USER MOD reduce.3.24.130724 H: found=0, std=0, add=760, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 761 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 121 SER OG : rot 28:sc= 0.98 USER MOD Set 1.2: A 162 TYR OH : rot -147:sc= 0.052 USER MOD Single : A 93 GLN : amide:sc= -0.398 K(o=-0.4,f=-1.6) USER MOD Single : A 96 LYS NZ :NH3+ 157:sc= -0.0576 (180deg=-0.33) USER MOD Single : A 101 GLN : amide:sc= -5.85 K(o=-5.8,f=-4.5!) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 104 THR OG1 : rot -45:sc= 0.561 USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0506) USER MOD Single : A 126 SER OG : rot -42:sc= 1.25 USER MOD Single : A 127 LYS NZ :NH3+ 142:sc= -0.535 (180deg=-2.53!) USER MOD Single : A 132 MET CE :methyl 165:sc= 0 (180deg=-0.159) USER MOD Single : A 134 THR OG1 : rot 180:sc= 0.0378 USER MOD Single : A 135 LYS NZ :NH3+ -113:sc= -0.0171 (180deg=-0.0544) USER MOD Single : A 137 LYS NZ :NH3+ 159:sc= -0.0305 (180deg=-0.269) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 SER OG : rot 180:sc= 0.0426 USER MOD Single : A 141 LYS NZ :NH3+ -134:sc= -0.581 (180deg=-2.23!) USER MOD Single : A 144 SER OG : rot 78:sc= 0.629 USER MOD Single : A 148 TYR OH : rot 180:sc= -0.969 USER MOD Single : A 152 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 154 THR OG1 : rot 180:sc= 0 USER MOD Single : A 156 SER OG : rot 180:sc= 0 USER MOD Single : A 159 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0183) USER MOD Single : A 160 SER OG : rot 180:sc= 0 USER MOD Single : A 161 HIS : no HD1:sc= -0.0369 X(o=-0.037,f=-0.13) USER MOD Single : A 167 TYR OH : rot 180:sc= -1.03 USER MOD Single : A 169 TYR OH : rot 180:sc= 0 USER MOD Single : A 173 GLN : amide:sc= 1.19 K(o=1.2,f=0.35) USER MOD Single : A 174 SER OG : rot 47:sc= 1.11 USER MOD ----------------------------------------------------------------- ATOM 85 N VAL A 86 -8.958 10.046 3.100 1.00 0.00 N ATOM 86 CA VAL A 86 -7.507 10.055 2.970 1.00 0.00 C ATOM 87 C VAL A 86 -7.076 9.577 1.587 1.00 0.00 C ATOM 88 O VAL A 86 -6.139 10.117 0.997 1.00 0.00 O ATOM 89 CB VAL A 86 -6.841 9.167 4.039 1.00 0.00 C ATOM 90 CG1 VAL A 86 -7.082 9.733 5.430 1.00 0.00 C ATOM 91 CG2 VAL A 86 -7.352 7.737 3.940 1.00 0.00 C ATOM 0 HA VAL A 86 -7.183 11.086 3.112 1.00 0.00 H new ATOM 0 HB VAL A 86 -5.766 9.157 3.858 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -6.604 9.092 6.171 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -6.661 10.737 5.492 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -8.154 9.776 5.625 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -6.870 7.125 4.703 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -8.431 7.725 4.093 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -7.121 7.336 2.953 1.00 0.00 H new ATOM 101 N ARG A 87 -7.764 8.561 1.076 1.00 0.00 N ATOM 102 CA ARG A 87 -7.451 8.012 -0.238 1.00 0.00 C ATOM 103 C ARG A 87 -7.633 9.065 -1.327 1.00 0.00 C ATOM 104 O ARG A 87 -6.798 9.197 -2.222 1.00 0.00 O ATOM 105 CB ARG A 87 -8.337 6.799 -0.532 1.00 0.00 C ATOM 106 CG ARG A 87 -7.611 5.678 -1.260 1.00 0.00 C ATOM 107 CD ARG A 87 -8.311 5.308 -2.559 1.00 0.00 C ATOM 108 NE ARG A 87 -9.147 4.118 -2.412 1.00 0.00 N ATOM 109 CZ ARG A 87 -10.093 3.766 -3.279 1.00 0.00 C ATOM 110 NH1 ARG A 87 -10.328 4.507 -4.355 1.00 0.00 N ATOM 111 NH2 ARG A 87 -10.807 2.669 -3.069 1.00 0.00 N ATOM 0 H ARG A 87 -8.541 8.102 1.551 1.00 0.00 H new ATOM 0 HA ARG A 87 -6.407 7.698 -0.233 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -8.735 6.414 0.407 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -9.189 7.119 -1.132 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -6.587 5.985 -1.473 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -7.554 4.802 -0.615 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -8.926 6.145 -2.890 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -7.566 5.134 -3.335 1.00 0.00 H new ATOM 0 HE ARG A 87 -8.996 3.523 -1.597 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -9.782 5.352 -4.521 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -11.055 4.231 -5.015 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -10.631 2.096 -2.244 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -11.533 2.398 -3.733 1.00 0.00 H new ATOM 125 N LEU A 88 -8.730 9.810 -1.245 1.00 0.00 N ATOM 126 CA LEU A 88 -9.021 10.852 -2.224 1.00 0.00 C ATOM 127 C LEU A 88 -7.980 11.965 -2.160 1.00 0.00 C ATOM 128 O LEU A 88 -7.511 12.449 -3.190 1.00 0.00 O ATOM 129 CB LEU A 88 -10.421 11.425 -1.986 1.00 0.00 C ATOM 130 CG LEU A 88 -11.456 11.072 -3.055 1.00 0.00 C ATOM 131 CD1 LEU A 88 -12.153 9.765 -2.712 1.00 0.00 C ATOM 132 CD2 LEU A 88 -12.470 12.196 -3.207 1.00 0.00 C ATOM 0 H LEU A 88 -9.432 9.712 -0.512 1.00 0.00 H new ATOM 0 HA LEU A 88 -8.984 10.406 -3.218 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -10.783 11.070 -1.021 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -10.346 12.510 -1.919 1.00 0.00 H new ATOM 0 HG LEU A 88 -10.939 10.945 -4.006 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -12.886 9.530 -3.484 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -11.416 8.964 -2.655 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -12.657 9.863 -1.751 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -13.199 11.928 -3.972 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -12.982 12.355 -2.258 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -11.957 13.112 -3.500 1.00 0.00 H new ATOM 144 N ASP A 89 -7.628 12.370 -0.944 1.00 0.00 N ATOM 145 CA ASP A 89 -6.651 13.429 -0.744 1.00 0.00 C ATOM 146 C ASP A 89 -5.319 13.078 -1.400 1.00 0.00 C ATOM 147 O ASP A 89 -4.690 13.920 -2.040 1.00 0.00 O ATOM 148 CB ASP A 89 -6.443 13.682 0.750 1.00 0.00 C ATOM 149 CG ASP A 89 -7.393 14.731 1.295 1.00 0.00 C ATOM 150 OD1 ASP A 89 -8.516 14.852 0.759 1.00 0.00 O ATOM 151 OD2 ASP A 89 -7.014 15.432 2.257 1.00 0.00 O ATOM 0 H ASP A 89 -8.007 11.978 -0.082 1.00 0.00 H new ATOM 0 HA ASP A 89 -7.037 14.335 -1.212 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -6.583 12.750 1.297 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -5.415 14.002 0.922 1.00 0.00 H new ATOM 156 N PHE A 90 -4.894 11.829 -1.238 1.00 0.00 N ATOM 157 CA PHE A 90 -3.637 11.368 -1.815 1.00 0.00 C ATOM 158 C PHE A 90 -3.680 11.438 -3.338 1.00 0.00 C ATOM 159 O PHE A 90 -2.720 11.865 -3.977 1.00 0.00 O ATOM 160 CB PHE A 90 -3.342 9.935 -1.367 1.00 0.00 C ATOM 161 CG PHE A 90 -2.041 9.397 -1.891 1.00 0.00 C ATOM 162 CD1 PHE A 90 -0.852 10.068 -1.656 1.00 0.00 C ATOM 163 CD2 PHE A 90 -2.008 8.218 -2.618 1.00 0.00 C ATOM 164 CE1 PHE A 90 0.347 9.575 -2.136 1.00 0.00 C ATOM 165 CE2 PHE A 90 -0.813 7.719 -3.103 1.00 0.00 C ATOM 166 CZ PHE A 90 0.366 8.399 -2.861 1.00 0.00 C ATOM 0 H PHE A 90 -5.402 11.118 -0.712 1.00 0.00 H new ATOM 0 HA PHE A 90 -2.841 12.023 -1.461 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -3.328 9.899 -0.278 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -4.153 9.286 -1.697 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -0.862 10.988 -1.091 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -2.926 7.682 -2.808 1.00 0.00 H new ATOM 0 HE1 PHE A 90 1.267 10.108 -1.945 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -0.801 6.800 -3.670 1.00 0.00 H new ATOM 0 HZ PHE A 90 1.301 8.011 -3.238 1.00 0.00 H new ATOM 176 N LEU A 91 -4.800 11.015 -3.913 1.00 0.00 N ATOM 177 CA LEU A 91 -4.970 11.029 -5.361 1.00 0.00 C ATOM 178 C LEU A 91 -4.847 12.446 -5.911 1.00 0.00 C ATOM 179 O LEU A 91 -4.369 12.650 -7.027 1.00 0.00 O ATOM 180 CB LEU A 91 -6.331 10.436 -5.739 1.00 0.00 C ATOM 181 CG LEU A 91 -6.298 9.412 -6.874 1.00 0.00 C ATOM 182 CD1 LEU A 91 -5.462 8.205 -6.479 1.00 0.00 C ATOM 183 CD2 LEU A 91 -7.710 8.986 -7.247 1.00 0.00 C ATOM 0 H LEU A 91 -5.605 10.658 -3.398 1.00 0.00 H new ATOM 0 HA LEU A 91 -4.180 10.421 -5.802 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -6.762 9.964 -4.856 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -6.998 11.250 -6.023 1.00 0.00 H new ATOM 0 HG LEU A 91 -5.838 9.877 -7.746 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -5.450 7.487 -7.299 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -4.443 8.524 -6.261 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -5.893 7.738 -5.594 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -7.668 8.257 -8.056 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -8.196 8.538 -6.380 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -8.279 9.857 -7.572 1.00 0.00 H new ATOM 195 N ASP A 92 -5.280 13.422 -5.121 1.00 0.00 N ATOM 196 CA ASP A 92 -5.221 14.822 -5.530 1.00 0.00 C ATOM 197 C ASP A 92 -3.775 15.291 -5.671 1.00 0.00 C ATOM 198 O ASP A 92 -3.418 15.945 -6.650 1.00 0.00 O ATOM 199 CB ASP A 92 -5.961 15.701 -4.520 1.00 0.00 C ATOM 200 CG ASP A 92 -6.908 16.678 -5.188 1.00 0.00 C ATOM 201 OD1 ASP A 92 -6.605 17.120 -6.316 1.00 0.00 O ATOM 202 OD2 ASP A 92 -7.953 17.000 -4.584 1.00 0.00 O ATOM 0 H ASP A 92 -5.676 13.270 -4.193 1.00 0.00 H new ATOM 0 HA ASP A 92 -5.706 14.911 -6.502 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -6.522 15.067 -3.833 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -5.235 16.253 -3.923 1.00 0.00 H new ATOM 207 N GLN A 93 -2.948 14.952 -4.687 1.00 0.00 N ATOM 208 CA GLN A 93 -1.541 15.341 -4.704 1.00 0.00 C ATOM 209 C GLN A 93 -0.773 14.555 -5.759 1.00 0.00 C ATOM 210 O GLN A 93 0.169 15.067 -6.366 1.00 0.00 O ATOM 211 CB GLN A 93 -0.906 15.119 -3.327 1.00 0.00 C ATOM 212 CG GLN A 93 -1.821 15.465 -2.162 1.00 0.00 C ATOM 213 CD GLN A 93 -2.459 16.833 -2.302 1.00 0.00 C ATOM 214 OE1 GLN A 93 -1.932 17.710 -2.987 1.00 0.00 O ATOM 215 NE2 GLN A 93 -3.602 17.022 -1.652 1.00 0.00 N ATOM 0 H GLN A 93 -3.226 14.410 -3.869 1.00 0.00 H new ATOM 0 HA GLN A 93 -1.489 16.401 -4.953 1.00 0.00 H new ATOM 0 HB2 GLN A 93 -0.604 14.075 -3.241 1.00 0.00 H new ATOM 0 HB3 GLN A 93 0.001 15.720 -3.255 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -2.604 14.710 -2.084 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -1.250 15.429 -1.234 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -4.003 16.267 -1.096 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -4.078 17.922 -1.709 1.00 0.00 H new ATOM 224 N LEU A 94 -1.180 13.309 -5.975 1.00 0.00 N ATOM 225 CA LEU A 94 -0.529 12.450 -6.956 1.00 0.00 C ATOM 226 C LEU A 94 -0.755 12.971 -8.373 1.00 0.00 C ATOM 227 O LEU A 94 0.192 13.132 -9.144 1.00 0.00 O ATOM 228 CB LEU A 94 -1.052 11.019 -6.838 1.00 0.00 C ATOM 229 CG LEU A 94 -0.347 9.993 -7.728 1.00 0.00 C ATOM 230 CD1 LEU A 94 0.935 9.506 -7.070 1.00 0.00 C ATOM 231 CD2 LEU A 94 -1.273 8.824 -8.028 1.00 0.00 C ATOM 0 H LEU A 94 -1.959 12.871 -5.483 1.00 0.00 H new ATOM 0 HA LEU A 94 0.542 12.457 -6.753 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -0.960 10.700 -5.800 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -2.115 11.016 -7.079 1.00 0.00 H new ATOM 0 HG LEU A 94 -0.086 10.475 -8.670 1.00 0.00 H new ATOM 0 HD11 LEU A 94 1.422 8.777 -7.718 1.00 0.00 H new ATOM 0 HD12 LEU A 94 1.604 10.351 -6.907 1.00 0.00 H new ATOM 0 HD13 LEU A 94 0.699 9.040 -6.113 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -0.756 8.104 -8.662 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -1.565 8.342 -7.095 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -2.163 9.187 -8.542 1.00 0.00 H new ATOM 243 N ALA A 95 -2.014 13.231 -8.708 1.00 0.00 N ATOM 244 CA ALA A 95 -2.365 13.732 -10.032 1.00 0.00 C ATOM 245 C ALA A 95 -1.886 15.167 -10.227 1.00 0.00 C ATOM 246 O ALA A 95 -1.460 15.547 -11.317 1.00 0.00 O ATOM 247 CB ALA A 95 -3.867 13.642 -10.248 1.00 0.00 C ATOM 0 H ALA A 95 -2.808 13.103 -8.081 1.00 0.00 H new ATOM 0 HA ALA A 95 -1.863 13.108 -10.771 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -4.115 14.019 -11.240 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -4.185 12.603 -10.165 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -4.379 14.240 -9.494 1.00 0.00 H new ATOM 253 N LYS A 96 -1.963 15.961 -9.165 1.00 0.00 N ATOM 254 CA LYS A 96 -1.542 17.357 -9.221 1.00 0.00 C ATOM 255 C LYS A 96 -0.033 17.469 -9.425 1.00 0.00 C ATOM 256 O LYS A 96 0.438 18.314 -10.184 1.00 0.00 O ATOM 257 CB LYS A 96 -1.949 18.084 -7.938 1.00 0.00 C ATOM 258 CG LYS A 96 -3.430 18.413 -7.871 1.00 0.00 C ATOM 259 CD LYS A 96 -3.836 18.870 -6.478 1.00 0.00 C ATOM 260 CE LYS A 96 -3.891 20.386 -6.385 1.00 0.00 C ATOM 261 NZ LYS A 96 -5.005 20.953 -7.194 1.00 0.00 N ATOM 0 H LYS A 96 -2.313 15.662 -8.255 1.00 0.00 H new ATOM 0 HA LYS A 96 -2.038 17.824 -10.072 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -1.683 17.466 -7.080 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -1.376 19.007 -7.856 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -3.663 19.194 -8.594 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -4.012 17.535 -8.151 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -4.811 18.453 -6.227 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -3.126 18.485 -5.746 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -4.013 20.681 -5.343 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -2.945 20.805 -6.727 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -5.261 21.890 -6.823 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -4.703 21.044 -8.185 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -5.830 20.322 -7.140 1.00 0.00 H new ATOM 275 N PHE A 97 0.718 16.614 -8.738 1.00 0.00 N ATOM 276 CA PHE A 97 2.173 16.621 -8.841 1.00 0.00 C ATOM 277 C PHE A 97 2.627 16.247 -10.249 1.00 0.00 C ATOM 278 O PHE A 97 3.458 16.931 -10.846 1.00 0.00 O ATOM 279 CB PHE A 97 2.783 15.656 -7.826 1.00 0.00 C ATOM 280 CG PHE A 97 4.284 15.687 -7.793 1.00 0.00 C ATOM 281 CD1 PHE A 97 5.026 14.905 -8.662 1.00 0.00 C ATOM 282 CD2 PHE A 97 4.954 16.503 -6.892 1.00 0.00 C ATOM 283 CE1 PHE A 97 6.407 14.931 -8.634 1.00 0.00 C ATOM 284 CE2 PHE A 97 6.335 16.533 -6.860 1.00 0.00 C ATOM 285 CZ PHE A 97 7.062 15.748 -7.732 1.00 0.00 C ATOM 0 H PHE A 97 0.343 15.908 -8.104 1.00 0.00 H new ATOM 0 HA PHE A 97 2.518 17.632 -8.626 1.00 0.00 H new ATOM 0 HB2 PHE A 97 2.401 15.896 -6.834 1.00 0.00 H new ATOM 0 HB3 PHE A 97 2.454 14.643 -8.057 1.00 0.00 H new ATOM 0 HD1 PHE A 97 4.519 14.267 -9.370 1.00 0.00 H new ATOM 0 HD2 PHE A 97 4.390 17.121 -6.209 1.00 0.00 H new ATOM 0 HE1 PHE A 97 6.974 14.314 -9.316 1.00 0.00 H new ATOM 0 HE2 PHE A 97 6.845 17.170 -6.153 1.00 0.00 H new ATOM 0 HZ PHE A 97 8.141 15.772 -7.709 1.00 0.00 H new ATOM 295 N TRP A 98 2.079 15.156 -10.773 1.00 0.00 N ATOM 296 CA TRP A 98 2.432 14.690 -12.109 1.00 0.00 C ATOM 297 C TRP A 98 1.980 15.683 -13.174 1.00 0.00 C ATOM 298 O TRP A 98 2.644 15.856 -14.197 1.00 0.00 O ATOM 299 CB TRP A 98 1.811 13.319 -12.376 1.00 0.00 C ATOM 300 CG TRP A 98 2.621 12.185 -11.824 1.00 0.00 C ATOM 301 CD1 TRP A 98 2.335 11.430 -10.722 1.00 0.00 C ATOM 302 CD2 TRP A 98 3.856 11.679 -12.345 1.00 0.00 C ATOM 303 NE1 TRP A 98 3.312 10.488 -10.529 1.00 0.00 N ATOM 304 CE2 TRP A 98 4.256 10.621 -11.511 1.00 0.00 C ATOM 305 CE3 TRP A 98 4.663 12.018 -13.436 1.00 0.00 C ATOM 306 CZ2 TRP A 98 5.422 9.898 -11.730 1.00 0.00 C ATOM 307 CZ3 TRP A 98 5.823 11.298 -13.655 1.00 0.00 C ATOM 308 CH2 TRP A 98 6.193 10.248 -12.805 1.00 0.00 C ATOM 0 H TRP A 98 1.389 14.578 -10.293 1.00 0.00 H new ATOM 0 HA TRP A 98 3.518 14.605 -12.158 1.00 0.00 H new ATOM 0 HB2 TRP A 98 0.812 13.289 -11.941 1.00 0.00 H new ATOM 0 HB3 TRP A 98 1.694 13.184 -13.451 1.00 0.00 H new ATOM 0 HD1 TRP A 98 1.466 11.557 -10.094 1.00 0.00 H new ATOM 0 HE1 TRP A 98 3.332 9.800 -9.776 1.00 0.00 H new ATOM 0 HE3 TRP A 98 4.385 12.827 -14.095 1.00 0.00 H new ATOM 0 HZ2 TRP A 98 5.710 9.089 -11.075 1.00 0.00 H new ATOM 0 HZ3 TRP A 98 6.454 11.549 -14.495 1.00 0.00 H new ATOM 0 HH2 TRP A 98 7.105 9.704 -13.002 1.00 0.00 H new ATOM 319 N GLU A 99 0.849 16.336 -12.930 1.00 0.00 N ATOM 320 CA GLU A 99 0.310 17.309 -13.869 1.00 0.00 C ATOM 321 C GLU A 99 1.331 18.400 -14.174 1.00 0.00 C ATOM 322 O GLU A 99 1.494 18.808 -15.323 1.00 0.00 O ATOM 323 CB GLU A 99 -0.971 17.933 -13.311 1.00 0.00 C ATOM 324 CG GLU A 99 -1.805 18.651 -14.359 1.00 0.00 C ATOM 325 CD GLU A 99 -3.133 19.138 -13.813 1.00 0.00 C ATOM 326 OE1 GLU A 99 -3.147 20.186 -13.134 1.00 0.00 O ATOM 327 OE2 GLU A 99 -4.158 18.471 -14.066 1.00 0.00 O ATOM 0 H GLU A 99 0.288 16.208 -12.088 1.00 0.00 H new ATOM 0 HA GLU A 99 0.078 16.788 -14.798 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -1.575 17.151 -12.851 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -0.708 18.638 -12.522 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -1.242 19.500 -14.747 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -1.986 17.979 -15.198 1.00 0.00 H new ATOM 334 N LEU A 100 2.019 18.868 -13.136 1.00 0.00 N ATOM 335 CA LEU A 100 3.026 19.911 -13.294 1.00 0.00 C ATOM 336 C LEU A 100 4.125 19.463 -14.252 1.00 0.00 C ATOM 337 O LEU A 100 4.617 20.252 -15.059 1.00 0.00 O ATOM 338 CB LEU A 100 3.633 20.272 -11.936 1.00 0.00 C ATOM 339 CG LEU A 100 2.626 20.724 -10.876 1.00 0.00 C ATOM 340 CD1 LEU A 100 3.276 20.750 -9.501 1.00 0.00 C ATOM 341 CD2 LEU A 100 2.061 22.092 -11.227 1.00 0.00 C ATOM 0 H LEU A 100 1.897 18.541 -12.177 1.00 0.00 H new ATOM 0 HA LEU A 100 2.540 20.792 -13.713 1.00 0.00 H new ATOM 0 HB2 LEU A 100 4.174 19.406 -11.555 1.00 0.00 H new ATOM 0 HB3 LEU A 100 4.365 21.066 -12.082 1.00 0.00 H new ATOM 0 HG LEU A 100 1.804 20.009 -10.854 1.00 0.00 H new ATOM 0 HD11 LEU A 100 2.546 21.074 -8.759 1.00 0.00 H new ATOM 0 HD12 LEU A 100 3.632 19.751 -9.248 1.00 0.00 H new ATOM 0 HD13 LEU A 100 4.117 21.444 -9.509 1.00 0.00 H new ATOM 0 HD21 LEU A 100 1.347 22.398 -10.463 1.00 0.00 H new ATOM 0 HD22 LEU A 100 2.872 22.819 -11.277 1.00 0.00 H new ATOM 0 HD23 LEU A 100 1.559 22.041 -12.193 1.00 0.00 H new ATOM 353 N GLN A 101 4.502 18.194 -14.157 1.00 0.00 N ATOM 354 CA GLN A 101 5.541 17.637 -15.017 1.00 0.00 C ATOM 355 C GLN A 101 5.144 17.743 -16.483 1.00 0.00 C ATOM 356 O GLN A 101 5.947 18.128 -17.332 1.00 0.00 O ATOM 357 CB GLN A 101 5.800 16.173 -14.656 1.00 0.00 C ATOM 358 CG GLN A 101 6.673 15.993 -13.428 1.00 0.00 C ATOM 359 CD GLN A 101 5.975 16.411 -12.149 1.00 0.00 C ATOM 360 OE1 GLN A 101 5.474 15.574 -11.398 1.00 0.00 O ATOM 361 NE2 GLN A 101 5.940 17.714 -11.892 1.00 0.00 N ATOM 0 H GLN A 101 4.104 17.530 -13.493 1.00 0.00 H new ATOM 0 HA GLN A 101 6.454 18.211 -14.861 1.00 0.00 H new ATOM 0 HB2 GLN A 101 4.845 15.675 -14.488 1.00 0.00 H new ATOM 0 HB3 GLN A 101 6.274 15.677 -15.503 1.00 0.00 H new ATOM 0 HG2 GLN A 101 6.972 14.948 -13.349 1.00 0.00 H new ATOM 0 HG3 GLN A 101 7.586 16.577 -13.547 1.00 0.00 H new ATOM 0 HE21 GLN A 101 6.368 18.374 -12.542 1.00 0.00 H new ATOM 0 HE22 GLN A 101 5.485 18.055 -11.045 1.00 0.00 H new ATOM 370 N GLY A 102 3.895 17.396 -16.773 1.00 0.00 N ATOM 371 CA GLY A 102 3.402 17.453 -18.133 1.00 0.00 C ATOM 372 C GLY A 102 3.056 16.080 -18.679 1.00 0.00 C ATOM 373 O GLY A 102 3.035 15.874 -19.893 1.00 0.00 O ATOM 0 H GLY A 102 3.213 17.075 -16.085 1.00 0.00 H new ATOM 0 HA2 GLY A 102 2.518 18.089 -18.170 1.00 0.00 H new ATOM 0 HA3 GLY A 102 4.155 17.916 -18.771 1.00 0.00 H new ATOM 377 N SER A 103 2.784 15.140 -17.780 1.00 0.00 N ATOM 378 CA SER A 103 2.439 13.781 -18.173 1.00 0.00 C ATOM 379 C SER A 103 0.956 13.503 -17.939 1.00 0.00 C ATOM 380 O SER A 103 0.384 12.596 -18.544 1.00 0.00 O ATOM 381 CB SER A 103 3.289 12.773 -17.396 1.00 0.00 C ATOM 382 OG SER A 103 3.821 11.782 -18.258 1.00 0.00 O ATOM 0 H SER A 103 2.796 15.296 -16.772 1.00 0.00 H new ATOM 0 HA SER A 103 2.644 13.675 -19.238 1.00 0.00 H new ATOM 0 HB2 SER A 103 4.102 13.293 -16.889 1.00 0.00 H new ATOM 0 HB3 SER A 103 2.682 12.300 -16.624 1.00 0.00 H new ATOM 0 HG SER A 103 4.361 11.151 -17.737 1.00 0.00 H new ATOM 388 N THR A 104 0.337 14.294 -17.063 1.00 0.00 N ATOM 389 CA THR A 104 -1.077 14.142 -16.752 1.00 0.00 C ATOM 390 C THR A 104 -1.367 12.759 -16.173 1.00 0.00 C ATOM 391 O THR A 104 -1.016 11.738 -16.764 1.00 0.00 O ATOM 392 CB THR A 104 -1.935 14.396 -17.995 1.00 0.00 C ATOM 393 OG1 THR A 104 -2.398 13.181 -18.556 1.00 0.00 O ATOM 394 CG2 THR A 104 -1.218 15.161 -19.088 1.00 0.00 C ATOM 0 H THR A 104 0.799 15.049 -16.556 1.00 0.00 H new ATOM 0 HA THR A 104 -1.335 14.884 -15.997 1.00 0.00 H new ATOM 0 HB THR A 104 -2.765 15.005 -17.636 1.00 0.00 H new ATOM 0 HG1 THR A 104 -1.662 12.534 -18.589 1.00 0.00 H new ATOM 0 HG21 THR A 104 -1.890 15.302 -19.935 1.00 0.00 H new ATOM 0 HG22 THR A 104 -0.906 16.133 -18.707 1.00 0.00 H new ATOM 0 HG23 THR A 104 -0.341 14.599 -19.410 1.00 0.00 H new ATOM 402 N LEU A 105 -2.010 12.738 -15.012 1.00 0.00 N ATOM 403 CA LEU A 105 -2.347 11.486 -14.348 1.00 0.00 C ATOM 404 C LEU A 105 -3.639 10.901 -14.908 1.00 0.00 C ATOM 405 O LEU A 105 -4.638 11.605 -15.060 1.00 0.00 O ATOM 406 CB LEU A 105 -2.483 11.707 -12.839 1.00 0.00 C ATOM 407 CG LEU A 105 -2.720 10.437 -12.017 1.00 0.00 C ATOM 408 CD1 LEU A 105 -1.896 10.465 -10.739 1.00 0.00 C ATOM 409 CD2 LEU A 105 -4.198 10.277 -11.697 1.00 0.00 C ATOM 0 H LEU A 105 -2.309 13.575 -14.511 1.00 0.00 H new ATOM 0 HA LEU A 105 -1.541 10.776 -14.534 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -1.578 12.193 -12.475 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -3.309 12.396 -12.661 1.00 0.00 H new ATOM 0 HG LEU A 105 -2.402 9.580 -12.610 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -2.078 9.554 -10.169 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -0.837 10.530 -10.990 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -2.181 11.331 -10.141 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -4.348 9.369 -11.112 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -4.542 11.138 -11.124 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -4.766 10.209 -12.625 1.00 0.00 H new ATOM 421 N LYS A 106 -3.610 9.608 -15.212 1.00 0.00 N ATOM 422 CA LYS A 106 -4.777 8.920 -15.754 1.00 0.00 C ATOM 423 C LYS A 106 -5.149 7.723 -14.887 1.00 0.00 C ATOM 424 O LYS A 106 -4.289 6.921 -14.521 1.00 0.00 O ATOM 425 CB LYS A 106 -4.504 8.465 -17.189 1.00 0.00 C ATOM 426 CG LYS A 106 -3.899 9.548 -18.068 1.00 0.00 C ATOM 427 CD LYS A 106 -4.494 9.531 -19.466 1.00 0.00 C ATOM 428 CE LYS A 106 -4.700 10.940 -20.002 1.00 0.00 C ATOM 429 NZ LYS A 106 -4.929 10.947 -21.473 1.00 0.00 N ATOM 0 H LYS A 106 -2.790 9.014 -15.092 1.00 0.00 H new ATOM 0 HA LYS A 106 -5.615 9.617 -15.757 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -3.830 7.608 -17.167 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -5.438 8.125 -17.637 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -4.067 10.524 -17.612 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -2.820 9.407 -18.129 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -3.835 8.978 -20.136 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -5.448 9.004 -19.450 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -5.552 11.398 -19.500 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -3.827 11.549 -19.768 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -5.065 11.925 -21.799 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -4.105 10.533 -21.955 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -5.777 10.387 -21.695 1.00 0.00 H new ATOM 443 N ILE A 107 -6.432 7.609 -14.559 1.00 0.00 N ATOM 444 CA ILE A 107 -6.916 6.511 -13.732 1.00 0.00 C ATOM 445 C ILE A 107 -7.484 5.380 -14.590 1.00 0.00 C ATOM 446 O ILE A 107 -8.621 5.460 -15.055 1.00 0.00 O ATOM 447 CB ILE A 107 -8.002 6.986 -12.748 1.00 0.00 C ATOM 448 CG1 ILE A 107 -7.537 8.244 -12.009 1.00 0.00 C ATOM 449 CG2 ILE A 107 -8.344 5.880 -11.760 1.00 0.00 C ATOM 450 CD1 ILE A 107 -8.670 9.031 -11.386 1.00 0.00 C ATOM 0 H ILE A 107 -7.155 8.265 -14.854 1.00 0.00 H new ATOM 0 HA ILE A 107 -6.060 6.140 -13.168 1.00 0.00 H new ATOM 0 HB ILE A 107 -8.901 7.231 -13.313 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -6.832 7.958 -11.229 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -6.998 8.887 -12.705 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -9.113 6.232 -11.072 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -8.713 5.009 -12.302 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -7.452 5.606 -11.198 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -8.268 9.908 -10.879 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -9.364 9.348 -12.164 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -9.195 8.404 -10.665 1.00 0.00 H new ATOM 462 N PRO A 108 -6.702 4.307 -14.810 1.00 0.00 N ATOM 463 CA PRO A 108 -7.141 3.163 -15.616 1.00 0.00 C ATOM 464 C PRO A 108 -8.194 2.321 -14.903 1.00 0.00 C ATOM 465 O PRO A 108 -8.494 2.548 -13.730 1.00 0.00 O ATOM 466 CB PRO A 108 -5.859 2.354 -15.810 1.00 0.00 C ATOM 467 CG PRO A 108 -5.024 2.688 -14.623 1.00 0.00 C ATOM 468 CD PRO A 108 -5.330 4.123 -14.295 1.00 0.00 C ATOM 0 HA PRO A 108 -7.610 3.479 -16.548 1.00 0.00 H new ATOM 0 HB2 PRO A 108 -6.068 1.285 -15.860 1.00 0.00 H new ATOM 0 HB3 PRO A 108 -5.356 2.624 -16.738 1.00 0.00 H new ATOM 0 HG2 PRO A 108 -5.261 2.036 -13.782 1.00 0.00 H new ATOM 0 HG3 PRO A 108 -3.964 2.554 -14.841 1.00 0.00 H new ATOM 0 HD2 PRO A 108 -5.275 4.311 -13.223 1.00 0.00 H new ATOM 0 HD3 PRO A 108 -4.626 4.804 -14.774 1.00 0.00 H new ATOM 476 N VAL A 109 -8.749 1.349 -15.618 1.00 0.00 N ATOM 477 CA VAL A 109 -9.766 0.469 -15.053 1.00 0.00 C ATOM 478 C VAL A 109 -9.364 -0.993 -15.199 1.00 0.00 C ATOM 479 O VAL A 109 -9.317 -1.529 -16.306 1.00 0.00 O ATOM 480 CB VAL A 109 -11.135 0.684 -15.728 1.00 0.00 C ATOM 481 CG1 VAL A 109 -12.218 -0.095 -14.998 1.00 0.00 C ATOM 482 CG2 VAL A 109 -11.477 2.165 -15.781 1.00 0.00 C ATOM 0 H VAL A 109 -8.512 1.150 -16.590 1.00 0.00 H new ATOM 0 HA VAL A 109 -9.850 0.718 -13.995 1.00 0.00 H new ATOM 0 HB VAL A 109 -11.078 0.311 -16.751 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -13.177 0.069 -15.489 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -11.977 -1.158 -15.017 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -12.276 0.245 -13.964 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -12.447 2.298 -16.261 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -11.515 2.566 -14.768 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -10.714 2.694 -16.352 1.00 0.00 H new ATOM 492 N VAL A 110 -9.072 -1.636 -14.072 1.00 0.00 N ATOM 493 CA VAL A 110 -8.672 -3.037 -14.074 1.00 0.00 C ATOM 494 C VAL A 110 -9.786 -3.929 -13.538 1.00 0.00 C ATOM 495 O VAL A 110 -10.359 -3.655 -12.484 1.00 0.00 O ATOM 496 CB VAL A 110 -7.402 -3.261 -13.230 1.00 0.00 C ATOM 497 CG1 VAL A 110 -6.884 -4.681 -13.412 1.00 0.00 C ATOM 498 CG2 VAL A 110 -6.331 -2.244 -13.593 1.00 0.00 C ATOM 0 H VAL A 110 -9.105 -1.208 -13.147 1.00 0.00 H new ATOM 0 HA VAL A 110 -8.463 -3.303 -15.110 1.00 0.00 H new ATOM 0 HB VAL A 110 -7.658 -3.123 -12.179 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -5.987 -4.821 -12.809 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -7.649 -5.391 -13.096 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -6.645 -4.849 -14.462 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -5.443 -2.419 -12.986 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -6.076 -2.345 -14.648 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -6.706 -1.238 -13.405 1.00 0.00 H new ATOM 508 N GLU A 111 -10.088 -4.995 -14.270 1.00 0.00 N ATOM 509 CA GLU A 111 -11.135 -5.928 -13.868 1.00 0.00 C ATOM 510 C GLU A 111 -12.483 -5.223 -13.778 1.00 0.00 C ATOM 511 O GLU A 111 -13.304 -5.539 -12.917 1.00 0.00 O ATOM 512 CB GLU A 111 -10.789 -6.567 -12.523 1.00 0.00 C ATOM 513 CG GLU A 111 -9.460 -7.307 -12.525 1.00 0.00 C ATOM 514 CD GLU A 111 -9.370 -8.341 -13.630 1.00 0.00 C ATOM 515 OE1 GLU A 111 -10.427 -8.869 -14.035 1.00 0.00 O ATOM 516 OE2 GLU A 111 -8.245 -8.622 -14.091 1.00 0.00 O ATOM 0 H GLU A 111 -9.623 -5.235 -15.145 1.00 0.00 H new ATOM 0 HA GLU A 111 -11.203 -6.709 -14.625 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -10.762 -5.791 -11.758 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -11.582 -7.262 -12.245 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -8.648 -6.588 -12.638 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -9.320 -7.797 -11.562 1.00 0.00 H new ATOM 523 N ARG A 112 -12.704 -4.264 -14.673 1.00 0.00 N ATOM 524 CA ARG A 112 -13.955 -3.513 -14.695 1.00 0.00 C ATOM 525 C ARG A 112 -14.171 -2.782 -13.375 1.00 0.00 C ATOM 526 O ARG A 112 -15.307 -2.612 -12.928 1.00 0.00 O ATOM 527 CB ARG A 112 -15.132 -4.449 -14.971 1.00 0.00 C ATOM 528 CG ARG A 112 -16.241 -3.804 -15.787 1.00 0.00 C ATOM 529 CD ARG A 112 -16.388 -4.457 -17.154 1.00 0.00 C ATOM 530 NE ARG A 112 -17.595 -5.274 -17.241 1.00 0.00 N ATOM 531 CZ ARG A 112 -18.147 -5.660 -18.390 1.00 0.00 C ATOM 532 NH1 ARG A 112 -17.602 -5.307 -19.548 1.00 0.00 N ATOM 533 NH2 ARG A 112 -19.245 -6.403 -18.380 1.00 0.00 N ATOM 0 H ARG A 112 -12.034 -3.989 -15.391 1.00 0.00 H new ATOM 0 HA ARG A 112 -13.893 -2.774 -15.494 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -14.769 -5.331 -15.499 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -15.543 -4.793 -14.022 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -17.183 -3.880 -15.244 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -16.030 -2.742 -15.912 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -16.416 -3.686 -17.924 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -15.515 -5.077 -17.356 1.00 0.00 H new ATOM 0 HE ARG A 112 -18.041 -5.566 -16.372 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -16.756 -4.737 -19.561 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -18.029 -5.606 -20.425 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -19.666 -6.679 -17.493 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -19.668 -6.699 -19.259 1.00 0.00 H new ATOM 547 N LYS A 113 -13.079 -2.349 -12.756 1.00 0.00 N ATOM 548 CA LYS A 113 -13.152 -1.633 -11.488 1.00 0.00 C ATOM 549 C LYS A 113 -11.918 -0.760 -11.283 1.00 0.00 C ATOM 550 O LYS A 113 -10.900 -0.937 -11.954 1.00 0.00 O ATOM 551 CB LYS A 113 -13.294 -2.623 -10.328 1.00 0.00 C ATOM 552 CG LYS A 113 -14.622 -2.516 -9.598 1.00 0.00 C ATOM 553 CD LYS A 113 -14.452 -2.704 -8.099 1.00 0.00 C ATOM 554 CE LYS A 113 -15.728 -2.364 -7.345 1.00 0.00 C ATOM 555 NZ LYS A 113 -16.463 -3.587 -6.918 1.00 0.00 N ATOM 0 H LYS A 113 -12.132 -2.481 -13.112 1.00 0.00 H new ATOM 0 HA LYS A 113 -14.029 -0.986 -11.513 1.00 0.00 H new ATOM 0 HB2 LYS A 113 -13.180 -3.637 -10.711 1.00 0.00 H new ATOM 0 HB3 LYS A 113 -12.484 -2.457 -9.618 1.00 0.00 H new ATOM 0 HG2 LYS A 113 -15.069 -1.541 -9.795 1.00 0.00 H new ATOM 0 HG3 LYS A 113 -15.312 -3.267 -9.984 1.00 0.00 H new ATOM 0 HD2 LYS A 113 -14.169 -3.736 -7.891 1.00 0.00 H new ATOM 0 HD3 LYS A 113 -13.638 -2.072 -7.742 1.00 0.00 H new ATOM 0 HE2 LYS A 113 -15.483 -1.763 -6.469 1.00 0.00 H new ATOM 0 HE3 LYS A 113 -16.373 -1.755 -7.979 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 -17.327 -3.313 -6.408 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 -16.719 -4.148 -7.755 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 -15.857 -4.156 -6.293 1.00 0.00 H new ATOM 569 N ILE A 114 -12.015 0.183 -10.351 1.00 0.00 N ATOM 570 CA ILE A 114 -10.908 1.085 -10.058 1.00 0.00 C ATOM 571 C ILE A 114 -9.804 0.363 -9.291 1.00 0.00 C ATOM 572 O ILE A 114 -10.055 -0.260 -8.260 1.00 0.00 O ATOM 573 CB ILE A 114 -11.376 2.303 -9.236 1.00 0.00 C ATOM 574 CG1 ILE A 114 -12.589 2.960 -9.901 1.00 0.00 C ATOM 575 CG2 ILE A 114 -10.243 3.306 -9.082 1.00 0.00 C ATOM 576 CD1 ILE A 114 -13.654 3.395 -8.918 1.00 0.00 C ATOM 0 H ILE A 114 -12.849 0.342 -9.786 1.00 0.00 H new ATOM 0 HA ILE A 114 -10.519 1.432 -11.015 1.00 0.00 H new ATOM 0 HB ILE A 114 -11.670 1.961 -8.244 1.00 0.00 H new ATOM 0 HG12 ILE A 114 -12.256 3.827 -10.471 1.00 0.00 H new ATOM 0 HG13 ILE A 114 -13.027 2.260 -10.613 1.00 0.00 H new ATOM 0 HG21 ILE A 114 -10.589 4.160 -8.500 1.00 0.00 H new ATOM 0 HG22 ILE A 114 -9.405 2.833 -8.569 1.00 0.00 H new ATOM 0 HG23 ILE A 114 -9.921 3.645 -10.067 1.00 0.00 H new ATOM 0 HD11 ILE A 114 -14.483 3.852 -9.458 1.00 0.00 H new ATOM 0 HD12 ILE A 114 -14.015 2.528 -8.365 1.00 0.00 H new ATOM 0 HD13 ILE A 114 -13.232 4.119 -8.221 1.00 0.00 H new ATOM 588 N LEU A 115 -8.581 0.451 -9.803 1.00 0.00 N ATOM 589 CA LEU A 115 -7.438 -0.195 -9.167 1.00 0.00 C ATOM 590 C LEU A 115 -6.882 0.670 -8.041 1.00 0.00 C ATOM 591 O LEU A 115 -6.658 1.867 -8.217 1.00 0.00 O ATOM 592 CB LEU A 115 -6.344 -0.475 -10.199 1.00 0.00 C ATOM 593 CG LEU A 115 -5.063 -1.095 -9.630 1.00 0.00 C ATOM 594 CD1 LEU A 115 -4.780 -2.440 -10.285 1.00 0.00 C ATOM 595 CD2 LEU A 115 -3.884 -0.152 -9.817 1.00 0.00 C ATOM 0 H LEU A 115 -8.356 0.963 -10.656 1.00 0.00 H new ATOM 0 HA LEU A 115 -7.776 -1.140 -8.742 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -6.746 -1.143 -10.961 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -6.087 0.460 -10.698 1.00 0.00 H new ATOM 0 HG LEU A 115 -5.208 -1.258 -8.562 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -3.867 -2.863 -9.867 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -5.613 -3.118 -10.098 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -4.658 -2.303 -11.359 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -2.984 -0.609 -9.407 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -3.740 0.044 -10.879 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -4.083 0.786 -9.299 1.00 0.00 H new ATOM 607 N ASP A 116 -6.661 0.056 -6.883 1.00 0.00 N ATOM 608 CA ASP A 116 -6.130 0.769 -5.728 1.00 0.00 C ATOM 609 C ASP A 116 -4.719 1.278 -6.005 1.00 0.00 C ATOM 610 O ASP A 116 -4.097 0.902 -6.999 1.00 0.00 O ATOM 611 CB ASP A 116 -6.123 -0.139 -4.498 1.00 0.00 C ATOM 612 CG ASP A 116 -6.122 0.643 -3.199 1.00 0.00 C ATOM 613 OD1 ASP A 116 -5.037 1.098 -2.781 1.00 0.00 O ATOM 614 OD2 ASP A 116 -7.208 0.801 -2.601 1.00 0.00 O ATOM 0 H ASP A 116 -6.842 -0.935 -6.720 1.00 0.00 H new ATOM 0 HA ASP A 116 -6.776 1.625 -5.534 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -6.997 -0.790 -4.526 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -5.245 -0.783 -4.531 1.00 0.00 H new ATOM 619 N LEU A 117 -4.218 2.135 -5.121 1.00 0.00 N ATOM 620 CA LEU A 117 -2.879 2.694 -5.273 1.00 0.00 C ATOM 621 C LEU A 117 -2.178 2.803 -3.923 1.00 0.00 C ATOM 622 O LEU A 117 -1.110 2.224 -3.720 1.00 0.00 O ATOM 623 CB LEU A 117 -2.951 4.071 -5.936 1.00 0.00 C ATOM 624 CG LEU A 117 -3.475 4.072 -7.374 1.00 0.00 C ATOM 625 CD1 LEU A 117 -4.167 5.389 -7.688 1.00 0.00 C ATOM 626 CD2 LEU A 117 -2.341 3.816 -8.355 1.00 0.00 C ATOM 0 H LEU A 117 -4.718 2.457 -4.293 1.00 0.00 H new ATOM 0 HA LEU A 117 -2.302 2.022 -5.908 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -3.590 4.715 -5.332 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -1.955 4.513 -5.928 1.00 0.00 H new ATOM 0 HG LEU A 117 -4.204 3.268 -7.476 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -4.533 5.372 -8.714 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -5.005 5.531 -7.006 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -3.459 6.209 -7.569 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -2.732 3.820 -9.372 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -1.588 4.597 -8.253 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -1.889 2.847 -8.144 1.00 0.00 H new ATOM 638 N TYR A 118 -2.782 3.548 -3.005 1.00 0.00 N ATOM 639 CA TYR A 118 -2.214 3.733 -1.673 1.00 0.00 C ATOM 640 C TYR A 118 -2.041 2.392 -0.968 1.00 0.00 C ATOM 641 O TYR A 118 -0.963 2.081 -0.458 1.00 0.00 O ATOM 642 CB TYR A 118 -3.109 4.651 -0.839 1.00 0.00 C ATOM 643 CG TYR A 118 -2.389 5.324 0.307 1.00 0.00 C ATOM 644 CD1 TYR A 118 -1.810 4.575 1.324 1.00 0.00 C ATOM 645 CD2 TYR A 118 -2.290 6.708 0.374 1.00 0.00 C ATOM 646 CE1 TYR A 118 -1.152 5.187 2.375 1.00 0.00 C ATOM 647 CE2 TYR A 118 -1.635 7.327 1.421 1.00 0.00 C ATOM 648 CZ TYR A 118 -1.068 6.562 2.419 1.00 0.00 C ATOM 649 OH TYR A 118 -0.414 7.174 3.463 1.00 0.00 O ATOM 0 H TYR A 118 -3.665 4.034 -3.158 1.00 0.00 H new ATOM 0 HA TYR A 118 -1.233 4.196 -1.781 1.00 0.00 H new ATOM 0 HB2 TYR A 118 -3.535 5.416 -1.488 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -3.941 4.070 -0.442 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -1.875 3.497 1.293 1.00 0.00 H new ATOM 0 HD2 TYR A 118 -2.733 7.310 -0.406 1.00 0.00 H new ATOM 0 HE1 TYR A 118 -0.706 4.591 3.157 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -1.567 8.404 1.458 1.00 0.00 H new ATOM 0 HH TYR A 118 -0.444 8.146 3.343 1.00 0.00 H new ATOM 659 N ALA A 119 -3.109 1.603 -0.939 1.00 0.00 N ATOM 660 CA ALA A 119 -3.081 0.300 -0.298 1.00 0.00 C ATOM 661 C ALA A 119 -2.106 -0.640 -0.995 1.00 0.00 C ATOM 662 O ALA A 119 -1.402 -1.414 -0.345 1.00 0.00 O ATOM 663 CB ALA A 119 -4.478 -0.306 -0.278 1.00 0.00 C ATOM 0 H ALA A 119 -4.008 1.847 -1.355 1.00 0.00 H new ATOM 0 HA ALA A 119 -2.738 0.437 0.727 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -4.444 -1.283 0.205 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -5.151 0.349 0.275 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -4.840 -0.419 -1.300 1.00 0.00 H new ATOM 669 N LEU A 120 -2.070 -0.572 -2.321 1.00 0.00 N ATOM 670 CA LEU A 120 -1.182 -1.420 -3.109 1.00 0.00 C ATOM 671 C LEU A 120 0.281 -1.118 -2.802 1.00 0.00 C ATOM 672 O LEU A 120 1.101 -2.029 -2.685 1.00 0.00 O ATOM 673 CB LEU A 120 -1.451 -1.226 -4.602 1.00 0.00 C ATOM 674 CG LEU A 120 -0.639 -2.131 -5.530 1.00 0.00 C ATOM 675 CD1 LEU A 120 -0.942 -3.595 -5.249 1.00 0.00 C ATOM 676 CD2 LEU A 120 -0.925 -1.794 -6.985 1.00 0.00 C ATOM 0 H LEU A 120 -2.646 0.062 -2.874 1.00 0.00 H new ATOM 0 HA LEU A 120 -1.382 -2.457 -2.840 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -2.511 -1.397 -4.790 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -1.245 -0.187 -4.861 1.00 0.00 H new ATOM 0 HG LEU A 120 0.420 -1.959 -5.339 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -0.355 -4.223 -5.919 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -0.685 -3.828 -4.216 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -2.003 -3.785 -5.411 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -0.339 -2.447 -7.632 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -1.986 -1.937 -7.190 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -0.655 -0.756 -7.178 1.00 0.00 H new ATOM 688 N SER A 121 0.602 0.165 -2.674 1.00 0.00 N ATOM 689 CA SER A 121 1.967 0.587 -2.382 1.00 0.00 C ATOM 690 C SER A 121 2.467 -0.037 -1.082 1.00 0.00 C ATOM 691 O SER A 121 3.623 -0.454 -0.986 1.00 0.00 O ATOM 692 CB SER A 121 2.045 2.111 -2.291 1.00 0.00 C ATOM 693 OG SER A 121 3.359 2.573 -2.549 1.00 0.00 O ATOM 0 H SER A 121 -0.065 0.931 -2.768 1.00 0.00 H new ATOM 0 HA SER A 121 2.605 0.245 -3.196 1.00 0.00 H new ATOM 0 HB2 SER A 121 1.353 2.556 -3.006 1.00 0.00 H new ATOM 0 HB3 SER A 121 1.731 2.435 -1.299 1.00 0.00 H new ATOM 0 HG SER A 121 3.819 1.940 -3.139 1.00 0.00 H new ATOM 699 N LYS A 122 1.594 -0.096 -0.083 1.00 0.00 N ATOM 700 CA LYS A 122 1.949 -0.666 1.211 1.00 0.00 C ATOM 701 C LYS A 122 2.180 -2.171 1.101 1.00 0.00 C ATOM 702 O LYS A 122 3.138 -2.704 1.663 1.00 0.00 O ATOM 703 CB LYS A 122 0.848 -0.383 2.235 1.00 0.00 C ATOM 704 CG LYS A 122 0.836 1.054 2.732 1.00 0.00 C ATOM 705 CD LYS A 122 -0.534 1.693 2.567 1.00 0.00 C ATOM 706 CE LYS A 122 -1.409 1.460 3.787 1.00 0.00 C ATOM 707 NZ LYS A 122 -2.858 1.546 3.457 1.00 0.00 N ATOM 0 H LYS A 122 0.634 0.244 -0.145 1.00 0.00 H new ATOM 0 HA LYS A 122 2.876 -0.198 1.543 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -0.120 -0.613 1.789 1.00 0.00 H new ATOM 0 HB3 LYS A 122 0.974 -1.052 3.086 1.00 0.00 H new ATOM 0 HG2 LYS A 122 1.125 1.078 3.783 1.00 0.00 H new ATOM 0 HG3 LYS A 122 1.577 1.635 2.184 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -0.419 2.764 2.400 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -1.024 1.283 1.684 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -1.190 0.479 4.208 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -1.167 2.197 4.553 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -3.417 1.500 4.333 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -3.050 2.445 2.971 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -3.120 0.754 2.837 1.00 0.00 H new ATOM 721 N ILE A 123 1.296 -2.851 0.380 1.00 0.00 N ATOM 722 CA ILE A 123 1.398 -4.290 0.202 1.00 0.00 C ATOM 723 C ILE A 123 2.725 -4.676 -0.447 1.00 0.00 C ATOM 724 O ILE A 123 3.366 -5.645 -0.043 1.00 0.00 O ATOM 725 CB ILE A 123 0.237 -4.838 -0.653 1.00 0.00 C ATOM 726 CG1 ILE A 123 -1.108 -4.416 -0.060 1.00 0.00 C ATOM 727 CG2 ILE A 123 0.321 -6.355 -0.758 1.00 0.00 C ATOM 728 CD1 ILE A 123 -2.199 -4.246 -1.095 1.00 0.00 C ATOM 0 H ILE A 123 0.498 -2.425 -0.092 1.00 0.00 H new ATOM 0 HA ILE A 123 1.344 -4.733 1.196 1.00 0.00 H new ATOM 0 HB ILE A 123 0.319 -4.419 -1.656 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -1.424 -5.161 0.670 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -0.980 -3.477 0.478 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -0.506 -6.724 -1.365 1.00 0.00 H new ATOM 0 HG22 ILE A 123 1.266 -6.636 -1.223 1.00 0.00 H new ATOM 0 HG23 ILE A 123 0.263 -6.792 0.239 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -3.124 -3.946 -0.603 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -1.904 -3.479 -1.812 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -2.355 -5.190 -1.617 1.00 0.00 H new ATOM 740 N VAL A 124 3.129 -3.913 -1.459 1.00 0.00 N ATOM 741 CA VAL A 124 4.377 -4.180 -2.164 1.00 0.00 C ATOM 742 C VAL A 124 5.568 -4.143 -1.211 1.00 0.00 C ATOM 743 O VAL A 124 6.389 -5.060 -1.191 1.00 0.00 O ATOM 744 CB VAL A 124 4.614 -3.163 -3.298 1.00 0.00 C ATOM 745 CG1 VAL A 124 5.798 -3.584 -4.154 1.00 0.00 C ATOM 746 CG2 VAL A 124 3.359 -3.005 -4.147 1.00 0.00 C ATOM 0 H VAL A 124 2.611 -3.107 -1.808 1.00 0.00 H new ATOM 0 HA VAL A 124 4.287 -5.178 -2.593 1.00 0.00 H new ATOM 0 HB VAL A 124 4.845 -2.196 -2.851 1.00 0.00 H new ATOM 0 HG11 VAL A 124 5.950 -2.854 -4.949 1.00 0.00 H new ATOM 0 HG12 VAL A 124 6.694 -3.638 -3.535 1.00 0.00 H new ATOM 0 HG13 VAL A 124 5.600 -4.562 -4.592 1.00 0.00 H new ATOM 0 HG21 VAL A 124 3.546 -2.283 -4.942 1.00 0.00 H new ATOM 0 HG22 VAL A 124 3.093 -3.967 -4.585 1.00 0.00 H new ATOM 0 HG23 VAL A 124 2.539 -2.652 -3.522 1.00 0.00 H new ATOM 756 N ALA A 125 5.656 -3.075 -0.422 1.00 0.00 N ATOM 757 CA ALA A 125 6.744 -2.915 0.530 1.00 0.00 C ATOM 758 C ALA A 125 6.801 -4.086 1.506 1.00 0.00 C ATOM 759 O ALA A 125 7.875 -4.613 1.797 1.00 0.00 O ATOM 760 CB ALA A 125 6.594 -1.603 1.284 1.00 0.00 C ATOM 0 H ALA A 125 4.984 -2.308 -0.426 1.00 0.00 H new ATOM 0 HA ALA A 125 7.681 -2.898 -0.027 1.00 0.00 H new ATOM 0 HB1 ALA A 125 7.414 -1.495 1.993 1.00 0.00 H new ATOM 0 HB2 ALA A 125 6.614 -0.773 0.578 1.00 0.00 H new ATOM 0 HB3 ALA A 125 5.646 -1.599 1.822 1.00 0.00 H new ATOM 766 N SER A 126 5.638 -4.485 2.014 1.00 0.00 N ATOM 767 CA SER A 126 5.552 -5.586 2.961 1.00 0.00 C ATOM 768 C SER A 126 6.160 -6.860 2.382 1.00 0.00 C ATOM 769 O SER A 126 6.645 -7.719 3.120 1.00 0.00 O ATOM 770 CB SER A 126 4.095 -5.837 3.352 1.00 0.00 C ATOM 771 OG SER A 126 3.424 -6.599 2.363 1.00 0.00 O ATOM 0 H SER A 126 4.741 -4.059 1.783 1.00 0.00 H new ATOM 0 HA SER A 126 6.120 -5.308 3.849 1.00 0.00 H new ATOM 0 HB2 SER A 126 4.057 -6.361 4.307 1.00 0.00 H new ATOM 0 HB3 SER A 126 3.583 -4.885 3.491 1.00 0.00 H new ATOM 0 HG SER A 126 3.681 -6.279 1.473 1.00 0.00 H new ATOM 777 N LYS A 127 6.135 -6.977 1.058 1.00 0.00 N ATOM 778 CA LYS A 127 6.684 -8.147 0.384 1.00 0.00 C ATOM 779 C LYS A 127 8.193 -8.015 0.213 1.00 0.00 C ATOM 780 O LYS A 127 8.910 -9.013 0.142 1.00 0.00 O ATOM 781 CB LYS A 127 6.019 -8.333 -0.982 1.00 0.00 C ATOM 782 CG LYS A 127 4.531 -8.631 -0.899 1.00 0.00 C ATOM 783 CD LYS A 127 4.271 -10.010 -0.312 1.00 0.00 C ATOM 784 CE LYS A 127 3.024 -10.018 0.556 1.00 0.00 C ATOM 785 NZ LYS A 127 3.013 -11.170 1.501 1.00 0.00 N ATOM 0 H LYS A 127 5.740 -6.276 0.431 1.00 0.00 H new ATOM 0 HA LYS A 127 6.480 -9.022 1.002 1.00 0.00 H new ATOM 0 HB2 LYS A 127 6.168 -7.431 -1.575 1.00 0.00 H new ATOM 0 HB3 LYS A 127 6.515 -9.147 -1.510 1.00 0.00 H new ATOM 0 HG2 LYS A 127 4.041 -7.875 -0.286 1.00 0.00 H new ATOM 0 HG3 LYS A 127 4.090 -8.569 -1.894 1.00 0.00 H new ATOM 0 HD2 LYS A 127 4.159 -10.735 -1.118 1.00 0.00 H new ATOM 0 HD3 LYS A 127 5.131 -10.323 0.281 1.00 0.00 H new ATOM 0 HE2 LYS A 127 2.967 -9.086 1.119 1.00 0.00 H new ATOM 0 HE3 LYS A 127 2.139 -10.061 -0.079 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 2.615 -10.867 2.413 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 2.432 -11.937 1.107 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 3.985 -11.511 1.644 1.00 0.00 H new ATOM 799 N GLY A 128 8.671 -6.776 0.149 1.00 0.00 N ATOM 800 CA GLY A 128 10.093 -6.539 -0.012 1.00 0.00 C ATOM 801 C GLY A 128 10.396 -5.172 -0.593 1.00 0.00 C ATOM 802 O GLY A 128 11.481 -4.629 -0.385 1.00 0.00 O ATOM 0 H GLY A 128 8.099 -5.933 0.206 1.00 0.00 H new ATOM 0 HA2 GLY A 128 10.585 -6.635 0.956 1.00 0.00 H new ATOM 0 HA3 GLY A 128 10.514 -7.307 -0.661 1.00 0.00 H new ATOM 806 N GLY A 129 9.437 -4.613 -1.325 1.00 0.00 N ATOM 807 CA GLY A 129 9.628 -3.306 -1.925 1.00 0.00 C ATOM 808 C GLY A 129 9.036 -3.217 -3.317 1.00 0.00 C ATOM 809 O GLY A 129 8.181 -2.372 -3.582 1.00 0.00 O ATOM 0 H GLY A 129 8.531 -5.042 -1.513 1.00 0.00 H new ATOM 0 HA2 GLY A 129 9.171 -2.547 -1.290 1.00 0.00 H new ATOM 0 HA3 GLY A 129 10.694 -3.083 -1.972 1.00 0.00 H new ATOM 813 N PHE A 130 9.491 -4.092 -4.209 1.00 0.00 N ATOM 814 CA PHE A 130 9.001 -4.111 -5.583 1.00 0.00 C ATOM 815 C PHE A 130 9.660 -5.232 -6.380 1.00 0.00 C ATOM 816 O PHE A 130 8.981 -6.091 -6.943 1.00 0.00 O ATOM 817 CB PHE A 130 9.264 -2.765 -6.261 1.00 0.00 C ATOM 818 CG PHE A 130 8.743 -2.690 -7.668 1.00 0.00 C ATOM 819 CD1 PHE A 130 7.392 -2.838 -7.930 1.00 0.00 C ATOM 820 CD2 PHE A 130 9.609 -2.469 -8.729 1.00 0.00 C ATOM 821 CE1 PHE A 130 6.910 -2.769 -9.223 1.00 0.00 C ATOM 822 CE2 PHE A 130 9.133 -2.399 -10.025 1.00 0.00 C ATOM 823 CZ PHE A 130 7.783 -2.549 -10.273 1.00 0.00 C ATOM 0 H PHE A 130 10.199 -4.797 -4.005 1.00 0.00 H new ATOM 0 HA PHE A 130 7.926 -4.291 -5.556 1.00 0.00 H new ATOM 0 HB2 PHE A 130 8.804 -1.973 -5.669 1.00 0.00 H new ATOM 0 HB3 PHE A 130 10.337 -2.575 -6.269 1.00 0.00 H new ATOM 0 HD1 PHE A 130 6.706 -3.010 -7.114 1.00 0.00 H new ATOM 0 HD2 PHE A 130 10.666 -2.350 -8.541 1.00 0.00 H new ATOM 0 HE1 PHE A 130 5.853 -2.887 -9.413 1.00 0.00 H new ATOM 0 HE2 PHE A 130 9.817 -2.227 -10.843 1.00 0.00 H new ATOM 0 HZ PHE A 130 7.409 -2.495 -11.285 1.00 0.00 H new ATOM 833 N GLU A 131 10.988 -5.216 -6.425 1.00 0.00 N ATOM 834 CA GLU A 131 11.742 -6.231 -7.153 1.00 0.00 C ATOM 835 C GLU A 131 11.558 -7.604 -6.518 1.00 0.00 C ATOM 836 O GLU A 131 11.432 -8.610 -7.217 1.00 0.00 O ATOM 837 CB GLU A 131 13.226 -5.866 -7.189 1.00 0.00 C ATOM 838 CG GLU A 131 13.583 -4.876 -8.284 1.00 0.00 C ATOM 839 CD GLU A 131 14.892 -5.212 -8.971 1.00 0.00 C ATOM 840 OE1 GLU A 131 15.949 -4.743 -8.497 1.00 0.00 O ATOM 841 OE2 GLU A 131 14.862 -5.944 -9.982 1.00 0.00 O ATOM 0 H GLU A 131 11.565 -4.511 -5.966 1.00 0.00 H new ATOM 0 HA GLU A 131 11.361 -6.269 -8.173 1.00 0.00 H new ATOM 0 HB2 GLU A 131 13.512 -5.446 -6.224 1.00 0.00 H new ATOM 0 HB3 GLU A 131 13.812 -6.775 -7.327 1.00 0.00 H new ATOM 0 HG2 GLU A 131 12.783 -4.855 -9.024 1.00 0.00 H new ATOM 0 HG3 GLU A 131 13.648 -3.875 -7.857 1.00 0.00 H new ATOM 848 N MET A 132 11.545 -7.640 -5.191 1.00 0.00 N ATOM 849 CA MET A 132 11.377 -8.893 -4.462 1.00 0.00 C ATOM 850 C MET A 132 10.039 -9.541 -4.798 1.00 0.00 C ATOM 851 O MET A 132 9.921 -10.765 -4.830 1.00 0.00 O ATOM 852 CB MET A 132 11.475 -8.647 -2.954 1.00 0.00 C ATOM 853 CG MET A 132 11.701 -9.915 -2.146 1.00 0.00 C ATOM 854 SD MET A 132 13.343 -10.616 -2.397 1.00 0.00 S ATOM 855 CE MET A 132 12.935 -12.134 -3.254 1.00 0.00 C ATOM 0 H MET A 132 11.649 -6.817 -4.597 1.00 0.00 H new ATOM 0 HA MET A 132 12.175 -9.571 -4.764 1.00 0.00 H new ATOM 0 HB2 MET A 132 12.291 -7.951 -2.760 1.00 0.00 H new ATOM 0 HB3 MET A 132 10.558 -8.166 -2.612 1.00 0.00 H new ATOM 0 HG2 MET A 132 11.562 -9.696 -1.087 1.00 0.00 H new ATOM 0 HG3 MET A 132 10.949 -10.655 -2.420 1.00 0.00 H new ATOM 0 HE1 MET A 132 13.834 -12.547 -3.711 1.00 0.00 H new ATOM 0 HE2 MET A 132 12.525 -12.853 -2.545 1.00 0.00 H new ATOM 0 HE3 MET A 132 12.197 -11.927 -4.029 1.00 0.00 H new ATOM 865 N VAL A 133 9.031 -8.710 -5.047 1.00 0.00 N ATOM 866 CA VAL A 133 7.701 -9.204 -5.381 1.00 0.00 C ATOM 867 C VAL A 133 7.701 -9.909 -6.734 1.00 0.00 C ATOM 868 O VAL A 133 7.049 -10.938 -6.908 1.00 0.00 O ATOM 869 CB VAL A 133 6.666 -8.062 -5.410 1.00 0.00 C ATOM 870 CG1 VAL A 133 5.255 -8.624 -5.490 1.00 0.00 C ATOM 871 CG2 VAL A 133 6.823 -7.168 -4.190 1.00 0.00 C ATOM 0 H VAL A 133 9.111 -7.693 -5.024 1.00 0.00 H new ATOM 0 HA VAL A 133 7.424 -9.915 -4.603 1.00 0.00 H new ATOM 0 HB VAL A 133 6.843 -7.457 -6.299 1.00 0.00 H new ATOM 0 HG11 VAL A 133 4.537 -7.804 -5.510 1.00 0.00 H new ATOM 0 HG12 VAL A 133 5.151 -9.219 -6.397 1.00 0.00 H new ATOM 0 HG13 VAL A 133 5.064 -9.253 -4.620 1.00 0.00 H new ATOM 0 HG21 VAL A 133 6.084 -6.368 -4.228 1.00 0.00 H new ATOM 0 HG22 VAL A 133 6.674 -7.757 -3.285 1.00 0.00 H new ATOM 0 HG23 VAL A 133 7.824 -6.737 -4.181 1.00 0.00 H new ATOM 881 N THR A 134 8.437 -9.348 -7.689 1.00 0.00 N ATOM 882 CA THR A 134 8.521 -9.925 -9.025 1.00 0.00 C ATOM 883 C THR A 134 9.246 -11.268 -8.995 1.00 0.00 C ATOM 884 O THR A 134 8.795 -12.241 -9.598 1.00 0.00 O ATOM 885 CB THR A 134 9.242 -8.965 -9.974 1.00 0.00 C ATOM 886 OG1 THR A 134 9.013 -7.619 -9.595 1.00 0.00 O ATOM 887 CG2 THR A 134 8.812 -9.115 -11.418 1.00 0.00 C ATOM 0 H THR A 134 8.983 -8.496 -7.562 1.00 0.00 H new ATOM 0 HA THR A 134 7.506 -10.089 -9.386 1.00 0.00 H new ATOM 0 HB THR A 134 10.298 -9.223 -9.898 1.00 0.00 H new ATOM 0 HG1 THR A 134 9.483 -7.021 -10.212 1.00 0.00 H new ATOM 0 HG21 THR A 134 9.361 -8.405 -12.037 1.00 0.00 H new ATOM 0 HG22 THR A 134 9.021 -10.130 -11.756 1.00 0.00 H new ATOM 0 HG23 THR A 134 7.743 -8.918 -11.502 1.00 0.00 H new ATOM 895 N LYS A 135 10.373 -11.310 -8.291 1.00 0.00 N ATOM 896 CA LYS A 135 11.160 -12.527 -8.184 1.00 0.00 C ATOM 897 C LYS A 135 10.361 -13.637 -7.509 1.00 0.00 C ATOM 898 O LYS A 135 10.461 -14.805 -7.887 1.00 0.00 O ATOM 899 CB LYS A 135 12.448 -12.261 -7.402 1.00 0.00 C ATOM 900 CG LYS A 135 13.289 -11.134 -7.980 1.00 0.00 C ATOM 901 CD LYS A 135 14.772 -11.469 -7.951 1.00 0.00 C ATOM 902 CE LYS A 135 15.563 -10.444 -7.153 1.00 0.00 C ATOM 903 NZ LYS A 135 15.529 -9.098 -7.788 1.00 0.00 N ATOM 0 H LYS A 135 10.760 -10.512 -7.786 1.00 0.00 H new ATOM 0 HA LYS A 135 11.416 -12.852 -9.192 1.00 0.00 H new ATOM 0 HB2 LYS A 135 12.193 -12.021 -6.370 1.00 0.00 H new ATOM 0 HB3 LYS A 135 13.044 -13.173 -7.379 1.00 0.00 H new ATOM 0 HG2 LYS A 135 12.980 -10.939 -9.007 1.00 0.00 H new ATOM 0 HG3 LYS A 135 13.111 -10.220 -7.414 1.00 0.00 H new ATOM 0 HD2 LYS A 135 14.914 -12.458 -7.515 1.00 0.00 H new ATOM 0 HD3 LYS A 135 15.156 -11.512 -8.970 1.00 0.00 H new ATOM 0 HE2 LYS A 135 15.158 -10.379 -6.143 1.00 0.00 H new ATOM 0 HE3 LYS A 135 16.597 -10.776 -7.061 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 16.481 -8.850 -8.126 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 14.868 -9.110 -8.591 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 15.214 -8.393 -7.091 1.00 0.00 H new ATOM 917 N GLU A 136 9.568 -13.266 -6.509 1.00 0.00 N ATOM 918 CA GLU A 136 8.750 -14.230 -5.781 1.00 0.00 C ATOM 919 C GLU A 136 7.416 -14.460 -6.484 1.00 0.00 C ATOM 920 O GLU A 136 6.763 -15.483 -6.275 1.00 0.00 O ATOM 921 CB GLU A 136 8.510 -13.749 -4.350 1.00 0.00 C ATOM 922 CG GLU A 136 9.756 -13.772 -3.480 1.00 0.00 C ATOM 923 CD GLU A 136 9.616 -14.693 -2.283 1.00 0.00 C ATOM 924 OE1 GLU A 136 9.063 -14.249 -1.255 1.00 0.00 O ATOM 925 OE2 GLU A 136 10.060 -15.857 -2.373 1.00 0.00 O ATOM 0 H GLU A 136 9.474 -12.304 -6.184 1.00 0.00 H new ATOM 0 HA GLU A 136 9.290 -15.176 -5.754 1.00 0.00 H new ATOM 0 HB2 GLU A 136 8.117 -12.733 -4.379 1.00 0.00 H new ATOM 0 HB3 GLU A 136 7.745 -14.374 -3.890 1.00 0.00 H new ATOM 0 HG2 GLU A 136 10.608 -14.090 -4.081 1.00 0.00 H new ATOM 0 HG3 GLU A 136 9.971 -12.761 -3.133 1.00 0.00 H new ATOM 932 N LYS A 137 7.011 -13.504 -7.316 1.00 0.00 N ATOM 933 CA LYS A 137 5.752 -13.606 -8.047 1.00 0.00 C ATOM 934 C LYS A 137 4.565 -13.579 -7.090 1.00 0.00 C ATOM 935 O LYS A 137 3.573 -14.281 -7.294 1.00 0.00 O ATOM 936 CB LYS A 137 5.721 -14.888 -8.882 1.00 0.00 C ATOM 937 CG LYS A 137 4.574 -14.940 -9.877 1.00 0.00 C ATOM 938 CD LYS A 137 3.997 -16.343 -9.992 1.00 0.00 C ATOM 939 CE LYS A 137 3.333 -16.562 -11.342 1.00 0.00 C ATOM 940 NZ LYS A 137 4.329 -16.618 -12.448 1.00 0.00 N ATOM 0 H LYS A 137 7.537 -12.650 -7.501 1.00 0.00 H new ATOM 0 HA LYS A 137 5.679 -12.747 -8.714 1.00 0.00 H new ATOM 0 HB2 LYS A 137 6.663 -14.983 -9.422 1.00 0.00 H new ATOM 0 HB3 LYS A 137 5.649 -15.745 -8.213 1.00 0.00 H new ATOM 0 HG2 LYS A 137 3.791 -14.248 -9.567 1.00 0.00 H new ATOM 0 HG3 LYS A 137 4.924 -14.608 -10.855 1.00 0.00 H new ATOM 0 HD2 LYS A 137 4.791 -17.077 -9.852 1.00 0.00 H new ATOM 0 HD3 LYS A 137 3.269 -16.505 -9.197 1.00 0.00 H new ATOM 0 HE2 LYS A 137 2.763 -17.491 -11.320 1.00 0.00 H new ATOM 0 HE3 LYS A 137 2.624 -15.757 -11.533 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 3.912 -17.107 -13.266 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 4.598 -15.652 -12.722 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 5.173 -17.135 -12.129 1.00 0.00 H new ATOM 954 N LYS A 138 4.673 -12.766 -6.045 1.00 0.00 N ATOM 955 CA LYS A 138 3.607 -12.646 -5.055 1.00 0.00 C ATOM 956 C LYS A 138 2.614 -11.550 -5.438 1.00 0.00 C ATOM 957 O LYS A 138 1.750 -11.183 -4.642 1.00 0.00 O ATOM 958 CB LYS A 138 4.198 -12.352 -3.675 1.00 0.00 C ATOM 959 CG LYS A 138 5.000 -13.506 -3.096 1.00 0.00 C ATOM 960 CD LYS A 138 5.245 -13.321 -1.608 1.00 0.00 C ATOM 961 CE LYS A 138 3.984 -13.579 -0.798 1.00 0.00 C ATOM 962 NZ LYS A 138 3.853 -15.012 -0.414 1.00 0.00 N ATOM 0 H LYS A 138 5.487 -12.180 -5.861 1.00 0.00 H new ATOM 0 HA LYS A 138 3.072 -13.595 -5.024 1.00 0.00 H new ATOM 0 HB2 LYS A 138 4.840 -11.474 -3.744 1.00 0.00 H new ATOM 0 HB3 LYS A 138 3.389 -12.103 -2.988 1.00 0.00 H new ATOM 0 HG2 LYS A 138 4.467 -14.442 -3.265 1.00 0.00 H new ATOM 0 HG3 LYS A 138 5.955 -13.584 -3.616 1.00 0.00 H new ATOM 0 HD2 LYS A 138 6.033 -13.999 -1.281 1.00 0.00 H new ATOM 0 HD3 LYS A 138 5.598 -12.307 -1.420 1.00 0.00 H new ATOM 0 HE2 LYS A 138 3.997 -12.962 0.101 1.00 0.00 H new ATOM 0 HE3 LYS A 138 3.112 -13.278 -1.378 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 2.981 -15.146 0.137 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 3.814 -15.599 -1.272 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 4.672 -15.293 0.162 1.00 0.00 H new ATOM 976 N TRP A 139 2.738 -11.030 -6.656 1.00 0.00 N ATOM 977 CA TRP A 139 1.845 -9.978 -7.130 1.00 0.00 C ATOM 978 C TRP A 139 0.417 -10.499 -7.259 1.00 0.00 C ATOM 979 O TRP A 139 -0.544 -9.773 -7.006 1.00 0.00 O ATOM 980 CB TRP A 139 2.327 -9.435 -8.476 1.00 0.00 C ATOM 981 CG TRP A 139 3.520 -8.535 -8.361 1.00 0.00 C ATOM 982 CD1 TRP A 139 4.820 -8.859 -8.625 1.00 0.00 C ATOM 983 CD2 TRP A 139 3.521 -7.164 -7.948 1.00 0.00 C ATOM 984 NE1 TRP A 139 5.631 -7.771 -8.403 1.00 0.00 N ATOM 985 CE2 TRP A 139 4.857 -6.719 -7.988 1.00 0.00 C ATOM 986 CE3 TRP A 139 2.524 -6.268 -7.552 1.00 0.00 C ATOM 987 CZ2 TRP A 139 5.219 -5.418 -7.645 1.00 0.00 C ATOM 988 CZ3 TRP A 139 2.885 -4.979 -7.213 1.00 0.00 C ATOM 989 CH2 TRP A 139 4.221 -4.564 -7.261 1.00 0.00 C ATOM 0 H TRP A 139 3.446 -11.319 -7.331 1.00 0.00 H new ATOM 0 HA TRP A 139 1.855 -9.170 -6.399 1.00 0.00 H new ATOM 0 HB2 TRP A 139 2.574 -10.272 -9.130 1.00 0.00 H new ATOM 0 HB3 TRP A 139 1.513 -8.888 -8.952 1.00 0.00 H new ATOM 0 HD1 TRP A 139 5.161 -9.828 -8.959 1.00 0.00 H new ATOM 0 HE1 TRP A 139 6.643 -7.750 -8.527 1.00 0.00 H new ATOM 0 HE3 TRP A 139 1.490 -6.578 -7.512 1.00 0.00 H new ATOM 0 HZ2 TRP A 139 6.249 -5.095 -7.681 1.00 0.00 H new ATOM 0 HZ3 TRP A 139 2.123 -4.278 -6.905 1.00 0.00 H new ATOM 0 HH2 TRP A 139 4.469 -3.549 -6.989 1.00 0.00 H new ATOM 1000 N SER A 140 0.287 -11.762 -7.652 1.00 0.00 N ATOM 1001 CA SER A 140 -1.024 -12.381 -7.811 1.00 0.00 C ATOM 1002 C SER A 140 -1.760 -12.439 -6.477 1.00 0.00 C ATOM 1003 O SER A 140 -2.984 -12.313 -6.425 1.00 0.00 O ATOM 1004 CB SER A 140 -0.880 -13.789 -8.390 1.00 0.00 C ATOM 1005 OG SER A 140 0.204 -13.859 -9.300 1.00 0.00 O ATOM 0 H SER A 140 1.073 -12.376 -7.866 1.00 0.00 H new ATOM 0 HA SER A 140 -1.606 -11.771 -8.502 1.00 0.00 H new ATOM 0 HB2 SER A 140 -0.727 -14.504 -7.582 1.00 0.00 H new ATOM 0 HB3 SER A 140 -1.803 -14.073 -8.896 1.00 0.00 H new ATOM 0 HG SER A 140 0.275 -14.770 -9.654 1.00 0.00 H new ATOM 1011 N LYS A 141 -1.005 -12.630 -5.399 1.00 0.00 N ATOM 1012 CA LYS A 141 -1.585 -12.701 -4.063 1.00 0.00 C ATOM 1013 C LYS A 141 -2.058 -11.325 -3.606 1.00 0.00 C ATOM 1014 O LYS A 141 -3.089 -11.199 -2.946 1.00 0.00 O ATOM 1015 CB LYS A 141 -0.563 -13.258 -3.071 1.00 0.00 C ATOM 1016 CG LYS A 141 -0.307 -14.748 -3.232 1.00 0.00 C ATOM 1017 CD LYS A 141 0.946 -15.011 -4.052 1.00 0.00 C ATOM 1018 CE LYS A 141 0.848 -16.325 -4.811 1.00 0.00 C ATOM 1019 NZ LYS A 141 -0.160 -16.262 -5.905 1.00 0.00 N ATOM 0 H LYS A 141 0.009 -12.738 -5.425 1.00 0.00 H new ATOM 0 HA LYS A 141 -2.446 -13.369 -4.100 1.00 0.00 H new ATOM 0 HB2 LYS A 141 0.378 -12.721 -3.192 1.00 0.00 H new ATOM 0 HB3 LYS A 141 -0.912 -13.065 -2.056 1.00 0.00 H new ATOM 0 HG2 LYS A 141 -0.204 -15.209 -2.250 1.00 0.00 H new ATOM 0 HG3 LYS A 141 -1.165 -15.216 -3.715 1.00 0.00 H new ATOM 0 HD2 LYS A 141 1.100 -14.193 -4.756 1.00 0.00 H new ATOM 0 HD3 LYS A 141 1.815 -15.033 -3.394 1.00 0.00 H new ATOM 0 HE2 LYS A 141 1.823 -16.576 -5.230 1.00 0.00 H new ATOM 0 HE3 LYS A 141 0.583 -17.125 -4.119 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 -0.755 -17.114 -5.878 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 -0.756 -15.419 -5.780 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 0.326 -16.209 -6.823 1.00 0.00 H new ATOM 1033 N VAL A 142 -1.296 -10.296 -3.964 1.00 0.00 N ATOM 1034 CA VAL A 142 -1.636 -8.928 -3.595 1.00 0.00 C ATOM 1035 C VAL A 142 -2.997 -8.529 -4.157 1.00 0.00 C ATOM 1036 O VAL A 142 -3.813 -7.925 -3.463 1.00 0.00 O ATOM 1037 CB VAL A 142 -0.574 -7.931 -4.096 1.00 0.00 C ATOM 1038 CG1 VAL A 142 -0.853 -6.536 -3.559 1.00 0.00 C ATOM 1039 CG2 VAL A 142 0.821 -8.393 -3.702 1.00 0.00 C ATOM 0 H VAL A 142 -0.439 -10.385 -4.510 1.00 0.00 H new ATOM 0 HA VAL A 142 -1.671 -8.893 -2.506 1.00 0.00 H new ATOM 0 HB VAL A 142 -0.625 -7.892 -5.184 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -0.092 -5.847 -3.924 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -1.835 -6.205 -3.898 1.00 0.00 H new ATOM 0 HG13 VAL A 142 -0.833 -6.555 -2.469 1.00 0.00 H new ATOM 0 HG21 VAL A 142 1.558 -7.676 -4.065 1.00 0.00 H new ATOM 0 HG22 VAL A 142 0.888 -8.464 -2.616 1.00 0.00 H new ATOM 0 HG23 VAL A 142 1.019 -9.370 -4.142 1.00 0.00 H new ATOM 1049 N GLY A 143 -3.233 -8.876 -5.419 1.00 0.00 N ATOM 1050 CA GLY A 143 -4.496 -8.550 -6.054 1.00 0.00 C ATOM 1051 C GLY A 143 -5.671 -9.253 -5.403 1.00 0.00 C ATOM 1052 O GLY A 143 -6.729 -8.656 -5.208 1.00 0.00 O ATOM 0 H GLY A 143 -2.572 -9.377 -6.012 1.00 0.00 H new ATOM 0 HA2 GLY A 143 -4.653 -7.472 -6.012 1.00 0.00 H new ATOM 0 HA3 GLY A 143 -4.451 -8.825 -7.108 1.00 0.00 H new ATOM 1056 N SER A 144 -5.485 -10.526 -5.069 1.00 0.00 N ATOM 1057 CA SER A 144 -6.539 -11.311 -4.437 1.00 0.00 C ATOM 1058 C SER A 144 -6.958 -10.689 -3.108 1.00 0.00 C ATOM 1059 O SER A 144 -8.133 -10.719 -2.741 1.00 0.00 O ATOM 1060 CB SER A 144 -6.068 -12.750 -4.213 1.00 0.00 C ATOM 1061 OG SER A 144 -5.481 -13.283 -5.388 1.00 0.00 O ATOM 0 H SER A 144 -4.615 -11.035 -5.225 1.00 0.00 H new ATOM 0 HA SER A 144 -7.402 -11.318 -5.103 1.00 0.00 H new ATOM 0 HB2 SER A 144 -5.345 -12.777 -3.397 1.00 0.00 H new ATOM 0 HB3 SER A 144 -6.912 -13.370 -3.911 1.00 0.00 H new ATOM 0 HG SER A 144 -4.570 -12.935 -5.485 1.00 0.00 H new ATOM 1067 N ARG A 145 -5.990 -10.126 -2.392 1.00 0.00 N ATOM 1068 CA ARG A 145 -6.259 -9.496 -1.105 1.00 0.00 C ATOM 1069 C ARG A 145 -7.168 -8.283 -1.273 1.00 0.00 C ATOM 1070 O ARG A 145 -7.971 -7.968 -0.395 1.00 0.00 O ATOM 1071 CB ARG A 145 -4.949 -9.076 -0.436 1.00 0.00 C ATOM 1072 CG ARG A 145 -4.247 -10.210 0.291 1.00 0.00 C ATOM 1073 CD ARG A 145 -2.786 -9.878 0.561 1.00 0.00 C ATOM 1074 NE ARG A 145 -2.327 -10.423 1.836 1.00 0.00 N ATOM 1075 CZ ARG A 145 -1.986 -11.697 2.019 1.00 0.00 C ATOM 1076 NH1 ARG A 145 -2.052 -12.560 1.013 1.00 0.00 N ATOM 1077 NH2 ARG A 145 -1.579 -12.109 3.212 1.00 0.00 N ATOM 0 H ARG A 145 -5.012 -10.093 -2.681 1.00 0.00 H new ATOM 0 HA ARG A 145 -6.766 -10.223 -0.471 1.00 0.00 H new ATOM 0 HB2 ARG A 145 -4.278 -8.670 -1.193 1.00 0.00 H new ATOM 0 HB3 ARG A 145 -5.153 -8.273 0.272 1.00 0.00 H new ATOM 0 HG2 ARG A 145 -4.756 -10.410 1.234 1.00 0.00 H new ATOM 0 HG3 ARG A 145 -4.310 -11.120 -0.305 1.00 0.00 H new ATOM 0 HD2 ARG A 145 -2.169 -10.274 -0.246 1.00 0.00 H new ATOM 0 HD3 ARG A 145 -2.654 -8.796 0.561 1.00 0.00 H new ATOM 0 HE ARG A 145 -2.264 -9.790 2.633 1.00 0.00 H new ATOM 0 HH11 ARG A 145 -2.365 -12.249 0.094 1.00 0.00 H new ATOM 0 HH12 ARG A 145 -1.789 -13.535 1.159 1.00 0.00 H new ATOM 0 HH21 ARG A 145 -1.527 -11.450 3.989 1.00 0.00 H new ATOM 0 HH22 ARG A 145 -1.318 -13.085 3.353 1.00 0.00 H new ATOM 1091 N LEU A 146 -7.035 -7.603 -2.408 1.00 0.00 N ATOM 1092 CA LEU A 146 -7.843 -6.423 -2.691 1.00 0.00 C ATOM 1093 C LEU A 146 -9.268 -6.817 -3.073 1.00 0.00 C ATOM 1094 O LEU A 146 -10.209 -6.595 -2.311 1.00 0.00 O ATOM 1095 CB LEU A 146 -7.207 -5.602 -3.815 1.00 0.00 C ATOM 1096 CG LEU A 146 -7.130 -4.094 -3.551 1.00 0.00 C ATOM 1097 CD1 LEU A 146 -5.689 -3.610 -3.615 1.00 0.00 C ATOM 1098 CD2 LEU A 146 -7.994 -3.333 -4.546 1.00 0.00 C ATOM 0 H LEU A 146 -6.375 -7.849 -3.146 1.00 0.00 H new ATOM 0 HA LEU A 146 -7.885 -5.816 -1.787 1.00 0.00 H new ATOM 0 HB2 LEU A 146 -6.199 -5.977 -3.993 1.00 0.00 H new ATOM 0 HB3 LEU A 146 -7.774 -5.767 -4.731 1.00 0.00 H new ATOM 0 HG LEU A 146 -7.510 -3.903 -2.548 1.00 0.00 H new ATOM 0 HD11 LEU A 146 -5.657 -2.537 -3.425 1.00 0.00 H new ATOM 0 HD12 LEU A 146 -5.097 -4.130 -2.862 1.00 0.00 H new ATOM 0 HD13 LEU A 146 -5.280 -3.816 -4.604 1.00 0.00 H new ATOM 0 HD21 LEU A 146 -7.927 -2.264 -4.343 1.00 0.00 H new ATOM 0 HD22 LEU A 146 -7.644 -3.533 -5.559 1.00 0.00 H new ATOM 0 HD23 LEU A 146 -9.031 -3.656 -4.450 1.00 0.00 H new ATOM 1110 N GLY A 147 -9.417 -7.401 -4.258 1.00 0.00 N ATOM 1111 CA GLY A 147 -10.728 -7.816 -4.719 1.00 0.00 C ATOM 1112 C GLY A 147 -10.765 -8.073 -6.213 1.00 0.00 C ATOM 1113 O GLY A 147 -11.715 -7.687 -6.893 1.00 0.00 O ATOM 0 H GLY A 147 -8.653 -7.594 -4.906 1.00 0.00 H new ATOM 0 HA2 GLY A 147 -11.025 -8.722 -4.191 1.00 0.00 H new ATOM 0 HA3 GLY A 147 -11.458 -7.046 -4.468 1.00 0.00 H new ATOM 1117 N TYR A 148 -9.726 -8.727 -6.724 1.00 0.00 N ATOM 1118 CA TYR A 148 -9.641 -9.035 -8.146 1.00 0.00 C ATOM 1119 C TYR A 148 -9.908 -10.515 -8.397 1.00 0.00 C ATOM 1120 O TYR A 148 -9.253 -11.381 -7.819 1.00 0.00 O ATOM 1121 CB TYR A 148 -8.264 -8.654 -8.689 1.00 0.00 C ATOM 1122 CG TYR A 148 -7.867 -7.224 -8.393 1.00 0.00 C ATOM 1123 CD1 TYR A 148 -8.797 -6.195 -8.465 1.00 0.00 C ATOM 1124 CD2 TYR A 148 -6.562 -6.905 -8.039 1.00 0.00 C ATOM 1125 CE1 TYR A 148 -8.437 -4.888 -8.194 1.00 0.00 C ATOM 1126 CE2 TYR A 148 -6.195 -5.602 -7.767 1.00 0.00 C ATOM 1127 CZ TYR A 148 -7.135 -4.597 -7.846 1.00 0.00 C ATOM 1128 OH TYR A 148 -6.773 -3.297 -7.576 1.00 0.00 O ATOM 0 H TYR A 148 -8.932 -9.053 -6.174 1.00 0.00 H new ATOM 0 HA TYR A 148 -10.402 -8.453 -8.666 1.00 0.00 H new ATOM 0 HB2 TYR A 148 -7.517 -9.324 -8.263 1.00 0.00 H new ATOM 0 HB3 TYR A 148 -8.253 -8.809 -9.768 1.00 0.00 H new ATOM 0 HD1 TYR A 148 -9.818 -6.419 -8.737 1.00 0.00 H new ATOM 0 HD2 TYR A 148 -5.822 -7.689 -7.976 1.00 0.00 H new ATOM 0 HE1 TYR A 148 -9.172 -4.099 -8.255 1.00 0.00 H new ATOM 0 HE2 TYR A 148 -5.176 -5.371 -7.494 1.00 0.00 H new ATOM 0 HH TYR A 148 -5.821 -3.264 -7.346 1.00 0.00 H new ATOM 1138 N LEU A 149 -10.875 -10.798 -9.265 1.00 0.00 N ATOM 1139 CA LEU A 149 -11.227 -12.175 -9.591 1.00 0.00 C ATOM 1140 C LEU A 149 -10.115 -12.845 -10.395 1.00 0.00 C ATOM 1141 O LEU A 149 -9.485 -12.213 -11.244 1.00 0.00 O ATOM 1142 CB LEU A 149 -12.536 -12.217 -10.382 1.00 0.00 C ATOM 1143 CG LEU A 149 -13.673 -11.373 -9.796 1.00 0.00 C ATOM 1144 CD1 LEU A 149 -13.912 -10.133 -10.644 1.00 0.00 C ATOM 1145 CD2 LEU A 149 -14.948 -12.196 -9.684 1.00 0.00 C ATOM 0 H LEU A 149 -11.427 -10.093 -9.754 1.00 0.00 H new ATOM 0 HA LEU A 149 -11.357 -12.720 -8.656 1.00 0.00 H new ATOM 0 HB2 LEU A 149 -12.339 -11.879 -11.399 1.00 0.00 H new ATOM 0 HB3 LEU A 149 -12.870 -13.253 -10.449 1.00 0.00 H new ATOM 0 HG LEU A 149 -13.381 -11.054 -8.796 1.00 0.00 H new ATOM 0 HD11 LEU A 149 -14.723 -9.547 -10.211 1.00 0.00 H new ATOM 0 HD12 LEU A 149 -13.004 -9.531 -10.672 1.00 0.00 H new ATOM 0 HD13 LEU A 149 -14.181 -10.431 -11.657 1.00 0.00 H new ATOM 0 HD21 LEU A 149 -15.744 -11.579 -9.266 1.00 0.00 H new ATOM 0 HD22 LEU A 149 -15.243 -12.547 -10.673 1.00 0.00 H new ATOM 0 HD23 LEU A 149 -14.772 -13.052 -9.033 1.00 0.00 H new ATOM 1157 N PRO A 150 -9.856 -14.141 -10.142 1.00 0.00 N ATOM 1158 CA PRO A 150 -8.812 -14.889 -10.850 1.00 0.00 C ATOM 1159 C PRO A 150 -8.961 -14.794 -12.365 1.00 0.00 C ATOM 1160 O PRO A 150 -9.984 -14.329 -12.868 1.00 0.00 O ATOM 1161 CB PRO A 150 -9.025 -16.331 -10.383 1.00 0.00 C ATOM 1162 CG PRO A 150 -9.699 -16.207 -9.060 1.00 0.00 C ATOM 1163 CD PRO A 150 -10.557 -14.976 -9.148 1.00 0.00 C ATOM 0 HA PRO A 150 -7.816 -14.501 -10.634 1.00 0.00 H new ATOM 0 HB2 PRO A 150 -9.640 -16.889 -11.089 1.00 0.00 H new ATOM 0 HB3 PRO A 150 -8.077 -16.863 -10.296 1.00 0.00 H new ATOM 0 HG2 PRO A 150 -10.302 -17.089 -8.845 1.00 0.00 H new ATOM 0 HG3 PRO A 150 -8.968 -16.117 -8.256 1.00 0.00 H new ATOM 0 HD2 PRO A 150 -11.571 -15.215 -9.468 1.00 0.00 H new ATOM 0 HD3 PRO A 150 -10.637 -14.472 -8.185 1.00 0.00 H new ATOM 1171 N GLY A 151 -7.936 -15.235 -13.085 1.00 0.00 N ATOM 1172 CA GLY A 151 -7.974 -15.192 -14.534 1.00 0.00 C ATOM 1173 C GLY A 151 -6.592 -15.237 -15.152 1.00 0.00 C ATOM 1174 O GLY A 151 -5.621 -15.611 -14.495 1.00 0.00 O ATOM 0 H GLY A 151 -7.079 -15.622 -12.690 1.00 0.00 H new ATOM 0 HA2 GLY A 151 -8.561 -16.032 -14.904 1.00 0.00 H new ATOM 0 HA3 GLY A 151 -8.482 -14.282 -14.854 1.00 0.00 H new ATOM 1178 N LYS A 152 -6.502 -14.855 -16.423 1.00 0.00 N ATOM 1179 CA LYS A 152 -5.228 -14.853 -17.133 1.00 0.00 C ATOM 1180 C LYS A 152 -4.648 -13.444 -17.205 1.00 0.00 C ATOM 1181 O LYS A 152 -5.317 -12.508 -17.642 1.00 0.00 O ATOM 1182 CB LYS A 152 -5.406 -15.418 -18.543 1.00 0.00 C ATOM 1183 CG LYS A 152 -5.695 -16.911 -18.568 1.00 0.00 C ATOM 1184 CD LYS A 152 -5.620 -17.469 -19.980 1.00 0.00 C ATOM 1185 CE LYS A 152 -5.284 -18.952 -19.976 1.00 0.00 C ATOM 1186 NZ LYS A 152 -6.130 -19.716 -20.935 1.00 0.00 N ATOM 0 H LYS A 152 -7.296 -14.543 -16.982 1.00 0.00 H new ATOM 0 HA LYS A 152 -4.531 -15.485 -16.582 1.00 0.00 H new ATOM 0 HB2 LYS A 152 -6.222 -14.890 -19.037 1.00 0.00 H new ATOM 0 HB3 LYS A 152 -4.503 -15.221 -19.121 1.00 0.00 H new ATOM 0 HG2 LYS A 152 -4.980 -17.432 -17.931 1.00 0.00 H new ATOM 0 HG3 LYS A 152 -6.686 -17.098 -18.154 1.00 0.00 H new ATOM 0 HD2 LYS A 152 -6.573 -17.312 -20.485 1.00 0.00 H new ATOM 0 HD3 LYS A 152 -4.865 -16.925 -20.548 1.00 0.00 H new ATOM 0 HE2 LYS A 152 -4.233 -19.087 -20.232 1.00 0.00 H new ATOM 0 HE3 LYS A 152 -5.421 -19.353 -18.972 1.00 0.00 H new ATOM 0 HZ1 LYS A 152 -5.870 -20.722 -20.902 1.00 0.00 H new ATOM 0 HZ2 LYS A 152 -7.132 -19.609 -20.676 1.00 0.00 H new ATOM 0 HZ3 LYS A 152 -5.980 -19.351 -21.897 1.00 0.00 H new ATOM 1200 N GLY A 153 -3.399 -13.301 -16.772 1.00 0.00 N ATOM 1201 CA GLY A 153 -2.752 -12.002 -16.795 1.00 0.00 C ATOM 1202 C GLY A 153 -3.361 -11.032 -15.801 1.00 0.00 C ATOM 1203 O GLY A 153 -4.326 -10.336 -16.115 1.00 0.00 O ATOM 0 H GLY A 153 -2.824 -14.060 -16.406 1.00 0.00 H new ATOM 0 HA2 GLY A 153 -1.691 -12.124 -16.575 1.00 0.00 H new ATOM 0 HA3 GLY A 153 -2.823 -11.582 -17.798 1.00 0.00 H new ATOM 1207 N THR A 154 -2.798 -10.989 -14.598 1.00 0.00 N ATOM 1208 CA THR A 154 -3.293 -10.098 -13.555 1.00 0.00 C ATOM 1209 C THR A 154 -2.138 -9.492 -12.765 1.00 0.00 C ATOM 1210 O THR A 154 -2.013 -8.270 -12.667 1.00 0.00 O ATOM 1211 CB THR A 154 -4.228 -10.856 -12.612 1.00 0.00 C ATOM 1212 OG1 THR A 154 -5.123 -11.674 -13.345 1.00 0.00 O ATOM 1213 CG2 THR A 154 -5.057 -9.946 -11.730 1.00 0.00 C ATOM 0 H THR A 154 -1.999 -11.560 -14.321 1.00 0.00 H new ATOM 0 HA THR A 154 -3.846 -9.290 -14.033 1.00 0.00 H new ATOM 0 HB THR A 154 -3.574 -11.454 -11.977 1.00 0.00 H new ATOM 0 HG1 THR A 154 -5.712 -12.152 -12.725 1.00 0.00 H new ATOM 0 HG21 THR A 154 -5.698 -10.548 -11.086 1.00 0.00 H new ATOM 0 HG22 THR A 154 -4.396 -9.335 -11.115 1.00 0.00 H new ATOM 0 HG23 THR A 154 -5.674 -9.299 -12.353 1.00 0.00 H new ATOM 1221 N GLY A 155 -1.296 -10.352 -12.200 1.00 0.00 N ATOM 1222 CA GLY A 155 -0.164 -9.882 -11.425 1.00 0.00 C ATOM 1223 C GLY A 155 0.768 -9.002 -12.235 1.00 0.00 C ATOM 1224 O GLY A 155 1.357 -8.058 -11.707 1.00 0.00 O ATOM 0 H GLY A 155 -1.378 -11.367 -12.266 1.00 0.00 H new ATOM 0 HA2 GLY A 155 -0.526 -9.325 -10.561 1.00 0.00 H new ATOM 0 HA3 GLY A 155 0.391 -10.738 -11.042 1.00 0.00 H new ATOM 1228 N SER A 156 0.901 -9.310 -13.521 1.00 0.00 N ATOM 1229 CA SER A 156 1.768 -8.540 -14.406 1.00 0.00 C ATOM 1230 C SER A 156 1.150 -7.183 -14.725 1.00 0.00 C ATOM 1231 O SER A 156 1.862 -6.200 -14.933 1.00 0.00 O ATOM 1232 CB SER A 156 2.024 -9.314 -15.702 1.00 0.00 C ATOM 1233 OG SER A 156 2.104 -10.707 -15.457 1.00 0.00 O ATOM 0 H SER A 156 0.420 -10.087 -13.974 1.00 0.00 H new ATOM 0 HA SER A 156 2.717 -8.377 -13.894 1.00 0.00 H new ATOM 0 HB2 SER A 156 1.224 -9.112 -16.414 1.00 0.00 H new ATOM 0 HB3 SER A 156 2.951 -8.968 -16.159 1.00 0.00 H new ATOM 0 HG SER A 156 2.266 -11.179 -16.301 1.00 0.00 H new ATOM 1239 N LEU A 157 -0.177 -7.135 -14.760 1.00 0.00 N ATOM 1240 CA LEU A 157 -0.890 -5.898 -15.054 1.00 0.00 C ATOM 1241 C LEU A 157 -0.735 -4.897 -13.912 1.00 0.00 C ATOM 1242 O LEU A 157 -0.573 -3.699 -14.141 1.00 0.00 O ATOM 1243 CB LEU A 157 -2.372 -6.184 -15.300 1.00 0.00 C ATOM 1244 CG LEU A 157 -2.690 -6.843 -16.643 1.00 0.00 C ATOM 1245 CD1 LEU A 157 -2.236 -5.957 -17.792 1.00 0.00 C ATOM 1246 CD2 LEU A 157 -2.035 -8.213 -16.734 1.00 0.00 C ATOM 0 H LEU A 157 -0.781 -7.939 -14.588 1.00 0.00 H new ATOM 0 HA LEU A 157 -0.458 -5.464 -15.956 1.00 0.00 H new ATOM 0 HB2 LEU A 157 -2.740 -6.827 -14.501 1.00 0.00 H new ATOM 0 HB3 LEU A 157 -2.923 -5.246 -15.233 1.00 0.00 H new ATOM 0 HG LEU A 157 -3.770 -6.973 -16.715 1.00 0.00 H new ATOM 0 HD11 LEU A 157 -2.470 -6.442 -18.740 1.00 0.00 H new ATOM 0 HD12 LEU A 157 -2.751 -4.998 -17.738 1.00 0.00 H new ATOM 0 HD13 LEU A 157 -1.160 -5.795 -17.723 1.00 0.00 H new ATOM 0 HD21 LEU A 157 -2.272 -8.667 -17.696 1.00 0.00 H new ATOM 0 HD22 LEU A 157 -0.954 -8.107 -16.640 1.00 0.00 H new ATOM 0 HD23 LEU A 157 -2.408 -8.849 -15.931 1.00 0.00 H new ATOM 1258 N LEU A 158 -0.790 -5.399 -12.682 1.00 0.00 N ATOM 1259 CA LEU A 158 -0.655 -4.549 -11.504 1.00 0.00 C ATOM 1260 C LEU A 158 0.756 -3.979 -11.403 1.00 0.00 C ATOM 1261 O LEU A 158 0.948 -2.843 -10.971 1.00 0.00 O ATOM 1262 CB LEU A 158 -0.989 -5.339 -10.238 1.00 0.00 C ATOM 1263 CG LEU A 158 -2.314 -6.105 -10.283 1.00 0.00 C ATOM 1264 CD1 LEU A 158 -2.334 -7.199 -9.228 1.00 0.00 C ATOM 1265 CD2 LEU A 158 -3.485 -5.152 -10.089 1.00 0.00 C ATOM 0 H LEU A 158 -0.927 -6.388 -12.475 1.00 0.00 H new ATOM 0 HA LEU A 158 -1.356 -3.721 -11.603 1.00 0.00 H new ATOM 0 HB2 LEU A 158 -0.183 -6.048 -10.047 1.00 0.00 H new ATOM 0 HB3 LEU A 158 -1.014 -4.650 -9.394 1.00 0.00 H new ATOM 0 HG LEU A 158 -2.409 -6.573 -11.263 1.00 0.00 H new ATOM 0 HD11 LEU A 158 -3.283 -7.733 -9.275 1.00 0.00 H new ATOM 0 HD12 LEU A 158 -1.516 -7.896 -9.411 1.00 0.00 H new ATOM 0 HD13 LEU A 158 -2.217 -6.754 -8.240 1.00 0.00 H new ATOM 0 HD21 LEU A 158 -4.419 -5.712 -10.124 1.00 0.00 H new ATOM 0 HD22 LEU A 158 -3.395 -4.656 -9.122 1.00 0.00 H new ATOM 0 HD23 LEU A 158 -3.481 -4.404 -10.882 1.00 0.00 H new ATOM 1277 N LYS A 159 1.740 -4.776 -11.805 1.00 0.00 N ATOM 1278 CA LYS A 159 3.134 -4.353 -11.760 1.00 0.00 C ATOM 1279 C LYS A 159 3.387 -3.207 -12.737 1.00 0.00 C ATOM 1280 O LYS A 159 4.076 -2.241 -12.412 1.00 0.00 O ATOM 1281 CB LYS A 159 4.057 -5.531 -12.081 1.00 0.00 C ATOM 1282 CG LYS A 159 5.118 -5.779 -11.019 1.00 0.00 C ATOM 1283 CD LYS A 159 6.483 -5.278 -11.464 1.00 0.00 C ATOM 1284 CE LYS A 159 7.300 -6.385 -12.109 1.00 0.00 C ATOM 1285 NZ LYS A 159 6.989 -6.532 -13.558 1.00 0.00 N ATOM 0 H LYS A 159 1.597 -5.719 -12.166 1.00 0.00 H new ATOM 0 HA LYS A 159 3.349 -3.999 -10.752 1.00 0.00 H new ATOM 0 HB2 LYS A 159 3.455 -6.432 -12.199 1.00 0.00 H new ATOM 0 HB3 LYS A 159 4.547 -5.348 -13.037 1.00 0.00 H new ATOM 0 HG2 LYS A 159 4.831 -5.280 -10.093 1.00 0.00 H new ATOM 0 HG3 LYS A 159 5.174 -6.846 -10.802 1.00 0.00 H new ATOM 0 HD2 LYS A 159 6.358 -4.458 -12.171 1.00 0.00 H new ATOM 0 HD3 LYS A 159 7.023 -4.879 -10.605 1.00 0.00 H new ATOM 0 HE2 LYS A 159 8.362 -6.172 -11.985 1.00 0.00 H new ATOM 0 HE3 LYS A 159 7.102 -7.327 -11.598 1.00 0.00 H new ATOM 0 HZ1 LYS A 159 7.626 -7.238 -13.980 1.00 0.00 H new ATOM 0 HZ2 LYS A 159 6.003 -6.843 -13.672 1.00 0.00 H new ATOM 0 HZ3 LYS A 159 7.121 -5.618 -14.036 1.00 0.00 H new ATOM 1299 N SER A 160 2.827 -3.326 -13.936 1.00 0.00 N ATOM 1300 CA SER A 160 2.992 -2.302 -14.961 1.00 0.00 C ATOM 1301 C SER A 160 2.297 -1.007 -14.554 1.00 0.00 C ATOM 1302 O SER A 160 2.854 0.081 -14.704 1.00 0.00 O ATOM 1303 CB SER A 160 2.434 -2.794 -16.298 1.00 0.00 C ATOM 1304 OG SER A 160 3.373 -3.618 -16.970 1.00 0.00 O ATOM 0 H SER A 160 2.255 -4.121 -14.222 1.00 0.00 H new ATOM 0 HA SER A 160 4.058 -2.103 -15.071 1.00 0.00 H new ATOM 0 HB2 SER A 160 1.512 -3.351 -16.128 1.00 0.00 H new ATOM 0 HB3 SER A 160 2.180 -1.940 -16.926 1.00 0.00 H new ATOM 0 HG SER A 160 2.992 -3.921 -17.821 1.00 0.00 H new ATOM 1310 N HIS A 161 1.078 -1.131 -14.038 1.00 0.00 N ATOM 1311 CA HIS A 161 0.307 0.030 -13.610 1.00 0.00 C ATOM 1312 C HIS A 161 0.922 0.663 -12.366 1.00 0.00 C ATOM 1313 O HIS A 161 1.048 1.885 -12.276 1.00 0.00 O ATOM 1314 CB HIS A 161 -1.143 -0.370 -13.329 1.00 0.00 C ATOM 1315 CG HIS A 161 -1.967 -0.538 -14.567 1.00 0.00 C ATOM 1316 ND1 HIS A 161 -2.214 0.492 -15.453 1.00 0.00 N ATOM 1317 CD2 HIS A 161 -2.601 -1.623 -15.070 1.00 0.00 C ATOM 1318 CE1 HIS A 161 -2.965 0.047 -16.444 1.00 0.00 C ATOM 1319 NE2 HIS A 161 -3.214 -1.233 -16.237 1.00 0.00 N ATOM 0 H HIS A 161 0.603 -2.024 -13.906 1.00 0.00 H new ATOM 0 HA HIS A 161 0.325 0.764 -14.416 1.00 0.00 H new ATOM 0 HB2 HIS A 161 -1.151 -1.304 -12.767 1.00 0.00 H new ATOM 0 HB3 HIS A 161 -1.604 0.387 -12.695 1.00 0.00 H new ATOM 0 HD2 HIS A 161 -2.621 -2.611 -14.635 1.00 0.00 H new ATOM 0 HE1 HIS A 161 -3.316 0.631 -17.282 1.00 0.00 H new ATOM 0 HE2 HIS A 161 -3.771 -1.835 -16.844 1.00 0.00 H new ATOM 1328 N TYR A 162 1.303 -0.176 -11.407 1.00 0.00 N ATOM 1329 CA TYR A 162 1.905 0.301 -10.168 1.00 0.00 C ATOM 1330 C TYR A 162 3.177 1.095 -10.452 1.00 0.00 C ATOM 1331 O TYR A 162 3.363 2.195 -9.931 1.00 0.00 O ATOM 1332 CB TYR A 162 2.221 -0.876 -9.244 1.00 0.00 C ATOM 1333 CG TYR A 162 2.829 -0.465 -7.922 1.00 0.00 C ATOM 1334 CD1 TYR A 162 2.152 0.387 -7.058 1.00 0.00 C ATOM 1335 CD2 TYR A 162 4.082 -0.927 -7.539 1.00 0.00 C ATOM 1336 CE1 TYR A 162 2.706 0.765 -5.850 1.00 0.00 C ATOM 1337 CE2 TYR A 162 4.643 -0.553 -6.332 1.00 0.00 C ATOM 1338 CZ TYR A 162 3.950 0.293 -5.491 1.00 0.00 C ATOM 1339 OH TYR A 162 4.505 0.668 -4.290 1.00 0.00 O ATOM 0 H TYR A 162 1.205 -1.190 -11.465 1.00 0.00 H new ATOM 0 HA TYR A 162 1.189 0.959 -9.675 1.00 0.00 H new ATOM 0 HB2 TYR A 162 1.304 -1.434 -9.054 1.00 0.00 H new ATOM 0 HB3 TYR A 162 2.906 -1.553 -9.754 1.00 0.00 H new ATOM 0 HD1 TYR A 162 1.177 0.760 -7.335 1.00 0.00 H new ATOM 0 HD2 TYR A 162 4.627 -1.589 -8.195 1.00 0.00 H new ATOM 0 HE1 TYR A 162 2.166 1.428 -5.190 1.00 0.00 H new ATOM 0 HE2 TYR A 162 5.618 -0.921 -6.049 1.00 0.00 H new ATOM 0 HH TYR A 162 5.478 0.732 -4.385 1.00 0.00 H new ATOM 1349 N GLU A 163 4.048 0.529 -11.280 1.00 0.00 N ATOM 1350 CA GLU A 163 5.302 1.184 -11.633 1.00 0.00 C ATOM 1351 C GLU A 163 5.134 2.038 -12.887 1.00 0.00 C ATOM 1352 O GLU A 163 5.768 1.786 -13.913 1.00 0.00 O ATOM 1353 CB GLU A 163 6.401 0.142 -11.851 1.00 0.00 C ATOM 1354 CG GLU A 163 7.798 0.661 -11.555 1.00 0.00 C ATOM 1355 CD GLU A 163 8.859 -0.003 -12.410 1.00 0.00 C ATOM 1356 OE1 GLU A 163 8.531 -0.438 -13.533 1.00 0.00 O ATOM 1357 OE2 GLU A 163 10.020 -0.088 -11.956 1.00 0.00 O ATOM 0 H GLU A 163 3.909 -0.381 -11.719 1.00 0.00 H new ATOM 0 HA GLU A 163 5.590 1.836 -10.808 1.00 0.00 H new ATOM 0 HB2 GLU A 163 6.202 -0.722 -11.217 1.00 0.00 H new ATOM 0 HB3 GLU A 163 6.362 -0.204 -12.884 1.00 0.00 H new ATOM 0 HG2 GLU A 163 7.824 1.738 -11.721 1.00 0.00 H new ATOM 0 HG3 GLU A 163 8.028 0.495 -10.503 1.00 0.00 H new ATOM 1364 N ARG A 164 4.273 3.048 -12.799 1.00 0.00 N ATOM 1365 CA ARG A 164 4.022 3.937 -13.926 1.00 0.00 C ATOM 1366 C ARG A 164 3.569 5.314 -13.447 1.00 0.00 C ATOM 1367 O ARG A 164 4.117 6.336 -13.858 1.00 0.00 O ATOM 1368 CB ARG A 164 2.967 3.331 -14.856 1.00 0.00 C ATOM 1369 CG ARG A 164 3.513 2.937 -16.219 1.00 0.00 C ATOM 1370 CD ARG A 164 3.265 4.022 -17.256 1.00 0.00 C ATOM 1371 NE ARG A 164 2.636 3.491 -18.464 1.00 0.00 N ATOM 1372 CZ ARG A 164 2.003 4.242 -19.362 1.00 0.00 C ATOM 1373 NH1 ARG A 164 1.910 5.555 -19.193 1.00 0.00 N ATOM 1374 NH2 ARG A 164 1.460 3.677 -20.432 1.00 0.00 N ATOM 0 H ARG A 164 3.738 3.270 -11.959 1.00 0.00 H new ATOM 0 HA ARG A 164 4.955 4.056 -14.477 1.00 0.00 H new ATOM 0 HB2 ARG A 164 2.536 2.451 -14.378 1.00 0.00 H new ATOM 0 HB3 ARG A 164 2.158 4.049 -14.991 1.00 0.00 H new ATOM 0 HG2 ARG A 164 4.583 2.745 -16.141 1.00 0.00 H new ATOM 0 HG3 ARG A 164 3.045 2.008 -16.544 1.00 0.00 H new ATOM 0 HD2 ARG A 164 2.629 4.796 -16.826 1.00 0.00 H new ATOM 0 HD3 ARG A 164 4.211 4.496 -17.518 1.00 0.00 H new ATOM 0 HE ARG A 164 2.685 2.486 -18.628 1.00 0.00 H new ATOM 0 HH11 ARG A 164 2.325 5.994 -18.371 1.00 0.00 H new ATOM 0 HH12 ARG A 164 1.424 6.125 -19.885 1.00 0.00 H new ATOM 0 HH21 ARG A 164 1.528 2.668 -20.566 1.00 0.00 H new ATOM 0 HH22 ARG A 164 0.975 4.251 -21.121 1.00 0.00 H new ATOM 1388 N ILE A 165 2.563 5.333 -12.578 1.00 0.00 N ATOM 1389 CA ILE A 165 2.038 6.588 -12.048 1.00 0.00 C ATOM 1390 C ILE A 165 1.999 6.586 -10.519 1.00 0.00 C ATOM 1391 O ILE A 165 1.600 7.575 -9.903 1.00 0.00 O ATOM 1392 CB ILE A 165 0.619 6.873 -12.580 1.00 0.00 C ATOM 1393 CG1 ILE A 165 0.533 6.562 -14.076 1.00 0.00 C ATOM 1394 CG2 ILE A 165 0.234 8.321 -12.310 1.00 0.00 C ATOM 1395 CD1 ILE A 165 -0.123 5.234 -14.381 1.00 0.00 C ATOM 0 H ILE A 165 2.096 4.497 -12.227 1.00 0.00 H new ATOM 0 HA ILE A 165 2.717 7.371 -12.386 1.00 0.00 H new ATOM 0 HB ILE A 165 -0.084 6.225 -12.056 1.00 0.00 H new ATOM 0 HG12 ILE A 165 -0.025 7.356 -14.572 1.00 0.00 H new ATOM 0 HG13 ILE A 165 1.538 6.567 -14.498 1.00 0.00 H new ATOM 0 HG21 ILE A 165 -0.770 8.508 -12.691 1.00 0.00 H new ATOM 0 HG22 ILE A 165 0.256 8.509 -11.237 1.00 0.00 H new ATOM 0 HG23 ILE A 165 0.940 8.984 -12.809 1.00 0.00 H new ATOM 0 HD11 ILE A 165 -0.149 5.080 -15.460 1.00 0.00 H new ATOM 0 HD12 ILE A 165 0.447 4.431 -13.914 1.00 0.00 H new ATOM 0 HD13 ILE A 165 -1.140 5.232 -13.989 1.00 0.00 H new ATOM 1407 N LEU A 166 2.408 5.476 -9.907 1.00 0.00 N ATOM 1408 CA LEU A 166 2.408 5.368 -8.453 1.00 0.00 C ATOM 1409 C LEU A 166 3.824 5.186 -7.915 1.00 0.00 C ATOM 1410 O LEU A 166 4.302 5.988 -7.113 1.00 0.00 O ATOM 1411 CB LEU A 166 1.527 4.202 -8.006 1.00 0.00 C ATOM 1412 CG LEU A 166 0.960 4.324 -6.590 1.00 0.00 C ATOM 1413 CD1 LEU A 166 2.074 4.213 -5.560 1.00 0.00 C ATOM 1414 CD2 LEU A 166 0.211 5.639 -6.429 1.00 0.00 C ATOM 0 H LEU A 166 2.742 4.644 -10.394 1.00 0.00 H new ATOM 0 HA LEU A 166 2.004 6.296 -8.049 1.00 0.00 H new ATOM 0 HB2 LEU A 166 0.697 4.104 -8.706 1.00 0.00 H new ATOM 0 HB3 LEU A 166 2.108 3.282 -8.070 1.00 0.00 H new ATOM 0 HG LEU A 166 0.258 3.506 -6.426 1.00 0.00 H new ATOM 0 HD11 LEU A 166 1.654 4.302 -4.558 1.00 0.00 H new ATOM 0 HD12 LEU A 166 2.569 3.247 -5.662 1.00 0.00 H new ATOM 0 HD13 LEU A 166 2.799 5.011 -5.721 1.00 0.00 H new ATOM 0 HD21 LEU A 166 -0.186 5.710 -5.416 1.00 0.00 H new ATOM 0 HD22 LEU A 166 0.892 6.470 -6.611 1.00 0.00 H new ATOM 0 HD23 LEU A 166 -0.610 5.680 -7.144 1.00 0.00 H new ATOM 1426 N TYR A 167 4.488 4.124 -8.357 1.00 0.00 N ATOM 1427 CA TYR A 167 5.848 3.839 -7.913 1.00 0.00 C ATOM 1428 C TYR A 167 6.797 4.984 -8.267 1.00 0.00 C ATOM 1429 O TYR A 167 7.558 5.450 -7.419 1.00 0.00 O ATOM 1430 CB TYR A 167 6.353 2.533 -8.530 1.00 0.00 C ATOM 1431 CG TYR A 167 7.345 1.798 -7.658 1.00 0.00 C ATOM 1432 CD1 TYR A 167 7.026 1.446 -6.352 1.00 0.00 C ATOM 1433 CD2 TYR A 167 8.604 1.458 -8.139 1.00 0.00 C ATOM 1434 CE1 TYR A 167 7.930 0.777 -5.551 1.00 0.00 C ATOM 1435 CE2 TYR A 167 9.514 0.788 -7.345 1.00 0.00 C ATOM 1436 CZ TYR A 167 9.174 0.450 -6.052 1.00 0.00 C ATOM 1437 OH TYR A 167 10.078 -0.216 -5.257 1.00 0.00 O ATOM 0 H TYR A 167 4.109 3.448 -9.020 1.00 0.00 H new ATOM 0 HA TYR A 167 5.827 3.734 -6.828 1.00 0.00 H new ATOM 0 HB2 TYR A 167 5.502 1.881 -8.728 1.00 0.00 H new ATOM 0 HB3 TYR A 167 6.818 2.751 -9.492 1.00 0.00 H new ATOM 0 HD1 TYR A 167 6.054 1.700 -5.957 1.00 0.00 H new ATOM 0 HD2 TYR A 167 8.875 1.722 -9.150 1.00 0.00 H new ATOM 0 HE1 TYR A 167 7.665 0.511 -4.538 1.00 0.00 H new ATOM 0 HE2 TYR A 167 10.488 0.530 -7.735 1.00 0.00 H new ATOM 0 HH TYR A 167 10.904 -0.371 -5.761 1.00 0.00 H new ATOM 1447 N PRO A 168 6.769 5.458 -9.527 1.00 0.00 N ATOM 1448 CA PRO A 168 7.639 6.552 -9.974 1.00 0.00 C ATOM 1449 C PRO A 168 7.409 7.837 -9.183 1.00 0.00 C ATOM 1450 O PRO A 168 8.305 8.672 -9.067 1.00 0.00 O ATOM 1451 CB PRO A 168 7.257 6.747 -11.447 1.00 0.00 C ATOM 1452 CG PRO A 168 6.587 5.479 -11.846 1.00 0.00 C ATOM 1453 CD PRO A 168 5.901 4.970 -10.612 1.00 0.00 C ATOM 0 HA PRO A 168 8.693 6.315 -9.828 1.00 0.00 H new ATOM 0 HB2 PRO A 168 6.591 7.601 -11.572 1.00 0.00 H new ATOM 0 HB3 PRO A 168 8.138 6.937 -12.061 1.00 0.00 H new ATOM 0 HG2 PRO A 168 5.870 5.652 -12.648 1.00 0.00 H new ATOM 0 HG3 PRO A 168 7.312 4.754 -12.217 1.00 0.00 H new ATOM 0 HD2 PRO A 168 4.887 5.360 -10.524 1.00 0.00 H new ATOM 0 HD3 PRO A 168 5.826 3.883 -10.611 1.00 0.00 H new ATOM 1461 N TYR A 169 6.203 7.992 -8.636 1.00 0.00 N ATOM 1462 CA TYR A 169 5.866 9.178 -7.854 1.00 0.00 C ATOM 1463 C TYR A 169 6.842 9.359 -6.695 1.00 0.00 C ATOM 1464 O TYR A 169 7.435 10.426 -6.531 1.00 0.00 O ATOM 1465 CB TYR A 169 4.439 9.069 -7.314 1.00 0.00 C ATOM 1466 CG TYR A 169 4.019 10.247 -6.463 1.00 0.00 C ATOM 1467 CD1 TYR A 169 4.300 10.279 -5.102 1.00 0.00 C ATOM 1468 CD2 TYR A 169 3.343 11.325 -7.019 1.00 0.00 C ATOM 1469 CE1 TYR A 169 3.919 11.352 -4.320 1.00 0.00 C ATOM 1470 CE2 TYR A 169 2.960 12.403 -6.243 1.00 0.00 C ATOM 1471 CZ TYR A 169 3.249 12.411 -4.895 1.00 0.00 C ATOM 1472 OH TYR A 169 2.869 13.482 -4.119 1.00 0.00 O ATOM 0 H TYR A 169 5.447 7.313 -8.720 1.00 0.00 H new ATOM 0 HA TYR A 169 5.937 10.046 -8.509 1.00 0.00 H new ATOM 0 HB2 TYR A 169 3.749 8.974 -8.152 1.00 0.00 H new ATOM 0 HB3 TYR A 169 4.352 8.157 -6.724 1.00 0.00 H new ATOM 0 HD1 TYR A 169 4.825 9.451 -4.649 1.00 0.00 H new ATOM 0 HD2 TYR A 169 3.113 11.321 -8.074 1.00 0.00 H new ATOM 0 HE1 TYR A 169 4.145 11.361 -3.264 1.00 0.00 H new ATOM 0 HE2 TYR A 169 2.437 13.235 -6.691 1.00 0.00 H new ATOM 0 HH TYR A 169 2.408 14.143 -4.677 1.00 0.00 H new ATOM 1482 N GLU A 170 7.002 8.311 -5.891 1.00 0.00 N ATOM 1483 CA GLU A 170 7.901 8.355 -4.749 1.00 0.00 C ATOM 1484 C GLU A 170 9.319 8.715 -5.182 1.00 0.00 C ATOM 1485 O GLU A 170 9.944 9.611 -4.616 1.00 0.00 O ATOM 1486 CB GLU A 170 7.900 7.006 -4.023 1.00 0.00 C ATOM 1487 CG GLU A 170 7.804 7.130 -2.512 1.00 0.00 C ATOM 1488 CD GLU A 170 6.421 7.542 -2.049 1.00 0.00 C ATOM 1489 OE1 GLU A 170 5.533 6.668 -1.980 1.00 0.00 O ATOM 1490 OE2 GLU A 170 6.227 8.741 -1.756 1.00 0.00 O ATOM 0 H GLU A 170 6.518 7.421 -6.012 1.00 0.00 H new ATOM 0 HA GLU A 170 7.545 9.128 -4.067 1.00 0.00 H new ATOM 0 HB2 GLU A 170 7.063 6.409 -4.384 1.00 0.00 H new ATOM 0 HB3 GLU A 170 8.811 6.465 -4.278 1.00 0.00 H new ATOM 0 HG2 GLU A 170 8.067 6.176 -2.055 1.00 0.00 H new ATOM 0 HG3 GLU A 170 8.533 7.862 -2.164 1.00 0.00 H new ATOM 1497 N LEU A 171 9.819 8.009 -6.191 1.00 0.00 N ATOM 1498 CA LEU A 171 11.160 8.248 -6.704 1.00 0.00 C ATOM 1499 C LEU A 171 11.314 9.690 -7.173 1.00 0.00 C ATOM 1500 O LEU A 171 12.389 10.281 -7.058 1.00 0.00 O ATOM 1501 CB LEU A 171 11.463 7.289 -7.855 1.00 0.00 C ATOM 1502 CG LEU A 171 11.389 5.802 -7.495 1.00 0.00 C ATOM 1503 CD1 LEU A 171 10.661 5.022 -8.579 1.00 0.00 C ATOM 1504 CD2 LEU A 171 12.785 5.236 -7.274 1.00 0.00 C ATOM 0 H LEU A 171 9.312 7.265 -6.670 1.00 0.00 H new ATOM 0 HA LEU A 171 11.870 8.072 -5.896 1.00 0.00 H new ATOM 0 HB2 LEU A 171 10.762 7.486 -8.666 1.00 0.00 H new ATOM 0 HB3 LEU A 171 12.461 7.506 -8.236 1.00 0.00 H new ATOM 0 HG LEU A 171 10.826 5.702 -6.567 1.00 0.00 H new ATOM 0 HD11 LEU A 171 10.620 3.968 -8.303 1.00 0.00 H new ATOM 0 HD12 LEU A 171 9.648 5.409 -8.687 1.00 0.00 H new ATOM 0 HD13 LEU A 171 11.193 5.129 -9.524 1.00 0.00 H new ATOM 0 HD21 LEU A 171 12.713 4.179 -7.019 1.00 0.00 H new ATOM 0 HD22 LEU A 171 13.372 5.350 -8.185 1.00 0.00 H new ATOM 0 HD23 LEU A 171 13.271 5.773 -6.459 1.00 0.00 H new ATOM 1516 N PHE A 172 10.233 10.252 -7.705 1.00 0.00 N ATOM 1517 CA PHE A 172 10.246 11.624 -8.196 1.00 0.00 C ATOM 1518 C PHE A 172 10.482 12.612 -7.059 1.00 0.00 C ATOM 1519 O PHE A 172 11.102 13.658 -7.251 1.00 0.00 O ATOM 1520 CB PHE A 172 8.924 11.945 -8.898 1.00 0.00 C ATOM 1521 CG PHE A 172 9.059 12.956 -9.999 1.00 0.00 C ATOM 1522 CD1 PHE A 172 9.440 14.259 -9.718 1.00 0.00 C ATOM 1523 CD2 PHE A 172 8.802 12.606 -11.314 1.00 0.00 C ATOM 1524 CE1 PHE A 172 9.566 15.193 -10.730 1.00 0.00 C ATOM 1525 CE2 PHE A 172 8.924 13.536 -12.330 1.00 0.00 C ATOM 1526 CZ PHE A 172 9.307 14.831 -12.037 1.00 0.00 C ATOM 0 H PHE A 172 9.336 9.777 -7.807 1.00 0.00 H new ATOM 0 HA PHE A 172 11.065 11.720 -8.908 1.00 0.00 H new ATOM 0 HB2 PHE A 172 8.508 11.025 -9.309 1.00 0.00 H new ATOM 0 HB3 PHE A 172 8.211 12.315 -8.161 1.00 0.00 H new ATOM 0 HD1 PHE A 172 9.641 14.548 -8.697 1.00 0.00 H new ATOM 0 HD2 PHE A 172 8.503 11.595 -11.549 1.00 0.00 H new ATOM 0 HE1 PHE A 172 9.867 16.204 -10.498 1.00 0.00 H new ATOM 0 HE2 PHE A 172 8.720 13.251 -13.351 1.00 0.00 H new ATOM 0 HZ PHE A 172 9.404 15.559 -12.829 1.00 0.00 H new ATOM 1536 N GLN A 173 9.984 12.276 -5.873 1.00 0.00 N ATOM 1537 CA GLN A 173 10.143 13.137 -4.707 1.00 0.00 C ATOM 1538 C GLN A 173 11.604 13.209 -4.275 1.00 0.00 C ATOM 1539 O GLN A 173 12.119 14.285 -3.970 1.00 0.00 O ATOM 1540 CB GLN A 173 9.281 12.630 -3.547 1.00 0.00 C ATOM 1541 CG GLN A 173 7.885 12.198 -3.965 1.00 0.00 C ATOM 1542 CD GLN A 173 7.170 13.247 -4.793 1.00 0.00 C ATOM 1543 OE1 GLN A 173 7.218 14.437 -4.485 1.00 0.00 O ATOM 1544 NE2 GLN A 173 6.500 12.809 -5.854 1.00 0.00 N ATOM 0 H GLN A 173 9.468 11.415 -5.695 1.00 0.00 H new ATOM 0 HA GLN A 173 9.815 14.139 -4.983 1.00 0.00 H new ATOM 0 HB2 GLN A 173 9.785 11.788 -3.073 1.00 0.00 H new ATOM 0 HB3 GLN A 173 9.199 13.416 -2.797 1.00 0.00 H new ATOM 0 HG2 GLN A 173 7.952 11.273 -4.538 1.00 0.00 H new ATOM 0 HG3 GLN A 173 7.295 11.980 -3.075 1.00 0.00 H new ATOM 0 HE21 GLN A 173 6.486 11.813 -6.073 1.00 0.00 H new ATOM 0 HE22 GLN A 173 5.999 13.469 -6.449 1.00 0.00 H new ATOM 1553 N SER A 174 12.267 12.056 -4.250 1.00 0.00 N ATOM 1554 CA SER A 174 13.672 11.989 -3.856 1.00 0.00 C ATOM 1555 C SER A 174 14.174 10.548 -3.881 1.00 0.00 C ATOM 1556 O SER A 174 14.935 10.130 -3.009 1.00 0.00 O ATOM 1557 CB SER A 174 13.862 12.583 -2.458 1.00 0.00 C ATOM 1558 OG SER A 174 14.124 13.974 -2.527 1.00 0.00 O ATOM 0 H SER A 174 11.855 11.156 -4.497 1.00 0.00 H new ATOM 0 HA SER A 174 14.253 12.571 -4.572 1.00 0.00 H new ATOM 0 HB2 SER A 174 12.968 12.407 -1.860 1.00 0.00 H new ATOM 0 HB3 SER A 174 14.687 12.079 -1.954 1.00 0.00 H new ATOM 0 HG SER A 174 13.479 14.399 -3.131 1.00 0.00 H new ATOM 1564 N GLY A 175 13.742 9.794 -4.887 1.00 0.00 N ATOM 1565 CA GLY A 175 14.157 8.409 -5.006 1.00 0.00 C ATOM 1566 C GLY A 175 13.564 7.530 -3.923 1.00 0.00 C ATOM 1567 O GLY A 175 14.057 7.586 -2.777 1.00 0.00 O ATOM 1568 OXT GLY A 175 12.606 6.785 -4.219 1.00 0.00 O ATOM 0 H GLY A 175 13.112 10.118 -5.621 1.00 0.00 H new ATOM 0 HA2 GLY A 175 13.860 8.027 -5.983 1.00 0.00 H new ATOM 0 HA3 GLY A 175 15.245 8.354 -4.959 1.00 0.00 H new