USER MOD reduce.3.24.130724 H: found=0, std=0, add=574, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 575 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 184 MET CE :methyl -126:sc= -13! (180deg=-11.3!) USER MOD Set 1.2: A 195 MET CE :methyl -162:sc= -0.999 (180deg=-0.049) USER MOD Set 2.1: A 169 SER OG : rot -176:sc= 0.865 USER MOD Set 2.2: A 172 THR OG1 : rot 138:sc= 0.991 USER MOD Single : A 133 ASN : amide:sc= -6.36! K(o=-6.4!,f=-2.3) USER MOD Single : A 140 GLN : amide:sc= -4.52! C(o=-4.5!,f=-12!) USER MOD Single : A 141 THR OG1 : rot -28:sc= -1.08 USER MOD Single : A 143 SER OG : rot 77:sc= 1.13 USER MOD Single : A 148 GLN : amide:sc= -3.62! C(o=-3.6!,f=-4.1!) USER MOD Single : A 151 SER OG : rot -94:sc= 0.972 USER MOD Single : A 159 ASN : amide:sc= -2.76! C(o=-2.8!,f=-5.2!) USER MOD Single : A 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 SER OG : rot 180:sc= 0 USER MOD Single : A 164 TYR OH : rot 180:sc= 0 USER MOD Single : A 176 HIS : no HE2:sc= -13.7! C(o=-14!,f=-15!) USER MOD Single : A 179 ASN : amide:sc= -0.073 X(o=-0.073,f=-0.0099) USER MOD Single : A 181 MET CE :methyl -165:sc= -6.34! (180deg=-7.71!) USER MOD Single : A 183 LYS NZ :NH3+ 173:sc=-0.00753 (180deg=-0.0121) USER MOD Single : A 185 LYS NZ :NH3+ 147:sc=-0.00342 (180deg=-0.861) USER MOD Single : A 187 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 188 SER OG : rot 180:sc= -0.629 USER MOD Single : A 191 HIS : no HD1:sc= -5.19! C(o=-5.2!,f=-6.4!) USER MOD ----------------------------------------------------------------- ATOM 68 N ASP A 131 15.163 -5.583 2.175 1.00 0.00 N ATOM 69 CA ASP A 131 15.030 -6.918 1.601 1.00 0.00 C ATOM 70 C ASP A 131 13.623 -7.142 1.060 1.00 0.00 C ATOM 71 O ASP A 131 12.635 -6.883 1.748 1.00 0.00 O ATOM 72 CB ASP A 131 15.362 -7.981 2.651 1.00 0.00 C ATOM 73 CG ASP A 131 16.741 -8.580 2.451 1.00 0.00 C ATOM 74 OD1 ASP A 131 17.700 -7.807 2.247 1.00 0.00 O ATOM 75 OD2 ASP A 131 16.859 -9.822 2.498 1.00 0.00 O ATOM 0 HA ASP A 131 15.733 -7.002 0.773 1.00 0.00 H new ATOM 0 HB2 ASP A 131 15.302 -7.537 3.645 1.00 0.00 H new ATOM 0 HB3 ASP A 131 14.615 -8.774 2.610 1.00 0.00 H new ATOM 80 N ALA A 132 13.540 -7.627 -0.175 1.00 0.00 N ATOM 81 CA ALA A 132 12.256 -7.889 -0.819 1.00 0.00 C ATOM 82 C ALA A 132 11.304 -8.629 0.118 1.00 0.00 C ATOM 83 O ALA A 132 10.281 -8.087 0.536 1.00 0.00 O ATOM 84 CB ALA A 132 12.463 -8.685 -2.097 1.00 0.00 C ATOM 0 H ALA A 132 14.351 -7.848 -0.753 1.00 0.00 H new ATOM 0 HA ALA A 132 11.802 -6.929 -1.066 1.00 0.00 H new ATOM 0 HB1 ALA A 132 11.498 -8.874 -2.568 1.00 0.00 H new ATOM 0 HB2 ALA A 132 13.096 -8.118 -2.780 1.00 0.00 H new ATOM 0 HB3 ALA A 132 12.944 -9.634 -1.861 1.00 0.00 H new ATOM 90 N ASN A 133 11.646 -9.872 0.436 1.00 0.00 N ATOM 91 CA ASN A 133 10.834 -10.694 1.311 1.00 0.00 C ATOM 92 C ASN A 133 10.528 -9.976 2.612 1.00 0.00 C ATOM 93 O ASN A 133 9.517 -10.244 3.261 1.00 0.00 O ATOM 94 CB ASN A 133 11.544 -12.014 1.594 1.00 0.00 C ATOM 95 CG ASN A 133 10.812 -13.178 0.975 1.00 0.00 C ATOM 96 OD1 ASN A 133 11.416 -14.064 0.370 1.00 0.00 O ATOM 97 ND2 ASN A 133 9.498 -13.176 1.125 1.00 0.00 N ATOM 0 H ASN A 133 12.490 -10.332 0.094 1.00 0.00 H new ATOM 0 HA ASN A 133 9.889 -10.895 0.807 1.00 0.00 H new ATOM 0 HB2 ASN A 133 12.561 -11.973 1.203 1.00 0.00 H new ATOM 0 HB3 ASN A 133 11.622 -12.163 2.671 1.00 0.00 H new ATOM 0 HD21 ASN A 133 8.939 -13.932 0.730 1.00 0.00 H new ATOM 0 HD22 ASN A 133 9.044 -12.418 1.635 1.00 0.00 H new ATOM 104 N ASP A 134 11.405 -9.062 2.987 1.00 0.00 N ATOM 105 CA ASP A 134 11.225 -8.304 4.212 1.00 0.00 C ATOM 106 C ASP A 134 10.038 -7.360 4.084 1.00 0.00 C ATOM 107 O ASP A 134 9.315 -7.124 5.052 1.00 0.00 O ATOM 108 CB ASP A 134 12.494 -7.519 4.552 1.00 0.00 C ATOM 109 CG ASP A 134 12.553 -7.122 6.014 1.00 0.00 C ATOM 110 OD1 ASP A 134 12.806 -8.005 6.859 1.00 0.00 O ATOM 111 OD2 ASP A 134 12.349 -5.926 6.313 1.00 0.00 O ATOM 0 H ASP A 134 12.247 -8.827 2.462 1.00 0.00 H new ATOM 0 HA ASP A 134 11.026 -9.005 5.022 1.00 0.00 H new ATOM 0 HB2 ASP A 134 13.368 -8.122 4.306 1.00 0.00 H new ATOM 0 HB3 ASP A 134 12.541 -6.623 3.933 1.00 0.00 H new ATOM 116 N ILE A 135 9.832 -6.829 2.883 1.00 0.00 N ATOM 117 CA ILE A 135 8.720 -5.924 2.640 1.00 0.00 C ATOM 118 C ILE A 135 7.399 -6.679 2.707 1.00 0.00 C ATOM 119 O ILE A 135 6.499 -6.289 3.443 1.00 0.00 O ATOM 120 CB ILE A 135 8.837 -5.212 1.279 1.00 0.00 C ATOM 121 CG1 ILE A 135 10.098 -4.350 1.248 1.00 0.00 C ATOM 122 CG2 ILE A 135 7.605 -4.358 1.004 1.00 0.00 C ATOM 123 CD1 ILE A 135 11.232 -4.986 0.487 1.00 0.00 C ATOM 0 H ILE A 135 10.418 -7.010 2.068 1.00 0.00 H new ATOM 0 HA ILE A 135 8.751 -5.163 3.420 1.00 0.00 H new ATOM 0 HB ILE A 135 8.904 -5.970 0.498 1.00 0.00 H new ATOM 0 HG12 ILE A 135 9.861 -3.387 0.796 1.00 0.00 H new ATOM 0 HG13 ILE A 135 10.421 -4.152 2.270 1.00 0.00 H new ATOM 0 HG21 ILE A 135 7.712 -3.866 0.037 1.00 0.00 H new ATOM 0 HG22 ILE A 135 6.718 -4.992 0.992 1.00 0.00 H new ATOM 0 HG23 ILE A 135 7.503 -3.605 1.785 1.00 0.00 H new ATOM 0 HD11 ILE A 135 12.097 -4.323 0.503 1.00 0.00 H new ATOM 0 HD12 ILE A 135 11.494 -5.936 0.952 1.00 0.00 H new ATOM 0 HD13 ILE A 135 10.926 -5.159 -0.545 1.00 0.00 H new ATOM 135 N ARG A 136 7.289 -7.766 1.942 1.00 0.00 N ATOM 136 CA ARG A 136 6.057 -8.565 1.946 1.00 0.00 C ATOM 137 C ARG A 136 5.671 -8.911 3.377 1.00 0.00 C ATOM 138 O ARG A 136 4.564 -8.617 3.829 1.00 0.00 O ATOM 139 CB ARG A 136 6.179 -9.859 1.121 1.00 0.00 C ATOM 140 CG ARG A 136 7.580 -10.193 0.642 1.00 0.00 C ATOM 141 CD ARG A 136 7.599 -11.487 -0.155 1.00 0.00 C ATOM 142 NE ARG A 136 7.001 -12.595 0.584 1.00 0.00 N ATOM 143 CZ ARG A 136 6.637 -13.743 0.022 1.00 0.00 C ATOM 144 NH1 ARG A 136 6.810 -13.931 -1.280 1.00 0.00 N ATOM 145 NH2 ARG A 136 6.101 -14.705 0.761 1.00 0.00 N ATOM 0 H ARG A 136 8.022 -8.111 1.322 1.00 0.00 H new ATOM 0 HA ARG A 136 5.284 -7.955 1.479 1.00 0.00 H new ATOM 0 HB2 ARG A 136 5.811 -10.690 1.723 1.00 0.00 H new ATOM 0 HB3 ARG A 136 5.525 -9.780 0.253 1.00 0.00 H new ATOM 0 HG2 ARG A 136 7.959 -9.378 0.025 1.00 0.00 H new ATOM 0 HG3 ARG A 136 8.248 -10.282 1.499 1.00 0.00 H new ATOM 0 HD2 ARG A 136 7.060 -11.344 -1.092 1.00 0.00 H new ATOM 0 HD3 ARG A 136 8.628 -11.738 -0.414 1.00 0.00 H new ATOM 0 HE ARG A 136 6.854 -12.482 1.587 1.00 0.00 H new ATOM 0 HH11 ARG A 136 7.223 -13.194 -1.851 1.00 0.00 H new ATOM 0 HH12 ARG A 136 6.530 -14.813 -1.710 1.00 0.00 H new ATOM 0 HH21 ARG A 136 5.968 -14.564 1.762 1.00 0.00 H new ATOM 0 HH22 ARG A 136 5.822 -15.585 0.328 1.00 0.00 H new ATOM 159 N ALA A 137 6.604 -9.517 4.100 1.00 0.00 N ATOM 160 CA ALA A 137 6.361 -9.871 5.486 1.00 0.00 C ATOM 161 C ALA A 137 5.886 -8.645 6.257 1.00 0.00 C ATOM 162 O ALA A 137 5.172 -8.758 7.252 1.00 0.00 O ATOM 163 CB ALA A 137 7.615 -10.448 6.113 1.00 0.00 C ATOM 0 H ALA A 137 7.528 -9.771 3.750 1.00 0.00 H new ATOM 0 HA ALA A 137 5.582 -10.632 5.527 1.00 0.00 H new ATOM 0 HB1 ALA A 137 7.415 -10.708 7.153 1.00 0.00 H new ATOM 0 HB2 ALA A 137 7.917 -11.342 5.567 1.00 0.00 H new ATOM 0 HB3 ALA A 137 8.416 -9.710 6.071 1.00 0.00 H new ATOM 169 N ARG A 138 6.275 -7.467 5.767 1.00 0.00 N ATOM 170 CA ARG A 138 5.876 -6.212 6.383 1.00 0.00 C ATOM 171 C ARG A 138 4.518 -5.783 5.843 1.00 0.00 C ATOM 172 O ARG A 138 3.692 -5.230 6.570 1.00 0.00 O ATOM 173 CB ARG A 138 6.918 -5.126 6.113 1.00 0.00 C ATOM 174 CG ARG A 138 7.254 -4.286 7.334 1.00 0.00 C ATOM 175 CD ARG A 138 7.932 -2.982 6.944 1.00 0.00 C ATOM 176 NE ARG A 138 8.461 -2.272 8.104 1.00 0.00 N ATOM 177 CZ ARG A 138 9.621 -2.564 8.680 1.00 0.00 C ATOM 178 NH1 ARG A 138 10.369 -3.552 8.206 1.00 0.00 N ATOM 179 NH2 ARG A 138 10.036 -1.870 9.732 1.00 0.00 N ATOM 0 H ARG A 138 6.867 -7.361 4.943 1.00 0.00 H new ATOM 0 HA ARG A 138 5.803 -6.357 7.461 1.00 0.00 H new ATOM 0 HB2 ARG A 138 7.830 -5.594 5.742 1.00 0.00 H new ATOM 0 HB3 ARG A 138 6.551 -4.472 5.322 1.00 0.00 H new ATOM 0 HG2 ARG A 138 6.342 -4.071 7.891 1.00 0.00 H new ATOM 0 HG3 ARG A 138 7.907 -4.852 7.998 1.00 0.00 H new ATOM 0 HD2 ARG A 138 8.743 -3.190 6.246 1.00 0.00 H new ATOM 0 HD3 ARG A 138 7.218 -2.344 6.423 1.00 0.00 H new ATOM 0 HE ARG A 138 7.909 -1.509 8.494 1.00 0.00 H new ATOM 0 HH11 ARG A 138 10.053 -4.088 7.398 1.00 0.00 H new ATOM 0 HH12 ARG A 138 11.260 -3.775 8.650 1.00 0.00 H new ATOM 0 HH21 ARG A 138 9.463 -1.110 10.100 1.00 0.00 H new ATOM 0 HH22 ARG A 138 10.928 -2.096 10.173 1.00 0.00 H new ATOM 193 N LEU A 139 4.291 -6.062 4.557 1.00 0.00 N ATOM 194 CA LEU A 139 3.030 -5.729 3.897 1.00 0.00 C ATOM 195 C LEU A 139 1.846 -6.100 4.781 1.00 0.00 C ATOM 196 O LEU A 139 0.782 -5.484 4.717 1.00 0.00 O ATOM 197 CB LEU A 139 2.930 -6.450 2.559 1.00 0.00 C ATOM 198 CG LEU A 139 3.039 -5.534 1.346 1.00 0.00 C ATOM 199 CD1 LEU A 139 4.280 -4.659 1.445 1.00 0.00 C ATOM 200 CD2 LEU A 139 3.065 -6.352 0.075 1.00 0.00 C ATOM 0 H LEU A 139 4.970 -6.521 3.950 1.00 0.00 H new ATOM 0 HA LEU A 139 3.007 -4.653 3.722 1.00 0.00 H new ATOM 0 HB2 LEU A 139 3.717 -7.202 2.504 1.00 0.00 H new ATOM 0 HB3 LEU A 139 1.979 -6.981 2.515 1.00 0.00 H new ATOM 0 HG LEU A 139 2.165 -4.883 1.323 1.00 0.00 H new ATOM 0 HD11 LEU A 139 4.340 -4.012 0.570 1.00 0.00 H new ATOM 0 HD12 LEU A 139 4.223 -4.047 2.345 1.00 0.00 H new ATOM 0 HD13 LEU A 139 5.167 -5.290 1.491 1.00 0.00 H new ATOM 0 HD21 LEU A 139 3.143 -5.686 -0.785 1.00 0.00 H new ATOM 0 HD22 LEU A 139 3.923 -7.024 0.092 1.00 0.00 H new ATOM 0 HD23 LEU A 139 2.148 -6.936 -0.001 1.00 0.00 H new ATOM 212 N GLN A 140 2.053 -7.119 5.603 1.00 0.00 N ATOM 213 CA GLN A 140 1.024 -7.601 6.512 1.00 0.00 C ATOM 214 C GLN A 140 1.184 -6.982 7.896 1.00 0.00 C ATOM 215 O GLN A 140 0.205 -6.581 8.525 1.00 0.00 O ATOM 216 CB GLN A 140 1.101 -9.122 6.598 1.00 0.00 C ATOM 217 CG GLN A 140 1.324 -9.770 5.246 1.00 0.00 C ATOM 218 CD GLN A 140 2.733 -10.302 5.081 1.00 0.00 C ATOM 219 OE1 GLN A 140 3.494 -10.381 6.045 1.00 0.00 O ATOM 220 NE2 GLN A 140 3.088 -10.670 3.855 1.00 0.00 N ATOM 0 H GLN A 140 2.933 -7.632 5.658 1.00 0.00 H new ATOM 0 HA GLN A 140 0.047 -7.307 6.128 1.00 0.00 H new ATOM 0 HB2 GLN A 140 1.911 -9.404 7.270 1.00 0.00 H new ATOM 0 HB3 GLN A 140 0.178 -9.505 7.033 1.00 0.00 H new ATOM 0 HG2 GLN A 140 0.614 -10.587 5.117 1.00 0.00 H new ATOM 0 HG3 GLN A 140 1.120 -9.043 4.460 1.00 0.00 H new ATOM 0 HE21 GLN A 140 2.424 -10.587 3.085 1.00 0.00 H new ATOM 0 HE22 GLN A 140 4.025 -11.036 3.683 1.00 0.00 H new ATOM 229 N THR A 141 2.426 -6.901 8.364 1.00 0.00 N ATOM 230 CA THR A 141 2.710 -6.322 9.671 1.00 0.00 C ATOM 231 C THR A 141 2.145 -4.909 9.765 1.00 0.00 C ATOM 232 O THR A 141 1.846 -4.419 10.854 1.00 0.00 O ATOM 233 CB THR A 141 4.217 -6.303 9.930 1.00 0.00 C ATOM 234 OG1 THR A 141 4.852 -5.331 9.120 1.00 0.00 O ATOM 235 CG2 THR A 141 4.886 -7.634 9.664 1.00 0.00 C ATOM 0 H THR A 141 3.249 -7.228 7.858 1.00 0.00 H new ATOM 0 HA THR A 141 2.231 -6.940 10.430 1.00 0.00 H new ATOM 0 HB THR A 141 4.326 -6.066 10.988 1.00 0.00 H new ATOM 0 HG1 THR A 141 4.335 -5.202 8.297 1.00 0.00 H new ATOM 0 HG21 THR A 141 5.954 -7.552 9.867 1.00 0.00 H new ATOM 0 HG22 THR A 141 4.451 -8.396 10.311 1.00 0.00 H new ATOM 0 HG23 THR A 141 4.736 -7.915 8.622 1.00 0.00 H new ATOM 243 N LEU A 142 1.998 -4.259 8.613 1.00 0.00 N ATOM 244 CA LEU A 142 1.465 -2.904 8.563 1.00 0.00 C ATOM 245 C LEU A 142 0.058 -2.855 9.139 1.00 0.00 C ATOM 246 O LEU A 142 -0.134 -2.541 10.313 1.00 0.00 O ATOM 247 CB LEU A 142 1.486 -2.378 7.126 1.00 0.00 C ATOM 248 CG LEU A 142 2.888 -2.098 6.574 1.00 0.00 C ATOM 249 CD1 LEU A 142 3.146 -2.917 5.323 1.00 0.00 C ATOM 250 CD2 LEU A 142 3.071 -0.619 6.283 1.00 0.00 C ATOM 0 H LEU A 142 2.241 -4.650 7.703 1.00 0.00 H new ATOM 0 HA LEU A 142 2.098 -2.261 9.174 1.00 0.00 H new ATOM 0 HB2 LEU A 142 0.993 -3.104 6.479 1.00 0.00 H new ATOM 0 HB3 LEU A 142 0.901 -1.460 7.080 1.00 0.00 H new ATOM 0 HG LEU A 142 3.612 -2.390 7.335 1.00 0.00 H new ATOM 0 HD11 LEU A 142 4.147 -2.703 4.948 1.00 0.00 H new ATOM 0 HD12 LEU A 142 3.067 -3.978 5.560 1.00 0.00 H new ATOM 0 HD13 LEU A 142 2.410 -2.659 4.561 1.00 0.00 H new ATOM 0 HD21 LEU A 142 4.074 -0.446 5.892 1.00 0.00 H new ATOM 0 HD22 LEU A 142 2.334 -0.299 5.546 1.00 0.00 H new ATOM 0 HD23 LEU A 142 2.936 -0.048 7.202 1.00 0.00 H new ATOM 262 N SER A 143 -0.919 -3.175 8.310 1.00 0.00 N ATOM 263 CA SER A 143 -2.317 -3.178 8.736 1.00 0.00 C ATOM 264 C SER A 143 -3.255 -3.380 7.551 1.00 0.00 C ATOM 265 O SER A 143 -2.850 -3.248 6.396 1.00 0.00 O ATOM 266 CB SER A 143 -2.662 -1.867 9.447 1.00 0.00 C ATOM 267 OG SER A 143 -2.433 -1.966 10.842 1.00 0.00 O ATOM 0 H SER A 143 -0.775 -3.437 7.335 1.00 0.00 H new ATOM 0 HA SER A 143 -2.450 -4.010 9.428 1.00 0.00 H new ATOM 0 HB2 SER A 143 -2.061 -1.057 9.034 1.00 0.00 H new ATOM 0 HB3 SER A 143 -3.707 -1.615 9.264 1.00 0.00 H new ATOM 0 HG SER A 143 -1.472 -1.893 11.022 1.00 0.00 H new ATOM 273 N GLU A 144 -4.514 -3.693 7.848 1.00 0.00 N ATOM 274 CA GLU A 144 -5.517 -3.904 6.808 1.00 0.00 C ATOM 275 C GLU A 144 -5.502 -2.758 5.807 1.00 0.00 C ATOM 276 O GLU A 144 -5.862 -2.931 4.645 1.00 0.00 O ATOM 277 CB GLU A 144 -6.909 -4.036 7.430 1.00 0.00 C ATOM 278 CG GLU A 144 -7.651 -5.290 6.999 1.00 0.00 C ATOM 279 CD GLU A 144 -8.030 -6.175 8.171 1.00 0.00 C ATOM 280 OE1 GLU A 144 -9.061 -5.895 8.818 1.00 0.00 O ATOM 281 OE2 GLU A 144 -7.295 -7.148 8.441 1.00 0.00 O ATOM 0 H GLU A 144 -4.863 -3.806 8.800 1.00 0.00 H new ATOM 0 HA GLU A 144 -5.275 -4.828 6.283 1.00 0.00 H new ATOM 0 HB2 GLU A 144 -6.814 -4.035 8.516 1.00 0.00 H new ATOM 0 HB3 GLU A 144 -7.502 -3.162 7.161 1.00 0.00 H new ATOM 0 HG2 GLU A 144 -8.553 -5.006 6.457 1.00 0.00 H new ATOM 0 HG3 GLU A 144 -7.028 -5.857 6.307 1.00 0.00 H new ATOM 288 N ARG A 145 -5.069 -1.590 6.267 1.00 0.00 N ATOM 289 CA ARG A 145 -4.991 -0.409 5.419 1.00 0.00 C ATOM 290 C ARG A 145 -3.929 -0.602 4.344 1.00 0.00 C ATOM 291 O ARG A 145 -4.107 -0.191 3.198 1.00 0.00 O ATOM 292 CB ARG A 145 -4.667 0.836 6.251 1.00 0.00 C ATOM 293 CG ARG A 145 -5.176 0.782 7.682 1.00 0.00 C ATOM 294 CD ARG A 145 -6.640 0.378 7.740 1.00 0.00 C ATOM 295 NE ARG A 145 -7.384 1.158 8.725 1.00 0.00 N ATOM 296 CZ ARG A 145 -8.598 0.834 9.158 1.00 0.00 C ATOM 297 NH1 ARG A 145 -9.202 -0.249 8.689 1.00 0.00 N ATOM 298 NH2 ARG A 145 -9.208 1.592 10.057 1.00 0.00 N ATOM 0 H ARG A 145 -4.765 -1.436 7.229 1.00 0.00 H new ATOM 0 HA ARG A 145 -5.961 -0.267 4.943 1.00 0.00 H new ATOM 0 HB2 ARG A 145 -3.586 0.977 6.267 1.00 0.00 H new ATOM 0 HB3 ARG A 145 -5.095 1.709 5.758 1.00 0.00 H new ATOM 0 HG2 ARG A 145 -4.579 0.072 8.255 1.00 0.00 H new ATOM 0 HG3 ARG A 145 -5.048 1.757 8.151 1.00 0.00 H new ATOM 0 HD2 ARG A 145 -7.092 0.510 6.757 1.00 0.00 H new ATOM 0 HD3 ARG A 145 -6.714 -0.681 7.985 1.00 0.00 H new ATOM 0 HE ARG A 145 -6.947 1.999 9.102 1.00 0.00 H new ATOM 0 HH11 ARG A 145 -8.735 -0.834 7.996 1.00 0.00 H new ATOM 0 HH12 ARG A 145 -10.134 -0.498 9.021 1.00 0.00 H new ATOM 0 HH21 ARG A 145 -8.746 2.426 10.418 1.00 0.00 H new ATOM 0 HH22 ARG A 145 -10.140 1.341 10.388 1.00 0.00 H new ATOM 312 N GLU A 146 -2.825 -1.236 4.726 1.00 0.00 N ATOM 313 CA GLU A 146 -1.732 -1.490 3.797 1.00 0.00 C ATOM 314 C GLU A 146 -2.120 -2.552 2.788 1.00 0.00 C ATOM 315 O GLU A 146 -2.131 -2.306 1.585 1.00 0.00 O ATOM 316 CB GLU A 146 -0.470 -1.916 4.552 1.00 0.00 C ATOM 317 CG GLU A 146 0.805 -1.602 3.794 1.00 0.00 C ATOM 318 CD GLU A 146 1.328 -2.797 3.024 1.00 0.00 C ATOM 319 OE1 GLU A 146 0.617 -3.823 2.965 1.00 0.00 O ATOM 320 OE2 GLU A 146 2.445 -2.707 2.474 1.00 0.00 O ATOM 0 H GLU A 146 -2.665 -1.583 5.672 1.00 0.00 H new ATOM 0 HA GLU A 146 -1.522 -0.564 3.262 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -0.445 -1.414 5.519 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -0.515 -2.987 4.750 1.00 0.00 H new ATOM 0 HG2 GLU A 146 0.620 -0.780 3.102 1.00 0.00 H new ATOM 0 HG3 GLU A 146 1.567 -1.263 4.495 1.00 0.00 H new ATOM 327 N ARG A 147 -2.452 -3.729 3.283 1.00 0.00 N ATOM 328 CA ARG A 147 -2.851 -4.824 2.419 1.00 0.00 C ATOM 329 C ARG A 147 -4.002 -4.389 1.526 1.00 0.00 C ATOM 330 O ARG A 147 -4.189 -4.921 0.433 1.00 0.00 O ATOM 331 CB ARG A 147 -3.262 -6.040 3.252 1.00 0.00 C ATOM 332 CG ARG A 147 -2.283 -6.374 4.366 1.00 0.00 C ATOM 333 CD ARG A 147 -2.480 -7.794 4.871 1.00 0.00 C ATOM 334 NE ARG A 147 -3.885 -8.093 5.134 1.00 0.00 N ATOM 335 CZ ARG A 147 -4.550 -7.631 6.188 1.00 0.00 C ATOM 336 NH1 ARG A 147 -3.941 -6.852 7.070 1.00 0.00 N ATOM 337 NH2 ARG A 147 -5.827 -7.947 6.357 1.00 0.00 N ATOM 0 H ARG A 147 -2.453 -3.952 4.278 1.00 0.00 H new ATOM 0 HA ARG A 147 -2.002 -5.102 1.794 1.00 0.00 H new ATOM 0 HB2 ARG A 147 -4.245 -5.857 3.686 1.00 0.00 H new ATOM 0 HB3 ARG A 147 -3.360 -6.904 2.595 1.00 0.00 H new ATOM 0 HG2 ARG A 147 -1.262 -6.254 4.003 1.00 0.00 H new ATOM 0 HG3 ARG A 147 -2.414 -5.672 5.190 1.00 0.00 H new ATOM 0 HD2 ARG A 147 -2.092 -8.497 4.134 1.00 0.00 H new ATOM 0 HD3 ARG A 147 -1.902 -7.937 5.784 1.00 0.00 H new ATOM 0 HE ARG A 147 -4.383 -8.689 4.473 1.00 0.00 H new ATOM 0 HH11 ARG A 147 -2.960 -6.606 6.941 1.00 0.00 H new ATOM 0 HH12 ARG A 147 -4.454 -6.499 7.878 1.00 0.00 H new ATOM 0 HH21 ARG A 147 -6.299 -8.545 5.678 1.00 0.00 H new ATOM 0 HH22 ARG A 147 -6.337 -7.592 7.166 1.00 0.00 H new ATOM 351 N GLN A 148 -4.774 -3.414 2.001 1.00 0.00 N ATOM 352 CA GLN A 148 -5.908 -2.914 1.248 1.00 0.00 C ATOM 353 C GLN A 148 -5.478 -1.905 0.188 1.00 0.00 C ATOM 354 O GLN A 148 -5.489 -2.201 -1.006 1.00 0.00 O ATOM 355 CB GLN A 148 -6.918 -2.266 2.189 1.00 0.00 C ATOM 356 CG GLN A 148 -7.837 -3.259 2.880 1.00 0.00 C ATOM 357 CD GLN A 148 -8.667 -2.620 3.977 1.00 0.00 C ATOM 358 OE1 GLN A 148 -8.954 -3.247 4.997 1.00 0.00 O ATOM 359 NE2 GLN A 148 -9.058 -1.367 3.773 1.00 0.00 N ATOM 0 H GLN A 148 -4.630 -2.959 2.903 1.00 0.00 H new ATOM 0 HA GLN A 148 -6.368 -3.763 0.743 1.00 0.00 H new ATOM 0 HB2 GLN A 148 -6.381 -1.695 2.946 1.00 0.00 H new ATOM 0 HB3 GLN A 148 -7.523 -1.557 1.625 1.00 0.00 H new ATOM 0 HG2 GLN A 148 -8.501 -3.708 2.142 1.00 0.00 H new ATOM 0 HG3 GLN A 148 -7.240 -4.066 3.305 1.00 0.00 H new ATOM 0 HE21 GLN A 148 -8.797 -0.885 2.913 1.00 0.00 H new ATOM 0 HE22 GLN A 148 -9.619 -0.887 4.477 1.00 0.00 H new ATOM 368 N VAL A 149 -5.117 -0.706 0.635 1.00 0.00 N ATOM 369 CA VAL A 149 -4.702 0.355 -0.274 1.00 0.00 C ATOM 370 C VAL A 149 -3.563 -0.092 -1.183 1.00 0.00 C ATOM 371 O VAL A 149 -3.439 0.388 -2.309 1.00 0.00 O ATOM 372 CB VAL A 149 -4.281 1.624 0.487 1.00 0.00 C ATOM 373 CG1 VAL A 149 -3.011 1.371 1.268 1.00 0.00 C ATOM 374 CG2 VAL A 149 -4.105 2.790 -0.474 1.00 0.00 C ATOM 0 H VAL A 149 -5.104 -0.446 1.621 1.00 0.00 H new ATOM 0 HA VAL A 149 -5.571 0.587 -0.890 1.00 0.00 H new ATOM 0 HB VAL A 149 -5.070 1.885 1.193 1.00 0.00 H new ATOM 0 HG11 VAL A 149 -2.725 2.278 1.801 1.00 0.00 H new ATOM 0 HG12 VAL A 149 -3.178 0.566 1.984 1.00 0.00 H new ATOM 0 HG13 VAL A 149 -2.213 1.086 0.582 1.00 0.00 H new ATOM 0 HG21 VAL A 149 -3.807 3.679 0.083 1.00 0.00 H new ATOM 0 HG22 VAL A 149 -3.335 2.545 -1.206 1.00 0.00 H new ATOM 0 HG23 VAL A 149 -5.046 2.983 -0.988 1.00 0.00 H new ATOM 384 N LEU A 150 -2.732 -1.007 -0.695 1.00 0.00 N ATOM 385 CA LEU A 150 -1.611 -1.501 -1.483 1.00 0.00 C ATOM 386 C LEU A 150 -2.102 -2.311 -2.677 1.00 0.00 C ATOM 387 O LEU A 150 -1.845 -1.946 -3.823 1.00 0.00 O ATOM 388 CB LEU A 150 -0.665 -2.343 -0.624 1.00 0.00 C ATOM 389 CG LEU A 150 0.679 -2.702 -1.271 1.00 0.00 C ATOM 390 CD1 LEU A 150 1.194 -1.564 -2.143 1.00 0.00 C ATOM 391 CD2 LEU A 150 1.697 -3.052 -0.203 1.00 0.00 C ATOM 0 H LEU A 150 -2.813 -1.418 0.235 1.00 0.00 H new ATOM 0 HA LEU A 150 -1.060 -0.637 -1.854 1.00 0.00 H new ATOM 0 HB2 LEU A 150 -0.469 -1.804 0.303 1.00 0.00 H new ATOM 0 HB3 LEU A 150 -1.175 -3.267 -0.353 1.00 0.00 H new ATOM 0 HG LEU A 150 0.525 -3.570 -1.912 1.00 0.00 H new ATOM 0 HD11 LEU A 150 2.148 -1.849 -2.587 1.00 0.00 H new ATOM 0 HD12 LEU A 150 0.473 -1.356 -2.934 1.00 0.00 H new ATOM 0 HD13 LEU A 150 1.330 -0.671 -1.533 1.00 0.00 H new ATOM 0 HD21 LEU A 150 2.647 -3.305 -0.674 1.00 0.00 H new ATOM 0 HD22 LEU A 150 1.837 -2.198 0.460 1.00 0.00 H new ATOM 0 HD23 LEU A 150 1.340 -3.905 0.374 1.00 0.00 H new ATOM 403 N SER A 151 -2.816 -3.404 -2.409 1.00 0.00 N ATOM 404 CA SER A 151 -3.339 -4.247 -3.483 1.00 0.00 C ATOM 405 C SER A 151 -4.171 -3.420 -4.458 1.00 0.00 C ATOM 406 O SER A 151 -4.330 -3.789 -5.621 1.00 0.00 O ATOM 407 CB SER A 151 -4.162 -5.406 -2.940 1.00 0.00 C ATOM 408 OG SER A 151 -4.975 -5.001 -1.853 1.00 0.00 O ATOM 0 H SER A 151 -3.044 -3.724 -1.468 1.00 0.00 H new ATOM 0 HA SER A 151 -2.484 -4.666 -4.014 1.00 0.00 H new ATOM 0 HB2 SER A 151 -4.789 -5.811 -3.734 1.00 0.00 H new ATOM 0 HB3 SER A 151 -3.496 -6.207 -2.619 1.00 0.00 H new ATOM 0 HG SER A 151 -4.508 -5.180 -1.010 1.00 0.00 H new ATOM 414 N ALA A 152 -4.660 -2.279 -3.994 1.00 0.00 N ATOM 415 CA ALA A 152 -5.417 -1.381 -4.846 1.00 0.00 C ATOM 416 C ALA A 152 -4.433 -0.490 -5.586 1.00 0.00 C ATOM 417 O ALA A 152 -4.620 -0.148 -6.754 1.00 0.00 O ATOM 418 CB ALA A 152 -6.378 -0.547 -4.021 1.00 0.00 C ATOM 0 H ALA A 152 -4.545 -1.956 -3.033 1.00 0.00 H new ATOM 0 HA ALA A 152 -6.010 -1.954 -5.559 1.00 0.00 H new ATOM 0 HB1 ALA A 152 -6.937 0.120 -4.677 1.00 0.00 H new ATOM 0 HB2 ALA A 152 -7.071 -1.204 -3.496 1.00 0.00 H new ATOM 0 HB3 ALA A 152 -5.818 0.043 -3.296 1.00 0.00 H new ATOM 424 N VAL A 153 -3.363 -0.145 -4.876 1.00 0.00 N ATOM 425 CA VAL A 153 -2.293 0.676 -5.400 1.00 0.00 C ATOM 426 C VAL A 153 -1.566 -0.065 -6.532 1.00 0.00 C ATOM 427 O VAL A 153 -1.395 0.465 -7.630 1.00 0.00 O ATOM 428 CB VAL A 153 -1.334 1.041 -4.228 1.00 0.00 C ATOM 429 CG1 VAL A 153 0.137 0.852 -4.565 1.00 0.00 C ATOM 430 CG2 VAL A 153 -1.604 2.455 -3.746 1.00 0.00 C ATOM 0 H VAL A 153 -3.219 -0.435 -3.909 1.00 0.00 H new ATOM 0 HA VAL A 153 -2.688 1.598 -5.827 1.00 0.00 H new ATOM 0 HB VAL A 153 -1.547 0.338 -3.423 1.00 0.00 H new ATOM 0 HG11 VAL A 153 0.746 1.125 -3.703 1.00 0.00 H new ATOM 0 HG12 VAL A 153 0.320 -0.191 -4.823 1.00 0.00 H new ATOM 0 HG13 VAL A 153 0.401 1.486 -5.411 1.00 0.00 H new ATOM 0 HG21 VAL A 153 -0.926 2.696 -2.927 1.00 0.00 H new ATOM 0 HG22 VAL A 153 -1.445 3.155 -4.566 1.00 0.00 H new ATOM 0 HG23 VAL A 153 -2.634 2.530 -3.398 1.00 0.00 H new ATOM 440 N VAL A 154 -1.150 -1.299 -6.245 1.00 0.00 N ATOM 441 CA VAL A 154 -0.451 -2.135 -7.213 1.00 0.00 C ATOM 442 C VAL A 154 -1.124 -2.086 -8.581 1.00 0.00 C ATOM 443 O VAL A 154 -0.454 -2.045 -9.613 1.00 0.00 O ATOM 444 CB VAL A 154 -0.404 -3.596 -6.726 1.00 0.00 C ATOM 445 CG1 VAL A 154 0.654 -3.770 -5.649 1.00 0.00 C ATOM 446 CG2 VAL A 154 -1.761 -4.026 -6.220 1.00 0.00 C ATOM 0 H VAL A 154 -1.289 -1.743 -5.337 1.00 0.00 H new ATOM 0 HA VAL A 154 0.562 -1.745 -7.308 1.00 0.00 H new ATOM 0 HB VAL A 154 -0.135 -4.232 -7.569 1.00 0.00 H new ATOM 0 HG11 VAL A 154 0.670 -4.809 -5.319 1.00 0.00 H new ATOM 0 HG12 VAL A 154 1.631 -3.502 -6.052 1.00 0.00 H new ATOM 0 HG13 VAL A 154 0.421 -3.124 -4.802 1.00 0.00 H new ATOM 0 HG21 VAL A 154 -1.711 -5.060 -5.880 1.00 0.00 H new ATOM 0 HG22 VAL A 154 -2.060 -3.385 -5.391 1.00 0.00 H new ATOM 0 HG23 VAL A 154 -2.492 -3.943 -7.024 1.00 0.00 H new ATOM 456 N ALA A 155 -2.451 -2.089 -8.579 1.00 0.00 N ATOM 457 CA ALA A 155 -3.218 -2.044 -9.817 1.00 0.00 C ATOM 458 C ALA A 155 -2.996 -0.728 -10.554 1.00 0.00 C ATOM 459 O ALA A 155 -2.676 -0.717 -11.743 1.00 0.00 O ATOM 460 CB ALA A 155 -4.696 -2.248 -9.525 1.00 0.00 C ATOM 0 H ALA A 155 -3.019 -2.122 -7.732 1.00 0.00 H new ATOM 0 HA ALA A 155 -2.871 -2.851 -10.462 1.00 0.00 H new ATOM 0 HB1 ALA A 155 -5.259 -2.212 -10.457 1.00 0.00 H new ATOM 0 HB2 ALA A 155 -4.842 -3.218 -9.049 1.00 0.00 H new ATOM 0 HB3 ALA A 155 -5.047 -1.460 -8.859 1.00 0.00 H new ATOM 466 N GLY A 156 -3.166 0.380 -9.840 1.00 0.00 N ATOM 467 CA GLY A 156 -2.978 1.687 -10.443 1.00 0.00 C ATOM 468 C GLY A 156 -4.275 2.462 -10.568 1.00 0.00 C ATOM 469 O GLY A 156 -4.399 3.345 -11.417 1.00 0.00 O ATOM 0 H GLY A 156 -3.430 0.396 -8.855 1.00 0.00 H new ATOM 0 HA2 GLY A 156 -2.272 2.262 -9.844 1.00 0.00 H new ATOM 0 HA3 GLY A 156 -2.534 1.567 -11.431 1.00 0.00 H new ATOM 473 N LEU A 157 -5.244 2.132 -9.722 1.00 0.00 N ATOM 474 CA LEU A 157 -6.538 2.804 -9.742 1.00 0.00 C ATOM 475 C LEU A 157 -6.476 4.128 -8.983 1.00 0.00 C ATOM 476 O LEU A 157 -5.588 4.338 -8.156 1.00 0.00 O ATOM 477 CB LEU A 157 -7.614 1.903 -9.131 1.00 0.00 C ATOM 478 CG LEU A 157 -7.746 0.524 -9.780 1.00 0.00 C ATOM 479 CD1 LEU A 157 -8.003 -0.540 -8.722 1.00 0.00 C ATOM 480 CD2 LEU A 157 -8.859 0.528 -10.816 1.00 0.00 C ATOM 0 H LEU A 157 -5.158 1.403 -9.014 1.00 0.00 H new ATOM 0 HA LEU A 157 -6.795 3.012 -10.781 1.00 0.00 H new ATOM 0 HB2 LEU A 157 -7.397 1.770 -8.071 1.00 0.00 H new ATOM 0 HB3 LEU A 157 -8.575 2.413 -9.198 1.00 0.00 H new ATOM 0 HG LEU A 157 -6.809 0.288 -10.284 1.00 0.00 H new ATOM 0 HD11 LEU A 157 -8.094 -1.515 -9.201 1.00 0.00 H new ATOM 0 HD12 LEU A 157 -7.173 -0.559 -8.016 1.00 0.00 H new ATOM 0 HD13 LEU A 157 -8.926 -0.309 -8.190 1.00 0.00 H new ATOM 0 HD21 LEU A 157 -8.939 -0.461 -11.268 1.00 0.00 H new ATOM 0 HD22 LEU A 157 -9.803 0.785 -10.335 1.00 0.00 H new ATOM 0 HD23 LEU A 157 -8.634 1.263 -11.589 1.00 0.00 H new ATOM 492 N PRO A 158 -7.425 5.041 -9.254 1.00 0.00 N ATOM 493 CA PRO A 158 -7.473 6.348 -8.592 1.00 0.00 C ATOM 494 C PRO A 158 -7.513 6.223 -7.073 1.00 0.00 C ATOM 495 O PRO A 158 -7.332 5.137 -6.524 1.00 0.00 O ATOM 496 CB PRO A 158 -8.775 6.969 -9.104 1.00 0.00 C ATOM 497 CG PRO A 158 -9.073 6.258 -10.379 1.00 0.00 C ATOM 498 CD PRO A 158 -8.520 4.869 -10.226 1.00 0.00 C ATOM 0 HA PRO A 158 -6.587 6.944 -8.813 1.00 0.00 H new ATOM 0 HB2 PRO A 158 -9.583 6.840 -8.383 1.00 0.00 H new ATOM 0 HB3 PRO A 158 -8.662 8.041 -9.268 1.00 0.00 H new ATOM 0 HG2 PRO A 158 -10.146 6.231 -10.567 1.00 0.00 H new ATOM 0 HG3 PRO A 158 -8.614 6.768 -11.225 1.00 0.00 H new ATOM 0 HD2 PRO A 158 -9.276 4.174 -9.861 1.00 0.00 H new ATOM 0 HD3 PRO A 158 -8.156 4.475 -11.175 1.00 0.00 H new ATOM 506 N ASN A 159 -7.757 7.342 -6.400 1.00 0.00 N ATOM 507 CA ASN A 159 -7.829 7.359 -4.944 1.00 0.00 C ATOM 508 C ASN A 159 -9.224 6.966 -4.469 1.00 0.00 C ATOM 509 O ASN A 159 -9.397 6.469 -3.357 1.00 0.00 O ATOM 510 CB ASN A 159 -7.466 8.745 -4.410 1.00 0.00 C ATOM 511 CG ASN A 159 -7.299 8.759 -2.903 1.00 0.00 C ATOM 512 OD1 ASN A 159 -8.279 8.795 -2.159 1.00 0.00 O ATOM 513 ND2 ASN A 159 -6.053 8.731 -2.445 1.00 0.00 N ATOM 0 H ASN A 159 -7.908 8.250 -6.840 1.00 0.00 H new ATOM 0 HA ASN A 159 -7.113 6.633 -4.559 1.00 0.00 H new ATOM 0 HB2 ASN A 159 -6.541 9.081 -4.878 1.00 0.00 H new ATOM 0 HB3 ASN A 159 -8.243 9.455 -4.693 1.00 0.00 H new ATOM 0 HD21 ASN A 159 -5.879 8.739 -1.440 1.00 0.00 H new ATOM 0 HD22 ASN A 159 -5.270 8.701 -3.098 1.00 0.00 H new ATOM 520 N LYS A 160 -10.218 7.191 -5.324 1.00 0.00 N ATOM 521 CA LYS A 160 -11.600 6.861 -4.998 1.00 0.00 C ATOM 522 C LYS A 160 -11.869 5.377 -5.219 1.00 0.00 C ATOM 523 O LYS A 160 -12.325 4.677 -4.314 1.00 0.00 O ATOM 524 CB LYS A 160 -12.557 7.697 -5.849 1.00 0.00 C ATOM 525 CG LYS A 160 -13.591 8.458 -5.036 1.00 0.00 C ATOM 526 CD LYS A 160 -14.000 9.750 -5.726 1.00 0.00 C ATOM 527 CE LYS A 160 -13.296 10.953 -5.118 1.00 0.00 C ATOM 528 NZ LYS A 160 -14.107 11.588 -4.044 1.00 0.00 N ATOM 0 H LYS A 160 -10.091 7.601 -6.249 1.00 0.00 H new ATOM 0 HA LYS A 160 -11.766 7.089 -3.945 1.00 0.00 H new ATOM 0 HB2 LYS A 160 -11.978 8.407 -6.440 1.00 0.00 H new ATOM 0 HB3 LYS A 160 -13.071 7.042 -6.552 1.00 0.00 H new ATOM 0 HG2 LYS A 160 -14.470 7.831 -4.884 1.00 0.00 H new ATOM 0 HG3 LYS A 160 -13.186 8.683 -4.049 1.00 0.00 H new ATOM 0 HD2 LYS A 160 -13.764 9.687 -6.788 1.00 0.00 H new ATOM 0 HD3 LYS A 160 -15.079 9.880 -5.647 1.00 0.00 H new ATOM 0 HE2 LYS A 160 -12.334 10.643 -4.711 1.00 0.00 H new ATOM 0 HE3 LYS A 160 -13.090 11.686 -5.898 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 -13.592 12.404 -3.656 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 -15.015 11.908 -4.438 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 -14.282 10.897 -3.287 1.00 0.00 H new ATOM 542 N SER A 161 -11.577 4.898 -6.426 1.00 0.00 N ATOM 543 CA SER A 161 -11.784 3.493 -6.763 1.00 0.00 C ATOM 544 C SER A 161 -11.190 2.592 -5.685 1.00 0.00 C ATOM 545 O SER A 161 -11.861 1.703 -5.166 1.00 0.00 O ATOM 546 CB SER A 161 -11.149 3.174 -8.119 1.00 0.00 C ATOM 547 OG SER A 161 -12.016 3.527 -9.183 1.00 0.00 O ATOM 0 H SER A 161 -11.197 5.462 -7.186 1.00 0.00 H new ATOM 0 HA SER A 161 -12.857 3.308 -6.822 1.00 0.00 H new ATOM 0 HB2 SER A 161 -10.207 3.713 -8.219 1.00 0.00 H new ATOM 0 HB3 SER A 161 -10.915 2.111 -8.174 1.00 0.00 H new ATOM 0 HG SER A 161 -11.587 3.315 -10.038 1.00 0.00 H new ATOM 553 N ILE A 162 -9.931 2.844 -5.348 1.00 0.00 N ATOM 554 CA ILE A 162 -9.238 2.075 -4.323 1.00 0.00 C ATOM 555 C ILE A 162 -10.053 2.030 -3.038 1.00 0.00 C ATOM 556 O ILE A 162 -10.400 0.961 -2.539 1.00 0.00 O ATOM 557 CB ILE A 162 -7.858 2.697 -4.019 1.00 0.00 C ATOM 558 CG1 ILE A 162 -6.934 2.543 -5.225 1.00 0.00 C ATOM 559 CG2 ILE A 162 -7.225 2.078 -2.775 1.00 0.00 C ATOM 560 CD1 ILE A 162 -5.738 3.460 -5.179 1.00 0.00 C ATOM 0 H ILE A 162 -9.367 3.580 -5.773 1.00 0.00 H new ATOM 0 HA ILE A 162 -9.106 1.062 -4.702 1.00 0.00 H new ATOM 0 HB ILE A 162 -8.005 3.758 -3.818 1.00 0.00 H new ATOM 0 HG12 ILE A 162 -6.590 1.510 -5.281 1.00 0.00 H new ATOM 0 HG13 ILE A 162 -7.500 2.740 -6.135 1.00 0.00 H new ATOM 0 HG21 ILE A 162 -6.255 2.540 -2.592 1.00 0.00 H new ATOM 0 HG22 ILE A 162 -7.874 2.244 -1.915 1.00 0.00 H new ATOM 0 HG23 ILE A 162 -7.093 1.007 -2.928 1.00 0.00 H new ATOM 0 HD11 ILE A 162 -5.123 3.300 -6.064 1.00 0.00 H new ATOM 0 HD12 ILE A 162 -6.075 4.496 -5.153 1.00 0.00 H new ATOM 0 HD13 ILE A 162 -5.151 3.247 -4.286 1.00 0.00 H new ATOM 572 N ALA A 163 -10.338 3.209 -2.508 1.00 0.00 N ATOM 573 CA ALA A 163 -11.092 3.333 -1.279 1.00 0.00 C ATOM 574 C ALA A 163 -12.430 2.642 -1.398 1.00 0.00 C ATOM 575 O ALA A 163 -12.918 2.036 -0.445 1.00 0.00 O ATOM 576 CB ALA A 163 -11.291 4.798 -0.941 1.00 0.00 C ATOM 0 H ALA A 163 -10.054 4.099 -2.917 1.00 0.00 H new ATOM 0 HA ALA A 163 -10.529 2.853 -0.479 1.00 0.00 H new ATOM 0 HB1 ALA A 163 -11.859 4.884 -0.015 1.00 0.00 H new ATOM 0 HB2 ALA A 163 -10.320 5.278 -0.817 1.00 0.00 H new ATOM 0 HB3 ALA A 163 -11.837 5.287 -1.748 1.00 0.00 H new ATOM 582 N TYR A 164 -13.029 2.747 -2.571 1.00 0.00 N ATOM 583 CA TYR A 164 -14.325 2.145 -2.800 1.00 0.00 C ATOM 584 C TYR A 164 -14.220 0.678 -3.191 1.00 0.00 C ATOM 585 O TYR A 164 -15.225 -0.032 -3.224 1.00 0.00 O ATOM 586 CB TYR A 164 -15.093 2.918 -3.863 1.00 0.00 C ATOM 587 CG TYR A 164 -16.334 3.561 -3.312 1.00 0.00 C ATOM 588 CD1 TYR A 164 -16.243 4.661 -2.446 1.00 0.00 C ATOM 589 CD2 TYR A 164 -17.605 3.068 -3.639 1.00 0.00 C ATOM 590 CE1 TYR A 164 -17.387 5.257 -1.917 1.00 0.00 C ATOM 591 CE2 TYR A 164 -18.761 3.658 -3.114 1.00 0.00 C ATOM 592 CZ TYR A 164 -18.645 4.753 -2.253 1.00 0.00 C ATOM 593 OH TYR A 164 -19.778 5.337 -1.735 1.00 0.00 O ATOM 0 H TYR A 164 -12.639 3.241 -3.374 1.00 0.00 H new ATOM 0 HA TYR A 164 -14.869 2.193 -1.857 1.00 0.00 H new ATOM 0 HB2 TYR A 164 -14.447 3.685 -4.289 1.00 0.00 H new ATOM 0 HB3 TYR A 164 -15.365 2.243 -4.675 1.00 0.00 H new ATOM 0 HD1 TYR A 164 -15.271 5.052 -2.185 1.00 0.00 H new ATOM 0 HD2 TYR A 164 -17.694 2.222 -4.305 1.00 0.00 H new ATOM 0 HE1 TYR A 164 -17.301 6.103 -1.252 1.00 0.00 H new ATOM 0 HE2 TYR A 164 -19.735 3.270 -3.372 1.00 0.00 H new ATOM 0 HH TYR A 164 -20.570 4.867 -2.069 1.00 0.00 H new ATOM 603 N ASP A 165 -13.011 0.220 -3.483 1.00 0.00 N ATOM 604 CA ASP A 165 -12.813 -1.167 -3.864 1.00 0.00 C ATOM 605 C ASP A 165 -12.508 -2.031 -2.642 1.00 0.00 C ATOM 606 O ASP A 165 -12.657 -3.252 -2.685 1.00 0.00 O ATOM 607 CB ASP A 165 -11.681 -1.286 -4.885 1.00 0.00 C ATOM 608 CG ASP A 165 -12.185 -1.630 -6.273 1.00 0.00 C ATOM 609 OD1 ASP A 165 -12.941 -0.818 -6.847 1.00 0.00 O ATOM 610 OD2 ASP A 165 -11.824 -2.709 -6.785 1.00 0.00 O ATOM 0 H ASP A 165 -12.161 0.784 -3.463 1.00 0.00 H new ATOM 0 HA ASP A 165 -13.737 -1.525 -4.318 1.00 0.00 H new ATOM 0 HB2 ASP A 165 -11.131 -0.346 -4.924 1.00 0.00 H new ATOM 0 HB3 ASP A 165 -10.979 -2.052 -4.557 1.00 0.00 H new ATOM 615 N LEU A 166 -12.082 -1.393 -1.552 1.00 0.00 N ATOM 616 CA LEU A 166 -11.761 -2.118 -0.328 1.00 0.00 C ATOM 617 C LEU A 166 -12.757 -1.784 0.780 1.00 0.00 C ATOM 618 O LEU A 166 -12.393 -1.745 1.955 1.00 0.00 O ATOM 619 CB LEU A 166 -10.346 -1.764 0.153 1.00 0.00 C ATOM 620 CG LEU A 166 -9.348 -1.362 -0.937 1.00 0.00 C ATOM 621 CD1 LEU A 166 -8.489 -0.198 -0.465 1.00 0.00 C ATOM 622 CD2 LEU A 166 -8.475 -2.546 -1.320 1.00 0.00 C ATOM 0 H LEU A 166 -11.953 -0.383 -1.494 1.00 0.00 H new ATOM 0 HA LEU A 166 -11.816 -3.183 -0.553 1.00 0.00 H new ATOM 0 HB2 LEU A 166 -10.421 -0.946 0.869 1.00 0.00 H new ATOM 0 HB3 LEU A 166 -9.941 -2.622 0.690 1.00 0.00 H new ATOM 0 HG LEU A 166 -9.906 -1.046 -1.818 1.00 0.00 H new ATOM 0 HD11 LEU A 166 -7.785 0.076 -1.250 1.00 0.00 H new ATOM 0 HD12 LEU A 166 -9.127 0.655 -0.235 1.00 0.00 H new ATOM 0 HD13 LEU A 166 -7.939 -0.491 0.429 1.00 0.00 H new ATOM 0 HD21 LEU A 166 -7.771 -2.243 -2.096 1.00 0.00 H new ATOM 0 HD22 LEU A 166 -7.924 -2.890 -0.445 1.00 0.00 H new ATOM 0 HD23 LEU A 166 -9.103 -3.355 -1.695 1.00 0.00 H new ATOM 634 N ASP A 167 -14.013 -1.530 0.407 1.00 0.00 N ATOM 635 CA ASP A 167 -15.044 -1.184 1.389 1.00 0.00 C ATOM 636 C ASP A 167 -14.514 -0.083 2.289 1.00 0.00 C ATOM 637 O ASP A 167 -14.734 -0.072 3.500 1.00 0.00 O ATOM 638 CB ASP A 167 -15.422 -2.410 2.222 1.00 0.00 C ATOM 639 CG ASP A 167 -16.500 -2.104 3.244 1.00 0.00 C ATOM 640 OD1 ASP A 167 -17.216 -1.096 3.069 1.00 0.00 O ATOM 641 OD2 ASP A 167 -16.627 -2.873 4.221 1.00 0.00 O ATOM 0 H ASP A 167 -14.339 -1.557 -0.559 1.00 0.00 H new ATOM 0 HA ASP A 167 -15.938 -0.838 0.870 1.00 0.00 H new ATOM 0 HB2 ASP A 167 -15.768 -3.204 1.560 1.00 0.00 H new ATOM 0 HB3 ASP A 167 -14.536 -2.786 2.734 1.00 0.00 H new ATOM 646 N ILE A 168 -13.764 0.808 1.666 1.00 0.00 N ATOM 647 CA ILE A 168 -13.113 1.904 2.350 1.00 0.00 C ATOM 648 C ILE A 168 -13.636 3.259 1.861 1.00 0.00 C ATOM 649 O ILE A 168 -14.418 3.341 0.913 1.00 0.00 O ATOM 650 CB ILE A 168 -11.587 1.750 2.121 1.00 0.00 C ATOM 651 CG1 ILE A 168 -10.951 0.956 3.263 1.00 0.00 C ATOM 652 CG2 ILE A 168 -10.859 3.058 1.901 1.00 0.00 C ATOM 653 CD1 ILE A 168 -10.603 1.785 4.479 1.00 0.00 C ATOM 0 H ILE A 168 -13.590 0.788 0.661 1.00 0.00 H new ATOM 0 HA ILE A 168 -13.332 1.873 3.417 1.00 0.00 H new ATOM 0 HB ILE A 168 -11.479 1.196 1.188 1.00 0.00 H new ATOM 0 HG12 ILE A 168 -11.635 0.162 3.563 1.00 0.00 H new ATOM 0 HG13 ILE A 168 -10.045 0.474 2.895 1.00 0.00 H new ATOM 0 HG21 ILE A 168 -9.798 2.862 1.749 1.00 0.00 H new ATOM 0 HG22 ILE A 168 -11.266 3.557 1.022 1.00 0.00 H new ATOM 0 HG23 ILE A 168 -10.989 3.698 2.774 1.00 0.00 H new ATOM 0 HD11 ILE A 168 -10.157 1.145 5.240 1.00 0.00 H new ATOM 0 HD12 ILE A 168 -9.893 2.563 4.198 1.00 0.00 H new ATOM 0 HD13 ILE A 168 -11.507 2.246 4.876 1.00 0.00 H new ATOM 665 N SER A 169 -13.177 4.311 2.519 1.00 0.00 N ATOM 666 CA SER A 169 -13.551 5.668 2.178 1.00 0.00 C ATOM 667 C SER A 169 -12.410 6.362 1.434 1.00 0.00 C ATOM 668 O SER A 169 -11.240 6.162 1.755 1.00 0.00 O ATOM 669 CB SER A 169 -13.905 6.447 3.443 1.00 0.00 C ATOM 670 OG SER A 169 -13.412 5.793 4.599 1.00 0.00 O ATOM 0 H SER A 169 -12.533 4.244 3.307 1.00 0.00 H new ATOM 0 HA SER A 169 -14.424 5.637 1.526 1.00 0.00 H new ATOM 0 HB2 SER A 169 -13.487 7.452 3.384 1.00 0.00 H new ATOM 0 HB3 SER A 169 -14.987 6.555 3.516 1.00 0.00 H new ATOM 0 HG SER A 169 -13.705 6.278 5.399 1.00 0.00 H new ATOM 676 N PRO A 170 -12.726 7.187 0.426 1.00 0.00 N ATOM 677 CA PRO A 170 -11.705 7.896 -0.351 1.00 0.00 C ATOM 678 C PRO A 170 -10.873 8.831 0.509 1.00 0.00 C ATOM 679 O PRO A 170 -9.735 9.156 0.171 1.00 0.00 O ATOM 680 CB PRO A 170 -12.511 8.669 -1.400 1.00 0.00 C ATOM 681 CG PRO A 170 -13.896 8.740 -0.850 1.00 0.00 C ATOM 682 CD PRO A 170 -14.088 7.491 -0.037 1.00 0.00 C ATOM 0 HA PRO A 170 -10.980 7.212 -0.793 1.00 0.00 H new ATOM 0 HB2 PRO A 170 -12.098 9.665 -1.559 1.00 0.00 H new ATOM 0 HB3 PRO A 170 -12.495 8.160 -2.364 1.00 0.00 H new ATOM 0 HG2 PRO A 170 -14.025 9.630 -0.233 1.00 0.00 H new ATOM 0 HG3 PRO A 170 -14.631 8.799 -1.653 1.00 0.00 H new ATOM 0 HD2 PRO A 170 -14.771 7.653 0.797 1.00 0.00 H new ATOM 0 HD3 PRO A 170 -14.502 6.679 -0.635 1.00 0.00 H new ATOM 690 N ARG A 171 -11.425 9.222 1.645 1.00 0.00 N ATOM 691 CA ARG A 171 -10.714 10.071 2.580 1.00 0.00 C ATOM 692 C ARG A 171 -9.852 9.194 3.479 1.00 0.00 C ATOM 693 O ARG A 171 -8.879 9.655 4.079 1.00 0.00 O ATOM 694 CB ARG A 171 -11.695 10.891 3.419 1.00 0.00 C ATOM 695 CG ARG A 171 -11.027 11.973 4.253 1.00 0.00 C ATOM 696 CD ARG A 171 -11.345 13.362 3.725 1.00 0.00 C ATOM 697 NE ARG A 171 -12.567 13.903 4.311 1.00 0.00 N ATOM 698 CZ ARG A 171 -12.689 14.225 5.595 1.00 0.00 C ATOM 699 NH1 ARG A 171 -11.666 14.060 6.421 1.00 0.00 N ATOM 700 NH2 ARG A 171 -13.834 14.713 6.053 1.00 0.00 N ATOM 0 H ARG A 171 -12.366 8.963 1.941 1.00 0.00 H new ATOM 0 HA ARG A 171 -10.083 10.768 2.029 1.00 0.00 H new ATOM 0 HB2 ARG A 171 -12.427 11.354 2.757 1.00 0.00 H new ATOM 0 HB3 ARG A 171 -12.243 10.220 4.081 1.00 0.00 H new ATOM 0 HG2 ARG A 171 -11.358 11.892 5.288 1.00 0.00 H new ATOM 0 HG3 ARG A 171 -9.948 11.821 4.251 1.00 0.00 H new ATOM 0 HD2 ARG A 171 -10.512 14.031 3.941 1.00 0.00 H new ATOM 0 HD3 ARG A 171 -11.449 13.323 2.641 1.00 0.00 H new ATOM 0 HE ARG A 171 -13.373 14.042 3.701 1.00 0.00 H new ATOM 0 HH11 ARG A 171 -10.784 13.686 6.072 1.00 0.00 H new ATOM 0 HH12 ARG A 171 -11.761 14.307 7.406 1.00 0.00 H new ATOM 0 HH21 ARG A 171 -14.623 14.842 5.420 1.00 0.00 H new ATOM 0 HH22 ARG A 171 -13.925 14.959 7.039 1.00 0.00 H new ATOM 714 N THR A 172 -10.215 7.910 3.554 1.00 0.00 N ATOM 715 CA THR A 172 -9.486 6.957 4.359 1.00 0.00 C ATOM 716 C THR A 172 -8.180 6.579 3.669 1.00 0.00 C ATOM 717 O THR A 172 -7.113 6.660 4.271 1.00 0.00 O ATOM 718 CB THR A 172 -10.354 5.717 4.635 1.00 0.00 C ATOM 719 OG1 THR A 172 -11.246 5.965 5.706 1.00 0.00 O ATOM 720 CG2 THR A 172 -9.567 4.473 4.983 1.00 0.00 C ATOM 0 H THR A 172 -11.016 7.516 3.060 1.00 0.00 H new ATOM 0 HA THR A 172 -9.241 7.413 5.318 1.00 0.00 H new ATOM 0 HB THR A 172 -10.881 5.533 3.699 1.00 0.00 H new ATOM 0 HG1 THR A 172 -12.127 5.592 5.491 1.00 0.00 H new ATOM 0 HG21 THR A 172 -10.254 3.646 5.162 1.00 0.00 H new ATOM 0 HG22 THR A 172 -8.902 4.220 4.157 1.00 0.00 H new ATOM 0 HG23 THR A 172 -8.976 4.655 5.881 1.00 0.00 H new ATOM 728 N VAL A 173 -8.265 6.181 2.406 1.00 0.00 N ATOM 729 CA VAL A 173 -7.080 5.811 1.661 1.00 0.00 C ATOM 730 C VAL A 173 -6.070 6.945 1.685 1.00 0.00 C ATOM 731 O VAL A 173 -4.867 6.716 1.765 1.00 0.00 O ATOM 732 CB VAL A 173 -7.416 5.447 0.208 1.00 0.00 C ATOM 733 CG1 VAL A 173 -8.450 4.338 0.175 1.00 0.00 C ATOM 734 CG2 VAL A 173 -7.890 6.667 -0.567 1.00 0.00 C ATOM 0 H VAL A 173 -9.138 6.108 1.884 1.00 0.00 H new ATOM 0 HA VAL A 173 -6.652 4.931 2.140 1.00 0.00 H new ATOM 0 HB VAL A 173 -6.509 5.087 -0.278 1.00 0.00 H new ATOM 0 HG11 VAL A 173 -8.682 4.087 -0.860 1.00 0.00 H new ATOM 0 HG12 VAL A 173 -8.056 3.458 0.682 1.00 0.00 H new ATOM 0 HG13 VAL A 173 -9.357 4.671 0.679 1.00 0.00 H new ATOM 0 HG21 VAL A 173 -8.121 6.379 -1.593 1.00 0.00 H new ATOM 0 HG22 VAL A 173 -8.784 7.074 -0.094 1.00 0.00 H new ATOM 0 HG23 VAL A 173 -7.105 7.424 -0.570 1.00 0.00 H new ATOM 744 N GLU A 174 -6.569 8.178 1.649 1.00 0.00 N ATOM 745 CA GLU A 174 -5.693 9.337 1.702 1.00 0.00 C ATOM 746 C GLU A 174 -4.839 9.246 2.953 1.00 0.00 C ATOM 747 O GLU A 174 -3.625 9.450 2.913 1.00 0.00 O ATOM 748 CB GLU A 174 -6.505 10.633 1.702 1.00 0.00 C ATOM 749 CG GLU A 174 -6.396 11.418 0.405 1.00 0.00 C ATOM 750 CD GLU A 174 -7.647 12.216 0.098 1.00 0.00 C ATOM 751 OE1 GLU A 174 -8.713 11.889 0.661 1.00 0.00 O ATOM 752 OE2 GLU A 174 -7.563 13.168 -0.706 1.00 0.00 O ATOM 0 H GLU A 174 -7.563 8.395 1.584 1.00 0.00 H new ATOM 0 HA GLU A 174 -5.054 9.348 0.819 1.00 0.00 H new ATOM 0 HB2 GLU A 174 -7.553 10.396 1.887 1.00 0.00 H new ATOM 0 HB3 GLU A 174 -6.170 11.262 2.527 1.00 0.00 H new ATOM 0 HG2 GLU A 174 -5.544 12.095 0.465 1.00 0.00 H new ATOM 0 HG3 GLU A 174 -6.199 10.729 -0.416 1.00 0.00 H new ATOM 759 N VAL A 175 -5.487 8.898 4.057 1.00 0.00 N ATOM 760 CA VAL A 175 -4.791 8.733 5.325 1.00 0.00 C ATOM 761 C VAL A 175 -4.037 7.415 5.334 1.00 0.00 C ATOM 762 O VAL A 175 -2.815 7.379 5.465 1.00 0.00 O ATOM 763 CB VAL A 175 -5.763 8.738 6.521 1.00 0.00 C ATOM 764 CG1 VAL A 175 -5.025 9.088 7.805 1.00 0.00 C ATOM 765 CG2 VAL A 175 -6.918 9.700 6.280 1.00 0.00 C ATOM 0 H VAL A 175 -6.491 8.725 4.100 1.00 0.00 H new ATOM 0 HA VAL A 175 -4.105 9.574 5.425 1.00 0.00 H new ATOM 0 HB VAL A 175 -6.179 7.736 6.627 1.00 0.00 H new ATOM 0 HG11 VAL A 175 -5.726 9.087 8.640 1.00 0.00 H new ATOM 0 HG12 VAL A 175 -4.243 8.351 7.987 1.00 0.00 H new ATOM 0 HG13 VAL A 175 -4.577 10.077 7.709 1.00 0.00 H new ATOM 0 HG21 VAL A 175 -7.589 9.685 7.139 1.00 0.00 H new ATOM 0 HG22 VAL A 175 -6.529 10.709 6.142 1.00 0.00 H new ATOM 0 HG23 VAL A 175 -7.464 9.396 5.387 1.00 0.00 H new ATOM 775 N HIS A 176 -4.793 6.334 5.185 1.00 0.00 N ATOM 776 CA HIS A 176 -4.242 4.986 5.171 1.00 0.00 C ATOM 777 C HIS A 176 -3.019 4.892 4.272 1.00 0.00 C ATOM 778 O HIS A 176 -2.002 4.322 4.656 1.00 0.00 O ATOM 779 CB HIS A 176 -5.307 3.998 4.699 1.00 0.00 C ATOM 780 CG HIS A 176 -6.376 3.739 5.715 1.00 0.00 C ATOM 781 ND1 HIS A 176 -6.579 4.546 6.815 1.00 0.00 N ATOM 782 CD2 HIS A 176 -7.301 2.754 5.798 1.00 0.00 C ATOM 783 CE1 HIS A 176 -7.580 4.066 7.532 1.00 0.00 C ATOM 784 NE2 HIS A 176 -8.037 2.981 6.935 1.00 0.00 N ATOM 0 H HIS A 176 -5.806 6.368 5.070 1.00 0.00 H new ATOM 0 HA HIS A 176 -3.933 4.739 6.186 1.00 0.00 H new ATOM 0 HB2 HIS A 176 -5.768 4.381 3.788 1.00 0.00 H new ATOM 0 HB3 HIS A 176 -4.826 3.054 4.441 1.00 0.00 H new ATOM 0 HD1 HIS A 176 -6.041 5.383 7.040 1.00 0.00 H new ATOM 0 HD2 HIS A 176 -7.435 1.941 5.100 1.00 0.00 H new ATOM 0 HE1 HIS A 176 -7.960 4.489 8.450 1.00 0.00 H new ATOM 793 N ARG A 177 -3.127 5.447 3.073 1.00 0.00 N ATOM 794 CA ARG A 177 -2.028 5.419 2.117 1.00 0.00 C ATOM 795 C ARG A 177 -0.779 6.070 2.701 1.00 0.00 C ATOM 796 O ARG A 177 0.201 5.390 3.002 1.00 0.00 O ATOM 797 CB ARG A 177 -2.434 6.124 0.824 1.00 0.00 C ATOM 798 CG ARG A 177 -1.450 5.923 -0.313 1.00 0.00 C ATOM 799 CD ARG A 177 -1.104 7.239 -0.990 1.00 0.00 C ATOM 800 NE ARG A 177 -1.612 7.302 -2.357 1.00 0.00 N ATOM 801 CZ ARG A 177 -1.491 8.369 -3.138 1.00 0.00 C ATOM 802 NH1 ARG A 177 -0.882 9.458 -2.687 1.00 0.00 N ATOM 803 NH2 ARG A 177 -1.979 8.350 -4.371 1.00 0.00 N ATOM 0 H ARG A 177 -3.965 5.923 2.739 1.00 0.00 H new ATOM 0 HA ARG A 177 -1.797 4.377 1.896 1.00 0.00 H new ATOM 0 HB2 ARG A 177 -3.414 5.760 0.514 1.00 0.00 H new ATOM 0 HB3 ARG A 177 -2.538 7.191 1.019 1.00 0.00 H new ATOM 0 HG2 ARG A 177 -0.541 5.459 0.069 1.00 0.00 H new ATOM 0 HG3 ARG A 177 -1.874 5.236 -1.046 1.00 0.00 H new ATOM 0 HD2 ARG A 177 -1.519 8.064 -0.411 1.00 0.00 H new ATOM 0 HD3 ARG A 177 -0.022 7.368 -0.999 1.00 0.00 H new ATOM 0 HE ARG A 177 -2.086 6.481 -2.733 1.00 0.00 H new ATOM 0 HH11 ARG A 177 -0.506 9.476 -1.739 1.00 0.00 H new ATOM 0 HH12 ARG A 177 -0.790 10.277 -3.288 1.00 0.00 H new ATOM 0 HH21 ARG A 177 -2.448 7.515 -4.721 1.00 0.00 H new ATOM 0 HH22 ARG A 177 -1.885 9.171 -4.969 1.00 0.00 H new ATOM 817 N ALA A 178 -0.822 7.390 2.863 1.00 0.00 N ATOM 818 CA ALA A 178 0.310 8.131 3.415 1.00 0.00 C ATOM 819 C ALA A 178 0.836 7.472 4.686 1.00 0.00 C ATOM 820 O ALA A 178 2.025 7.553 4.995 1.00 0.00 O ATOM 821 CB ALA A 178 -0.093 9.569 3.695 1.00 0.00 C ATOM 0 H ALA A 178 -1.627 7.968 2.621 1.00 0.00 H new ATOM 0 HA ALA A 178 1.112 8.123 2.677 1.00 0.00 H new ATOM 0 HB1 ALA A 178 0.758 10.112 4.106 1.00 0.00 H new ATOM 0 HB2 ALA A 178 -0.413 10.044 2.768 1.00 0.00 H new ATOM 0 HB3 ALA A 178 -0.914 9.584 4.412 1.00 0.00 H new ATOM 827 N ASN A 179 -0.058 6.813 5.410 1.00 0.00 N ATOM 828 CA ASN A 179 0.305 6.125 6.645 1.00 0.00 C ATOM 829 C ASN A 179 0.954 4.794 6.330 1.00 0.00 C ATOM 830 O ASN A 179 1.921 4.380 6.971 1.00 0.00 O ATOM 831 CB ASN A 179 -0.942 5.873 7.492 1.00 0.00 C ATOM 832 CG ASN A 179 -0.799 6.385 8.912 1.00 0.00 C ATOM 833 OD1 ASN A 179 0.160 6.059 9.610 1.00 0.00 O ATOM 834 ND2 ASN A 179 -1.760 7.193 9.344 1.00 0.00 N ATOM 0 H ASN A 179 -1.045 6.739 5.163 1.00 0.00 H new ATOM 0 HA ASN A 179 1.004 6.755 7.195 1.00 0.00 H new ATOM 0 HB2 ASN A 179 -1.799 6.354 7.021 1.00 0.00 H new ATOM 0 HB3 ASN A 179 -1.150 4.803 7.515 1.00 0.00 H new ATOM 0 HD21 ASN A 179 -1.721 7.571 10.291 1.00 0.00 H new ATOM 0 HD22 ASN A 179 -2.537 7.436 8.729 1.00 0.00 H new ATOM 841 N VAL A 180 0.391 4.128 5.339 1.00 0.00 N ATOM 842 CA VAL A 180 0.854 2.844 4.907 1.00 0.00 C ATOM 843 C VAL A 180 2.295 2.936 4.415 1.00 0.00 C ATOM 844 O VAL A 180 3.192 2.335 5.000 1.00 0.00 O ATOM 845 CB VAL A 180 -0.120 2.322 3.827 1.00 0.00 C ATOM 846 CG1 VAL A 180 0.579 1.609 2.694 1.00 0.00 C ATOM 847 CG2 VAL A 180 -1.162 1.432 4.474 1.00 0.00 C ATOM 0 H VAL A 180 -0.410 4.477 4.812 1.00 0.00 H new ATOM 0 HA VAL A 180 0.864 2.133 5.733 1.00 0.00 H new ATOM 0 HB VAL A 180 -0.606 3.187 3.377 1.00 0.00 H new ATOM 0 HG11 VAL A 180 -0.159 1.267 1.969 1.00 0.00 H new ATOM 0 HG12 VAL A 180 1.275 2.293 2.208 1.00 0.00 H new ATOM 0 HG13 VAL A 180 1.127 0.752 3.086 1.00 0.00 H new ATOM 0 HG21 VAL A 180 -1.849 1.064 3.712 1.00 0.00 H new ATOM 0 HG22 VAL A 180 -0.670 0.588 4.958 1.00 0.00 H new ATOM 0 HG23 VAL A 180 -1.717 2.003 5.218 1.00 0.00 H new ATOM 857 N MET A 181 2.514 3.695 3.350 1.00 0.00 N ATOM 858 CA MET A 181 3.856 3.858 2.812 1.00 0.00 C ATOM 859 C MET A 181 4.815 4.318 3.903 1.00 0.00 C ATOM 860 O MET A 181 5.975 3.907 3.939 1.00 0.00 O ATOM 861 CB MET A 181 3.853 4.862 1.663 1.00 0.00 C ATOM 862 CG MET A 181 3.191 6.183 2.008 1.00 0.00 C ATOM 863 SD MET A 181 3.034 7.278 0.582 1.00 0.00 S ATOM 864 CE MET A 181 4.476 6.814 -0.376 1.00 0.00 C ATOM 0 H MET A 181 1.787 4.203 2.846 1.00 0.00 H new ATOM 0 HA MET A 181 4.192 2.893 2.433 1.00 0.00 H new ATOM 0 HB2 MET A 181 4.881 5.051 1.355 1.00 0.00 H new ATOM 0 HB3 MET A 181 3.340 4.421 0.808 1.00 0.00 H new ATOM 0 HG2 MET A 181 2.202 5.991 2.424 1.00 0.00 H new ATOM 0 HG3 MET A 181 3.771 6.684 2.783 1.00 0.00 H new ATOM 0 HE1 MET A 181 4.665 7.570 -1.138 1.00 0.00 H new ATOM 0 HE2 MET A 181 5.341 6.738 0.282 1.00 0.00 H new ATOM 0 HE3 MET A 181 4.300 5.851 -0.856 1.00 0.00 H new ATOM 874 N ALA A 182 4.318 5.168 4.796 1.00 0.00 N ATOM 875 CA ALA A 182 5.128 5.676 5.895 1.00 0.00 C ATOM 876 C ALA A 182 5.656 4.532 6.751 1.00 0.00 C ATOM 877 O ALA A 182 6.813 4.541 7.175 1.00 0.00 O ATOM 878 CB ALA A 182 4.319 6.646 6.742 1.00 0.00 C ATOM 0 H ALA A 182 3.360 5.518 4.779 1.00 0.00 H new ATOM 0 HA ALA A 182 5.982 6.208 5.475 1.00 0.00 H new ATOM 0 HB1 ALA A 182 4.937 7.018 7.560 1.00 0.00 H new ATOM 0 HB2 ALA A 182 3.992 7.483 6.125 1.00 0.00 H new ATOM 0 HB3 ALA A 182 3.448 6.134 7.150 1.00 0.00 H new ATOM 884 N LYS A 183 4.803 3.540 6.994 1.00 0.00 N ATOM 885 CA LYS A 183 5.181 2.380 7.790 1.00 0.00 C ATOM 886 C LYS A 183 5.814 1.310 6.904 1.00 0.00 C ATOM 887 O LYS A 183 6.687 0.561 7.339 1.00 0.00 O ATOM 888 CB LYS A 183 3.958 1.810 8.513 1.00 0.00 C ATOM 889 CG LYS A 183 3.073 2.873 9.143 1.00 0.00 C ATOM 890 CD LYS A 183 1.600 2.512 9.027 1.00 0.00 C ATOM 891 CE LYS A 183 1.299 1.182 9.701 1.00 0.00 C ATOM 892 NZ LYS A 183 -0.086 0.716 9.415 1.00 0.00 N ATOM 0 H LYS A 183 3.843 3.518 6.649 1.00 0.00 H new ATOM 0 HA LYS A 183 5.913 2.695 8.534 1.00 0.00 H new ATOM 0 HB2 LYS A 183 3.366 1.229 7.806 1.00 0.00 H new ATOM 0 HB3 LYS A 183 4.293 1.122 9.289 1.00 0.00 H new ATOM 0 HG2 LYS A 183 3.338 2.993 10.194 1.00 0.00 H new ATOM 0 HG3 LYS A 183 3.253 3.832 8.658 1.00 0.00 H new ATOM 0 HD2 LYS A 183 0.995 3.297 9.481 1.00 0.00 H new ATOM 0 HD3 LYS A 183 1.318 2.460 7.975 1.00 0.00 H new ATOM 0 HE2 LYS A 183 2.012 0.432 9.359 1.00 0.00 H new ATOM 0 HE3 LYS A 183 1.433 1.282 10.778 1.00 0.00 H new ATOM 0 HZ1 LYS A 183 -0.214 -0.245 9.791 1.00 0.00 H new ATOM 0 HZ2 LYS A 183 -0.768 1.358 9.866 1.00 0.00 H new ATOM 0 HZ3 LYS A 183 -0.245 0.709 8.387 1.00 0.00 H new ATOM 906 N MET A 184 5.366 1.258 5.653 1.00 0.00 N ATOM 907 CA MET A 184 5.881 0.299 4.684 1.00 0.00 C ATOM 908 C MET A 184 7.375 0.507 4.449 1.00 0.00 C ATOM 909 O MET A 184 8.049 -0.363 3.897 1.00 0.00 O ATOM 910 CB MET A 184 5.127 0.443 3.360 1.00 0.00 C ATOM 911 CG MET A 184 4.369 -0.804 2.946 1.00 0.00 C ATOM 912 SD MET A 184 4.352 -1.046 1.161 1.00 0.00 S ATOM 913 CE MET A 184 5.850 -1.998 0.941 1.00 0.00 C ATOM 0 H MET A 184 4.641 1.875 5.286 1.00 0.00 H new ATOM 0 HA MET A 184 5.731 -0.704 5.084 1.00 0.00 H new ATOM 0 HB2 MET A 184 4.425 1.273 3.441 1.00 0.00 H new ATOM 0 HB3 MET A 184 5.837 0.702 2.575 1.00 0.00 H new ATOM 0 HG2 MET A 184 4.821 -1.674 3.422 1.00 0.00 H new ATOM 0 HG3 MET A 184 3.344 -0.738 3.310 1.00 0.00 H new ATOM 0 HE1 MET A 184 6.486 -1.510 0.202 1.00 0.00 H new ATOM 0 HE2 MET A 184 6.382 -2.064 1.890 1.00 0.00 H new ATOM 0 HE3 MET A 184 5.597 -3.001 0.597 1.00 0.00 H new ATOM 923 N LYS A 185 7.884 1.670 4.860 1.00 0.00 N ATOM 924 CA LYS A 185 9.293 2.013 4.689 1.00 0.00 C ATOM 925 C LYS A 185 9.555 2.559 3.288 1.00 0.00 C ATOM 926 O LYS A 185 10.707 2.699 2.876 1.00 0.00 O ATOM 927 CB LYS A 185 10.202 0.807 4.962 1.00 0.00 C ATOM 928 CG LYS A 185 9.838 0.035 6.221 1.00 0.00 C ATOM 929 CD LYS A 185 9.723 0.953 7.428 1.00 0.00 C ATOM 930 CE LYS A 185 11.082 1.236 8.044 1.00 0.00 C ATOM 931 NZ LYS A 185 11.753 2.400 7.401 1.00 0.00 N ATOM 0 H LYS A 185 7.333 2.396 5.318 1.00 0.00 H new ATOM 0 HA LYS A 185 9.528 2.789 5.418 1.00 0.00 H new ATOM 0 HB2 LYS A 185 10.159 0.131 4.108 1.00 0.00 H new ATOM 0 HB3 LYS A 185 11.233 1.152 5.044 1.00 0.00 H new ATOM 0 HG2 LYS A 185 8.893 -0.486 6.068 1.00 0.00 H new ATOM 0 HG3 LYS A 185 10.594 -0.726 6.413 1.00 0.00 H new ATOM 0 HD2 LYS A 185 9.255 1.891 7.130 1.00 0.00 H new ATOM 0 HD3 LYS A 185 9.073 0.496 8.174 1.00 0.00 H new ATOM 0 HE2 LYS A 185 10.964 1.429 9.110 1.00 0.00 H new ATOM 0 HE3 LYS A 185 11.715 0.354 7.948 1.00 0.00 H new ATOM 0 HZ1 LYS A 185 12.325 2.905 8.108 1.00 0.00 H new ATOM 0 HZ2 LYS A 185 12.369 2.065 6.633 1.00 0.00 H new ATOM 0 HZ3 LYS A 185 11.035 3.044 7.013 1.00 0.00 H new ATOM 945 N ALA A 186 8.485 2.873 2.557 1.00 0.00 N ATOM 946 CA ALA A 186 8.623 3.406 1.209 1.00 0.00 C ATOM 947 C ALA A 186 8.768 4.924 1.233 1.00 0.00 C ATOM 948 O ALA A 186 9.091 5.512 2.265 1.00 0.00 O ATOM 949 CB ALA A 186 7.435 2.999 0.352 1.00 0.00 C ATOM 0 H ALA A 186 7.522 2.767 2.876 1.00 0.00 H new ATOM 0 HA ALA A 186 9.529 2.987 0.771 1.00 0.00 H new ATOM 0 HB1 ALA A 186 7.554 3.406 -0.652 1.00 0.00 H new ATOM 0 HB2 ALA A 186 7.380 1.912 0.299 1.00 0.00 H new ATOM 0 HB3 ALA A 186 6.517 3.387 0.794 1.00 0.00 H new ATOM 955 N LYS A 187 8.527 5.551 0.087 1.00 0.00 N ATOM 956 CA LYS A 187 8.629 7.001 -0.031 1.00 0.00 C ATOM 957 C LYS A 187 7.505 7.548 -0.906 1.00 0.00 C ATOM 958 O LYS A 187 6.839 8.521 -0.551 1.00 0.00 O ATOM 959 CB LYS A 187 9.988 7.385 -0.620 1.00 0.00 C ATOM 960 CG LYS A 187 10.099 7.125 -2.113 1.00 0.00 C ATOM 961 CD LYS A 187 11.477 7.485 -2.643 1.00 0.00 C ATOM 962 CE LYS A 187 11.536 7.379 -4.159 1.00 0.00 C ATOM 963 NZ LYS A 187 12.563 6.397 -4.608 1.00 0.00 N ATOM 0 H LYS A 187 8.259 5.077 -0.775 1.00 0.00 H new ATOM 0 HA LYS A 187 8.537 7.437 0.964 1.00 0.00 H new ATOM 0 HB2 LYS A 187 10.172 8.442 -0.429 1.00 0.00 H new ATOM 0 HB3 LYS A 187 10.769 6.827 -0.103 1.00 0.00 H new ATOM 0 HG2 LYS A 187 9.894 6.074 -2.316 1.00 0.00 H new ATOM 0 HG3 LYS A 187 9.342 7.705 -2.641 1.00 0.00 H new ATOM 0 HD2 LYS A 187 11.732 8.500 -2.338 1.00 0.00 H new ATOM 0 HD3 LYS A 187 12.222 6.823 -2.202 1.00 0.00 H new ATOM 0 HE2 LYS A 187 10.559 7.082 -4.540 1.00 0.00 H new ATOM 0 HE3 LYS A 187 11.760 8.358 -4.583 1.00 0.00 H new ATOM 0 HZ1 LYS A 187 12.572 6.354 -5.647 1.00 0.00 H new ATOM 0 HZ2 LYS A 187 13.499 6.693 -4.266 1.00 0.00 H new ATOM 0 HZ3 LYS A 187 12.336 5.457 -4.225 1.00 0.00 H new ATOM 977 N SER A 188 7.305 6.907 -2.052 1.00 0.00 N ATOM 978 CA SER A 188 6.267 7.311 -2.992 1.00 0.00 C ATOM 979 C SER A 188 5.318 6.148 -3.261 1.00 0.00 C ATOM 980 O SER A 188 5.550 5.030 -2.803 1.00 0.00 O ATOM 981 CB SER A 188 6.894 7.787 -4.303 1.00 0.00 C ATOM 982 OG SER A 188 5.976 8.559 -5.057 1.00 0.00 O ATOM 0 H SER A 188 7.852 6.101 -2.353 1.00 0.00 H new ATOM 0 HA SER A 188 5.703 8.134 -2.553 1.00 0.00 H new ATOM 0 HB2 SER A 188 7.784 8.380 -4.090 1.00 0.00 H new ATOM 0 HB3 SER A 188 7.217 6.926 -4.889 1.00 0.00 H new ATOM 0 HG SER A 188 6.402 8.853 -5.889 1.00 0.00 H new ATOM 988 N LEU A 189 4.255 6.413 -4.011 1.00 0.00 N ATOM 989 CA LEU A 189 3.286 5.375 -4.340 1.00 0.00 C ATOM 990 C LEU A 189 3.958 4.249 -5.116 1.00 0.00 C ATOM 991 O LEU A 189 3.811 3.075 -4.776 1.00 0.00 O ATOM 992 CB LEU A 189 2.130 5.957 -5.154 1.00 0.00 C ATOM 993 CG LEU A 189 0.754 5.373 -4.828 1.00 0.00 C ATOM 994 CD1 LEU A 189 0.734 3.880 -5.112 1.00 0.00 C ATOM 995 CD2 LEU A 189 0.388 5.649 -3.378 1.00 0.00 C ATOM 0 H LEU A 189 4.043 7.332 -4.401 1.00 0.00 H new ATOM 0 HA LEU A 189 2.887 4.971 -3.409 1.00 0.00 H new ATOM 0 HB2 LEU A 189 2.098 7.035 -4.994 1.00 0.00 H new ATOM 0 HB3 LEU A 189 2.334 5.798 -6.213 1.00 0.00 H new ATOM 0 HG LEU A 189 0.012 5.855 -5.464 1.00 0.00 H new ATOM 0 HD11 LEU A 189 -0.251 3.478 -4.875 1.00 0.00 H new ATOM 0 HD12 LEU A 189 0.953 3.707 -6.166 1.00 0.00 H new ATOM 0 HD13 LEU A 189 1.486 3.383 -4.499 1.00 0.00 H new ATOM 0 HD21 LEU A 189 -0.594 5.227 -3.164 1.00 0.00 H new ATOM 0 HD22 LEU A 189 1.130 5.193 -2.722 1.00 0.00 H new ATOM 0 HD23 LEU A 189 0.365 6.725 -3.207 1.00 0.00 H new ATOM 1007 N PRO A 190 4.718 4.595 -6.170 1.00 0.00 N ATOM 1008 CA PRO A 190 5.423 3.606 -6.991 1.00 0.00 C ATOM 1009 C PRO A 190 6.294 2.678 -6.151 1.00 0.00 C ATOM 1010 O PRO A 190 6.254 1.459 -6.313 1.00 0.00 O ATOM 1011 CB PRO A 190 6.293 4.467 -7.909 1.00 0.00 C ATOM 1012 CG PRO A 190 5.576 5.766 -7.994 1.00 0.00 C ATOM 1013 CD PRO A 190 4.955 5.973 -6.643 1.00 0.00 C ATOM 0 HA PRO A 190 4.735 2.950 -7.524 1.00 0.00 H new ATOM 0 HB2 PRO A 190 7.296 4.594 -7.501 1.00 0.00 H new ATOM 0 HB3 PRO A 190 6.404 4.010 -8.892 1.00 0.00 H new ATOM 0 HG2 PRO A 190 6.262 6.577 -8.239 1.00 0.00 H new ATOM 0 HG3 PRO A 190 4.816 5.744 -8.775 1.00 0.00 H new ATOM 0 HD2 PRO A 190 5.619 6.521 -5.974 1.00 0.00 H new ATOM 0 HD3 PRO A 190 4.028 6.542 -6.708 1.00 0.00 H new ATOM 1021 N HIS A 191 7.086 3.265 -5.255 1.00 0.00 N ATOM 1022 CA HIS A 191 7.972 2.489 -4.392 1.00 0.00 C ATOM 1023 C HIS A 191 7.233 1.316 -3.756 1.00 0.00 C ATOM 1024 O HIS A 191 7.637 0.164 -3.904 1.00 0.00 O ATOM 1025 CB HIS A 191 8.575 3.376 -3.302 1.00 0.00 C ATOM 1026 CG HIS A 191 9.668 2.706 -2.532 1.00 0.00 C ATOM 1027 ND1 HIS A 191 10.215 3.233 -1.381 1.00 0.00 N ATOM 1028 CD2 HIS A 191 10.316 1.536 -2.751 1.00 0.00 C ATOM 1029 CE1 HIS A 191 11.151 2.418 -0.927 1.00 0.00 C ATOM 1030 NE2 HIS A 191 11.231 1.381 -1.739 1.00 0.00 N ATOM 0 H HIS A 191 7.132 4.273 -5.109 1.00 0.00 H new ATOM 0 HA HIS A 191 8.776 2.094 -5.013 1.00 0.00 H new ATOM 0 HB2 HIS A 191 8.966 4.285 -3.758 1.00 0.00 H new ATOM 0 HB3 HIS A 191 7.787 3.679 -2.612 1.00 0.00 H new ATOM 0 HD2 HIS A 191 10.145 0.853 -3.569 1.00 0.00 H new ATOM 0 HE1 HIS A 191 11.749 2.574 -0.041 1.00 0.00 H new ATOM 0 HE2 HIS A 191 11.869 0.592 -1.632 1.00 0.00 H new ATOM 1039 N LEU A 192 6.140 1.614 -3.053 1.00 0.00 N ATOM 1040 CA LEU A 192 5.337 0.576 -2.403 1.00 0.00 C ATOM 1041 C LEU A 192 5.142 -0.614 -3.333 1.00 0.00 C ATOM 1042 O LEU A 192 5.672 -1.699 -3.098 1.00 0.00 O ATOM 1043 CB LEU A 192 3.970 1.131 -2.005 1.00 0.00 C ATOM 1044 CG LEU A 192 3.996 2.315 -1.044 1.00 0.00 C ATOM 1045 CD1 LEU A 192 2.588 2.848 -0.841 1.00 0.00 C ATOM 1046 CD2 LEU A 192 4.614 1.912 0.282 1.00 0.00 C ATOM 0 H LEU A 192 5.790 2.563 -2.919 1.00 0.00 H new ATOM 0 HA LEU A 192 5.870 0.249 -1.510 1.00 0.00 H new ATOM 0 HB2 LEU A 192 3.442 1.432 -2.910 1.00 0.00 H new ATOM 0 HB3 LEU A 192 3.390 0.328 -1.549 1.00 0.00 H new ATOM 0 HG LEU A 192 4.610 3.106 -1.476 1.00 0.00 H new ATOM 0 HD11 LEU A 192 2.615 3.693 -0.153 1.00 0.00 H new ATOM 0 HD12 LEU A 192 2.180 3.172 -1.799 1.00 0.00 H new ATOM 0 HD13 LEU A 192 1.958 2.062 -0.425 1.00 0.00 H new ATOM 0 HD21 LEU A 192 4.624 2.770 0.954 1.00 0.00 H new ATOM 0 HD22 LEU A 192 4.028 1.108 0.727 1.00 0.00 H new ATOM 0 HD23 LEU A 192 5.635 1.568 0.118 1.00 0.00 H new ATOM 1058 N VAL A 193 4.382 -0.387 -4.398 1.00 0.00 N ATOM 1059 CA VAL A 193 4.110 -1.420 -5.391 1.00 0.00 C ATOM 1060 C VAL A 193 5.382 -2.175 -5.743 1.00 0.00 C ATOM 1061 O VAL A 193 5.397 -3.401 -5.786 1.00 0.00 O ATOM 1062 CB VAL A 193 3.516 -0.818 -6.680 1.00 0.00 C ATOM 1063 CG1 VAL A 193 3.350 -1.890 -7.748 1.00 0.00 C ATOM 1064 CG2 VAL A 193 2.192 -0.134 -6.388 1.00 0.00 C ATOM 0 H VAL A 193 3.940 0.510 -4.597 1.00 0.00 H new ATOM 0 HA VAL A 193 3.385 -2.105 -4.951 1.00 0.00 H new ATOM 0 HB VAL A 193 4.209 -0.068 -7.060 1.00 0.00 H new ATOM 0 HG11 VAL A 193 2.929 -1.444 -8.649 1.00 0.00 H new ATOM 0 HG12 VAL A 193 4.321 -2.327 -7.979 1.00 0.00 H new ATOM 0 HG13 VAL A 193 2.680 -2.668 -7.382 1.00 0.00 H new ATOM 0 HG21 VAL A 193 1.788 0.285 -7.310 1.00 0.00 H new ATOM 0 HG22 VAL A 193 1.489 -0.861 -5.981 1.00 0.00 H new ATOM 0 HG23 VAL A 193 2.347 0.666 -5.664 1.00 0.00 H new ATOM 1074 N ARG A 194 6.450 -1.434 -5.990 1.00 0.00 N ATOM 1075 CA ARG A 194 7.724 -2.049 -6.330 1.00 0.00 C ATOM 1076 C ARG A 194 8.115 -3.048 -5.252 1.00 0.00 C ATOM 1077 O ARG A 194 8.570 -4.154 -5.543 1.00 0.00 O ATOM 1078 CB ARG A 194 8.807 -0.986 -6.495 1.00 0.00 C ATOM 1079 CG ARG A 194 8.374 0.198 -7.343 1.00 0.00 C ATOM 1080 CD ARG A 194 9.204 0.308 -8.612 1.00 0.00 C ATOM 1081 NE ARG A 194 9.275 1.681 -9.103 1.00 0.00 N ATOM 1082 CZ ARG A 194 9.773 2.013 -10.290 1.00 0.00 C ATOM 1083 NH1 ARG A 194 10.240 1.074 -11.101 1.00 0.00 N ATOM 1084 NH2 ARG A 194 9.802 3.285 -10.666 1.00 0.00 N ATOM 0 H ARG A 194 6.462 -0.414 -5.962 1.00 0.00 H new ATOM 0 HA ARG A 194 7.621 -2.575 -7.279 1.00 0.00 H new ATOM 0 HB2 ARG A 194 9.105 -0.627 -5.510 1.00 0.00 H new ATOM 0 HB3 ARG A 194 9.687 -1.443 -6.947 1.00 0.00 H new ATOM 0 HG2 ARG A 194 7.321 0.094 -7.604 1.00 0.00 H new ATOM 0 HG3 ARG A 194 8.470 1.116 -6.764 1.00 0.00 H new ATOM 0 HD2 ARG A 194 10.212 -0.060 -8.419 1.00 0.00 H new ATOM 0 HD3 ARG A 194 8.773 -0.331 -9.383 1.00 0.00 H new ATOM 0 HE ARG A 194 8.923 2.427 -8.502 1.00 0.00 H new ATOM 0 HH11 ARG A 194 10.217 0.095 -10.815 1.00 0.00 H new ATOM 0 HH12 ARG A 194 10.622 1.330 -12.011 1.00 0.00 H new ATOM 0 HH21 ARG A 194 9.442 4.009 -10.044 1.00 0.00 H new ATOM 0 HH22 ARG A 194 10.184 3.539 -11.577 1.00 0.00 H new ATOM 1098 N MET A 195 7.905 -2.654 -4.002 1.00 0.00 N ATOM 1099 CA MET A 195 8.201 -3.510 -2.869 1.00 0.00 C ATOM 1100 C MET A 195 7.102 -4.558 -2.705 1.00 0.00 C ATOM 1101 O MET A 195 7.329 -5.632 -2.149 1.00 0.00 O ATOM 1102 CB MET A 195 8.328 -2.670 -1.599 1.00 0.00 C ATOM 1103 CG MET A 195 9.083 -1.365 -1.807 1.00 0.00 C ATOM 1104 SD MET A 195 8.380 0.005 -0.873 1.00 0.00 S ATOM 1105 CE MET A 195 8.807 -0.476 0.796 1.00 0.00 C ATOM 0 H MET A 195 7.528 -1.740 -3.750 1.00 0.00 H new ATOM 0 HA MET A 195 9.147 -4.021 -3.046 1.00 0.00 H new ATOM 0 HB2 MET A 195 7.331 -2.447 -1.219 1.00 0.00 H new ATOM 0 HB3 MET A 195 8.837 -3.257 -0.834 1.00 0.00 H new ATOM 0 HG2 MET A 195 10.124 -1.502 -1.514 1.00 0.00 H new ATOM 0 HG3 MET A 195 9.081 -1.114 -2.868 1.00 0.00 H new ATOM 0 HE1 MET A 195 8.187 0.075 1.503 1.00 0.00 H new ATOM 0 HE2 MET A 195 8.638 -1.545 0.921 1.00 0.00 H new ATOM 0 HE3 MET A 195 9.857 -0.251 0.982 1.00 0.00 H new ATOM 1115 N ALA A 196 5.908 -4.235 -3.205 1.00 0.00 N ATOM 1116 CA ALA A 196 4.770 -5.141 -3.131 1.00 0.00 C ATOM 1117 C ALA A 196 4.892 -6.231 -4.181 1.00 0.00 C ATOM 1118 O ALA A 196 5.035 -7.411 -3.862 1.00 0.00 O ATOM 1119 CB ALA A 196 3.472 -4.371 -3.314 1.00 0.00 C ATOM 0 H ALA A 196 5.708 -3.348 -3.667 1.00 0.00 H new ATOM 0 HA ALA A 196 4.761 -5.609 -2.147 1.00 0.00 H new ATOM 0 HB1 ALA A 196 2.629 -5.060 -3.257 1.00 0.00 H new ATOM 0 HB2 ALA A 196 3.381 -3.620 -2.529 1.00 0.00 H new ATOM 0 HB3 ALA A 196 3.474 -3.881 -4.287 1.00 0.00 H new ATOM 1125 N LEU A 197 4.857 -5.819 -5.439 1.00 0.00 N ATOM 1126 CA LEU A 197 4.990 -6.732 -6.559 1.00 0.00 C ATOM 1127 C LEU A 197 6.178 -7.660 -6.337 1.00 0.00 C ATOM 1128 O LEU A 197 6.113 -8.855 -6.625 1.00 0.00 O ATOM 1129 CB LEU A 197 5.151 -5.931 -7.836 1.00 0.00 C ATOM 1130 CG LEU A 197 6.465 -5.193 -7.912 1.00 0.00 C ATOM 1131 CD1 LEU A 197 7.538 -6.147 -8.384 1.00 0.00 C ATOM 1132 CD2 LEU A 197 6.352 -3.975 -8.811 1.00 0.00 C ATOM 0 H LEU A 197 4.736 -4.843 -5.710 1.00 0.00 H new ATOM 0 HA LEU A 197 4.096 -7.350 -6.644 1.00 0.00 H new ATOM 0 HB2 LEU A 197 5.068 -6.602 -8.691 1.00 0.00 H new ATOM 0 HB3 LEU A 197 4.334 -5.214 -7.913 1.00 0.00 H new ATOM 0 HG LEU A 197 6.737 -4.825 -6.923 1.00 0.00 H new ATOM 0 HD11 LEU A 197 8.492 -5.622 -8.442 1.00 0.00 H new ATOM 0 HD12 LEU A 197 7.622 -6.976 -7.682 1.00 0.00 H new ATOM 0 HD13 LEU A 197 7.275 -6.532 -9.369 1.00 0.00 H new ATOM 0 HD21 LEU A 197 7.312 -3.460 -8.849 1.00 0.00 H new ATOM 0 HD22 LEU A 197 6.069 -4.289 -9.816 1.00 0.00 H new ATOM 0 HD23 LEU A 197 5.594 -3.299 -8.415 1.00 0.00 H new ATOM 1144 N ALA A 198 7.254 -7.097 -5.795 1.00 0.00 N ATOM 1145 CA ALA A 198 8.450 -7.871 -5.498 1.00 0.00 C ATOM 1146 C ALA A 198 8.186 -8.755 -4.291 1.00 0.00 C ATOM 1147 O ALA A 198 8.688 -9.876 -4.195 1.00 0.00 O ATOM 1148 CB ALA A 198 9.634 -6.949 -5.241 1.00 0.00 C ATOM 0 H ALA A 198 7.320 -6.108 -5.554 1.00 0.00 H new ATOM 0 HA ALA A 198 8.696 -8.498 -6.355 1.00 0.00 H new ATOM 0 HB1 ALA A 198 10.519 -7.546 -5.021 1.00 0.00 H new ATOM 0 HB2 ALA A 198 9.819 -6.339 -6.125 1.00 0.00 H new ATOM 0 HB3 ALA A 198 9.413 -6.301 -4.393 1.00 0.00 H new ATOM 1154 N GLY A 199 7.364 -8.238 -3.383 1.00 0.00 N ATOM 1155 CA GLY A 199 6.997 -8.977 -2.196 1.00 0.00 C ATOM 1156 C GLY A 199 5.755 -9.811 -2.432 1.00 0.00 C ATOM 1157 O GLY A 199 4.748 -9.660 -1.742 1.00 0.00 O ATOM 0 H GLY A 199 6.944 -7.311 -3.453 1.00 0.00 H new ATOM 0 HA2 GLY A 199 7.822 -9.624 -1.898 1.00 0.00 H new ATOM 0 HA3 GLY A 199 6.822 -8.284 -1.373 1.00 0.00 H new ATOM 1161 N GLY A 200 5.827 -10.678 -3.437 1.00 0.00 N ATOM 1162 CA GLY A 200 4.699 -11.527 -3.789 1.00 0.00 C ATOM 1163 C GLY A 200 3.386 -10.775 -3.765 1.00 0.00 C ATOM 1164 O GLY A 200 2.329 -11.350 -3.506 1.00 0.00 O ATOM 0 H GLY A 200 6.654 -10.810 -4.020 1.00 0.00 H new ATOM 0 HA2 GLY A 200 4.858 -11.945 -4.783 1.00 0.00 H new ATOM 0 HA3 GLY A 200 4.648 -12.366 -3.095 1.00 0.00 H new ATOM 1168 N PHE A 201 3.468 -9.479 -4.035 1.00 0.00 N ATOM 1169 CA PHE A 201 2.292 -8.619 -4.046 1.00 0.00 C ATOM 1170 C PHE A 201 2.089 -7.989 -5.420 1.00 0.00 C ATOM 1171 O PHE A 201 1.706 -6.825 -5.529 1.00 0.00 O ATOM 1172 CB PHE A 201 2.436 -7.523 -2.991 1.00 0.00 C ATOM 1173 CG PHE A 201 1.335 -7.519 -1.970 1.00 0.00 C ATOM 1174 CD1 PHE A 201 1.039 -8.678 -1.239 1.00 0.00 C ATOM 1175 CD2 PHE A 201 0.589 -6.357 -1.730 1.00 0.00 C ATOM 1176 CE1 PHE A 201 0.017 -8.678 -0.287 1.00 0.00 C ATOM 1177 CE2 PHE A 201 -0.435 -6.351 -0.778 1.00 0.00 C ATOM 1178 CZ PHE A 201 -0.721 -7.513 -0.056 1.00 0.00 C ATOM 0 H PHE A 201 4.341 -8.998 -4.250 1.00 0.00 H new ATOM 0 HA PHE A 201 1.420 -9.232 -3.816 1.00 0.00 H new ATOM 0 HB2 PHE A 201 3.392 -7.645 -2.481 1.00 0.00 H new ATOM 0 HB3 PHE A 201 2.462 -6.553 -3.488 1.00 0.00 H new ATOM 0 HD1 PHE A 201 1.607 -9.580 -1.414 1.00 0.00 H new ATOM 0 HD2 PHE A 201 0.807 -5.457 -2.286 1.00 0.00 H new ATOM 0 HE1 PHE A 201 -0.203 -9.577 0.270 1.00 0.00 H new ATOM 0 HE2 PHE A 201 -1.004 -5.450 -0.601 1.00 0.00 H new ATOM 0 HZ PHE A 201 -1.512 -7.511 0.680 1.00 0.00 H new