USER MOD reduce.3.24.130724 H: found=0, std=0, add=661, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 660 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 62 HIS : no HE2:sc= -0.337 K(o=-0.33,f=-2.7) USER MOD Set 1.2: A 96 GLN : amide:sc= 0.00289 K(o=-0.33,f=-3.5) USER MOD Single : A 58 SER OG : rot 180:sc= -0.0579 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 ASN : amide:sc= 0.713 K(o=0.71,f=0) USER MOD Single : A 90 MET CE :methyl 164:sc= 0 (180deg=-0.152) USER MOD Single : A 92 LYS NZ :NH3+ 149:sc= 1.27 (180deg=0.632) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 ASN : amide:sc= 0.0807 X(o=0.081,f=0) USER MOD Single : A 101 MET CE :methyl 170:sc= -4.83! (180deg=-5.27!) USER MOD Single : A 102 ASN :FLIP amide:sc= -0.942 F(o=-2.9,f=-0.94) USER MOD Single : A 103 THR OG1 : rot 180:sc= 0.709 USER MOD Single : A 108 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 109 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 MET CE :methyl 179:sc= -1.49 (180deg=-1.52) USER MOD Single : A 112 ASN : amide:sc= 0.2 X(o=0.2,f=0) USER MOD Single : A 113 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 TYR OH : rot 180:sc= -0.174 USER MOD Single : A 115 THR OG1 : rot 80:sc= 0.874 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 118 THR OG1 : rot 180:sc=0.000271 USER MOD Single : A 124 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 GLN : amide:sc= 0.283 K(o=0.28,f=-4.1!) USER MOD Single : A 131 SER OG : rot 170:sc= 0.536 USER MOD Single : A 132 ASN : amide:sc= 0 X(o=0,f=-0.07) USER MOD Single : A 133 HIS : no HD1:sc= -0.136 X(o=-0.14,f=0.024) USER MOD Single : A 134 LYS NZ :NH3+ -145:sc= 0 (180deg=-0.0186) USER MOD Single : A 137 LYS NZ :NH3+ 158:sc= 1.19 (180deg=0.692) USER MOD ----------------------------------------------------------------- ATOM 113 N SER A 58 -7.171 10.062 -1.649 1.00 0.00 N ATOM 114 CA SER A 58 -6.974 10.829 -2.894 1.00 0.00 C ATOM 115 C SER A 58 -6.006 10.177 -3.894 1.00 0.00 C ATOM 116 O SER A 58 -6.447 9.651 -4.914 1.00 0.00 O ATOM 117 CB SER A 58 -6.540 12.268 -2.560 1.00 0.00 C ATOM 118 OG SER A 58 -5.359 12.280 -1.773 1.00 0.00 O ATOM 0 HA SER A 58 -7.938 10.841 -3.402 1.00 0.00 H new ATOM 0 HB2 SER A 58 -6.370 12.823 -3.483 1.00 0.00 H new ATOM 0 HB3 SER A 58 -7.342 12.777 -2.025 1.00 0.00 H new ATOM 0 HG SER A 58 -5.106 13.206 -1.577 1.00 0.00 H new ATOM 124 N ARG A 59 -4.692 10.246 -3.629 1.00 0.00 N ATOM 125 CA ARG A 59 -3.608 10.035 -4.611 1.00 0.00 C ATOM 126 C ARG A 59 -2.570 8.966 -4.258 1.00 0.00 C ATOM 127 O ARG A 59 -1.801 8.599 -5.145 1.00 0.00 O ATOM 128 CB ARG A 59 -2.908 11.379 -4.861 1.00 0.00 C ATOM 129 CG ARG A 59 -3.560 12.193 -5.995 1.00 0.00 C ATOM 130 CD ARG A 59 -2.990 13.618 -6.047 1.00 0.00 C ATOM 131 NE ARG A 59 -1.509 13.621 -6.016 1.00 0.00 N ATOM 132 CZ ARG A 59 -0.715 14.295 -5.202 1.00 0.00 C ATOM 133 NH1 ARG A 59 -1.127 15.266 -4.438 1.00 0.00 N ATOM 134 NH2 ARG A 59 0.543 14.004 -5.084 1.00 0.00 N ATOM 0 H ARG A 59 -4.339 10.457 -2.695 1.00 0.00 H new ATOM 0 HA ARG A 59 -4.096 9.645 -5.504 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -2.923 11.967 -3.943 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -1.861 11.198 -5.106 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -3.390 11.695 -6.949 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -4.639 12.234 -5.844 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -3.335 14.114 -6.954 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -3.372 14.193 -5.204 1.00 0.00 H new ATOM 0 HE ARG A 59 -1.045 13.031 -6.707 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -2.109 15.542 -4.448 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -0.468 15.751 -3.829 1.00 0.00 H new ATOM 0 HH21 ARG A 59 0.942 13.238 -5.627 1.00 0.00 H new ATOM 0 HH22 ARG A 59 1.133 14.541 -4.448 1.00 0.00 H new ATOM 148 N VAL A 60 -2.553 8.434 -3.030 1.00 0.00 N ATOM 149 CA VAL A 60 -1.759 7.238 -2.670 1.00 0.00 C ATOM 150 C VAL A 60 -2.645 6.032 -2.350 1.00 0.00 C ATOM 151 O VAL A 60 -3.661 6.152 -1.668 1.00 0.00 O ATOM 152 CB VAL A 60 -0.603 7.508 -1.697 1.00 0.00 C ATOM 153 CG1 VAL A 60 -0.818 8.230 -0.375 1.00 0.00 C ATOM 154 CG2 VAL A 60 0.190 6.239 -1.428 1.00 0.00 C ATOM 0 H VAL A 60 -3.089 8.817 -2.251 1.00 0.00 H new ATOM 0 HA VAL A 60 -1.216 6.944 -3.569 1.00 0.00 H new ATOM 0 HB VAL A 60 -0.077 8.265 -2.278 1.00 0.00 H new ATOM 0 HG11 VAL A 60 0.132 8.312 0.153 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -1.215 9.227 -0.565 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -1.525 7.668 0.236 1.00 0.00 H new ATOM 0 HG21 VAL A 60 1.003 6.458 -0.736 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -0.466 5.486 -0.991 1.00 0.00 H new ATOM 0 HG23 VAL A 60 0.602 5.862 -2.364 1.00 0.00 H new ATOM 164 N ILE A 61 -2.263 4.868 -2.875 1.00 0.00 N ATOM 165 CA ILE A 61 -2.837 3.535 -2.621 1.00 0.00 C ATOM 166 C ILE A 61 -1.769 2.689 -1.928 1.00 0.00 C ATOM 167 O ILE A 61 -0.583 2.884 -2.179 1.00 0.00 O ATOM 168 CB ILE A 61 -3.273 2.911 -3.966 1.00 0.00 C ATOM 169 CG1 ILE A 61 -4.489 3.669 -4.531 1.00 0.00 C ATOM 170 CG2 ILE A 61 -3.582 1.400 -3.930 1.00 0.00 C ATOM 171 CD1 ILE A 61 -4.483 3.607 -6.054 1.00 0.00 C ATOM 0 H ILE A 61 -1.489 4.822 -3.538 1.00 0.00 H new ATOM 0 HA ILE A 61 -3.716 3.592 -1.979 1.00 0.00 H new ATOM 0 HB ILE A 61 -2.403 3.014 -4.614 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -5.411 3.233 -4.145 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -4.465 4.708 -4.201 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -3.878 1.065 -4.924 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -2.693 0.854 -3.613 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -4.394 1.211 -3.227 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -5.347 4.146 -6.443 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -3.569 4.064 -6.433 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -4.529 2.567 -6.376 1.00 0.00 H new ATOM 183 N HIS A 62 -2.175 1.735 -1.096 1.00 0.00 N ATOM 184 CA HIS A 62 -1.290 0.826 -0.379 1.00 0.00 C ATOM 185 C HIS A 62 -1.554 -0.631 -0.794 1.00 0.00 C ATOM 186 O HIS A 62 -2.697 -1.098 -0.806 1.00 0.00 O ATOM 187 CB HIS A 62 -1.399 1.113 1.128 1.00 0.00 C ATOM 188 CG HIS A 62 -0.957 0.013 2.069 1.00 0.00 C ATOM 189 ND1 HIS A 62 -1.526 -1.237 2.202 1.00 0.00 N ATOM 190 CD2 HIS A 62 -0.054 0.158 3.084 1.00 0.00 C ATOM 191 CE1 HIS A 62 -0.964 -1.832 3.270 1.00 0.00 C ATOM 192 NE2 HIS A 62 -0.034 -1.035 3.825 1.00 0.00 N ATOM 0 H HIS A 62 -3.161 1.569 -0.896 1.00 0.00 H new ATOM 0 HA HIS A 62 -0.247 0.994 -0.647 1.00 0.00 H new ATOM 0 HB2 HIS A 62 -0.810 2.004 1.347 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -2.438 1.355 1.353 1.00 0.00 H new ATOM 0 HD1 HIS A 62 -2.244 -1.638 1.599 1.00 0.00 H new ATOM 0 HD2 HIS A 62 0.541 1.037 3.282 1.00 0.00 H new ATOM 0 HE1 HIS A 62 -1.224 -2.816 3.632 1.00 0.00 H new ATOM 200 N ILE A 63 -0.471 -1.336 -1.132 1.00 0.00 N ATOM 201 CA ILE A 63 -0.426 -2.700 -1.683 1.00 0.00 C ATOM 202 C ILE A 63 0.309 -3.602 -0.684 1.00 0.00 C ATOM 203 O ILE A 63 1.433 -3.278 -0.321 1.00 0.00 O ATOM 204 CB ILE A 63 0.330 -2.762 -3.035 1.00 0.00 C ATOM 205 CG1 ILE A 63 0.139 -1.516 -3.936 1.00 0.00 C ATOM 206 CG2 ILE A 63 -0.048 -4.069 -3.760 1.00 0.00 C ATOM 207 CD1 ILE A 63 0.957 -1.548 -5.237 1.00 0.00 C ATOM 0 H ILE A 63 0.464 -0.945 -1.022 1.00 0.00 H new ATOM 0 HA ILE A 63 -1.452 -3.027 -1.851 1.00 0.00 H new ATOM 0 HB ILE A 63 1.397 -2.757 -2.811 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -0.918 -1.421 -4.187 1.00 0.00 H new ATOM 0 HG13 ILE A 63 0.413 -0.626 -3.369 1.00 0.00 H new ATOM 0 HG21 ILE A 63 0.479 -4.122 -4.713 1.00 0.00 H new ATOM 0 HG22 ILE A 63 0.233 -4.922 -3.142 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -1.123 -4.088 -3.938 1.00 0.00 H new ATOM 0 HD11 ILE A 63 0.766 -0.640 -5.809 1.00 0.00 H new ATOM 0 HD12 ILE A 63 2.019 -1.610 -4.998 1.00 0.00 H new ATOM 0 HD13 ILE A 63 0.667 -2.417 -5.828 1.00 0.00 H new ATOM 219 N ARG A 64 -0.280 -4.717 -0.247 1.00 0.00 N ATOM 220 CA ARG A 64 0.288 -5.675 0.734 1.00 0.00 C ATOM 221 C ARG A 64 0.624 -7.038 0.116 1.00 0.00 C ATOM 222 O ARG A 64 0.345 -7.287 -1.059 1.00 0.00 O ATOM 223 CB ARG A 64 -0.565 -5.778 2.034 1.00 0.00 C ATOM 224 CG ARG A 64 -1.997 -5.247 1.917 1.00 0.00 C ATOM 225 CD ARG A 64 -2.874 -5.467 3.148 1.00 0.00 C ATOM 226 NE ARG A 64 -3.912 -4.420 3.206 1.00 0.00 N ATOM 227 CZ ARG A 64 -5.103 -4.406 2.637 1.00 0.00 C ATOM 228 NH1 ARG A 64 -5.643 -5.453 2.082 1.00 0.00 N ATOM 229 NH2 ARG A 64 -5.797 -3.310 2.637 1.00 0.00 N ATOM 0 H ARG A 64 -1.204 -4.999 -0.574 1.00 0.00 H new ATOM 0 HA ARG A 64 1.246 -5.258 1.044 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -0.606 -6.823 2.341 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -0.056 -5.232 2.828 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -1.955 -4.178 1.707 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -2.475 -5.722 1.060 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -3.338 -6.452 3.106 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -2.265 -5.440 4.051 1.00 0.00 H new ATOM 0 HE ARG A 64 -3.678 -3.596 3.760 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -5.141 -6.341 2.073 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -6.567 -5.385 1.656 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -5.421 -2.469 3.074 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -6.718 -3.290 2.200 1.00 0.00 H new ATOM 243 N LYS A 65 1.219 -7.915 0.935 1.00 0.00 N ATOM 244 CA LYS A 65 1.636 -9.302 0.619 1.00 0.00 C ATOM 245 C LYS A 65 2.645 -9.421 -0.529 1.00 0.00 C ATOM 246 O LYS A 65 2.688 -10.446 -1.211 1.00 0.00 O ATOM 247 CB LYS A 65 0.396 -10.197 0.411 1.00 0.00 C ATOM 248 CG LYS A 65 -0.761 -9.899 1.376 1.00 0.00 C ATOM 249 CD LYS A 65 -0.424 -10.052 2.862 1.00 0.00 C ATOM 250 CE LYS A 65 -0.581 -11.523 3.259 1.00 0.00 C ATOM 251 NZ LYS A 65 0.277 -11.874 4.423 1.00 0.00 N ATOM 0 H LYS A 65 1.439 -7.666 1.899 1.00 0.00 H new ATOM 0 HA LYS A 65 2.188 -9.662 1.487 1.00 0.00 H new ATOM 0 HB2 LYS A 65 0.042 -10.076 -0.613 1.00 0.00 H new ATOM 0 HB3 LYS A 65 0.691 -11.240 0.525 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -1.106 -8.880 1.201 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -1.592 -10.563 1.138 1.00 0.00 H new ATOM 0 HD2 LYS A 65 0.595 -9.717 3.053 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -1.083 -9.427 3.464 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -1.624 -11.725 3.502 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -0.322 -12.158 2.412 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 0.144 -12.877 4.662 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 1.275 -11.705 4.182 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 0.013 -11.285 5.239 1.00 0.00 H new ATOM 265 N LEU A 66 3.457 -8.385 -0.742 1.00 0.00 N ATOM 266 CA LEU A 66 4.531 -8.352 -1.744 1.00 0.00 C ATOM 267 C LEU A 66 5.526 -9.535 -1.582 1.00 0.00 C ATOM 268 O LEU A 66 5.675 -10.058 -0.475 1.00 0.00 O ATOM 269 CB LEU A 66 5.241 -6.975 -1.715 1.00 0.00 C ATOM 270 CG LEU A 66 4.750 -6.009 -2.802 1.00 0.00 C ATOM 271 CD1 LEU A 66 3.281 -5.647 -2.607 1.00 0.00 C ATOM 272 CD2 LEU A 66 5.576 -4.730 -2.728 1.00 0.00 C ATOM 0 H LEU A 66 3.386 -7.519 -0.208 1.00 0.00 H new ATOM 0 HA LEU A 66 4.082 -8.481 -2.729 1.00 0.00 H new ATOM 0 HB2 LEU A 66 5.088 -6.517 -0.738 1.00 0.00 H new ATOM 0 HB3 LEU A 66 6.314 -7.126 -1.832 1.00 0.00 H new ATOM 0 HG LEU A 66 4.861 -6.498 -3.770 1.00 0.00 H new ATOM 0 HD11 LEU A 66 2.968 -4.962 -3.394 1.00 0.00 H new ATOM 0 HD12 LEU A 66 2.674 -6.552 -2.651 1.00 0.00 H new ATOM 0 HD13 LEU A 66 3.150 -5.169 -1.636 1.00 0.00 H new ATOM 0 HD21 LEU A 66 5.238 -4.034 -3.495 1.00 0.00 H new ATOM 0 HD22 LEU A 66 5.454 -4.274 -1.745 1.00 0.00 H new ATOM 0 HD23 LEU A 66 6.628 -4.966 -2.890 1.00 0.00 H new ATOM 284 N PRO A 67 6.238 -9.937 -2.658 1.00 0.00 N ATOM 285 CA PRO A 67 7.187 -11.061 -2.693 1.00 0.00 C ATOM 286 C PRO A 67 8.170 -11.123 -1.513 1.00 0.00 C ATOM 287 O PRO A 67 8.124 -12.033 -0.684 1.00 0.00 O ATOM 288 CB PRO A 67 7.919 -10.910 -4.039 1.00 0.00 C ATOM 289 CG PRO A 67 6.848 -10.317 -4.941 1.00 0.00 C ATOM 290 CD PRO A 67 6.097 -9.376 -3.994 1.00 0.00 C ATOM 0 HA PRO A 67 6.648 -12.004 -2.598 1.00 0.00 H new ATOM 0 HB2 PRO A 67 8.786 -10.255 -3.956 1.00 0.00 H new ATOM 0 HB3 PRO A 67 8.278 -11.868 -4.414 1.00 0.00 H new ATOM 0 HG2 PRO A 67 7.281 -9.781 -5.786 1.00 0.00 H new ATOM 0 HG3 PRO A 67 6.193 -11.085 -5.352 1.00 0.00 H new ATOM 0 HD2 PRO A 67 6.512 -8.369 -4.038 1.00 0.00 H new ATOM 0 HD3 PRO A 67 5.046 -9.300 -4.274 1.00 0.00 H new ATOM 298 N ILE A 68 9.054 -10.129 -1.480 1.00 0.00 N ATOM 299 CA ILE A 68 10.084 -9.788 -0.487 1.00 0.00 C ATOM 300 C ILE A 68 10.326 -8.277 -0.570 1.00 0.00 C ATOM 301 O ILE A 68 10.235 -7.564 0.429 1.00 0.00 O ATOM 302 CB ILE A 68 11.409 -10.584 -0.682 1.00 0.00 C ATOM 303 CG1 ILE A 68 11.913 -10.694 -2.145 1.00 0.00 C ATOM 304 CG2 ILE A 68 11.246 -11.989 -0.089 1.00 0.00 C ATOM 305 CD1 ILE A 68 13.272 -11.388 -2.293 1.00 0.00 C ATOM 0 H ILE A 68 9.071 -9.454 -2.245 1.00 0.00 H new ATOM 0 HA ILE A 68 9.727 -10.070 0.503 1.00 0.00 H new ATOM 0 HB ILE A 68 12.173 -10.008 -0.160 1.00 0.00 H new ATOM 0 HG12 ILE A 68 11.174 -11.239 -2.732 1.00 0.00 H new ATOM 0 HG13 ILE A 68 11.981 -9.693 -2.570 1.00 0.00 H new ATOM 0 HG21 ILE A 68 12.171 -12.550 -0.223 1.00 0.00 H new ATOM 0 HG22 ILE A 68 11.020 -11.911 0.974 1.00 0.00 H new ATOM 0 HG23 ILE A 68 10.431 -12.506 -0.596 1.00 0.00 H new ATOM 0 HD11 ILE A 68 13.550 -11.423 -3.346 1.00 0.00 H new ATOM 0 HD12 ILE A 68 14.027 -10.832 -1.737 1.00 0.00 H new ATOM 0 HD13 ILE A 68 13.207 -12.403 -1.901 1.00 0.00 H new ATOM 317 N ASP A 69 10.552 -7.788 -1.793 1.00 0.00 N ATOM 318 CA ASP A 69 10.775 -6.369 -2.114 1.00 0.00 C ATOM 319 C ASP A 69 10.333 -5.965 -3.541 1.00 0.00 C ATOM 320 O ASP A 69 10.355 -4.780 -3.868 1.00 0.00 O ATOM 321 CB ASP A 69 12.267 -6.056 -1.894 1.00 0.00 C ATOM 322 CG ASP A 69 12.560 -4.552 -1.755 1.00 0.00 C ATOM 323 OD1 ASP A 69 11.918 -3.889 -0.905 1.00 0.00 O ATOM 324 OD2 ASP A 69 13.502 -4.046 -2.412 1.00 0.00 O ATOM 0 H ASP A 69 10.587 -8.387 -2.618 1.00 0.00 H new ATOM 0 HA ASP A 69 10.146 -5.777 -1.449 1.00 0.00 H new ATOM 0 HB2 ASP A 69 12.610 -6.570 -0.996 1.00 0.00 H new ATOM 0 HB3 ASP A 69 12.842 -6.455 -2.730 1.00 0.00 H new ATOM 329 N VAL A 70 9.915 -6.931 -4.384 1.00 0.00 N ATOM 330 CA VAL A 70 9.558 -6.780 -5.817 1.00 0.00 C ATOM 331 C VAL A 70 10.570 -5.898 -6.577 1.00 0.00 C ATOM 332 O VAL A 70 11.770 -5.956 -6.295 1.00 0.00 O ATOM 333 CB VAL A 70 8.043 -6.447 -5.968 1.00 0.00 C ATOM 334 CG1 VAL A 70 7.605 -4.994 -5.754 1.00 0.00 C ATOM 335 CG2 VAL A 70 7.452 -6.946 -7.290 1.00 0.00 C ATOM 0 H VAL A 70 9.810 -7.895 -4.068 1.00 0.00 H new ATOM 0 HA VAL A 70 9.663 -7.731 -6.340 1.00 0.00 H new ATOM 0 HB VAL A 70 7.637 -6.999 -5.121 1.00 0.00 H new ATOM 0 HG11 VAL A 70 6.527 -4.915 -5.892 1.00 0.00 H new ATOM 0 HG12 VAL A 70 7.866 -4.680 -4.743 1.00 0.00 H new ATOM 0 HG13 VAL A 70 8.111 -4.352 -6.475 1.00 0.00 H new ATOM 0 HG21 VAL A 70 6.395 -6.685 -7.338 1.00 0.00 H new ATOM 0 HG22 VAL A 70 7.979 -6.480 -8.123 1.00 0.00 H new ATOM 0 HG23 VAL A 70 7.561 -8.029 -7.352 1.00 0.00 H new ATOM 345 N THR A 71 10.142 -5.126 -7.574 1.00 0.00 N ATOM 346 CA THR A 71 10.901 -3.991 -8.105 1.00 0.00 C ATOM 347 C THR A 71 9.972 -2.825 -8.413 1.00 0.00 C ATOM 348 O THR A 71 8.878 -2.979 -8.965 1.00 0.00 O ATOM 349 CB THR A 71 11.779 -4.388 -9.305 1.00 0.00 C ATOM 350 OG1 THR A 71 12.386 -3.236 -9.854 1.00 0.00 O ATOM 351 CG2 THR A 71 11.033 -5.104 -10.427 1.00 0.00 C ATOM 0 H THR A 71 9.248 -5.271 -8.043 1.00 0.00 H new ATOM 0 HA THR A 71 11.596 -3.659 -7.333 1.00 0.00 H new ATOM 0 HB THR A 71 12.511 -5.090 -8.905 1.00 0.00 H new ATOM 0 HG1 THR A 71 12.945 -3.493 -10.617 1.00 0.00 H new ATOM 0 HG21 THR A 71 11.729 -5.346 -11.230 1.00 0.00 H new ATOM 0 HG22 THR A 71 10.590 -6.022 -10.041 1.00 0.00 H new ATOM 0 HG23 THR A 71 10.246 -4.456 -10.812 1.00 0.00 H new ATOM 359 N GLU A 72 10.402 -1.627 -8.025 1.00 0.00 N ATOM 360 CA GLU A 72 9.660 -0.391 -8.250 1.00 0.00 C ATOM 361 C GLU A 72 9.340 -0.144 -9.730 1.00 0.00 C ATOM 362 O GLU A 72 8.245 0.317 -10.053 1.00 0.00 O ATOM 363 CB GLU A 72 10.402 0.807 -7.636 1.00 0.00 C ATOM 364 CG GLU A 72 11.912 0.822 -7.871 1.00 0.00 C ATOM 365 CD GLU A 72 12.534 2.168 -7.458 1.00 0.00 C ATOM 366 OE1 GLU A 72 12.953 2.318 -6.285 1.00 0.00 O ATOM 367 OE2 GLU A 72 12.634 3.081 -8.315 1.00 0.00 O ATOM 0 H GLU A 72 11.288 -1.486 -7.539 1.00 0.00 H new ATOM 0 HA GLU A 72 8.700 -0.505 -7.746 1.00 0.00 H new ATOM 0 HB2 GLU A 72 9.977 1.725 -8.042 1.00 0.00 H new ATOM 0 HB3 GLU A 72 10.217 0.818 -6.562 1.00 0.00 H new ATOM 0 HG2 GLU A 72 12.377 0.016 -7.304 1.00 0.00 H new ATOM 0 HG3 GLU A 72 12.119 0.632 -8.924 1.00 0.00 H new ATOM 374 N GLY A 73 10.248 -0.536 -10.627 1.00 0.00 N ATOM 375 CA GLY A 73 10.052 -0.523 -12.077 1.00 0.00 C ATOM 376 C GLY A 73 8.812 -1.303 -12.532 1.00 0.00 C ATOM 377 O GLY A 73 8.066 -0.844 -13.396 1.00 0.00 O ATOM 0 H GLY A 73 11.168 -0.882 -10.355 1.00 0.00 H new ATOM 0 HA2 GLY A 73 9.967 0.510 -12.415 1.00 0.00 H new ATOM 0 HA3 GLY A 73 10.934 -0.944 -12.559 1.00 0.00 H new ATOM 381 N GLU A 74 8.549 -2.458 -11.918 1.00 0.00 N ATOM 382 CA GLU A 74 7.305 -3.215 -12.124 1.00 0.00 C ATOM 383 C GLU A 74 6.100 -2.462 -11.569 1.00 0.00 C ATOM 384 O GLU A 74 5.124 -2.255 -12.288 1.00 0.00 O ATOM 385 CB GLU A 74 7.396 -4.635 -11.533 1.00 0.00 C ATOM 386 CG GLU A 74 8.033 -5.576 -12.563 1.00 0.00 C ATOM 387 CD GLU A 74 8.244 -7.013 -12.041 1.00 0.00 C ATOM 388 OE1 GLU A 74 7.415 -7.515 -11.247 1.00 0.00 O ATOM 389 OE2 GLU A 74 9.232 -7.667 -12.457 1.00 0.00 O ATOM 0 H GLU A 74 9.193 -2.899 -11.261 1.00 0.00 H new ATOM 0 HA GLU A 74 7.166 -3.320 -13.200 1.00 0.00 H new ATOM 0 HB2 GLU A 74 7.990 -4.623 -10.619 1.00 0.00 H new ATOM 0 HB3 GLU A 74 6.402 -4.993 -11.263 1.00 0.00 H new ATOM 0 HG2 GLU A 74 7.401 -5.610 -13.451 1.00 0.00 H new ATOM 0 HG3 GLU A 74 8.995 -5.166 -12.871 1.00 0.00 H new ATOM 396 N VAL A 75 6.181 -2.016 -10.315 1.00 0.00 N ATOM 397 CA VAL A 75 5.073 -1.342 -9.617 1.00 0.00 C ATOM 398 C VAL A 75 4.554 -0.110 -10.377 1.00 0.00 C ATOM 399 O VAL A 75 3.352 -0.007 -10.639 1.00 0.00 O ATOM 400 CB VAL A 75 5.455 -1.053 -8.153 1.00 0.00 C ATOM 401 CG1 VAL A 75 4.345 -0.327 -7.389 1.00 0.00 C ATOM 402 CG2 VAL A 75 5.718 -2.387 -7.440 1.00 0.00 C ATOM 0 H VAL A 75 7.022 -2.111 -9.746 1.00 0.00 H new ATOM 0 HA VAL A 75 4.223 -2.023 -9.594 1.00 0.00 H new ATOM 0 HB VAL A 75 6.337 -0.413 -8.167 1.00 0.00 H new ATOM 0 HG11 VAL A 75 4.666 -0.148 -6.363 1.00 0.00 H new ATOM 0 HG12 VAL A 75 4.133 0.626 -7.874 1.00 0.00 H new ATOM 0 HG13 VAL A 75 3.444 -0.941 -7.385 1.00 0.00 H new ATOM 0 HG21 VAL A 75 5.990 -2.197 -6.402 1.00 0.00 H new ATOM 0 HG22 VAL A 75 4.818 -3.001 -7.473 1.00 0.00 H new ATOM 0 HG23 VAL A 75 6.533 -2.911 -7.938 1.00 0.00 H new ATOM 412 N ILE A 76 5.421 0.813 -10.812 1.00 0.00 N ATOM 413 CA ILE A 76 4.977 2.009 -11.550 1.00 0.00 C ATOM 414 C ILE A 76 4.735 1.777 -13.044 1.00 0.00 C ATOM 415 O ILE A 76 3.886 2.452 -13.615 1.00 0.00 O ATOM 416 CB ILE A 76 5.862 3.245 -11.307 1.00 0.00 C ATOM 417 CG1 ILE A 76 6.985 3.536 -12.322 1.00 0.00 C ATOM 418 CG2 ILE A 76 6.362 3.304 -9.858 1.00 0.00 C ATOM 419 CD1 ILE A 76 8.017 2.423 -12.416 1.00 0.00 C ATOM 0 H ILE A 76 6.429 0.758 -10.668 1.00 0.00 H new ATOM 0 HA ILE A 76 4.000 2.227 -11.119 1.00 0.00 H new ATOM 0 HB ILE A 76 5.174 4.070 -11.491 1.00 0.00 H new ATOM 0 HG12 ILE A 76 6.543 3.696 -13.306 1.00 0.00 H new ATOM 0 HG13 ILE A 76 7.486 4.463 -12.043 1.00 0.00 H new ATOM 0 HG21 ILE A 76 6.983 4.189 -9.723 1.00 0.00 H new ATOM 0 HG22 ILE A 76 5.509 3.353 -9.181 1.00 0.00 H new ATOM 0 HG23 ILE A 76 6.949 2.412 -9.639 1.00 0.00 H new ATOM 0 HD11 ILE A 76 8.778 2.693 -13.148 1.00 0.00 H new ATOM 0 HD12 ILE A 76 8.485 2.278 -11.443 1.00 0.00 H new ATOM 0 HD13 ILE A 76 7.528 1.499 -12.725 1.00 0.00 H new ATOM 431 N SER A 77 5.387 0.795 -13.678 1.00 0.00 N ATOM 432 CA SER A 77 5.014 0.357 -15.038 1.00 0.00 C ATOM 433 C SER A 77 3.591 -0.179 -15.050 1.00 0.00 C ATOM 434 O SER A 77 2.838 0.036 -16.006 1.00 0.00 O ATOM 435 CB SER A 77 5.985 -0.701 -15.570 1.00 0.00 C ATOM 436 OG SER A 77 5.675 -1.041 -16.913 1.00 0.00 O ATOM 0 H SER A 77 6.175 0.286 -13.276 1.00 0.00 H new ATOM 0 HA SER A 77 5.071 1.225 -15.695 1.00 0.00 H new ATOM 0 HB2 SER A 77 7.007 -0.325 -15.512 1.00 0.00 H new ATOM 0 HB3 SER A 77 5.937 -1.592 -14.944 1.00 0.00 H new ATOM 0 HG SER A 77 6.308 -1.717 -17.234 1.00 0.00 H new ATOM 442 N LEU A 78 3.188 -0.786 -13.933 1.00 0.00 N ATOM 443 CA LEU A 78 1.816 -1.190 -13.715 1.00 0.00 C ATOM 444 C LEU A 78 0.880 -0.028 -13.358 1.00 0.00 C ATOM 445 O LEU A 78 -0.306 -0.111 -13.676 1.00 0.00 O ATOM 446 CB LEU A 78 1.787 -2.290 -12.645 1.00 0.00 C ATOM 447 CG LEU A 78 2.034 -3.683 -13.224 1.00 0.00 C ATOM 448 CD1 LEU A 78 2.456 -4.648 -12.119 1.00 0.00 C ATOM 449 CD2 LEU A 78 0.750 -4.188 -13.883 1.00 0.00 C ATOM 0 H LEU A 78 3.812 -1.008 -13.158 1.00 0.00 H new ATOM 0 HA LEU A 78 1.430 -1.577 -14.658 1.00 0.00 H new ATOM 0 HB2 LEU A 78 2.543 -2.076 -11.889 1.00 0.00 H new ATOM 0 HB3 LEU A 78 0.820 -2.276 -12.142 1.00 0.00 H new ATOM 0 HG LEU A 78 2.832 -3.627 -13.964 1.00 0.00 H new ATOM 0 HD11 LEU A 78 2.629 -5.636 -12.545 1.00 0.00 H new ATOM 0 HD12 LEU A 78 3.373 -4.289 -11.653 1.00 0.00 H new ATOM 0 HD13 LEU A 78 1.668 -4.709 -11.369 1.00 0.00 H new ATOM 0 HD21 LEU A 78 0.920 -5.181 -14.298 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -0.046 -4.237 -13.140 1.00 0.00 H new ATOM 0 HD23 LEU A 78 0.459 -3.506 -14.682 1.00 0.00 H new ATOM 461 N GLY A 79 1.381 1.068 -12.770 1.00 0.00 N ATOM 462 CA GLY A 79 0.557 2.249 -12.487 1.00 0.00 C ATOM 463 C GLY A 79 0.429 3.238 -13.650 1.00 0.00 C ATOM 464 O GLY A 79 -0.486 4.066 -13.669 1.00 0.00 O ATOM 0 H GLY A 79 2.355 1.160 -12.481 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -0.441 1.918 -12.199 1.00 0.00 H new ATOM 0 HA3 GLY A 79 0.979 2.772 -11.629 1.00 0.00 H new ATOM 468 N LEU A 80 1.339 3.193 -14.624 1.00 0.00 N ATOM 469 CA LEU A 80 1.460 4.240 -15.635 1.00 0.00 C ATOM 470 C LEU A 80 0.337 4.366 -16.684 1.00 0.00 C ATOM 471 O LEU A 80 0.064 5.503 -17.074 1.00 0.00 O ATOM 472 CB LEU A 80 2.860 4.195 -16.272 1.00 0.00 C ATOM 473 CG LEU A 80 3.849 5.118 -15.534 1.00 0.00 C ATOM 474 CD1 LEU A 80 5.261 4.908 -16.076 1.00 0.00 C ATOM 475 CD2 LEU A 80 3.465 6.589 -15.718 1.00 0.00 C ATOM 0 H LEU A 80 2.010 2.432 -14.733 1.00 0.00 H new ATOM 0 HA LEU A 80 1.323 5.165 -15.075 1.00 0.00 H new ATOM 0 HB2 LEU A 80 3.235 3.172 -16.256 1.00 0.00 H new ATOM 0 HB3 LEU A 80 2.794 4.494 -17.318 1.00 0.00 H new ATOM 0 HG LEU A 80 3.813 4.869 -14.473 1.00 0.00 H new ATOM 0 HD11 LEU A 80 5.954 5.564 -15.549 1.00 0.00 H new ATOM 0 HD12 LEU A 80 5.558 3.870 -15.925 1.00 0.00 H new ATOM 0 HD13 LEU A 80 5.280 5.140 -17.141 1.00 0.00 H new ATOM 0 HD21 LEU A 80 4.178 7.220 -15.188 1.00 0.00 H new ATOM 0 HD22 LEU A 80 3.478 6.839 -16.779 1.00 0.00 H new ATOM 0 HD23 LEU A 80 2.465 6.757 -15.318 1.00 0.00 H new ATOM 487 N PRO A 81 -0.369 3.297 -17.115 1.00 0.00 N ATOM 488 CA PRO A 81 -1.585 3.404 -17.937 1.00 0.00 C ATOM 489 C PRO A 81 -2.747 4.201 -17.348 1.00 0.00 C ATOM 490 O PRO A 81 -3.745 4.400 -18.045 1.00 0.00 O ATOM 491 CB PRO A 81 -2.004 1.962 -18.257 1.00 0.00 C ATOM 492 CG PRO A 81 -0.707 1.170 -18.112 1.00 0.00 C ATOM 493 CD PRO A 81 0.024 1.902 -16.991 1.00 0.00 C ATOM 0 HA PRO A 81 -1.336 3.992 -18.820 1.00 0.00 H new ATOM 0 HB2 PRO A 81 -2.770 1.605 -17.569 1.00 0.00 H new ATOM 0 HB3 PRO A 81 -2.415 1.878 -19.263 1.00 0.00 H new ATOM 0 HG2 PRO A 81 -0.898 0.128 -17.855 1.00 0.00 H new ATOM 0 HG3 PRO A 81 -0.130 1.170 -19.037 1.00 0.00 H new ATOM 0 HD2 PRO A 81 -0.253 1.502 -16.016 1.00 0.00 H new ATOM 0 HD3 PRO A 81 1.104 1.789 -17.087 1.00 0.00 H new ATOM 501 N PHE A 82 -2.635 4.670 -16.100 1.00 0.00 N ATOM 502 CA PHE A 82 -3.776 5.186 -15.357 1.00 0.00 C ATOM 503 C PHE A 82 -3.748 6.706 -15.181 1.00 0.00 C ATOM 504 O PHE A 82 -4.786 7.353 -15.320 1.00 0.00 O ATOM 505 CB PHE A 82 -3.891 4.460 -14.007 1.00 0.00 C ATOM 506 CG PHE A 82 -4.047 2.964 -14.164 1.00 0.00 C ATOM 507 CD1 PHE A 82 -2.969 2.147 -14.567 1.00 0.00 C ATOM 508 CD2 PHE A 82 -5.317 2.401 -13.989 1.00 0.00 C ATOM 509 CE1 PHE A 82 -3.184 0.785 -14.840 1.00 0.00 C ATOM 510 CE2 PHE A 82 -5.536 1.049 -14.283 1.00 0.00 C ATOM 511 CZ PHE A 82 -4.471 0.242 -14.713 1.00 0.00 C ATOM 0 H PHE A 82 -1.755 4.700 -15.585 1.00 0.00 H new ATOM 0 HA PHE A 82 -4.668 4.982 -15.949 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -3.004 4.669 -13.410 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -4.745 4.855 -13.457 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -1.979 2.568 -14.666 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -6.131 3.011 -13.626 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -2.360 0.158 -15.147 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -6.525 0.627 -14.179 1.00 0.00 H new ATOM 0 HZ PHE A 82 -4.643 -0.798 -14.946 1.00 0.00 H new ATOM 521 N GLY A 83 -2.571 7.276 -14.906 1.00 0.00 N ATOM 522 CA GLY A 83 -2.368 8.715 -14.785 1.00 0.00 C ATOM 523 C GLY A 83 -0.952 9.126 -15.173 1.00 0.00 C ATOM 524 O GLY A 83 -0.538 9.051 -16.330 1.00 0.00 O ATOM 0 H GLY A 83 -1.718 6.736 -14.759 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -3.084 9.237 -15.420 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -2.567 9.024 -13.759 1.00 0.00 H new ATOM 528 N LYS A 84 -0.210 9.525 -14.143 1.00 0.00 N ATOM 529 CA LYS A 84 1.242 9.684 -14.064 1.00 0.00 C ATOM 530 C LYS A 84 1.573 9.345 -12.608 1.00 0.00 C ATOM 531 O LYS A 84 0.763 9.678 -11.744 1.00 0.00 O ATOM 532 CB LYS A 84 1.608 11.131 -14.449 1.00 0.00 C ATOM 533 CG LYS A 84 3.043 11.327 -14.960 1.00 0.00 C ATOM 534 CD LYS A 84 3.299 10.655 -16.322 1.00 0.00 C ATOM 535 CE LYS A 84 4.744 10.841 -16.809 1.00 0.00 C ATOM 536 NZ LYS A 84 5.038 12.244 -17.217 1.00 0.00 N ATOM 0 H LYS A 84 -0.652 9.769 -13.257 1.00 0.00 H new ATOM 0 HA LYS A 84 1.807 9.046 -14.743 1.00 0.00 H new ATOM 0 HB2 LYS A 84 0.915 11.472 -15.218 1.00 0.00 H new ATOM 0 HB3 LYS A 84 1.458 11.771 -13.579 1.00 0.00 H new ATOM 0 HG2 LYS A 84 3.249 12.394 -15.044 1.00 0.00 H new ATOM 0 HG3 LYS A 84 3.741 10.924 -14.226 1.00 0.00 H new ATOM 0 HD2 LYS A 84 3.080 9.590 -16.245 1.00 0.00 H new ATOM 0 HD3 LYS A 84 2.614 11.069 -17.062 1.00 0.00 H new ATOM 0 HE2 LYS A 84 5.431 10.546 -16.016 1.00 0.00 H new ATOM 0 HE3 LYS A 84 4.927 10.176 -17.653 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 6.025 12.313 -17.537 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 4.403 12.520 -17.993 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 4.891 12.879 -16.407 1.00 0.00 H new ATOM 550 N VAL A 85 2.635 8.605 -12.308 1.00 0.00 N ATOM 551 CA VAL A 85 2.767 7.963 -10.980 1.00 0.00 C ATOM 552 C VAL A 85 4.139 8.273 -10.398 1.00 0.00 C ATOM 553 O VAL A 85 5.123 7.561 -10.602 1.00 0.00 O ATOM 554 CB VAL A 85 2.285 6.496 -10.967 1.00 0.00 C ATOM 555 CG1 VAL A 85 2.141 5.873 -9.578 1.00 0.00 C ATOM 556 CG2 VAL A 85 1.212 6.223 -12.014 1.00 0.00 C ATOM 0 H VAL A 85 3.411 8.429 -12.946 1.00 0.00 H new ATOM 0 HA VAL A 85 2.066 8.402 -10.270 1.00 0.00 H new ATOM 0 HB VAL A 85 3.109 5.880 -11.328 1.00 0.00 H new ATOM 0 HG11 VAL A 85 1.798 4.843 -9.675 1.00 0.00 H new ATOM 0 HG12 VAL A 85 3.106 5.888 -9.071 1.00 0.00 H new ATOM 0 HG13 VAL A 85 1.417 6.443 -8.997 1.00 0.00 H new ATOM 0 HG21 VAL A 85 0.910 5.177 -11.961 1.00 0.00 H new ATOM 0 HG22 VAL A 85 0.348 6.861 -11.825 1.00 0.00 H new ATOM 0 HG23 VAL A 85 1.610 6.436 -13.006 1.00 0.00 H new ATOM 566 N THR A 86 4.191 9.464 -9.791 1.00 0.00 N ATOM 567 CA THR A 86 5.393 10.244 -9.500 1.00 0.00 C ATOM 568 C THR A 86 6.173 9.718 -8.300 1.00 0.00 C ATOM 569 O THR A 86 7.381 9.954 -8.237 1.00 0.00 O ATOM 570 CB THR A 86 5.035 11.734 -9.352 1.00 0.00 C ATOM 571 OG1 THR A 86 6.189 12.550 -9.410 1.00 0.00 O ATOM 572 CG2 THR A 86 4.270 12.045 -8.069 1.00 0.00 C ATOM 0 H THR A 86 3.344 9.934 -9.472 1.00 0.00 H new ATOM 0 HA THR A 86 6.067 10.133 -10.349 1.00 0.00 H new ATOM 0 HB THR A 86 4.380 11.958 -10.194 1.00 0.00 H new ATOM 0 HG1 THR A 86 5.930 13.490 -9.315 1.00 0.00 H new ATOM 0 HG21 THR A 86 4.049 13.111 -8.027 1.00 0.00 H new ATOM 0 HG22 THR A 86 3.338 11.480 -8.055 1.00 0.00 H new ATOM 0 HG23 THR A 86 4.876 11.766 -7.207 1.00 0.00 H new ATOM 580 N ASN A 87 5.543 8.959 -7.390 1.00 0.00 N ATOM 581 CA ASN A 87 6.298 8.185 -6.411 1.00 0.00 C ATOM 582 C ASN A 87 5.697 6.808 -6.123 1.00 0.00 C ATOM 583 O ASN A 87 4.532 6.524 -6.393 1.00 0.00 O ATOM 584 CB ASN A 87 6.463 9.010 -5.114 1.00 0.00 C ATOM 585 CG ASN A 87 7.913 9.181 -4.694 1.00 0.00 C ATOM 586 OD1 ASN A 87 8.563 10.169 -5.007 1.00 0.00 O ATOM 587 ND2 ASN A 87 8.487 8.241 -3.974 1.00 0.00 N ATOM 0 H ASN A 87 4.530 8.869 -7.317 1.00 0.00 H new ATOM 0 HA ASN A 87 7.278 7.985 -6.845 1.00 0.00 H new ATOM 0 HB2 ASN A 87 6.014 9.993 -5.257 1.00 0.00 H new ATOM 0 HB3 ASN A 87 5.913 8.523 -4.309 1.00 0.00 H new ATOM 0 HD21 ASN A 87 9.460 8.342 -3.685 1.00 0.00 H new ATOM 0 HD22 ASN A 87 7.959 7.411 -3.705 1.00 0.00 H new ATOM 594 N LEU A 88 6.497 5.967 -5.479 1.00 0.00 N ATOM 595 CA LEU A 88 6.057 4.825 -4.694 1.00 0.00 C ATOM 596 C LEU A 88 6.869 4.742 -3.387 1.00 0.00 C ATOM 597 O LEU A 88 7.759 5.563 -3.157 1.00 0.00 O ATOM 598 CB LEU A 88 6.140 3.582 -5.592 1.00 0.00 C ATOM 599 CG LEU A 88 7.492 2.853 -5.591 1.00 0.00 C ATOM 600 CD1 LEU A 88 7.279 1.584 -6.389 1.00 0.00 C ATOM 601 CD2 LEU A 88 8.653 3.637 -6.202 1.00 0.00 C ATOM 0 H LEU A 88 7.512 6.068 -5.491 1.00 0.00 H new ATOM 0 HA LEU A 88 5.020 4.916 -4.370 1.00 0.00 H new ATOM 0 HB2 LEU A 88 5.368 2.879 -5.281 1.00 0.00 H new ATOM 0 HB3 LEU A 88 5.908 3.878 -6.615 1.00 0.00 H new ATOM 0 HG LEU A 88 7.784 2.686 -4.554 1.00 0.00 H new ATOM 0 HD11 LEU A 88 8.209 1.017 -6.426 1.00 0.00 H new ATOM 0 HD12 LEU A 88 6.505 0.981 -5.914 1.00 0.00 H new ATOM 0 HD13 LEU A 88 6.969 1.839 -7.402 1.00 0.00 H new ATOM 0 HD21 LEU A 88 9.562 3.038 -6.154 1.00 0.00 H new ATOM 0 HD22 LEU A 88 8.427 3.870 -7.242 1.00 0.00 H new ATOM 0 HD23 LEU A 88 8.799 4.563 -5.646 1.00 0.00 H new ATOM 613 N LEU A 89 6.577 3.759 -2.541 1.00 0.00 N ATOM 614 CA LEU A 89 7.332 3.430 -1.329 1.00 0.00 C ATOM 615 C LEU A 89 7.209 1.931 -1.035 1.00 0.00 C ATOM 616 O LEU A 89 6.264 1.302 -1.507 1.00 0.00 O ATOM 617 CB LEU A 89 6.879 4.408 -0.228 1.00 0.00 C ATOM 618 CG LEU A 89 6.684 3.927 1.212 1.00 0.00 C ATOM 619 CD1 LEU A 89 6.121 5.114 1.983 1.00 0.00 C ATOM 620 CD2 LEU A 89 5.665 2.835 1.425 1.00 0.00 C ATOM 0 H LEU A 89 5.777 3.143 -2.684 1.00 0.00 H new ATOM 0 HA LEU A 89 8.408 3.574 -1.425 1.00 0.00 H new ATOM 0 HB2 LEU A 89 7.607 5.219 -0.200 1.00 0.00 H new ATOM 0 HB3 LEU A 89 5.933 4.841 -0.553 1.00 0.00 H new ATOM 0 HG LEU A 89 7.653 3.536 1.522 1.00 0.00 H new ATOM 0 HD11 LEU A 89 5.960 4.829 3.023 1.00 0.00 H new ATOM 0 HD12 LEU A 89 6.826 5.944 1.939 1.00 0.00 H new ATOM 0 HD13 LEU A 89 5.173 5.419 1.540 1.00 0.00 H new ATOM 0 HD21 LEU A 89 5.619 2.582 2.484 1.00 0.00 H new ATOM 0 HD22 LEU A 89 4.686 3.181 1.092 1.00 0.00 H new ATOM 0 HD23 LEU A 89 5.952 1.953 0.853 1.00 0.00 H new ATOM 632 N MET A 90 8.136 1.359 -0.253 1.00 0.00 N ATOM 633 CA MET A 90 8.206 -0.087 0.022 1.00 0.00 C ATOM 634 C MET A 90 8.409 -0.393 1.512 1.00 0.00 C ATOM 635 O MET A 90 9.518 -0.294 2.039 1.00 0.00 O ATOM 636 CB MET A 90 9.272 -0.738 -0.880 1.00 0.00 C ATOM 637 CG MET A 90 8.907 -0.442 -2.341 1.00 0.00 C ATOM 638 SD MET A 90 9.663 -1.455 -3.626 1.00 0.00 S ATOM 639 CE MET A 90 8.142 -1.646 -4.583 1.00 0.00 C ATOM 0 H MET A 90 8.869 1.893 0.213 1.00 0.00 H new ATOM 0 HA MET A 90 7.242 -0.533 -0.225 1.00 0.00 H new ATOM 0 HB2 MET A 90 10.261 -0.342 -0.647 1.00 0.00 H new ATOM 0 HB3 MET A 90 9.311 -1.814 -0.708 1.00 0.00 H new ATOM 0 HG2 MET A 90 7.825 -0.531 -2.439 1.00 0.00 H new ATOM 0 HG3 MET A 90 9.161 0.598 -2.544 1.00 0.00 H new ATOM 0 HE1 MET A 90 8.385 -1.999 -5.585 1.00 0.00 H new ATOM 0 HE2 MET A 90 7.491 -2.369 -4.091 1.00 0.00 H new ATOM 0 HE3 MET A 90 7.632 -0.685 -4.650 1.00 0.00 H new ATOM 649 N LEU A 91 7.316 -0.754 2.194 1.00 0.00 N ATOM 650 CA LEU A 91 7.309 -1.249 3.573 1.00 0.00 C ATOM 651 C LEU A 91 7.841 -2.695 3.648 1.00 0.00 C ATOM 652 O LEU A 91 7.091 -3.668 3.538 1.00 0.00 O ATOM 653 CB LEU A 91 5.898 -1.173 4.200 1.00 0.00 C ATOM 654 CG LEU A 91 5.190 0.186 4.369 1.00 0.00 C ATOM 655 CD1 LEU A 91 6.155 1.336 4.645 1.00 0.00 C ATOM 656 CD2 LEU A 91 4.232 0.485 3.220 1.00 0.00 C ATOM 0 H LEU A 91 6.382 -0.708 1.787 1.00 0.00 H new ATOM 0 HA LEU A 91 7.972 -0.601 4.146 1.00 0.00 H new ATOM 0 HB2 LEU A 91 5.244 -1.804 3.598 1.00 0.00 H new ATOM 0 HB3 LEU A 91 5.960 -1.629 5.188 1.00 0.00 H new ATOM 0 HG LEU A 91 4.579 0.097 5.267 1.00 0.00 H new ATOM 0 HD11 LEU A 91 5.594 2.264 4.754 1.00 0.00 H new ATOM 0 HD12 LEU A 91 6.706 1.136 5.564 1.00 0.00 H new ATOM 0 HD13 LEU A 91 6.855 1.431 3.815 1.00 0.00 H new ATOM 0 HD21 LEU A 91 3.758 1.453 3.384 1.00 0.00 H new ATOM 0 HD22 LEU A 91 4.785 0.507 2.281 1.00 0.00 H new ATOM 0 HD23 LEU A 91 3.468 -0.291 3.173 1.00 0.00 H new ATOM 668 N LYS A 92 9.148 -2.845 3.880 1.00 0.00 N ATOM 669 CA LYS A 92 9.810 -4.150 4.075 1.00 0.00 C ATOM 670 C LYS A 92 9.313 -4.934 5.307 1.00 0.00 C ATOM 671 O LYS A 92 9.461 -6.155 5.345 1.00 0.00 O ATOM 672 CB LYS A 92 11.335 -3.944 4.147 1.00 0.00 C ATOM 673 CG LYS A 92 11.952 -3.633 2.773 1.00 0.00 C ATOM 674 CD LYS A 92 13.414 -3.183 2.934 1.00 0.00 C ATOM 675 CE LYS A 92 14.202 -3.121 1.615 1.00 0.00 C ATOM 676 NZ LYS A 92 13.560 -2.254 0.593 1.00 0.00 N ATOM 0 H LYS A 92 9.791 -2.055 3.940 1.00 0.00 H new ATOM 0 HA LYS A 92 9.545 -4.765 3.215 1.00 0.00 H new ATOM 0 HB2 LYS A 92 11.556 -3.127 4.834 1.00 0.00 H new ATOM 0 HB3 LYS A 92 11.801 -4.840 4.556 1.00 0.00 H new ATOM 0 HG2 LYS A 92 11.904 -4.517 2.137 1.00 0.00 H new ATOM 0 HG3 LYS A 92 11.376 -2.852 2.277 1.00 0.00 H new ATOM 0 HD2 LYS A 92 13.430 -2.198 3.401 1.00 0.00 H new ATOM 0 HD3 LYS A 92 13.920 -3.867 3.615 1.00 0.00 H new ATOM 0 HE2 LYS A 92 15.208 -2.752 1.816 1.00 0.00 H new ATOM 0 HE3 LYS A 92 14.307 -4.129 1.214 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 14.292 -1.827 -0.009 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 12.919 -2.825 0.006 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 13.019 -1.502 1.066 1.00 0.00 H new ATOM 690 N GLY A 93 8.702 -4.261 6.290 1.00 0.00 N ATOM 691 CA GLY A 93 8.264 -4.827 7.579 1.00 0.00 C ATOM 692 C GLY A 93 7.280 -6.003 7.475 1.00 0.00 C ATOM 693 O GLY A 93 7.539 -7.072 8.033 1.00 0.00 O ATOM 0 H GLY A 93 8.489 -3.267 6.209 1.00 0.00 H new ATOM 0 HA2 GLY A 93 9.144 -5.158 8.130 1.00 0.00 H new ATOM 0 HA3 GLY A 93 7.799 -4.035 8.166 1.00 0.00 H new ATOM 697 N LYS A 94 6.160 -5.819 6.754 1.00 0.00 N ATOM 698 CA LYS A 94 5.099 -6.829 6.516 1.00 0.00 C ATOM 699 C LYS A 94 4.857 -7.069 5.014 1.00 0.00 C ATOM 700 O LYS A 94 3.808 -7.575 4.622 1.00 0.00 O ATOM 701 CB LYS A 94 3.809 -6.432 7.265 1.00 0.00 C ATOM 702 CG LYS A 94 3.951 -6.389 8.800 1.00 0.00 C ATOM 703 CD LYS A 94 3.184 -5.218 9.434 1.00 0.00 C ATOM 704 CE LYS A 94 3.875 -3.878 9.131 1.00 0.00 C ATOM 705 NZ LYS A 94 3.242 -2.763 9.875 1.00 0.00 N ATOM 0 H LYS A 94 5.956 -4.929 6.300 1.00 0.00 H new ATOM 0 HA LYS A 94 5.438 -7.784 6.918 1.00 0.00 H new ATOM 0 HB2 LYS A 94 3.487 -5.451 6.915 1.00 0.00 H new ATOM 0 HB3 LYS A 94 3.020 -7.138 7.005 1.00 0.00 H new ATOM 0 HG2 LYS A 94 3.587 -7.326 9.221 1.00 0.00 H new ATOM 0 HG3 LYS A 94 5.006 -6.311 9.061 1.00 0.00 H new ATOM 0 HD2 LYS A 94 2.163 -5.199 9.053 1.00 0.00 H new ATOM 0 HD3 LYS A 94 3.119 -5.362 10.512 1.00 0.00 H new ATOM 0 HE2 LYS A 94 4.930 -3.942 9.397 1.00 0.00 H new ATOM 0 HE3 LYS A 94 3.828 -3.676 8.061 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 3.731 -1.873 9.649 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 2.241 -2.687 9.602 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 3.309 -2.945 10.897 1.00 0.00 H new ATOM 719 N ASN A 95 5.836 -6.708 4.177 1.00 0.00 N ATOM 720 CA ASN A 95 5.788 -6.718 2.710 1.00 0.00 C ATOM 721 C ASN A 95 4.593 -5.939 2.156 1.00 0.00 C ATOM 722 O ASN A 95 3.696 -6.500 1.523 1.00 0.00 O ATOM 723 CB ASN A 95 5.875 -8.156 2.173 1.00 0.00 C ATOM 724 CG ASN A 95 7.045 -8.937 2.746 1.00 0.00 C ATOM 725 OD1 ASN A 95 6.889 -9.825 3.574 1.00 0.00 O ATOM 726 ND2 ASN A 95 8.257 -8.616 2.364 1.00 0.00 N ATOM 0 H ASN A 95 6.737 -6.381 4.526 1.00 0.00 H new ATOM 0 HA ASN A 95 6.666 -6.186 2.344 1.00 0.00 H new ATOM 0 HB2 ASN A 95 4.948 -8.680 2.404 1.00 0.00 H new ATOM 0 HB3 ASN A 95 5.962 -8.127 1.087 1.00 0.00 H new ATOM 0 HD21 ASN A 95 9.062 -9.105 2.756 1.00 0.00 H new ATOM 0 HD22 ASN A 95 8.396 -7.877 1.674 1.00 0.00 H new ATOM 733 N GLN A 96 4.607 -4.624 2.360 1.00 0.00 N ATOM 734 CA GLN A 96 3.665 -3.709 1.725 1.00 0.00 C ATOM 735 C GLN A 96 4.370 -2.574 0.965 1.00 0.00 C ATOM 736 O GLN A 96 5.597 -2.512 0.895 1.00 0.00 O ATOM 737 CB GLN A 96 2.522 -3.245 2.659 1.00 0.00 C ATOM 738 CG GLN A 96 2.355 -3.975 3.997 1.00 0.00 C ATOM 739 CD GLN A 96 3.285 -3.366 5.020 1.00 0.00 C ATOM 740 OE1 GLN A 96 4.372 -3.839 5.317 1.00 0.00 O ATOM 741 NE2 GLN A 96 2.931 -2.222 5.547 1.00 0.00 N ATOM 0 H GLN A 96 5.277 -4.162 2.975 1.00 0.00 H new ATOM 0 HA GLN A 96 3.150 -4.288 0.958 1.00 0.00 H new ATOM 0 HB2 GLN A 96 2.671 -2.186 2.871 1.00 0.00 H new ATOM 0 HB3 GLN A 96 1.584 -3.332 2.110 1.00 0.00 H new ATOM 0 HG2 GLN A 96 1.322 -3.901 4.338 1.00 0.00 H new ATOM 0 HG3 GLN A 96 2.575 -5.036 3.875 1.00 0.00 H new ATOM 0 HE21 GLN A 96 2.028 -1.810 5.312 1.00 0.00 H new ATOM 0 HE22 GLN A 96 3.558 -1.742 6.193 1.00 0.00 H new ATOM 750 N ALA A 97 3.602 -1.691 0.340 1.00 0.00 N ATOM 751 CA ALA A 97 4.053 -0.590 -0.498 1.00 0.00 C ATOM 752 C ALA A 97 3.005 0.527 -0.500 1.00 0.00 C ATOM 753 O ALA A 97 1.836 0.286 -0.202 1.00 0.00 O ATOM 754 CB ALA A 97 4.222 -1.147 -1.926 1.00 0.00 C ATOM 0 H ALA A 97 2.585 -1.728 0.410 1.00 0.00 H new ATOM 0 HA ALA A 97 4.991 -0.178 -0.125 1.00 0.00 H new ATOM 0 HB1 ALA A 97 4.560 -0.351 -2.589 1.00 0.00 H new ATOM 0 HB2 ALA A 97 4.958 -1.951 -1.918 1.00 0.00 H new ATOM 0 HB3 ALA A 97 3.267 -1.534 -2.281 1.00 0.00 H new ATOM 760 N PHE A 98 3.413 1.723 -0.918 1.00 0.00 N ATOM 761 CA PHE A 98 2.542 2.800 -1.404 1.00 0.00 C ATOM 762 C PHE A 98 2.750 2.907 -2.920 1.00 0.00 C ATOM 763 O PHE A 98 3.873 2.702 -3.382 1.00 0.00 O ATOM 764 CB PHE A 98 2.927 4.153 -0.786 1.00 0.00 C ATOM 765 CG PHE A 98 2.489 4.468 0.639 1.00 0.00 C ATOM 766 CD1 PHE A 98 2.110 3.457 1.544 1.00 0.00 C ATOM 767 CD2 PHE A 98 2.497 5.810 1.078 1.00 0.00 C ATOM 768 CE1 PHE A 98 1.771 3.772 2.866 1.00 0.00 C ATOM 769 CE2 PHE A 98 2.135 6.133 2.389 1.00 0.00 C ATOM 770 CZ PHE A 98 1.782 5.111 3.273 1.00 0.00 C ATOM 0 H PHE A 98 4.399 1.983 -0.929 1.00 0.00 H new ATOM 0 HA PHE A 98 1.511 2.572 -1.135 1.00 0.00 H new ATOM 0 HB2 PHE A 98 4.013 4.233 -0.821 1.00 0.00 H new ATOM 0 HB3 PHE A 98 2.529 4.935 -1.433 1.00 0.00 H new ATOM 0 HD1 PHE A 98 2.081 2.429 1.215 1.00 0.00 H new ATOM 0 HD2 PHE A 98 2.786 6.595 0.394 1.00 0.00 H new ATOM 0 HE1 PHE A 98 1.504 2.991 3.563 1.00 0.00 H new ATOM 0 HE2 PHE A 98 2.128 7.163 2.715 1.00 0.00 H new ATOM 0 HZ PHE A 98 1.513 5.358 4.289 1.00 0.00 H new ATOM 780 N ILE A 99 1.750 3.337 -3.688 1.00 0.00 N ATOM 781 CA ILE A 99 1.902 3.803 -5.073 1.00 0.00 C ATOM 782 C ILE A 99 1.135 5.122 -5.227 1.00 0.00 C ATOM 783 O ILE A 99 -0.037 5.211 -4.855 1.00 0.00 O ATOM 784 CB ILE A 99 1.505 2.691 -6.073 1.00 0.00 C ATOM 785 CG1 ILE A 99 1.798 3.148 -7.512 1.00 0.00 C ATOM 786 CG2 ILE A 99 0.041 2.264 -5.910 1.00 0.00 C ATOM 787 CD1 ILE A 99 1.597 2.065 -8.580 1.00 0.00 C ATOM 0 H ILE A 99 0.785 3.373 -3.359 1.00 0.00 H new ATOM 0 HA ILE A 99 2.944 4.016 -5.310 1.00 0.00 H new ATOM 0 HB ILE A 99 2.110 1.811 -5.855 1.00 0.00 H new ATOM 0 HG12 ILE A 99 1.155 3.996 -7.748 1.00 0.00 H new ATOM 0 HG13 ILE A 99 2.827 3.504 -7.564 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -0.192 1.482 -6.632 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -0.117 1.884 -4.901 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -0.609 3.122 -6.081 1.00 0.00 H new ATOM 0 HD11 ILE A 99 1.826 2.476 -9.563 1.00 0.00 H new ATOM 0 HD12 ILE A 99 2.260 1.224 -8.375 1.00 0.00 H new ATOM 0 HD13 ILE A 99 0.562 1.724 -8.562 1.00 0.00 H new ATOM 799 N GLU A 100 1.821 6.176 -5.669 1.00 0.00 N ATOM 800 CA GLU A 100 1.381 7.566 -5.531 1.00 0.00 C ATOM 801 C GLU A 100 1.460 8.343 -6.831 1.00 0.00 C ATOM 802 O GLU A 100 2.486 8.395 -7.512 1.00 0.00 O ATOM 803 CB GLU A 100 2.209 8.256 -4.459 1.00 0.00 C ATOM 804 CG GLU A 100 1.709 9.665 -4.132 1.00 0.00 C ATOM 805 CD GLU A 100 2.375 10.804 -4.922 1.00 0.00 C ATOM 806 OE1 GLU A 100 3.590 11.030 -4.728 1.00 0.00 O ATOM 807 OE2 GLU A 100 1.662 11.532 -5.653 1.00 0.00 O ATOM 0 H GLU A 100 2.719 6.086 -6.144 1.00 0.00 H new ATOM 0 HA GLU A 100 0.330 7.546 -5.243 1.00 0.00 H new ATOM 0 HB2 GLU A 100 2.195 7.652 -3.552 1.00 0.00 H new ATOM 0 HB3 GLU A 100 3.246 8.312 -4.789 1.00 0.00 H new ATOM 0 HG2 GLU A 100 0.635 9.701 -4.312 1.00 0.00 H new ATOM 0 HG3 GLU A 100 1.860 9.847 -3.068 1.00 0.00 H new ATOM 814 N MET A 101 0.328 8.941 -7.174 1.00 0.00 N ATOM 815 CA MET A 101 0.047 9.364 -8.536 1.00 0.00 C ATOM 816 C MET A 101 -0.524 10.780 -8.641 1.00 0.00 C ATOM 817 O MET A 101 -0.975 11.389 -7.677 1.00 0.00 O ATOM 818 CB MET A 101 -0.725 8.264 -9.279 1.00 0.00 C ATOM 819 CG MET A 101 -1.576 7.341 -8.411 1.00 0.00 C ATOM 820 SD MET A 101 -2.624 6.239 -9.377 1.00 0.00 S ATOM 821 CE MET A 101 -1.557 5.812 -10.769 1.00 0.00 C ATOM 0 H MET A 101 -0.422 9.146 -6.514 1.00 0.00 H new ATOM 0 HA MET A 101 0.991 9.478 -9.068 1.00 0.00 H new ATOM 0 HB2 MET A 101 -1.374 8.737 -10.016 1.00 0.00 H new ATOM 0 HB3 MET A 101 -0.009 7.654 -9.830 1.00 0.00 H new ATOM 0 HG2 MET A 101 -0.922 6.746 -7.773 1.00 0.00 H new ATOM 0 HG3 MET A 101 -2.201 7.944 -7.753 1.00 0.00 H new ATOM 0 HE1 MET A 101 -2.013 5.005 -11.343 1.00 0.00 H new ATOM 0 HE2 MET A 101 -1.428 6.684 -11.409 1.00 0.00 H new ATOM 0 HE3 MET A 101 -0.585 5.488 -10.397 1.00 0.00 H new ATOM 831 N ASN A 102 -0.428 11.333 -9.845 1.00 0.00 N ATOM 832 CA ASN A 102 -0.532 12.763 -10.157 1.00 0.00 C ATOM 833 C ASN A 102 -1.991 13.273 -10.205 1.00 0.00 C ATOM 834 O ASN A 102 -2.224 14.483 -10.193 1.00 0.00 O ATOM 835 CB ASN A 102 0.289 12.987 -11.452 1.00 0.00 C ATOM 836 CG ASN A 102 -0.474 13.473 -12.666 1.00 0.00 C ATOM 837 OD1 ASN A 102 -0.961 12.558 -13.461 1.00 0.00 O flip ATOM 838 ND2 ASN A 102 -0.613 14.656 -12.932 1.00 0.00 N flip ATOM 0 H ASN A 102 -0.267 10.768 -10.679 1.00 0.00 H new ATOM 0 HA ASN A 102 -0.113 13.374 -9.358 1.00 0.00 H new ATOM 0 HB2 ASN A 102 1.077 13.708 -11.235 1.00 0.00 H new ATOM 0 HB3 ASN A 102 0.778 12.048 -11.711 1.00 0.00 H new ATOM 0 HD21 ASN A 102 -0.231 15.367 -12.308 1.00 0.00 H new ATOM 0 HD22 ASN A 102 -1.111 14.933 -13.778 1.00 0.00 H new ATOM 845 N THR A 103 -2.970 12.358 -10.225 1.00 0.00 N ATOM 846 CA THR A 103 -4.408 12.666 -10.297 1.00 0.00 C ATOM 847 C THR A 103 -5.226 11.716 -9.416 1.00 0.00 C ATOM 848 O THR A 103 -5.000 10.501 -9.358 1.00 0.00 O ATOM 849 CB THR A 103 -4.956 12.727 -11.749 1.00 0.00 C ATOM 850 OG1 THR A 103 -6.045 11.862 -11.979 1.00 0.00 O ATOM 851 CG2 THR A 103 -3.927 12.441 -12.838 1.00 0.00 C ATOM 0 H THR A 103 -2.780 11.356 -10.191 1.00 0.00 H new ATOM 0 HA THR A 103 -4.523 13.675 -9.900 1.00 0.00 H new ATOM 0 HB THR A 103 -5.272 13.768 -11.821 1.00 0.00 H new ATOM 0 HG1 THR A 103 -6.342 11.950 -12.909 1.00 0.00 H new ATOM 0 HG21 THR A 103 -4.404 12.507 -13.816 1.00 0.00 H new ATOM 0 HG22 THR A 103 -3.121 13.172 -12.778 1.00 0.00 H new ATOM 0 HG23 THR A 103 -3.520 11.439 -12.700 1.00 0.00 H new ATOM 859 N GLU A 104 -6.204 12.305 -8.730 1.00 0.00 N ATOM 860 CA GLU A 104 -7.166 11.599 -7.882 1.00 0.00 C ATOM 861 C GLU A 104 -8.020 10.620 -8.702 1.00 0.00 C ATOM 862 O GLU A 104 -8.366 9.544 -8.221 1.00 0.00 O ATOM 863 CB GLU A 104 -8.089 12.619 -7.190 1.00 0.00 C ATOM 864 CG GLU A 104 -7.325 13.677 -6.385 1.00 0.00 C ATOM 865 CD GLU A 104 -8.293 14.638 -5.676 1.00 0.00 C ATOM 866 OE1 GLU A 104 -8.675 15.674 -6.275 1.00 0.00 O ATOM 867 OE2 GLU A 104 -8.676 14.369 -4.511 1.00 0.00 O ATOM 0 H GLU A 104 -6.354 13.314 -8.748 1.00 0.00 H new ATOM 0 HA GLU A 104 -6.608 11.030 -7.138 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -8.700 13.116 -7.944 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -8.772 12.089 -6.526 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -6.688 13.188 -5.648 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -6.669 14.240 -7.049 1.00 0.00 H new ATOM 874 N GLU A 105 -8.345 10.974 -9.951 1.00 0.00 N ATOM 875 CA GLU A 105 -9.148 10.140 -10.852 1.00 0.00 C ATOM 876 C GLU A 105 -8.364 8.966 -11.434 1.00 0.00 C ATOM 877 O GLU A 105 -8.921 7.873 -11.546 1.00 0.00 O ATOM 878 CB GLU A 105 -9.728 10.965 -12.007 1.00 0.00 C ATOM 879 CG GLU A 105 -10.789 11.968 -11.544 1.00 0.00 C ATOM 880 CD GLU A 105 -11.379 12.739 -12.739 1.00 0.00 C ATOM 881 OE1 GLU A 105 -12.360 12.256 -13.356 1.00 0.00 O ATOM 882 OE2 GLU A 105 -10.878 13.846 -13.065 1.00 0.00 O ATOM 0 H GLU A 105 -8.054 11.858 -10.369 1.00 0.00 H new ATOM 0 HA GLU A 105 -9.955 9.741 -10.237 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -8.921 11.501 -12.506 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -10.167 10.292 -12.744 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -11.585 11.443 -11.017 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -10.347 12.670 -10.837 1.00 0.00 H new ATOM 889 N ALA A 106 -7.073 9.142 -11.744 1.00 0.00 N ATOM 890 CA ALA A 106 -6.191 8.028 -12.061 1.00 0.00 C ATOM 891 C ALA A 106 -6.194 7.033 -10.918 1.00 0.00 C ATOM 892 O ALA A 106 -6.462 5.861 -11.135 1.00 0.00 O ATOM 893 CB ALA A 106 -4.759 8.491 -12.298 1.00 0.00 C ATOM 0 H ALA A 106 -6.620 10.055 -11.780 1.00 0.00 H new ATOM 0 HA ALA A 106 -6.563 7.566 -12.975 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -4.132 7.630 -12.532 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -4.737 9.193 -13.132 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -4.382 8.981 -11.401 1.00 0.00 H new ATOM 899 N ALA A 107 -5.921 7.472 -9.693 1.00 0.00 N ATOM 900 CA ALA A 107 -5.874 6.530 -8.589 1.00 0.00 C ATOM 901 C ALA A 107 -7.229 5.918 -8.212 1.00 0.00 C ATOM 902 O ALA A 107 -7.292 4.730 -7.914 1.00 0.00 O ATOM 903 CB ALA A 107 -5.267 7.235 -7.414 1.00 0.00 C ATOM 0 H ALA A 107 -5.735 8.444 -9.447 1.00 0.00 H new ATOM 0 HA ALA A 107 -5.271 5.680 -8.907 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -5.218 6.552 -6.566 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -4.262 7.569 -7.670 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -5.880 8.097 -7.151 1.00 0.00 H new ATOM 909 N ASN A 108 -8.326 6.673 -8.289 1.00 0.00 N ATOM 910 CA ASN A 108 -9.679 6.128 -8.184 1.00 0.00 C ATOM 911 C ASN A 108 -9.904 5.013 -9.217 1.00 0.00 C ATOM 912 O ASN A 108 -10.288 3.900 -8.855 1.00 0.00 O ATOM 913 CB ASN A 108 -10.682 7.282 -8.320 1.00 0.00 C ATOM 914 CG ASN A 108 -12.121 6.795 -8.254 1.00 0.00 C ATOM 915 OD1 ASN A 108 -12.765 6.529 -9.258 1.00 0.00 O ATOM 916 ND2 ASN A 108 -12.670 6.648 -7.072 1.00 0.00 N ATOM 0 H ASN A 108 -8.300 7.683 -8.426 1.00 0.00 H new ATOM 0 HA ASN A 108 -9.826 5.661 -7.210 1.00 0.00 H new ATOM 0 HB2 ASN A 108 -10.508 8.009 -7.527 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -10.516 7.797 -9.266 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -13.630 6.313 -6.994 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -12.137 6.869 -6.231 1.00 0.00 H new ATOM 923 N THR A 109 -9.587 5.260 -10.489 1.00 0.00 N ATOM 924 CA THR A 109 -9.663 4.229 -11.524 1.00 0.00 C ATOM 925 C THR A 109 -8.653 3.106 -11.276 1.00 0.00 C ATOM 926 O THR A 109 -8.966 1.960 -11.574 1.00 0.00 O ATOM 927 CB THR A 109 -9.579 4.843 -12.941 1.00 0.00 C ATOM 928 OG1 THR A 109 -10.601 4.285 -13.741 1.00 0.00 O ATOM 929 CG2 THR A 109 -8.268 4.638 -13.696 1.00 0.00 C ATOM 0 H THR A 109 -9.274 6.170 -10.828 1.00 0.00 H new ATOM 0 HA THR A 109 -10.644 3.758 -11.464 1.00 0.00 H new ATOM 0 HB THR A 109 -9.673 5.916 -12.773 1.00 0.00 H new ATOM 0 HG1 THR A 109 -10.558 4.669 -14.642 1.00 0.00 H new ATOM 0 HG21 THR A 109 -8.333 5.114 -14.674 1.00 0.00 H new ATOM 0 HG22 THR A 109 -7.449 5.082 -13.130 1.00 0.00 H new ATOM 0 HG23 THR A 109 -8.084 3.571 -13.823 1.00 0.00 H new ATOM 937 N MET A 110 -7.488 3.376 -10.664 1.00 0.00 N ATOM 938 CA MET A 110 -6.442 2.389 -10.419 1.00 0.00 C ATOM 939 C MET A 110 -6.831 1.422 -9.295 1.00 0.00 C ATOM 940 O MET A 110 -6.703 0.208 -9.427 1.00 0.00 O ATOM 941 CB MET A 110 -5.074 3.039 -10.102 1.00 0.00 C ATOM 942 CG MET A 110 -4.012 2.071 -10.654 1.00 0.00 C ATOM 943 SD MET A 110 -2.273 2.471 -10.413 1.00 0.00 S ATOM 944 CE MET A 110 -2.318 2.868 -8.663 1.00 0.00 C ATOM 0 H MET A 110 -7.250 4.307 -10.322 1.00 0.00 H new ATOM 0 HA MET A 110 -6.338 1.828 -11.347 1.00 0.00 H new ATOM 0 HB2 MET A 110 -4.990 4.020 -10.569 1.00 0.00 H new ATOM 0 HB3 MET A 110 -4.950 3.185 -9.029 1.00 0.00 H new ATOM 0 HG2 MET A 110 -4.192 1.093 -10.208 1.00 0.00 H new ATOM 0 HG3 MET A 110 -4.183 1.968 -11.726 1.00 0.00 H new ATOM 0 HE1 MET A 110 -1.315 3.127 -8.323 1.00 0.00 H new ATOM 0 HE2 MET A 110 -2.986 3.713 -8.499 1.00 0.00 H new ATOM 0 HE3 MET A 110 -2.680 2.005 -8.103 1.00 0.00 H new ATOM 954 N VAL A 111 -7.340 1.946 -8.180 1.00 0.00 N ATOM 955 CA VAL A 111 -7.805 1.155 -7.037 1.00 0.00 C ATOM 956 C VAL A 111 -9.015 0.308 -7.416 1.00 0.00 C ATOM 957 O VAL A 111 -9.085 -0.864 -7.058 1.00 0.00 O ATOM 958 CB VAL A 111 -8.081 2.079 -5.838 1.00 0.00 C ATOM 959 CG1 VAL A 111 -9.469 2.696 -5.767 1.00 0.00 C ATOM 960 CG2 VAL A 111 -7.864 1.339 -4.519 1.00 0.00 C ATOM 0 H VAL A 111 -7.443 2.951 -8.042 1.00 0.00 H new ATOM 0 HA VAL A 111 -7.022 0.457 -6.740 1.00 0.00 H new ATOM 0 HB VAL A 111 -7.373 2.892 -5.995 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -9.542 3.326 -4.880 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -9.644 3.301 -6.657 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -10.217 1.905 -5.713 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -8.065 2.013 -3.686 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -8.539 0.485 -4.466 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -6.833 0.991 -4.463 1.00 0.00 H new ATOM 970 N ASN A 112 -9.939 0.869 -8.209 1.00 0.00 N ATOM 971 CA ASN A 112 -11.111 0.156 -8.716 1.00 0.00 C ATOM 972 C ASN A 112 -10.694 -0.920 -9.728 1.00 0.00 C ATOM 973 O ASN A 112 -11.092 -2.075 -9.581 1.00 0.00 O ATOM 974 CB ASN A 112 -12.115 1.155 -9.304 1.00 0.00 C ATOM 975 CG ASN A 112 -12.937 1.840 -8.219 1.00 0.00 C ATOM 976 OD1 ASN A 112 -14.125 1.590 -8.067 1.00 0.00 O ATOM 977 ND2 ASN A 112 -12.352 2.697 -7.414 1.00 0.00 N ATOM 0 H ASN A 112 -9.890 1.840 -8.517 1.00 0.00 H new ATOM 0 HA ASN A 112 -11.605 -0.361 -7.894 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -11.581 1.907 -9.884 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -12.783 0.636 -9.992 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -12.888 3.147 -6.671 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -11.362 2.913 -7.531 1.00 0.00 H new ATOM 984 N TYR A 113 -9.810 -0.588 -10.675 1.00 0.00 N ATOM 985 CA TYR A 113 -9.123 -1.537 -11.558 1.00 0.00 C ATOM 986 C TYR A 113 -8.519 -2.709 -10.779 1.00 0.00 C ATOM 987 O TYR A 113 -8.708 -3.854 -11.168 1.00 0.00 O ATOM 988 CB TYR A 113 -8.035 -0.804 -12.365 1.00 0.00 C ATOM 989 CG TYR A 113 -7.070 -1.689 -13.126 1.00 0.00 C ATOM 990 CD1 TYR A 113 -5.886 -2.156 -12.515 1.00 0.00 C ATOM 991 CD2 TYR A 113 -7.344 -2.006 -14.464 1.00 0.00 C ATOM 992 CE1 TYR A 113 -5.040 -3.038 -13.216 1.00 0.00 C ATOM 993 CE2 TYR A 113 -6.484 -2.858 -15.184 1.00 0.00 C ATOM 994 CZ TYR A 113 -5.334 -3.385 -14.553 1.00 0.00 C ATOM 995 OH TYR A 113 -4.477 -4.181 -15.247 1.00 0.00 O ATOM 0 H TYR A 113 -9.544 0.380 -10.854 1.00 0.00 H new ATOM 0 HA TYR A 113 -9.861 -1.954 -12.243 1.00 0.00 H new ATOM 0 HB2 TYR A 113 -8.524 -0.137 -13.075 1.00 0.00 H new ATOM 0 HB3 TYR A 113 -7.462 -0.178 -11.681 1.00 0.00 H new ATOM 0 HD1 TYR A 113 -5.630 -1.839 -11.515 1.00 0.00 H new ATOM 0 HD2 TYR A 113 -8.219 -1.595 -14.945 1.00 0.00 H new ATOM 0 HE1 TYR A 113 -4.167 -3.449 -12.731 1.00 0.00 H new ATOM 0 HE2 TYR A 113 -6.702 -3.107 -16.212 1.00 0.00 H new ATOM 0 HH TYR A 113 -4.825 -4.326 -16.152 1.00 0.00 H new ATOM 1005 N TYR A 114 -7.882 -2.475 -9.631 1.00 0.00 N ATOM 1006 CA TYR A 114 -7.207 -3.516 -8.865 1.00 0.00 C ATOM 1007 C TYR A 114 -8.155 -4.263 -7.936 1.00 0.00 C ATOM 1008 O TYR A 114 -7.851 -5.366 -7.482 1.00 0.00 O ATOM 1009 CB TYR A 114 -6.039 -2.919 -8.096 1.00 0.00 C ATOM 1010 CG TYR A 114 -4.812 -2.630 -8.925 1.00 0.00 C ATOM 1011 CD1 TYR A 114 -4.280 -3.630 -9.768 1.00 0.00 C ATOM 1012 CD2 TYR A 114 -4.141 -1.407 -8.746 1.00 0.00 C ATOM 1013 CE1 TYR A 114 -3.010 -3.431 -10.342 1.00 0.00 C ATOM 1014 CE2 TYR A 114 -2.883 -1.200 -9.335 1.00 0.00 C ATOM 1015 CZ TYR A 114 -2.311 -2.226 -10.109 1.00 0.00 C ATOM 1016 OH TYR A 114 -1.075 -2.053 -10.632 1.00 0.00 O ATOM 0 H TYR A 114 -7.821 -1.550 -9.206 1.00 0.00 H new ATOM 0 HA TYR A 114 -6.827 -4.254 -9.572 1.00 0.00 H new ATOM 0 HB2 TYR A 114 -6.368 -1.992 -7.626 1.00 0.00 H new ATOM 0 HB3 TYR A 114 -5.764 -3.603 -7.293 1.00 0.00 H new ATOM 0 HD1 TYR A 114 -4.838 -4.533 -9.969 1.00 0.00 H new ATOM 0 HD2 TYR A 114 -4.594 -0.625 -8.154 1.00 0.00 H new ATOM 0 HE1 TYR A 114 -2.570 -4.200 -10.960 1.00 0.00 H new ATOM 0 HE2 TYR A 114 -2.361 -0.265 -9.195 1.00 0.00 H new ATOM 0 HH TYR A 114 -0.733 -1.170 -10.379 1.00 0.00 H new ATOM 1026 N THR A 115 -9.338 -3.690 -7.738 1.00 0.00 N ATOM 1027 CA THR A 115 -10.458 -4.328 -7.065 1.00 0.00 C ATOM 1028 C THR A 115 -11.244 -5.226 -8.048 1.00 0.00 C ATOM 1029 O THR A 115 -12.009 -6.103 -7.646 1.00 0.00 O ATOM 1030 CB THR A 115 -11.299 -3.259 -6.335 1.00 0.00 C ATOM 1031 OG1 THR A 115 -10.489 -2.641 -5.357 1.00 0.00 O ATOM 1032 CG2 THR A 115 -12.525 -3.789 -5.596 1.00 0.00 C ATOM 0 H THR A 115 -9.547 -2.742 -8.051 1.00 0.00 H new ATOM 0 HA THR A 115 -10.108 -5.010 -6.290 1.00 0.00 H new ATOM 0 HB THR A 115 -11.650 -2.588 -7.119 1.00 0.00 H new ATOM 0 HG1 THR A 115 -9.914 -1.972 -5.784 1.00 0.00 H new ATOM 0 HG21 THR A 115 -13.047 -2.961 -5.117 1.00 0.00 H new ATOM 0 HG22 THR A 115 -13.193 -4.278 -6.304 1.00 0.00 H new ATOM 0 HG23 THR A 115 -12.211 -4.507 -4.838 1.00 0.00 H new ATOM 1040 N SER A 116 -10.982 -5.055 -9.354 1.00 0.00 N ATOM 1041 CA SER A 116 -11.531 -5.772 -10.514 1.00 0.00 C ATOM 1042 C SER A 116 -10.631 -6.919 -11.000 1.00 0.00 C ATOM 1043 O SER A 116 -11.064 -8.065 -11.137 1.00 0.00 O ATOM 1044 CB SER A 116 -11.647 -4.759 -11.668 1.00 0.00 C ATOM 1045 OG SER A 116 -12.938 -4.800 -12.255 1.00 0.00 O ATOM 0 H SER A 116 -10.316 -4.342 -9.652 1.00 0.00 H new ATOM 0 HA SER A 116 -12.486 -6.204 -10.215 1.00 0.00 H new ATOM 0 HB2 SER A 116 -11.445 -3.755 -11.296 1.00 0.00 H new ATOM 0 HB3 SER A 116 -10.893 -4.977 -12.424 1.00 0.00 H new ATOM 0 HG SER A 116 -12.987 -4.147 -12.984 1.00 0.00 H new ATOM 1051 N VAL A 117 -9.382 -6.578 -11.326 1.00 0.00 N ATOM 1052 CA VAL A 117 -8.460 -7.312 -12.214 1.00 0.00 C ATOM 1053 C VAL A 117 -7.903 -8.604 -11.597 1.00 0.00 C ATOM 1054 O VAL A 117 -7.632 -9.572 -12.306 1.00 0.00 O ATOM 1055 CB VAL A 117 -7.291 -6.365 -12.589 1.00 0.00 C ATOM 1056 CG1 VAL A 117 -6.343 -6.115 -11.445 1.00 0.00 C ATOM 1057 CG2 VAL A 117 -6.504 -6.858 -13.794 1.00 0.00 C ATOM 0 H VAL A 117 -8.955 -5.729 -10.956 1.00 0.00 H new ATOM 0 HA VAL A 117 -9.027 -7.620 -13.092 1.00 0.00 H new ATOM 0 HB VAL A 117 -7.773 -5.421 -12.846 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -5.548 -5.445 -11.771 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -6.885 -5.658 -10.617 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -5.910 -7.060 -11.118 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -5.698 -6.158 -14.013 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -6.083 -7.840 -13.577 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -7.166 -6.930 -14.657 1.00 0.00 H new ATOM 1067 N THR A 118 -7.711 -8.559 -10.277 1.00 0.00 N ATOM 1068 CA THR A 118 -6.520 -8.961 -9.488 1.00 0.00 C ATOM 1069 C THR A 118 -5.340 -9.563 -10.282 1.00 0.00 C ATOM 1070 O THR A 118 -5.488 -10.647 -10.846 1.00 0.00 O ATOM 1071 CB THR A 118 -6.871 -9.854 -8.283 1.00 0.00 C ATOM 1072 OG1 THR A 118 -8.165 -9.582 -7.776 1.00 0.00 O ATOM 1073 CG2 THR A 118 -5.901 -9.534 -7.149 1.00 0.00 C ATOM 0 H THR A 118 -8.449 -8.209 -9.666 1.00 0.00 H new ATOM 0 HA THR A 118 -6.154 -8.000 -9.126 1.00 0.00 H new ATOM 0 HB THR A 118 -6.818 -10.889 -8.619 1.00 0.00 H new ATOM 0 HG1 THR A 118 -8.348 -10.171 -7.014 1.00 0.00 H new ATOM 0 HG21 THR A 118 -6.133 -10.157 -6.285 1.00 0.00 H new ATOM 0 HG22 THR A 118 -4.880 -9.733 -7.476 1.00 0.00 H new ATOM 0 HG23 THR A 118 -5.996 -8.483 -6.875 1.00 0.00 H new ATOM 1081 N PRO A 119 -4.151 -8.915 -10.356 1.00 0.00 N ATOM 1082 CA PRO A 119 -3.127 -9.203 -11.372 1.00 0.00 C ATOM 1083 C PRO A 119 -2.304 -10.484 -11.102 1.00 0.00 C ATOM 1084 O PRO A 119 -1.549 -10.921 -11.967 1.00 0.00 O ATOM 1085 CB PRO A 119 -2.223 -7.950 -11.415 1.00 0.00 C ATOM 1086 CG PRO A 119 -2.853 -6.948 -10.447 1.00 0.00 C ATOM 1087 CD PRO A 119 -3.613 -7.865 -9.507 1.00 0.00 C ATOM 0 HA PRO A 119 -3.608 -9.406 -12.329 1.00 0.00 H new ATOM 0 HB2 PRO A 119 -1.203 -8.193 -11.117 1.00 0.00 H new ATOM 0 HB3 PRO A 119 -2.171 -7.540 -12.424 1.00 0.00 H new ATOM 0 HG2 PRO A 119 -2.102 -6.357 -9.924 1.00 0.00 H new ATOM 0 HG3 PRO A 119 -3.513 -6.246 -10.957 1.00 0.00 H new ATOM 0 HD2 PRO A 119 -2.956 -8.276 -8.740 1.00 0.00 H new ATOM 0 HD3 PRO A 119 -4.409 -7.329 -8.991 1.00 0.00 H new ATOM 1095 N VAL A 120 -2.492 -11.092 -9.920 1.00 0.00 N ATOM 1096 CA VAL A 120 -1.933 -12.349 -9.384 1.00 0.00 C ATOM 1097 C VAL A 120 -0.401 -12.363 -9.258 1.00 0.00 C ATOM 1098 O VAL A 120 0.332 -12.416 -10.245 1.00 0.00 O ATOM 1099 CB VAL A 120 -2.481 -13.580 -10.127 1.00 0.00 C ATOM 1100 CG1 VAL A 120 -2.317 -14.840 -9.278 1.00 0.00 C ATOM 1101 CG2 VAL A 120 -3.978 -13.433 -10.398 1.00 0.00 C ATOM 0 H VAL A 120 -3.114 -10.665 -9.233 1.00 0.00 H new ATOM 0 HA VAL A 120 -2.286 -12.406 -8.354 1.00 0.00 H new ATOM 0 HB VAL A 120 -1.922 -13.658 -11.060 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -2.711 -15.699 -9.822 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -1.260 -14.999 -9.064 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -2.863 -14.722 -8.342 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -4.341 -14.316 -10.924 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -4.510 -13.329 -9.453 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -4.152 -12.549 -11.011 1.00 0.00 H new ATOM 1111 N LEU A 121 0.096 -12.298 -8.017 1.00 0.00 N ATOM 1112 CA LEU A 121 1.515 -12.066 -7.717 1.00 0.00 C ATOM 1113 C LEU A 121 2.388 -13.301 -8.021 1.00 0.00 C ATOM 1114 O LEU A 121 3.385 -13.225 -8.742 1.00 0.00 O ATOM 1115 CB LEU A 121 1.636 -11.657 -6.230 1.00 0.00 C ATOM 1116 CG LEU A 121 3.065 -11.285 -5.822 1.00 0.00 C ATOM 1117 CD1 LEU A 121 3.377 -9.849 -6.265 1.00 0.00 C ATOM 1118 CD2 LEU A 121 3.184 -11.428 -4.307 1.00 0.00 C ATOM 0 H LEU A 121 -0.482 -12.406 -7.183 1.00 0.00 H new ATOM 0 HA LEU A 121 1.885 -11.268 -8.361 1.00 0.00 H new ATOM 0 HB2 LEU A 121 0.978 -10.810 -6.038 1.00 0.00 H new ATOM 0 HB3 LEU A 121 1.288 -12.479 -5.604 1.00 0.00 H new ATOM 0 HG LEU A 121 3.784 -11.946 -6.305 1.00 0.00 H new ATOM 0 HD11 LEU A 121 4.395 -9.591 -5.972 1.00 0.00 H new ATOM 0 HD12 LEU A 121 3.281 -9.773 -7.348 1.00 0.00 H new ATOM 0 HD13 LEU A 121 2.677 -9.162 -5.790 1.00 0.00 H new ATOM 0 HD21 LEU A 121 4.195 -11.167 -3.995 1.00 0.00 H new ATOM 0 HD22 LEU A 121 2.471 -10.761 -3.822 1.00 0.00 H new ATOM 0 HD23 LEU A 121 2.970 -12.458 -4.021 1.00 0.00 H new ATOM 1130 N ARG A 122 2.014 -14.427 -7.403 1.00 0.00 N ATOM 1131 CA ARG A 122 2.821 -15.645 -7.183 1.00 0.00 C ATOM 1132 C ARG A 122 2.152 -16.927 -7.708 1.00 0.00 C ATOM 1133 O ARG A 122 2.740 -18.007 -7.660 1.00 0.00 O ATOM 1134 CB ARG A 122 3.146 -15.636 -5.671 1.00 0.00 C ATOM 1135 CG ARG A 122 3.816 -16.880 -5.062 1.00 0.00 C ATOM 1136 CD ARG A 122 2.771 -17.870 -4.527 1.00 0.00 C ATOM 1137 NE ARG A 122 3.394 -18.949 -3.739 1.00 0.00 N ATOM 1138 CZ ARG A 122 2.782 -19.956 -3.140 1.00 0.00 C ATOM 1139 NH1 ARG A 122 1.489 -20.121 -3.200 1.00 0.00 N ATOM 1140 NH2 ARG A 122 3.467 -20.832 -2.460 1.00 0.00 N ATOM 0 H ARG A 122 1.076 -14.524 -7.015 1.00 0.00 H new ATOM 0 HA ARG A 122 3.742 -15.641 -7.766 1.00 0.00 H new ATOM 0 HB2 ARG A 122 3.792 -14.781 -5.475 1.00 0.00 H new ATOM 0 HB3 ARG A 122 2.215 -15.462 -5.132 1.00 0.00 H new ATOM 0 HG2 ARG A 122 4.432 -17.370 -5.816 1.00 0.00 H new ATOM 0 HG3 ARG A 122 4.482 -16.578 -4.253 1.00 0.00 H new ATOM 0 HD2 ARG A 122 2.049 -17.338 -3.908 1.00 0.00 H new ATOM 0 HD3 ARG A 122 2.218 -18.302 -5.361 1.00 0.00 H new ATOM 0 HE ARG A 122 4.409 -18.915 -3.646 1.00 0.00 H new ATOM 0 HH11 ARG A 122 0.914 -19.460 -3.723 1.00 0.00 H new ATOM 0 HH12 ARG A 122 1.053 -20.911 -2.724 1.00 0.00 H new ATOM 0 HH21 ARG A 122 4.481 -20.742 -2.388 1.00 0.00 H new ATOM 0 HH22 ARG A 122 2.990 -21.607 -2.000 1.00 0.00 H new ATOM 1154 N GLY A 123 0.915 -16.818 -8.193 1.00 0.00 N ATOM 1155 CA GLY A 123 -0.104 -17.877 -8.111 1.00 0.00 C ATOM 1156 C GLY A 123 -1.102 -17.644 -6.963 1.00 0.00 C ATOM 1157 O GLY A 123 -1.828 -18.557 -6.573 1.00 0.00 O ATOM 0 H GLY A 123 0.582 -15.977 -8.664 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -0.646 -17.929 -9.055 1.00 0.00 H new ATOM 0 HA3 GLY A 123 0.387 -18.840 -7.972 1.00 0.00 H new ATOM 1161 N GLN A 124 -1.113 -16.430 -6.394 1.00 0.00 N ATOM 1162 CA GLN A 124 -1.921 -15.962 -5.276 1.00 0.00 C ATOM 1163 C GLN A 124 -2.416 -14.526 -5.570 1.00 0.00 C ATOM 1164 O GLN A 124 -1.668 -13.761 -6.195 1.00 0.00 O ATOM 1165 CB GLN A 124 -1.046 -16.023 -4.019 1.00 0.00 C ATOM 1166 CG GLN A 124 -1.811 -15.674 -2.741 1.00 0.00 C ATOM 1167 CD GLN A 124 -0.967 -15.936 -1.500 1.00 0.00 C ATOM 1168 OE1 GLN A 124 -0.320 -15.055 -0.946 1.00 0.00 O ATOM 1169 NE2 GLN A 124 -0.931 -17.162 -1.018 1.00 0.00 N ATOM 0 H GLN A 124 -0.500 -15.692 -6.740 1.00 0.00 H new ATOM 0 HA GLN A 124 -2.804 -16.583 -5.125 1.00 0.00 H new ATOM 0 HB2 GLN A 124 -0.627 -17.025 -3.923 1.00 0.00 H new ATOM 0 HB3 GLN A 124 -0.207 -15.336 -4.133 1.00 0.00 H new ATOM 0 HG2 GLN A 124 -2.107 -14.625 -2.767 1.00 0.00 H new ATOM 0 HG3 GLN A 124 -2.727 -16.263 -2.691 1.00 0.00 H new ATOM 0 HE21 GLN A 124 -1.465 -17.904 -1.470 1.00 0.00 H new ATOM 0 HE22 GLN A 124 -0.369 -17.369 -0.192 1.00 0.00 H new ATOM 1178 N PRO A 125 -3.641 -14.142 -5.151 1.00 0.00 N ATOM 1179 CA PRO A 125 -4.175 -12.787 -5.313 1.00 0.00 C ATOM 1180 C PRO A 125 -3.307 -11.690 -4.674 1.00 0.00 C ATOM 1181 O PRO A 125 -2.399 -11.964 -3.886 1.00 0.00 O ATOM 1182 CB PRO A 125 -5.576 -12.817 -4.683 1.00 0.00 C ATOM 1183 CG PRO A 125 -5.982 -14.283 -4.774 1.00 0.00 C ATOM 1184 CD PRO A 125 -4.651 -14.996 -4.543 1.00 0.00 C ATOM 0 HA PRO A 125 -4.194 -12.526 -6.371 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -5.558 -12.470 -3.650 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -6.272 -12.175 -5.223 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -6.723 -14.549 -4.020 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -6.413 -14.528 -5.745 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -4.459 -15.134 -3.479 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -4.653 -15.987 -4.998 1.00 0.00 H new ATOM 1192 N ILE A 126 -3.621 -10.429 -4.984 1.00 0.00 N ATOM 1193 CA ILE A 126 -2.889 -9.234 -4.521 1.00 0.00 C ATOM 1194 C ILE A 126 -3.851 -8.270 -3.833 1.00 0.00 C ATOM 1195 O ILE A 126 -5.047 -8.230 -4.118 1.00 0.00 O ATOM 1196 CB ILE A 126 -2.078 -8.523 -5.629 1.00 0.00 C ATOM 1197 CG1 ILE A 126 -1.759 -9.473 -6.800 1.00 0.00 C ATOM 1198 CG2 ILE A 126 -0.800 -7.920 -5.000 1.00 0.00 C ATOM 1199 CD1 ILE A 126 -0.696 -8.972 -7.759 1.00 0.00 C ATOM 0 H ILE A 126 -4.415 -10.198 -5.582 1.00 0.00 H new ATOM 0 HA ILE A 126 -2.145 -9.583 -3.805 1.00 0.00 H new ATOM 0 HB ILE A 126 -2.675 -7.717 -6.056 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -1.438 -10.432 -6.393 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -2.676 -9.656 -7.360 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -0.218 -7.415 -5.771 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -1.078 -7.203 -4.228 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -0.202 -8.716 -4.557 1.00 0.00 H new ATOM 0 HD11 ILE A 126 -0.541 -9.708 -8.548 1.00 0.00 H new ATOM 0 HD12 ILE A 126 -1.020 -8.029 -8.201 1.00 0.00 H new ATOM 0 HD13 ILE A 126 0.238 -8.818 -7.219 1.00 0.00 H new ATOM 1211 N TYR A 127 -3.315 -7.534 -2.868 1.00 0.00 N ATOM 1212 CA TYR A 127 -4.070 -6.988 -1.746 1.00 0.00 C ATOM 1213 C TYR A 127 -3.945 -5.458 -1.743 1.00 0.00 C ATOM 1214 O TYR A 127 -2.915 -4.931 -1.324 1.00 0.00 O ATOM 1215 CB TYR A 127 -3.519 -7.571 -0.435 1.00 0.00 C ATOM 1216 CG TYR A 127 -3.776 -9.017 -0.043 1.00 0.00 C ATOM 1217 CD1 TYR A 127 -3.687 -10.090 -0.958 1.00 0.00 C ATOM 1218 CD2 TYR A 127 -3.990 -9.294 1.325 1.00 0.00 C ATOM 1219 CE1 TYR A 127 -3.907 -11.412 -0.520 1.00 0.00 C ATOM 1220 CE2 TYR A 127 -4.219 -10.607 1.760 1.00 0.00 C ATOM 1221 CZ TYR A 127 -4.194 -11.675 0.838 1.00 0.00 C ATOM 1222 OH TYR A 127 -4.388 -12.950 1.278 1.00 0.00 O ATOM 0 H TYR A 127 -2.324 -7.295 -2.842 1.00 0.00 H new ATOM 0 HA TYR A 127 -5.123 -7.255 -1.840 1.00 0.00 H new ATOM 0 HB2 TYR A 127 -2.438 -7.435 -0.457 1.00 0.00 H new ATOM 0 HB3 TYR A 127 -3.902 -6.950 0.375 1.00 0.00 H new ATOM 0 HD1 TYR A 127 -3.450 -9.897 -1.994 1.00 0.00 H new ATOM 0 HD2 TYR A 127 -3.977 -8.487 2.043 1.00 0.00 H new ATOM 0 HE1 TYR A 127 -3.856 -12.228 -1.226 1.00 0.00 H new ATOM 0 HE2 TYR A 127 -4.415 -10.802 2.804 1.00 0.00 H new ATOM 0 HH TYR A 127 -4.573 -12.939 2.240 1.00 0.00 H new ATOM 1232 N ILE A 128 -4.961 -4.736 -2.220 1.00 0.00 N ATOM 1233 CA ILE A 128 -4.965 -3.273 -2.323 1.00 0.00 C ATOM 1234 C ILE A 128 -6.075 -2.623 -1.488 1.00 0.00 C ATOM 1235 O ILE A 128 -7.160 -3.187 -1.335 1.00 0.00 O ATOM 1236 CB ILE A 128 -5.008 -2.881 -3.826 1.00 0.00 C ATOM 1237 CG1 ILE A 128 -3.725 -2.093 -4.126 1.00 0.00 C ATOM 1238 CG2 ILE A 128 -6.284 -2.117 -4.252 1.00 0.00 C ATOM 1239 CD1 ILE A 128 -3.546 -1.714 -5.599 1.00 0.00 C ATOM 0 H ILE A 128 -5.826 -5.162 -2.554 1.00 0.00 H new ATOM 0 HA ILE A 128 -4.046 -2.878 -1.890 1.00 0.00 H new ATOM 0 HB ILE A 128 -5.054 -3.791 -4.424 1.00 0.00 H new ATOM 0 HG12 ILE A 128 -3.723 -1.183 -3.526 1.00 0.00 H new ATOM 0 HG13 ILE A 128 -2.867 -2.685 -3.809 1.00 0.00 H new ATOM 0 HG21 ILE A 128 -6.230 -1.883 -5.315 1.00 0.00 H new ATOM 0 HG22 ILE A 128 -7.160 -2.737 -4.061 1.00 0.00 H new ATOM 0 HG23 ILE A 128 -6.362 -1.192 -3.681 1.00 0.00 H new ATOM 0 HD11 ILE A 128 -2.615 -1.160 -5.722 1.00 0.00 H new ATOM 0 HD12 ILE A 128 -3.513 -2.619 -6.206 1.00 0.00 H new ATOM 0 HD13 ILE A 128 -4.383 -1.093 -5.919 1.00 0.00 H new ATOM 1251 N GLN A 129 -5.818 -1.396 -1.025 1.00 0.00 N ATOM 1252 CA GLN A 129 -6.805 -0.355 -0.685 1.00 0.00 C ATOM 1253 C GLN A 129 -6.159 1.028 -0.866 1.00 0.00 C ATOM 1254 O GLN A 129 -4.935 1.143 -0.880 1.00 0.00 O ATOM 1255 CB GLN A 129 -7.292 -0.511 0.774 1.00 0.00 C ATOM 1256 CG GLN A 129 -8.663 -1.196 0.888 1.00 0.00 C ATOM 1257 CD GLN A 129 -9.008 -1.530 2.335 1.00 0.00 C ATOM 1258 OE1 GLN A 129 -8.507 -2.491 2.906 1.00 0.00 O ATOM 1259 NE2 GLN A 129 -9.861 -0.769 2.984 1.00 0.00 N ATOM 0 H GLN A 129 -4.861 -1.080 -0.867 1.00 0.00 H new ATOM 0 HA GLN A 129 -7.665 -0.458 -1.346 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -6.557 -1.089 1.335 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -7.346 0.473 1.239 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -9.431 -0.544 0.472 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -8.664 -2.110 0.293 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -10.285 0.034 2.519 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -10.099 -0.981 3.953 1.00 0.00 H new ATOM 1268 N PHE A 130 -6.957 2.094 -0.935 1.00 0.00 N ATOM 1269 CA PHE A 130 -6.443 3.461 -0.782 1.00 0.00 C ATOM 1270 C PHE A 130 -5.624 3.630 0.511 1.00 0.00 C ATOM 1271 O PHE A 130 -5.856 2.958 1.522 1.00 0.00 O ATOM 1272 CB PHE A 130 -7.600 4.468 -0.783 1.00 0.00 C ATOM 1273 CG PHE A 130 -7.946 5.096 -2.119 1.00 0.00 C ATOM 1274 CD1 PHE A 130 -6.951 5.719 -2.895 1.00 0.00 C ATOM 1275 CD2 PHE A 130 -9.283 5.131 -2.545 1.00 0.00 C ATOM 1276 CE1 PHE A 130 -7.287 6.344 -4.106 1.00 0.00 C ATOM 1277 CE2 PHE A 130 -9.619 5.756 -3.759 1.00 0.00 C ATOM 1278 CZ PHE A 130 -8.624 6.368 -4.539 1.00 0.00 C ATOM 0 H PHE A 130 -7.963 2.040 -1.096 1.00 0.00 H new ATOM 0 HA PHE A 130 -5.783 3.651 -1.629 1.00 0.00 H new ATOM 0 HB2 PHE A 130 -8.489 3.967 -0.400 1.00 0.00 H new ATOM 0 HB3 PHE A 130 -7.358 5.267 -0.082 1.00 0.00 H new ATOM 0 HD1 PHE A 130 -5.925 5.716 -2.557 1.00 0.00 H new ATOM 0 HD2 PHE A 130 -10.054 4.678 -1.940 1.00 0.00 H new ATOM 0 HE1 PHE A 130 -6.517 6.807 -4.706 1.00 0.00 H new ATOM 0 HE2 PHE A 130 -10.646 5.766 -4.093 1.00 0.00 H new ATOM 0 HZ PHE A 130 -8.885 6.855 -5.467 1.00 0.00 H new ATOM 1288 N SER A 131 -4.671 4.563 0.482 1.00 0.00 N ATOM 1289 CA SER A 131 -3.861 4.907 1.645 1.00 0.00 C ATOM 1290 C SER A 131 -4.670 5.676 2.706 1.00 0.00 C ATOM 1291 O SER A 131 -5.658 6.354 2.403 1.00 0.00 O ATOM 1292 CB SER A 131 -2.613 5.674 1.203 1.00 0.00 C ATOM 1293 OG SER A 131 -1.859 6.124 2.301 1.00 0.00 O ATOM 0 H SER A 131 -4.441 5.101 -0.353 1.00 0.00 H new ATOM 0 HA SER A 131 -3.541 3.983 2.125 1.00 0.00 H new ATOM 0 HB2 SER A 131 -1.994 5.031 0.577 1.00 0.00 H new ATOM 0 HB3 SER A 131 -2.908 6.526 0.591 1.00 0.00 H new ATOM 0 HG SER A 131 -0.995 6.465 1.987 1.00 0.00 H new ATOM 1299 N ASN A 132 -4.218 5.614 3.960 1.00 0.00 N ATOM 1300 CA ASN A 132 -4.623 6.509 5.048 1.00 0.00 C ATOM 1301 C ASN A 132 -4.115 7.957 4.866 1.00 0.00 C ATOM 1302 O ASN A 132 -4.499 8.846 5.629 1.00 0.00 O ATOM 1303 CB ASN A 132 -4.110 5.930 6.376 1.00 0.00 C ATOM 1304 CG ASN A 132 -4.695 4.570 6.717 1.00 0.00 C ATOM 1305 OD1 ASN A 132 -5.876 4.298 6.541 1.00 0.00 O ATOM 1306 ND2 ASN A 132 -3.895 3.680 7.257 1.00 0.00 N ATOM 0 H ASN A 132 -3.537 4.916 4.257 1.00 0.00 H new ATOM 0 HA ASN A 132 -5.711 6.567 5.043 1.00 0.00 H new ATOM 0 HB2 ASN A 132 -3.024 5.847 6.330 1.00 0.00 H new ATOM 0 HB3 ASN A 132 -4.343 6.628 7.180 1.00 0.00 H new ATOM 0 HD21 ASN A 132 -4.258 2.766 7.528 1.00 0.00 H new ATOM 0 HD22 ASN A 132 -2.911 3.902 7.405 1.00 0.00 H new ATOM 1313 N HIS A 133 -3.260 8.200 3.867 1.00 0.00 N ATOM 1314 CA HIS A 133 -2.602 9.468 3.550 1.00 0.00 C ATOM 1315 C HIS A 133 -2.988 9.951 2.133 1.00 0.00 C ATOM 1316 O HIS A 133 -3.740 9.283 1.415 1.00 0.00 O ATOM 1317 CB HIS A 133 -1.080 9.300 3.726 1.00 0.00 C ATOM 1318 CG HIS A 133 -0.680 8.533 4.970 1.00 0.00 C ATOM 1319 ND1 HIS A 133 -0.679 8.988 6.273 1.00 0.00 N ATOM 1320 CD2 HIS A 133 -0.313 7.217 5.001 1.00 0.00 C ATOM 1321 CE1 HIS A 133 -0.312 7.962 7.066 1.00 0.00 C ATOM 1322 NE2 HIS A 133 -0.066 6.868 6.329 1.00 0.00 N ATOM 0 H HIS A 133 -2.992 7.463 3.214 1.00 0.00 H new ATOM 0 HA HIS A 133 -2.940 10.245 4.236 1.00 0.00 H new ATOM 0 HB2 HIS A 133 -0.679 8.787 2.852 1.00 0.00 H new ATOM 0 HB3 HIS A 133 -0.618 10.287 3.757 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -0.229 6.562 4.147 1.00 0.00 H new ATOM 0 HE1 HIS A 133 -0.228 8.013 8.142 1.00 0.00 H new ATOM 0 HE2 HIS A 133 0.242 5.958 6.673 1.00 0.00 H new ATOM 1330 N LYS A 134 -2.489 11.129 1.725 1.00 0.00 N ATOM 1331 CA LYS A 134 -2.949 11.878 0.529 1.00 0.00 C ATOM 1332 C LYS A 134 -1.871 12.118 -0.544 1.00 0.00 C ATOM 1333 O LYS A 134 -2.135 12.796 -1.531 1.00 0.00 O ATOM 1334 CB LYS A 134 -3.621 13.191 0.984 1.00 0.00 C ATOM 1335 CG LYS A 134 -4.897 12.920 1.803 1.00 0.00 C ATOM 1336 CD LYS A 134 -5.792 14.153 2.017 1.00 0.00 C ATOM 1337 CE LYS A 134 -5.174 15.248 2.904 1.00 0.00 C ATOM 1338 NZ LYS A 134 -4.402 16.257 2.127 1.00 0.00 N ATOM 0 H LYS A 134 -1.737 11.604 2.224 1.00 0.00 H new ATOM 0 HA LYS A 134 -3.675 11.244 0.019 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -2.919 13.771 1.584 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -3.869 13.795 0.111 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -5.479 12.147 1.300 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -4.611 12.521 2.776 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -6.032 14.584 1.045 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -6.732 13.830 2.464 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -5.967 15.752 3.456 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -4.518 14.784 3.640 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -3.583 16.572 2.685 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -4.072 15.832 1.237 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -5.011 17.073 1.916 1.00 0.00 H new ATOM 1352 N GLU A 135 -0.682 11.537 -0.360 1.00 0.00 N ATOM 1353 CA GLU A 135 0.557 11.585 -1.164 1.00 0.00 C ATOM 1354 C GLU A 135 1.779 11.118 -0.338 1.00 0.00 C ATOM 1355 O GLU A 135 1.708 11.024 0.891 1.00 0.00 O ATOM 1356 CB GLU A 135 0.844 12.964 -1.802 1.00 0.00 C ATOM 1357 CG GLU A 135 0.970 14.138 -0.813 1.00 0.00 C ATOM 1358 CD GLU A 135 1.335 15.470 -1.506 1.00 0.00 C ATOM 1359 OE1 GLU A 135 1.065 15.632 -2.724 1.00 0.00 O ATOM 1360 OE2 GLU A 135 1.871 16.372 -0.817 1.00 0.00 O ATOM 0 H GLU A 135 -0.541 10.945 0.459 1.00 0.00 H new ATOM 0 HA GLU A 135 0.387 10.894 -1.989 1.00 0.00 H new ATOM 0 HB2 GLU A 135 1.768 12.894 -2.376 1.00 0.00 H new ATOM 0 HB3 GLU A 135 0.046 13.191 -2.509 1.00 0.00 H new ATOM 0 HG2 GLU A 135 0.028 14.259 -0.278 1.00 0.00 H new ATOM 0 HG3 GLU A 135 1.731 13.900 -0.070 1.00 0.00 H new ATOM 1367 N LEU A 136 2.915 10.864 -0.999 1.00 0.00 N ATOM 1368 CA LEU A 136 4.237 10.866 -0.371 1.00 0.00 C ATOM 1369 C LEU A 136 4.674 12.315 -0.101 1.00 0.00 C ATOM 1370 O LEU A 136 4.384 13.219 -0.892 1.00 0.00 O ATOM 1371 CB LEU A 136 5.284 10.190 -1.292 1.00 0.00 C ATOM 1372 CG LEU A 136 5.468 8.664 -1.188 1.00 0.00 C ATOM 1373 CD1 LEU A 136 5.734 8.207 0.236 1.00 0.00 C ATOM 1374 CD2 LEU A 136 4.301 7.859 -1.732 1.00 0.00 C ATOM 0 H LEU A 136 2.940 10.649 -1.996 1.00 0.00 H new ATOM 0 HA LEU A 136 4.175 10.309 0.564 1.00 0.00 H new ATOM 0 HB2 LEU A 136 5.020 10.424 -2.323 1.00 0.00 H new ATOM 0 HB3 LEU A 136 6.250 10.656 -1.096 1.00 0.00 H new ATOM 0 HG LEU A 136 6.339 8.469 -1.813 1.00 0.00 H new ATOM 0 HD11 LEU A 136 5.856 7.124 0.254 1.00 0.00 H new ATOM 0 HD12 LEU A 136 6.643 8.681 0.606 1.00 0.00 H new ATOM 0 HD13 LEU A 136 4.894 8.488 0.871 1.00 0.00 H new ATOM 0 HD21 LEU A 136 4.510 6.795 -1.621 1.00 0.00 H new ATOM 0 HD22 LEU A 136 3.396 8.111 -1.179 1.00 0.00 H new ATOM 0 HD23 LEU A 136 4.158 8.093 -2.787 1.00 0.00 H new ATOM 1386 N LYS A 137 5.433 12.526 0.976 1.00 0.00 N ATOM 1387 CA LYS A 137 6.062 13.810 1.315 1.00 0.00 C ATOM 1388 C LYS A 137 7.471 13.587 1.869 1.00 0.00 C ATOM 1389 O LYS A 137 7.745 13.732 3.060 1.00 0.00 O ATOM 1390 CB LYS A 137 5.105 14.630 2.207 1.00 0.00 C ATOM 1391 CG LYS A 137 5.193 16.134 1.897 1.00 0.00 C ATOM 1392 CD LYS A 137 3.982 16.884 2.478 1.00 0.00 C ATOM 1393 CE LYS A 137 3.781 18.286 1.890 1.00 0.00 C ATOM 1394 NZ LYS A 137 3.480 18.249 0.431 1.00 0.00 N ATOM 0 H LYS A 137 5.634 11.792 1.655 1.00 0.00 H new ATOM 0 HA LYS A 137 6.221 14.422 0.427 1.00 0.00 H new ATOM 0 HB2 LYS A 137 4.082 14.286 2.057 1.00 0.00 H new ATOM 0 HB3 LYS A 137 5.348 14.459 3.256 1.00 0.00 H new ATOM 0 HG2 LYS A 137 6.114 16.542 2.314 1.00 0.00 H new ATOM 0 HG3 LYS A 137 5.237 16.286 0.818 1.00 0.00 H new ATOM 0 HD2 LYS A 137 3.083 16.294 2.302 1.00 0.00 H new ATOM 0 HD3 LYS A 137 4.102 16.967 3.558 1.00 0.00 H new ATOM 0 HE2 LYS A 137 2.966 18.784 2.415 1.00 0.00 H new ATOM 0 HE3 LYS A 137 4.679 18.881 2.059 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 2.997 19.127 0.154 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 4.367 18.157 -0.104 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 2.865 17.436 0.224 1.00 0.00 H new