USER MOD reduce.3.24.130724 H: found=0, std=0, add=553, rem=0, adj=11 USER MOD reduce.3.24.130724 removed 554 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 150 HIS : no HD1:sc= -0.0573 K(o=-0.044,f=-1.8) USER MOD Set 1.2: A 151 GLN : amide:sc= 0.0131 K(o=-0.044,f=-0.9) USER MOD Set 2.1: A 138 ASN : amide:sc= -0.797 K(o=-2.3,f=-4) USER MOD Set 2.2: A 141 GLN : amide:sc= -1.47 K(o=-2.3,f=-2.9) USER MOD Set 3.1: A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.2: A 131 THR OG1 : rot 59:sc= 1.06 USER MOD Single : A 101 ASN : amide:sc= -0.0132 K(o=-0.013,f=-1.2!) USER MOD Single : A 104 GLN : amide:sc= -0.0273 K(o=-0.027,f=-1.5!) USER MOD Single : A 106 SER OG : rot -90:sc= -4.2! USER MOD Single : A 107 ASN : amide:sc= -3.91! C(o=-3.9!,f=-4.1!) USER MOD Single : A 109 GLN : amide:sc= 0 X(o=0,f=-0.054) USER MOD Single : A 112 HIS : no HD1:sc= -0.0321 X(o=-0.032,f=0) USER MOD Single : A 116 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00938) USER MOD Single : A 118 TYR OH : rot 180:sc= 0 USER MOD Single : A 121 LYS NZ :NH3+ -108:sc= -0.547 (180deg=-2.38!) USER MOD Single : A 122 TYR OH : rot 180:sc= 0 USER MOD Single : A 124 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 ASN : amide:sc= -0.21 K(o=-0.21,f=-1.3) USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 THR OG1 : rot 180:sc= 0 USER MOD Single : A 143 GLN : amide:sc= -0.0292 K(o=-0.029,f=-0.74) USER MOD Single : A 144 ASN : amide:sc= -0.0793 X(o=-0.079,f=0) USER MOD Single : A 147 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 148 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 152 TYR OH : rot 180:sc= 0 USER MOD Single : A 153 SER OG : rot 180:sc= 0 USER MOD Single : A 157 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 162 GLN :FLIP amide:sc= 0 F(o=-0.57,f=0) USER MOD ----------------------------------------------------------------- ATOM 59 N GLY A 96 1.129 12.346 -2.198 1.00 0.00 N ATOM 60 CA GLY A 96 1.620 11.227 -1.417 1.00 0.00 C ATOM 61 C GLY A 96 0.527 10.234 -1.075 1.00 0.00 C ATOM 62 O GLY A 96 -0.635 10.609 -0.918 1.00 0.00 O ATOM 0 HA2 GLY A 96 2.408 10.718 -1.973 1.00 0.00 H new ATOM 0 HA3 GLY A 96 2.069 11.600 -0.496 1.00 0.00 H new ATOM 66 N ILE A 97 0.899 8.963 -0.961 1.00 0.00 N ATOM 67 CA ILE A 97 -0.058 7.914 -0.636 1.00 0.00 C ATOM 68 C ILE A 97 0.534 6.915 0.352 1.00 0.00 C ATOM 69 O ILE A 97 1.752 6.741 0.421 1.00 0.00 O ATOM 70 CB ILE A 97 -0.516 7.159 -1.899 1.00 0.00 C ATOM 71 CG1 ILE A 97 0.694 6.622 -2.665 1.00 0.00 C ATOM 72 CG2 ILE A 97 -1.351 8.070 -2.787 1.00 0.00 C ATOM 73 CD1 ILE A 97 0.331 5.638 -3.755 1.00 0.00 C ATOM 0 H ILE A 97 1.857 8.636 -1.089 1.00 0.00 H new ATOM 0 HA ILE A 97 -0.919 8.403 -0.182 1.00 0.00 H new ATOM 0 HB ILE A 97 -1.134 6.314 -1.596 1.00 0.00 H new ATOM 0 HG12 ILE A 97 1.234 7.459 -3.107 1.00 0.00 H new ATOM 0 HG13 ILE A 97 1.374 6.139 -1.963 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -1.667 7.523 -3.675 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -2.229 8.408 -2.237 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -0.755 8.933 -3.086 1.00 0.00 H new ATOM 0 HD11 ILE A 97 1.238 5.299 -4.256 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -0.183 4.782 -3.317 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -0.324 6.122 -4.479 1.00 0.00 H new ATOM 85 N LEU A 98 -0.334 6.260 1.115 1.00 0.00 N ATOM 86 CA LEU A 98 0.103 5.276 2.100 1.00 0.00 C ATOM 87 C LEU A 98 -0.226 3.860 1.637 1.00 0.00 C ATOM 88 O LEU A 98 -1.349 3.577 1.221 1.00 0.00 O ATOM 89 CB LEU A 98 -0.559 5.550 3.451 1.00 0.00 C ATOM 90 CG LEU A 98 -0.311 6.934 4.052 1.00 0.00 C ATOM 91 CD1 LEU A 98 -1.177 7.144 5.285 1.00 0.00 C ATOM 92 CD2 LEU A 98 1.161 7.109 4.397 1.00 0.00 C ATOM 0 H LEU A 98 -1.344 6.392 1.071 1.00 0.00 H new ATOM 0 HA LEU A 98 1.184 5.361 2.208 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -1.635 5.411 3.341 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -0.212 4.800 4.162 1.00 0.00 H new ATOM 0 HG LEU A 98 -0.582 7.685 3.310 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -0.987 8.134 5.699 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -2.228 7.062 5.009 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -0.937 6.387 6.031 1.00 0.00 H new ATOM 0 HD21 LEU A 98 1.319 8.099 4.824 1.00 0.00 H new ATOM 0 HD22 LEU A 98 1.458 6.350 5.121 1.00 0.00 H new ATOM 0 HD23 LEU A 98 1.762 7.003 3.494 1.00 0.00 H new ATOM 104 N VAL A 99 0.762 2.974 1.715 1.00 0.00 N ATOM 105 CA VAL A 99 0.577 1.586 1.308 1.00 0.00 C ATOM 106 C VAL A 99 0.334 0.687 2.514 1.00 0.00 C ATOM 107 O VAL A 99 1.275 0.262 3.186 1.00 0.00 O ATOM 108 CB VAL A 99 1.799 1.063 0.529 1.00 0.00 C ATOM 109 CG1 VAL A 99 1.797 -0.458 0.492 1.00 0.00 C ATOM 110 CG2 VAL A 99 1.819 1.639 -0.879 1.00 0.00 C ATOM 0 H VAL A 99 1.698 3.193 2.056 1.00 0.00 H new ATOM 0 HA VAL A 99 -0.298 1.560 0.658 1.00 0.00 H new ATOM 0 HB VAL A 99 2.703 1.389 1.043 1.00 0.00 H new ATOM 0 HG11 VAL A 99 2.667 -0.810 -0.062 1.00 0.00 H new ATOM 0 HG12 VAL A 99 1.834 -0.847 1.510 1.00 0.00 H new ATOM 0 HG13 VAL A 99 0.889 -0.809 0.002 1.00 0.00 H new ATOM 0 HG21 VAL A 99 2.689 1.259 -1.415 1.00 0.00 H new ATOM 0 HG22 VAL A 99 0.911 1.345 -1.405 1.00 0.00 H new ATOM 0 HG23 VAL A 99 1.872 2.726 -0.827 1.00 0.00 H new ATOM 120 N LYS A 100 -0.935 0.399 2.785 1.00 0.00 N ATOM 121 CA LYS A 100 -1.304 -0.452 3.910 1.00 0.00 C ATOM 122 C LYS A 100 -1.806 -1.808 3.424 1.00 0.00 C ATOM 123 O LYS A 100 -2.266 -1.940 2.291 1.00 0.00 O ATOM 124 CB LYS A 100 -2.380 0.228 4.759 1.00 0.00 C ATOM 125 CG LYS A 100 -2.002 1.627 5.214 1.00 0.00 C ATOM 126 CD LYS A 100 -2.729 2.014 6.490 1.00 0.00 C ATOM 127 CE LYS A 100 -2.019 3.148 7.215 1.00 0.00 C ATOM 128 NZ LYS A 100 -1.005 2.640 8.179 1.00 0.00 N ATOM 0 H LYS A 100 -1.726 0.743 2.240 1.00 0.00 H new ATOM 0 HA LYS A 100 -0.415 -0.611 4.521 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -3.305 0.279 4.185 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -2.582 -0.388 5.635 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -0.926 1.679 5.378 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -2.240 2.343 4.427 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -3.749 2.316 6.252 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -2.798 1.147 7.148 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -1.534 3.798 6.486 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -2.752 3.755 7.745 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -0.543 3.443 8.653 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -1.471 2.040 8.889 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -0.291 2.081 7.669 1.00 0.00 H new ATOM 142 N ASN A 101 -1.715 -2.812 4.291 1.00 0.00 N ATOM 143 CA ASN A 101 -2.161 -4.158 3.950 1.00 0.00 C ATOM 144 C ASN A 101 -1.180 -4.831 2.995 1.00 0.00 C ATOM 145 O ASN A 101 -1.577 -5.396 1.975 1.00 0.00 O ATOM 146 CB ASN A 101 -3.554 -4.111 3.318 1.00 0.00 C ATOM 147 CG ASN A 101 -4.352 -5.373 3.584 1.00 0.00 C ATOM 148 OD1 ASN A 101 -4.256 -5.967 4.658 1.00 0.00 O ATOM 149 ND2 ASN A 101 -5.146 -5.788 2.604 1.00 0.00 N ATOM 0 H ASN A 101 -1.337 -2.719 5.234 1.00 0.00 H new ATOM 0 HA ASN A 101 -2.205 -4.743 4.869 1.00 0.00 H new ATOM 0 HB2 ASN A 101 -4.098 -3.251 3.708 1.00 0.00 H new ATOM 0 HB3 ASN A 101 -3.457 -3.965 2.242 1.00 0.00 H new ATOM 0 HD21 ASN A 101 -5.708 -6.631 2.725 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -5.194 -5.264 1.730 1.00 0.00 H new ATOM 156 N LEU A 102 0.103 -4.768 3.334 1.00 0.00 N ATOM 157 CA LEU A 102 1.143 -5.372 2.507 1.00 0.00 C ATOM 158 C LEU A 102 1.373 -6.828 2.900 1.00 0.00 C ATOM 159 O LEU A 102 1.080 -7.249 4.019 1.00 0.00 O ATOM 160 CB LEU A 102 2.447 -4.585 2.638 1.00 0.00 C ATOM 161 CG LEU A 102 2.515 -3.265 1.868 1.00 0.00 C ATOM 162 CD1 LEU A 102 3.756 -2.480 2.263 1.00 0.00 C ATOM 163 CD2 LEU A 102 2.498 -3.522 0.368 1.00 0.00 C ATOM 0 H LEU A 102 0.448 -4.305 4.175 1.00 0.00 H new ATOM 0 HA LEU A 102 0.811 -5.343 1.469 1.00 0.00 H new ATOM 0 HB2 LEU A 102 2.617 -4.376 3.694 1.00 0.00 H new ATOM 0 HB3 LEU A 102 3.267 -5.221 2.303 1.00 0.00 H new ATOM 0 HG LEU A 102 1.638 -2.671 2.124 1.00 0.00 H new ATOM 0 HD11 LEU A 102 3.787 -1.544 1.705 1.00 0.00 H new ATOM 0 HD12 LEU A 102 3.726 -2.265 3.331 1.00 0.00 H new ATOM 0 HD13 LEU A 102 4.646 -3.068 2.036 1.00 0.00 H new ATOM 0 HD21 LEU A 102 2.547 -2.572 -0.164 1.00 0.00 H new ATOM 0 HD22 LEU A 102 3.356 -4.136 0.094 1.00 0.00 H new ATOM 0 HD23 LEU A 102 1.579 -4.042 0.098 1.00 0.00 H new ATOM 175 N PRO A 103 1.911 -7.617 1.958 1.00 0.00 N ATOM 176 CA PRO A 103 2.195 -9.038 2.183 1.00 0.00 C ATOM 177 C PRO A 103 3.347 -9.251 3.160 1.00 0.00 C ATOM 178 O PRO A 103 3.741 -8.332 3.878 1.00 0.00 O ATOM 179 CB PRO A 103 2.574 -9.548 0.791 1.00 0.00 C ATOM 180 CG PRO A 103 3.077 -8.346 0.070 1.00 0.00 C ATOM 181 CD PRO A 103 2.285 -7.183 0.602 1.00 0.00 C ATOM 0 HA PRO A 103 1.346 -9.558 2.626 1.00 0.00 H new ATOM 0 HB2 PRO A 103 3.338 -10.324 0.848 1.00 0.00 H new ATOM 0 HB3 PRO A 103 1.715 -9.984 0.282 1.00 0.00 H new ATOM 0 HG2 PRO A 103 4.144 -8.204 0.244 1.00 0.00 H new ATOM 0 HG3 PRO A 103 2.941 -8.451 -1.006 1.00 0.00 H new ATOM 0 HD2 PRO A 103 2.878 -6.269 0.622 1.00 0.00 H new ATOM 0 HD3 PRO A 103 1.407 -6.980 -0.012 1.00 0.00 H new ATOM 189 N GLN A 104 3.881 -10.468 3.181 1.00 0.00 N ATOM 190 CA GLN A 104 4.988 -10.800 4.070 1.00 0.00 C ATOM 191 C GLN A 104 6.329 -10.536 3.393 1.00 0.00 C ATOM 192 O GLN A 104 7.312 -10.196 4.053 1.00 0.00 O ATOM 193 CB GLN A 104 4.901 -12.265 4.501 1.00 0.00 C ATOM 194 CG GLN A 104 5.791 -12.605 5.686 1.00 0.00 C ATOM 195 CD GLN A 104 5.229 -12.102 7.001 1.00 0.00 C ATOM 196 OE1 GLN A 104 4.040 -11.797 7.105 1.00 0.00 O ATOM 197 NE2 GLN A 104 6.082 -12.014 8.015 1.00 0.00 N ATOM 0 H GLN A 104 3.565 -11.240 2.593 1.00 0.00 H new ATOM 0 HA GLN A 104 4.916 -10.164 4.952 1.00 0.00 H new ATOM 0 HB2 GLN A 104 3.867 -12.500 4.755 1.00 0.00 H new ATOM 0 HB3 GLN A 104 5.174 -12.900 3.658 1.00 0.00 H new ATOM 0 HG2 GLN A 104 5.920 -13.686 5.740 1.00 0.00 H new ATOM 0 HG3 GLN A 104 6.779 -12.173 5.529 1.00 0.00 H new ATOM 0 HE21 GLN A 104 7.059 -12.277 7.884 1.00 0.00 H new ATOM 0 HE22 GLN A 104 5.760 -11.683 8.925 1.00 0.00 H new ATOM 206 N ASP A 105 6.362 -10.693 2.075 1.00 0.00 N ATOM 207 CA ASP A 105 7.582 -10.471 1.308 1.00 0.00 C ATOM 208 C ASP A 105 7.474 -9.201 0.471 1.00 0.00 C ATOM 209 O ASP A 105 7.994 -9.133 -0.643 1.00 0.00 O ATOM 210 CB ASP A 105 7.867 -11.671 0.403 1.00 0.00 C ATOM 211 CG ASP A 105 8.172 -12.930 1.190 1.00 0.00 C ATOM 212 OD1 ASP A 105 9.158 -12.927 1.957 1.00 0.00 O ATOM 213 OD2 ASP A 105 7.424 -13.918 1.040 1.00 0.00 O ATOM 0 H ASP A 105 5.557 -10.973 1.515 1.00 0.00 H new ATOM 0 HA ASP A 105 8.407 -10.352 2.011 1.00 0.00 H new ATOM 0 HB2 ASP A 105 7.006 -11.849 -0.242 1.00 0.00 H new ATOM 0 HB3 ASP A 105 8.710 -11.440 -0.248 1.00 0.00 H new ATOM 218 N SER A 106 6.793 -8.196 1.014 1.00 0.00 N ATOM 219 CA SER A 106 6.612 -6.929 0.314 1.00 0.00 C ATOM 220 C SER A 106 7.923 -6.151 0.252 1.00 0.00 C ATOM 221 O SER A 106 8.778 -6.284 1.126 1.00 0.00 O ATOM 222 CB SER A 106 5.539 -6.089 1.008 1.00 0.00 C ATOM 223 OG SER A 106 4.881 -5.239 0.084 1.00 0.00 O ATOM 0 H SER A 106 6.358 -8.235 1.936 1.00 0.00 H new ATOM 0 HA SER A 106 6.291 -7.146 -0.705 1.00 0.00 H new ATOM 0 HB2 SER A 106 4.811 -6.745 1.486 1.00 0.00 H new ATOM 0 HB3 SER A 106 5.995 -5.491 1.797 1.00 0.00 H new ATOM 0 HG SER A 106 5.352 -4.381 0.036 1.00 0.00 H new ATOM 229 N ASN A 107 8.072 -5.338 -0.789 1.00 0.00 N ATOM 230 CA ASN A 107 9.279 -4.538 -0.967 1.00 0.00 C ATOM 231 C ASN A 107 9.007 -3.338 -1.869 1.00 0.00 C ATOM 232 O ASN A 107 8.073 -3.350 -2.672 1.00 0.00 O ATOM 233 CB ASN A 107 10.400 -5.393 -1.559 1.00 0.00 C ATOM 234 CG ASN A 107 10.403 -6.806 -1.008 1.00 0.00 C ATOM 235 OD1 ASN A 107 11.027 -7.084 0.016 1.00 0.00 O ATOM 236 ND2 ASN A 107 9.702 -7.707 -1.687 1.00 0.00 N ATOM 0 H ASN A 107 7.373 -5.216 -1.522 1.00 0.00 H new ATOM 0 HA ASN A 107 9.590 -4.171 0.011 1.00 0.00 H new ATOM 0 HB2 ASN A 107 10.292 -5.429 -2.643 1.00 0.00 H new ATOM 0 HB3 ASN A 107 11.361 -4.923 -1.350 1.00 0.00 H new ATOM 0 HD21 ASN A 107 9.666 -8.674 -1.364 1.00 0.00 H new ATOM 0 HD22 ASN A 107 9.200 -7.432 -2.531 1.00 0.00 H new ATOM 243 N CYS A 108 9.831 -2.304 -1.733 1.00 0.00 N ATOM 244 CA CYS A 108 9.681 -1.096 -2.536 1.00 0.00 C ATOM 245 C CYS A 108 9.891 -1.398 -4.017 1.00 0.00 C ATOM 246 O CYS A 108 9.004 -1.168 -4.838 1.00 0.00 O ATOM 247 CB CYS A 108 10.675 -0.027 -2.076 1.00 0.00 C ATOM 248 SG CYS A 108 10.623 1.507 -3.057 1.00 0.00 S ATOM 0 H CYS A 108 10.609 -2.279 -1.074 1.00 0.00 H new ATOM 0 HA CYS A 108 8.666 -0.722 -2.400 1.00 0.00 H new ATOM 0 HB2 CYS A 108 10.475 0.215 -1.032 1.00 0.00 H new ATOM 0 HB3 CYS A 108 11.683 -0.440 -2.120 1.00 0.00 H new ATOM 253 N GLN A 109 11.070 -1.914 -4.349 1.00 0.00 N ATOM 254 CA GLN A 109 11.396 -2.246 -5.731 1.00 0.00 C ATOM 255 C GLN A 109 10.164 -2.752 -6.474 1.00 0.00 C ATOM 256 O GLN A 109 9.984 -2.470 -7.659 1.00 0.00 O ATOM 257 CB GLN A 109 12.502 -3.302 -5.776 1.00 0.00 C ATOM 258 CG GLN A 109 13.902 -2.721 -5.654 1.00 0.00 C ATOM 259 CD GLN A 109 14.970 -3.792 -5.545 1.00 0.00 C ATOM 260 OE1 GLN A 109 14.890 -4.680 -4.696 1.00 0.00 O ATOM 261 NE2 GLN A 109 15.978 -3.712 -6.405 1.00 0.00 N ATOM 0 H GLN A 109 11.815 -2.111 -3.681 1.00 0.00 H new ATOM 0 HA GLN A 109 11.748 -1.339 -6.223 1.00 0.00 H new ATOM 0 HB2 GLN A 109 12.343 -4.018 -4.969 1.00 0.00 H new ATOM 0 HB3 GLN A 109 12.427 -3.855 -6.712 1.00 0.00 H new ATOM 0 HG2 GLN A 109 14.108 -2.094 -6.522 1.00 0.00 H new ATOM 0 HG3 GLN A 109 13.949 -2.076 -4.777 1.00 0.00 H new ATOM 0 HE21 GLN A 109 16.004 -2.959 -7.092 1.00 0.00 H new ATOM 0 HE22 GLN A 109 16.727 -4.404 -6.379 1.00 0.00 H new ATOM 270 N GLU A 110 9.320 -3.499 -5.771 1.00 0.00 N ATOM 271 CA GLU A 110 8.105 -4.045 -6.366 1.00 0.00 C ATOM 272 C GLU A 110 7.066 -2.948 -6.583 1.00 0.00 C ATOM 273 O GLU A 110 6.485 -2.834 -7.662 1.00 0.00 O ATOM 274 CB GLU A 110 7.524 -5.144 -5.475 1.00 0.00 C ATOM 275 CG GLU A 110 6.517 -6.034 -6.185 1.00 0.00 C ATOM 276 CD GLU A 110 6.988 -6.466 -7.560 1.00 0.00 C ATOM 277 OE1 GLU A 110 7.819 -7.395 -7.638 1.00 0.00 O ATOM 278 OE2 GLU A 110 6.525 -5.876 -8.558 1.00 0.00 O ATOM 0 H GLU A 110 9.454 -3.740 -4.789 1.00 0.00 H new ATOM 0 HA GLU A 110 8.365 -4.472 -7.334 1.00 0.00 H new ATOM 0 HB2 GLU A 110 8.338 -5.761 -5.096 1.00 0.00 H new ATOM 0 HB3 GLU A 110 7.044 -4.684 -4.611 1.00 0.00 H new ATOM 0 HG2 GLU A 110 6.326 -6.918 -5.576 1.00 0.00 H new ATOM 0 HG3 GLU A 110 5.571 -5.502 -6.280 1.00 0.00 H new ATOM 285 N VAL A 111 6.837 -2.145 -5.549 1.00 0.00 N ATOM 286 CA VAL A 111 5.869 -1.057 -5.626 1.00 0.00 C ATOM 287 C VAL A 111 6.282 -0.027 -6.671 1.00 0.00 C ATOM 288 O VAL A 111 5.447 0.484 -7.418 1.00 0.00 O ATOM 289 CB VAL A 111 5.706 -0.354 -4.265 1.00 0.00 C ATOM 290 CG1 VAL A 111 4.715 0.795 -4.373 1.00 0.00 C ATOM 291 CG2 VAL A 111 5.266 -1.350 -3.202 1.00 0.00 C ATOM 0 H VAL A 111 7.308 -2.227 -4.648 1.00 0.00 H new ATOM 0 HA VAL A 111 4.916 -1.501 -5.914 1.00 0.00 H new ATOM 0 HB VAL A 111 6.671 0.057 -3.969 1.00 0.00 H new ATOM 0 HG11 VAL A 111 4.613 1.280 -3.402 1.00 0.00 H new ATOM 0 HG12 VAL A 111 5.075 1.519 -5.104 1.00 0.00 H new ATOM 0 HG13 VAL A 111 3.746 0.411 -4.691 1.00 0.00 H new ATOM 0 HG21 VAL A 111 5.155 -0.837 -2.246 1.00 0.00 H new ATOM 0 HG22 VAL A 111 4.312 -1.791 -3.490 1.00 0.00 H new ATOM 0 HG23 VAL A 111 6.015 -2.136 -3.107 1.00 0.00 H new ATOM 301 N HIS A 112 7.576 0.274 -6.719 1.00 0.00 N ATOM 302 CA HIS A 112 8.100 1.244 -7.674 1.00 0.00 C ATOM 303 C HIS A 112 7.564 0.970 -9.076 1.00 0.00 C ATOM 304 O HIS A 112 6.847 1.792 -9.648 1.00 0.00 O ATOM 305 CB HIS A 112 9.629 1.206 -7.684 1.00 0.00 C ATOM 306 CG HIS A 112 10.257 2.494 -8.119 1.00 0.00 C ATOM 307 ND1 HIS A 112 11.383 3.021 -7.522 1.00 0.00 N ATOM 308 CD2 HIS A 112 9.912 3.361 -9.099 1.00 0.00 C ATOM 309 CE1 HIS A 112 11.702 4.158 -8.115 1.00 0.00 C ATOM 310 NE2 HIS A 112 10.825 4.386 -9.076 1.00 0.00 N ATOM 0 H HIS A 112 8.280 -0.140 -6.108 1.00 0.00 H new ATOM 0 HA HIS A 112 7.770 2.236 -7.365 1.00 0.00 H new ATOM 0 HB2 HIS A 112 9.985 0.957 -6.684 1.00 0.00 H new ATOM 0 HB3 HIS A 112 9.960 0.407 -8.348 1.00 0.00 H new ATOM 0 HD2 HIS A 112 9.074 3.265 -9.774 1.00 0.00 H new ATOM 0 HE1 HIS A 112 12.537 4.793 -7.858 1.00 0.00 H new ATOM 0 HE2 HIS A 112 10.826 5.193 -9.700 1.00 0.00 H new ATOM 319 N ASP A 113 7.915 -0.188 -9.623 1.00 0.00 N ATOM 320 CA ASP A 113 7.469 -0.570 -10.958 1.00 0.00 C ATOM 321 C ASP A 113 5.953 -0.447 -11.079 1.00 0.00 C ATOM 322 O ASP A 113 5.437 0.022 -12.094 1.00 0.00 O ATOM 323 CB ASP A 113 7.904 -2.001 -11.274 1.00 0.00 C ATOM 324 CG ASP A 113 8.135 -2.222 -12.756 1.00 0.00 C ATOM 325 OD1 ASP A 113 8.955 -1.486 -13.345 1.00 0.00 O ATOM 326 OD2 ASP A 113 7.497 -3.131 -13.327 1.00 0.00 O ATOM 0 H ASP A 113 8.507 -0.879 -9.163 1.00 0.00 H new ATOM 0 HA ASP A 113 7.929 0.108 -11.677 1.00 0.00 H new ATOM 0 HB2 ASP A 113 8.820 -2.228 -10.729 1.00 0.00 H new ATOM 0 HB3 ASP A 113 7.142 -2.696 -10.920 1.00 0.00 H new ATOM 331 N LEU A 114 5.245 -0.873 -10.039 1.00 0.00 N ATOM 332 CA LEU A 114 3.787 -0.812 -10.029 1.00 0.00 C ATOM 333 C LEU A 114 3.300 0.614 -10.268 1.00 0.00 C ATOM 334 O LEU A 114 2.496 0.864 -11.167 1.00 0.00 O ATOM 335 CB LEU A 114 3.244 -1.333 -8.697 1.00 0.00 C ATOM 336 CG LEU A 114 1.722 -1.356 -8.556 1.00 0.00 C ATOM 337 CD1 LEU A 114 1.139 -2.569 -9.264 1.00 0.00 C ATOM 338 CD2 LEU A 114 1.322 -1.349 -7.088 1.00 0.00 C ATOM 0 H LEU A 114 5.656 -1.264 -9.192 1.00 0.00 H new ATOM 0 HA LEU A 114 3.416 -1.443 -10.837 1.00 0.00 H new ATOM 0 HB2 LEU A 114 3.618 -2.346 -8.546 1.00 0.00 H new ATOM 0 HB3 LEU A 114 3.654 -0.719 -7.895 1.00 0.00 H new ATOM 0 HG LEU A 114 1.319 -0.459 -9.025 1.00 0.00 H new ATOM 0 HD11 LEU A 114 0.055 -2.569 -9.153 1.00 0.00 H new ATOM 0 HD12 LEU A 114 1.395 -2.530 -10.323 1.00 0.00 H new ATOM 0 HD13 LEU A 114 1.548 -3.479 -8.824 1.00 0.00 H new ATOM 0 HD21 LEU A 114 0.235 -1.366 -7.007 1.00 0.00 H new ATOM 0 HD22 LEU A 114 1.736 -2.228 -6.594 1.00 0.00 H new ATOM 0 HD23 LEU A 114 1.708 -0.449 -6.610 1.00 0.00 H new ATOM 350 N LEU A 115 3.794 1.545 -9.460 1.00 0.00 N ATOM 351 CA LEU A 115 3.411 2.947 -9.584 1.00 0.00 C ATOM 352 C LEU A 115 4.316 3.673 -10.574 1.00 0.00 C ATOM 353 O LEU A 115 4.695 4.824 -10.357 1.00 0.00 O ATOM 354 CB LEU A 115 3.473 3.636 -8.219 1.00 0.00 C ATOM 355 CG LEU A 115 2.320 3.333 -7.262 1.00 0.00 C ATOM 356 CD1 LEU A 115 2.678 3.754 -5.845 1.00 0.00 C ATOM 357 CD2 LEU A 115 1.048 4.031 -7.722 1.00 0.00 C ATOM 0 H LEU A 115 4.461 1.355 -8.712 1.00 0.00 H new ATOM 0 HA LEU A 115 2.388 2.987 -9.958 1.00 0.00 H new ATOM 0 HB2 LEU A 115 4.406 3.352 -7.733 1.00 0.00 H new ATOM 0 HB3 LEU A 115 3.512 4.713 -8.380 1.00 0.00 H new ATOM 0 HG LEU A 115 2.143 2.258 -7.266 1.00 0.00 H new ATOM 0 HD11 LEU A 115 1.845 3.531 -5.178 1.00 0.00 H new ATOM 0 HD12 LEU A 115 3.563 3.209 -5.516 1.00 0.00 H new ATOM 0 HD13 LEU A 115 2.883 4.824 -5.824 1.00 0.00 H new ATOM 0 HD21 LEU A 115 0.238 3.804 -7.029 1.00 0.00 H new ATOM 0 HD22 LEU A 115 1.213 5.108 -7.747 1.00 0.00 H new ATOM 0 HD23 LEU A 115 0.781 3.681 -8.719 1.00 0.00 H new ATOM 369 N LYS A 116 4.658 2.993 -11.663 1.00 0.00 N ATOM 370 CA LYS A 116 5.515 3.573 -12.690 1.00 0.00 C ATOM 371 C LYS A 116 4.862 4.803 -13.313 1.00 0.00 C ATOM 372 O LYS A 116 5.509 5.834 -13.498 1.00 0.00 O ATOM 373 CB LYS A 116 5.818 2.538 -13.776 1.00 0.00 C ATOM 374 CG LYS A 116 4.577 2.002 -14.468 1.00 0.00 C ATOM 375 CD LYS A 116 4.933 1.019 -15.570 1.00 0.00 C ATOM 376 CE LYS A 116 3.699 0.564 -16.333 1.00 0.00 C ATOM 377 NZ LYS A 116 2.820 -0.304 -15.501 1.00 0.00 N ATOM 0 H LYS A 116 4.354 2.039 -11.857 1.00 0.00 H new ATOM 0 HA LYS A 116 6.449 3.879 -12.218 1.00 0.00 H new ATOM 0 HB2 LYS A 116 6.474 2.987 -14.522 1.00 0.00 H new ATOM 0 HB3 LYS A 116 6.364 1.706 -13.331 1.00 0.00 H new ATOM 0 HG2 LYS A 116 3.934 1.512 -13.736 1.00 0.00 H new ATOM 0 HG3 LYS A 116 4.007 2.831 -14.889 1.00 0.00 H new ATOM 0 HD2 LYS A 116 5.637 1.484 -16.260 1.00 0.00 H new ATOM 0 HD3 LYS A 116 5.435 0.153 -15.138 1.00 0.00 H new ATOM 0 HE2 LYS A 116 3.137 1.436 -16.667 1.00 0.00 H new ATOM 0 HE3 LYS A 116 4.005 0.020 -17.227 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 2.008 -0.620 -16.068 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 3.358 -1.132 -15.175 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 2.480 0.234 -14.678 1.00 0.00 H new ATOM 391 N ASP A 117 3.578 4.687 -13.634 1.00 0.00 N ATOM 392 CA ASP A 117 2.837 5.790 -14.234 1.00 0.00 C ATOM 393 C ASP A 117 3.107 7.094 -13.490 1.00 0.00 C ATOM 394 O ASP A 117 3.357 8.131 -14.105 1.00 0.00 O ATOM 395 CB ASP A 117 1.338 5.487 -14.230 1.00 0.00 C ATOM 396 CG ASP A 117 0.985 4.300 -15.105 1.00 0.00 C ATOM 397 OD1 ASP A 117 1.151 4.402 -16.338 1.00 0.00 O ATOM 398 OD2 ASP A 117 0.542 3.269 -14.556 1.00 0.00 O ATOM 0 H ASP A 117 3.029 3.840 -13.489 1.00 0.00 H new ATOM 0 HA ASP A 117 3.174 5.904 -15.264 1.00 0.00 H new ATOM 0 HB2 ASP A 117 1.013 5.291 -13.208 1.00 0.00 H new ATOM 0 HB3 ASP A 117 0.792 6.365 -14.576 1.00 0.00 H new ATOM 403 N TYR A 118 3.054 7.035 -12.164 1.00 0.00 N ATOM 404 CA TYR A 118 3.290 8.212 -11.337 1.00 0.00 C ATOM 405 C TYR A 118 4.762 8.323 -10.953 1.00 0.00 C ATOM 406 O TYR A 118 5.428 7.317 -10.706 1.00 0.00 O ATOM 407 CB TYR A 118 2.426 8.155 -10.076 1.00 0.00 C ATOM 408 CG TYR A 118 1.015 7.673 -10.329 1.00 0.00 C ATOM 409 CD1 TYR A 118 0.706 6.319 -10.293 1.00 0.00 C ATOM 410 CD2 TYR A 118 -0.008 8.571 -10.606 1.00 0.00 C ATOM 411 CE1 TYR A 118 -0.580 5.873 -10.524 1.00 0.00 C ATOM 412 CE2 TYR A 118 -1.298 8.134 -10.837 1.00 0.00 C ATOM 413 CZ TYR A 118 -1.579 6.784 -10.796 1.00 0.00 C ATOM 414 OH TYR A 118 -2.863 6.345 -11.027 1.00 0.00 O ATOM 0 H TYR A 118 2.850 6.185 -11.639 1.00 0.00 H new ATOM 0 HA TYR A 118 3.018 9.093 -11.918 1.00 0.00 H new ATOM 0 HB2 TYR A 118 2.901 7.496 -9.350 1.00 0.00 H new ATOM 0 HB3 TYR A 118 2.387 9.148 -9.628 1.00 0.00 H new ATOM 0 HD1 TYR A 118 1.486 5.603 -10.081 1.00 0.00 H new ATOM 0 HD2 TYR A 118 0.209 9.628 -10.641 1.00 0.00 H new ATOM 0 HE1 TYR A 118 -0.802 4.817 -10.492 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -2.082 8.846 -11.049 1.00 0.00 H new ATOM 0 HH TYR A 118 -3.445 7.114 -11.202 1.00 0.00 H new ATOM 424 N ASP A 119 5.263 9.552 -10.905 1.00 0.00 N ATOM 425 CA ASP A 119 6.656 9.797 -10.550 1.00 0.00 C ATOM 426 C ASP A 119 6.870 9.637 -9.048 1.00 0.00 C ATOM 427 O ASP A 119 6.246 10.330 -8.244 1.00 0.00 O ATOM 428 CB ASP A 119 7.079 11.199 -10.992 1.00 0.00 C ATOM 429 CG ASP A 119 7.275 11.298 -12.492 1.00 0.00 C ATOM 430 OD1 ASP A 119 8.195 10.635 -13.015 1.00 0.00 O ATOM 431 OD2 ASP A 119 6.510 12.040 -13.143 1.00 0.00 O ATOM 0 H ASP A 119 4.725 10.395 -11.108 1.00 0.00 H new ATOM 0 HA ASP A 119 7.272 9.061 -11.067 1.00 0.00 H new ATOM 0 HB2 ASP A 119 6.323 11.919 -10.679 1.00 0.00 H new ATOM 0 HB3 ASP A 119 8.007 11.471 -10.488 1.00 0.00 H new ATOM 436 N LEU A 120 7.755 8.719 -8.676 1.00 0.00 N ATOM 437 CA LEU A 120 8.052 8.467 -7.270 1.00 0.00 C ATOM 438 C LEU A 120 9.266 9.272 -6.817 1.00 0.00 C ATOM 439 O LEU A 120 10.320 9.237 -7.452 1.00 0.00 O ATOM 440 CB LEU A 120 8.300 6.975 -7.040 1.00 0.00 C ATOM 441 CG LEU A 120 7.053 6.095 -6.941 1.00 0.00 C ATOM 442 CD1 LEU A 120 6.499 5.795 -8.325 1.00 0.00 C ATOM 443 CD2 LEU A 120 7.370 4.804 -6.200 1.00 0.00 C ATOM 0 H LEU A 120 8.280 8.136 -9.328 1.00 0.00 H new ATOM 0 HA LEU A 120 7.191 8.781 -6.680 1.00 0.00 H new ATOM 0 HB2 LEU A 120 8.921 6.601 -7.854 1.00 0.00 H new ATOM 0 HB3 LEU A 120 8.875 6.860 -6.121 1.00 0.00 H new ATOM 0 HG LEU A 120 6.293 6.637 -6.378 1.00 0.00 H new ATOM 0 HD11 LEU A 120 5.612 5.168 -8.234 1.00 0.00 H new ATOM 0 HD12 LEU A 120 6.234 6.729 -8.821 1.00 0.00 H new ATOM 0 HD13 LEU A 120 7.253 5.273 -8.914 1.00 0.00 H new ATOM 0 HD21 LEU A 120 6.472 4.190 -6.139 1.00 0.00 H new ATOM 0 HD22 LEU A 120 8.147 4.258 -6.736 1.00 0.00 H new ATOM 0 HD23 LEU A 120 7.719 5.038 -5.194 1.00 0.00 H new ATOM 455 N LYS A 121 9.111 9.995 -5.713 1.00 0.00 N ATOM 456 CA LYS A 121 10.194 10.806 -5.171 1.00 0.00 C ATOM 457 C LYS A 121 10.937 10.056 -4.069 1.00 0.00 C ATOM 458 O LYS A 121 12.167 10.056 -4.026 1.00 0.00 O ATOM 459 CB LYS A 121 9.646 12.126 -4.624 1.00 0.00 C ATOM 460 CG LYS A 121 8.945 12.974 -5.671 1.00 0.00 C ATOM 461 CD LYS A 121 9.929 13.533 -6.686 1.00 0.00 C ATOM 462 CE LYS A 121 10.633 14.772 -6.156 1.00 0.00 C ATOM 463 NZ LYS A 121 11.828 14.424 -5.338 1.00 0.00 N ATOM 0 H LYS A 121 8.245 10.036 -5.176 1.00 0.00 H new ATOM 0 HA LYS A 121 10.895 11.017 -5.979 1.00 0.00 H new ATOM 0 HB2 LYS A 121 8.948 11.912 -3.815 1.00 0.00 H new ATOM 0 HB3 LYS A 121 10.467 12.700 -4.194 1.00 0.00 H new ATOM 0 HG2 LYS A 121 8.194 12.373 -6.184 1.00 0.00 H new ATOM 0 HG3 LYS A 121 8.419 13.794 -5.183 1.00 0.00 H new ATOM 0 HD2 LYS A 121 10.668 12.772 -6.935 1.00 0.00 H new ATOM 0 HD3 LYS A 121 9.402 13.779 -7.608 1.00 0.00 H new ATOM 0 HE2 LYS A 121 10.936 15.403 -6.992 1.00 0.00 H new ATOM 0 HE3 LYS A 121 9.937 15.355 -5.553 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 11.629 14.612 -4.335 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 12.053 13.416 -5.464 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 12.638 15.000 -5.644 1.00 0.00 H new ATOM 477 N TYR A 122 10.182 9.418 -3.182 1.00 0.00 N ATOM 478 CA TYR A 122 10.769 8.665 -2.080 1.00 0.00 C ATOM 479 C TYR A 122 9.865 7.506 -1.670 1.00 0.00 C ATOM 480 O TYR A 122 8.639 7.608 -1.727 1.00 0.00 O ATOM 481 CB TYR A 122 11.015 9.583 -0.882 1.00 0.00 C ATOM 482 CG TYR A 122 12.026 9.037 0.101 1.00 0.00 C ATOM 483 CD1 TYR A 122 13.380 9.001 -0.212 1.00 0.00 C ATOM 484 CD2 TYR A 122 11.628 8.558 1.343 1.00 0.00 C ATOM 485 CE1 TYR A 122 14.306 8.503 0.683 1.00 0.00 C ATOM 486 CE2 TYR A 122 12.548 8.059 2.245 1.00 0.00 C ATOM 487 CZ TYR A 122 13.886 8.033 1.910 1.00 0.00 C ATOM 488 OH TYR A 122 14.806 7.537 2.805 1.00 0.00 O ATOM 0 H TYR A 122 9.162 9.407 -3.204 1.00 0.00 H new ATOM 0 HA TYR A 122 11.721 8.257 -2.418 1.00 0.00 H new ATOM 0 HB2 TYR A 122 11.358 10.553 -1.242 1.00 0.00 H new ATOM 0 HB3 TYR A 122 10.071 9.751 -0.364 1.00 0.00 H new ATOM 0 HD1 TYR A 122 13.713 9.369 -1.171 1.00 0.00 H new ATOM 0 HD2 TYR A 122 10.581 8.576 1.608 1.00 0.00 H new ATOM 0 HE1 TYR A 122 15.354 8.482 0.424 1.00 0.00 H new ATOM 0 HE2 TYR A 122 12.222 7.691 3.207 1.00 0.00 H new ATOM 0 HH TYR A 122 14.346 7.248 3.621 1.00 0.00 H new ATOM 498 N CYS A 123 10.480 6.403 -1.256 1.00 0.00 N ATOM 499 CA CYS A 123 9.734 5.223 -0.835 1.00 0.00 C ATOM 500 C CYS A 123 10.377 4.582 0.392 1.00 0.00 C ATOM 501 O CYS A 123 11.587 4.356 0.425 1.00 0.00 O ATOM 502 CB CYS A 123 9.661 4.207 -1.976 1.00 0.00 C ATOM 503 SG CYS A 123 11.066 3.049 -2.031 1.00 0.00 S ATOM 0 H CYS A 123 11.494 6.302 -1.203 1.00 0.00 H new ATOM 0 HA CYS A 123 8.724 5.537 -0.572 1.00 0.00 H new ATOM 0 HB2 CYS A 123 8.737 3.636 -1.882 1.00 0.00 H new ATOM 0 HB3 CYS A 123 9.609 4.744 -2.923 1.00 0.00 H new ATOM 508 N TYR A 124 9.559 4.292 1.397 1.00 0.00 N ATOM 509 CA TYR A 124 10.047 3.678 2.627 1.00 0.00 C ATOM 510 C TYR A 124 9.089 2.595 3.113 1.00 0.00 C ATOM 511 O TYR A 124 7.973 2.885 3.545 1.00 0.00 O ATOM 512 CB TYR A 124 10.228 4.740 3.713 1.00 0.00 C ATOM 513 CG TYR A 124 10.702 4.178 5.035 1.00 0.00 C ATOM 514 CD1 TYR A 124 9.798 3.692 5.970 1.00 0.00 C ATOM 515 CD2 TYR A 124 12.056 4.134 5.347 1.00 0.00 C ATOM 516 CE1 TYR A 124 10.226 3.179 7.179 1.00 0.00 C ATOM 517 CE2 TYR A 124 12.493 3.621 6.553 1.00 0.00 C ATOM 518 CZ TYR A 124 11.575 3.145 7.466 1.00 0.00 C ATOM 519 OH TYR A 124 12.006 2.634 8.668 1.00 0.00 O ATOM 0 H TYR A 124 8.555 4.472 1.385 1.00 0.00 H new ATOM 0 HA TYR A 124 11.011 3.215 2.415 1.00 0.00 H new ATOM 0 HB2 TYR A 124 10.945 5.484 3.366 1.00 0.00 H new ATOM 0 HB3 TYR A 124 9.281 5.257 3.866 1.00 0.00 H new ATOM 0 HD1 TYR A 124 8.741 3.715 5.748 1.00 0.00 H new ATOM 0 HD2 TYR A 124 12.778 4.507 4.635 1.00 0.00 H new ATOM 0 HE1 TYR A 124 9.509 2.807 7.895 1.00 0.00 H new ATOM 0 HE2 TYR A 124 13.549 3.593 6.780 1.00 0.00 H new ATOM 0 HH TYR A 124 12.984 2.682 8.712 1.00 0.00 H new ATOM 529 N VAL A 125 9.534 1.345 3.040 1.00 0.00 N ATOM 530 CA VAL A 125 8.718 0.217 3.474 1.00 0.00 C ATOM 531 C VAL A 125 8.985 -0.124 4.936 1.00 0.00 C ATOM 532 O VAL A 125 10.113 -0.011 5.414 1.00 0.00 O ATOM 533 CB VAL A 125 8.982 -1.031 2.611 1.00 0.00 C ATOM 534 CG1 VAL A 125 8.247 -2.237 3.177 1.00 0.00 C ATOM 535 CG2 VAL A 125 8.573 -0.777 1.168 1.00 0.00 C ATOM 0 H VAL A 125 10.455 1.088 2.685 1.00 0.00 H new ATOM 0 HA VAL A 125 7.676 0.516 3.358 1.00 0.00 H new ATOM 0 HB VAL A 125 10.051 -1.245 2.630 1.00 0.00 H new ATOM 0 HG11 VAL A 125 8.445 -3.109 2.554 1.00 0.00 H new ATOM 0 HG12 VAL A 125 8.593 -2.430 4.193 1.00 0.00 H new ATOM 0 HG13 VAL A 125 7.176 -2.037 3.190 1.00 0.00 H new ATOM 0 HG21 VAL A 125 8.766 -1.669 0.573 1.00 0.00 H new ATOM 0 HG22 VAL A 125 7.510 -0.537 1.128 1.00 0.00 H new ATOM 0 HG23 VAL A 125 9.149 0.058 0.768 1.00 0.00 H new ATOM 545 N ASP A 126 7.939 -0.541 5.640 1.00 0.00 N ATOM 546 CA ASP A 126 8.059 -0.901 7.048 1.00 0.00 C ATOM 547 C ASP A 126 7.767 -2.383 7.258 1.00 0.00 C ATOM 548 O ASP A 126 6.970 -2.977 6.531 1.00 0.00 O ATOM 549 CB ASP A 126 7.107 -0.055 7.896 1.00 0.00 C ATOM 550 CG ASP A 126 7.612 0.141 9.312 1.00 0.00 C ATOM 551 OD1 ASP A 126 7.971 -0.865 9.958 1.00 0.00 O ATOM 552 OD2 ASP A 126 7.647 1.301 9.774 1.00 0.00 O ATOM 0 H ASP A 126 6.998 -0.638 5.259 1.00 0.00 H new ATOM 0 HA ASP A 126 9.084 -0.704 7.361 1.00 0.00 H new ATOM 0 HB2 ASP A 126 6.972 0.918 7.424 1.00 0.00 H new ATOM 0 HB3 ASP A 126 6.128 -0.534 7.925 1.00 0.00 H new ATOM 557 N ARG A 127 8.417 -2.974 8.255 1.00 0.00 N ATOM 558 CA ARG A 127 8.228 -4.388 8.558 1.00 0.00 C ATOM 559 C ARG A 127 7.351 -4.566 9.794 1.00 0.00 C ATOM 560 O ARG A 127 6.708 -5.600 9.967 1.00 0.00 O ATOM 561 CB ARG A 127 9.581 -5.069 8.777 1.00 0.00 C ATOM 562 CG ARG A 127 10.371 -4.496 9.942 1.00 0.00 C ATOM 563 CD ARG A 127 10.054 -5.221 11.240 1.00 0.00 C ATOM 564 NE ARG A 127 10.649 -4.558 12.397 1.00 0.00 N ATOM 565 CZ ARG A 127 10.830 -5.151 13.572 1.00 0.00 C ATOM 566 NH1 ARG A 127 10.463 -6.413 13.745 1.00 0.00 N ATOM 567 NH2 ARG A 127 11.379 -4.481 14.577 1.00 0.00 N ATOM 0 H ARG A 127 9.079 -2.496 8.867 1.00 0.00 H new ATOM 0 HA ARG A 127 7.728 -4.853 7.709 1.00 0.00 H new ATOM 0 HB2 ARG A 127 9.419 -6.133 8.948 1.00 0.00 H new ATOM 0 HB3 ARG A 127 10.175 -4.979 7.867 1.00 0.00 H new ATOM 0 HG2 ARG A 127 11.438 -4.573 9.732 1.00 0.00 H new ATOM 0 HG3 ARG A 127 10.143 -3.436 10.051 1.00 0.00 H new ATOM 0 HD2 ARG A 127 8.973 -5.276 11.370 1.00 0.00 H new ATOM 0 HD3 ARG A 127 10.420 -6.246 11.181 1.00 0.00 H new ATOM 0 HE ARG A 127 10.942 -3.586 12.298 1.00 0.00 H new ATOM 0 HH11 ARG A 127 10.040 -6.931 12.975 1.00 0.00 H new ATOM 0 HH12 ARG A 127 10.603 -6.866 14.648 1.00 0.00 H new ATOM 0 HH21 ARG A 127 11.662 -3.510 14.448 1.00 0.00 H new ATOM 0 HH22 ARG A 127 11.518 -4.937 15.479 1.00 0.00 H new ATOM 581 N ASN A 128 7.332 -3.550 10.651 1.00 0.00 N ATOM 582 CA ASN A 128 6.535 -3.595 11.872 1.00 0.00 C ATOM 583 C ASN A 128 5.052 -3.418 11.560 1.00 0.00 C ATOM 584 O ASN A 128 4.204 -4.137 12.089 1.00 0.00 O ATOM 585 CB ASN A 128 6.996 -2.510 12.847 1.00 0.00 C ATOM 586 CG ASN A 128 6.090 -2.398 14.058 1.00 0.00 C ATOM 587 OD1 ASN A 128 5.409 -3.354 14.428 1.00 0.00 O ATOM 588 ND2 ASN A 128 6.078 -1.226 14.682 1.00 0.00 N ATOM 0 H ASN A 128 7.859 -2.686 10.523 1.00 0.00 H new ATOM 0 HA ASN A 128 6.677 -4.572 12.333 1.00 0.00 H new ATOM 0 HB2 ASN A 128 8.012 -2.729 13.176 1.00 0.00 H new ATOM 0 HB3 ASN A 128 7.028 -1.551 12.330 1.00 0.00 H new ATOM 0 HD21 ASN A 128 5.488 -1.091 15.503 1.00 0.00 H new ATOM 0 HD22 ASN A 128 6.659 -0.460 14.340 1.00 0.00 H new ATOM 595 N LYS A 129 4.746 -2.455 10.697 1.00 0.00 N ATOM 596 CA LYS A 129 3.366 -2.183 10.312 1.00 0.00 C ATOM 597 C LYS A 129 3.131 -2.532 8.846 1.00 0.00 C ATOM 598 O LYS A 129 2.125 -2.137 8.257 1.00 0.00 O ATOM 599 CB LYS A 129 3.027 -0.711 10.557 1.00 0.00 C ATOM 600 CG LYS A 129 2.567 -0.420 11.975 1.00 0.00 C ATOM 601 CD LYS A 129 1.772 0.872 12.050 1.00 0.00 C ATOM 602 CE LYS A 129 1.098 1.035 13.403 1.00 0.00 C ATOM 603 NZ LYS A 129 -0.070 1.956 13.335 1.00 0.00 N ATOM 0 H LYS A 129 5.435 -1.850 10.251 1.00 0.00 H new ATOM 0 HA LYS A 129 2.715 -2.807 10.925 1.00 0.00 H new ATOM 0 HB2 LYS A 129 3.905 -0.103 10.337 1.00 0.00 H new ATOM 0 HB3 LYS A 129 2.246 -0.406 9.861 1.00 0.00 H new ATOM 0 HG2 LYS A 129 1.955 -1.246 12.336 1.00 0.00 H new ATOM 0 HG3 LYS A 129 3.433 -0.354 12.633 1.00 0.00 H new ATOM 0 HD2 LYS A 129 2.434 1.719 11.868 1.00 0.00 H new ATOM 0 HD3 LYS A 129 1.018 0.882 11.263 1.00 0.00 H new ATOM 0 HE2 LYS A 129 0.771 0.060 13.765 1.00 0.00 H new ATOM 0 HE3 LYS A 129 1.820 1.417 14.124 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 -0.501 2.040 14.278 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 0.245 2.894 13.014 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -0.771 1.579 12.666 1.00 0.00 H new ATOM 617 N ARG A 130 4.065 -3.276 8.262 1.00 0.00 N ATOM 618 CA ARG A 130 3.960 -3.678 6.865 1.00 0.00 C ATOM 619 C ARG A 130 3.331 -2.570 6.026 1.00 0.00 C ATOM 620 O ARG A 130 2.368 -2.800 5.294 1.00 0.00 O ATOM 621 CB ARG A 130 3.130 -4.958 6.742 1.00 0.00 C ATOM 622 CG ARG A 130 3.707 -6.134 7.513 1.00 0.00 C ATOM 623 CD ARG A 130 5.143 -6.420 7.101 1.00 0.00 C ATOM 624 NE ARG A 130 5.255 -6.713 5.674 1.00 0.00 N ATOM 625 CZ ARG A 130 6.414 -6.824 5.035 1.00 0.00 C ATOM 626 NH1 ARG A 130 7.554 -6.667 5.692 1.00 0.00 N ATOM 627 NH2 ARG A 130 6.433 -7.093 3.736 1.00 0.00 N ATOM 0 H ARG A 130 4.903 -3.613 8.735 1.00 0.00 H new ATOM 0 HA ARG A 130 4.966 -3.867 6.491 1.00 0.00 H new ATOM 0 HB2 ARG A 130 2.119 -4.761 7.099 1.00 0.00 H new ATOM 0 HB3 ARG A 130 3.049 -5.229 5.689 1.00 0.00 H new ATOM 0 HG2 ARG A 130 3.669 -5.923 8.582 1.00 0.00 H new ATOM 0 HG3 ARG A 130 3.095 -7.019 7.341 1.00 0.00 H new ATOM 0 HD2 ARG A 130 5.768 -5.561 7.345 1.00 0.00 H new ATOM 0 HD3 ARG A 130 5.524 -7.265 7.675 1.00 0.00 H new ATOM 0 HE ARG A 130 4.396 -6.839 5.139 1.00 0.00 H new ATOM 0 HH11 ARG A 130 7.543 -6.460 6.691 1.00 0.00 H new ATOM 0 HH12 ARG A 130 8.443 -6.753 5.199 1.00 0.00 H new ATOM 0 HH21 ARG A 130 5.557 -7.215 3.228 1.00 0.00 H new ATOM 0 HH22 ARG A 130 7.323 -7.178 3.246 1.00 0.00 H new ATOM 641 N THR A 131 3.882 -1.365 6.138 1.00 0.00 N ATOM 642 CA THR A 131 3.375 -0.220 5.392 1.00 0.00 C ATOM 643 C THR A 131 4.500 0.499 4.657 1.00 0.00 C ATOM 644 O THR A 131 5.612 0.619 5.170 1.00 0.00 O ATOM 645 CB THR A 131 2.659 0.782 6.318 1.00 0.00 C ATOM 646 OG1 THR A 131 1.462 0.196 6.841 1.00 0.00 O ATOM 647 CG2 THR A 131 2.319 2.062 5.570 1.00 0.00 C ATOM 0 H THR A 131 4.680 -1.157 6.739 1.00 0.00 H new ATOM 0 HA THR A 131 2.660 -0.607 4.666 1.00 0.00 H new ATOM 0 HB THR A 131 3.331 1.028 7.140 1.00 0.00 H new ATOM 0 HG1 THR A 131 1.686 -0.620 7.335 1.00 0.00 H new ATOM 0 HG21 THR A 131 1.814 2.754 6.244 1.00 0.00 H new ATOM 0 HG22 THR A 131 3.235 2.521 5.198 1.00 0.00 H new ATOM 0 HG23 THR A 131 1.663 1.830 4.731 1.00 0.00 H new ATOM 655 N ALA A 132 4.203 0.977 3.453 1.00 0.00 N ATOM 656 CA ALA A 132 5.190 1.688 2.648 1.00 0.00 C ATOM 657 C ALA A 132 4.702 3.088 2.292 1.00 0.00 C ATOM 658 O ALA A 132 3.598 3.258 1.773 1.00 0.00 O ATOM 659 CB ALA A 132 5.507 0.900 1.386 1.00 0.00 C ATOM 0 H ALA A 132 3.287 0.885 3.013 1.00 0.00 H new ATOM 0 HA ALA A 132 6.101 1.789 3.239 1.00 0.00 H new ATOM 0 HB1 ALA A 132 6.245 1.442 0.794 1.00 0.00 H new ATOM 0 HB2 ALA A 132 5.906 -0.077 1.658 1.00 0.00 H new ATOM 0 HB3 ALA A 132 4.597 0.770 0.800 1.00 0.00 H new ATOM 665 N PHE A 133 5.530 4.088 2.574 1.00 0.00 N ATOM 666 CA PHE A 133 5.182 5.474 2.284 1.00 0.00 C ATOM 667 C PHE A 133 5.748 5.906 0.935 1.00 0.00 C ATOM 668 O PHE A 133 6.952 5.812 0.694 1.00 0.00 O ATOM 669 CB PHE A 133 5.706 6.395 3.388 1.00 0.00 C ATOM 670 CG PHE A 133 5.488 5.855 4.773 1.00 0.00 C ATOM 671 CD1 PHE A 133 4.275 6.035 5.417 1.00 0.00 C ATOM 672 CD2 PHE A 133 6.497 5.169 5.430 1.00 0.00 C ATOM 673 CE1 PHE A 133 4.071 5.539 6.691 1.00 0.00 C ATOM 674 CE2 PHE A 133 6.298 4.671 6.704 1.00 0.00 C ATOM 675 CZ PHE A 133 5.084 4.857 7.336 1.00 0.00 C ATOM 0 H PHE A 133 6.447 3.965 3.003 1.00 0.00 H new ATOM 0 HA PHE A 133 4.095 5.549 2.243 1.00 0.00 H new ATOM 0 HB2 PHE A 133 6.772 6.562 3.235 1.00 0.00 H new ATOM 0 HB3 PHE A 133 5.216 7.365 3.304 1.00 0.00 H new ATOM 0 HD1 PHE A 133 3.480 6.569 4.918 1.00 0.00 H new ATOM 0 HD2 PHE A 133 7.449 5.022 4.941 1.00 0.00 H new ATOM 0 HE1 PHE A 133 3.120 5.685 7.182 1.00 0.00 H new ATOM 0 HE2 PHE A 133 7.092 4.137 7.205 1.00 0.00 H new ATOM 0 HZ PHE A 133 4.927 4.470 8.332 1.00 0.00 H new ATOM 685 N VAL A 134 4.870 6.379 0.056 1.00 0.00 N ATOM 686 CA VAL A 134 5.281 6.827 -1.270 1.00 0.00 C ATOM 687 C VAL A 134 4.957 8.302 -1.476 1.00 0.00 C ATOM 688 O VAL A 134 3.864 8.763 -1.142 1.00 0.00 O ATOM 689 CB VAL A 134 4.598 6.002 -2.377 1.00 0.00 C ATOM 690 CG1 VAL A 134 5.057 6.468 -3.750 1.00 0.00 C ATOM 691 CG2 VAL A 134 4.879 4.519 -2.186 1.00 0.00 C ATOM 0 H VAL A 134 3.870 6.462 0.238 1.00 0.00 H new ATOM 0 HA VAL A 134 6.360 6.683 -1.333 1.00 0.00 H new ATOM 0 HB VAL A 134 3.521 6.156 -2.309 1.00 0.00 H new ATOM 0 HG11 VAL A 134 4.564 5.874 -4.519 1.00 0.00 H new ATOM 0 HG12 VAL A 134 4.799 7.519 -3.882 1.00 0.00 H new ATOM 0 HG13 VAL A 134 6.137 6.346 -3.833 1.00 0.00 H new ATOM 0 HG21 VAL A 134 4.389 3.951 -2.977 1.00 0.00 H new ATOM 0 HG22 VAL A 134 5.954 4.344 -2.227 1.00 0.00 H new ATOM 0 HG23 VAL A 134 4.496 4.198 -1.218 1.00 0.00 H new ATOM 701 N THR A 135 5.913 9.041 -2.031 1.00 0.00 N ATOM 702 CA THR A 135 5.731 10.464 -2.282 1.00 0.00 C ATOM 703 C THR A 135 5.599 10.747 -3.774 1.00 0.00 C ATOM 704 O THR A 135 6.581 10.693 -4.516 1.00 0.00 O ATOM 705 CB THR A 135 6.902 11.290 -1.716 1.00 0.00 C ATOM 706 OG1 THR A 135 7.008 11.084 -0.303 1.00 0.00 O ATOM 707 CG2 THR A 135 6.709 12.771 -2.005 1.00 0.00 C ATOM 0 H THR A 135 6.822 8.676 -2.315 1.00 0.00 H new ATOM 0 HA THR A 135 4.811 10.758 -1.776 1.00 0.00 H new ATOM 0 HB THR A 135 7.820 10.958 -2.201 1.00 0.00 H new ATOM 0 HG1 THR A 135 7.755 11.611 0.049 1.00 0.00 H new ATOM 0 HG21 THR A 135 7.548 13.334 -1.596 1.00 0.00 H new ATOM 0 HG22 THR A 135 6.658 12.928 -3.082 1.00 0.00 H new ATOM 0 HG23 THR A 135 5.783 13.114 -1.544 1.00 0.00 H new ATOM 715 N LEU A 136 4.381 11.048 -4.209 1.00 0.00 N ATOM 716 CA LEU A 136 4.121 11.340 -5.615 1.00 0.00 C ATOM 717 C LEU A 136 4.578 12.751 -5.972 1.00 0.00 C ATOM 718 O LEU A 136 5.071 13.490 -5.118 1.00 0.00 O ATOM 719 CB LEU A 136 2.630 11.182 -5.922 1.00 0.00 C ATOM 720 CG LEU A 136 2.030 9.804 -5.643 1.00 0.00 C ATOM 721 CD1 LEU A 136 0.533 9.809 -5.913 1.00 0.00 C ATOM 722 CD2 LEU A 136 2.722 8.741 -6.485 1.00 0.00 C ATOM 0 H LEU A 136 3.558 11.096 -3.609 1.00 0.00 H new ATOM 0 HA LEU A 136 4.688 10.631 -6.218 1.00 0.00 H new ATOM 0 HB2 LEU A 136 2.079 11.921 -5.340 1.00 0.00 H new ATOM 0 HB3 LEU A 136 2.469 11.420 -6.973 1.00 0.00 H new ATOM 0 HG LEU A 136 2.188 9.566 -4.591 1.00 0.00 H new ATOM 0 HD11 LEU A 136 0.123 8.820 -5.709 1.00 0.00 H new ATOM 0 HD12 LEU A 136 0.049 10.542 -5.268 1.00 0.00 H new ATOM 0 HD13 LEU A 136 0.352 10.069 -6.956 1.00 0.00 H new ATOM 0 HD21 LEU A 136 2.282 7.766 -6.274 1.00 0.00 H new ATOM 0 HD22 LEU A 136 2.595 8.975 -7.542 1.00 0.00 H new ATOM 0 HD23 LEU A 136 3.785 8.720 -6.243 1.00 0.00 H new ATOM 734 N LEU A 137 4.409 13.120 -7.236 1.00 0.00 N ATOM 735 CA LEU A 137 4.803 14.444 -7.706 1.00 0.00 C ATOM 736 C LEU A 137 3.721 15.474 -7.399 1.00 0.00 C ATOM 737 O LEU A 137 3.951 16.426 -6.654 1.00 0.00 O ATOM 738 CB LEU A 137 5.079 14.411 -9.210 1.00 0.00 C ATOM 739 CG LEU A 137 5.313 15.766 -9.879 1.00 0.00 C ATOM 740 CD1 LEU A 137 6.602 16.396 -9.374 1.00 0.00 C ATOM 741 CD2 LEU A 137 5.350 15.614 -11.393 1.00 0.00 C ATOM 0 H LEU A 137 4.002 12.521 -7.955 1.00 0.00 H new ATOM 0 HA LEU A 137 5.714 14.733 -7.182 1.00 0.00 H new ATOM 0 HB2 LEU A 137 5.955 13.786 -9.385 1.00 0.00 H new ATOM 0 HB3 LEU A 137 4.237 13.925 -9.703 1.00 0.00 H new ATOM 0 HG LEU A 137 4.485 16.425 -9.619 1.00 0.00 H new ATOM 0 HD11 LEU A 137 6.751 17.359 -9.861 1.00 0.00 H new ATOM 0 HD12 LEU A 137 6.538 16.541 -8.296 1.00 0.00 H new ATOM 0 HD13 LEU A 137 7.442 15.740 -9.603 1.00 0.00 H new ATOM 0 HD21 LEU A 137 5.517 16.588 -11.852 1.00 0.00 H new ATOM 0 HD22 LEU A 137 6.158 14.938 -11.671 1.00 0.00 H new ATOM 0 HD23 LEU A 137 4.401 15.207 -11.741 1.00 0.00 H new ATOM 753 N ASN A 138 2.541 15.276 -7.976 1.00 0.00 N ATOM 754 CA ASN A 138 1.422 16.187 -7.763 1.00 0.00 C ATOM 755 C ASN A 138 0.315 15.511 -6.960 1.00 0.00 C ATOM 756 O ASN A 138 0.171 14.290 -6.987 1.00 0.00 O ATOM 757 CB ASN A 138 0.870 16.674 -9.104 1.00 0.00 C ATOM 758 CG ASN A 138 1.969 16.985 -10.102 1.00 0.00 C ATOM 759 OD1 ASN A 138 2.250 16.191 -11.000 1.00 0.00 O ATOM 760 ND2 ASN A 138 2.595 18.146 -9.950 1.00 0.00 N ATOM 0 H ASN A 138 2.334 14.492 -8.595 1.00 0.00 H new ATOM 0 HA ASN A 138 1.787 17.043 -7.196 1.00 0.00 H new ATOM 0 HB2 ASN A 138 0.210 15.913 -9.520 1.00 0.00 H new ATOM 0 HB3 ASN A 138 0.266 17.567 -8.943 1.00 0.00 H new ATOM 0 HD21 ASN A 138 3.342 18.411 -10.592 1.00 0.00 H new ATOM 0 HD22 ASN A 138 2.329 18.773 -9.191 1.00 0.00 H new ATOM 767 N GLY A 139 -0.466 16.315 -6.245 1.00 0.00 N ATOM 768 CA GLY A 139 -1.550 15.778 -5.444 1.00 0.00 C ATOM 769 C GLY A 139 -2.637 15.144 -6.291 1.00 0.00 C ATOM 770 O GLY A 139 -3.085 14.034 -6.006 1.00 0.00 O ATOM 0 H GLY A 139 -0.367 17.329 -6.206 1.00 0.00 H new ATOM 0 HA2 GLY A 139 -1.153 15.035 -4.752 1.00 0.00 H new ATOM 0 HA3 GLY A 139 -1.982 16.576 -4.841 1.00 0.00 H new ATOM 774 N GLU A 140 -3.061 15.852 -7.333 1.00 0.00 N ATOM 775 CA GLU A 140 -4.103 15.351 -8.222 1.00 0.00 C ATOM 776 C GLU A 140 -3.831 13.904 -8.619 1.00 0.00 C ATOM 777 O GLU A 140 -4.758 13.110 -8.784 1.00 0.00 O ATOM 778 CB GLU A 140 -4.200 16.226 -9.473 1.00 0.00 C ATOM 779 CG GLU A 140 -4.469 17.691 -9.173 1.00 0.00 C ATOM 780 CD GLU A 140 -3.197 18.478 -8.925 1.00 0.00 C ATOM 781 OE1 GLU A 140 -2.353 18.546 -9.844 1.00 0.00 O ATOM 782 OE2 GLU A 140 -3.045 19.026 -7.814 1.00 0.00 O ATOM 0 H GLU A 140 -2.700 16.773 -7.582 1.00 0.00 H new ATOM 0 HA GLU A 140 -5.051 15.389 -7.686 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -3.270 16.144 -10.036 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -4.995 15.843 -10.113 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -5.010 18.136 -10.008 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -5.115 17.766 -8.298 1.00 0.00 H new ATOM 789 N GLN A 141 -2.554 13.568 -8.771 1.00 0.00 N ATOM 790 CA GLN A 141 -2.160 12.216 -9.151 1.00 0.00 C ATOM 791 C GLN A 141 -2.577 11.208 -8.085 1.00 0.00 C ATOM 792 O GLN A 141 -3.109 10.144 -8.398 1.00 0.00 O ATOM 793 CB GLN A 141 -0.648 12.147 -9.372 1.00 0.00 C ATOM 794 CG GLN A 141 -0.227 12.464 -10.798 1.00 0.00 C ATOM 795 CD GLN A 141 1.220 12.105 -11.072 1.00 0.00 C ATOM 796 OE1 GLN A 141 1.512 11.073 -11.678 1.00 0.00 O ATOM 797 NE2 GLN A 141 2.137 12.957 -10.627 1.00 0.00 N ATOM 0 H GLN A 141 -1.775 14.213 -8.637 1.00 0.00 H new ATOM 0 HA GLN A 141 -2.668 11.964 -10.082 1.00 0.00 H new ATOM 0 HB2 GLN A 141 -0.158 12.845 -8.693 1.00 0.00 H new ATOM 0 HB3 GLN A 141 -0.296 11.149 -9.111 1.00 0.00 H new ATOM 0 HG2 GLN A 141 -0.870 11.922 -11.492 1.00 0.00 H new ATOM 0 HG3 GLN A 141 -0.376 13.527 -10.989 1.00 0.00 H new ATOM 0 HE21 GLN A 141 1.851 13.800 -10.130 1.00 0.00 H new ATOM 0 HE22 GLN A 141 3.127 12.768 -10.783 1.00 0.00 H new ATOM 806 N ALA A 142 -2.330 11.551 -6.825 1.00 0.00 N ATOM 807 CA ALA A 142 -2.681 10.677 -5.713 1.00 0.00 C ATOM 808 C ALA A 142 -4.193 10.519 -5.595 1.00 0.00 C ATOM 809 O ALA A 142 -4.706 9.402 -5.525 1.00 0.00 O ATOM 810 CB ALA A 142 -2.102 11.217 -4.414 1.00 0.00 C ATOM 0 H ALA A 142 -1.888 12.428 -6.549 1.00 0.00 H new ATOM 0 HA ALA A 142 -2.253 9.693 -5.907 1.00 0.00 H new ATOM 0 HB1 ALA A 142 -2.372 10.554 -3.592 1.00 0.00 H new ATOM 0 HB2 ALA A 142 -1.016 11.272 -4.494 1.00 0.00 H new ATOM 0 HB3 ALA A 142 -2.502 12.213 -4.224 1.00 0.00 H new ATOM 816 N GLN A 143 -4.901 11.644 -5.573 1.00 0.00 N ATOM 817 CA GLN A 143 -6.355 11.629 -5.462 1.00 0.00 C ATOM 818 C GLN A 143 -6.946 10.435 -6.203 1.00 0.00 C ATOM 819 O GLN A 143 -7.869 9.785 -5.716 1.00 0.00 O ATOM 820 CB GLN A 143 -6.943 12.929 -6.014 1.00 0.00 C ATOM 821 CG GLN A 143 -6.583 14.157 -5.193 1.00 0.00 C ATOM 822 CD GLN A 143 -7.449 14.306 -3.957 1.00 0.00 C ATOM 823 OE1 GLN A 143 -8.652 14.049 -3.993 1.00 0.00 O ATOM 824 NE2 GLN A 143 -6.839 14.724 -2.854 1.00 0.00 N ATOM 0 H GLN A 143 -4.492 12.576 -5.631 1.00 0.00 H new ATOM 0 HA GLN A 143 -6.612 11.541 -4.406 1.00 0.00 H new ATOM 0 HB2 GLN A 143 -6.593 13.071 -7.037 1.00 0.00 H new ATOM 0 HB3 GLN A 143 -8.028 12.837 -6.058 1.00 0.00 H new ATOM 0 HG2 GLN A 143 -5.537 14.096 -4.894 1.00 0.00 H new ATOM 0 HG3 GLN A 143 -6.685 15.047 -5.813 1.00 0.00 H new ATOM 0 HE21 GLN A 143 -5.839 14.926 -2.869 1.00 0.00 H new ATOM 0 HE22 GLN A 143 -7.370 14.843 -1.991 1.00 0.00 H new ATOM 833 N ASN A 144 -6.406 10.152 -7.384 1.00 0.00 N ATOM 834 CA ASN A 144 -6.880 9.035 -8.194 1.00 0.00 C ATOM 835 C ASN A 144 -6.151 7.747 -7.825 1.00 0.00 C ATOM 836 O ASN A 144 -6.775 6.748 -7.470 1.00 0.00 O ATOM 837 CB ASN A 144 -6.685 9.337 -9.681 1.00 0.00 C ATOM 838 CG ASN A 144 -7.684 10.353 -10.201 1.00 0.00 C ATOM 839 OD1 ASN A 144 -8.600 10.012 -10.950 1.00 0.00 O ATOM 840 ND2 ASN A 144 -7.512 11.608 -9.805 1.00 0.00 N ATOM 0 H ASN A 144 -5.640 10.680 -7.802 1.00 0.00 H new ATOM 0 HA ASN A 144 -7.943 8.899 -7.994 1.00 0.00 H new ATOM 0 HB2 ASN A 144 -5.674 9.710 -9.844 1.00 0.00 H new ATOM 0 HB3 ASN A 144 -6.780 8.413 -10.252 1.00 0.00 H new ATOM 0 HD21 ASN A 144 -8.153 12.335 -10.122 1.00 0.00 H new ATOM 0 HD22 ASN A 144 -6.739 11.845 -9.184 1.00 0.00 H new ATOM 847 N ALA A 145 -4.825 7.779 -7.912 1.00 0.00 N ATOM 848 CA ALA A 145 -4.010 6.615 -7.585 1.00 0.00 C ATOM 849 C ALA A 145 -4.527 5.918 -6.331 1.00 0.00 C ATOM 850 O ALA A 145 -4.344 4.712 -6.161 1.00 0.00 O ATOM 851 CB ALA A 145 -2.556 7.024 -7.402 1.00 0.00 C ATOM 0 H ALA A 145 -4.293 8.598 -8.206 1.00 0.00 H new ATOM 0 HA ALA A 145 -4.077 5.911 -8.414 1.00 0.00 H new ATOM 0 HB1 ALA A 145 -1.959 6.145 -7.158 1.00 0.00 H new ATOM 0 HB2 ALA A 145 -2.185 7.471 -8.324 1.00 0.00 H new ATOM 0 HB3 ALA A 145 -2.481 7.750 -6.592 1.00 0.00 H new ATOM 857 N ILE A 146 -5.171 6.684 -5.457 1.00 0.00 N ATOM 858 CA ILE A 146 -5.714 6.138 -4.219 1.00 0.00 C ATOM 859 C ILE A 146 -6.717 5.025 -4.502 1.00 0.00 C ATOM 860 O ILE A 146 -6.491 3.868 -4.147 1.00 0.00 O ATOM 861 CB ILE A 146 -6.400 7.229 -3.376 1.00 0.00 C ATOM 862 CG1 ILE A 146 -5.366 8.235 -2.865 1.00 0.00 C ATOM 863 CG2 ILE A 146 -7.157 6.604 -2.214 1.00 0.00 C ATOM 864 CD1 ILE A 146 -5.939 9.609 -2.598 1.00 0.00 C ATOM 0 H ILE A 146 -5.330 7.684 -5.583 1.00 0.00 H new ATOM 0 HA ILE A 146 -4.873 5.732 -3.658 1.00 0.00 H new ATOM 0 HB ILE A 146 -7.114 7.758 -4.007 1.00 0.00 H new ATOM 0 HG12 ILE A 146 -4.921 7.851 -1.947 1.00 0.00 H new ATOM 0 HG13 ILE A 146 -4.563 8.321 -3.597 1.00 0.00 H new ATOM 0 HG21 ILE A 146 -7.636 7.388 -1.628 1.00 0.00 H new ATOM 0 HG22 ILE A 146 -7.916 5.923 -2.599 1.00 0.00 H new ATOM 0 HG23 ILE A 146 -6.462 6.052 -1.582 1.00 0.00 H new ATOM 0 HD11 ILE A 146 -5.149 10.269 -2.239 1.00 0.00 H new ATOM 0 HD12 ILE A 146 -6.359 10.013 -3.519 1.00 0.00 H new ATOM 0 HD13 ILE A 146 -6.722 9.536 -1.844 1.00 0.00 H new ATOM 876 N GLN A 147 -7.824 5.383 -5.145 1.00 0.00 N ATOM 877 CA GLN A 147 -8.861 4.413 -5.477 1.00 0.00 C ATOM 878 C GLN A 147 -8.399 3.482 -6.593 1.00 0.00 C ATOM 879 O GLN A 147 -8.624 2.274 -6.539 1.00 0.00 O ATOM 880 CB GLN A 147 -10.145 5.131 -5.894 1.00 0.00 C ATOM 881 CG GLN A 147 -10.930 5.703 -4.725 1.00 0.00 C ATOM 882 CD GLN A 147 -12.287 6.238 -5.139 1.00 0.00 C ATOM 883 OE1 GLN A 147 -13.324 5.734 -4.705 1.00 0.00 O ATOM 884 NE2 GLN A 147 -12.288 7.263 -5.982 1.00 0.00 N ATOM 0 H GLN A 147 -8.026 6.336 -5.446 1.00 0.00 H new ATOM 0 HA GLN A 147 -9.060 3.814 -4.589 1.00 0.00 H new ATOM 0 HB2 GLN A 147 -9.893 5.939 -6.581 1.00 0.00 H new ATOM 0 HB3 GLN A 147 -10.780 4.434 -6.441 1.00 0.00 H new ATOM 0 HG2 GLN A 147 -11.064 4.929 -3.969 1.00 0.00 H new ATOM 0 HG3 GLN A 147 -10.354 6.504 -4.262 1.00 0.00 H new ATOM 0 HE21 GLN A 147 -11.405 7.649 -6.316 1.00 0.00 H new ATOM 0 HE22 GLN A 147 -13.172 7.665 -6.296 1.00 0.00 H new ATOM 893 N MET A 148 -7.752 4.054 -7.604 1.00 0.00 N ATOM 894 CA MET A 148 -7.258 3.275 -8.733 1.00 0.00 C ATOM 895 C MET A 148 -6.519 2.030 -8.252 1.00 0.00 C ATOM 896 O MET A 148 -6.563 0.982 -8.897 1.00 0.00 O ATOM 897 CB MET A 148 -6.332 4.127 -9.602 1.00 0.00 C ATOM 898 CG MET A 148 -7.044 5.268 -10.311 1.00 0.00 C ATOM 899 SD MET A 148 -8.056 4.704 -11.693 1.00 0.00 S ATOM 900 CE MET A 148 -7.095 5.301 -13.082 1.00 0.00 C ATOM 0 H MET A 148 -7.558 5.054 -7.664 1.00 0.00 H new ATOM 0 HA MET A 148 -8.115 2.961 -9.328 1.00 0.00 H new ATOM 0 HB2 MET A 148 -5.537 4.537 -8.979 1.00 0.00 H new ATOM 0 HB3 MET A 148 -5.856 3.488 -10.346 1.00 0.00 H new ATOM 0 HG2 MET A 148 -7.674 5.797 -9.597 1.00 0.00 H new ATOM 0 HG3 MET A 148 -6.305 5.982 -10.675 1.00 0.00 H new ATOM 0 HE1 MET A 148 -7.593 5.029 -14.013 1.00 0.00 H new ATOM 0 HE2 MET A 148 -7.004 6.386 -13.022 1.00 0.00 H new ATOM 0 HE3 MET A 148 -6.102 4.852 -13.057 1.00 0.00 H new ATOM 910 N PHE A 149 -5.840 2.152 -7.116 1.00 0.00 N ATOM 911 CA PHE A 149 -5.090 1.036 -6.550 1.00 0.00 C ATOM 912 C PHE A 149 -5.868 0.379 -5.414 1.00 0.00 C ATOM 913 O PHE A 149 -5.900 -0.846 -5.295 1.00 0.00 O ATOM 914 CB PHE A 149 -3.729 1.515 -6.041 1.00 0.00 C ATOM 915 CG PHE A 149 -2.782 1.906 -7.139 1.00 0.00 C ATOM 916 CD1 PHE A 149 -3.110 2.916 -8.028 1.00 0.00 C ATOM 917 CD2 PHE A 149 -1.563 1.263 -7.282 1.00 0.00 C ATOM 918 CE1 PHE A 149 -2.241 3.279 -9.040 1.00 0.00 C ATOM 919 CE2 PHE A 149 -0.690 1.621 -8.291 1.00 0.00 C ATOM 920 CZ PHE A 149 -1.029 2.629 -9.172 1.00 0.00 C ATOM 0 H PHE A 149 -5.794 3.012 -6.569 1.00 0.00 H new ATOM 0 HA PHE A 149 -4.937 0.297 -7.337 1.00 0.00 H new ATOM 0 HB2 PHE A 149 -3.877 2.368 -5.379 1.00 0.00 H new ATOM 0 HB3 PHE A 149 -3.274 0.724 -5.444 1.00 0.00 H new ATOM 0 HD1 PHE A 149 -4.057 3.426 -7.929 1.00 0.00 H new ATOM 0 HD2 PHE A 149 -1.292 0.473 -6.597 1.00 0.00 H new ATOM 0 HE1 PHE A 149 -2.509 4.069 -9.726 1.00 0.00 H new ATOM 0 HE2 PHE A 149 0.258 1.113 -8.391 1.00 0.00 H new ATOM 0 HZ PHE A 149 -0.348 2.909 -9.962 1.00 0.00 H new ATOM 930 N HIS A 150 -6.495 1.203 -4.579 1.00 0.00 N ATOM 931 CA HIS A 150 -7.273 0.703 -3.452 1.00 0.00 C ATOM 932 C HIS A 150 -7.962 -0.612 -3.808 1.00 0.00 C ATOM 933 O HIS A 150 -8.678 -0.697 -4.805 1.00 0.00 O ATOM 934 CB HIS A 150 -8.314 1.738 -3.024 1.00 0.00 C ATOM 935 CG HIS A 150 -9.067 1.355 -1.787 1.00 0.00 C ATOM 936 ND1 HIS A 150 -8.461 0.803 -0.678 1.00 0.00 N ATOM 937 CD2 HIS A 150 -10.384 1.448 -1.488 1.00 0.00 C ATOM 938 CE1 HIS A 150 -9.373 0.572 0.250 1.00 0.00 C ATOM 939 NE2 HIS A 150 -10.548 0.955 -0.217 1.00 0.00 N ATOM 0 H HIS A 150 -6.479 2.219 -4.662 1.00 0.00 H new ATOM 0 HA HIS A 150 -6.589 0.522 -2.622 1.00 0.00 H new ATOM 0 HB2 HIS A 150 -7.817 2.693 -2.855 1.00 0.00 H new ATOM 0 HB3 HIS A 150 -9.022 1.887 -3.839 1.00 0.00 H new ATOM 0 HD2 HIS A 150 -11.161 1.837 -2.129 1.00 0.00 H new ATOM 0 HE1 HIS A 150 -9.189 0.143 1.224 1.00 0.00 H new ATOM 0 HE2 HIS A 150 -11.434 0.894 0.285 1.00 0.00 H new ATOM 948 N GLN A 151 -7.739 -1.632 -2.986 1.00 0.00 N ATOM 949 CA GLN A 151 -8.337 -2.942 -3.216 1.00 0.00 C ATOM 950 C GLN A 151 -7.829 -3.552 -4.518 1.00 0.00 C ATOM 951 O GLN A 151 -8.613 -4.021 -5.343 1.00 0.00 O ATOM 952 CB GLN A 151 -9.862 -2.830 -3.252 1.00 0.00 C ATOM 953 CG GLN A 151 -10.466 -2.324 -1.953 1.00 0.00 C ATOM 954 CD GLN A 151 -11.904 -1.871 -2.115 1.00 0.00 C ATOM 955 OE1 GLN A 151 -12.533 -2.120 -3.144 1.00 0.00 O ATOM 956 NE2 GLN A 151 -12.433 -1.202 -1.097 1.00 0.00 N ATOM 0 H GLN A 151 -7.149 -1.577 -2.156 1.00 0.00 H new ATOM 0 HA GLN A 151 -8.047 -3.595 -2.393 1.00 0.00 H new ATOM 0 HB2 GLN A 151 -10.150 -2.160 -4.062 1.00 0.00 H new ATOM 0 HB3 GLN A 151 -10.284 -3.808 -3.483 1.00 0.00 H new ATOM 0 HG2 GLN A 151 -10.420 -3.114 -1.204 1.00 0.00 H new ATOM 0 HG3 GLN A 151 -9.868 -1.494 -1.578 1.00 0.00 H new ATOM 0 HE21 GLN A 151 -11.875 -1.018 -0.263 1.00 0.00 H new ATOM 0 HE22 GLN A 151 -13.397 -0.872 -1.149 1.00 0.00 H new ATOM 965 N TYR A 152 -6.512 -3.541 -4.696 1.00 0.00 N ATOM 966 CA TYR A 152 -5.900 -4.090 -5.900 1.00 0.00 C ATOM 967 C TYR A 152 -5.539 -5.560 -5.705 1.00 0.00 C ATOM 968 O TYR A 152 -5.432 -6.040 -4.577 1.00 0.00 O ATOM 969 CB TYR A 152 -4.649 -3.292 -6.270 1.00 0.00 C ATOM 970 CG TYR A 152 -3.807 -3.948 -7.341 1.00 0.00 C ATOM 971 CD1 TYR A 152 -4.304 -4.138 -8.625 1.00 0.00 C ATOM 972 CD2 TYR A 152 -2.513 -4.377 -7.070 1.00 0.00 C ATOM 973 CE1 TYR A 152 -3.539 -4.737 -9.606 1.00 0.00 C ATOM 974 CE2 TYR A 152 -1.740 -4.976 -8.045 1.00 0.00 C ATOM 975 CZ TYR A 152 -2.257 -5.155 -9.311 1.00 0.00 C ATOM 976 OH TYR A 152 -1.491 -5.751 -10.286 1.00 0.00 O ATOM 0 H TYR A 152 -5.849 -3.158 -4.022 1.00 0.00 H new ATOM 0 HA TYR A 152 -6.624 -4.016 -6.712 1.00 0.00 H new ATOM 0 HB2 TYR A 152 -4.948 -2.301 -6.611 1.00 0.00 H new ATOM 0 HB3 TYR A 152 -4.041 -3.151 -5.377 1.00 0.00 H new ATOM 0 HD1 TYR A 152 -5.306 -3.811 -8.860 1.00 0.00 H new ATOM 0 HD2 TYR A 152 -2.105 -4.239 -6.080 1.00 0.00 H new ATOM 0 HE1 TYR A 152 -3.941 -4.878 -10.598 1.00 0.00 H new ATOM 0 HE2 TYR A 152 -0.736 -5.303 -7.817 1.00 0.00 H new ATOM 0 HH TYR A 152 -0.614 -5.985 -9.916 1.00 0.00 H new ATOM 986 N SER A 153 -5.353 -6.269 -6.814 1.00 0.00 N ATOM 987 CA SER A 153 -5.007 -7.685 -6.768 1.00 0.00 C ATOM 988 C SER A 153 -3.500 -7.872 -6.624 1.00 0.00 C ATOM 989 O SER A 153 -2.756 -7.781 -7.601 1.00 0.00 O ATOM 990 CB SER A 153 -5.503 -8.394 -8.029 1.00 0.00 C ATOM 991 OG SER A 153 -5.043 -9.733 -8.076 1.00 0.00 O ATOM 0 H SER A 153 -5.436 -5.886 -7.756 1.00 0.00 H new ATOM 0 HA SER A 153 -5.494 -8.125 -5.898 1.00 0.00 H new ATOM 0 HB2 SER A 153 -6.593 -8.380 -8.053 1.00 0.00 H new ATOM 0 HB3 SER A 153 -5.157 -7.856 -8.912 1.00 0.00 H new ATOM 0 HG SER A 153 -5.375 -10.165 -8.891 1.00 0.00 H new ATOM 997 N PHE A 154 -3.057 -8.133 -5.399 1.00 0.00 N ATOM 998 CA PHE A 154 -1.638 -8.332 -5.126 1.00 0.00 C ATOM 999 C PHE A 154 -1.437 -9.364 -4.019 1.00 0.00 C ATOM 1000 O PHE A 154 -1.815 -9.138 -2.870 1.00 0.00 O ATOM 1001 CB PHE A 154 -0.982 -7.008 -4.730 1.00 0.00 C ATOM 1002 CG PHE A 154 0.513 -7.013 -4.872 1.00 0.00 C ATOM 1003 CD1 PHE A 154 1.103 -6.959 -6.124 1.00 0.00 C ATOM 1004 CD2 PHE A 154 1.328 -7.073 -3.753 1.00 0.00 C ATOM 1005 CE1 PHE A 154 2.479 -6.963 -6.258 1.00 0.00 C ATOM 1006 CE2 PHE A 154 2.704 -7.077 -3.880 1.00 0.00 C ATOM 1007 CZ PHE A 154 3.280 -7.023 -5.135 1.00 0.00 C ATOM 0 H PHE A 154 -3.659 -8.212 -4.580 1.00 0.00 H new ATOM 0 HA PHE A 154 -1.167 -8.704 -6.036 1.00 0.00 H new ATOM 0 HB2 PHE A 154 -1.395 -6.209 -5.346 1.00 0.00 H new ATOM 0 HB3 PHE A 154 -1.240 -6.779 -3.696 1.00 0.00 H new ATOM 0 HD1 PHE A 154 0.481 -6.913 -7.006 1.00 0.00 H new ATOM 0 HD2 PHE A 154 0.883 -7.117 -2.770 1.00 0.00 H new ATOM 0 HE1 PHE A 154 2.927 -6.919 -7.240 1.00 0.00 H new ATOM 0 HE2 PHE A 154 3.328 -7.122 -3.000 1.00 0.00 H new ATOM 0 HZ PHE A 154 4.355 -7.028 -5.237 1.00 0.00 H new ATOM 1017 N ARG A 155 -0.839 -10.496 -4.376 1.00 0.00 N ATOM 1018 CA ARG A 155 -0.589 -11.563 -3.414 1.00 0.00 C ATOM 1019 C ARG A 155 -1.884 -11.994 -2.731 1.00 0.00 C ATOM 1020 O ARG A 155 -1.912 -12.230 -1.524 1.00 0.00 O ATOM 1021 CB ARG A 155 0.426 -11.105 -2.365 1.00 0.00 C ATOM 1022 CG ARG A 155 1.684 -10.494 -2.960 1.00 0.00 C ATOM 1023 CD ARG A 155 2.726 -11.557 -3.270 1.00 0.00 C ATOM 1024 NE ARG A 155 3.181 -12.245 -2.065 1.00 0.00 N ATOM 1025 CZ ARG A 155 3.960 -13.321 -2.083 1.00 0.00 C ATOM 1026 NH1 ARG A 155 4.369 -13.828 -3.238 1.00 0.00 N ATOM 1027 NH2 ARG A 155 4.332 -13.892 -0.944 1.00 0.00 N ATOM 0 H ARG A 155 -0.519 -10.698 -5.323 1.00 0.00 H new ATOM 0 HA ARG A 155 -0.182 -12.418 -3.955 1.00 0.00 H new ATOM 0 HB2 ARG A 155 -0.047 -10.374 -1.709 1.00 0.00 H new ATOM 0 HB3 ARG A 155 0.704 -11.957 -1.745 1.00 0.00 H new ATOM 0 HG2 ARG A 155 1.431 -9.954 -3.872 1.00 0.00 H new ATOM 0 HG3 ARG A 155 2.101 -9.766 -2.264 1.00 0.00 H new ATOM 0 HD2 ARG A 155 2.307 -12.284 -3.966 1.00 0.00 H new ATOM 0 HD3 ARG A 155 3.579 -11.095 -3.767 1.00 0.00 H new ATOM 0 HE ARG A 155 2.885 -11.879 -1.160 1.00 0.00 H new ATOM 0 HH11 ARG A 155 4.086 -13.392 -4.115 1.00 0.00 H new ATOM 0 HH12 ARG A 155 4.967 -14.654 -3.249 1.00 0.00 H new ATOM 0 HH21 ARG A 155 4.020 -13.505 -0.054 1.00 0.00 H new ATOM 0 HH22 ARG A 155 4.930 -14.718 -0.959 1.00 0.00 H new ATOM 1041 N GLY A 156 -2.954 -12.095 -3.514 1.00 0.00 N ATOM 1042 CA GLY A 156 -4.237 -12.497 -2.967 1.00 0.00 C ATOM 1043 C GLY A 156 -4.713 -11.571 -1.865 1.00 0.00 C ATOM 1044 O GLY A 156 -5.649 -11.895 -1.133 1.00 0.00 O ATOM 0 H GLY A 156 -2.955 -11.906 -4.516 1.00 0.00 H new ATOM 0 HA2 GLY A 156 -4.979 -12.518 -3.766 1.00 0.00 H new ATOM 0 HA3 GLY A 156 -4.160 -13.512 -2.577 1.00 0.00 H new ATOM 1048 N LYS A 157 -4.067 -10.417 -1.743 1.00 0.00 N ATOM 1049 CA LYS A 157 -4.428 -9.441 -0.722 1.00 0.00 C ATOM 1050 C LYS A 157 -5.102 -8.224 -1.346 1.00 0.00 C ATOM 1051 O LYS A 157 -5.126 -8.075 -2.568 1.00 0.00 O ATOM 1052 CB LYS A 157 -3.186 -9.005 0.058 1.00 0.00 C ATOM 1053 CG LYS A 157 -2.603 -10.099 0.936 1.00 0.00 C ATOM 1054 CD LYS A 157 -3.570 -10.506 2.036 1.00 0.00 C ATOM 1055 CE LYS A 157 -2.863 -11.268 3.146 1.00 0.00 C ATOM 1056 NZ LYS A 157 -2.167 -10.351 4.091 1.00 0.00 N ATOM 0 H LYS A 157 -3.289 -10.134 -2.340 1.00 0.00 H new ATOM 0 HA LYS A 157 -5.133 -9.913 -0.037 1.00 0.00 H new ATOM 0 HB2 LYS A 157 -2.424 -8.671 -0.646 1.00 0.00 H new ATOM 0 HB3 LYS A 157 -3.441 -8.148 0.681 1.00 0.00 H new ATOM 0 HG2 LYS A 157 -2.360 -10.968 0.324 1.00 0.00 H new ATOM 0 HG3 LYS A 157 -1.670 -9.752 1.380 1.00 0.00 H new ATOM 0 HD2 LYS A 157 -4.047 -9.617 2.450 1.00 0.00 H new ATOM 0 HD3 LYS A 157 -4.362 -11.126 1.615 1.00 0.00 H new ATOM 0 HE2 LYS A 157 -3.589 -11.870 3.692 1.00 0.00 H new ATOM 0 HE3 LYS A 157 -2.140 -11.958 2.710 1.00 0.00 H new ATOM 0 HZ1 LYS A 157 -1.697 -10.908 4.833 1.00 0.00 H new ATOM 0 HZ2 LYS A 157 -1.457 -9.794 3.574 1.00 0.00 H new ATOM 0 HZ3 LYS A 157 -2.860 -9.710 4.526 1.00 0.00 H new ATOM 1070 N ASP A 158 -5.647 -7.356 -0.501 1.00 0.00 N ATOM 1071 CA ASP A 158 -6.319 -6.150 -0.970 1.00 0.00 C ATOM 1072 C ASP A 158 -5.555 -4.901 -0.543 1.00 0.00 C ATOM 1073 O ASP A 158 -5.947 -4.213 0.401 1.00 0.00 O ATOM 1074 CB ASP A 158 -7.750 -6.097 -0.434 1.00 0.00 C ATOM 1075 CG ASP A 158 -8.681 -7.036 -1.174 1.00 0.00 C ATOM 1076 OD1 ASP A 158 -9.253 -6.618 -2.203 1.00 0.00 O ATOM 1077 OD2 ASP A 158 -8.838 -8.191 -0.726 1.00 0.00 O ATOM 0 H ASP A 158 -5.637 -7.465 0.513 1.00 0.00 H new ATOM 0 HA ASP A 158 -6.349 -6.180 -2.059 1.00 0.00 H new ATOM 0 HB2 ASP A 158 -7.748 -6.353 0.626 1.00 0.00 H new ATOM 0 HB3 ASP A 158 -8.127 -5.078 -0.515 1.00 0.00 H new ATOM 1082 N LEU A 159 -4.463 -4.613 -1.242 1.00 0.00 N ATOM 1083 CA LEU A 159 -3.643 -3.446 -0.934 1.00 0.00 C ATOM 1084 C LEU A 159 -4.513 -2.216 -0.696 1.00 0.00 C ATOM 1085 O LEU A 159 -5.244 -1.780 -1.586 1.00 0.00 O ATOM 1086 CB LEU A 159 -2.658 -3.176 -2.073 1.00 0.00 C ATOM 1087 CG LEU A 159 -1.490 -4.155 -2.197 1.00 0.00 C ATOM 1088 CD1 LEU A 159 -0.743 -3.932 -3.503 1.00 0.00 C ATOM 1089 CD2 LEU A 159 -0.548 -4.014 -1.011 1.00 0.00 C ATOM 0 H LEU A 159 -4.125 -5.171 -2.026 1.00 0.00 H new ATOM 0 HA LEU A 159 -3.085 -3.655 -0.021 1.00 0.00 H new ATOM 0 HB2 LEU A 159 -3.210 -3.180 -3.013 1.00 0.00 H new ATOM 0 HB3 LEU A 159 -2.253 -2.172 -1.946 1.00 0.00 H new ATOM 0 HG LEU A 159 -1.890 -5.169 -2.199 1.00 0.00 H new ATOM 0 HD11 LEU A 159 0.085 -4.638 -3.574 1.00 0.00 H new ATOM 0 HD12 LEU A 159 -1.423 -4.085 -4.341 1.00 0.00 H new ATOM 0 HD13 LEU A 159 -0.355 -2.914 -3.531 1.00 0.00 H new ATOM 0 HD21 LEU A 159 0.277 -4.718 -1.116 1.00 0.00 H new ATOM 0 HD22 LEU A 159 -0.156 -2.998 -0.977 1.00 0.00 H new ATOM 0 HD23 LEU A 159 -1.090 -4.225 -0.089 1.00 0.00 H new ATOM 1101 N ILE A 160 -4.427 -1.661 0.508 1.00 0.00 N ATOM 1102 CA ILE A 160 -5.204 -0.480 0.861 1.00 0.00 C ATOM 1103 C ILE A 160 -4.397 0.795 0.639 1.00 0.00 C ATOM 1104 O ILE A 160 -3.512 1.128 1.427 1.00 0.00 O ATOM 1105 CB ILE A 160 -5.670 -0.530 2.328 1.00 0.00 C ATOM 1106 CG1 ILE A 160 -6.618 -1.711 2.545 1.00 0.00 C ATOM 1107 CG2 ILE A 160 -6.346 0.777 2.714 1.00 0.00 C ATOM 1108 CD1 ILE A 160 -6.835 -2.052 4.003 1.00 0.00 C ATOM 0 H ILE A 160 -3.827 -2.010 1.255 1.00 0.00 H new ATOM 0 HA ILE A 160 -6.079 -0.472 0.211 1.00 0.00 H new ATOM 0 HB ILE A 160 -4.797 -0.667 2.966 1.00 0.00 H new ATOM 0 HG12 ILE A 160 -7.580 -1.483 2.086 1.00 0.00 H new ATOM 0 HG13 ILE A 160 -6.219 -2.586 2.031 1.00 0.00 H new ATOM 0 HG21 ILE A 160 -6.670 0.726 3.754 1.00 0.00 H new ATOM 0 HG22 ILE A 160 -5.642 1.600 2.593 1.00 0.00 H new ATOM 0 HG23 ILE A 160 -7.211 0.942 2.072 1.00 0.00 H new ATOM 0 HD11 ILE A 160 -7.518 -2.898 4.081 1.00 0.00 H new ATOM 0 HD12 ILE A 160 -5.881 -2.312 4.462 1.00 0.00 H new ATOM 0 HD13 ILE A 160 -7.263 -1.192 4.518 1.00 0.00 H new ATOM 1120 N VAL A 161 -4.711 1.507 -0.439 1.00 0.00 N ATOM 1121 CA VAL A 161 -4.018 2.748 -0.764 1.00 0.00 C ATOM 1122 C VAL A 161 -4.802 3.960 -0.274 1.00 0.00 C ATOM 1123 O VAL A 161 -5.987 4.106 -0.572 1.00 0.00 O ATOM 1124 CB VAL A 161 -3.785 2.880 -2.281 1.00 0.00 C ATOM 1125 CG1 VAL A 161 -2.879 4.064 -2.581 1.00 0.00 C ATOM 1126 CG2 VAL A 161 -3.199 1.594 -2.843 1.00 0.00 C ATOM 0 H VAL A 161 -5.441 1.245 -1.102 1.00 0.00 H new ATOM 0 HA VAL A 161 -3.054 2.714 -0.257 1.00 0.00 H new ATOM 0 HB VAL A 161 -4.746 3.057 -2.765 1.00 0.00 H new ATOM 0 HG11 VAL A 161 -2.726 4.141 -3.657 1.00 0.00 H new ATOM 0 HG12 VAL A 161 -3.343 4.979 -2.214 1.00 0.00 H new ATOM 0 HG13 VAL A 161 -1.918 3.921 -2.087 1.00 0.00 H new ATOM 0 HG21 VAL A 161 -3.041 1.705 -3.916 1.00 0.00 H new ATOM 0 HG22 VAL A 161 -2.247 1.384 -2.355 1.00 0.00 H new ATOM 0 HG23 VAL A 161 -3.889 0.770 -2.661 1.00 0.00 H new ATOM 1136 N GLN A 162 -4.131 4.826 0.479 1.00 0.00 N ATOM 1137 CA GLN A 162 -4.766 6.027 1.010 1.00 0.00 C ATOM 1138 C GLN A 162 -3.894 7.255 0.773 1.00 0.00 C ATOM 1139 O GLN A 162 -2.773 7.146 0.272 1.00 0.00 O ATOM 1140 CB GLN A 162 -5.041 5.863 2.506 1.00 0.00 C ATOM 1141 CG GLN A 162 -6.290 5.052 2.810 1.00 0.00 C ATOM 1142 CD GLN A 162 -6.270 4.447 4.200 1.00 0.00 C ATOM 1143 OE1 GLN A 162 -5.285 3.594 4.460 1.00 0.00 O flip ATOM 1144 NE2 GLN A 162 -7.129 4.742 5.031 1.00 0.00 N flip ATOM 0 H GLN A 162 -3.149 4.719 0.735 1.00 0.00 H new ATOM 0 HA GLN A 162 -5.711 6.170 0.486 1.00 0.00 H new ATOM 0 HB2 GLN A 162 -4.182 5.381 2.974 1.00 0.00 H new ATOM 0 HB3 GLN A 162 -5.139 6.849 2.959 1.00 0.00 H new ATOM 0 HG2 GLN A 162 -7.167 5.691 2.709 1.00 0.00 H new ATOM 0 HG3 GLN A 162 -6.390 4.255 2.073 1.00 0.00 H new ATOM 0 HE21 GLN A 162 -7.868 5.402 4.788 1.00 0.00 H new ATOM 0 HE22 GLN A 162 -7.102 4.326 5.962 1.00 0.00 H new ATOM 1153 N LEU A 163 -4.414 8.422 1.134 1.00 0.00 N ATOM 1154 CA LEU A 163 -3.682 9.672 0.960 1.00 0.00 C ATOM 1155 C LEU A 163 -3.077 10.138 2.281 1.00 0.00 C ATOM 1156 O LEU A 163 -3.736 10.108 3.320 1.00 0.00 O ATOM 1157 CB LEU A 163 -4.607 10.754 0.400 1.00 0.00 C ATOM 1158 CG LEU A 163 -4.017 12.162 0.312 1.00 0.00 C ATOM 1159 CD1 LEU A 163 -3.317 12.365 -1.022 1.00 0.00 C ATOM 1160 CD2 LEU A 163 -5.104 13.209 0.510 1.00 0.00 C ATOM 0 H LEU A 163 -5.340 8.529 1.549 1.00 0.00 H new ATOM 0 HA LEU A 163 -2.871 9.494 0.253 1.00 0.00 H new ATOM 0 HB2 LEU A 163 -4.924 10.452 -0.598 1.00 0.00 H new ATOM 0 HB3 LEU A 163 -5.502 10.795 1.020 1.00 0.00 H new ATOM 0 HG LEU A 163 -3.280 12.277 1.107 1.00 0.00 H new ATOM 0 HD11 LEU A 163 -2.904 13.373 -1.066 1.00 0.00 H new ATOM 0 HD12 LEU A 163 -2.512 11.637 -1.125 1.00 0.00 H new ATOM 0 HD13 LEU A 163 -4.033 12.231 -1.833 1.00 0.00 H new ATOM 0 HD21 LEU A 163 -4.666 14.205 0.444 1.00 0.00 H new ATOM 0 HD22 LEU A 163 -5.864 13.095 -0.263 1.00 0.00 H new ATOM 0 HD23 LEU A 163 -5.561 13.078 1.491 1.00 0.00 H new