -16.164 15.981 1.00 0.00 H new ATOM 0 HB THR A 140 -7.745 -13.664 16.369 1.00 0.00 H new ATOM 0 HG1 THR A 140 -6.703 -12.279 14.791 1.00 0.00 H new ATOM 0 HG21 THR A 140 -5.348 -13.113 16.575 1.00 0.00 H new ATOM 0 HG22 THR A 140 -5.695 -14.761 17.150 1.00 0.00 H new ATOM 0 HG23 THR A 140 -4.942 -14.516 15.557 1.00 0.00 H new ATOM 557 N GLU A 141 -9.431 -15.012 13.786 1.00 0.00 N ATOM 558 CA GLU A 141 -10.850 -14.941 13.455 1.00 0.00 C ATOM 559 C GLU A 141 -11.098 -15.402 12.022 1.00 0.00 C ATOM 560 O GLU A 141 -10.205 -15.345 11.176 1.00 0.00 O ATOM 561 CB GLU A 141 -11.369 -13.513 13.640 1.00 0.00 C ATOM 562 CG GLU A 141 -12.836 -13.444 14.029 1.00 0.00 C ATOM 563 CD GLU A 141 -13.059 -13.687 15.509 1.00 0.00 C ATOM 564 OE1 GLU A 141 -12.224 -13.229 16.317 1.00 0.00 O ATOM 565 OE2 GLU A 141 -14.068 -14.334 15.859 1.00 0.00 O ATOM 0 H GLU A 141 -8.807 -14.726 13.032 1.00 0.00 H new ATOM 0 HA GLU A 141 -11.388 -15.606 14.131 1.00 0.00 H new ATOM 0 HB2 GLU A 141 -10.775 -13.016 14.407 1.00 0.00 H new ATOM 0 HB3 GLU A 141 -11.221 -12.959 12.713 1.00 0.00 H new ATOM 0 HG2 GLU A 141 -13.233 -12.465 13.761 1.00 0.00 H new ATOM 0 HG3 GLU A 141 -13.395 -14.183 13.455 1.00 0.00 H new ATOM 572 N VAL A 142 -12.317 -15.861 11.757 1.00 0.00 N ATOM 573 CA VAL A 142 -12.684 -16.332 10.427 1.00 0.00 C ATOM 574 C VAL A 142 -14.065 -15.827 10.026 1.00 0.00 C ATOM 575 O VAL A 142 -15.083 -16.303 10.530 1.00 0.00 O ATOM 576 CB VAL A 142 -12.671 -17.871 10.353 1.00 0.00 C ATOM 577 CG1 VAL A 142 -13.176 -18.345 8.999 1.00 0.00 C ATOM 578 CG2 VAL A 142 -11.273 -18.405 10.627 1.00 0.00 C ATOM 0 H VAL A 142 -13.067 -15.917 12.446 1.00 0.00 H new ATOM 0 HA VAL A 142 -11.941 -15.936 9.735 1.00 0.00 H new ATOM 0 HB VAL A 142 -13.341 -18.260 11.120 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -13.160 -19.434 8.966 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -14.196 -17.993 8.848 1.00 0.00 H new ATOM 0 HG13 VAL A 142 -12.535 -17.948 8.212 1.00 0.00 H new ATOM 0 HG21 VAL A 142 -11.282 -19.494 10.571 1.00 0.00 H new ATOM 0 HG22 VAL A 142 -10.580 -18.009 9.885 1.00 0.00 H new ATOM 0 HG23 VAL A 142 -10.954 -18.096 11.622 1.00 0.00 H new ATOM 588 N VAL A 143 -14.094 -14.859 9.116 1.00 0.00 N ATOM 589 CA VAL A 143 -15.351 -14.289 8.646 1.00 0.00 C ATOM 590 C VAL A 143 -15.830 -14.986 7.377 1.00 0.00 C ATOM 591 O VAL A 143 -15.037 -15.286 6.485 1.00 0.00 O ATOM 592 CB VAL A 143 -15.215 -12.780 8.369 1.00 0.00 C ATOM 593 CG1 VAL A 143 -16.553 -12.190 7.952 1.00 0.00 C ATOM 594 CG2 VAL A 143 -14.664 -12.062 9.592 1.00 0.00 C ATOM 0 H VAL A 143 -13.261 -14.453 8.689 1.00 0.00 H new ATOM 0 HA VAL A 143 -16.083 -14.441 9.439 1.00 0.00 H new ATOM 0 HB VAL A 143 -14.513 -12.641 7.547 1.00 0.00 H new ATOM 0 HG11 VAL A 143 -16.436 -11.123 7.761 1.00 0.00 H new ATOM 0 HG12 VAL A 143 -16.902 -12.685 7.046 1.00 0.00 H new ATOM 0 HG13 VAL A 143 -17.281 -12.338 8.750 1.00 0.00 H new ATOM 0 HG21 VAL A 143 -14.574 -10.997 9.379 1.00 0.00 H new ATOM 0 HG22 VAL A 143 -15.340 -12.208 10.435 1.00 0.00 H new ATOM 0 HG23 VAL A 143 -13.683 -12.466 9.840 1.00 0.00 H new ATOM 604 N MET A 144 -17.132 -15.240 7.304 1.00 0.00 N ATOM 605 CA MET A 144 -17.718 -15.900 6.143 1.00 0.00 C ATOM 606 C MET A 144 -19.050 -15.259 5.767 1.00 0.00 C ATOM 607 O MET A 144 -19.875 -14.968 6.633 1.00 0.00 O ATOM 608 CB MET A 144 -17.917 -17.391 6.423 1.00 0.00 C ATOM 609 CG MET A 144 -16.656 -18.218 6.234 1.00 0.00 C ATOM 610 SD MET A 144 -16.994 -19.986 6.131 1.00 0.00 S ATOM 611 CE MET A 144 -16.141 -20.407 4.614 1.00 0.00 C ATOM 0 H MET A 144 -17.802 -14.999 8.035 1.00 0.00 H new ATOM 0 HA MET A 144 -17.030 -15.784 5.305 1.00 0.00 H new ATOM 0 HB2 MET A 144 -18.274 -17.516 7.445 1.00 0.00 H new ATOM 0 HB3 MET A 144 -18.696 -17.775 5.764 1.00 0.00 H new ATOM 0 HG2 MET A 144 -16.148 -17.896 5.325 1.00 0.00 H new ATOM 0 HG3 MET A 144 -15.975 -18.030 7.064 1.00 0.00 H new ATOM 0 HE1 MET A 144 -16.831 -20.911 3.937 1.00 0.00 H new ATOM 0 HE2 MET A 144 -15.768 -19.498 4.142 1.00 0.00 H new ATOM 0 HE3 MET A 144 -15.305 -21.069 4.839 1.00 0.00 H new ATOM 621 N ILE A 145 -19.253 -15.043 4.472 1.00 0.00 N ATOM 622 CA ILE A 145 -20.485 -14.437 3.983 1.00 0.00 C ATOM 623 C ILE A 145 -21.428 -15.492 3.413 1.00 0.00 C ATOM 624 O ILE A 145 -21.021 -16.338 2.616 1.00 0.00 O ATOM 625 CB ILE A 145 -20.202 -13.380 2.899 1.00 0.00 C ATOM 626 CG1 ILE A 145 -19.352 -12.245 3.474 1.00 0.00 C ATOM 627 CG2 ILE A 145 -21.506 -12.838 2.334 1.00 0.00 C ATOM 628 CD1 ILE A 145 -18.640 -11.429 2.418 1.00 0.00 C ATOM 0 H ILE A 145 -18.580 -15.279 3.742 1.00 0.00 H new ATOM 0 HA ILE A 145 -20.958 -13.952 4.837 1.00 0.00 H new ATOM 0 HB ILE A 145 -19.646 -13.851 2.088 1.00 0.00 H new ATOM 0 HG12 ILE A 145 -19.991 -11.586 4.062 1.00 0.00 H new ATOM 0 HG13 ILE A 145 -18.613 -12.665 4.157 1.00 0.00 H new ATOM 0 HG21 ILE A 145 -21.289 -12.092 1.569 1.00 0.00 H new ATOM 0 HG22 ILE A 145 -22.078 -13.654 1.893 1.00 0.00 H new ATOM 0 HG23 ILE A 145 -22.086 -12.379 3.134 1.00 0.00 H new ATOM 0 HD11 ILE A 145 -18.057 -10.643 2.898 1.00 0.00 H new ATOM 0 HD12 ILE A 145 -17.975 -12.076 1.845 1.00 0.00 H new ATOM 0 HD13 ILE A 145 -19.374 -10.980 1.749 1.00 0.00 H new ATOM 640 N TYR A 146 -22.689 -15.435 3.825 1.00 0.00 N ATOM 641 CA TYR A 146 -23.690 -16.386 3.357 1.00 0.00 C ATOM 642 C TYR A 146 -25.088 -15.971 3.807 1.00 0.00 C ATOM 643 O TYR A 146 -25.243 -15.129 4.691 1.00 0.00 O ATOM 644 CB TYR A 146 -23.371 -17.790 3.873 1.00 0.00 C ATOM 645 CG TYR A 146 -22.898 -17.814 5.309 1.00 0.00 C ATOM 646 CD1 TYR A 146 -23.637 -17.205 6.315 1.00 0.00 C ATOM 647 CD2 TYR A 146 -21.711 -18.446 5.659 1.00 0.00 C ATOM 648 CE1 TYR A 146 -23.209 -17.223 7.628 1.00 0.00 C ATOM 649 CE2 TYR A 146 -21.275 -18.471 6.970 1.00 0.00 C ATOM 650 CZ TYR A 146 -22.027 -17.858 7.950 1.00 0.00 C ATOM 651 OH TYR A 146 -21.596 -17.880 9.257 1.00 0.00 O ATOM 0 H TYR A 146 -23.043 -14.740 4.482 1.00 0.00 H new ATOM 0 HA TYR A 146 -23.666 -16.393 2.267 1.00 0.00 H new ATOM 0 HB2 TYR A 146 -24.261 -18.412 3.782 1.00 0.00 H new ATOM 0 HB3 TYR A 146 -22.604 -18.236 3.239 1.00 0.00 H new ATOM 0 HD1 TYR A 146 -24.563 -16.708 6.066 1.00 0.00 H new ATOM 0 HD2 TYR A 146 -21.119 -18.926 4.893 1.00 0.00 H new ATOM 0 HE1 TYR A 146 -23.796 -16.743 8.398 1.00 0.00 H new ATOM 0 HE2 TYR A 146 -20.351 -18.968 7.226 1.00 0.00 H new ATOM 0 HH TYR A 146 -20.748 -18.368 9.314 1.00 0.00 H new ATOM 661 N ASP A 147 -26.102 -16.570 3.192 1.00 0.00 N ATOM 662 CA ASP A 147 -27.488 -16.266 3.529 1.00 0.00 C ATOM 663 C ASP A 147 -27.956 -17.106 4.713 1.00 0.00 C ATOM 664 O ASP A 147 -28.088 -18.325 4.608 1.00 0.00 O ATOM 665 CB ASP A 147 -28.394 -16.513 2.322 1.00 0.00 C ATOM 666 CG ASP A 147 -29.841 -16.156 2.603 1.00 0.00 C ATOM 667 OD1 ASP A 147 -30.082 -15.110 3.241 1.00 0.00 O ATOM 668 OD2 ASP A 147 -30.733 -16.923 2.183 1.00 0.00 O ATOM 0 H ASP A 147 -25.990 -17.269 2.458 1.00 0.00 H new ATOM 0 HA ASP A 147 -27.546 -15.214 3.808 1.00 0.00 H new ATOM 0 HB2 ASP A 147 -28.036 -15.927 1.476 1.00 0.00 H new ATOM 0 HB3 ASP A 147 -28.331 -17.562 2.032 1.00 0.00 H new ATOM 673 N ALA A 148 -28.204 -16.446 5.839 1.00 0.00 N ATOM 674 CA ALA A 148 -28.659 -17.132 7.042 1.00 0.00 C ATOM 675 C ALA A 148 -29.544 -18.324 6.694 1.00 0.00 C ATOM 676 O ALA A 148 -29.223 -19.464 7.027 1.00 0.00 O ATOM 677 CB ALA A 148 -29.404 -16.166 7.951 1.00 0.00 C ATOM 0 H ALA A 148 -28.098 -15.437 5.943 1.00 0.00 H new ATOM 0 HA ALA A 148 -27.782 -17.507 7.570 1.00 0.00 H new ATOM 0 HB1 ALA A 148 -29.738 -16.692 8.845 1.00 0.00 H new ATOM 0 HB2 ALA A 148 -28.740 -15.350 8.237 1.00 0.00 H new ATOM 0 HB3 ALA A 148 -30.268 -15.763 7.423 1.00 0.00 H new ATOM 683 N GLU A 149 -30.658 -18.051 6.022 1.00 0.00 N ATOM 684 CA GLU A 149 -31.590 -19.102 5.631 1.00 0.00 C ATOM 685 C GLU A 149 -30.841 -20.359 5.197 1.00 0.00 C ATOM 686 O GLU A 149 -31.189 -21.472 5.594 1.00 0.00 O ATOM 687 CB GLU A 149 -32.493 -18.617 4.496 1.00 0.00 C ATOM 688 CG GLU A 149 -33.827 -19.341 4.427 1.00 0.00 C ATOM 689 CD GLU A 149 -33.711 -20.721 3.808 1.00 0.00 C ATOM 690 OE1 GLU A 149 -32.867 -20.895 2.905 1.00 0.00 O ATOM 691 OE2 GLU A 149 -34.463 -21.625 4.227 1.00 0.00 O ATOM 0 H GLU A 149 -30.937 -17.112 5.737 1.00 0.00 H new ATOM 0 HA GLU A 149 -32.206 -19.347 6.497 1.00 0.00 H new ATOM 0 HB2 GLU A 149 -32.675 -17.549 4.619 1.00 0.00 H new ATOM 0 HB3 GLU A 149 -31.971 -18.744 3.548 1.00 0.00 H new ATOM 0 HG2 GLU A 149 -34.240 -19.431 5.432 1.00 0.00 H new ATOM 0 HG3 GLU A 149 -34.530 -18.744 3.846 1.00 0.00 H new ATOM 698 N LYS A 150 -29.810 -20.174 4.379 1.00 0.00 N ATOM 699 CA LYS A 150 -29.010 -21.291 3.891 1.00 0.00 C ATOM 700 C LYS A 150 -28.024 -21.760 4.956 1.00 0.00 C ATOM 701 O LYS A 150 -27.814 -22.960 5.133 1.00 0.00 O ATOM 702 CB LYS A 150 -28.254 -20.887 2.623 1.00 0.00 C ATOM 703 CG LYS A 150 -27.608 -22.057 1.902 1.00 0.00 C ATOM 704 CD LYS A 150 -28.586 -22.741 0.961 1.00 0.00 C ATOM 705 CE LYS A 150 -28.819 -21.917 -0.296 1.00 0.00 C ATOM 706 NZ LYS A 150 -29.921 -22.475 -1.128 1.00 0.00 N ATOM 0 H LYS A 150 -29.509 -19.260 4.040 1.00 0.00 H new ATOM 0 HA LYS A 150 -29.685 -22.115 3.658 1.00 0.00 H new ATOM 0 HB2 LYS A 150 -28.944 -20.387 1.942 1.00 0.00 H new ATOM 0 HB3 LYS A 150 -27.483 -20.162 2.885 1.00 0.00 H new ATOM 0 HG2 LYS A 150 -26.744 -21.706 1.338 1.00 0.00 H new ATOM 0 HG3 LYS A 150 -27.240 -22.777 2.633 1.00 0.00 H new ATOM 0 HD2 LYS A 150 -28.202 -23.724 0.687 1.00 0.00 H new ATOM 0 HD3 LYS A 150 -29.535 -22.901 1.474 1.00 0.00 H new ATOM 0 HE2 LYS A 150 -29.058 -20.890 -0.018 1.00 0.00 H new ATOM 0 HE3 LYS A 150 -27.902 -21.883 -0.884 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 -30.049 -21.886 -1.975 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 -29.682 -23.446 -1.414 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 -30.802 -22.484 -0.576 1.00 0.00 H new ATOM 720 N GLN A 151 -27.424 -20.807 5.662 1.00 0.00 N ATOM 721 CA GLN A 151 -26.461 -21.125 6.710 1.00 0.00 C ATOM 722 C GLN A 151 -25.275 -21.899 6.143 1.00 0.00 C ATOM 723 O GLN A 151 -24.930 -22.973 6.636 1.00 0.00 O ATOM 724 CB GLN A 151 -27.132 -21.937 7.819 1.00 0.00 C ATOM 725 CG GLN A 151 -27.716 -21.080 8.931 1.00 0.00 C ATOM 726 CD GLN A 151 -27.707 -21.783 10.275 1.00 0.00 C ATOM 727 OE1 GLN A 151 -28.310 -22.844 10.437 1.00 0.00 O ATOM 728 NE2 GLN A 151 -27.021 -21.193 11.247 1.00 0.00 N ATOM 0 H GLN A 151 -27.587 -19.809 5.528 1.00 0.00 H new ATOM 0 HA GLN A 151 -26.093 -20.188 7.127 1.00 0.00 H new ATOM 0 HB2 GLN A 151 -27.926 -22.544 7.384 1.00 0.00 H new ATOM 0 HB3 GLN A 151 -26.403 -22.625 8.247 1.00 0.00 H new ATOM 0 HG2 GLN A 151 -27.148 -20.153 9.006 1.00 0.00 H new ATOM 0 HG3 GLN A 151 -28.740 -20.807 8.675 1.00 0.00 H new ATOM 0 HE21 GLN A 151 -26.536 -20.314 11.068 1.00 0.00 H new ATOM 0 HE22 GLN A 151 -26.979 -21.619 12.173 1.00 0.00 H new ATOM 737 N ARG A 152 -24.657 -21.348 5.104 1.00 0.00 N ATOM 738 CA ARG A 152 -23.511 -21.987 4.469 1.00 0.00 C ATOM 739 C ARG A 152 -22.777 -21.008 3.558 1.00 0.00 C ATOM 740 O ARG A 152 -23.386 -20.227 2.826 1.00 0.00 O ATOM 741 CB ARG A 152 -23.962 -23.208 3.664 1.00 0.00 C ATOM 742 CG ARG A 152 -23.097 -23.489 2.447 1.00 0.00 C ATOM 743 CD ARG A 152 -23.241 -24.929 1.982 1.00 0.00 C ATOM 744 NE ARG A 152 -24.599 -25.228 1.537 1.00 0.00 N ATOM 745 CZ ARG A 152 -25.044 -24.971 0.312 1.00 0.00 C ATOM 746 NH1 ARG A 152 -24.242 -24.416 -0.586 1.00 0.00 N ATOM 747 NH2 ARG A 152 -26.294 -25.272 -0.018 1.00 0.00 N ATOM 0 H ARG A 152 -24.931 -20.460 4.684 1.00 0.00 H new ATOM 0 HA ARG A 152 -22.827 -22.309 5.254 1.00 0.00 H new ATOM 0 HB2 ARG A 152 -23.956 -24.083 4.314 1.00 0.00 H new ATOM 0 HB3 ARG A 152 -24.992 -23.059 3.340 1.00 0.00 H new ATOM 0 HG2 ARG A 152 -23.376 -22.814 1.637 1.00 0.00 H new ATOM 0 HG3 ARG A 152 -22.053 -23.285 2.686 1.00 0.00 H new ATOM 0 HD2 ARG A 152 -22.543 -25.118 1.167 1.00 0.00 H new ATOM 0 HD3 ARG A 152 -22.970 -25.601 2.796 1.00 0.00 H new ATOM 0 HE ARG A 152 -25.241 -25.658 2.203 1.00 0.00 H new ATOM 0 HH11 ARG A 152 -23.280 -24.185 -0.337 1.00 0.00 H new ATOM 0 HH12 ARG A 152 -24.587 -24.220 -1.526 1.00 0.00 H new ATOM 0 HH21 ARG A 152 -26.914 -25.701 0.669 1.00 0.00 H new ATOM 0 HH22 ARG A 152 -26.635 -25.074 -0.959 1.00 0.00 H new ATOM 761 N PRO A 153 -21.437 -21.048 3.603 1.00 0.00 N ATOM 762 CA PRO A 153 -20.591 -20.170 2.789 1.00 0.00 C ATOM 763 C PRO A 153 -20.649 -20.522 1.306 1.00 0.00 C ATOM 764 O PRO A 153 -20.165 -21.574 0.888 1.00 0.00 O ATOM 765 CB PRO A 153 -19.186 -20.419 3.342 1.00 0.00 C ATOM 766 CG PRO A 153 -19.245 -21.788 3.927 1.00 0.00 C ATOM 767 CD PRO A 153 -20.645 -21.953 4.452 1.00 0.00 C ATOM 0 HA PRO A 153 -20.909 -19.129 2.847 1.00 0.00 H new ATOM 0 HB2 PRO A 153 -18.434 -20.357 2.555 1.00 0.00 H new ATOM 0 HB3 PRO A 153 -18.920 -19.678 4.096 1.00 0.00 H new ATOM 0 HG2 PRO A 153 -19.018 -22.544 3.175 1.00 0.00 H new ATOM 0 HG3 PRO A 153 -18.512 -21.903 4.726 1.00 0.00 H new ATOM 0 HD2 PRO A 153 -20.987 -22.985 4.368 1.00 0.00 H new ATOM 0 HD3 PRO A 153 -20.714 -21.679 5.505 1.00 0.00 H new ATOM 775 N ARG A 154 -21.245 -19.635 0.516 1.00 0.00 N ATOM 776 CA ARG A 154 -21.367 -19.852 -0.921 1.00 0.00 C ATOM 777 C ARG A 154 -20.011 -20.184 -1.538 1.00 0.00 C ATOM 778 O ARG A 154 -19.871 -21.167 -2.263 1.00 0.00 O ATOM 779 CB ARG A 154 -21.958 -18.614 -1.597 1.00 0.00 C ATOM 780 CG ARG A 154 -23.295 -18.182 -1.016 1.00 0.00 C ATOM 781 CD ARG A 154 -23.617 -16.739 -1.371 1.00 0.00 C ATOM 782 NE ARG A 154 -23.807 -16.559 -2.808 1.00 0.00 N ATOM 783 CZ ARG A 154 -24.914 -16.909 -3.453 1.00 0.00 C ATOM 784 NH1 ARG A 154 -25.925 -17.455 -2.792 1.00 0.00 N ATOM 785 NH2 ARG A 154 -25.012 -16.713 -4.761 1.00 0.00 N ATOM 0 H ARG A 154 -21.651 -18.760 0.846 1.00 0.00 H new ATOM 0 HA ARG A 154 -22.036 -20.698 -1.080 1.00 0.00 H new ATOM 0 HB2 ARG A 154 -21.250 -17.790 -1.509 1.00 0.00 H new ATOM 0 HB3 ARG A 154 -22.082 -18.816 -2.661 1.00 0.00 H new ATOM 0 HG2 ARG A 154 -24.084 -18.835 -1.391 1.00 0.00 H new ATOM 0 HG3 ARG A 154 -23.276 -18.295 0.068 1.00 0.00 H new ATOM 0 HD2 ARG A 154 -24.519 -16.429 -0.844 1.00 0.00 H new ATOM 0 HD3 ARG A 154 -22.809 -16.092 -1.028 1.00 0.00 H new ATOM 0 HE ARG A 154 -23.048 -16.141 -3.346 1.00 0.00 H new ATOM 0 HH11 ARG A 154 -25.854 -17.607 -1.786 1.00 0.00 H new ATOM 0 HH12 ARG A 154 -26.774 -17.723 -3.289 1.00 0.00 H new ATOM 0 HH21 ARG A 154 -24.236 -16.293 -5.273 1.00 0.00 H new ATOM 0 HH22 ARG A 154 -25.863 -16.982 -5.255 1.00 0.00 H new ATOM 799 N GLY A 155 -19.014 -19.354 -1.244 1.00 0.00 N ATOM 800 CA GLY A 155 -17.683 -19.575 -1.778 1.00 0.00 C ATOM 801 C GLY A 155 -16.821 -18.330 -1.719 1.00 0.00 C ATOM 802 O GLY A 155 -16.056 -18.051 -2.643 1.00 0.00 O ATOM 0 H GLY A 155 -19.105 -18.533 -0.646 1.00 0.00 H new ATOM 0 HA2 GLY A 155 -17.199 -20.375 -1.219 1.00 0.00 H new ATOM 0 HA3 GLY A 155 -17.761 -19.911 -2.812 1.00 0.00 H new ATOM 806 N PHE A 156 -16.944 -17.578 -0.630 1.00 0.00 N ATOM 807 CA PHE A 156 -16.171 -16.354 -0.455 1.00 0.00 C ATOM 808 C PHE A 156 -16.307 -15.824 0.969 1.00 0.00 C ATOM 809 O PHE A 156 -17.231 -16.191 1.694 1.00 0.00 O ATOM 810 CB PHE A 156 -16.629 -15.289 -1.453 1.00 0.00 C ATOM 811 CG PHE A 156 -18.103 -15.007 -1.394 1.00 0.00 C ATOM 812 CD1 PHE A 156 -18.604 -14.045 -0.532 1.00 0.00 C ATOM 813 CD2 PHE A 156 -18.988 -15.704 -2.201 1.00 0.00 C ATOM 814 CE1 PHE A 156 -19.960 -13.782 -0.476 1.00 0.00 C ATOM 815 CE2 PHE A 156 -20.345 -15.446 -2.149 1.00 0.00 C ATOM 816 CZ PHE A 156 -20.831 -14.485 -1.285 1.00 0.00 C ATOM 0 H PHE A 156 -17.572 -17.795 0.144 1.00 0.00 H new ATOM 0 HA PHE A 156 -15.122 -16.587 -0.639 1.00 0.00 H new ATOM 0 HB2 PHE A 156 -16.083 -14.365 -1.263 1.00 0.00 H new ATOM 0 HB3 PHE A 156 -16.369 -15.611 -2.461 1.00 0.00 H new ATOM 0 HD1 PHE A 156 -17.927 -13.494 0.104 1.00 0.00 H new ATOM 0 HD2 PHE A 156 -18.613 -16.457 -2.878 1.00 0.00 H new ATOM 0 HE1 PHE A 156 -20.338 -13.028 0.199 1.00 0.00 H new ATOM 0 HE2 PHE A 156 -21.024 -15.996 -2.784 1.00 0.00 H new ATOM 0 HZ PHE A 156 -21.891 -14.283 -1.242 1.00 0.00 H new ATOM 826 N GLY A 157 -15.377 -14.959 1.364 1.00 0.00 N ATOM 827 CA GLY A 157 -15.410 -14.392 2.700 1.00 0.00 C ATOM 828 C GLY A 157 -14.104 -13.722 3.077 1.00 0.00 C ATOM 829 O GLY A 157 -13.383 -13.221 2.215 1.00 0.00 O ATOM 0 H GLY A 157 -14.602 -14.641 0.783 1.00 0.00 H new ATOM 0 HA2 GLY A 157 -16.219 -13.665 2.763 1.00 0.00 H new ATOM 0 HA3 GLY A 157 -15.632 -15.179 3.420 1.00 0.00 H new ATOM 833 N PHE A 158 -13.800 -13.710 4.371 1.00 0.00 N ATOM 834 CA PHE A 158 -12.573 -13.093 4.862 1.00 0.00 C ATOM 835 C PHE A 158 -12.028 -13.852 6.068 1.00 0.00 C ATOM 836 O PHE A 158 -12.721 -14.680 6.659 1.00 0.00 O ATOM 837 CB PHE A 158 -12.826 -11.631 5.236 1.00 0.00 C ATOM 838 CG PHE A 158 -13.431 -10.824 4.123 1.00 0.00 C ATOM 839 CD1 PHE A 158 -14.739 -11.041 3.724 1.00 0.00 C ATOM 840 CD2 PHE A 158 -12.690 -9.847 3.477 1.00 0.00 C ATOM 841 CE1 PHE A 158 -15.298 -10.300 2.699 1.00 0.00 C ATOM 842 CE2 PHE A 158 -13.243 -9.102 2.452 1.00 0.00 C ATOM 843 CZ PHE A 158 -14.549 -9.328 2.064 1.00 0.00 C ATOM 0 H PHE A 158 -14.386 -14.120 5.098 1.00 0.00 H new ATOM 0 HA PHE A 158 -11.831 -13.133 4.064 1.00 0.00 H new ATOM 0 HB2 PHE A 158 -13.488 -11.595 6.101 1.00 0.00 H new ATOM 0 HB3 PHE A 158 -11.884 -11.173 5.536 1.00 0.00 H new ATOM 0 HD1 PHE A 158 -15.329 -11.798 4.219 1.00 0.00 H new ATOM 0 HD2 PHE A 158 -11.669 -9.666 3.778 1.00 0.00 H new ATOM 0 HE1 PHE A 158 -16.319 -10.481 2.395 1.00 0.00 H new ATOM 0 HE2 PHE A 158 -12.655 -8.345 1.956 1.00 0.00 H new ATOM 0 HZ PHE A 158 -14.984 -8.746 1.265 1.00 0.00 H new ATOM 853 N ILE A 159 -10.781 -13.563 6.427 1.00 0.00 N ATOM 854 CA ILE A 159 -10.143 -14.217 7.562 1.00 0.00 C ATOM 855 C ILE A 159 -9.113 -13.302 8.216 1.00 0.00 C ATOM 856 O ILE A 159 -8.334 -12.637 7.533 1.00 0.00 O ATOM 857 CB ILE A 159 -9.454 -15.529 7.142 1.00 0.00 C ATOM 858 CG1 ILE A 159 -10.445 -16.441 6.417 1.00 0.00 C ATOM 859 CG2 ILE A 159 -8.870 -16.233 8.358 1.00 0.00 C ATOM 860 CD1 ILE A 159 -9.897 -17.823 6.132 1.00 0.00 C ATOM 0 H ILE A 159 -10.193 -12.881 5.948 1.00 0.00 H new ATOM 0 HA ILE A 159 -10.932 -14.444 8.279 1.00 0.00 H new ATOM 0 HB ILE A 159 -8.639 -15.292 6.458 1.00 0.00 H new ATOM 0 HG12 ILE A 159 -11.348 -16.534 7.020 1.00 0.00 H new ATOM 0 HG13 ILE A 159 -10.736 -15.973 5.476 1.00 0.00 H new ATOM 0 HG21 ILE A 159 -8.386 -17.158 8.045 1.00 0.00 H new ATOM 0 HG22 ILE A 159 -8.137 -15.584 8.837 1.00 0.00 H new ATOM 0 HG23 ILE A 159 -9.668 -16.461 9.064 1.00 0.00 H new ATOM 0 HD11 ILE A 159 -10.653 -18.415 5.617 1.00 0.00 H new ATOM 0 HD12 ILE A 159 -9.010 -17.740 5.504 1.00 0.00 H new ATOM 0 HD13 ILE A 159 -9.632 -18.310 7.070 1.00 0.00 H new ATOM 872 N THR A 160 -9.114 -13.274 9.546 1.00 0.00 N ATOM 873 CA THR A 160 -8.180 -12.441 10.293 1.00 0.00 C ATOM 874 C THR A 160 -7.053 -13.277 10.889 1.00 0.00 C ATOM 875 O THR A 160 -7.269 -14.410 11.321 1.00 0.00 O ATOM 876 CB THR A 160 -8.891 -11.677 11.426 1.00 0.00 C ATOM 877 OG1 THR A 160 -10.001 -10.941 10.899 1.00 0.00 O ATOM 878 CG2 THR A 160 -7.930 -10.725 12.123 1.00 0.00 C ATOM 0 H THR A 160 -9.751 -13.819 10.127 1.00 0.00 H new ATOM 0 HA THR A 160 -7.762 -11.723 9.587 1.00 0.00 H new ATOM 0 HB THR A 160 -9.250 -12.404 12.155 1.00 0.00 H new ATOM 0 HG1 THR A 160 -10.449 -10.459 11.626 1.00 0.00 H new ATOM 0 HG21 THR A 160 -8.455 -10.197 12.919 1.00 0.00 H new ATOM 0 HG22 THR A 160 -7.101 -11.291 12.548 1.00 0.00 H new ATOM 0 HG23 THR A 160 -7.545 -10.004 11.402 1.00 0.00 H new ATOM 886 N PHE A 161 -5.851 -12.712 10.910 1.00 0.00 N ATOM 887 CA PHE A 161 -4.690 -13.406 11.454 1.00 0.00 C ATOM 888 C PHE A 161 -4.202 -12.732 12.732 1.00 0.00 C ATOM 889 O PHE A 161 -4.731 -11.699 13.142 1.00 0.00 O ATOM 890 CB PHE A 161 -3.561 -13.443 10.421 1.00 0.00 C ATOM 891 CG PHE A 161 -3.832 -14.371 9.271 1.00 0.00 C ATOM 892 CD1 PHE A 161 -4.739 -14.025 8.283 1.00 0.00 C ATOM 893 CD2 PHE A 161 -3.178 -15.589 9.178 1.00 0.00 C ATOM 894 CE1 PHE A 161 -4.990 -14.877 7.224 1.00 0.00 C ATOM 895 CE2 PHE A 161 -3.425 -16.445 8.121 1.00 0.00 C ATOM 896 CZ PHE A 161 -4.331 -16.088 7.142 1.00 0.00 C ATOM 0 H PHE A 161 -5.655 -11.775 10.557 1.00 0.00 H new ATOM 0 HA PHE A 161 -4.988 -14.427 11.694 1.00 0.00 H new ATOM 0 HB2 PHE A 161 -3.399 -12.437 10.035 1.00 0.00 H new ATOM 0 HB3 PHE A 161 -2.638 -13.748 10.914 1.00 0.00 H new ATOM 0 HD1 PHE A 161 -5.256 -13.079 8.341 1.00 0.00 H new ATOM 0 HD2 PHE A 161 -2.467 -15.873 9.940 1.00 0.00 H new ATOM 0 HE1 PHE A 161 -5.701 -14.596 6.461 1.00 0.00 H new ATOM 0 HE2 PHE A 161 -2.910 -17.392 8.061 1.00 0.00 H new ATOM 0 HZ PHE A 161 -4.524 -16.754 6.314 1.00 0.00 H new ATOM 906 N GLU A 162 -3.189 -13.324 13.358 1.00 0.00 N ATOM 907 CA GLU A 162 -2.631 -12.781 14.591 1.00 0.00 C ATOM 908 C GLU A 162 -1.717 -11.595 14.298 1.00 0.00 C ATOM 909 O GLU A 162 -1.710 -10.607 15.033 1.00 0.00 O ATOM 910 CB GLU A 162 -1.854 -13.863 15.345 1.00 0.00 C ATOM 911 CG GLU A 162 -1.233 -13.373 16.642 1.00 0.00 C ATOM 912 CD GLU A 162 -0.332 -14.409 17.285 1.00 0.00 C ATOM 913 OE1 GLU A 162 -0.848 -15.462 17.714 1.00 0.00 O ATOM 914 OE2 GLU A 162 0.891 -14.167 17.358 1.00 0.00 O ATOM 0 H GLU A 162 -2.739 -14.179 13.032 1.00 0.00 H new ATOM 0 HA GLU A 162 -3.457 -12.436 15.213 1.00 0.00 H new ATOM 0 HB2 GLU A 162 -2.524 -14.694 15.564 1.00 0.00 H new ATOM 0 HB3 GLU A 162 -1.067 -14.250 14.698 1.00 0.00 H new ATOM 0 HG2 GLU A 162 -0.658 -12.468 16.446 1.00 0.00 H new ATOM 0 HG3 GLU A 162 -2.025 -13.102 17.340 1.00 0.00 H new ATOM 921 N ASP A 163 -0.948 -11.700 13.220 1.00 0.00 N ATOM 922 CA ASP A 163 -0.031 -10.636 12.828 1.00 0.00 C ATOM 923 C ASP A 163 -0.143 -10.344 11.335 1.00 0.00 C ATOM 924 O ASP A 163 -0.370 -11.248 10.532 1.00 0.00 O ATOM 925 CB ASP A 163 1.408 -11.019 13.179 1.00 0.00 C ATOM 926 CG ASP A 163 1.769 -10.668 14.609 1.00 0.00 C ATOM 927 OD1 ASP A 163 1.160 -11.246 15.533 1.00 0.00 O ATOM 928 OD2 ASP A 163 2.659 -9.814 14.803 1.00 0.00 O ATOM 0 H ASP A 163 -0.941 -12.511 12.602 1.00 0.00 H new ATOM 0 HA ASP A 163 -0.303 -9.735 13.377 1.00 0.00 H new ATOM 0 HB2 ASP A 163 1.543 -12.090 13.026 1.00 0.00 H new ATOM 0 HB3 ASP A 163 2.092 -10.511 12.500 1.00 0.00 H new ATOM 933 N GLU A 164 0.018 -9.075 10.972 1.00 0.00 N ATOM 934 CA GLU A 164 -0.068 -8.665 9.575 1.00 0.00 C ATOM 935 C GLU A 164 0.786 -9.567 8.689 1.00 0.00 C ATOM 936 O GLU A 164 0.352 -9.994 7.620 1.00 0.00 O ATOM 937 CB GLU A 164 0.379 -7.209 9.420 1.00 0.00 C ATOM 938 CG GLU A 164 0.216 -6.670 8.009 1.00 0.00 C ATOM 939 CD GLU A 164 1.039 -5.420 7.764 1.00 0.00 C ATOM 940 OE1 GLU A 164 2.104 -5.277 8.401 1.00 0.00 O ATOM 941 OE2 GLU A 164 0.618 -4.585 6.937 1.00 0.00 O ATOM 0 H GLU A 164 0.208 -8.315 11.625 1.00 0.00 H new ATOM 0 HA GLU A 164 -1.108 -8.755 9.260 1.00 0.00 H new ATOM 0 HB2 GLU A 164 -0.195 -6.586 10.106 1.00 0.00 H new ATOM 0 HB3 GLU A 164 1.426 -7.126 9.713 1.00 0.00 H new ATOM 0 HG2 GLU A 164 0.508 -7.439 7.294 1.00 0.00 H new ATOM 0 HG3 GLU A 164 -0.836 -6.449 7.827 1.00 0.00 H new ATOM 948 N GLN A 165 2.002 -9.853 9.143 1.00 0.00 N ATOM 949 CA GLN A 165 2.917 -10.703 8.392 1.00 0.00 C ATOM 950 C GLN A 165 2.158 -11.799 7.651 1.00 0.00 C ATOM 951 O GLN A 165 2.360 -12.009 6.455 1.00 0.00 O ATOM 952 CB GLN A 165 3.953 -11.328 9.329 1.00 0.00 C ATOM 953 CG GLN A 165 5.014 -12.142 8.607 1.00 0.00 C ATOM 954 CD GLN A 165 5.887 -12.938 9.558 1.00 0.00 C ATOM 955 OE1 GLN A 165 6.313 -12.433 10.597 1.00 0.00 O ATOM 956 NE2 GLN A 165 6.157 -14.189 9.206 1.00 0.00 N ATOM 0 H GLN A 165 2.376 -9.508 10.027 1.00 0.00 H new ATOM 0 HA GLN A 165 3.430 -10.081 7.658 1.00 0.00 H new ATOM 0 HB2 GLN A 165 4.440 -10.536 9.899 1.00 0.00 H new ATOM 0 HB3 GLN A 165 3.441 -11.969 10.047 1.00 0.00 H new ATOM 0 HG2 GLN A 165 4.530 -12.824 7.908 1.00 0.00 H new ATOM 0 HG3 GLN A 165 5.641 -11.473 8.018 1.00 0.00 H new ATOM 0 HE21 GLN A 165 5.782 -14.566 8.335 1.00 0.00 H new ATOM 0 HE22 GLN A 165 6.739 -14.773 9.806 1.00 0.00 H new ATOM 965 N SER A 166 1.284 -12.496 8.370 1.00 0.00 N ATOM 966 CA SER A 166 0.497 -13.574 7.782 1.00 0.00 C ATOM 967 C SER A 166 -0.248 -13.088 6.543 1.00 0.00 C ATOM 968 O SER A 166 -0.161 -13.695 5.475 1.00 0.00 O ATOM 969 CB SER A 166 -0.498 -14.124 8.806 1.00 0.00 C ATOM 970 OG SER A 166 0.160 -14.513 9.999 1.00 0.00 O ATOM 0 H SER A 166 1.103 -12.334 9.361 1.00 0.00 H new ATOM 0 HA SER A 166 1.180 -14.370 7.486 1.00 0.00 H new ATOM 0 HB2 SER A 166 -1.249 -13.366 9.032 1.00 0.00 H new ATOM 0 HB3 SER A 166 -1.025 -14.979 8.383 1.00 0.00 H new ATOM 0 HG SER A 166 -0.505 -14.692 10.696 1.00 0.00 H new ATOM 976 N VAL A 167 -0.981 -11.990 6.693 1.00 0.00 N ATOM 977 CA VAL A 167 -1.741 -11.421 5.586 1.00 0.00 C ATOM 978 C VAL A 167 -0.888 -11.322 4.327 1.00 0.00 C ATOM 979 O VAL A 167 -1.319 -11.708 3.240 1.00 0.00 O ATOM 980 CB VAL A 167 -2.283 -10.023 5.937 1.00 0.00 C ATOM 981 CG1 VAL A 167 -2.896 -9.363 4.711 1.00 0.00 C ATOM 982 CG2 VAL A 167 -3.298 -10.113 7.067 1.00 0.00 C ATOM 0 H VAL A 167 -1.065 -11.476 7.570 1.00 0.00 H new ATOM 0 HA VAL A 167 -2.580 -12.092 5.401 1.00 0.00 H new ATOM 0 HB VAL A 167 -1.451 -9.405 6.274 1.00 0.00 H new ATOM 0 HG11 VAL A 167 -3.273 -8.376 4.979 1.00 0.00 H new ATOM 0 HG12 VAL A 167 -2.138 -9.263 3.934 1.00 0.00 H new ATOM 0 HG13 VAL A 167 -3.717 -9.977 4.340 1.00 0.00 H new ATOM 0 HG21 VAL A 167 -3.670 -9.116 7.302 1.00 0.00 H new ATOM 0 HG22 VAL A 167 -4.129 -10.748 6.760 1.00 0.00 H new ATOM 0 HG23 VAL A 167 -2.823 -10.540 7.950 1.00 0.00 H new ATOM 992 N ASP A 168 0.325 -10.802 4.480 1.00 0.00 N ATOM 993 CA ASP A 168 1.241 -10.653 3.356 1.00 0.00 C ATOM 994 C ASP A 168 1.618 -12.013 2.778 1.00 0.00 C ATOM 995 O ASP A 168 1.492 -12.243 1.575 1.00 0.00 O ATOM 996 CB ASP A 168 2.501 -9.904 3.793 1.00 0.00 C ATOM 997 CG ASP A 168 3.255 -9.306 2.621 1.00 0.00 C ATOM 998 OD1 ASP A 168 3.447 -10.019 1.613 1.00 0.00 O ATOM 999 OD2 ASP A 168 3.652 -8.126 2.711 1.00 0.00 O ATOM 0 H ASP A 168 0.697 -10.476 5.372 1.00 0.00 H new ATOM 0 HA ASP A 168 0.735 -10.077 2.581 1.00 0.00 H new ATOM 0 HB2 ASP A 168 2.226 -9.110 4.487 1.00 0.00 H new ATOM 0 HB3 ASP A 168 3.157 -10.587 4.333 1.00 0.00 H new ATOM 1004 N GLN A 169 2.081 -12.910 3.642 1.00 0.00 N ATOM 1005 CA GLN A 169 2.478 -14.247 3.216 1.00 0.00 C ATOM 1006 C GLN A 169 1.413 -14.871 2.320 1.00 0.00 C ATOM 1007 O GLN A 169 1.712 -15.349 1.226 1.00 0.00 O ATOM 1008 CB GLN A 169 2.724 -15.141 4.433 1.00 0.00 C ATOM 1009 CG GLN A 169 4.048 -14.869 5.129 1.00 0.00 C ATOM 1010 CD GLN A 169 4.368 -15.897 6.197 1.00 0.00 C ATOM 1011 OE1 GLN A 169 4.340 -15.598 7.391 1.00 0.00 O ATOM 1012 NE2 GLN A 169 4.674 -17.117 5.771 1.00 0.00 N ATOM 0 H GLN A 169 2.191 -12.736 4.641 1.00 0.00 H new ATOM 0 HA GLN A 169 3.402 -14.160 2.645 1.00 0.00 H new ATOM 0 HB2 GLN A 169 1.912 -15.001 5.147 1.00 0.00 H new ATOM 0 HB3 GLN A 169 2.696 -16.184 4.119 1.00 0.00 H new ATOM 0 HG2 GLN A 169 4.848 -14.859 4.389 1.00 0.00 H new ATOM 0 HG3 GLN A 169 4.019 -13.878 5.581 1.00 0.00 H new ATOM 0 HE21 GLN A 169 4.685 -17.320 4.772 1.00 0.00 H new ATOM 0 HE22 GLN A 169 4.898 -17.851 6.443 1.00 0.00 H new ATOM 1021 N ALA A 170 0.171 -14.864 2.791 1.00 0.00 N ATOM 1022 CA ALA A 170 -0.938 -15.427 2.032 1.00 0.00 C ATOM 1023 C ALA A 170 -1.243 -14.584 0.798 1.00 0.00 C ATOM 1024 O ALA A 170 -1.235 -15.085 -0.326 1.00 0.00 O ATOM 1025 CB ALA A 170 -2.174 -15.546 2.911 1.00 0.00 C ATOM 0 H ALA A 170 -0.093 -14.474 3.696 1.00 0.00 H new ATOM 0 HA ALA A 170 -0.647 -16.423 1.697 1.00 0.00 H new ATOM 0 HB1 ALA A 170 -2.994 -15.968 2.330 1.00 0.00 H new ATOM 0 HB2 ALA A 170 -1.957 -16.197 3.758 1.00 0.00 H new ATOM 0 HB3 ALA A 170 -2.458 -14.559 3.275 1.00 0.00 H new ATOM 1031 N VAL A 171 -1.513 -13.301 1.017 1.00 0.00 N ATOM 1032 CA VAL A 171 -1.820 -12.387 -0.078 1.00 0.00 C ATOM 1033 C VAL A 171 -0.871 -12.597 -1.252 1.00 0.00 C ATOM 1034 O VAL A 171 -1.302 -12.872 -2.370 1.00 0.00 O ATOM 1035 CB VAL A 171 -1.740 -10.918 0.378 1.00 0.00 C ATOM 1036 CG1 VAL A 171 -1.732 -9.986 -0.824 1.00 0.00 C ATOM 1037 CG2 VAL A 171 -2.893 -10.587 1.313 1.00 0.00 C ATOM 0 H VAL A 171 -1.525 -12.871 1.942 1.00 0.00 H new ATOM 0 HA VAL A 171 -2.839 -12.605 -0.396 1.00 0.00 H new ATOM 0 HB VAL A 171 -0.808 -10.775 0.924 1.00 0.00 H new ATOM 0 HG11 VAL A 171 -1.675 -8.952 -0.483 1.00 0.00 H new ATOM 0 HG12 VAL A 171 -0.869 -10.209 -1.451 1.00 0.00 H new ATOM 0 HG13 VAL A 171 -2.646 -10.128 -1.401 1.00 0.00 H new ATOM 0 HG21 VAL A 171 -2.821 -9.545 1.625 1.00 0.00 H new ATOM 0 HG22 VAL A 171 -3.839 -10.746 0.795 1.00 0.00 H new ATOM 0 HG23 VAL A 171 -2.847 -11.233 2.190 1.00 0.00 H new ATOM 1047 N ASN A 172 0.425 -12.464 -0.989 1.00 0.00 N ATOM 1048 CA ASN A 172 1.437 -12.639 -2.024 1.00 0.00 C ATOM 1049 C ASN A 172 1.066 -13.786 -2.959 1.00 0.00 C ATOM 1050 O ASN A 172 0.867 -13.585 -4.156 1.00 0.00 O ATOM 1051 CB ASN A 172 2.804 -12.904 -1.391 1.00 0.00 C ATOM 1052 CG ASN A 172 3.932 -12.839 -2.402 1.00 0.00 C ATOM 1053 OD1 ASN A 172 3.825 -13.378 -3.504 1.00 0.00 O ATOM 1054 ND2 ASN A 172 5.022 -12.176 -2.031 1.00 0.00 N ATOM 0 H ASN A 172 0.799 -12.236 -0.068 1.00 0.00 H new ATOM 0 HA ASN A 172 1.487 -11.720 -2.607 1.00 0.00 H new ATOM 0 HB2 ASN A 172 2.984 -12.173 -0.603 1.00 0.00 H new ATOM 0 HB3 ASN A 172 2.799 -13.887 -0.920 1.00 0.00 H new ATOM 0 HD21 ASN A 172 5.814 -12.098 -2.669 1.00 0.00 H new ATOM 0 HD22 ASN A 172 5.067 -11.745 -1.108 1.00 0.00 H new ATOM 1061 N MET A 173 0.975 -14.990 -2.402 1.00 0.00 N ATOM 1062 CA MET A 173 0.627 -16.169 -3.186 1.00 0.00 C ATOM 1063 C MET A 173 -0.601 -15.903 -4.051 1.00 0.00 C ATOM 1064 O MET A 173 -0.647 -16.294 -5.218 1.00 0.00 O ATOM 1065 CB MET A 173 0.367 -17.362 -2.264 1.00 0.00 C ATOM 1066 CG MET A 173 1.624 -18.138 -1.905 1.00 0.00 C ATOM 1067 SD MET A 173 2.005 -19.433 -3.099 1.00 0.00 S ATOM 1068 CE MET A 173 0.598 -20.520 -2.881 1.00 0.00 C ATOM 0 H MET A 173 1.137 -15.174 -1.412 1.00 0.00 H new ATOM 0 HA MET A 173 1.467 -16.401 -3.840 1.00 0.00 H new ATOM 0 HB2 MET A 173 -0.105 -17.007 -1.348 1.00 0.00 H new ATOM 0 HB3 MET A 173 -0.341 -18.036 -2.746 1.00 0.00 H new ATOM 0 HG2 MET A 173 2.466 -17.449 -1.841 1.00 0.00 H new ATOM 0 HG3 MET A 173 1.502 -18.584 -0.918 1.00 0.00 H new ATOM 0 HE1 MET A 173 0.948 -21.534 -2.689 1.00 0.00 H new ATOM 0 HE2 MET A 173 0.000 -20.177 -2.036 1.00 0.00 H new ATOM 0 HE3 MET A 173 -0.012 -20.511 -3.784 1.00 0.00 H new ATOM 1078 N HIS A 174 -1.595 -15.237 -3.472 1.00 0.00 N ATOM 1079 CA HIS A 174 -2.824 -14.920 -4.191 1.00 0.00 C ATOM 1080 C HIS A 174 -3.444 -16.178 -4.790 1.00 0.00 C ATOM 1081 O HIS A 174 -4.169 -16.113 -5.783 1.00 0.00 O ATOM 1082 CB HIS A 174 -2.544 -13.900 -5.296 1.00 0.00 C ATOM 1083 CG HIS A 174 -3.748 -13.565 -6.121 1.00 0.00 C ATOM 1084 ND1 HIS A 174 -3.675 -13.223 -7.455 1.00 0.00 N ATOM 1085 CD2 HIS A 174 -5.061 -13.522 -5.794 1.00 0.00 C ATOM 1086 CE1 HIS A 174 -4.891 -12.983 -7.912 1.00 0.00 C ATOM 1087 NE2 HIS A 174 -5.750 -13.158 -6.924 1.00 0.00 N ATOM 0 H HIS A 174 -1.574 -14.906 -2.507 1.00 0.00 H new ATOM 0 HA HIS A 174 -3.531 -14.491 -3.480 1.00 0.00 H new ATOM 0 HB2 HIS A 174 -2.157 -12.986 -4.846 1.00 0.00 H new ATOM 0 HB3 HIS A 174 -1.763 -14.289 -5.949 1.00 0.00 H new ATOM 0 HD1 HIS A 174 -2.817 -13.165 -8.003 1.00 0.00 H new ATOM 0 HD2 HIS A 174 -5.487 -13.735 -4.825 1.00 0.00 H new ATOM 0 HE1 HIS A 174 -5.140 -12.693 -8.922 1.00 0.00 H new ATOM 1095 N PHE A 175 -3.153 -17.323 -4.181 1.00 0.00 N ATOM 1096 CA PHE A 175 -3.680 -18.597 -4.655 1.00 0.00 C ATOM 1097 C PHE A 175 -3.350 -19.720 -3.677 1.00 0.00 C ATOM 1098 O PHE A 175 -2.286 -19.726 -3.056 1.00 0.00 O ATOM 1099 CB PHE A 175 -3.112 -18.926 -6.037 1.00 0.00 C ATOM 1100 CG PHE A 175 -3.903 -18.331 -7.167 1.00 0.00 C ATOM 1101 CD1 PHE A 175 -5.283 -18.443 -7.199 1.00 0.00 C ATOM 1102 CD2 PHE A 175 -3.265 -17.659 -8.198 1.00 0.00 C ATOM 1103 CE1 PHE A 175 -6.013 -17.897 -8.238 1.00 0.00 C ATOM 1104 CE2 PHE A 175 -3.990 -17.111 -9.240 1.00 0.00 C ATOM 1105 CZ PHE A 175 -5.366 -17.229 -9.259 1.00 0.00 C ATOM 0 H PHE A 175 -2.555 -17.394 -3.358 1.00 0.00 H new ATOM 0 HA PHE A 175 -4.764 -18.509 -4.727 1.00 0.00 H new ATOM 0 HB2 PHE A 175 -2.085 -18.566 -6.094 1.00 0.00 H new ATOM 0 HB3 PHE A 175 -3.078 -20.009 -6.159 1.00 0.00 H new ATOM 0 HD1 PHE A 175 -5.795 -18.963 -6.403 1.00 0.00 H new ATOM 0 HD2 PHE A 175 -2.189 -17.562 -8.187 1.00 0.00 H new ATOM 0 HE1 PHE A 175 -7.089 -17.993 -8.251 1.00 0.00 H new ATOM 0 HE2 PHE A 175 -3.481 -16.591 -10.038 1.00 0.00 H new ATOM 0 HZ PHE A 175 -5.935 -16.800 -10.071 1.00 0.00 H new ATOM 1115 N HIS A 176 -4.270 -20.671 -3.544 1.00 0.00 N ATOM 1116 CA HIS A 176 -4.078 -21.800 -2.641 1.00 0.00 C ATOM 1117 C HIS A 176 -4.925 -22.992 -3.074 1.00 0.00 C ATOM 1118 O HIS A 176 -5.911 -22.837 -3.795 1.00 0.00 O ATOM 1119 CB HIS A 176 -4.432 -21.401 -1.208 1.00 0.00 C ATOM 1120 CG HIS A 176 -3.739 -20.157 -0.744 1.00 0.00 C ATOM 1121 ND1 HIS A 176 -2.513 -20.170 -0.114 1.00 0.00 N ATOM 1122 CD2 HIS A 176 -4.107 -18.857 -0.822 1.00 0.00 C ATOM 1123 CE1 HIS A 176 -2.157 -18.931 0.177 1.00 0.00 C ATOM 1124 NE2 HIS A 176 -3.107 -18.115 -0.243 1.00 0.00 N ATOM 0 H HIS A 176 -5.155 -20.682 -4.050 1.00 0.00 H new ATOM 0 HA HIS A 176 -3.028 -22.090 -2.680 1.00 0.00 H new ATOM 0 HB2 HIS A 176 -5.510 -21.255 -1.136 1.00 0.00 H new ATOM 0 HB3 HIS A 176 -4.176 -22.221 -0.537 1.00 0.00 H new ATOM 0 HD2 HIS A 176 -5.018 -18.474 -1.258 1.00 0.00 H new ATOM 0 HE1 HIS A 176 -1.245 -18.636 0.674 1.00 0.00 H new ATOM 0 HE2 HIS A 176 -3.099 -17.099 -0.152 1.00 0.00 H new ATOM 1132 N ASP A 177 -4.534 -24.182 -2.631 1.00 0.00 N ATOM 1133 CA ASP A 177 -5.257 -25.401 -2.973 1.00 0.00 C ATOM 1134 C ASP A 177 -5.972 -25.970 -1.750 1.00 0.00 C ATOM 1135 O ASP A 177 -5.346 -26.573 -0.879 1.00 0.00 O ATOM 1136 CB ASP A 177 -4.299 -26.444 -3.549 1.00 0.00 C ATOM 1137 CG ASP A 177 -3.420 -25.878 -4.648 1.00 0.00 C ATOM 1138 OD1 ASP A 177 -3.894 -24.993 -5.390 1.00 0.00 O ATOM 1139 OD2 ASP A 177 -2.258 -26.320 -4.765 1.00 0.00 O ATOM 0 H ASP A 177 -3.720 -24.328 -2.034 1.00 0.00 H new ATOM 0 HA ASP A 177 -6.004 -25.151 -3.726 1.00 0.00 H new ATOM 0 HB2 ASP A 177 -3.670 -26.836 -2.750 1.00 0.00 H new ATOM 0 HB3 ASP A 177 -4.873 -27.283 -3.943 1.00 0.00 H new ATOM 1144 N ILE A 178 -7.284 -25.772 -1.694 1.00 0.00 N ATOM 1145 CA ILE A 178 -8.083 -26.265 -0.578 1.00 0.00 C ATOM 1146 C ILE A 178 -9.301 -27.037 -1.074 1.00 0.00 C ATOM 1147 O ILE A 178 -10.034 -26.568 -1.944 1.00 0.00 O ATOM 1148 CB ILE A 178 -8.554 -25.113 0.329 1.00 0.00 C ATOM 1149 CG1 ILE A 178 -7.359 -24.276 0.790 1.00 0.00 C ATOM 1150 CG2 ILE A 178 -9.317 -25.660 1.526 1.00 0.00 C ATOM 1151 CD1 ILE A 178 -7.739 -22.894 1.273 1.00 0.00 C ATOM 0 H ILE A 178 -7.817 -25.274 -2.407 1.00 0.00 H new ATOM 0 HA ILE A 178 -7.443 -26.932 -0.001 1.00 0.00 H new ATOM 0 HB ILE A 178 -9.224 -24.471 -0.243 1.00 0.00 H new ATOM 0 HG12 ILE A 178 -6.844 -24.804 1.593 1.00 0.00 H new ATOM 0 HG13 ILE A 178 -6.652 -24.182 -0.034 1.00 0.00 H new ATOM 0 HG21 ILE A 178 -9.643 -24.834 2.158 1.00 0.00 H new ATOM 0 HG22 ILE A 178 -10.187 -26.217 1.179 1.00 0.00 H new ATOM 0 HG23 ILE A 178 -8.668 -26.321 2.100 1.00 0.00 H new ATOM 0 HD11 ILE A 178 -6.842 -22.358 1.584 1.00 0.00 H new ATOM 0 HD12 ILE A 178 -8.227 -22.348 0.466 1.00 0.00 H new ATOM 0 HD13 ILE A 178 -8.422 -22.979 2.118 1.00 0.00 H new ATOM 1163 N MET A 179 -9.511 -28.223 -0.512 1.00 0.00 N ATOM 1164 CA MET A 179 -10.642 -29.060 -0.895 1.00 0.00 C ATOM 1165 C MET A 179 -10.548 -29.464 -2.363 1.00 0.00 C ATOM 1166 O MET A 179 -11.559 -29.744 -3.006 1.00 0.00 O ATOM 1167 CB MET A 179 -11.958 -28.323 -0.640 1.00 0.00 C ATOM 1168 CG MET A 179 -12.434 -28.409 0.801 1.00 0.00 C ATOM 1169 SD MET A 179 -12.628 -30.109 1.368 1.00 0.00 S ATOM 1170 CE MET A 179 -13.317 -29.845 3.000 1.00 0.00 C ATOM 0 H MET A 179 -8.913 -28.626 0.210 1.00 0.00 H new ATOM 0 HA MET A 179 -10.616 -29.964 -0.286 1.00 0.00 H new ATOM 0 HB2 MET A 179 -11.836 -27.274 -0.912 1.00 0.00 H new ATOM 0 HB3 MET A 179 -12.728 -28.734 -1.293 1.00 0.00 H new ATOM 0 HG2 MET A 179 -11.722 -27.894 1.446 1.00 0.00 H new ATOM 0 HG3 MET A 179 -13.386 -27.887 0.897 1.00 0.00 H new ATOM 0 HE1 MET A 179 -12.712 -30.369 3.740 1.00 0.00 H new ATOM 0 HE2 MET A 179 -13.322 -28.778 3.225 1.00 0.00 H new ATOM 0 HE3 MET A 179 -14.338 -30.227 3.030 1.00 0.00 H new ATOM 1180 N GLY A 180 -9.326 -29.491 -2.888 1.00 0.00 N ATOM 1181 CA GLY A 180 -9.124 -29.861 -4.276 1.00 0.00 C ATOM 1182 C GLY A 180 -9.478 -28.740 -5.233 1.00 0.00 C ATOM 1183 O GLY A 180 -9.578 -28.953 -6.441 1.00 0.00 O ATOM 0 H GLY A 180 -8.473 -29.263 -2.377 1.00 0.00 H new ATOM 0 HA2 GLY A 180 -8.083 -30.146 -4.425 1.00 0.00 H new ATOM 0 HA3 GLY A 180 -9.730 -30.737 -4.507 1.00 0.00 H new ATOM 1187 N LYS A 181 -9.671 -27.542 -4.692 1.00 0.00 N ATOM 1188 CA LYS A 181 -10.018 -26.382 -5.505 1.00 0.00 C ATOM 1189 C LYS A 181 -9.082 -25.213 -5.212 1.00 0.00 C ATOM 1190 O LYS A 181 -8.404 -25.189 -4.185 1.00 0.00 O ATOM 1191 CB LYS A 181 -11.467 -25.965 -5.244 1.00 0.00 C ATOM 1192 CG LYS A 181 -12.127 -25.283 -6.430 1.00 0.00 C ATOM 1193 CD LYS A 181 -13.497 -24.736 -6.068 1.00 0.00 C ATOM 1194 CE LYS A 181 -14.551 -25.832 -6.061 1.00 0.00 C ATOM 1195 NZ LYS A 181 -15.078 -26.104 -7.427 1.00 0.00 N ATOM 0 H LYS A 181 -9.593 -27.349 -3.694 1.00 0.00 H new ATOM 0 HA LYS A 181 -9.909 -26.659 -6.554 1.00 0.00 H new ATOM 0 HB2 LYS A 181 -12.047 -26.847 -4.974 1.00 0.00 H new ATOM 0 HB3 LYS A 181 -11.494 -25.292 -4.387 1.00 0.00 H new ATOM 0 HG2 LYS A 181 -11.492 -24.471 -6.783 1.00 0.00 H new ATOM 0 HG3 LYS A 181 -12.223 -25.993 -7.252 1.00 0.00 H new ATOM 0 HD2 LYS A 181 -13.454 -24.265 -5.086 1.00 0.00 H new ATOM 0 HD3 LYS A 181 -13.781 -23.962 -6.781 1.00 0.00 H new ATOM 0 HE2 LYS A 181 -14.122 -26.745 -5.649 1.00 0.00 H new ATOM 0 HE3 LYS A 181 -15.372 -25.542 -5.406 1.00 0.00 H new ATOM 0 HZ1 LYS A 181 -15.794 -26.857 -7.379 1.00 0.00 H new ATOM 0 HZ2 LYS A 181 -15.510 -25.239 -7.811 1.00 0.00 H new ATOM 0 HZ3 LYS A 181 -14.299 -26.406 -8.046 1.00 0.00 H new ATOM 1209 N LYS A 182 -9.050 -24.245 -6.121 1.00 0.00 N ATOM 1210 CA LYS A 182 -8.200 -23.071 -5.960 1.00 0.00 C ATOM 1211 C LYS A 182 -8.929 -21.972 -5.194 1.00 0.00 C ATOM 1212 O LYS A 182 -10.050 -21.598 -5.540 1.00 0.00 O ATOM 1213 CB LYS A 182 -7.756 -22.546 -7.328 1.00 0.00 C ATOM 1214 CG LYS A 182 -6.492 -21.706 -7.276 1.00 0.00 C ATOM 1215 CD LYS A 182 -5.245 -22.572 -7.327 1.00 0.00 C ATOM 1216 CE LYS A 182 -4.087 -21.844 -7.993 1.00 0.00 C ATOM 1217 NZ LYS A 182 -4.165 -21.921 -9.478 1.00 0.00 N ATOM 0 H LYS A 182 -9.603 -24.250 -6.978 1.00 0.00 H new ATOM 0 HA LYS A 182 -7.320 -23.366 -5.388 1.00 0.00 H new ATOM 0 HB2 LYS A 182 -7.593 -23.391 -7.997 1.00 0.00 H new ATOM 0 HB3 LYS A 182 -8.561 -21.950 -7.758 1.00 0.00 H new ATOM 0 HG2 LYS A 182 -6.484 -21.006 -8.112 1.00 0.00 H new ATOM 0 HG3 LYS A 182 -6.486 -21.112 -6.362 1.00 0.00 H new ATOM 0 HD2 LYS A 182 -4.960 -22.862 -6.315 1.00 0.00 H new ATOM 0 HD3 LYS A 182 -5.461 -23.491 -7.873 1.00 0.00 H new ATOM 0 HE2 LYS A 182 -4.088 -20.799 -7.683 1.00 0.00 H new ATOM 0 HE3 LYS A 182 -3.145 -22.275 -7.656 1.00 0.00 H new ATOM 0 HZ1 LYS A 182 -3.359 -21.413 -9.895 1.00 0.00 H new ATOM 0 HZ2 LYS A 182 -4.138 -22.917 -9.776 1.00 0.00 H new ATOM 0 HZ3 LYS A 182 -5.053 -21.486 -9.802 1.00 0.00 H new ATOM 1231 N VAL A 183 -8.285 -21.456 -4.152 1.00 0.00 N ATOM 1232 CA VAL A 183 -8.871 -20.398 -3.338 1.00 0.00 C ATOM 1233 C VAL A 183 -8.104 -19.091 -3.502 1.00 0.00 C ATOM 1234 O VAL A 183 -6.903 -19.027 -3.238 1.00 0.00 O ATOM 1235 CB VAL A 183 -8.894 -20.784 -1.847 1.00 0.00 C ATOM 1236 CG1 VAL A 183 -9.855 -19.890 -1.079 1.00 0.00 C ATOM 1237 CG2 VAL A 183 -9.268 -22.249 -1.682 1.00 0.00 C ATOM 0 H VAL A 183 -7.357 -21.754 -3.852 1.00 0.00 H new ATOM 0 HA VAL A 183 -9.895 -20.261 -3.685 1.00 0.00 H new ATOM 0 HB VAL A 183 -7.895 -20.640 -1.436 1.00 0.00 H new ATOM 0 HG11 VAL A 183 -9.858 -20.177 -0.028 1.00 0.00 H new ATOM 0 HG12 VAL A 183 -9.537 -18.851 -1.170 1.00 0.00 H new ATOM 0 HG13 VAL A 183 -10.859 -20.000 -1.488 1.00 0.00 H new ATOM 0 HG21 VAL A 183 -9.279 -22.504 -0.622 1.00 0.00 H new ATOM 0 HG22 VAL A 183 -10.256 -22.422 -2.108 1.00 0.00 H new ATOM 0 HG23 VAL A 183 -8.537 -22.872 -2.197 1.00 0.00 H new ATOM 1247 N GLU A 184 -8.806 -18.049 -3.938 1.00 0.00 N ATOM 1248 CA GLU A 184 -8.190 -16.743 -4.137 1.00 0.00 C ATOM 1249 C GLU A 184 -8.081 -15.986 -2.816 1.00 0.00 C ATOM 1250 O GLU A 184 -8.949 -16.099 -1.950 1.00 0.00 O ATOM 1251 CB GLU A 184 -8.998 -15.921 -5.143 1.00 0.00 C ATOM 1252 CG GLU A 184 -8.166 -14.904 -5.906 1.00 0.00 C ATOM 1253 CD GLU A 184 -8.985 -14.111 -6.905 1.00 0.00 C ATOM 1254 OE1 GLU A 184 -9.518 -14.724 -7.854 1.00 0.00 O ATOM 1255 OE2 GLU A 184 -9.094 -12.878 -6.739 1.00 0.00 O ATOM 0 H GLU A 184 -9.801 -18.085 -4.160 1.00 0.00 H new ATOM 0 HA GLU A 184 -7.186 -16.900 -4.530 1.00 0.00 H new ATOM 0 HB2 GLU A 184 -9.472 -16.597 -5.854 1.00 0.00 H new ATOM 0 HB3 GLU A 184 -9.798 -15.401 -4.616 1.00 0.00 H new ATOM 0 HG2 GLU A 184 -7.699 -14.218 -5.199 1.00 0.00 H new ATOM 0 HG3 GLU A 184 -7.360 -15.419 -6.430 1.00 0.00 H new ATOM 1262 N VAL A 185 -7.009 -15.215 -2.669 1.00 0.00 N ATOM 1263 CA VAL A 185 -6.785 -14.438 -1.455 1.00 0.00 C ATOM 1264 C VAL A 185 -6.174 -13.079 -1.777 1.00 0.00 C ATOM 1265 O VAL A 185 -5.151 -12.991 -2.457 1.00 0.00 O ATOM 1266 CB VAL A 185 -5.863 -15.185 -0.473 1.00 0.00 C ATOM 1267 CG1 VAL A 185 -5.391 -14.251 0.631 1.00 0.00 C ATOM 1268 CG2 VAL A 185 -6.576 -16.395 0.110 1.00 0.00 C ATOM 0 H VAL A 185 -6.281 -15.111 -3.376 1.00 0.00 H new ATOM 0 HA VAL A 185 -7.759 -14.293 -0.988 1.00 0.00 H new ATOM 0 HB VAL A 185 -4.987 -15.536 -1.019 1.00 0.00 H new ATOM 0 HG11 VAL A 185 -4.741 -14.796 1.315 1.00 0.00 H new ATOM 0 HG12 VAL A 185 -4.840 -13.419 0.193 1.00 0.00 H new ATOM 0 HG13 VAL A 185 -6.253 -13.868 1.177 1.00 0.00 H new ATOM 0 HG21 VAL A 185 -5.910 -16.911 0.802 1.00 0.00 H new ATOM 0 HG22 VAL A 185 -7.470 -16.069 0.642 1.00 0.00 H new ATOM 0 HG23 VAL A 185 -6.860 -17.073 -0.695 1.00 0.00 H new ATOM 1278 N LYS A 186 -6.805 -12.020 -1.282 1.00 0.00 N ATOM 1279 CA LYS A 186 -6.323 -10.664 -1.514 1.00 0.00 C ATOM 1280 C LYS A 186 -6.421 -9.827 -0.242 1.00 0.00 C ATOM 1281 O LYS A 186 -7.362 -9.975 0.538 1.00 0.00 O ATOM 1282 CB LYS A 186 -7.124 -10.001 -2.637 1.00 0.00 C ATOM 1283 CG LYS A 186 -6.917 -10.648 -3.995 1.00 0.00 C ATOM 1284 CD LYS A 186 -5.659 -10.130 -4.673 1.00 0.00 C ATOM 1285 CE LYS A 186 -5.932 -8.852 -5.452 1.00 0.00 C ATOM 1286 NZ LYS A 186 -4.680 -8.256 -5.994 1.00 0.00 N ATOM 0 H LYS A 186 -7.652 -12.075 -0.717 1.00 0.00 H new ATOM 0 HA LYS A 186 -5.275 -10.723 -1.809 1.00 0.00 H new ATOM 0 HB2 LYS A 186 -8.184 -10.036 -2.385 1.00 0.00 H new ATOM 0 HB3 LYS A 186 -6.845 -8.949 -2.699 1.00 0.00 H new ATOM 0 HG2 LYS A 186 -6.849 -11.730 -3.877 1.00 0.00 H new ATOM 0 HG3 LYS A 186 -7.781 -10.450 -4.629 1.00 0.00 H new ATOM 0 HD2 LYS A 186 -4.891 -9.943 -3.923 1.00 0.00 H new ATOM 0 HD3 LYS A 186 -5.268 -10.892 -5.347 1.00 0.00 H new ATOM 0 HE2 LYS A 186 -6.617 -9.066 -6.272 1.00 0.00 H new ATOM 0 HE3 LYS A 186 -6.427 -8.130 -4.803 1.00 0.00 H new ATOM 0 HZ1 LYS A 186 -4.908 -7.387 -6.518 1.00 0.00 H new ATOM 0 HZ2 LYS A 186 -4.036 -8.028 -5.210 1.00 0.00 H new ATOM 0 HZ3 LYS A 186 -4.220 -8.936 -6.633 1.00 0.00 H new ATOM 1300 N ARG A 187 -5.446 -8.947 -0.042 1.00 0.00 N ATOM 1301 CA ARG A 187 -5.423 -8.086 1.135 1.00 0.00 C ATOM 1302 C ARG A 187 -6.705 -7.265 1.232 1.00 0.00 C ATOM 1303 O ARG A 187 -7.012 -6.467 0.348 1.00 0.00 O ATOM 1304 CB ARG A 187 -4.210 -7.155 1.088 1.00 0.00 C ATOM 1305 CG ARG A 187 -3.688 -6.765 2.461 1.00 0.00 C ATOM 1306 CD ARG A 187 -2.880 -5.479 2.406 1.00 0.00 C ATOM 1307 NE ARG A 187 -3.720 -4.316 2.132 1.00 0.00 N ATOM 1308 CZ ARG A 187 -3.251 -3.077 2.035 1.00 0.00 C ATOM 1309 NH1 ARG A 187 -1.955 -2.841 2.187 1.00 0.00 N ATOM 1310 NH2 ARG A 187 -4.078 -2.070 1.784 1.00 0.00 N ATOM 0 H ARG A 187 -4.661 -8.811 -0.679 1.00 0.00 H new ATOM 0 HA ARG A 187 -5.351 -8.721 2.018 1.00 0.00 H new ATOM 0 HB2 ARG A 187 -3.410 -7.642 0.529 1.00 0.00 H new ATOM 0 HB3 ARG A 187 -4.477 -6.251 0.540 1.00 0.00 H new ATOM 0 HG2 ARG A 187 -4.525 -6.641 3.148 1.00 0.00 H new ATOM 0 HG3 ARG A 187 -3.068 -7.569 2.857 1.00 0.00 H new ATOM 0 HD2 ARG A 187 -2.361 -5.336 3.354 1.00 0.00 H new ATOM 0 HD3 ARG A 187 -2.115 -5.564 1.634 1.00 0.00 H new ATOM 0 HE ARG A 187 -4.722 -4.463 2.008 1.00 0.00 H new ATOM 0 HH11 ARG A 187 -1.315 -3.612 2.379 1.00 0.00 H new ATOM 0 HH12 ARG A 187 -1.598 -1.889 2.112 1.00 0.00 H new ATOM 0 HH21 ARG A 187 -5.076 -2.247 1.665 1.00 0.00 H new ATOM 0 HH22 ARG A 187 -3.716 -1.119 1.710 1.00 0.00 H new ATOM 1324 N ALA A 188 -7.451 -7.468 2.314 1.00 0.00 N ATOM 1325 CA ALA A 188 -8.698 -6.746 2.528 1.00 0.00 C ATOM 1326 C ALA A 188 -8.434 -5.321 3.004 1.00 0.00 C ATOM 1327 O ALA A 188 -7.305 -4.972 3.346 1.00 0.00 O ATOM 1328 CB ALA A 188 -9.571 -7.486 3.531 1.00 0.00 C ATOM 0 H ALA A 188 -7.212 -8.127 3.055 1.00 0.00 H new ATOM 0 HA ALA A 188 -9.224 -6.691 1.575 1.00 0.00 H new ATOM 0 HB1 ALA A 188 -10.499 -6.935 3.681 1.00 0.00 H new ATOM 0 HB2 ALA A 188 -9.798 -8.482 3.151 1.00 0.00 H new ATOM 0 HB3 ALA A 188 -9.042 -7.571 4.480 1.00 0.00 H new