USER MOD reduce.3.24.130724 H: found=0, std=0, add=578, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 580 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 98 SER OG : rot 70:sc= 0.745 USER MOD Set 1.2: A 150 TYR OH : rot -8:sc= -1.65 USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 103 MET CE :methyl 179:sc= 0 (180deg=-0.00152) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 ASN : amide:sc= -0.315 K(o=-0.32,f=-2.6!) USER MOD Single : A 111 TYR OH : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 MET CE :methyl 172:sc= -5.35! (180deg=-5.89!) USER MOD Single : A 122 GLN : amide:sc= -0.0293 K(o=-0.029,f=-1.6) USER MOD Single : A 124 THR OG1 : rot 165:sc= -1 USER MOD Single : A 127 THR OG1 : rot 180:sc= 0 USER MOD Single : A 129 THR OG1 : rot 180:sc= -0.117 USER MOD Single : A 137 MET CE :methyl 155:sc= -3.04 (180deg=-4.29!) USER MOD Single : A 138 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0357) USER MOD Single : A 142 LYS NZ :NH3+ -168:sc=-0.00126 (180deg=-0.234) USER MOD Single : A 143 ASN : amide:sc= -1.34 X(o=-1.3,f=-1.5!) USER MOD Single : A 144 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 157 MET CE :methyl -107:sc= -1.49 (180deg=-5.51!) USER MOD Single : A 158 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 71 N SER A 93 2.098 14.562 -1.331 1.00 0.00 N ATOM 72 CA SER A 93 2.753 13.259 -1.242 1.00 0.00 C ATOM 73 C SER A 93 2.281 12.479 -0.014 1.00 0.00 C ATOM 74 O SER A 93 2.848 11.440 0.324 1.00 0.00 O ATOM 75 CB SER A 93 4.274 13.429 -1.199 1.00 0.00 C ATOM 76 OG SER A 93 4.870 13.001 -2.411 1.00 0.00 O ATOM 0 HA SER A 93 2.480 12.690 -2.131 1.00 0.00 H new ATOM 0 HB2 SER A 93 4.521 14.475 -1.018 1.00 0.00 H new ATOM 0 HB3 SER A 93 4.684 12.856 -0.367 1.00 0.00 H new ATOM 0 HG SER A 93 5.841 13.122 -2.358 1.00 0.00 H new ATOM 82 N GLU A 94 1.244 12.982 0.651 1.00 0.00 N ATOM 83 CA GLU A 94 0.705 12.325 1.837 1.00 0.00 C ATOM 84 C GLU A 94 -0.769 11.981 1.646 1.00 0.00 C ATOM 85 O GLU A 94 -1.274 11.024 2.235 1.00 0.00 O ATOM 86 CB GLU A 94 0.877 13.222 3.064 1.00 0.00 C ATOM 87 CG GLU A 94 1.185 12.454 4.340 1.00 0.00 C ATOM 88 CD GLU A 94 2.319 13.072 5.134 1.00 0.00 C ATOM 89 OE1 GLU A 94 2.341 14.314 5.270 1.00 0.00 O ATOM 90 OE2 GLU A 94 3.184 12.315 5.622 1.00 0.00 O ATOM 0 H GLU A 94 0.761 13.841 0.389 1.00 0.00 H new ATOM 0 HA GLU A 94 1.258 11.399 1.992 1.00 0.00 H new ATOM 0 HB2 GLU A 94 1.681 13.933 2.874 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -0.034 13.803 3.210 1.00 0.00 H new ATOM 0 HG2 GLU A 94 0.290 12.416 4.961 1.00 0.00 H new ATOM 0 HG3 GLU A 94 1.442 11.425 4.087 1.00 0.00 H new ATOM 97 N GLU A 95 -1.455 12.766 0.821 1.00 0.00 N ATOM 98 CA GLU A 95 -2.871 12.543 0.553 1.00 0.00 C ATOM 99 C GLU A 95 -3.078 11.275 -0.269 1.00 0.00 C ATOM 100 O GLU A 95 -4.117 10.623 -0.171 1.00 0.00 O ATOM 101 CB GLU A 95 -3.466 13.746 -0.182 1.00 0.00 C ATOM 102 CG GLU A 95 -4.086 14.779 0.744 1.00 0.00 C ATOM 103 CD GLU A 95 -5.009 15.736 0.016 1.00 0.00 C ATOM 104 OE1 GLU A 95 -6.019 15.270 -0.552 1.00 0.00 O ATOM 105 OE2 GLU A 95 -4.721 16.952 0.013 1.00 0.00 O ATOM 0 H GLU A 95 -1.053 13.562 0.327 1.00 0.00 H new ATOM 0 HA GLU A 95 -3.381 12.420 1.508 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -2.684 14.223 -0.773 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -4.225 13.395 -0.881 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -4.644 14.269 1.529 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -3.293 15.346 1.233 1.00 0.00 H new ATOM 112 N GLU A 96 -2.082 10.931 -1.081 1.00 0.00 N ATOM 113 CA GLU A 96 -2.158 9.741 -1.920 1.00 0.00 C ATOM 114 C GLU A 96 -2.370 8.490 -1.074 1.00 0.00 C ATOM 115 O GLU A 96 -3.171 7.622 -1.421 1.00 0.00 O ATOM 116 CB GLU A 96 -0.883 9.597 -2.754 1.00 0.00 C ATOM 117 CG GLU A 96 -0.479 10.875 -3.473 1.00 0.00 C ATOM 118 CD GLU A 96 -0.687 10.791 -4.972 1.00 0.00 C ATOM 119 OE1 GLU A 96 -1.846 10.925 -5.419 1.00 0.00 O ATOM 120 OE2 GLU A 96 0.309 10.592 -5.700 1.00 0.00 O ATOM 0 H GLU A 96 -1.214 11.459 -1.175 1.00 0.00 H new ATOM 0 HA GLU A 96 -3.011 9.853 -2.589 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -0.067 9.282 -2.104 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -1.027 8.806 -3.490 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -1.057 11.709 -3.076 1.00 0.00 H new ATOM 0 HG3 GLU A 96 0.570 11.087 -3.267 1.00 0.00 H new ATOM 127 N LEU A 97 -1.648 8.405 0.039 1.00 0.00 N ATOM 128 CA LEU A 97 -1.760 7.260 0.936 1.00 0.00 C ATOM 129 C LEU A 97 -2.947 7.424 1.878 1.00 0.00 C ATOM 130 O LEU A 97 -3.603 6.449 2.243 1.00 0.00 O ATOM 131 CB LEU A 97 -0.471 7.086 1.740 1.00 0.00 C ATOM 132 CG LEU A 97 0.681 6.430 0.976 1.00 0.00 C ATOM 133 CD1 LEU A 97 1.988 7.163 1.236 1.00 0.00 C ATOM 134 CD2 LEU A 97 0.804 4.963 1.358 1.00 0.00 C ATOM 0 H LEU A 97 -0.980 9.114 0.341 1.00 0.00 H new ATOM 0 HA LEU A 97 -1.921 6.368 0.330 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -0.144 8.065 2.091 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -0.689 6.487 2.624 1.00 0.00 H new ATOM 0 HG LEU A 97 0.464 6.492 -0.090 1.00 0.00 H new ATOM 0 HD11 LEU A 97 2.793 6.679 0.683 1.00 0.00 H new ATOM 0 HD12 LEU A 97 1.895 8.199 0.910 1.00 0.00 H new ATOM 0 HD13 LEU A 97 2.214 7.137 2.302 1.00 0.00 H new ATOM 0 HD21 LEU A 97 1.628 4.511 0.806 1.00 0.00 H new ATOM 0 HD22 LEU A 97 0.996 4.880 2.428 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -0.123 4.445 1.115 1.00 0.00 H new ATOM 146 N SER A 98 -3.223 8.667 2.266 1.00 0.00 N ATOM 147 CA SER A 98 -4.336 8.961 3.162 1.00 0.00 C ATOM 148 C SER A 98 -5.631 8.363 2.623 1.00 0.00 C ATOM 149 O SER A 98 -6.419 7.782 3.370 1.00 0.00 O ATOM 150 CB SER A 98 -4.493 10.472 3.338 1.00 0.00 C ATOM 151 OG SER A 98 -4.964 10.789 4.636 1.00 0.00 O ATOM 0 H SER A 98 -2.690 9.486 1.973 1.00 0.00 H new ATOM 0 HA SER A 98 -4.121 8.512 4.132 1.00 0.00 H new ATOM 0 HB2 SER A 98 -3.535 10.963 3.166 1.00 0.00 H new ATOM 0 HB3 SER A 98 -5.187 10.858 2.592 1.00 0.00 H new ATOM 0 HG SER A 98 -4.259 10.611 5.293 1.00 0.00 H new ATOM 157 N ASP A 99 -5.838 8.502 1.318 1.00 0.00 N ATOM 158 CA ASP A 99 -7.029 7.969 0.672 1.00 0.00 C ATOM 159 C ASP A 99 -6.866 6.478 0.396 1.00 0.00 C ATOM 160 O ASP A 99 -7.844 5.731 0.365 1.00 0.00 O ATOM 161 CB ASP A 99 -7.306 8.716 -0.634 1.00 0.00 C ATOM 162 CG ASP A 99 -8.032 10.028 -0.408 1.00 0.00 C ATOM 163 OD1 ASP A 99 -7.652 10.763 0.528 1.00 0.00 O ATOM 164 OD2 ASP A 99 -8.979 10.321 -1.166 1.00 0.00 O ATOM 0 H ASP A 99 -5.195 8.980 0.687 1.00 0.00 H new ATOM 0 HA ASP A 99 -7.875 8.109 1.344 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -6.363 8.909 -1.146 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -7.902 8.083 -1.292 1.00 0.00 H new ATOM 169 N LEU A 100 -5.621 6.052 0.198 1.00 0.00 N ATOM 170 CA LEU A 100 -5.328 4.650 -0.071 1.00 0.00 C ATOM 171 C LEU A 100 -5.244 3.842 1.226 1.00 0.00 C ATOM 172 O LEU A 100 -5.052 2.627 1.194 1.00 0.00 O ATOM 173 CB LEU A 100 -4.020 4.520 -0.859 1.00 0.00 C ATOM 174 CG LEU A 100 -4.174 4.584 -2.381 1.00 0.00 C ATOM 175 CD1 LEU A 100 -2.829 4.393 -3.066 1.00 0.00 C ATOM 176 CD2 LEU A 100 -5.170 3.538 -2.859 1.00 0.00 C ATOM 0 H LEU A 100 -4.801 6.658 0.219 1.00 0.00 H new ATOM 0 HA LEU A 100 -6.145 4.247 -0.669 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -3.343 5.314 -0.543 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -3.547 3.574 -0.596 1.00 0.00 H new ATOM 0 HG LEU A 100 -4.555 5.570 -2.646 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -2.961 4.442 -4.147 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -2.144 5.179 -2.748 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -2.417 3.421 -2.794 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -5.268 3.597 -3.943 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -4.817 2.545 -2.580 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -6.140 3.721 -2.397 1.00 0.00 H new ATOM 188 N PHE A 101 -5.392 4.518 2.367 1.00 0.00 N ATOM 189 CA PHE A 101 -5.336 3.847 3.664 1.00 0.00 C ATOM 190 C PHE A 101 -6.729 3.412 4.111 1.00 0.00 C ATOM 191 O PHE A 101 -6.950 2.249 4.445 1.00 0.00 O ATOM 192 CB PHE A 101 -4.719 4.767 4.721 1.00 0.00 C ATOM 193 CG PHE A 101 -4.320 4.051 5.982 1.00 0.00 C ATOM 194 CD1 PHE A 101 -3.545 2.902 5.930 1.00 0.00 C ATOM 195 CD2 PHE A 101 -4.719 4.529 7.220 1.00 0.00 C ATOM 196 CE1 PHE A 101 -3.177 2.244 7.090 1.00 0.00 C ATOM 197 CE2 PHE A 101 -4.354 3.875 8.382 1.00 0.00 C ATOM 198 CZ PHE A 101 -3.582 2.732 8.316 1.00 0.00 C ATOM 0 H PHE A 101 -5.551 5.524 2.418 1.00 0.00 H new ATOM 0 HA PHE A 101 -4.710 2.962 3.555 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -3.842 5.256 4.298 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -5.433 5.552 4.969 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -3.225 2.517 4.973 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -5.322 5.423 7.278 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -2.574 1.350 7.036 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -4.672 4.258 9.340 1.00 0.00 H new ATOM 0 HZ PHE A 101 -3.295 2.220 9.223 1.00 0.00 H new ATOM 208 N ARG A 102 -7.664 4.358 4.117 1.00 0.00 N ATOM 209 CA ARG A 102 -9.036 4.079 4.526 1.00 0.00 C ATOM 210 C ARG A 102 -9.659 2.990 3.656 1.00 0.00 C ATOM 211 O ARG A 102 -10.120 1.967 4.161 1.00 0.00 O ATOM 212 CB ARG A 102 -9.879 5.355 4.452 1.00 0.00 C ATOM 213 CG ARG A 102 -10.367 5.841 5.807 1.00 0.00 C ATOM 214 CD ARG A 102 -9.475 6.940 6.360 1.00 0.00 C ATOM 215 NE ARG A 102 -9.720 7.182 7.780 1.00 0.00 N ATOM 216 CZ ARG A 102 -10.742 7.896 8.245 1.00 0.00 C ATOM 217 NH1 ARG A 102 -11.617 8.441 7.407 1.00 0.00 N ATOM 218 NH2 ARG A 102 -10.892 8.067 9.552 1.00 0.00 N ATOM 0 H ARG A 102 -7.495 5.326 3.843 1.00 0.00 H new ATOM 0 HA ARG A 102 -9.015 3.722 5.556 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -9.290 6.143 3.983 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -10.740 5.175 3.808 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -11.388 6.212 5.715 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -10.393 5.005 6.507 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -8.430 6.666 6.214 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -9.645 7.860 5.801 1.00 0.00 H new ATOM 0 HE ARG A 102 -9.069 6.780 8.455 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -11.507 8.313 6.401 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -12.398 8.987 7.770 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -10.224 7.651 10.201 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -11.676 8.614 9.908 1.00 0.00 H new ATOM 232 N MET A 103 -9.669 3.220 2.347 1.00 0.00 N ATOM 233 CA MET A 103 -10.237 2.261 1.405 1.00 0.00 C ATOM 234 C MET A 103 -9.577 0.890 1.542 1.00 0.00 C ATOM 235 O MET A 103 -10.148 -0.125 1.146 1.00 0.00 O ATOM 236 CB MET A 103 -10.080 2.772 -0.029 1.00 0.00 C ATOM 237 CG MET A 103 -10.785 1.907 -1.063 1.00 0.00 C ATOM 238 SD MET A 103 -12.160 2.758 -1.864 1.00 0.00 S ATOM 239 CE MET A 103 -11.280 3.934 -2.889 1.00 0.00 C ATOM 0 H MET A 103 -9.290 4.062 1.914 1.00 0.00 H new ATOM 0 HA MET A 103 -11.297 2.154 1.637 1.00 0.00 H new ATOM 0 HB2 MET A 103 -10.471 3.788 -0.089 1.00 0.00 H new ATOM 0 HB3 MET A 103 -9.019 2.824 -0.273 1.00 0.00 H new ATOM 0 HG2 MET A 103 -10.066 1.595 -1.820 1.00 0.00 H new ATOM 0 HG3 MET A 103 -11.155 1.001 -0.582 1.00 0.00 H new ATOM 0 HE1 MET A 103 -11.995 4.524 -3.462 1.00 0.00 H new ATOM 0 HE2 MET A 103 -10.687 4.595 -2.257 1.00 0.00 H new ATOM 0 HE3 MET A 103 -10.621 3.399 -3.573 1.00 0.00 H new ATOM 249 N PHE A 104 -8.371 0.867 2.102 1.00 0.00 N ATOM 250 CA PHE A 104 -7.638 -0.380 2.285 1.00 0.00 C ATOM 251 C PHE A 104 -8.032 -1.063 3.591 1.00 0.00 C ATOM 252 O PHE A 104 -8.172 -2.285 3.644 1.00 0.00 O ATOM 253 CB PHE A 104 -6.132 -0.114 2.273 1.00 0.00 C ATOM 254 CG PHE A 104 -5.307 -1.331 1.967 1.00 0.00 C ATOM 255 CD1 PHE A 104 -5.320 -2.426 2.816 1.00 0.00 C ATOM 256 CD2 PHE A 104 -4.519 -1.378 0.829 1.00 0.00 C ATOM 257 CE1 PHE A 104 -4.560 -3.546 2.535 1.00 0.00 C ATOM 258 CE2 PHE A 104 -3.757 -2.495 0.543 1.00 0.00 C ATOM 259 CZ PHE A 104 -3.778 -3.580 1.397 1.00 0.00 C ATOM 0 H PHE A 104 -7.882 1.697 2.436 1.00 0.00 H new ATOM 0 HA PHE A 104 -7.894 -1.044 1.459 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -5.914 0.657 1.534 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -5.834 0.282 3.244 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -5.930 -2.404 3.707 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -4.500 -0.532 0.158 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -4.578 -4.393 3.204 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -3.146 -2.519 -0.347 1.00 0.00 H new ATOM 0 HZ PHE A 104 -3.184 -4.454 1.175 1.00 0.00 H new ATOM 269 N ASP A 105 -8.204 -0.270 4.643 1.00 0.00 N ATOM 270 CA ASP A 105 -8.576 -0.806 5.948 1.00 0.00 C ATOM 271 C ASP A 105 -9.990 -1.383 5.924 1.00 0.00 C ATOM 272 O ASP A 105 -10.171 -2.600 5.930 1.00 0.00 O ATOM 273 CB ASP A 105 -8.465 0.280 7.020 1.00 0.00 C ATOM 274 CG ASP A 105 -8.123 -0.288 8.383 1.00 0.00 C ATOM 275 OD1 ASP A 105 -8.321 -1.504 8.587 1.00 0.00 O ATOM 276 OD2 ASP A 105 -7.657 0.484 9.248 1.00 0.00 O ATOM 0 H ASP A 105 -8.092 0.744 4.618 1.00 0.00 H new ATOM 0 HA ASP A 105 -7.885 -1.614 6.190 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -7.701 1.000 6.727 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -9.408 0.824 7.082 1.00 0.00 H new ATOM 281 N LYS A 106 -10.991 -0.504 5.898 1.00 0.00 N ATOM 282 CA LYS A 106 -12.389 -0.930 5.874 1.00 0.00 C ATOM 283 C LYS A 106 -12.797 -1.605 7.185 1.00 0.00 C ATOM 284 O LYS A 106 -13.894 -2.154 7.291 1.00 0.00 O ATOM 285 CB LYS A 106 -12.629 -1.889 4.706 1.00 0.00 C ATOM 286 CG LYS A 106 -13.456 -1.285 3.582 1.00 0.00 C ATOM 287 CD LYS A 106 -12.594 -0.935 2.380 1.00 0.00 C ATOM 288 CE LYS A 106 -12.253 -2.169 1.561 1.00 0.00 C ATOM 289 NZ LYS A 106 -13.160 -2.327 0.390 1.00 0.00 N ATOM 0 H LYS A 106 -10.859 0.507 5.893 1.00 0.00 H new ATOM 0 HA LYS A 106 -13.002 -0.037 5.748 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -11.667 -2.209 4.306 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -13.133 -2.781 5.077 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -14.232 -1.989 3.281 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -13.961 -0.389 3.942 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -13.118 -0.214 1.753 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -11.675 -0.455 2.717 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -11.222 -2.101 1.215 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -12.319 -3.054 2.194 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -12.894 -3.180 -0.142 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -14.142 -2.417 0.721 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -13.078 -1.494 -0.227 1.00 0.00 H new ATOM 303 N ASN A 107 -11.916 -1.564 8.179 1.00 0.00 N ATOM 304 CA ASN A 107 -12.196 -2.176 9.474 1.00 0.00 C ATOM 305 C ASN A 107 -12.599 -1.129 10.512 1.00 0.00 C ATOM 306 O ASN A 107 -12.935 -1.470 11.647 1.00 0.00 O ATOM 307 CB ASN A 107 -10.974 -2.956 9.965 1.00 0.00 C ATOM 308 CG ASN A 107 -11.334 -4.342 10.463 1.00 0.00 C ATOM 309 OD1 ASN A 107 -12.395 -4.874 10.136 1.00 0.00 O ATOM 310 ND2 ASN A 107 -10.451 -4.934 11.258 1.00 0.00 N ATOM 0 H ASN A 107 -11.003 -1.114 8.113 1.00 0.00 H new ATOM 0 HA ASN A 107 -13.033 -2.862 9.344 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -10.251 -3.041 9.154 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -10.489 -2.399 10.767 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -10.639 -5.867 11.624 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -9.584 -4.456 11.503 1.00 0.00 H new ATOM 317 N ALA A 108 -12.566 0.144 10.123 1.00 0.00 N ATOM 318 CA ALA A 108 -12.930 1.228 11.028 1.00 0.00 C ATOM 319 C ALA A 108 -11.977 1.298 12.217 1.00 0.00 C ATOM 320 O ALA A 108 -12.360 1.720 13.308 1.00 0.00 O ATOM 321 CB ALA A 108 -14.364 1.056 11.509 1.00 0.00 C ATOM 0 H ALA A 108 -12.291 0.448 9.189 1.00 0.00 H new ATOM 0 HA ALA A 108 -12.852 2.166 10.478 1.00 0.00 H new ATOM 0 HB1 ALA A 108 -14.622 1.872 12.184 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -15.039 1.066 10.653 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -14.460 0.106 12.035 1.00 0.00 H new ATOM 327 N ASP A 109 -10.733 0.883 11.999 1.00 0.00 N ATOM 328 CA ASP A 109 -9.725 0.902 13.053 1.00 0.00 C ATOM 329 C ASP A 109 -8.588 1.854 12.697 1.00 0.00 C ATOM 330 O ASP A 109 -8.164 2.666 13.519 1.00 0.00 O ATOM 331 CB ASP A 109 -9.173 -0.506 13.288 1.00 0.00 C ATOM 332 CG ASP A 109 -8.575 -1.110 12.033 1.00 0.00 C ATOM 333 OD1 ASP A 109 -9.023 -0.745 10.926 1.00 0.00 O ATOM 334 OD2 ASP A 109 -7.658 -1.949 12.157 1.00 0.00 O ATOM 0 H ASP A 109 -10.399 0.530 11.102 1.00 0.00 H new ATOM 0 HA ASP A 109 -10.199 1.254 13.969 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -8.413 -0.469 14.068 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -9.973 -1.151 13.652 1.00 0.00 H new ATOM 339 N GLY A 110 -8.101 1.750 11.464 1.00 0.00 N ATOM 340 CA GLY A 110 -7.020 2.610 11.019 1.00 0.00 C ATOM 341 C GLY A 110 -5.680 1.900 10.984 1.00 0.00 C ATOM 342 O GLY A 110 -4.631 2.546 10.989 1.00 0.00 O ATOM 0 H GLY A 110 -8.436 1.086 10.766 1.00 0.00 H new ATOM 0 HA2 GLY A 110 -7.251 2.990 10.024 1.00 0.00 H new ATOM 0 HA3 GLY A 110 -6.952 3.473 11.682 1.00 0.00 H new ATOM 346 N TYR A 111 -5.710 0.571 10.946 1.00 0.00 N ATOM 347 CA TYR A 111 -4.482 -0.218 10.908 1.00 0.00 C ATOM 348 C TYR A 111 -4.640 -1.421 9.984 1.00 0.00 C ATOM 349 O TYR A 111 -5.757 -1.870 9.725 1.00 0.00 O ATOM 350 CB TYR A 111 -4.102 -0.694 12.315 1.00 0.00 C ATOM 351 CG TYR A 111 -4.535 0.243 13.422 1.00 0.00 C ATOM 352 CD1 TYR A 111 -4.063 1.548 13.478 1.00 0.00 C ATOM 353 CD2 TYR A 111 -5.416 -0.179 14.410 1.00 0.00 C ATOM 354 CE1 TYR A 111 -4.456 2.406 14.488 1.00 0.00 C ATOM 355 CE2 TYR A 111 -5.814 0.674 15.423 1.00 0.00 C ATOM 356 CZ TYR A 111 -5.331 1.964 15.457 1.00 0.00 C ATOM 357 OH TYR A 111 -5.725 2.816 16.463 1.00 0.00 O ATOM 0 H TYR A 111 -6.568 0.019 10.941 1.00 0.00 H new ATOM 0 HA TYR A 111 -3.687 0.420 10.522 1.00 0.00 H new ATOM 0 HB2 TYR A 111 -4.547 -1.674 12.488 1.00 0.00 H new ATOM 0 HB3 TYR A 111 -3.021 -0.822 12.364 1.00 0.00 H new ATOM 0 HD1 TYR A 111 -3.378 1.898 12.720 1.00 0.00 H new ATOM 0 HD2 TYR A 111 -5.796 -1.190 14.386 1.00 0.00 H new ATOM 0 HE1 TYR A 111 -4.079 3.418 14.518 1.00 0.00 H new ATOM 0 HE2 TYR A 111 -6.500 0.331 16.183 1.00 0.00 H new ATOM 0 HH TYR A 111 -6.344 2.350 17.063 1.00 0.00 H new ATOM 367 N ILE A 112 -3.520 -1.945 9.488 1.00 0.00 N ATOM 368 CA ILE A 112 -3.557 -3.100 8.596 1.00 0.00 C ATOM 369 C ILE A 112 -2.859 -4.304 9.221 1.00 0.00 C ATOM 370 O ILE A 112 -1.750 -4.192 9.742 1.00 0.00 O ATOM 371 CB ILE A 112 -2.907 -2.787 7.233 1.00 0.00 C ATOM 372 CG1 ILE A 112 -3.477 -1.484 6.662 1.00 0.00 C ATOM 373 CG2 ILE A 112 -3.123 -3.943 6.267 1.00 0.00 C ATOM 374 CD1 ILE A 112 -3.102 -1.231 5.216 1.00 0.00 C ATOM 0 H ILE A 112 -2.584 -1.591 9.687 1.00 0.00 H new ATOM 0 HA ILE A 112 -4.609 -3.338 8.437 1.00 0.00 H new ATOM 0 HB ILE A 112 -1.834 -2.658 7.375 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -4.563 -1.506 6.747 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -3.127 -0.649 7.269 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -2.659 -3.708 5.309 1.00 0.00 H new ATOM 0 HG22 ILE A 112 -2.673 -4.848 6.676 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -4.192 -4.102 6.123 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -3.543 -0.291 4.885 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -2.017 -1.175 5.126 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -3.476 -2.045 4.595 1.00 0.00 H new ATOM 386 N ASP A 113 -3.519 -5.457 9.165 1.00 0.00 N ATOM 387 CA ASP A 113 -2.965 -6.684 9.725 1.00 0.00 C ATOM 388 C ASP A 113 -2.747 -7.729 8.636 1.00 0.00 C ATOM 389 O ASP A 113 -3.062 -7.497 7.468 1.00 0.00 O ATOM 390 CB ASP A 113 -3.894 -7.241 10.805 1.00 0.00 C ATOM 391 CG ASP A 113 -3.610 -6.651 12.173 1.00 0.00 C ATOM 392 OD1 ASP A 113 -2.438 -6.688 12.604 1.00 0.00 O ATOM 393 OD2 ASP A 113 -4.560 -6.153 12.813 1.00 0.00 O ATOM 0 H ASP A 113 -4.438 -5.567 8.737 1.00 0.00 H new ATOM 0 HA ASP A 113 -2.000 -6.446 10.173 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -4.929 -7.035 10.531 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -3.785 -8.325 10.850 1.00 0.00 H new ATOM 398 N LEU A 114 -2.204 -8.879 9.025 1.00 0.00 N ATOM 399 CA LEU A 114 -1.938 -9.962 8.082 1.00 0.00 C ATOM 400 C LEU A 114 -3.177 -10.294 7.255 1.00 0.00 C ATOM 401 O LEU A 114 -3.072 -10.699 6.097 1.00 0.00 O ATOM 402 CB LEU A 114 -1.461 -11.208 8.830 1.00 0.00 C ATOM 403 CG LEU A 114 -0.199 -11.012 9.671 1.00 0.00 C ATOM 404 CD1 LEU A 114 -0.188 -11.971 10.850 1.00 0.00 C ATOM 405 CD2 LEU A 114 1.044 -11.203 8.815 1.00 0.00 C ATOM 0 H LEU A 114 -1.939 -9.086 9.988 1.00 0.00 H new ATOM 0 HA LEU A 114 -1.155 -9.628 7.401 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -2.264 -11.552 9.482 1.00 0.00 H new ATOM 0 HB3 LEU A 114 -1.277 -12.001 8.105 1.00 0.00 H new ATOM 0 HG LEU A 114 -0.198 -9.993 10.059 1.00 0.00 H new ATOM 0 HD11 LEU A 114 0.718 -11.816 11.436 1.00 0.00 H new ATOM 0 HD12 LEU A 114 -1.061 -11.788 11.476 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -0.212 -12.998 10.484 1.00 0.00 H new ATOM 0 HD21 LEU A 114 1.934 -11.060 9.428 1.00 0.00 H new ATOM 0 HD22 LEU A 114 1.048 -12.210 8.399 1.00 0.00 H new ATOM 0 HD23 LEU A 114 1.042 -10.475 8.003 1.00 0.00 H new ATOM 417 N GLU A 115 -4.350 -10.117 7.854 1.00 0.00 N ATOM 418 CA GLU A 115 -5.606 -10.396 7.168 1.00 0.00 C ATOM 419 C GLU A 115 -5.859 -9.371 6.068 1.00 0.00 C ATOM 420 O GLU A 115 -6.235 -9.725 4.951 1.00 0.00 O ATOM 421 CB GLU A 115 -6.768 -10.394 8.163 1.00 0.00 C ATOM 422 CG GLU A 115 -6.894 -9.076 8.902 1.00 0.00 C ATOM 423 OE1 GLU A 115 -7.996 -8.784 9.412 1.00 0.00 O ATOM 424 OE2 GLU A 115 -5.890 -8.336 8.971 1.00 0.00 O ATOM 0 H GLU A 115 -4.457 -9.782 8.812 1.00 0.00 H new ATOM 0 HA GLU A 115 -5.533 -11.383 6.712 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -7.698 -10.600 7.632 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -6.627 -11.199 8.884 1.00 0.00 H new ATOM 429 N GLU A 116 -5.645 -8.099 6.390 1.00 0.00 N ATOM 430 CA GLU A 116 -5.846 -7.026 5.425 1.00 0.00 C ATOM 431 C GLU A 116 -4.786 -7.077 4.328 1.00 0.00 C ATOM 432 O GLU A 116 -5.004 -6.591 3.219 1.00 0.00 O ATOM 433 CB GLU A 116 -5.811 -5.666 6.124 1.00 0.00 C ATOM 434 CG GLU A 116 -7.132 -5.280 6.770 1.00 0.00 C ATOM 435 CD GLU A 116 -6.957 -4.296 7.909 1.00 0.00 C ATOM 436 OE1 GLU A 116 -6.674 -3.111 7.633 1.00 0.00 O ATOM 437 OE2 GLU A 116 -7.103 -4.710 9.079 1.00 0.00 O ATOM 0 H GLU A 116 -5.333 -7.788 7.310 1.00 0.00 H new ATOM 0 HA GLU A 116 -6.825 -7.163 4.966 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -5.033 -5.679 6.887 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -5.533 -4.901 5.399 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -7.788 -4.845 6.016 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -7.626 -6.177 7.142 1.00 0.00 H new ATOM 444 N LEU A 117 -3.639 -7.678 4.642 1.00 0.00 N ATOM 445 CA LEU A 117 -2.552 -7.800 3.677 1.00 0.00 C ATOM 446 C LEU A 117 -3.025 -8.514 2.412 1.00 0.00 C ATOM 447 O LEU A 117 -2.416 -8.386 1.350 1.00 0.00 O ATOM 448 CB LEU A 117 -1.373 -8.556 4.295 1.00 0.00 C ATOM 449 CG LEU A 117 -0.292 -7.673 4.920 1.00 0.00 C ATOM 450 CD1 LEU A 117 0.408 -6.848 3.851 1.00 0.00 C ATOM 451 CD2 LEU A 117 -0.891 -6.768 5.986 1.00 0.00 C ATOM 0 H LEU A 117 -3.441 -8.086 5.555 1.00 0.00 H new ATOM 0 HA LEU A 117 -2.226 -6.796 3.406 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -1.756 -9.232 5.060 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -0.914 -9.175 3.524 1.00 0.00 H new ATOM 0 HG LEU A 117 0.447 -8.319 5.394 1.00 0.00 H new ATOM 0 HD11 LEU A 117 1.174 -6.226 4.315 1.00 0.00 H new ATOM 0 HD12 LEU A 117 0.873 -7.514 3.124 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -0.320 -6.212 3.347 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -0.107 -6.147 6.419 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -1.652 -6.130 5.536 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -1.345 -7.377 6.768 1.00 0.00 H new ATOM 463 N LYS A 118 -4.116 -9.264 2.533 1.00 0.00 N ATOM 464 CA LYS A 118 -4.674 -9.992 1.401 1.00 0.00 C ATOM 465 C LYS A 118 -5.408 -9.042 0.455 1.00 0.00 C ATOM 466 O LYS A 118 -5.560 -9.327 -0.733 1.00 0.00 O ATOM 467 CB LYS A 118 -5.627 -11.080 1.898 1.00 0.00 C ATOM 468 CG LYS A 118 -6.273 -11.886 0.782 1.00 0.00 C ATOM 469 CD LYS A 118 -7.571 -12.527 1.242 1.00 0.00 C ATOM 470 CE LYS A 118 -8.684 -11.499 1.375 1.00 0.00 C ATOM 471 NZ LYS A 118 -9.834 -12.024 2.161 1.00 0.00 N ATOM 0 H LYS A 118 -4.631 -9.383 3.405 1.00 0.00 H new ATOM 0 HA LYS A 118 -3.855 -10.458 0.852 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -5.080 -11.758 2.553 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -6.410 -10.618 2.500 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -6.468 -11.237 -0.072 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -5.583 -12.659 0.443 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -7.869 -13.298 0.531 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -7.414 -13.021 2.201 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -8.294 -10.602 1.857 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -9.027 -11.205 0.383 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -10.571 -11.293 2.229 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -10.223 -12.865 1.688 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -9.513 -12.281 3.116 1.00 0.00 H new ATOM 485 N ILE A 119 -5.859 -7.910 0.990 1.00 0.00 N ATOM 486 CA ILE A 119 -6.575 -6.915 0.199 1.00 0.00 C ATOM 487 C ILE A 119 -5.739 -6.450 -0.992 1.00 0.00 C ATOM 488 O ILE A 119 -6.154 -6.583 -2.143 1.00 0.00 O ATOM 489 CB ILE A 119 -6.960 -5.694 1.064 1.00 0.00 C ATOM 490 CG1 ILE A 119 -8.040 -6.084 2.074 1.00 0.00 C ATOM 491 CG2 ILE A 119 -7.436 -4.535 0.195 1.00 0.00 C ATOM 492 CD1 ILE A 119 -7.852 -5.450 3.435 1.00 0.00 C ATOM 0 H ILE A 119 -5.740 -7.659 1.972 1.00 0.00 H new ATOM 0 HA ILE A 119 -7.483 -7.390 -0.172 1.00 0.00 H new ATOM 0 HB ILE A 119 -6.073 -5.365 1.605 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -9.015 -5.797 1.680 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -8.048 -7.168 2.185 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -7.700 -3.689 0.830 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -6.639 -4.241 -0.488 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -8.309 -4.845 -0.379 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -8.654 -5.771 4.100 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -6.892 -5.757 3.850 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -7.874 -4.365 3.337 1.00 0.00 H new ATOM 504 N MET A 120 -4.565 -5.898 -0.703 1.00 0.00 N ATOM 505 CA MET A 120 -3.664 -5.400 -1.742 1.00 0.00 C ATOM 506 C MET A 120 -3.562 -6.373 -2.914 1.00 0.00 C ATOM 507 O MET A 120 -3.510 -5.960 -4.072 1.00 0.00 O ATOM 508 CB MET A 120 -2.273 -5.148 -1.158 1.00 0.00 C ATOM 509 CG MET A 120 -1.787 -6.257 -0.238 1.00 0.00 C ATOM 510 SD MET A 120 -0.138 -5.944 0.418 1.00 0.00 S ATOM 511 CE MET A 120 -0.503 -4.734 1.686 1.00 0.00 C ATOM 0 H MET A 120 -4.212 -5.783 0.247 1.00 0.00 H new ATOM 0 HA MET A 120 -4.079 -4.464 -2.116 1.00 0.00 H new ATOM 0 HB2 MET A 120 -1.562 -5.028 -1.975 1.00 0.00 H new ATOM 0 HB3 MET A 120 -2.285 -4.209 -0.605 1.00 0.00 H new ATOM 0 HG2 MET A 120 -2.487 -6.370 0.590 1.00 0.00 H new ATOM 0 HG3 MET A 120 -1.783 -7.201 -0.784 1.00 0.00 H new ATOM 0 HE1 MET A 120 0.393 -4.545 2.278 1.00 0.00 H new ATOM 0 HE2 MET A 120 -0.832 -3.806 1.219 1.00 0.00 H new ATOM 0 HE3 MET A 120 -1.293 -5.113 2.334 1.00 0.00 H new ATOM 521 N LEU A 121 -3.528 -7.665 -2.607 1.00 0.00 N ATOM 522 CA LEU A 121 -3.426 -8.691 -3.638 1.00 0.00 C ATOM 523 C LEU A 121 -4.592 -8.605 -4.616 1.00 0.00 C ATOM 524 O LEU A 121 -4.403 -8.696 -5.829 1.00 0.00 O ATOM 525 CB LEU A 121 -3.374 -10.079 -3.002 1.00 0.00 C ATOM 526 CG LEU A 121 -1.989 -10.512 -2.523 1.00 0.00 C ATOM 527 CD1 LEU A 121 -2.096 -11.706 -1.588 1.00 0.00 C ATOM 528 CD2 LEU A 121 -1.095 -10.836 -3.710 1.00 0.00 C ATOM 0 H LEU A 121 -3.570 -8.026 -1.654 1.00 0.00 H new ATOM 0 HA LEU A 121 -2.504 -8.520 -4.193 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -4.060 -10.101 -2.155 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -3.738 -10.809 -3.725 1.00 0.00 H new ATOM 0 HG LEU A 121 -1.540 -9.687 -1.970 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -1.100 -12.000 -1.258 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -2.701 -11.437 -0.722 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -2.564 -12.539 -2.113 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -0.112 -11.143 -3.352 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -1.539 -11.645 -4.290 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -0.992 -9.952 -4.340 1.00 0.00 H new ATOM 540 N GLN A 122 -5.797 -8.424 -4.085 1.00 0.00 N ATOM 541 CA GLN A 122 -6.989 -8.320 -4.921 1.00 0.00 C ATOM 542 C GLN A 122 -6.813 -7.237 -5.981 1.00 0.00 C ATOM 543 O GLN A 122 -7.439 -7.282 -7.040 1.00 0.00 O ATOM 544 CB GLN A 122 -8.218 -8.014 -4.063 1.00 0.00 C ATOM 545 CG GLN A 122 -9.006 -9.251 -3.664 1.00 0.00 C ATOM 546 CD GLN A 122 -10.419 -8.926 -3.222 1.00 0.00 C ATOM 547 OE1 GLN A 122 -10.823 -7.763 -3.201 1.00 0.00 O ATOM 548 NE2 GLN A 122 -11.179 -9.955 -2.864 1.00 0.00 N ATOM 0 H GLN A 122 -5.974 -8.346 -3.084 1.00 0.00 H new ATOM 0 HA GLN A 122 -7.136 -9.277 -5.422 1.00 0.00 H new ATOM 0 HB2 GLN A 122 -7.900 -7.490 -3.162 1.00 0.00 H new ATOM 0 HB3 GLN A 122 -8.874 -7.337 -4.611 1.00 0.00 H new ATOM 0 HG2 GLN A 122 -9.043 -9.941 -4.507 1.00 0.00 H new ATOM 0 HG3 GLN A 122 -8.485 -9.763 -2.855 1.00 0.00 H new ATOM 0 HE21 GLN A 122 -10.803 -10.903 -2.897 1.00 0.00 H new ATOM 0 HE22 GLN A 122 -12.139 -9.798 -2.556 1.00 0.00 H new ATOM 557 N ALA A 123 -5.955 -6.264 -5.688 1.00 0.00 N ATOM 558 CA ALA A 123 -5.694 -5.171 -6.613 1.00 0.00 C ATOM 559 C ALA A 123 -4.935 -5.661 -7.841 1.00 0.00 C ATOM 560 O ALA A 123 -5.154 -5.177 -8.952 1.00 0.00 O ATOM 561 CB ALA A 123 -4.914 -4.067 -5.915 1.00 0.00 C ATOM 0 H ALA A 123 -5.429 -6.212 -4.816 1.00 0.00 H new ATOM 0 HA ALA A 123 -6.652 -4.771 -6.946 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -4.725 -3.255 -6.617 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -5.493 -3.690 -5.072 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -3.965 -4.464 -5.555 1.00 0.00 H new ATOM 567 N THR A 124 -4.041 -6.623 -7.634 1.00 0.00 N ATOM 568 CA THR A 124 -3.249 -7.176 -8.727 1.00 0.00 C ATOM 569 C THR A 124 -3.918 -8.415 -9.313 1.00 0.00 C ATOM 570 O THR A 124 -3.980 -8.582 -10.531 1.00 0.00 O ATOM 571 CB THR A 124 -1.841 -7.524 -8.240 1.00 0.00 C ATOM 572 OG1 THR A 124 -1.084 -8.119 -9.280 1.00 0.00 O ATOM 573 CG2 THR A 124 -1.829 -8.474 -7.062 1.00 0.00 C ATOM 0 H THR A 124 -3.847 -7.035 -6.721 1.00 0.00 H new ATOM 0 HA THR A 124 -3.179 -6.420 -9.509 1.00 0.00 H new ATOM 0 HB THR A 124 -1.404 -6.577 -7.924 1.00 0.00 H new ATOM 0 HG1 THR A 124 -0.135 -8.114 -9.037 1.00 0.00 H new ATOM 0 HG21 THR A 124 -0.799 -8.677 -6.769 1.00 0.00 H new ATOM 0 HG22 THR A 124 -2.362 -8.023 -6.225 1.00 0.00 H new ATOM 0 HG23 THR A 124 -2.318 -9.407 -7.342 1.00 0.00 H new ATOM 581 N GLY A 125 -4.420 -9.281 -8.438 1.00 0.00 N ATOM 582 CA GLY A 125 -5.079 -10.492 -8.889 1.00 0.00 C ATOM 583 C GLY A 125 -4.244 -11.734 -8.646 1.00 0.00 C ATOM 584 O GLY A 125 -4.783 -12.818 -8.422 1.00 0.00 O ATOM 0 H GLY A 125 -4.382 -9.165 -7.425 1.00 0.00 H new ATOM 0 HA2 GLY A 125 -6.035 -10.595 -8.375 1.00 0.00 H new ATOM 0 HA3 GLY A 125 -5.297 -10.408 -9.954 1.00 0.00 H new ATOM 588 N GLU A 126 -2.924 -11.578 -8.689 1.00 0.00 N ATOM 589 CA GLU A 126 -2.014 -12.698 -8.471 1.00 0.00 C ATOM 590 C GLU A 126 -2.256 -13.339 -7.111 1.00 0.00 C ATOM 591 O GLU A 126 -2.007 -12.728 -6.072 1.00 0.00 O ATOM 592 CB GLU A 126 -0.561 -12.233 -8.579 1.00 0.00 C ATOM 593 CG GLU A 126 -0.270 -10.959 -7.804 1.00 0.00 C ATOM 594 CD GLU A 126 1.187 -10.840 -7.402 1.00 0.00 C ATOM 595 OE1 GLU A 126 1.988 -10.334 -8.216 1.00 0.00 O ATOM 596 OE2 GLU A 126 1.527 -11.253 -6.273 1.00 0.00 O ATOM 0 H GLU A 126 -2.461 -10.688 -8.873 1.00 0.00 H new ATOM 0 HA GLU A 126 -2.206 -13.444 -9.242 1.00 0.00 H new ATOM 0 HB2 GLU A 126 0.093 -13.026 -8.217 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -0.317 -12.073 -9.629 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -0.547 -10.097 -8.412 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -0.893 -10.932 -6.910 1.00 0.00 H new ATOM 603 N THR A 127 -2.745 -14.574 -7.126 1.00 0.00 N ATOM 604 CA THR A 127 -3.021 -15.295 -5.892 1.00 0.00 C ATOM 605 C THR A 127 -1.730 -15.658 -5.178 1.00 0.00 C ATOM 606 O THR A 127 -1.012 -16.572 -5.582 1.00 0.00 O ATOM 607 CB THR A 127 -3.842 -16.553 -6.177 1.00 0.00 C ATOM 608 OG1 THR A 127 -5.049 -16.224 -6.841 1.00 0.00 O ATOM 609 CG2 THR A 127 -4.202 -17.328 -4.928 1.00 0.00 C ATOM 0 H THR A 127 -2.957 -15.094 -7.977 1.00 0.00 H new ATOM 0 HA THR A 127 -3.601 -14.641 -5.241 1.00 0.00 H new ATOM 0 HB THR A 127 -3.205 -17.178 -6.802 1.00 0.00 H new ATOM 0 HG1 THR A 127 -5.559 -17.042 -7.016 1.00 0.00 H new ATOM 0 HG21 THR A 127 -4.784 -18.208 -5.201 1.00 0.00 H new ATOM 0 HG22 THR A 127 -3.291 -17.640 -4.418 1.00 0.00 H new ATOM 0 HG23 THR A 127 -4.791 -16.695 -4.264 1.00 0.00 H new ATOM 617 N ILE A 128 -1.442 -14.920 -4.116 1.00 0.00 N ATOM 618 CA ILE A 128 -0.238 -15.138 -3.335 1.00 0.00 C ATOM 619 C ILE A 128 -0.484 -16.105 -2.182 1.00 0.00 C ATOM 620 O ILE A 128 -1.608 -16.250 -1.701 1.00 0.00 O ATOM 621 CB ILE A 128 0.315 -13.794 -2.803 1.00 0.00 C ATOM 622 CG1 ILE A 128 1.488 -13.349 -3.672 1.00 0.00 C ATOM 623 CG2 ILE A 128 0.732 -13.886 -1.339 1.00 0.00 C ATOM 624 CD1 ILE A 128 2.207 -12.123 -3.151 1.00 0.00 C ATOM 0 H ILE A 128 -2.032 -14.160 -3.775 1.00 0.00 H new ATOM 0 HA ILE A 128 0.504 -15.589 -3.994 1.00 0.00 H new ATOM 0 HB ILE A 128 -0.482 -13.052 -2.858 1.00 0.00 H new ATOM 0 HG12 ILE A 128 2.201 -14.170 -3.751 1.00 0.00 H new ATOM 0 HG13 ILE A 128 1.124 -13.144 -4.679 1.00 0.00 H new ATOM 0 HG21 ILE A 128 1.114 -12.920 -1.008 1.00 0.00 H new ATOM 0 HG22 ILE A 128 -0.130 -14.163 -0.732 1.00 0.00 H new ATOM 0 HG23 ILE A 128 1.511 -14.641 -1.229 1.00 0.00 H new ATOM 0 HD11 ILE A 128 3.027 -11.870 -3.822 1.00 0.00 H new ATOM 0 HD12 ILE A 128 1.510 -11.287 -3.098 1.00 0.00 H new ATOM 0 HD13 ILE A 128 2.603 -12.328 -2.156 1.00 0.00 H new ATOM 636 N THR A 129 0.585 -16.760 -1.747 1.00 0.00 N ATOM 637 CA THR A 129 0.512 -17.715 -0.651 1.00 0.00 C ATOM 638 C THR A 129 0.508 -16.998 0.693 1.00 0.00 C ATOM 639 O THR A 129 0.930 -15.847 0.795 1.00 0.00 O ATOM 640 CB THR A 129 1.694 -18.682 -0.719 1.00 0.00 C ATOM 641 OG1 THR A 129 1.759 -19.479 0.450 1.00 0.00 O ATOM 642 CG2 THR A 129 3.028 -17.981 -0.873 1.00 0.00 C ATOM 0 H THR A 129 1.519 -16.645 -2.141 1.00 0.00 H new ATOM 0 HA THR A 129 -0.418 -18.275 -0.747 1.00 0.00 H new ATOM 0 HB THR A 129 1.518 -19.295 -1.603 1.00 0.00 H new ATOM 0 HG1 THR A 129 2.521 -20.092 0.386 1.00 0.00 H new ATOM 0 HG21 THR A 129 3.826 -18.722 -0.915 1.00 0.00 H new ATOM 0 HG22 THR A 129 3.028 -17.396 -1.793 1.00 0.00 H new ATOM 0 HG23 THR A 129 3.192 -17.320 -0.022 1.00 0.00 H new ATOM 650 N GLU A 130 0.035 -17.689 1.725 1.00 0.00 N ATOM 651 CA GLU A 130 -0.016 -17.117 3.066 1.00 0.00 C ATOM 652 C GLU A 130 1.372 -16.669 3.518 1.00 0.00 C ATOM 653 O GLU A 130 1.505 -15.813 4.393 1.00 0.00 O ATOM 654 CB GLU A 130 -0.584 -18.136 4.056 1.00 0.00 C ATOM 655 CG GLU A 130 -1.517 -17.526 5.089 1.00 0.00 C ATOM 656 CD GLU A 130 -1.903 -18.508 6.178 1.00 0.00 C ATOM 657 OE1 GLU A 130 -1.028 -19.286 6.614 1.00 0.00 O ATOM 658 OE2 GLU A 130 -3.081 -18.500 6.594 1.00 0.00 O ATOM 0 H GLU A 130 -0.318 -18.644 1.659 1.00 0.00 H new ATOM 0 HA GLU A 130 -0.669 -16.245 3.039 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -1.122 -18.906 3.503 1.00 0.00 H new ATOM 0 HB3 GLU A 130 0.241 -18.629 4.570 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -1.036 -16.659 5.541 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -2.418 -17.167 4.592 1.00 0.00 H new ATOM 665 N ASP A 131 2.404 -17.253 2.913 1.00 0.00 N ATOM 666 CA ASP A 131 3.781 -16.914 3.250 1.00 0.00 C ATOM 667 C ASP A 131 4.135 -15.513 2.760 1.00 0.00 C ATOM 668 O ASP A 131 4.681 -14.704 3.509 1.00 0.00 O ATOM 669 CB ASP A 131 4.741 -17.941 2.644 1.00 0.00 C ATOM 670 CG ASP A 131 5.649 -18.568 3.684 1.00 0.00 C ATOM 671 OD1 ASP A 131 6.595 -17.888 4.134 1.00 0.00 O ATOM 672 OD2 ASP A 131 5.415 -19.740 4.047 1.00 0.00 O ATOM 0 H ASP A 131 2.311 -17.963 2.187 1.00 0.00 H new ATOM 0 HA ASP A 131 3.879 -16.931 4.335 1.00 0.00 H new ATOM 0 HB2 ASP A 131 4.166 -18.723 2.149 1.00 0.00 H new ATOM 0 HB3 ASP A 131 5.349 -17.459 1.878 1.00 0.00 H new ATOM 677 N ASP A 132 3.822 -15.231 1.498 1.00 0.00 N ATOM 678 CA ASP A 132 4.110 -13.927 0.916 1.00 0.00 C ATOM 679 C ASP A 132 3.321 -12.830 1.625 1.00 0.00 C ATOM 680 O ASP A 132 3.768 -11.686 1.708 1.00 0.00 O ATOM 681 CB ASP A 132 3.782 -13.934 -0.579 1.00 0.00 C ATOM 682 CG ASP A 132 5.006 -13.689 -1.441 1.00 0.00 C ATOM 683 OD1 ASP A 132 5.922 -12.975 -0.981 1.00 0.00 O ATOM 684 OD2 ASP A 132 5.047 -14.210 -2.575 1.00 0.00 O ATOM 0 H ASP A 132 3.370 -15.888 0.862 1.00 0.00 H new ATOM 0 HA ASP A 132 5.172 -13.720 1.045 1.00 0.00 H new ATOM 0 HB2 ASP A 132 3.339 -14.893 -0.846 1.00 0.00 H new ATOM 0 HB3 ASP A 132 3.035 -13.168 -0.788 1.00 0.00 H new ATOM 689 N ILE A 133 2.147 -13.187 2.138 1.00 0.00 N ATOM 690 CA ILE A 133 1.299 -12.235 2.842 1.00 0.00 C ATOM 691 C ILE A 133 1.786 -12.020 4.272 1.00 0.00 C ATOM 692 O ILE A 133 1.791 -10.897 4.775 1.00 0.00 O ATOM 693 CB ILE A 133 -0.165 -12.711 2.875 1.00 0.00 C ATOM 694 CG1 ILE A 133 -0.634 -13.063 1.457 1.00 0.00 C ATOM 695 CG2 ILE A 133 -1.052 -11.643 3.499 1.00 0.00 C ATOM 696 CD1 ILE A 133 -2.126 -12.914 1.244 1.00 0.00 C ATOM 0 H ILE A 133 1.763 -14.130 2.078 1.00 0.00 H new ATOM 0 HA ILE A 133 1.356 -11.293 2.297 1.00 0.00 H new ATOM 0 HB ILE A 133 -0.237 -13.608 3.490 1.00 0.00 H new ATOM 0 HG12 ILE A 133 -0.111 -12.426 0.744 1.00 0.00 H new ATOM 0 HG13 ILE A 133 -0.347 -14.091 1.236 1.00 0.00 H new ATOM 0 HG21 ILE A 133 -2.084 -11.992 3.516 1.00 0.00 H new ATOM 0 HG22 ILE A 133 -0.719 -11.443 4.518 1.00 0.00 H new ATOM 0 HG23 ILE A 133 -0.988 -10.728 2.911 1.00 0.00 H new ATOM 0 HD11 ILE A 133 -2.375 -13.182 0.217 1.00 0.00 H new ATOM 0 HD12 ILE A 133 -2.659 -13.572 1.930 1.00 0.00 H new ATOM 0 HD13 ILE A 133 -2.419 -11.881 1.431 1.00 0.00 H new ATOM 708 N GLU A 134 2.191 -13.106 4.923 1.00 0.00 N ATOM 709 CA GLU A 134 2.676 -13.038 6.297 1.00 0.00 C ATOM 710 C GLU A 134 4.060 -12.402 6.358 1.00 0.00 C ATOM 711 O GLU A 134 4.404 -11.731 7.331 1.00 0.00 O ATOM 712 CB GLU A 134 2.718 -14.438 6.914 1.00 0.00 C ATOM 713 CG GLU A 134 2.502 -14.446 8.418 1.00 0.00 C ATOM 714 CD GLU A 134 2.987 -15.727 9.069 1.00 0.00 C ATOM 715 OE1 GLU A 134 2.272 -16.747 8.977 1.00 0.00 O ATOM 716 OE2 GLU A 134 4.081 -15.710 9.671 1.00 0.00 O ATOM 0 H GLU A 134 2.193 -14.044 4.521 1.00 0.00 H new ATOM 0 HA GLU A 134 1.987 -12.416 6.867 1.00 0.00 H new ATOM 0 HB2 GLU A 134 1.955 -15.057 6.442 1.00 0.00 H new ATOM 0 HB3 GLU A 134 3.682 -14.895 6.691 1.00 0.00 H new ATOM 0 HG2 GLU A 134 3.023 -13.597 8.861 1.00 0.00 H new ATOM 0 HG3 GLU A 134 1.441 -14.314 8.630 1.00 0.00 H new ATOM 723 N GLU A 135 4.852 -12.617 5.313 1.00 0.00 N ATOM 724 CA GLU A 135 6.200 -12.064 5.249 1.00 0.00 C ATOM 725 C GLU A 135 6.169 -10.590 4.858 1.00 0.00 C ATOM 726 O GLU A 135 7.060 -9.823 5.220 1.00 0.00 O ATOM 727 CB GLU A 135 7.049 -12.851 4.249 1.00 0.00 C ATOM 728 CG GLU A 135 8.515 -12.949 4.640 1.00 0.00 C ATOM 729 CD GLU A 135 8.889 -14.325 5.157 1.00 0.00 C ATOM 730 OE1 GLU A 135 9.211 -15.203 4.329 1.00 0.00 O ATOM 731 OE2 GLU A 135 8.861 -14.524 6.390 1.00 0.00 O ATOM 0 H GLU A 135 4.584 -13.170 4.499 1.00 0.00 H new ATOM 0 HA GLU A 135 6.646 -12.147 6.240 1.00 0.00 H new ATOM 0 HB2 GLU A 135 6.640 -13.856 4.150 1.00 0.00 H new ATOM 0 HB3 GLU A 135 6.974 -12.378 3.270 1.00 0.00 H new ATOM 0 HG2 GLU A 135 9.135 -12.709 3.776 1.00 0.00 H new ATOM 0 HG3 GLU A 135 8.734 -12.205 5.406 1.00 0.00 H new ATOM 738 N LEU A 136 5.138 -10.201 4.114 1.00 0.00 N ATOM 739 CA LEU A 136 4.995 -8.819 3.673 1.00 0.00 C ATOM 740 C LEU A 136 4.653 -7.903 4.844 1.00 0.00 C ATOM 741 O LEU A 136 5.285 -6.864 5.038 1.00 0.00 O ATOM 742 CB LEU A 136 3.911 -8.715 2.597 1.00 0.00 C ATOM 743 CG LEU A 136 3.617 -7.295 2.106 1.00 0.00 C ATOM 744 CD1 LEU A 136 4.909 -6.516 1.920 1.00 0.00 C ATOM 745 CD2 LEU A 136 2.823 -7.334 0.809 1.00 0.00 C ATOM 0 H LEU A 136 4.391 -10.823 3.805 1.00 0.00 H new ATOM 0 HA LEU A 136 5.949 -8.499 3.253 1.00 0.00 H new ATOM 0 HB2 LEU A 136 4.209 -9.324 1.743 1.00 0.00 H new ATOM 0 HB3 LEU A 136 2.989 -9.145 2.989 1.00 0.00 H new ATOM 0 HG LEU A 136 3.017 -6.787 2.861 1.00 0.00 H new ATOM 0 HD11 LEU A 136 4.680 -5.509 1.571 1.00 0.00 H new ATOM 0 HD12 LEU A 136 5.439 -6.458 2.871 1.00 0.00 H new ATOM 0 HD13 LEU A 136 5.536 -7.021 1.185 1.00 0.00 H new ATOM 0 HD21 LEU A 136 2.623 -6.316 0.474 1.00 0.00 H new ATOM 0 HD22 LEU A 136 3.397 -7.860 0.047 1.00 0.00 H new ATOM 0 HD23 LEU A 136 1.879 -7.853 0.976 1.00 0.00 H new ATOM 757 N MET A 137 3.647 -8.296 5.619 1.00 0.00 N ATOM 758 CA MET A 137 3.206 -7.517 6.777 1.00 0.00 C ATOM 759 C MET A 137 4.395 -7.019 7.597 1.00 0.00 C ATOM 760 O MET A 137 4.332 -5.955 8.213 1.00 0.00 O ATOM 761 CB MET A 137 2.284 -8.362 7.661 1.00 0.00 C ATOM 762 CG MET A 137 1.780 -7.628 8.893 1.00 0.00 C ATOM 763 SD MET A 137 0.947 -6.081 8.489 1.00 0.00 S ATOM 764 CE MET A 137 0.983 -5.253 10.077 1.00 0.00 C ATOM 0 H MET A 137 3.117 -9.154 5.467 1.00 0.00 H new ATOM 0 HA MET A 137 2.659 -6.649 6.408 1.00 0.00 H new ATOM 0 HB2 MET A 137 1.429 -8.691 7.070 1.00 0.00 H new ATOM 0 HB3 MET A 137 2.818 -9.258 7.976 1.00 0.00 H new ATOM 0 HG2 MET A 137 1.093 -8.274 9.440 1.00 0.00 H new ATOM 0 HG3 MET A 137 2.620 -7.421 9.557 1.00 0.00 H new ATOM 0 HE1 MET A 137 0.931 -4.175 9.926 1.00 0.00 H new ATOM 0 HE2 MET A 137 0.132 -5.577 10.676 1.00 0.00 H new ATOM 0 HE3 MET A 137 1.908 -5.502 10.596 1.00 0.00 H new ATOM 774 N LYS A 138 5.476 -7.792 7.597 1.00 0.00 N ATOM 775 CA LYS A 138 6.678 -7.425 8.338 1.00 0.00 C ATOM 776 C LYS A 138 7.167 -6.036 7.932 1.00 0.00 C ATOM 777 O LYS A 138 7.803 -5.336 8.719 1.00 0.00 O ATOM 778 CB LYS A 138 7.782 -8.460 8.104 1.00 0.00 C ATOM 779 CG LYS A 138 8.226 -9.172 9.371 1.00 0.00 C ATOM 780 CD LYS A 138 9.230 -10.272 9.070 1.00 0.00 C ATOM 781 CE LYS A 138 8.997 -11.494 9.943 1.00 0.00 C ATOM 782 NZ LYS A 138 9.135 -11.177 11.391 1.00 0.00 N ATOM 0 H LYS A 138 5.545 -8.676 7.093 1.00 0.00 H new ATOM 0 HA LYS A 138 6.429 -7.404 9.399 1.00 0.00 H new ATOM 0 HB2 LYS A 138 7.429 -9.200 7.386 1.00 0.00 H new ATOM 0 HB3 LYS A 138 8.643 -7.965 7.654 1.00 0.00 H new ATOM 0 HG2 LYS A 138 8.670 -8.451 10.058 1.00 0.00 H new ATOM 0 HG3 LYS A 138 7.358 -9.598 9.873 1.00 0.00 H new ATOM 0 HD2 LYS A 138 9.157 -10.555 8.020 1.00 0.00 H new ATOM 0 HD3 LYS A 138 10.241 -9.897 9.230 1.00 0.00 H new ATOM 0 HE2 LYS A 138 8.000 -11.892 9.752 1.00 0.00 H new ATOM 0 HE3 LYS A 138 9.709 -12.274 9.673 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 9.053 -12.052 11.947 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 10.064 -10.743 11.564 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 8.385 -10.515 11.674 1.00 0.00 H new ATOM 796 N ASP A 139 6.862 -5.645 6.698 1.00 0.00 N ATOM 797 CA ASP A 139 7.268 -4.342 6.186 1.00 0.00 C ATOM 798 C ASP A 139 6.389 -3.234 6.758 1.00 0.00 C ATOM 799 O ASP A 139 6.890 -2.238 7.280 1.00 0.00 O ATOM 800 CB ASP A 139 7.193 -4.327 4.658 1.00 0.00 C ATOM 801 CG ASP A 139 8.327 -3.541 4.031 1.00 0.00 C ATOM 802 OD1 ASP A 139 9.479 -3.696 4.486 1.00 0.00 O ATOM 803 OD2 ASP A 139 8.062 -2.770 3.084 1.00 0.00 O ATOM 0 H ASP A 139 6.335 -6.213 6.035 1.00 0.00 H new ATOM 0 HA ASP A 139 8.297 -4.162 6.496 1.00 0.00 H new ATOM 0 HB2 ASP A 139 7.215 -5.351 4.286 1.00 0.00 H new ATOM 0 HB3 ASP A 139 6.241 -3.896 4.348 1.00 0.00 H new ATOM 808 N GLY A 140 5.075 -3.414 6.657 1.00 0.00 N ATOM 809 CA GLY A 140 4.147 -2.421 7.169 1.00 0.00 C ATOM 810 C GLY A 140 4.410 -2.077 8.621 1.00 0.00 C ATOM 811 O GLY A 140 4.783 -0.948 8.942 1.00 0.00 O ATOM 0 H GLY A 140 4.636 -4.230 6.230 1.00 0.00 H new ATOM 0 HA2 GLY A 140 4.219 -1.516 6.566 1.00 0.00 H new ATOM 0 HA3 GLY A 140 3.128 -2.793 7.066 1.00 0.00 H new ATOM 815 N ASP A 141 4.211 -3.050 9.501 1.00 0.00 N ATOM 816 CA ASP A 141 4.425 -2.844 10.928 1.00 0.00 C ATOM 817 C ASP A 141 5.893 -3.043 11.293 1.00 0.00 C ATOM 818 O ASP A 141 6.289 -4.112 11.756 1.00 0.00 O ATOM 819 CB ASP A 141 3.547 -3.799 11.738 1.00 0.00 C ATOM 820 CG ASP A 141 3.679 -3.580 13.232 1.00 0.00 C ATOM 821 OD1 ASP A 141 4.125 -2.485 13.635 1.00 0.00 O ATOM 822 OD2 ASP A 141 3.337 -4.504 14.000 1.00 0.00 O ATOM 0 H ASP A 141 3.902 -3.990 9.252 1.00 0.00 H new ATOM 0 HA ASP A 141 4.149 -1.817 11.169 1.00 0.00 H new ATOM 0 HB2 ASP A 141 2.505 -3.667 11.445 1.00 0.00 H new ATOM 0 HB3 ASP A 141 3.818 -4.828 11.499 1.00 0.00 H new ATOM 827 N LYS A 142 6.695 -2.004 11.081 1.00 0.00 N ATOM 828 CA LYS A 142 8.120 -2.061 11.387 1.00 0.00 C ATOM 829 C LYS A 142 8.410 -1.445 12.753 1.00 0.00 C ATOM 830 O LYS A 142 9.509 -0.949 13.000 1.00 0.00 O ATOM 831 CB LYS A 142 8.924 -1.334 10.309 1.00 0.00 C ATOM 832 CG LYS A 142 9.276 -2.209 9.117 1.00 0.00 C ATOM 833 CD LYS A 142 9.631 -1.373 7.898 1.00 0.00 C ATOM 834 CE LYS A 142 11.137 -1.240 7.733 1.00 0.00 C ATOM 835 NZ LYS A 142 11.761 -0.527 8.881 1.00 0.00 N ATOM 0 H LYS A 142 6.382 -1.112 10.698 1.00 0.00 H new ATOM 0 HA LYS A 142 8.418 -3.109 11.410 1.00 0.00 H new ATOM 0 HB2 LYS A 142 8.353 -0.473 9.961 1.00 0.00 H new ATOM 0 HB3 LYS A 142 9.843 -0.950 10.751 1.00 0.00 H new ATOM 0 HG2 LYS A 142 10.116 -2.855 9.374 1.00 0.00 H new ATOM 0 HG3 LYS A 142 8.434 -2.860 8.881 1.00 0.00 H new ATOM 0 HD2 LYS A 142 9.205 -1.831 7.005 1.00 0.00 H new ATOM 0 HD3 LYS A 142 9.185 -0.383 7.992 1.00 0.00 H new ATOM 0 HE2 LYS A 142 11.580 -2.231 7.637 1.00 0.00 H new ATOM 0 HE3 LYS A 142 11.355 -0.702 6.810 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 12.742 -0.277 8.643 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 11.223 0.339 9.085 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 11.754 -1.144 9.718 1.00 0.00 H new ATOM 849 N ASN A 143 7.418 -1.479 13.637 1.00 0.00 N ATOM 850 CA ASN A 143 7.568 -0.923 14.977 1.00 0.00 C ATOM 851 C ASN A 143 7.568 -2.025 16.035 1.00 0.00 C ATOM 852 O ASN A 143 7.993 -1.806 17.169 1.00 0.00 O ATOM 853 CB ASN A 143 6.443 0.073 15.266 1.00 0.00 C ATOM 854 CG ASN A 143 6.622 1.379 14.517 1.00 0.00 C ATOM 855 OD1 ASN A 143 7.745 1.804 14.245 1.00 0.00 O ATOM 856 ND2 ASN A 143 5.511 2.025 14.181 1.00 0.00 N ATOM 0 H ASN A 143 6.502 -1.886 13.450 1.00 0.00 H new ATOM 0 HA ASN A 143 8.527 -0.406 15.020 1.00 0.00 H new ATOM 0 HB2 ASN A 143 5.487 -0.373 14.991 1.00 0.00 H new ATOM 0 HB3 ASN A 143 6.405 0.273 16.337 1.00 0.00 H new ATOM 0 HD21 ASN A 143 5.568 2.910 13.677 1.00 0.00 H new ATOM 0 HD22 ASN A 143 4.601 1.636 14.427 1.00 0.00 H new ATOM 863 N ASN A 144 7.088 -3.209 15.660 1.00 0.00 N ATOM 864 CA ASN A 144 7.034 -4.339 16.581 1.00 0.00 C ATOM 865 C ASN A 144 6.038 -4.072 17.706 1.00 0.00 C ATOM 866 O ASN A 144 6.367 -4.198 18.886 1.00 0.00 O ATOM 867 CB ASN A 144 8.422 -4.622 17.163 1.00 0.00 C ATOM 868 CG ASN A 144 8.704 -6.106 17.293 1.00 0.00 C ATOM 869 OD1 ASN A 144 8.515 -6.694 18.357 1.00 0.00 O ATOM 870 ND2 ASN A 144 9.159 -6.719 16.207 1.00 0.00 N ATOM 0 H ASN A 144 6.732 -3.409 14.726 1.00 0.00 H new ATOM 0 HA ASN A 144 6.701 -5.215 16.024 1.00 0.00 H new ATOM 0 HB2 ASN A 144 9.180 -4.166 16.526 1.00 0.00 H new ATOM 0 HB3 ASN A 144 8.504 -4.152 18.143 1.00 0.00 H new ATOM 0 HD21 ASN A 144 9.367 -7.717 16.234 1.00 0.00 H new ATOM 0 HD22 ASN A 144 9.301 -6.192 15.345 1.00 0.00 H new ATOM 877 N ASP A 145 4.818 -3.703 17.330 1.00 0.00 N ATOM 878 CA ASP A 145 3.771 -3.418 18.304 1.00 0.00 C ATOM 879 C ASP A 145 2.627 -4.419 18.179 1.00 0.00 C ATOM 880 O ASP A 145 2.124 -4.929 19.180 1.00 0.00 O ATOM 881 CB ASP A 145 3.242 -1.995 18.114 1.00 0.00 C ATOM 882 CG ASP A 145 2.782 -1.734 16.693 1.00 0.00 C ATOM 883 OD1 ASP A 145 1.699 -2.231 16.319 1.00 0.00 O ATOM 884 OD2 ASP A 145 3.505 -1.031 15.955 1.00 0.00 O ATOM 0 H ASP A 145 4.530 -3.594 16.358 1.00 0.00 H new ATOM 0 HA ASP A 145 4.202 -3.507 19.301 1.00 0.00 H new ATOM 0 HB2 ASP A 145 2.411 -1.825 18.799 1.00 0.00 H new ATOM 0 HB3 ASP A 145 4.023 -1.282 18.377 1.00 0.00 H new ATOM 889 N GLY A 146 2.222 -4.697 16.944 1.00 0.00 N ATOM 890 CA GLY A 146 1.141 -5.636 16.713 1.00 0.00 C ATOM 891 C GLY A 146 0.446 -5.413 15.384 1.00 0.00 C ATOM 892 O GLY A 146 -0.130 -6.340 14.815 1.00 0.00 O ATOM 0 H GLY A 146 2.623 -4.289 16.100 1.00 0.00 H new ATOM 0 HA2 GLY A 146 1.534 -6.652 16.747 1.00 0.00 H new ATOM 0 HA3 GLY A 146 0.412 -5.550 17.519 1.00 0.00 H new ATOM 896 N ARG A 147 0.498 -4.181 14.888 1.00 0.00 N ATOM 897 CA ARG A 147 -0.135 -3.844 13.618 1.00 0.00 C ATOM 898 C ARG A 147 0.505 -2.606 12.997 1.00 0.00 C ATOM 899 O ARG A 147 1.441 -2.032 13.553 1.00 0.00 O ATOM 900 CB ARG A 147 -1.634 -3.610 13.819 1.00 0.00 C ATOM 901 CG ARG A 147 -1.955 -2.693 14.989 1.00 0.00 C ATOM 902 CD ARG A 147 -3.327 -2.991 15.574 1.00 0.00 C ATOM 903 NE ARG A 147 -3.268 -3.233 17.014 1.00 0.00 N ATOM 904 CZ ARG A 147 -2.902 -4.392 17.557 1.00 0.00 C ATOM 905 NH1 ARG A 147 -2.556 -5.415 16.785 1.00 0.00 N ATOM 906 NH2 ARG A 147 -2.879 -4.528 18.876 1.00 0.00 N ATOM 0 H ARG A 147 0.971 -3.401 15.345 1.00 0.00 H new ATOM 0 HA ARG A 147 0.009 -4.683 12.937 1.00 0.00 H new ATOM 0 HB2 ARG A 147 -2.052 -3.182 12.908 1.00 0.00 H new ATOM 0 HB3 ARG A 147 -2.126 -4.570 13.975 1.00 0.00 H new ATOM 0 HG2 ARG A 147 -1.196 -2.810 15.762 1.00 0.00 H new ATOM 0 HG3 ARG A 147 -1.917 -1.655 14.659 1.00 0.00 H new ATOM 0 HD2 ARG A 147 -3.996 -2.154 15.374 1.00 0.00 H new ATOM 0 HD3 ARG A 147 -3.751 -3.863 15.077 1.00 0.00 H new ATOM 0 HE ARG A 147 -3.522 -2.469 17.640 1.00 0.00 H new ATOM 0 HH11 ARG A 147 -2.570 -5.315 15.770 1.00 0.00 H new ATOM 0 HH12 ARG A 147 -2.276 -6.301 17.207 1.00 0.00 H new ATOM 0 HH21 ARG A 147 -3.142 -3.745 19.474 1.00 0.00 H new ATOM 0 HH22 ARG A 147 -2.599 -5.416 19.292 1.00 0.00 H new ATOM 920 N ILE A 148 -0.008 -2.202 11.839 1.00 0.00 N ATOM 921 CA ILE A 148 0.508 -1.033 11.137 1.00 0.00 C ATOM 922 C ILE A 148 -0.553 0.059 11.053 1.00 0.00 C ATOM 923 O ILE A 148 -1.694 -0.204 10.681 1.00 0.00 O ATOM 924 CB ILE A 148 0.999 -1.409 9.718 1.00 0.00 C ATOM 925 CG1 ILE A 148 1.957 -0.347 9.176 1.00 0.00 C ATOM 926 CG2 ILE A 148 -0.164 -1.617 8.762 1.00 0.00 C ATOM 927 CD1 ILE A 148 1.281 0.948 8.788 1.00 0.00 C ATOM 0 H ILE A 148 -0.782 -2.668 11.366 1.00 0.00 H new ATOM 0 HA ILE A 148 1.357 -0.652 11.705 1.00 0.00 H new ATOM 0 HB ILE A 148 1.537 -2.354 9.797 1.00 0.00 H new ATOM 0 HG12 ILE A 148 2.716 -0.138 9.930 1.00 0.00 H new ATOM 0 HG13 ILE A 148 2.475 -0.750 8.306 1.00 0.00 H new ATOM 0 HG21 ILE A 148 0.218 -1.880 7.776 1.00 0.00 H new ATOM 0 HG22 ILE A 148 -0.799 -2.422 9.131 1.00 0.00 H new ATOM 0 HG23 ILE A 148 -0.747 -0.698 8.693 1.00 0.00 H new ATOM 0 HD11 ILE A 148 2.026 1.650 8.413 1.00 0.00 H new ATOM 0 HD12 ILE A 148 0.542 0.754 8.010 1.00 0.00 H new ATOM 0 HD13 ILE A 148 0.786 1.376 9.660 1.00 0.00 H new ATOM 939 N ASP A 149 -0.172 1.283 11.409 1.00 0.00 N ATOM 940 CA ASP A 149 -1.099 2.410 11.382 1.00 0.00 C ATOM 941 C ASP A 149 -0.667 3.460 10.364 1.00 0.00 C ATOM 942 O ASP A 149 0.436 3.399 9.825 1.00 0.00 O ATOM 943 CB ASP A 149 -1.198 3.046 12.770 1.00 0.00 C ATOM 944 CG ASP A 149 0.132 3.591 13.252 1.00 0.00 C ATOM 945 OD1 ASP A 149 0.908 2.818 13.853 1.00 0.00 O ATOM 946 OD2 ASP A 149 0.398 4.790 13.028 1.00 0.00 O ATOM 0 H ASP A 149 0.771 1.519 11.719 1.00 0.00 H new ATOM 0 HA ASP A 149 -2.077 2.030 11.086 1.00 0.00 H new ATOM 0 HB2 ASP A 149 -1.931 3.853 12.746 1.00 0.00 H new ATOM 0 HB3 ASP A 149 -1.563 2.305 13.481 1.00 0.00 H new ATOM 951 N TYR A 150 -1.550 4.422 10.106 1.00 0.00 N ATOM 952 CA TYR A 150 -1.270 5.491 9.149 1.00 0.00 C ATOM 953 C TYR A 150 0.067 6.167 9.450 1.00 0.00 C ATOM 954 O TYR A 150 0.129 7.153 10.184 1.00 0.00 O ATOM 955 CB TYR A 150 -2.398 6.527 9.170 1.00 0.00 C ATOM 956 CG TYR A 150 -2.354 7.515 8.021 1.00 0.00 C ATOM 957 CD1 TYR A 150 -1.817 7.165 6.786 1.00 0.00 C ATOM 958 CD2 TYR A 150 -2.855 8.802 8.175 1.00 0.00 C ATOM 959 CE1 TYR A 150 -1.780 8.070 5.742 1.00 0.00 C ATOM 960 CE2 TYR A 150 -2.821 9.711 7.135 1.00 0.00 C ATOM 961 CZ TYR A 150 -2.283 9.341 5.921 1.00 0.00 C ATOM 962 OH TYR A 150 -2.247 10.244 4.884 1.00 0.00 O ATOM 0 H TYR A 150 -2.468 4.484 10.547 1.00 0.00 H new ATOM 0 HA TYR A 150 -1.209 5.046 8.156 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -3.355 6.006 9.150 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -2.354 7.077 10.110 1.00 0.00 H new ATOM 0 HD1 TYR A 150 -1.423 6.170 6.641 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -3.278 9.097 9.124 1.00 0.00 H new ATOM 0 HE1 TYR A 150 -1.359 7.783 4.790 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -3.214 10.707 7.273 1.00 0.00 H new ATOM 0 HH TYR A 150 -1.718 9.874 4.146 1.00 0.00 H new ATOM 972 N ASP A 151 1.134 5.621 8.874 1.00 0.00 N ATOM 973 CA ASP A 151 2.481 6.149 9.064 1.00 0.00 C ATOM 974 C ASP A 151 3.495 5.256 8.362 1.00 0.00 C ATOM 975 O ASP A 151 4.094 5.647 7.360 1.00 0.00 O ATOM 976 CB ASP A 151 2.816 6.255 10.555 1.00 0.00 C ATOM 977 CG ASP A 151 3.493 7.566 10.905 1.00 0.00 C ATOM 978 OD1 ASP A 151 4.695 7.713 10.601 1.00 0.00 O ATOM 979 OD2 ASP A 151 2.820 8.445 11.483 1.00 0.00 O ATOM 0 H ASP A 151 1.090 4.804 8.265 1.00 0.00 H new ATOM 0 HA ASP A 151 2.525 7.148 8.630 1.00 0.00 H new ATOM 0 HB2 ASP A 151 1.900 6.155 11.138 1.00 0.00 H new ATOM 0 HB3 ASP A 151 3.466 5.427 10.838 1.00 0.00 H new ATOM 984 N GLU A 152 3.665 4.045 8.881 1.00 0.00 N ATOM 985 CA GLU A 152 4.588 3.088 8.284 1.00 0.00 C ATOM 986 C GLU A 152 4.063 2.644 6.924 1.00 0.00 C ATOM 987 O GLU A 152 4.831 2.258 6.042 1.00 0.00 O ATOM 988 CB GLU A 152 4.771 1.877 9.200 1.00 0.00 C ATOM 989 CG GLU A 152 5.037 2.244 10.651 1.00 0.00 C ATOM 990 CD GLU A 152 4.221 1.415 11.623 1.00 0.00 C ATOM 991 OE1 GLU A 152 3.085 1.823 11.943 1.00 0.00 O ATOM 992 OE2 GLU A 152 4.718 0.357 12.064 1.00 0.00 O ATOM 0 H GLU A 152 3.178 3.704 9.710 1.00 0.00 H new ATOM 0 HA GLU A 152 5.557 3.570 8.153 1.00 0.00 H new ATOM 0 HB2 GLU A 152 3.877 1.256 9.149 1.00 0.00 H new ATOM 0 HB3 GLU A 152 5.600 1.274 8.829 1.00 0.00 H new ATOM 0 HG2 GLU A 152 6.097 2.111 10.867 1.00 0.00 H new ATOM 0 HG3 GLU A 152 4.811 3.300 10.802 1.00 0.00 H new ATOM 999 N PHE A 153 2.744 2.714 6.762 1.00 0.00 N ATOM 1000 CA PHE A 153 2.097 2.336 5.515 1.00 0.00 C ATOM 1001 C PHE A 153 2.626 3.192 4.368 1.00 0.00 C ATOM 1002 O PHE A 153 2.781 2.719 3.244 1.00 0.00 O ATOM 1003 CB PHE A 153 0.575 2.490 5.651 1.00 0.00 C ATOM 1004 CG PHE A 153 -0.149 2.707 4.350 1.00 0.00 C ATOM 1005 CD1 PHE A 153 0.175 1.964 3.229 1.00 0.00 C ATOM 1006 CD2 PHE A 153 -1.154 3.656 4.252 1.00 0.00 C ATOM 1007 CE1 PHE A 153 -0.488 2.161 2.034 1.00 0.00 C ATOM 1008 CE2 PHE A 153 -1.821 3.858 3.059 1.00 0.00 C ATOM 1009 CZ PHE A 153 -1.487 3.109 1.948 1.00 0.00 C ATOM 0 H PHE A 153 2.101 3.032 7.487 1.00 0.00 H new ATOM 0 HA PHE A 153 2.323 1.293 5.295 1.00 0.00 H new ATOM 0 HB2 PHE A 153 0.174 1.597 6.131 1.00 0.00 H new ATOM 0 HB3 PHE A 153 0.365 3.330 6.313 1.00 0.00 H new ATOM 0 HD1 PHE A 153 0.956 1.221 3.289 1.00 0.00 H new ATOM 0 HD2 PHE A 153 -1.419 4.244 5.118 1.00 0.00 H new ATOM 0 HE1 PHE A 153 -0.225 1.573 1.167 1.00 0.00 H new ATOM 0 HE2 PHE A 153 -2.603 4.601 2.995 1.00 0.00 H new ATOM 0 HZ PHE A 153 -2.006 3.265 1.014 1.00 0.00 H new ATOM 1019 N LEU A 154 2.906 4.454 4.664 1.00 0.00 N ATOM 1020 CA LEU A 154 3.421 5.372 3.660 1.00 0.00 C ATOM 1021 C LEU A 154 4.741 4.866 3.088 1.00 0.00 C ATOM 1022 O LEU A 154 5.139 5.249 1.988 1.00 0.00 O ATOM 1023 CB LEU A 154 3.590 6.769 4.260 1.00 0.00 C ATOM 1024 CG LEU A 154 2.446 7.225 5.175 1.00 0.00 C ATOM 1025 CD1 LEU A 154 2.526 8.725 5.416 1.00 0.00 C ATOM 1026 CD2 LEU A 154 1.089 6.854 4.584 1.00 0.00 C ATOM 0 H LEU A 154 2.785 4.864 5.590 1.00 0.00 H new ATOM 0 HA LEU A 154 2.702 5.429 2.843 1.00 0.00 H new ATOM 0 HB2 LEU A 154 4.521 6.794 4.827 1.00 0.00 H new ATOM 0 HB3 LEU A 154 3.693 7.487 3.447 1.00 0.00 H new ATOM 0 HG LEU A 154 2.551 6.710 6.130 1.00 0.00 H new ATOM 0 HD11 LEU A 154 1.708 9.033 6.067 1.00 0.00 H new ATOM 0 HD12 LEU A 154 3.477 8.967 5.890 1.00 0.00 H new ATOM 0 HD13 LEU A 154 2.450 9.251 4.464 1.00 0.00 H new ATOM 0 HD21 LEU A 154 0.297 7.189 5.253 1.00 0.00 H new ATOM 0 HD22 LEU A 154 0.971 7.335 3.613 1.00 0.00 H new ATOM 0 HD23 LEU A 154 1.028 5.772 4.463 1.00 0.00 H new ATOM 1038 N GLU A 155 5.411 3.992 3.835 1.00 0.00 N ATOM 1039 CA GLU A 155 6.679 3.423 3.392 1.00 0.00 C ATOM 1040 C GLU A 155 6.453 2.442 2.244 1.00 0.00 C ATOM 1041 O GLU A 155 7.293 2.303 1.355 1.00 0.00 O ATOM 1042 CB GLU A 155 7.381 2.717 4.553 1.00 0.00 C ATOM 1043 CG GLU A 155 7.713 3.638 5.715 1.00 0.00 C ATOM 1044 CD GLU A 155 8.680 3.010 6.699 1.00 0.00 C ATOM 1045 OE1 GLU A 155 9.848 2.781 6.320 1.00 0.00 O ATOM 1046 OE2 GLU A 155 8.269 2.746 7.848 1.00 0.00 O ATOM 0 H GLU A 155 5.097 3.663 4.748 1.00 0.00 H new ATOM 0 HA GLU A 155 7.314 4.235 3.038 1.00 0.00 H new ATOM 0 HB2 GLU A 155 6.746 1.907 4.912 1.00 0.00 H new ATOM 0 HB3 GLU A 155 8.301 2.262 4.187 1.00 0.00 H new ATOM 0 HG2 GLU A 155 8.142 4.563 5.330 1.00 0.00 H new ATOM 0 HG3 GLU A 155 6.794 3.906 6.236 1.00 0.00 H new ATOM 1053 N PHE A 156 5.305 1.771 2.271 1.00 0.00 N ATOM 1054 CA PHE A 156 4.947 0.803 1.235 1.00 0.00 C ATOM 1055 C PHE A 156 5.041 1.428 -0.151 1.00 0.00 C ATOM 1056 O PHE A 156 5.853 1.018 -0.981 1.00 0.00 O ATOM 1057 CB PHE A 156 3.520 0.297 1.471 1.00 0.00 C ATOM 1058 CG PHE A 156 3.432 -1.163 1.800 1.00 0.00 C ATOM 1059 CD1 PHE A 156 3.721 -1.619 3.075 1.00 0.00 C ATOM 1060 CD2 PHE A 156 3.050 -2.077 0.835 1.00 0.00 C ATOM 1061 CE1 PHE A 156 3.630 -2.961 3.383 1.00 0.00 C ATOM 1062 CE2 PHE A 156 2.959 -3.423 1.135 1.00 0.00 C ATOM 1063 CZ PHE A 156 3.250 -3.864 2.411 1.00 0.00 C ATOM 0 H PHE A 156 4.602 1.880 3.002 1.00 0.00 H new ATOM 0 HA PHE A 156 5.648 -0.030 1.288 1.00 0.00 H new ATOM 0 HB2 PHE A 156 3.074 0.869 2.285 1.00 0.00 H new ATOM 0 HB3 PHE A 156 2.925 0.494 0.579 1.00 0.00 H new ATOM 0 HD1 PHE A 156 4.021 -0.916 3.838 1.00 0.00 H new ATOM 0 HD2 PHE A 156 2.820 -1.735 -0.163 1.00 0.00 H new ATOM 0 HE1 PHE A 156 3.856 -3.304 4.382 1.00 0.00 H new ATOM 0 HE2 PHE A 156 2.661 -4.128 0.373 1.00 0.00 H new ATOM 0 HZ PHE A 156 3.180 -4.915 2.648 1.00 0.00 H new ATOM 1073 N MET A 157 4.197 2.421 -0.387 1.00 0.00 N ATOM 1074 CA MET A 157 4.163 3.117 -1.670 1.00 0.00 C ATOM 1075 C MET A 157 5.439 3.917 -1.879 1.00 0.00 C ATOM 1076 O MET A 157 5.918 4.060 -3.003 1.00 0.00 O ATOM 1077 CB MET A 157 2.950 4.046 -1.745 1.00 0.00 C ATOM 1078 CG MET A 157 1.704 3.471 -1.094 1.00 0.00 C ATOM 1079 SD MET A 157 1.141 1.955 -1.892 1.00 0.00 S ATOM 1080 CE MET A 157 -0.625 2.059 -1.609 1.00 0.00 C ATOM 0 H MET A 157 3.522 2.766 0.295 1.00 0.00 H new ATOM 0 HA MET A 157 4.084 2.369 -2.459 1.00 0.00 H new ATOM 0 HB2 MET A 157 3.197 4.993 -1.264 1.00 0.00 H new ATOM 0 HB3 MET A 157 2.735 4.266 -2.791 1.00 0.00 H new ATOM 0 HG2 MET A 157 1.908 3.269 -0.042 1.00 0.00 H new ATOM 0 HG3 MET A 157 0.906 4.213 -1.127 1.00 0.00 H new ATOM 0 HE1 MET A 157 -0.915 1.334 -0.849 1.00 0.00 H new ATOM 0 HE2 MET A 157 -0.881 3.063 -1.269 1.00 0.00 H new ATOM 0 HE3 MET A 157 -1.155 1.844 -2.537 1.00 0.00 H new ATOM 1090 N LYS A 158 5.989 4.434 -0.787 1.00 0.00 N ATOM 1091 CA LYS A 158 7.220 5.218 -0.850 1.00 0.00 C ATOM 1092 C LYS A 158 8.274 4.499 -1.690 1.00 0.00 C ATOM 1093 O LYS A 158 9.123 5.133 -2.316 1.00 0.00 O ATOM 1094 CB LYS A 158 7.757 5.478 0.558 1.00 0.00 C ATOM 1095 CG LYS A 158 7.630 6.929 0.999 1.00 0.00 C ATOM 1096 CD LYS A 158 8.971 7.503 1.429 1.00 0.00 C ATOM 1097 CE LYS A 158 8.822 8.432 2.624 1.00 0.00 C ATOM 1098 NZ LYS A 158 8.930 9.864 2.232 1.00 0.00 N ATOM 0 H LYS A 158 5.604 4.326 0.152 1.00 0.00 H new ATOM 0 HA LYS A 158 6.993 6.174 -1.323 1.00 0.00 H new ATOM 0 HB2 LYS A 158 7.222 4.844 1.265 1.00 0.00 H new ATOM 0 HB3 LYS A 158 8.806 5.185 0.598 1.00 0.00 H new ATOM 0 HG2 LYS A 158 7.224 7.524 0.181 1.00 0.00 H new ATOM 0 HG3 LYS A 158 6.922 6.998 1.825 1.00 0.00 H new ATOM 0 HD2 LYS A 158 9.652 6.690 1.681 1.00 0.00 H new ATOM 0 HD3 LYS A 158 9.419 8.047 0.597 1.00 0.00 H new ATOM 0 HE2 LYS A 158 7.857 8.258 3.101 1.00 0.00 H new ATOM 0 HE3 LYS A 158 9.589 8.199 3.363 1.00 0.00 H new ATOM 0 HZ1 LYS A 158 8.823 10.464 3.075 1.00 0.00 H new ATOM 0 HZ2 LYS A 158 9.860 10.037 1.800 1.00 0.00 H new ATOM 0 HZ3 LYS A 158 8.182 10.094 1.547 1.00 0.00 H new ATOM 1112 N GLY A 159 8.203 3.170 -1.703 1.00 0.00 N ATOM 1113 CA GLY A 159 9.147 2.385 -2.474 1.00 0.00 C ATOM 1114 C GLY A 159 8.981 2.594 -3.966 1.00 0.00 C ATOM 1115 O GLY A 159 9.937 2.453 -4.729 1.00 0.00 O ATOM 0 H GLY A 159 7.508 2.625 -1.193 1.00 0.00 H new ATOM 0 HA2 GLY A 159 10.163 2.652 -2.182 1.00 0.00 H new ATOM 0 HA3 GLY A 159 9.015 1.329 -2.240 1.00 0.00 H new ATOM 1119 N VAL A 160 7.762 2.937 -4.382 1.00 0.00 N ATOM 1120 CA VAL A 160 7.465 3.174 -5.791 1.00 0.00 C ATOM 1121 C VAL A 160 8.548 4.028 -6.450 1.00 0.00 C ATOM 1122 O VAL A 160 8.888 3.827 -7.616 1.00 0.00 O ATOM 1123 CB VAL A 160 6.099 3.873 -5.963 1.00 0.00 C ATOM 1124 CG1 VAL A 160 5.818 4.144 -7.430 1.00 0.00 C ATOM 1125 CG2 VAL A 160 4.981 3.041 -5.348 1.00 0.00 C ATOM 0 H VAL A 160 6.963 3.057 -3.759 1.00 0.00 H new ATOM 0 HA VAL A 160 7.434 2.199 -6.277 1.00 0.00 H new ATOM 0 HB VAL A 160 6.139 4.827 -5.438 1.00 0.00 H new ATOM 0 HG11 VAL A 160 4.851 4.637 -7.530 1.00 0.00 H new ATOM 0 HG12 VAL A 160 6.598 4.788 -7.837 1.00 0.00 H new ATOM 0 HG13 VAL A 160 5.803 3.202 -7.978 1.00 0.00 H new ATOM 0 HG21 VAL A 160 4.029 3.555 -5.482 1.00 0.00 H new ATOM 0 HG22 VAL A 160 4.940 2.068 -5.837 1.00 0.00 H new ATOM 0 HG23 VAL A 160 5.173 2.904 -4.284 1.00 0.00 H new ATOM 1135 N GLU A 161 9.083 4.982 -5.694 1.00 0.00 N ATOM 1136 CA GLU A 161 10.125 5.866 -6.203 1.00 0.00 C ATOM 1137 C GLU A 161 11.445 5.117 -6.359 1.00 0.00 C ATOM 1138 O GLU A 161 11.586 4.034 -5.753 1.00 0.00 O ATOM 1139 CB GLU A 161 10.307 7.064 -5.267 1.00 0.00 C ATOM 1140 CG GLU A 161 9.991 8.399 -5.921 1.00 0.00 C ATOM 1141 CD GLU A 161 9.201 9.321 -5.013 1.00 0.00 C ATOM 1142 OE1 GLU A 161 9.684 9.614 -3.899 1.00 0.00 O ATOM 1143 OE2 GLU A 161 8.100 9.751 -5.416 1.00 0.00 O ATOM 1144 OXT GLU A 161 12.327 5.620 -7.087 1.00 0.00 O ATOM 0 H GLU A 161 8.812 5.162 -4.727 1.00 0.00 H new ATOM 0 HA GLU A 161 9.817 6.226 -7.185 1.00 0.00 H new ATOM 0 HB2 GLU A 161 9.665 6.935 -4.396 1.00 0.00 H new ATOM 0 HB3 GLU A 161 11.335 7.080 -4.906 1.00 0.00 H new ATOM 0 HG2 GLU A 161 10.922 8.888 -6.208 1.00 0.00 H new ATOM 0 HG3 GLU A 161 9.426 8.226 -6.837 1.00 0.00 H new ATOM 1226 N PHE B 132 3.131 -5.160 -5.610 1.00 0.00 N ATOM 1227 CA PHE B 132 2.469 -5.498 -6.862 1.00 0.00 C ATOM 1228 C PHE B 132 1.570 -4.351 -7.335 1.00 0.00 C ATOM 1229 O PHE B 132 2.054 -3.393 -7.939 1.00 0.00 O ATOM 1230 CB PHE B 132 1.674 -6.810 -6.732 1.00 0.00 C ATOM 1231 CG PHE B 132 1.327 -7.195 -5.315 1.00 0.00 C ATOM 1232 CD1 PHE B 132 2.283 -7.759 -4.483 1.00 0.00 C ATOM 1233 CD2 PHE B 132 0.046 -7.006 -4.818 1.00 0.00 C ATOM 1234 CE1 PHE B 132 1.968 -8.124 -3.187 1.00 0.00 C ATOM 1235 CE2 PHE B 132 -0.272 -7.368 -3.523 1.00 0.00 C ATOM 1236 CZ PHE B 132 0.689 -7.928 -2.708 1.00 0.00 C ATOM 0 HA PHE B 132 3.240 -5.651 -7.617 1.00 0.00 H new ATOM 0 HB2 PHE B 132 0.752 -6.720 -7.306 1.00 0.00 H new ATOM 0 HB3 PHE B 132 2.252 -7.616 -7.183 1.00 0.00 H new ATOM 0 HD1 PHE B 132 3.286 -7.915 -4.852 1.00 0.00 H new ATOM 0 HD2 PHE B 132 -0.713 -6.570 -5.451 1.00 0.00 H new ATOM 0 HE1 PHE B 132 2.722 -8.562 -2.550 1.00 0.00 H new ATOM 0 HE2 PHE B 132 -1.273 -7.212 -3.149 1.00 0.00 H new ATOM 0 HZ PHE B 132 0.441 -8.213 -1.696 1.00 0.00 H new ATOM 1246 N ASP B 133 0.270 -4.436 -7.057 1.00 0.00 N ATOM 1247 CA ASP B 133 -0.659 -3.387 -7.458 1.00 0.00 C ATOM 1248 C ASP B 133 -0.511 -2.173 -6.547 1.00 0.00 C ATOM 1249 O ASP B 133 -0.880 -1.056 -6.911 1.00 0.00 O ATOM 1250 CB ASP B 133 -2.099 -3.903 -7.419 1.00 0.00 C ATOM 1251 CG ASP B 133 -2.795 -3.775 -8.760 1.00 0.00 C ATOM 1252 OD1 ASP B 133 -2.306 -4.371 -9.742 1.00 0.00 O ATOM 1253 OD2 ASP B 133 -3.828 -3.077 -8.828 1.00 0.00 O ATOM 0 H ASP B 133 -0.159 -5.216 -6.559 1.00 0.00 H new ATOM 0 HA ASP B 133 -0.424 -3.090 -8.480 1.00 0.00 H new ATOM 0 HB2 ASP B 133 -2.099 -4.949 -7.111 1.00 0.00 H new ATOM 0 HB3 ASP B 133 -2.660 -3.349 -6.667 1.00 0.00 H new ATOM 1258 N LEU B 134 0.042 -2.406 -5.361 1.00 0.00 N ATOM 1259 CA LEU B 134 0.259 -1.348 -4.386 1.00 0.00 C ATOM 1260 C LEU B 134 1.076 -0.215 -4.995 1.00 0.00 C ATOM 1261 O LEU B 134 0.682 0.950 -4.944 1.00 0.00 O ATOM 1262 CB LEU B 134 0.979 -1.914 -3.163 1.00 0.00 C ATOM 1263 CG LEU B 134 0.320 -3.149 -2.539 1.00 0.00 C ATOM 1264 CD1 LEU B 134 0.983 -4.425 -3.039 1.00 0.00 C ATOM 1265 CD2 LEU B 134 0.381 -3.082 -1.021 1.00 0.00 C ATOM 0 H LEU B 134 0.350 -3.328 -5.052 1.00 0.00 H new ATOM 0 HA LEU B 134 -0.709 -0.949 -4.082 1.00 0.00 H new ATOM 0 HB2 LEU B 134 2.000 -2.170 -3.447 1.00 0.00 H new ATOM 0 HB3 LEU B 134 1.045 -1.133 -2.405 1.00 0.00 H new ATOM 0 HG LEU B 134 -0.727 -3.163 -2.843 1.00 0.00 H new ATOM 0 HD11 LEU B 134 0.499 -5.289 -2.583 1.00 0.00 H new ATOM 0 HD12 LEU B 134 0.886 -4.485 -4.123 1.00 0.00 H new ATOM 0 HD13 LEU B 134 2.039 -4.416 -2.769 1.00 0.00 H new ATOM 0 HD21 LEU B 134 -0.092 -3.968 -0.598 1.00 0.00 H new ATOM 0 HD22 LEU B 134 1.422 -3.039 -0.700 1.00 0.00 H new ATOM 0 HD23 LEU B 134 -0.143 -2.191 -0.675 1.00 0.00 H new ATOM 1277 N ARG B 135 2.214 -0.572 -5.579 1.00 0.00 N ATOM 1278 CA ARG B 135 3.091 0.405 -6.209 1.00 0.00 C ATOM 1279 C ARG B 135 2.431 0.987 -7.451 1.00 0.00 C ATOM 1280 O ARG B 135 2.417 2.203 -7.648 1.00 0.00 O ATOM 1281 CB ARG B 135 4.421 -0.258 -6.582 1.00 0.00 C ATOM 1282 CG ARG B 135 5.268 0.547 -7.556 1.00 0.00 C ATOM 1283 CD ARG B 135 6.573 -0.162 -7.885 1.00 0.00 C ATOM 1284 NE ARG B 135 6.597 -0.657 -9.260 1.00 0.00 N ATOM 1285 CZ ARG B 135 6.133 -1.849 -9.632 1.00 0.00 C ATOM 1286 NH1 ARG B 135 5.614 -2.679 -8.735 1.00 0.00 N ATOM 1287 NH2 ARG B 135 6.190 -2.213 -10.905 1.00 0.00 N ATOM 0 H ARG B 135 2.551 -1.534 -5.629 1.00 0.00 H new ATOM 0 HA ARG B 135 3.280 1.215 -5.505 1.00 0.00 H new ATOM 0 HB2 ARG B 135 4.997 -0.428 -5.672 1.00 0.00 H new ATOM 0 HB3 ARG B 135 4.217 -1.236 -7.018 1.00 0.00 H new ATOM 0 HG2 ARG B 135 4.705 0.717 -8.474 1.00 0.00 H new ATOM 0 HG3 ARG B 135 5.483 1.526 -7.128 1.00 0.00 H new ATOM 0 HD2 ARG B 135 7.406 0.524 -7.732 1.00 0.00 H new ATOM 0 HD3 ARG B 135 6.716 -0.996 -7.197 1.00 0.00 H new ATOM 0 HE ARG B 135 6.994 -0.052 -9.979 1.00 0.00 H new ATOM 0 HH11 ARG B 135 5.569 -2.406 -7.753 1.00 0.00 H new ATOM 0 HH12 ARG B 135 5.261 -3.590 -9.028 1.00 0.00 H new ATOM 0 HH21 ARG B 135 6.589 -1.581 -11.599 1.00 0.00 H new ATOM 0 HH22 ARG B 135 5.835 -3.125 -11.191 1.00 0.00 H new ATOM 1301 N GLY B 136 1.885 0.111 -8.288 1.00 0.00 N ATOM 1302 CA GLY B 136 1.233 0.558 -9.502 1.00 0.00 C ATOM 1303 C GLY B 136 0.219 1.653 -9.238 1.00 0.00 C ATOM 1304 O GLY B 136 -0.055 1.980 -8.084 1.00 0.00 O ATOM 0 H GLY B 136 1.883 -0.899 -8.146 1.00 0.00 H new ATOM 0 HA2 GLY B 136 1.984 0.922 -10.203 1.00 0.00 H new ATOM 0 HA3 GLY B 136 0.736 -0.287 -9.978 1.00 0.00 H new ATOM 1308 N LYS B 137 -0.336 2.227 -10.303 1.00 0.00 N ATOM 1309 CA LYS B 137 -1.318 3.302 -10.171 1.00 0.00 C ATOM 1310 C LYS B 137 -0.648 4.567 -9.646 1.00 0.00 C ATOM 1311 O LYS B 137 -0.609 5.593 -10.325 1.00 0.00 O ATOM 1312 CB LYS B 137 -2.455 2.894 -9.226 1.00 0.00 C ATOM 1313 CG LYS B 137 -2.884 1.441 -9.358 1.00 0.00 C ATOM 1314 CD LYS B 137 -3.597 1.186 -10.676 1.00 0.00 C ATOM 1315 CE LYS B 137 -3.654 -0.298 -11.003 1.00 0.00 C ATOM 1316 NZ LYS B 137 -3.002 -0.605 -12.307 1.00 0.00 N ATOM 0 H LYS B 137 -0.123 1.967 -11.266 1.00 0.00 H new ATOM 0 HA LYS B 137 -1.737 3.497 -11.158 1.00 0.00 H new ATOM 0 HB2 LYS B 137 -2.141 3.077 -8.198 1.00 0.00 H new ATOM 0 HB3 LYS B 137 -3.317 3.534 -9.415 1.00 0.00 H new ATOM 0 HG2 LYS B 137 -2.009 0.795 -9.286 1.00 0.00 H new ATOM 0 HG3 LYS B 137 -3.543 1.179 -8.530 1.00 0.00 H new ATOM 0 HD2 LYS B 137 -4.609 1.587 -10.627 1.00 0.00 H new ATOM 0 HD3 LYS B 137 -3.083 1.716 -11.477 1.00 0.00 H new ATOM 0 HE2 LYS B 137 -3.164 -0.863 -10.210 1.00 0.00 H new ATOM 0 HE3 LYS B 137 -4.694 -0.624 -11.031 1.00 0.00 H new ATOM 0 HZ1 LYS B 137 -3.062 -1.626 -12.493 1.00 0.00 H new ATOM 0 HZ2 LYS B 137 -3.485 -0.085 -13.067 1.00 0.00 H new ATOM 0 HZ3 LYS B 137 -2.003 -0.318 -12.272 1.00 0.00 H new ATOM 1330 N PHE B 138 -0.120 4.472 -8.429 1.00 0.00 N ATOM 1331 CA PHE B 138 0.564 5.583 -7.776 1.00 0.00 C ATOM 1332 C PHE B 138 1.454 6.351 -8.753 1.00 0.00 C ATOM 1333 O PHE B 138 1.595 7.570 -8.653 1.00 0.00 O ATOM 1334 CB PHE B 138 1.402 5.044 -6.616 1.00 0.00 C ATOM 1335 CG PHE B 138 1.045 5.635 -5.288 1.00 0.00 C ATOM 1336 CD1 PHE B 138 1.378 6.944 -4.981 1.00 0.00 C ATOM 1337 CD2 PHE B 138 0.381 4.875 -4.342 1.00 0.00 C ATOM 1338 CE1 PHE B 138 1.051 7.485 -3.753 1.00 0.00 C ATOM 1339 CE2 PHE B 138 0.053 5.407 -3.114 1.00 0.00 C ATOM 1340 CZ PHE B 138 0.388 6.715 -2.818 1.00 0.00 C ATOM 0 H PHE B 138 -0.155 3.621 -7.867 1.00 0.00 H new ATOM 0 HA PHE B 138 -0.188 6.278 -7.403 1.00 0.00 H new ATOM 0 HB2 PHE B 138 1.282 3.962 -6.566 1.00 0.00 H new ATOM 0 HB3 PHE B 138 2.455 5.239 -6.819 1.00 0.00 H new ATOM 0 HD1 PHE B 138 1.899 7.548 -5.709 1.00 0.00 H new ATOM 0 HD2 PHE B 138 0.117 3.853 -4.569 1.00 0.00 H new ATOM 0 HE1 PHE B 138 1.313 8.508 -3.525 1.00 0.00 H new ATOM 0 HE2 PHE B 138 -0.465 4.803 -2.384 1.00 0.00 H new ATOM 0 HZ PHE B 138 0.131 7.134 -1.856 1.00 0.00 H new