USER MOD reduce.3.24.130724 H: found=0, std=0, add=1040, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1034 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 117 HIS : no HE2:sc= -11.2! C(o=-11!,f=-17!) USER MOD Set 1.2: A 129 LYS NZ :NH3+ -167:sc= -0.0165 (180deg=0) USER MOD Set 2.1: A 91 CYS SG : rot -80:sc= -9.74! USER MOD Set 2.2: A 132 GLN :FLIP amide:sc= -7.62! C(o=-21!,f=-17!) USER MOD Set 3.1: A 42 CYS SG : rot 75:sc= 0.673 USER MOD Set 3.2: A 69 CYS SG : rot -137:sc= -0.936 USER MOD Set 3.3: A 72 CYS SG : rot -130:sc= -0.888 USER MOD Single : A 8 THR OG1 : rot 27:sc= 0.197 USER MOD Single : A 11 GLN : amide:sc= -0.137 K(o=-0.14,f=-1.2!) USER MOD Single : A 14 GLN : amide:sc= -0.118 K(o=-0.12,f=-0.78) USER MOD Single : A 15 SER OG : rot 70:sc= -2.66 USER MOD Single : A 22 ASN :FLIP amide:sc= -0.576 F(o=-2.1!,f=-0.58) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot -25:sc= 0.186 USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 46 HIS :FLIP no HE2:sc= -1.9 F(o=-4.4!,f=-1.9) USER MOD Single : A 51 ASN : amide:sc= -2.28 X(o=-2.3,f=-2.2) USER MOD Single : A 53 SER OG : rot 180:sc= -1.32 USER MOD Single : A 55 TYR OH : rot 180:sc= -0.57 USER MOD Single : A 57 ASN : amide:sc= -3.28! C(o=-3.3!,f=-18!) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 GLN : amide:sc=-0.00245 X(o=-0.0025,f=0) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 ASN :FLIP amide:sc= -6.11! C(o=-9.5!,f=-6.1!) USER MOD Single : A 81 GLN : amide:sc= -0.0181 K(o=-0.018,f=-0.94) USER MOD Single : A 82 HIS : no HD1:sc= -0.0737 X(o=-0.074,f=0) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0.00312 USER MOD Single : A 89 HIS : no HE2:sc= -0.037 K(o=-0.037,f=-0.57) USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 THR OG1 : rot -128:sc= -1.37! USER MOD Single : A 108 GLN : amide:sc= -0.098 X(o=-0.098,f=0) USER MOD Single : A 111 MET CE :methyl 157:sc= -15.8! (180deg=-20.4!) USER MOD Single : A 112 SER OG : rot 180:sc= 0.158 USER MOD Single : A 115 HIS : no HD1:sc= -0.822 X(o=-0.82,f=-0.94) USER MOD Single : A 121 LYS NZ :NH3+ -155:sc= 1.1 (180deg=0.949) USER MOD Single : A 123 THR OG1 : rot 180:sc= -0.039 USER MOD Single : A 124 THR OG1 : rot -176:sc= 0.241 USER MOD Single : A 126 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 127 THR OG1 : rot -57:sc= -0.624! USER MOD Single : A 133 GLN : amide:sc= -0.67 K(o=-0.67,f=-14!) USER MOD ----------------------------------------------------------------- ATOM 118 N THR A 8 8.406 15.126 19.239 1.00 0.00 N ATOM 119 CA THR A 8 7.349 15.781 18.460 1.00 0.00 C ATOM 120 C THR A 8 7.748 17.234 18.250 1.00 0.00 C ATOM 121 O THR A 8 7.141 18.139 18.808 1.00 0.00 O ATOM 122 CB THR A 8 6.093 15.677 19.322 1.00 0.00 C ATOM 123 OG1 THR A 8 5.796 14.308 19.561 1.00 0.00 O ATOM 124 CG2 THR A 8 4.915 16.341 18.606 1.00 0.00 C ATOM 0 HA THR A 8 7.185 15.330 17.481 1.00 0.00 H new ATOM 0 HB THR A 8 6.265 16.184 20.272 1.00 0.00 H new ATOM 0 HG1 THR A 8 6.621 13.782 19.517 1.00 0.00 H new ATOM 0 HG21 THR A 8 4.022 16.263 19.226 1.00 0.00 H new ATOM 0 HG22 THR A 8 5.143 17.392 18.428 1.00 0.00 H new ATOM 0 HG23 THR A 8 4.740 15.841 17.653 1.00 0.00 H new ATOM 132 N ASP A 9 8.783 17.471 17.477 1.00 0.00 N ATOM 133 CA ASP A 9 9.255 18.880 17.252 1.00 0.00 C ATOM 134 C ASP A 9 8.070 19.839 17.121 1.00 0.00 C ATOM 135 O ASP A 9 8.139 20.992 17.542 1.00 0.00 O ATOM 136 CB ASP A 9 10.066 18.859 15.950 1.00 0.00 C ATOM 137 CG ASP A 9 9.284 18.158 14.831 1.00 0.00 C ATOM 138 OD1 ASP A 9 8.137 17.806 15.054 1.00 0.00 O ATOM 139 OD2 ASP A 9 9.850 17.985 13.763 1.00 0.00 O ATOM 0 H ASP A 9 9.321 16.753 16.992 1.00 0.00 H new ATOM 0 HA ASP A 9 9.855 19.228 18.093 1.00 0.00 H new ATOM 0 HB2 ASP A 9 10.305 19.879 15.649 1.00 0.00 H new ATOM 0 HB3 ASP A 9 11.013 18.345 16.115 1.00 0.00 H new ATOM 144 N ASP A 10 6.972 19.381 16.585 1.00 0.00 N ATOM 145 CA ASP A 10 5.787 20.238 16.473 1.00 0.00 C ATOM 146 C ASP A 10 5.353 20.682 17.864 1.00 0.00 C ATOM 147 O ASP A 10 5.255 21.879 18.159 1.00 0.00 O ATOM 148 CB ASP A 10 4.754 19.329 15.826 1.00 0.00 C ATOM 149 CG ASP A 10 4.996 19.263 14.318 1.00 0.00 C ATOM 150 OD1 ASP A 10 6.133 19.052 13.929 1.00 0.00 O ATOM 151 OD2 ASP A 10 4.040 19.425 13.577 1.00 0.00 O ATOM 0 H ASP A 10 6.857 18.436 16.219 1.00 0.00 H new ATOM 0 HA ASP A 10 5.947 21.149 15.896 1.00 0.00 H new ATOM 0 HB2 ASP A 10 4.814 18.330 16.257 1.00 0.00 H new ATOM 0 HB3 ASP A 10 3.750 19.703 16.027 1.00 0.00 H new ATOM 156 N GLN A 11 5.123 19.754 18.752 1.00 0.00 N ATOM 157 CA GLN A 11 4.738 20.188 20.107 1.00 0.00 C ATOM 158 C GLN A 11 5.980 20.648 20.847 1.00 0.00 C ATOM 159 O GLN A 11 5.893 21.455 21.762 1.00 0.00 O ATOM 160 CB GLN A 11 4.093 19.019 20.826 1.00 0.00 C ATOM 161 CG GLN A 11 3.674 19.525 22.206 1.00 0.00 C ATOM 162 CD GLN A 11 2.149 19.494 22.333 1.00 0.00 C ATOM 163 OE1 GLN A 11 1.434 19.594 21.339 1.00 0.00 O ATOM 164 NE2 GLN A 11 1.610 19.360 23.514 1.00 0.00 N ATOM 0 H GLN A 11 5.184 18.747 18.599 1.00 0.00 H new ATOM 0 HA GLN A 11 4.029 21.014 20.061 1.00 0.00 H new ATOM 0 HB2 GLN A 11 3.230 18.652 20.270 1.00 0.00 H new ATOM 0 HB3 GLN A 11 4.792 18.187 20.915 1.00 0.00 H new ATOM 0 HG2 GLN A 11 4.125 18.906 22.982 1.00 0.00 H new ATOM 0 HG3 GLN A 11 4.039 20.541 22.357 1.00 0.00 H new ATOM 0 HE21 GLN A 11 2.204 19.277 24.339 1.00 0.00 H new ATOM 0 HE22 GLN A 11 0.595 19.338 23.612 1.00 0.00 H new ATOM 173 N ARG A 12 7.147 20.198 20.454 1.00 0.00 N ATOM 174 CA ARG A 12 8.357 20.689 21.128 1.00 0.00 C ATOM 175 C ARG A 12 8.298 22.192 20.991 1.00 0.00 C ATOM 176 O ARG A 12 8.533 22.940 21.938 1.00 0.00 O ATOM 177 CB ARG A 12 9.528 20.125 20.340 1.00 0.00 C ATOM 178 CG ARG A 12 9.693 18.595 20.534 1.00 0.00 C ATOM 179 CD ARG A 12 8.532 17.960 21.325 1.00 0.00 C ATOM 180 NE ARG A 12 8.722 18.393 22.739 1.00 0.00 N ATOM 181 CZ ARG A 12 7.705 18.418 23.570 1.00 0.00 C ATOM 182 NH1 ARG A 12 6.509 18.063 23.176 1.00 0.00 N ATOM 183 NH2 ARG A 12 7.887 18.799 24.804 1.00 0.00 N ATOM 0 H ARG A 12 7.299 19.522 19.705 1.00 0.00 H new ATOM 0 HA ARG A 12 8.447 20.404 22.176 1.00 0.00 H new ATOM 0 HB2 ARG A 12 9.386 20.340 19.281 1.00 0.00 H new ATOM 0 HB3 ARG A 12 10.445 20.628 20.648 1.00 0.00 H new ATOM 0 HG2 ARG A 12 9.765 18.116 19.557 1.00 0.00 H new ATOM 0 HG3 ARG A 12 10.630 18.399 21.055 1.00 0.00 H new ATOM 0 HD2 ARG A 12 7.568 18.293 20.940 1.00 0.00 H new ATOM 0 HD3 ARG A 12 8.550 16.873 21.243 1.00 0.00 H new ATOM 0 HE ARG A 12 9.648 18.672 23.063 1.00 0.00 H new ATOM 0 HH11 ARG A 12 6.358 17.762 22.213 1.00 0.00 H new ATOM 0 HH12 ARG A 12 5.728 18.087 23.832 1.00 0.00 H new ATOM 0 HH21 ARG A 12 8.816 19.076 25.120 1.00 0.00 H new ATOM 0 HH22 ARG A 12 7.100 18.820 25.453 1.00 0.00 H new ATOM 197 N TRP A 13 7.909 22.644 19.820 1.00 0.00 N ATOM 198 CA TRP A 13 7.751 24.090 19.620 1.00 0.00 C ATOM 199 C TRP A 13 6.673 24.566 20.571 1.00 0.00 C ATOM 200 O TRP A 13 6.805 25.602 21.215 1.00 0.00 O ATOM 201 CB TRP A 13 7.263 24.293 18.189 1.00 0.00 C ATOM 202 CG TRP A 13 7.163 25.765 17.960 1.00 0.00 C ATOM 203 CD1 TRP A 13 6.084 26.418 17.474 1.00 0.00 C ATOM 204 CD2 TRP A 13 8.154 26.780 18.257 1.00 0.00 C ATOM 205 NE1 TRP A 13 6.358 27.773 17.446 1.00 0.00 N ATOM 206 CE2 TRP A 13 7.624 28.046 17.921 1.00 0.00 C ATOM 207 CE3 TRP A 13 9.454 26.721 18.776 1.00 0.00 C ATOM 208 CZ2 TRP A 13 8.359 29.216 18.103 1.00 0.00 C ATOM 209 CZ3 TRP A 13 10.199 27.892 18.960 1.00 0.00 C ATOM 210 CH2 TRP A 13 9.655 29.140 18.627 1.00 0.00 C ATOM 0 H TRP A 13 7.699 22.064 19.008 1.00 0.00 H new ATOM 0 HA TRP A 13 8.681 24.631 19.795 1.00 0.00 H new ATOM 0 HB2 TRP A 13 7.955 23.840 17.479 1.00 0.00 H new ATOM 0 HB3 TRP A 13 6.295 23.814 18.041 1.00 0.00 H new ATOM 0 HD1 TRP A 13 5.159 25.957 17.159 1.00 0.00 H new ATOM 0 HE1 TRP A 13 5.705 28.483 17.115 1.00 0.00 H new ATOM 0 HE3 TRP A 13 9.885 25.765 19.036 1.00 0.00 H new ATOM 0 HZ2 TRP A 13 7.932 30.173 17.842 1.00 0.00 H new ATOM 0 HZ3 TRP A 13 11.200 27.833 19.361 1.00 0.00 H new ATOM 0 HH2 TRP A 13 10.234 30.040 18.774 1.00 0.00 H new ATOM 221 N GLN A 14 5.616 23.797 20.714 1.00 0.00 N ATOM 222 CA GLN A 14 4.570 24.219 21.677 1.00 0.00 C ATOM 223 C GLN A 14 5.226 24.270 23.059 1.00 0.00 C ATOM 224 O GLN A 14 4.885 25.088 23.901 1.00 0.00 O ATOM 225 CB GLN A 14 3.475 23.148 21.593 1.00 0.00 C ATOM 226 CG GLN A 14 2.455 23.354 22.716 1.00 0.00 C ATOM 227 CD GLN A 14 1.628 24.608 22.431 1.00 0.00 C ATOM 228 OE1 GLN A 14 1.579 25.525 23.247 1.00 0.00 O ATOM 229 NE2 GLN A 14 0.969 24.699 21.309 1.00 0.00 N ATOM 0 H GLN A 14 5.443 22.923 20.218 1.00 0.00 H new ATOM 0 HA GLN A 14 4.137 25.198 21.472 1.00 0.00 H new ATOM 0 HB2 GLN A 14 2.978 23.200 20.625 1.00 0.00 H new ATOM 0 HB3 GLN A 14 3.919 22.155 21.671 1.00 0.00 H new ATOM 0 HG2 GLN A 14 1.802 22.485 22.792 1.00 0.00 H new ATOM 0 HG3 GLN A 14 2.967 23.453 23.673 1.00 0.00 H new ATOM 0 HE21 GLN A 14 1.009 23.938 20.631 1.00 0.00 H new ATOM 0 HE22 GLN A 14 0.414 25.531 21.110 1.00 0.00 H new ATOM 238 N SER A 15 6.213 23.435 23.269 1.00 0.00 N ATOM 239 CA SER A 15 6.962 23.436 24.550 1.00 0.00 C ATOM 240 C SER A 15 7.848 24.671 24.588 1.00 0.00 C ATOM 241 O SER A 15 8.083 25.281 25.635 1.00 0.00 O ATOM 242 CB SER A 15 7.816 22.165 24.520 1.00 0.00 C ATOM 243 OG SER A 15 7.464 21.338 25.622 1.00 0.00 O ATOM 0 H SER A 15 6.532 22.743 22.591 1.00 0.00 H new ATOM 0 HA SER A 15 6.313 23.455 25.426 1.00 0.00 H new ATOM 0 HB2 SER A 15 7.659 21.629 23.584 1.00 0.00 H new ATOM 0 HB3 SER A 15 8.874 22.422 24.567 1.00 0.00 H new ATOM 0 HG SER A 15 6.567 20.970 25.481 1.00 0.00 H new ATOM 249 N VAL A 16 8.340 25.046 23.445 1.00 0.00 N ATOM 250 CA VAL A 16 9.227 26.226 23.361 1.00 0.00 C ATOM 251 C VAL A 16 8.464 27.498 23.593 1.00 0.00 C ATOM 252 O VAL A 16 8.961 28.470 24.159 1.00 0.00 O ATOM 253 CB VAL A 16 9.795 26.200 21.945 1.00 0.00 C ATOM 254 CG1 VAL A 16 10.791 27.329 21.786 1.00 0.00 C ATOM 255 CG2 VAL A 16 10.509 24.881 21.688 1.00 0.00 C ATOM 0 H VAL A 16 8.161 24.578 22.557 1.00 0.00 H new ATOM 0 HA VAL A 16 10.008 26.192 24.121 1.00 0.00 H new ATOM 0 HB VAL A 16 8.976 26.313 21.235 1.00 0.00 H new ATOM 0 HG11 VAL A 16 11.199 27.314 20.776 1.00 0.00 H new ATOM 0 HG12 VAL A 16 10.292 28.282 21.962 1.00 0.00 H new ATOM 0 HG13 VAL A 16 11.600 27.205 22.506 1.00 0.00 H new ATOM 0 HG21 VAL A 16 10.909 24.876 20.674 1.00 0.00 H new ATOM 0 HG22 VAL A 16 11.325 24.764 22.401 1.00 0.00 H new ATOM 0 HG23 VAL A 16 9.805 24.057 21.804 1.00 0.00 H new ATOM 265 N LEU A 17 7.281 27.500 23.154 1.00 0.00 N ATOM 266 CA LEU A 17 6.433 28.681 23.303 1.00 0.00 C ATOM 267 C LEU A 17 5.696 28.593 24.628 1.00 0.00 C ATOM 268 O LEU A 17 5.405 29.591 25.284 1.00 0.00 O ATOM 269 CB LEU A 17 5.487 28.544 22.131 1.00 0.00 C ATOM 270 CG LEU A 17 6.258 28.450 20.797 1.00 0.00 C ATOM 271 CD1 LEU A 17 5.500 29.226 19.735 1.00 0.00 C ATOM 272 CD2 LEU A 17 7.681 29.030 20.899 1.00 0.00 C ATOM 0 H LEU A 17 6.840 26.712 22.680 1.00 0.00 H new ATOM 0 HA LEU A 17 6.962 29.634 23.307 1.00 0.00 H new ATOM 0 HB2 LEU A 17 4.870 27.655 22.261 1.00 0.00 H new ATOM 0 HB3 LEU A 17 4.812 29.399 22.104 1.00 0.00 H new ATOM 0 HG LEU A 17 6.341 27.394 20.540 1.00 0.00 H new ATOM 0 HD11 LEU A 17 6.037 29.166 18.788 1.00 0.00 H new ATOM 0 HD12 LEU A 17 4.504 28.801 19.615 1.00 0.00 H new ATOM 0 HD13 LEU A 17 5.415 30.270 20.038 1.00 0.00 H new ATOM 0 HD21 LEU A 17 8.181 28.940 19.935 1.00 0.00 H new ATOM 0 HD22 LEU A 17 7.626 30.081 21.182 1.00 0.00 H new ATOM 0 HD23 LEU A 17 8.245 28.480 21.653 1.00 0.00 H new ATOM 284 N ALA A 18 5.409 27.395 25.026 1.00 0.00 N ATOM 285 CA ALA A 18 4.698 27.177 26.317 1.00 0.00 C ATOM 286 C ALA A 18 5.677 27.271 27.489 1.00 0.00 C ATOM 287 O ALA A 18 5.267 27.287 28.649 1.00 0.00 O ATOM 288 CB ALA A 18 4.111 25.768 26.237 1.00 0.00 C ATOM 0 H ALA A 18 5.636 26.544 24.511 1.00 0.00 H new ATOM 0 HA ALA A 18 3.926 27.929 26.478 1.00 0.00 H new ATOM 0 HB1 ALA A 18 3.574 25.545 27.159 1.00 0.00 H new ATOM 0 HB2 ALA A 18 3.424 25.707 25.393 1.00 0.00 H new ATOM 0 HB3 ALA A 18 4.916 25.046 26.103 1.00 0.00 H new ATOM 294 N ARG A 19 6.963 27.319 27.223 1.00 0.00 N ATOM 295 CA ARG A 19 7.955 27.400 28.330 1.00 0.00 C ATOM 296 C ARG A 19 7.915 26.116 29.133 1.00 0.00 C ATOM 297 O ARG A 19 7.999 26.119 30.357 1.00 0.00 O ATOM 298 CB ARG A 19 7.556 28.605 29.186 1.00 0.00 C ATOM 299 CG ARG A 19 7.080 29.760 28.296 1.00 0.00 C ATOM 300 CD ARG A 19 7.244 31.086 29.045 1.00 0.00 C ATOM 301 NE ARG A 19 7.856 32.017 28.052 1.00 0.00 N ATOM 302 CZ ARG A 19 7.776 33.316 28.212 1.00 0.00 C ATOM 303 NH1 ARG A 19 7.159 33.828 29.247 1.00 0.00 N ATOM 304 NH2 ARG A 19 8.319 34.109 27.329 1.00 0.00 N ATOM 0 H ARG A 19 7.362 27.305 26.285 1.00 0.00 H new ATOM 0 HA ARG A 19 8.973 27.523 27.961 1.00 0.00 H new ATOM 0 HB2 ARG A 19 6.764 28.321 29.878 1.00 0.00 H new ATOM 0 HB3 ARG A 19 8.405 28.928 29.789 1.00 0.00 H new ATOM 0 HG2 ARG A 19 7.655 29.780 27.370 1.00 0.00 H new ATOM 0 HG3 ARG A 19 6.036 29.613 28.020 1.00 0.00 H new ATOM 0 HD2 ARG A 19 6.284 31.461 29.398 1.00 0.00 H new ATOM 0 HD3 ARG A 19 7.882 30.968 29.921 1.00 0.00 H new ATOM 0 HE ARG A 19 8.342 31.638 27.239 1.00 0.00 H new ATOM 0 HH11 ARG A 19 6.733 33.214 29.942 1.00 0.00 H new ATOM 0 HH12 ARG A 19 7.104 34.840 29.359 1.00 0.00 H new ATOM 0 HH21 ARG A 19 8.802 33.717 26.520 1.00 0.00 H new ATOM 0 HH22 ARG A 19 8.260 35.120 27.447 1.00 0.00 H new ATOM 318 N ASP A 20 7.799 25.017 28.451 1.00 0.00 N ATOM 319 CA ASP A 20 7.762 23.706 29.142 1.00 0.00 C ATOM 320 C ASP A 20 9.141 23.382 29.729 1.00 0.00 C ATOM 321 O ASP A 20 10.082 23.095 28.990 1.00 0.00 O ATOM 322 CB ASP A 20 7.385 22.705 28.050 1.00 0.00 C ATOM 323 CG ASP A 20 7.176 21.324 28.669 1.00 0.00 C ATOM 324 OD1 ASP A 20 6.662 21.263 29.773 1.00 0.00 O ATOM 325 OD2 ASP A 20 7.533 20.349 28.028 1.00 0.00 O ATOM 0 H ASP A 20 7.728 24.971 27.435 1.00 0.00 H new ATOM 0 HA ASP A 20 7.056 23.687 29.973 1.00 0.00 H new ATOM 0 HB2 ASP A 20 6.476 23.029 27.544 1.00 0.00 H new ATOM 0 HB3 ASP A 20 8.171 22.661 27.296 1.00 0.00 H new ATOM 330 N PRO A 21 9.229 23.416 31.035 1.00 0.00 N ATOM 331 CA PRO A 21 10.503 23.099 31.725 1.00 0.00 C ATOM 332 C PRO A 21 10.744 21.588 31.674 1.00 0.00 C ATOM 333 O PRO A 21 11.665 21.064 32.298 1.00 0.00 O ATOM 334 CB PRO A 21 10.270 23.563 33.158 1.00 0.00 C ATOM 335 CG PRO A 21 8.789 23.519 33.345 1.00 0.00 C ATOM 336 CD PRO A 21 8.160 23.741 31.993 1.00 0.00 C ATOM 0 HA PRO A 21 11.373 23.577 31.275 1.00 0.00 H new ATOM 0 HB2 PRO A 21 10.777 22.912 33.870 1.00 0.00 H new ATOM 0 HB3 PRO A 21 10.657 24.570 33.314 1.00 0.00 H new ATOM 0 HG2 PRO A 21 8.482 22.558 33.759 1.00 0.00 H new ATOM 0 HG3 PRO A 21 8.468 24.286 34.049 1.00 0.00 H new ATOM 0 HD2 PRO A 21 7.290 23.101 31.850 1.00 0.00 H new ATOM 0 HD3 PRO A 21 7.821 24.770 31.876 1.00 0.00 H new ATOM 344 N ASN A 22 9.910 20.878 30.960 1.00 0.00 N ATOM 345 CA ASN A 22 10.039 19.416 30.871 1.00 0.00 C ATOM 346 C ASN A 22 10.718 19.056 29.568 1.00 0.00 C ATOM 347 O ASN A 22 11.174 17.934 29.360 1.00 0.00 O ATOM 348 CB ASN A 22 8.588 18.997 30.841 1.00 0.00 C ATOM 349 CG ASN A 22 8.486 17.519 30.518 1.00 0.00 C ATOM 350 OD1 ASN A 22 8.645 17.155 29.283 1.00 0.00 O flip ATOM 351 ND2 ASN A 22 8.258 16.687 31.394 1.00 0.00 N flip ATOM 0 H ASN A 22 9.133 21.270 30.428 1.00 0.00 H new ATOM 0 HA ASN A 22 10.621 18.951 31.667 1.00 0.00 H new ATOM 0 HB2 ASN A 22 8.121 19.201 31.805 1.00 0.00 H new ATOM 0 HB3 ASN A 22 8.047 19.580 30.095 1.00 0.00 H new ATOM 0 HD21 ASN A 22 8.135 16.986 32.361 1.00 0.00 H new ATOM 0 HD22 ASN A 22 8.192 15.698 31.153 1.00 0.00 H new ATOM 358 N ALA A 23 10.831 20.015 28.712 1.00 0.00 N ATOM 359 CA ALA A 23 11.532 19.777 27.433 1.00 0.00 C ATOM 360 C ALA A 23 12.840 20.543 27.454 1.00 0.00 C ATOM 361 O ALA A 23 13.675 20.438 26.551 1.00 0.00 O ATOM 362 CB ALA A 23 10.633 20.328 26.340 1.00 0.00 C ATOM 0 H ALA A 23 10.467 20.959 28.841 1.00 0.00 H new ATOM 0 HA ALA A 23 11.741 18.720 27.269 1.00 0.00 H new ATOM 0 HB1 ALA A 23 11.106 20.177 25.370 1.00 0.00 H new ATOM 0 HB2 ALA A 23 9.675 19.809 26.361 1.00 0.00 H new ATOM 0 HB3 ALA A 23 10.472 21.394 26.504 1.00 0.00 H new ATOM 368 N ASP A 24 13.026 21.313 28.484 1.00 0.00 N ATOM 369 CA ASP A 24 14.255 22.101 28.616 1.00 0.00 C ATOM 370 C ASP A 24 15.343 21.120 29.035 1.00 0.00 C ATOM 371 O ASP A 24 15.163 20.360 29.970 1.00 0.00 O ATOM 372 CB ASP A 24 13.910 23.109 29.722 1.00 0.00 C ATOM 373 CG ASP A 24 14.834 24.316 29.649 1.00 0.00 C ATOM 374 OD1 ASP A 24 15.445 24.491 28.618 1.00 0.00 O ATOM 375 OD2 ASP A 24 14.894 25.057 30.616 1.00 0.00 O ATOM 0 H ASP A 24 12.360 21.425 29.249 1.00 0.00 H new ATOM 0 HA ASP A 24 14.600 22.620 27.722 1.00 0.00 H new ATOM 0 HB2 ASP A 24 12.873 23.430 29.619 1.00 0.00 H new ATOM 0 HB3 ASP A 24 14.001 22.632 30.698 1.00 0.00 H new ATOM 380 N GLY A 25 16.432 21.064 28.333 1.00 0.00 N ATOM 381 CA GLY A 25 17.485 20.046 28.681 1.00 0.00 C ATOM 382 C GLY A 25 17.331 18.889 27.687 1.00 0.00 C ATOM 383 O GLY A 25 18.265 18.138 27.418 1.00 0.00 O ATOM 0 H GLY A 25 16.650 21.666 27.539 1.00 0.00 H new ATOM 0 HA2 GLY A 25 18.481 20.483 28.614 1.00 0.00 H new ATOM 0 HA3 GLY A 25 17.359 19.695 29.705 1.00 0.00 H new ATOM 387 N GLU A 26 16.152 18.755 27.123 1.00 0.00 N ATOM 388 CA GLU A 26 15.891 17.688 26.133 1.00 0.00 C ATOM 389 C GLU A 26 16.210 18.198 24.725 1.00 0.00 C ATOM 390 O GLU A 26 16.936 17.558 23.968 1.00 0.00 O ATOM 391 CB GLU A 26 14.398 17.384 26.267 1.00 0.00 C ATOM 392 CG GLU A 26 14.051 16.144 25.443 1.00 0.00 C ATOM 393 CD GLU A 26 14.474 14.887 26.203 1.00 0.00 C ATOM 394 OE1 GLU A 26 14.011 14.709 27.318 1.00 0.00 O ATOM 395 OE2 GLU A 26 15.253 14.123 25.658 1.00 0.00 O ATOM 0 H GLU A 26 15.352 19.357 27.318 1.00 0.00 H new ATOM 0 HA GLU A 26 16.503 16.802 26.301 1.00 0.00 H new ATOM 0 HB2 GLU A 26 14.142 17.220 27.314 1.00 0.00 H new ATOM 0 HB3 GLU A 26 13.811 18.236 25.925 1.00 0.00 H new ATOM 0 HG2 GLU A 26 12.980 16.117 25.242 1.00 0.00 H new ATOM 0 HG3 GLU A 26 14.555 16.184 24.477 1.00 0.00 H new ATOM 402 N PHE A 27 15.681 19.340 24.357 1.00 0.00 N ATOM 403 CA PHE A 27 15.967 19.888 22.991 1.00 0.00 C ATOM 404 C PHE A 27 16.157 21.394 23.021 1.00 0.00 C ATOM 405 O PHE A 27 15.868 22.077 24.001 1.00 0.00 O ATOM 406 CB PHE A 27 14.757 19.563 22.109 1.00 0.00 C ATOM 407 CG PHE A 27 13.567 20.463 22.426 1.00 0.00 C ATOM 408 CD1 PHE A 27 13.555 21.818 22.035 1.00 0.00 C ATOM 409 CD2 PHE A 27 12.459 19.924 23.084 1.00 0.00 C ATOM 410 CE1 PHE A 27 12.429 22.615 22.310 1.00 0.00 C ATOM 411 CE2 PHE A 27 11.337 20.726 23.362 1.00 0.00 C ATOM 412 CZ PHE A 27 11.322 22.064 22.971 1.00 0.00 C ATOM 0 H PHE A 27 15.068 19.913 24.937 1.00 0.00 H new ATOM 0 HA PHE A 27 16.886 19.443 22.609 1.00 0.00 H new ATOM 0 HB2 PHE A 27 15.030 19.678 21.060 1.00 0.00 H new ATOM 0 HB3 PHE A 27 14.473 18.521 22.252 1.00 0.00 H new ATOM 0 HD1 PHE A 27 14.408 22.242 21.526 1.00 0.00 H new ATOM 0 HD2 PHE A 27 12.464 18.886 23.381 1.00 0.00 H new ATOM 0 HE1 PHE A 27 12.417 23.653 22.012 1.00 0.00 H new ATOM 0 HE2 PHE A 27 10.487 20.305 23.878 1.00 0.00 H new ATOM 0 HZ PHE A 27 10.457 22.677 23.177 1.00 0.00 H new ATOM 422 N VAL A 28 16.593 21.911 21.921 1.00 0.00 N ATOM 423 CA VAL A 28 16.774 23.375 21.773 1.00 0.00 C ATOM 424 C VAL A 28 16.023 23.793 20.536 1.00 0.00 C ATOM 425 O VAL A 28 15.528 22.956 19.785 1.00 0.00 O ATOM 426 CB VAL A 28 18.268 23.636 21.569 1.00 0.00 C ATOM 427 CG1 VAL A 28 19.064 22.410 21.952 1.00 0.00 C ATOM 428 CG2 VAL A 28 18.569 23.931 20.110 1.00 0.00 C ATOM 0 H VAL A 28 16.839 21.368 21.093 1.00 0.00 H new ATOM 0 HA VAL A 28 16.412 23.924 22.643 1.00 0.00 H new ATOM 0 HB VAL A 28 18.540 24.489 22.191 1.00 0.00 H new ATOM 0 HG11 VAL A 28 20.126 22.605 21.804 1.00 0.00 H new ATOM 0 HG12 VAL A 28 18.882 22.171 23.000 1.00 0.00 H new ATOM 0 HG13 VAL A 28 18.759 21.569 21.329 1.00 0.00 H new ATOM 0 HG21 VAL A 28 19.637 24.113 19.988 1.00 0.00 H new ATOM 0 HG22 VAL A 28 18.275 23.078 19.498 1.00 0.00 H new ATOM 0 HG23 VAL A 28 18.012 24.813 19.795 1.00 0.00 H new ATOM 438 N PHE A 29 15.982 25.048 20.268 1.00 0.00 N ATOM 439 CA PHE A 29 15.318 25.476 19.025 1.00 0.00 C ATOM 440 C PHE A 29 16.104 26.609 18.405 1.00 0.00 C ATOM 441 O PHE A 29 16.383 27.627 19.029 1.00 0.00 O ATOM 442 CB PHE A 29 13.872 25.818 19.381 1.00 0.00 C ATOM 443 CG PHE A 29 13.640 27.307 19.613 1.00 0.00 C ATOM 444 CD1 PHE A 29 13.396 28.161 18.529 1.00 0.00 C ATOM 445 CD2 PHE A 29 13.594 27.819 20.919 1.00 0.00 C ATOM 446 CE1 PHE A 29 13.118 29.521 18.750 1.00 0.00 C ATOM 447 CE2 PHE A 29 13.309 29.177 21.135 1.00 0.00 C ATOM 448 CZ PHE A 29 13.073 30.026 20.051 1.00 0.00 C ATOM 0 H PHE A 29 16.373 25.792 20.845 1.00 0.00 H new ATOM 0 HA PHE A 29 15.290 24.697 18.264 1.00 0.00 H new ATOM 0 HB2 PHE A 29 13.218 25.477 18.579 1.00 0.00 H new ATOM 0 HB3 PHE A 29 13.588 25.270 20.279 1.00 0.00 H new ATOM 0 HD1 PHE A 29 13.422 27.773 17.521 1.00 0.00 H new ATOM 0 HD2 PHE A 29 13.778 27.167 21.760 1.00 0.00 H new ATOM 0 HE1 PHE A 29 12.939 30.177 17.911 1.00 0.00 H new ATOM 0 HE2 PHE A 29 13.272 29.566 22.142 1.00 0.00 H new ATOM 0 HZ PHE A 29 12.856 31.071 20.219 1.00 0.00 H new ATOM 458 N ALA A 30 16.524 26.392 17.200 1.00 0.00 N ATOM 459 CA ALA A 30 17.389 27.388 16.502 1.00 0.00 C ATOM 460 C ALA A 30 16.632 28.265 15.515 1.00 0.00 C ATOM 461 O ALA A 30 16.134 27.805 14.491 1.00 0.00 O ATOM 462 CB ALA A 30 18.420 26.547 15.757 1.00 0.00 C ATOM 0 H ALA A 30 16.306 25.558 16.655 1.00 0.00 H new ATOM 0 HA ALA A 30 17.821 28.081 17.224 1.00 0.00 H new ATOM 0 HB1 ALA A 30 19.100 27.203 15.214 1.00 0.00 H new ATOM 0 HB2 ALA A 30 18.986 25.949 16.471 1.00 0.00 H new ATOM 0 HB3 ALA A 30 17.912 25.888 15.053 1.00 0.00 H new ATOM 468 N VAL A 31 16.586 29.532 15.795 1.00 0.00 N ATOM 469 CA VAL A 31 15.916 30.485 14.880 1.00 0.00 C ATOM 470 C VAL A 31 16.971 30.991 13.881 1.00 0.00 C ATOM 471 O VAL A 31 17.932 31.670 14.262 1.00 0.00 O ATOM 472 CB VAL A 31 15.446 31.633 15.773 1.00 0.00 C ATOM 473 CG1 VAL A 31 14.330 32.397 15.079 1.00 0.00 C ATOM 474 CG2 VAL A 31 14.933 31.095 17.100 1.00 0.00 C ATOM 0 H VAL A 31 16.990 29.953 16.631 1.00 0.00 H new ATOM 0 HA VAL A 31 15.085 30.048 14.327 1.00 0.00 H new ATOM 0 HB VAL A 31 16.289 32.298 15.959 1.00 0.00 H new ATOM 0 HG11 VAL A 31 13.997 33.215 15.718 1.00 0.00 H new ATOM 0 HG12 VAL A 31 14.697 32.800 14.135 1.00 0.00 H new ATOM 0 HG13 VAL A 31 13.494 31.724 14.885 1.00 0.00 H new ATOM 0 HG21 VAL A 31 14.602 31.924 17.725 1.00 0.00 H new ATOM 0 HG22 VAL A 31 14.097 30.420 16.920 1.00 0.00 H new ATOM 0 HG23 VAL A 31 15.733 30.555 17.607 1.00 0.00 H new ATOM 484 N ARG A 32 16.824 30.664 12.625 1.00 0.00 N ATOM 485 CA ARG A 32 17.813 31.105 11.596 1.00 0.00 C ATOM 486 C ARG A 32 17.723 32.606 11.352 1.00 0.00 C ATOM 487 O ARG A 32 18.646 33.239 10.842 1.00 0.00 O ATOM 488 CB ARG A 32 17.344 30.410 10.336 1.00 0.00 C ATOM 489 CG ARG A 32 17.826 28.960 10.312 1.00 0.00 C ATOM 490 CD ARG A 32 17.705 28.409 8.888 1.00 0.00 C ATOM 491 NE ARG A 32 16.242 28.419 8.592 1.00 0.00 N ATOM 492 CZ ARG A 32 15.807 28.298 7.359 1.00 0.00 C ATOM 493 NH1 ARG A 32 16.647 28.165 6.364 1.00 0.00 N ATOM 494 NH2 ARG A 32 14.523 28.308 7.122 1.00 0.00 N ATOM 0 H ARG A 32 16.052 30.104 12.263 1.00 0.00 H new ATOM 0 HA ARG A 32 18.835 30.876 11.897 1.00 0.00 H new ATOM 0 HB2 ARG A 32 16.256 30.438 10.282 1.00 0.00 H new ATOM 0 HB3 ARG A 32 17.721 30.939 9.460 1.00 0.00 H new ATOM 0 HG2 ARG A 32 18.861 28.903 10.649 1.00 0.00 H new ATOM 0 HG3 ARG A 32 17.233 28.356 10.999 1.00 0.00 H new ATOM 0 HD2 ARG A 32 18.255 29.026 8.178 1.00 0.00 H new ATOM 0 HD3 ARG A 32 18.115 27.401 8.819 1.00 0.00 H new ATOM 0 HE ARG A 32 15.573 28.521 9.355 1.00 0.00 H new ATOM 0 HH11 ARG A 32 17.651 28.155 6.542 1.00 0.00 H new ATOM 0 HH12 ARG A 32 16.297 28.072 5.410 1.00 0.00 H new ATOM 0 HH21 ARG A 32 13.863 28.410 7.893 1.00 0.00 H new ATOM 0 HH22 ARG A 32 14.180 28.214 6.166 1.00 0.00 H new ATOM 508 N THR A 33 16.621 33.171 11.708 1.00 0.00 N ATOM 509 CA THR A 33 16.416 34.635 11.515 1.00 0.00 C ATOM 510 C THR A 33 17.370 35.398 12.422 1.00 0.00 C ATOM 511 O THR A 33 17.831 36.493 12.103 1.00 0.00 O ATOM 512 CB THR A 33 14.957 34.887 11.910 1.00 0.00 C ATOM 513 OG1 THR A 33 14.518 36.111 11.339 1.00 0.00 O ATOM 514 CG2 THR A 33 14.819 34.961 13.435 1.00 0.00 C ATOM 0 H THR A 33 15.834 32.681 12.133 1.00 0.00 H new ATOM 0 HA THR A 33 16.611 34.963 10.494 1.00 0.00 H new ATOM 0 HB THR A 33 14.346 34.063 11.540 1.00 0.00 H new ATOM 0 HG1 THR A 33 13.584 36.273 11.589 1.00 0.00 H new ATOM 0 HG21 THR A 33 13.776 35.140 13.698 1.00 0.00 H new ATOM 0 HG22 THR A 33 15.148 34.020 13.876 1.00 0.00 H new ATOM 0 HG23 THR A 33 15.435 35.775 13.817 1.00 0.00 H new ATOM 522 N THR A 34 17.674 34.827 13.549 1.00 0.00 N ATOM 523 CA THR A 34 18.611 35.503 14.496 1.00 0.00 C ATOM 524 C THR A 34 19.867 34.648 14.698 1.00 0.00 C ATOM 525 O THR A 34 20.781 35.025 15.428 1.00 0.00 O ATOM 526 CB THR A 34 17.833 35.647 15.807 1.00 0.00 C ATOM 527 OG1 THR A 34 18.601 36.401 16.730 1.00 0.00 O ATOM 528 CG2 THR A 34 17.542 34.269 16.394 1.00 0.00 C ATOM 0 H THR A 34 17.318 33.923 13.860 1.00 0.00 H new ATOM 0 HA THR A 34 18.945 36.471 14.122 1.00 0.00 H new ATOM 0 HB THR A 34 16.890 36.158 15.610 1.00 0.00 H new ATOM 0 HG1 THR A 34 19.552 36.323 16.505 1.00 0.00 H new ATOM 0 HG21 THR A 34 16.988 34.380 17.326 1.00 0.00 H new ATOM 0 HG22 THR A 34 16.949 33.690 15.686 1.00 0.00 H new ATOM 0 HG23 THR A 34 18.481 33.751 16.589 1.00 0.00 H new ATOM 536 N GLY A 35 19.931 33.508 14.062 1.00 0.00 N ATOM 537 CA GLY A 35 21.125 32.633 14.209 1.00 0.00 C ATOM 538 C GLY A 35 21.287 32.215 15.671 1.00 0.00 C ATOM 539 O GLY A 35 22.402 32.061 16.164 1.00 0.00 O ATOM 0 H GLY A 35 19.204 33.146 13.445 1.00 0.00 H new ATOM 0 HA2 GLY A 35 21.019 31.750 13.579 1.00 0.00 H new ATOM 0 HA3 GLY A 35 22.017 33.161 13.872 1.00 0.00 H new ATOM 543 N ILE A 36 20.202 32.016 16.373 1.00 0.00 N ATOM 544 CA ILE A 36 20.315 31.591 17.805 1.00 0.00 C ATOM 545 C ILE A 36 19.524 30.316 18.014 1.00 0.00 C ATOM 546 O ILE A 36 18.665 29.962 17.216 1.00 0.00 O ATOM 547 CB ILE A 36 19.649 32.692 18.641 1.00 0.00 C ATOM 548 CG1 ILE A 36 20.478 33.964 18.610 1.00 0.00 C ATOM 549 CG2 ILE A 36 19.511 32.245 20.114 1.00 0.00 C ATOM 550 CD1 ILE A 36 19.709 35.036 19.374 1.00 0.00 C ATOM 0 H ILE A 36 19.250 32.127 16.024 1.00 0.00 H new ATOM 0 HA ILE A 36 21.357 31.430 18.081 1.00 0.00 H new ATOM 0 HB ILE A 36 18.664 32.879 18.212 1.00 0.00 H new ATOM 0 HG12 ILE A 36 21.454 33.796 19.065 1.00 0.00 H new ATOM 0 HG13 ILE A 36 20.656 34.280 17.582 1.00 0.00 H new ATOM 0 HG21 ILE A 36 19.037 33.038 20.692 1.00 0.00 H new ATOM 0 HG22 ILE A 36 18.900 31.344 20.165 1.00 0.00 H new ATOM 0 HG23 ILE A 36 20.499 32.037 20.525 1.00 0.00 H new ATOM 0 HD11 ILE A 36 20.279 35.965 19.370 1.00 0.00 H new ATOM 0 HD12 ILE A 36 18.743 35.201 18.896 1.00 0.00 H new ATOM 0 HD13 ILE A 36 19.554 34.709 20.402 1.00 0.00 H new ATOM 562 N PHE A 37 19.742 29.672 19.112 1.00 0.00 N ATOM 563 CA PHE A 37 18.945 28.473 19.432 1.00 0.00 C ATOM 564 C PHE A 37 18.722 28.453 20.929 1.00 0.00 C ATOM 565 O PHE A 37 19.661 28.416 21.723 1.00 0.00 O ATOM 566 CB PHE A 37 19.719 27.253 18.934 1.00 0.00 C ATOM 567 CG PHE A 37 20.774 26.832 19.914 1.00 0.00 C ATOM 568 CD1 PHE A 37 20.406 26.067 21.020 1.00 0.00 C ATOM 569 CD2 PHE A 37 22.113 27.159 19.699 1.00 0.00 C ATOM 570 CE1 PHE A 37 21.369 25.629 21.918 1.00 0.00 C ATOM 571 CE2 PHE A 37 23.084 26.711 20.594 1.00 0.00 C ATOM 572 CZ PHE A 37 22.709 25.944 21.704 1.00 0.00 C ATOM 0 H PHE A 37 20.444 29.926 19.807 1.00 0.00 H new ATOM 0 HA PHE A 37 17.969 28.471 18.948 1.00 0.00 H new ATOM 0 HB2 PHE A 37 19.028 26.427 18.765 1.00 0.00 H new ATOM 0 HB3 PHE A 37 20.183 27.482 17.975 1.00 0.00 H new ATOM 0 HD1 PHE A 37 19.368 25.814 21.178 1.00 0.00 H new ATOM 0 HD2 PHE A 37 22.396 27.756 18.844 1.00 0.00 H new ATOM 0 HE1 PHE A 37 21.081 25.046 22.780 1.00 0.00 H new ATOM 0 HE2 PHE A 37 24.123 26.955 20.431 1.00 0.00 H new ATOM 0 HZ PHE A 37 23.461 25.596 22.396 1.00 0.00 H new ATOM 596 N ARG A 39 16.247 27.290 24.486 1.00 0.00 N ATOM 597 CA ARG A 39 15.574 26.148 25.068 1.00 0.00 C ATOM 598 C ARG A 39 14.080 26.369 24.879 1.00 0.00 C ATOM 599 O ARG A 39 13.676 27.400 24.343 1.00 0.00 O ATOM 600 CB ARG A 39 16.006 26.226 26.517 1.00 0.00 C ATOM 601 CG ARG A 39 17.259 25.367 26.700 1.00 0.00 C ATOM 602 CD ARG A 39 17.648 25.336 28.173 1.00 0.00 C ATOM 603 NE ARG A 39 19.043 25.842 28.237 1.00 0.00 N ATOM 604 CZ ARG A 39 19.562 26.164 29.391 1.00 0.00 C ATOM 605 NH1 ARG A 39 18.859 26.041 30.489 1.00 0.00 N ATOM 606 NH2 ARG A 39 20.787 26.609 29.450 1.00 0.00 N ATOM 0 HA ARG A 39 15.803 25.172 24.641 1.00 0.00 H new ATOM 0 HB2 ARG A 39 16.212 27.260 26.795 1.00 0.00 H new ATOM 0 HB3 ARG A 39 15.207 25.874 27.169 1.00 0.00 H new ATOM 0 HG2 ARG A 39 17.073 24.355 26.341 1.00 0.00 H new ATOM 0 HG3 ARG A 39 18.079 25.771 26.106 1.00 0.00 H new ATOM 0 HD2 ARG A 39 16.979 25.959 28.767 1.00 0.00 H new ATOM 0 HD3 ARG A 39 17.581 24.324 28.573 1.00 0.00 H new ATOM 0 HE ARG A 39 19.593 25.937 27.383 1.00 0.00 H new ATOM 0 HH11 ARG A 39 17.901 25.692 30.445 1.00 0.00 H new ATOM 0 HH12 ARG A 39 19.269 26.294 31.388 1.00 0.00 H new ATOM 0 HH21 ARG A 39 21.337 26.705 28.596 1.00 0.00 H new ATOM 0 HH22 ARG A 39 21.195 26.861 30.350 1.00 0.00 H new ATOM 620 N PRO A 40 13.295 25.424 25.278 1.00 0.00 N ATOM 621 CA PRO A 40 11.837 25.565 25.095 1.00 0.00 C ATOM 622 C PRO A 40 11.251 26.656 25.993 1.00 0.00 C ATOM 623 O PRO A 40 10.138 27.124 25.770 1.00 0.00 O ATOM 624 CB PRO A 40 11.294 24.197 25.489 1.00 0.00 C ATOM 625 CG PRO A 40 12.331 23.623 26.396 1.00 0.00 C ATOM 626 CD PRO A 40 13.655 24.160 25.927 1.00 0.00 C ATOM 0 HA PRO A 40 11.577 25.859 24.078 1.00 0.00 H new ATOM 0 HB2 PRO A 40 10.331 24.284 25.993 1.00 0.00 H new ATOM 0 HB3 PRO A 40 11.140 23.565 24.614 1.00 0.00 H new ATOM 0 HG2 PRO A 40 12.142 23.908 27.431 1.00 0.00 H new ATOM 0 HG3 PRO A 40 12.319 22.534 26.358 1.00 0.00 H new ATOM 0 HD2 PRO A 40 14.343 24.316 26.758 1.00 0.00 H new ATOM 0 HD3 PRO A 40 14.143 23.476 25.233 1.00 0.00 H new ATOM 634 N SER A 41 11.936 27.043 27.026 1.00 0.00 N ATOM 635 CA SER A 41 11.369 28.052 27.931 1.00 0.00 C ATOM 636 C SER A 41 12.172 29.374 27.939 1.00 0.00 C ATOM 637 O SER A 41 12.213 30.074 28.949 1.00 0.00 O ATOM 638 CB SER A 41 11.369 27.335 29.279 1.00 0.00 C ATOM 639 OG SER A 41 12.694 27.284 29.794 1.00 0.00 O ATOM 0 H SER A 41 12.863 26.700 27.277 1.00 0.00 H new ATOM 0 HA SER A 41 10.375 28.383 27.632 1.00 0.00 H new ATOM 0 HB2 SER A 41 10.716 27.856 29.979 1.00 0.00 H new ATOM 0 HB3 SER A 41 10.973 26.326 29.165 1.00 0.00 H new ATOM 0 HG SER A 41 12.691 26.825 30.660 1.00 0.00 H new ATOM 645 N CYS A 42 12.798 29.745 26.834 1.00 0.00 N ATOM 646 CA CYS A 42 13.570 31.031 26.795 1.00 0.00 C ATOM 647 C CYS A 42 12.735 32.179 27.352 1.00 0.00 C ATOM 648 O CYS A 42 11.550 32.328 27.060 1.00 0.00 O ATOM 649 CB CYS A 42 13.897 31.310 25.328 1.00 0.00 C ATOM 650 SG CYS A 42 14.863 32.849 25.218 1.00 0.00 S ATOM 0 H CYS A 42 12.804 29.211 25.965 1.00 0.00 H new ATOM 0 HA CYS A 42 14.473 30.948 27.400 1.00 0.00 H new ATOM 0 HB2 CYS A 42 14.462 30.480 24.904 1.00 0.00 H new ATOM 0 HB3 CYS A 42 12.978 31.400 24.748 1.00 0.00 H new ATOM 0 HG CYS A 42 16.079 32.628 25.621 1.00 0.00 H new ATOM 655 N ARG A 43 13.350 32.979 28.154 1.00 0.00 N ATOM 656 CA ARG A 43 12.647 34.140 28.774 1.00 0.00 C ATOM 657 C ARG A 43 12.972 35.466 28.069 1.00 0.00 C ATOM 658 O ARG A 43 12.595 36.529 28.552 1.00 0.00 O ATOM 659 CB ARG A 43 13.148 34.174 30.221 1.00 0.00 C ATOM 660 CG ARG A 43 14.666 34.389 30.245 1.00 0.00 C ATOM 661 CD ARG A 43 15.305 33.422 31.246 1.00 0.00 C ATOM 662 NE ARG A 43 15.595 32.185 30.462 1.00 0.00 N ATOM 663 CZ ARG A 43 15.655 31.013 31.052 1.00 0.00 C ATOM 664 NH1 ARG A 43 15.464 30.898 32.342 1.00 0.00 N ATOM 665 NH2 ARG A 43 15.911 29.947 30.342 1.00 0.00 N ATOM 0 H ARG A 43 14.331 32.885 28.418 1.00 0.00 H new ATOM 0 HA ARG A 43 11.566 34.025 28.699 1.00 0.00 H new ATOM 0 HB2 ARG A 43 12.650 34.975 30.768 1.00 0.00 H new ATOM 0 HB3 ARG A 43 12.897 33.240 30.724 1.00 0.00 H new ATOM 0 HG2 ARG A 43 15.082 34.227 29.251 1.00 0.00 H new ATOM 0 HG3 ARG A 43 14.894 35.418 30.522 1.00 0.00 H new ATOM 0 HD2 ARG A 43 16.216 33.841 31.672 1.00 0.00 H new ATOM 0 HD3 ARG A 43 14.631 33.213 32.077 1.00 0.00 H new ATOM 0 HE ARG A 43 15.748 32.251 29.456 1.00 0.00 H new ATOM 0 HH11 ARG A 43 15.265 31.726 32.904 1.00 0.00 H new ATOM 0 HH12 ARG A 43 15.514 29.981 32.785 1.00 0.00 H new ATOM 0 HH21 ARG A 43 16.063 30.028 29.337 1.00 0.00 H new ATOM 0 HH22 ARG A 43 15.959 29.033 30.793 1.00 0.00 H new ATOM 679 N ALA A 44 13.697 35.455 26.978 1.00 0.00 N ATOM 680 CA ALA A 44 14.050 36.767 26.342 1.00 0.00 C ATOM 681 C ALA A 44 13.020 37.228 25.306 1.00 0.00 C ATOM 682 O ALA A 44 12.544 38.359 25.353 1.00 0.00 O ATOM 683 CB ALA A 44 15.399 36.519 25.666 1.00 0.00 C ATOM 0 H ALA A 44 14.052 34.622 26.509 1.00 0.00 H new ATOM 0 HA ALA A 44 14.077 37.559 27.090 1.00 0.00 H new ATOM 0 HB1 ALA A 44 15.733 37.432 25.174 1.00 0.00 H new ATOM 0 HB2 ALA A 44 16.132 36.222 26.416 1.00 0.00 H new ATOM 0 HB3 ALA A 44 15.295 35.725 24.926 1.00 0.00 H new ATOM 689 N ARG A 45 12.672 36.380 24.383 1.00 0.00 N ATOM 690 CA ARG A 45 11.673 36.756 23.319 1.00 0.00 C ATOM 691 C ARG A 45 11.618 35.583 22.311 1.00 0.00 C ATOM 692 O ARG A 45 12.366 34.617 22.451 1.00 0.00 O ATOM 693 CB ARG A 45 12.230 38.053 22.680 1.00 0.00 C ATOM 694 CG ARG A 45 11.115 38.838 21.965 1.00 0.00 C ATOM 695 CD ARG A 45 11.092 40.289 22.486 1.00 0.00 C ATOM 696 NE ARG A 45 11.940 41.070 21.527 1.00 0.00 N ATOM 697 CZ ARG A 45 12.510 42.186 21.884 1.00 0.00 C ATOM 698 NH1 ARG A 45 12.363 42.667 23.091 1.00 0.00 N ATOM 699 NH2 ARG A 45 13.237 42.827 21.016 1.00 0.00 N ATOM 0 H ARG A 45 13.035 35.429 24.310 1.00 0.00 H new ATOM 0 HA ARG A 45 10.662 36.931 23.686 1.00 0.00 H new ATOM 0 HB2 ARG A 45 12.683 38.677 23.451 1.00 0.00 H new ATOM 0 HB3 ARG A 45 13.017 37.803 21.969 1.00 0.00 H new ATOM 0 HG2 ARG A 45 11.283 38.830 20.888 1.00 0.00 H new ATOM 0 HG3 ARG A 45 10.150 38.362 22.141 1.00 0.00 H new ATOM 0 HD2 ARG A 45 10.075 40.679 22.518 1.00 0.00 H new ATOM 0 HD3 ARG A 45 11.488 40.349 23.500 1.00 0.00 H new ATOM 0 HE ARG A 45 12.073 40.721 20.578 1.00 0.00 H new ATOM 0 HH11 ARG A 45 11.793 42.167 23.773 1.00 0.00 H new ATOM 0 HH12 ARG A 45 12.818 43.542 23.350 1.00 0.00 H new ATOM 0 HH21 ARG A 45 13.353 42.454 20.074 1.00 0.00 H new ATOM 0 HH22 ARG A 45 13.691 43.702 21.278 1.00 0.00 H new ATOM 713 N HIS A 46 10.748 35.607 21.325 1.00 0.00 N ATOM 714 CA HIS A 46 10.681 34.442 20.376 1.00 0.00 C ATOM 715 C HIS A 46 10.474 34.825 18.919 1.00 0.00 C ATOM 716 O HIS A 46 9.943 35.877 18.586 1.00 0.00 O ATOM 717 CB HIS A 46 9.471 33.641 20.803 1.00 0.00 C ATOM 718 CG HIS A 46 9.866 32.607 21.794 1.00 0.00 C ATOM 719 ND1 HIS A 46 10.060 32.645 23.146 1.00 0.00 N flip ATOM 720 CD2 HIS A 46 10.031 31.293 21.418 1.00 0.00 C flip ATOM 721 CE1 HIS A 46 10.324 31.364 23.610 1.00 0.00 C flip ATOM 722 NE2 HIS A 46 10.287 30.594 22.519 1.00 0.00 N flip ATOM 0 H HIS A 46 10.093 36.366 21.137 1.00 0.00 H new ATOM 0 HA HIS A 46 11.632 33.912 20.424 1.00 0.00 H new ATOM 0 HB2 HIS A 46 8.721 34.303 21.236 1.00 0.00 H new ATOM 0 HB3 HIS A 46 9.014 33.167 19.934 1.00 0.00 H new ATOM 0 HD1 HIS A 46 10.017 33.484 23.724 1.00 0.00 H new ATOM 0 HD2 HIS A 46 9.965 30.902 20.413 1.00 0.00 H new ATOM 0 HE1 HIS A 46 10.517 31.058 24.628 1.00 0.00 H new ATOM 730 N ALA A 47 10.831 33.912 18.058 1.00 0.00 N ATOM 731 CA ALA A 47 10.640 34.092 16.601 1.00 0.00 C ATOM 732 C ALA A 47 9.736 32.972 16.075 1.00 0.00 C ATOM 733 O ALA A 47 9.525 31.961 16.744 1.00 0.00 O ATOM 734 CB ALA A 47 12.039 33.993 16.000 1.00 0.00 C ATOM 0 H ALA A 47 11.260 33.024 18.318 1.00 0.00 H new ATOM 0 HA ALA A 47 10.168 35.041 16.345 1.00 0.00 H new ATOM 0 HB1 ALA A 47 11.980 34.117 14.919 1.00 0.00 H new ATOM 0 HB2 ALA A 47 12.672 34.774 16.421 1.00 0.00 H new ATOM 0 HB3 ALA A 47 12.466 33.017 16.231 1.00 0.00 H new ATOM 740 N LEU A 48 9.175 33.139 14.910 1.00 0.00 N ATOM 741 CA LEU A 48 8.266 32.106 14.361 1.00 0.00 C ATOM 742 C LEU A 48 8.939 30.728 14.281 1.00 0.00 C ATOM 743 O LEU A 48 10.162 30.606 14.264 1.00 0.00 O ATOM 744 CB LEU A 48 7.895 32.599 12.962 1.00 0.00 C ATOM 745 CG LEU A 48 6.934 33.785 13.075 1.00 0.00 C ATOM 746 CD1 LEU A 48 6.870 34.522 11.736 1.00 0.00 C ATOM 747 CD2 LEU A 48 5.539 33.274 13.441 1.00 0.00 C ATOM 0 H LEU A 48 9.311 33.955 14.313 1.00 0.00 H new ATOM 0 HA LEU A 48 7.395 31.974 15.003 1.00 0.00 H new ATOM 0 HB2 LEU A 48 8.793 32.896 12.420 1.00 0.00 H new ATOM 0 HB3 LEU A 48 7.430 31.794 12.393 1.00 0.00 H new ATOM 0 HG LEU A 48 7.288 34.467 13.848 1.00 0.00 H new ATOM 0 HD11 LEU A 48 6.185 35.366 11.818 1.00 0.00 H new ATOM 0 HD12 LEU A 48 7.864 34.885 11.472 1.00 0.00 H new ATOM 0 HD13 LEU A 48 6.515 33.841 10.962 1.00 0.00 H new ATOM 0 HD21 LEU A 48 4.853 34.117 13.522 1.00 0.00 H new ATOM 0 HD22 LEU A 48 5.187 32.592 12.667 1.00 0.00 H new ATOM 0 HD23 LEU A 48 5.583 32.749 14.395 1.00 0.00 H new ATOM 759 N ARG A 49 8.144 29.691 14.209 1.00 0.00 N ATOM 760 CA ARG A 49 8.690 28.301 14.102 1.00 0.00 C ATOM 761 C ARG A 49 9.421 28.156 12.777 1.00 0.00 C ATOM 762 O ARG A 49 10.371 27.393 12.618 1.00 0.00 O ATOM 763 CB ARG A 49 7.445 27.442 14.056 1.00 0.00 C ATOM 764 CG ARG A 49 7.784 26.003 14.458 1.00 0.00 C ATOM 765 CD ARG A 49 6.995 25.025 13.582 1.00 0.00 C ATOM 766 NE ARG A 49 6.182 24.214 14.535 1.00 0.00 N ATOM 767 CZ ARG A 49 5.201 23.461 14.099 1.00 0.00 C ATOM 768 NH1 ARG A 49 4.919 23.404 12.823 1.00 0.00 N ATOM 769 NH2 ARG A 49 4.501 22.760 14.948 1.00 0.00 N ATOM 0 H ARG A 49 7.126 29.748 14.220 1.00 0.00 H new ATOM 0 HA ARG A 49 9.376 28.043 14.909 1.00 0.00 H new ATOM 0 HB2 ARG A 49 6.689 27.847 14.728 1.00 0.00 H new ATOM 0 HB3 ARG A 49 7.020 27.457 13.052 1.00 0.00 H new ATOM 0 HG2 ARG A 49 8.854 25.826 14.346 1.00 0.00 H new ATOM 0 HG3 ARG A 49 7.543 25.842 15.509 1.00 0.00 H new ATOM 0 HD2 ARG A 49 6.358 25.556 12.874 1.00 0.00 H new ATOM 0 HD3 ARG A 49 7.663 24.393 12.997 1.00 0.00 H new ATOM 0 HE ARG A 49 6.391 24.246 15.533 1.00 0.00 H new ATOM 0 HH11 ARG A 49 5.465 23.949 12.155 1.00 0.00 H new ATOM 0 HH12 ARG A 49 4.154 22.815 12.496 1.00 0.00 H new ATOM 0 HH21 ARG A 49 4.718 22.800 15.944 1.00 0.00 H new ATOM 0 HH22 ARG A 49 3.736 22.172 14.616 1.00 0.00 H new ATOM 783 N GLU A 50 8.946 28.894 11.832 1.00 0.00 N ATOM 784 CA GLU A 50 9.492 28.911 10.459 1.00 0.00 C ATOM 785 C GLU A 50 11.012 28.818 10.445 1.00 0.00 C ATOM 786 O GLU A 50 11.602 27.871 9.929 1.00 0.00 O ATOM 787 CB GLU A 50 9.054 30.278 9.978 1.00 0.00 C ATOM 788 CG GLU A 50 9.186 30.344 8.486 1.00 0.00 C ATOM 789 CD GLU A 50 10.645 30.583 8.095 1.00 0.00 C ATOM 790 OE1 GLU A 50 11.049 31.734 8.066 1.00 0.00 O ATOM 791 OE2 GLU A 50 11.333 29.612 7.830 1.00 0.00 O ATOM 0 H GLU A 50 8.154 29.524 11.963 1.00 0.00 H new ATOM 0 HA GLU A 50 9.150 28.073 9.851 1.00 0.00 H new ATOM 0 HB2 GLU A 50 8.021 30.466 10.272 1.00 0.00 H new ATOM 0 HB3 GLU A 50 9.664 31.053 10.443 1.00 0.00 H new ATOM 0 HG2 GLU A 50 8.830 29.415 8.041 1.00 0.00 H new ATOM 0 HG3 GLU A 50 8.561 31.146 8.093 1.00 0.00 H new ATOM 798 N ASN A 51 11.644 29.792 11.013 1.00 0.00 N ATOM 799 CA ASN A 51 13.132 29.801 11.061 1.00 0.00 C ATOM 800 C ASN A 51 13.590 29.101 12.329 1.00 0.00 C ATOM 801 O ASN A 51 14.720 29.245 12.767 1.00 0.00 O ATOM 802 CB ASN A 51 13.504 31.280 11.148 1.00 0.00 C ATOM 803 CG ASN A 51 13.123 31.994 9.853 1.00 0.00 C ATOM 804 OD1 ASN A 51 13.577 31.624 8.772 1.00 0.00 O ATOM 805 ND2 ASN A 51 12.304 33.010 9.908 1.00 0.00 N ATOM 0 H ASN A 51 11.194 30.595 11.453 1.00 0.00 H new ATOM 0 HA ASN A 51 13.585 29.301 10.205 1.00 0.00 H new ATOM 0 HB2 ASN A 51 12.992 31.743 11.992 1.00 0.00 H new ATOM 0 HB3 ASN A 51 14.574 31.384 11.328 1.00 0.00 H new ATOM 0 HD21 ASN A 51 12.039 33.499 9.053 1.00 0.00 H new ATOM 0 HD22 ASN A 51 11.929 33.315 10.806 1.00 0.00 H new ATOM 812 N VAL A 52 12.724 28.356 12.928 1.00 0.00 N ATOM 813 CA VAL A 52 13.086 27.665 14.188 1.00 0.00 C ATOM 814 C VAL A 52 13.183 26.142 13.988 1.00 0.00 C ATOM 815 O VAL A 52 12.260 25.502 13.489 1.00 0.00 O ATOM 816 CB VAL A 52 11.933 28.034 15.123 1.00 0.00 C ATOM 817 CG1 VAL A 52 11.688 26.921 16.131 1.00 0.00 C ATOM 818 CG2 VAL A 52 12.278 29.320 15.873 1.00 0.00 C ATOM 0 H VAL A 52 11.772 28.191 12.601 1.00 0.00 H new ATOM 0 HA VAL A 52 14.062 27.959 14.573 1.00 0.00 H new ATOM 0 HB VAL A 52 11.032 28.178 14.526 1.00 0.00 H new ATOM 0 HG11 VAL A 52 10.864 27.200 16.788 1.00 0.00 H new ATOM 0 HG12 VAL A 52 11.435 26.001 15.603 1.00 0.00 H new ATOM 0 HG13 VAL A 52 12.588 26.763 16.725 1.00 0.00 H new ATOM 0 HG21 VAL A 52 11.457 29.584 16.540 1.00 0.00 H new ATOM 0 HG22 VAL A 52 13.185 29.168 16.457 1.00 0.00 H new ATOM 0 HG23 VAL A 52 12.438 30.127 15.158 1.00 0.00 H new ATOM 828 N SER A 53 14.275 25.555 14.403 1.00 0.00 N ATOM 829 CA SER A 53 14.441 24.080 14.285 1.00 0.00 C ATOM 830 C SER A 53 14.747 23.517 15.669 1.00 0.00 C ATOM 831 O SER A 53 14.868 24.265 16.629 1.00 0.00 O ATOM 832 CB SER A 53 15.622 23.874 13.342 1.00 0.00 C ATOM 833 OG SER A 53 16.638 24.821 13.644 1.00 0.00 O ATOM 0 H SER A 53 15.067 26.042 14.823 1.00 0.00 H new ATOM 0 HA SER A 53 13.551 23.579 13.905 1.00 0.00 H new ATOM 0 HB2 SER A 53 16.011 22.861 13.445 1.00 0.00 H new ATOM 0 HB3 SER A 53 15.299 23.988 12.307 1.00 0.00 H new ATOM 0 HG SER A 53 17.398 24.689 13.040 1.00 0.00 H new ATOM 839 N PHE A 54 14.835 22.224 15.808 1.00 0.00 N ATOM 840 CA PHE A 54 15.088 21.643 17.133 1.00 0.00 C ATOM 841 C PHE A 54 16.353 20.806 17.148 1.00 0.00 C ATOM 842 O PHE A 54 16.752 20.204 16.153 1.00 0.00 O ATOM 843 CB PHE A 54 13.871 20.778 17.369 1.00 0.00 C ATOM 844 CG PHE A 54 12.669 21.670 17.328 1.00 0.00 C ATOM 845 CD1 PHE A 54 12.324 22.420 18.455 1.00 0.00 C ATOM 846 CD2 PHE A 54 11.933 21.789 16.147 1.00 0.00 C ATOM 847 CE1 PHE A 54 11.235 23.286 18.404 1.00 0.00 C ATOM 848 CE2 PHE A 54 10.849 22.662 16.093 1.00 0.00 C ATOM 849 CZ PHE A 54 10.501 23.408 17.222 1.00 0.00 C ATOM 0 H PHE A 54 14.740 21.549 15.049 1.00 0.00 H new ATOM 0 HA PHE A 54 15.238 22.402 17.900 1.00 0.00 H new ATOM 0 HB2 PHE A 54 13.799 20.002 16.607 1.00 0.00 H new ATOM 0 HB3 PHE A 54 13.941 20.273 18.332 1.00 0.00 H new ATOM 0 HD1 PHE A 54 12.901 22.328 19.364 1.00 0.00 H new ATOM 0 HD2 PHE A 54 12.203 21.206 15.279 1.00 0.00 H new ATOM 0 HE1 PHE A 54 10.959 23.861 19.275 1.00 0.00 H new ATOM 0 HE2 PHE A 54 10.279 22.762 15.181 1.00 0.00 H new ATOM 0 HZ PHE A 54 9.659 24.083 17.180 1.00 0.00 H new ATOM 859 N TYR A 55 16.975 20.758 18.279 1.00 0.00 N ATOM 860 CA TYR A 55 18.219 19.963 18.426 1.00 0.00 C ATOM 861 C TYR A 55 18.134 19.106 19.676 1.00 0.00 C ATOM 862 O TYR A 55 17.443 19.448 20.629 1.00 0.00 O ATOM 863 CB TYR A 55 19.333 20.994 18.592 1.00 0.00 C ATOM 864 CG TYR A 55 19.590 21.664 17.269 1.00 0.00 C ATOM 865 CD1 TYR A 55 19.815 20.882 16.137 1.00 0.00 C ATOM 866 CD2 TYR A 55 19.603 23.058 17.170 1.00 0.00 C ATOM 867 CE1 TYR A 55 20.054 21.486 14.901 1.00 0.00 C ATOM 868 CE2 TYR A 55 19.842 23.667 15.936 1.00 0.00 C ATOM 869 CZ TYR A 55 20.070 22.882 14.799 1.00 0.00 C ATOM 870 OH TYR A 55 20.305 23.483 13.579 1.00 0.00 O ATOM 0 H TYR A 55 16.673 21.242 19.124 1.00 0.00 H new ATOM 0 HA TYR A 55 18.387 19.303 17.575 1.00 0.00 H new ATOM 0 HB2 TYR A 55 19.050 21.735 19.339 1.00 0.00 H new ATOM 0 HB3 TYR A 55 20.242 20.510 18.951 1.00 0.00 H new ATOM 0 HD1 TYR A 55 19.804 19.805 16.216 1.00 0.00 H new ATOM 0 HD2 TYR A 55 19.428 23.664 18.047 1.00 0.00 H new ATOM 0 HE1 TYR A 55 20.226 20.877 14.026 1.00 0.00 H new ATOM 0 HE2 TYR A 55 19.851 24.744 15.859 1.00 0.00 H new ATOM 0 HH TYR A 55 20.281 24.457 13.684 1.00 0.00 H new ATOM 880 N ALA A 56 18.849 18.023 19.712 1.00 0.00 N ATOM 881 CA ALA A 56 18.826 17.184 20.932 1.00 0.00 C ATOM 882 C ALA A 56 19.570 17.937 22.024 1.00 0.00 C ATOM 883 O ALA A 56 19.163 17.956 23.183 1.00 0.00 O ATOM 884 CB ALA A 56 19.553 15.902 20.563 1.00 0.00 C ATOM 0 H ALA A 56 19.444 17.685 18.956 1.00 0.00 H new ATOM 0 HA ALA A 56 17.820 16.961 21.289 1.00 0.00 H new ATOM 0 HB1 ALA A 56 19.572 15.234 21.424 1.00 0.00 H new ATOM 0 HB2 ALA A 56 19.035 15.415 19.737 1.00 0.00 H new ATOM 0 HB3 ALA A 56 20.574 16.136 20.263 1.00 0.00 H new ATOM 890 N ASN A 57 20.652 18.580 21.669 1.00 0.00 N ATOM 891 CA ASN A 57 21.407 19.350 22.667 1.00 0.00 C ATOM 892 C ASN A 57 21.854 20.677 22.087 1.00 0.00 C ATOM 893 O ASN A 57 21.873 20.900 20.869 1.00 0.00 O ATOM 894 CB ASN A 57 22.635 18.529 22.999 1.00 0.00 C ATOM 895 CG ASN A 57 23.420 18.247 21.728 1.00 0.00 C ATOM 896 OD1 ASN A 57 24.299 19.022 21.362 1.00 0.00 O ATOM 897 ND2 ASN A 57 23.146 17.184 21.032 1.00 0.00 N ATOM 0 H ASN A 57 21.036 18.597 20.724 1.00 0.00 H new ATOM 0 HA ASN A 57 20.791 19.549 23.544 1.00 0.00 H new ATOM 0 HB2 ASN A 57 23.260 19.065 23.713 1.00 0.00 H new ATOM 0 HB3 ASN A 57 22.341 17.592 23.472 1.00 0.00 H new ATOM 0 HD21 ASN A 57 23.663 16.989 20.175 1.00 0.00 H new ATOM 0 HD22 ASN A 57 22.414 16.545 21.343 1.00 0.00 H new ATOM 904 N ALA A 58 22.242 21.546 22.949 1.00 0.00 N ATOM 905 CA ALA A 58 22.724 22.863 22.507 1.00 0.00 C ATOM 906 C ALA A 58 23.980 22.707 21.651 1.00 0.00 C ATOM 907 O ALA A 58 24.268 23.555 20.828 1.00 0.00 O ATOM 908 CB ALA A 58 23.051 23.610 23.794 1.00 0.00 C ATOM 0 H ALA A 58 22.247 21.400 23.959 1.00 0.00 H new ATOM 0 HA ALA A 58 21.988 23.390 21.900 1.00 0.00 H new ATOM 0 HB1 ALA A 58 23.419 24.607 23.552 1.00 0.00 H new ATOM 0 HB2 ALA A 58 22.152 23.693 24.405 1.00 0.00 H new ATOM 0 HB3 ALA A 58 23.816 23.065 24.347 1.00 0.00 H new ATOM 914 N SER A 59 24.739 21.645 21.814 1.00 0.00 N ATOM 915 CA SER A 59 25.971 21.505 20.978 1.00 0.00 C ATOM 916 C SER A 59 25.569 21.241 19.533 1.00 0.00 C ATOM 917 O SER A 59 26.173 21.764 18.600 1.00 0.00 O ATOM 918 CB SER A 59 26.748 20.325 21.564 1.00 0.00 C ATOM 919 OG SER A 59 28.106 20.410 21.153 1.00 0.00 O ATOM 0 H SER A 59 24.562 20.888 22.474 1.00 0.00 H new ATOM 0 HA SER A 59 26.585 22.406 20.985 1.00 0.00 H new ATOM 0 HB2 SER A 59 26.683 20.336 22.652 1.00 0.00 H new ATOM 0 HB3 SER A 59 26.312 19.384 21.228 1.00 0.00 H new ATOM 0 HG SER A 59 28.609 19.657 21.527 1.00 0.00 H new ATOM 925 N GLU A 60 24.534 20.477 19.329 1.00 0.00 N ATOM 926 CA GLU A 60 24.069 20.232 17.945 1.00 0.00 C ATOM 927 C GLU A 60 23.693 21.586 17.359 1.00 0.00 C ATOM 928 O GLU A 60 24.140 21.990 16.279 1.00 0.00 O ATOM 929 CB GLU A 60 22.849 19.323 18.091 1.00 0.00 C ATOM 930 CG GLU A 60 22.369 18.884 16.710 1.00 0.00 C ATOM 931 CD GLU A 60 23.498 18.163 15.969 1.00 0.00 C ATOM 932 OE1 GLU A 60 24.308 18.840 15.359 1.00 0.00 O ATOM 933 OE2 GLU A 60 23.534 16.944 16.026 1.00 0.00 O ATOM 0 H GLU A 60 23.994 20.015 20.061 1.00 0.00 H new ATOM 0 HA GLU A 60 24.808 19.767 17.293 1.00 0.00 H new ATOM 0 HB2 GLU A 60 23.103 18.451 18.693 1.00 0.00 H new ATOM 0 HB3 GLU A 60 22.051 19.850 18.614 1.00 0.00 H new ATOM 0 HG2 GLU A 60 21.507 18.224 16.808 1.00 0.00 H new ATOM 0 HG3 GLU A 60 22.042 19.751 16.137 1.00 0.00 H new ATOM 940 N ALA A 61 22.920 22.328 18.102 1.00 0.00 N ATOM 941 CA ALA A 61 22.551 23.694 17.647 1.00 0.00 C ATOM 942 C ALA A 61 23.824 24.499 17.463 1.00 0.00 C ATOM 943 O ALA A 61 24.018 25.199 16.471 1.00 0.00 O ATOM 944 CB ALA A 61 21.749 24.277 18.793 1.00 0.00 C ATOM 0 H ALA A 61 22.530 22.047 19.002 1.00 0.00 H new ATOM 0 HA ALA A 61 21.995 23.698 16.709 1.00 0.00 H new ATOM 0 HB1 ALA A 61 21.435 25.290 18.539 1.00 0.00 H new ATOM 0 HB2 ALA A 61 20.869 23.659 18.973 1.00 0.00 H new ATOM 0 HB3 ALA A 61 22.365 24.302 19.692 1.00 0.00 H new ATOM 950 N LEU A 62 24.704 24.380 18.411 1.00 0.00 N ATOM 951 CA LEU A 62 25.994 25.092 18.335 1.00 0.00 C ATOM 952 C LEU A 62 26.731 24.616 17.081 1.00 0.00 C ATOM 953 O LEU A 62 27.516 25.347 16.479 1.00 0.00 O ATOM 954 CB LEU A 62 26.720 24.664 19.615 1.00 0.00 C ATOM 955 CG LEU A 62 26.087 25.321 20.851 1.00 0.00 C ATOM 956 CD1 LEU A 62 26.632 24.652 22.114 1.00 0.00 C ATOM 957 CD2 LEU A 62 26.410 26.815 20.910 1.00 0.00 C ATOM 0 H LEU A 62 24.578 23.809 19.247 1.00 0.00 H new ATOM 0 HA LEU A 62 25.912 26.177 18.267 1.00 0.00 H new ATOM 0 HB2 LEU A 62 26.681 23.579 19.715 1.00 0.00 H new ATOM 0 HB3 LEU A 62 27.772 24.940 19.550 1.00 0.00 H new ATOM 0 HG LEU A 62 25.006 25.198 20.785 1.00 0.00 H new ATOM 0 HD11 LEU A 62 26.185 25.116 22.993 1.00 0.00 H new ATOM 0 HD12 LEU A 62 26.385 23.590 22.099 1.00 0.00 H new ATOM 0 HD13 LEU A 62 27.715 24.772 22.151 1.00 0.00 H new ATOM 0 HD21 LEU A 62 25.949 27.252 21.795 1.00 0.00 H new ATOM 0 HD22 LEU A 62 27.490 26.952 20.959 1.00 0.00 H new ATOM 0 HD23 LEU A 62 26.022 27.307 20.018 1.00 0.00 H new ATOM 969 N ALA A 63 26.472 23.398 16.669 1.00 0.00 N ATOM 970 CA ALA A 63 27.121 22.861 15.455 1.00 0.00 C ATOM 971 C ALA A 63 26.435 23.415 14.202 1.00 0.00 C ATOM 972 O ALA A 63 26.999 23.393 13.109 1.00 0.00 O ATOM 973 CB ALA A 63 26.945 21.343 15.542 1.00 0.00 C ATOM 0 H ALA A 63 25.831 22.755 17.134 1.00 0.00 H new ATOM 0 HA ALA A 63 28.173 23.141 15.391 1.00 0.00 H new ATOM 0 HB1 ALA A 63 27.403 20.873 14.672 1.00 0.00 H new ATOM 0 HB2 ALA A 63 27.424 20.973 16.448 1.00 0.00 H new ATOM 0 HB3 ALA A 63 25.883 21.101 15.568 1.00 0.00 H new ATOM 979 N ALA A 64 25.232 23.922 14.338 1.00 0.00 N ATOM 980 CA ALA A 64 24.524 24.488 13.141 1.00 0.00 C ATOM 981 C ALA A 64 25.074 25.861 12.793 1.00 0.00 C ATOM 982 O ALA A 64 24.639 26.517 11.849 1.00 0.00 O ATOM 983 CB ALA A 64 23.039 24.590 13.512 1.00 0.00 C ATOM 0 H ALA A 64 24.713 23.969 15.215 1.00 0.00 H new ATOM 0 HA ALA A 64 24.669 23.850 12.269 1.00 0.00 H new ATOM 0 HB1 ALA A 64 22.481 24.998 12.670 1.00 0.00 H new ATOM 0 HB2 ALA A 64 22.656 23.599 13.755 1.00 0.00 H new ATOM 0 HB3 ALA A 64 22.924 25.245 14.375 1.00 0.00 H new ATOM 989 N GLY A 65 26.019 26.295 13.546 1.00 0.00 N ATOM 990 CA GLY A 65 26.636 27.631 13.302 1.00 0.00 C ATOM 991 C GLY A 65 25.770 28.723 13.939 1.00 0.00 C ATOM 992 O GLY A 65 25.599 29.805 13.381 1.00 0.00 O ATOM 0 H GLY A 65 26.407 25.782 14.338 1.00 0.00 H new ATOM 0 HA2 GLY A 65 27.642 27.660 13.721 1.00 0.00 H new ATOM 0 HA3 GLY A 65 26.732 27.808 12.231 1.00 0.00 H new ATOM 996 N PHE A 66 25.229 28.463 15.099 1.00 0.00 N ATOM 997 CA PHE A 66 24.381 29.487 15.779 1.00 0.00 C ATOM 998 C PHE A 66 25.026 29.986 17.063 1.00 0.00 C ATOM 999 O PHE A 66 25.893 29.341 17.648 1.00 0.00 O ATOM 1000 CB PHE A 66 23.058 28.793 16.117 1.00 0.00 C ATOM 1001 CG PHE A 66 22.263 28.546 14.863 1.00 0.00 C ATOM 1002 CD1 PHE A 66 22.743 27.689 13.873 1.00 0.00 C ATOM 1003 CD2 PHE A 66 21.033 29.193 14.697 1.00 0.00 C ATOM 1004 CE1 PHE A 66 21.991 27.476 12.711 1.00 0.00 C ATOM 1005 CE2 PHE A 66 20.282 28.982 13.541 1.00 0.00 C ATOM 1006 CZ PHE A 66 20.760 28.125 12.548 1.00 0.00 C ATOM 0 H PHE A 66 25.337 27.585 15.606 1.00 0.00 H new ATOM 0 HA PHE A 66 24.244 30.351 15.129 1.00 0.00 H new ATOM 0 HB2 PHE A 66 23.254 27.848 16.624 1.00 0.00 H new ATOM 0 HB3 PHE A 66 22.481 29.410 16.806 1.00 0.00 H new ATOM 0 HD1 PHE A 66 23.692 27.191 14.002 1.00 0.00 H new ATOM 0 HD2 PHE A 66 20.665 29.857 15.465 1.00 0.00 H new ATOM 0 HE1 PHE A 66 22.359 26.813 11.942 1.00 0.00 H new ATOM 0 HE2 PHE A 66 19.332 29.481 13.414 1.00 0.00 H new ATOM 0 HZ PHE A 66 20.180 27.962 11.652 1.00 0.00 H new ATOM 1016 N ARG A 67 24.573 31.113 17.529 1.00 0.00 N ATOM 1017 CA ARG A 67 25.097 31.667 18.799 1.00 0.00 C ATOM 1018 C ARG A 67 24.089 31.323 19.897 1.00 0.00 C ATOM 1019 O ARG A 67 22.946 31.772 19.851 1.00 0.00 O ATOM 1020 CB ARG A 67 25.174 33.182 18.578 1.00 0.00 C ATOM 1021 CG ARG A 67 26.620 33.660 18.756 1.00 0.00 C ATOM 1022 CD ARG A 67 26.736 34.481 20.043 1.00 0.00 C ATOM 1023 NE ARG A 67 28.013 35.238 19.901 1.00 0.00 N ATOM 1024 CZ ARG A 67 28.096 36.266 19.090 1.00 0.00 C ATOM 1025 NH1 ARG A 67 27.060 36.650 18.387 1.00 0.00 N ATOM 1026 NH2 ARG A 67 29.224 36.914 18.983 1.00 0.00 N ATOM 0 H ARG A 67 23.854 31.678 17.077 1.00 0.00 H new ATOM 0 HA ARG A 67 26.072 31.273 19.086 1.00 0.00 H new ATOM 0 HB2 ARG A 67 24.819 33.431 17.578 1.00 0.00 H new ATOM 0 HB3 ARG A 67 24.522 33.695 19.285 1.00 0.00 H new ATOM 0 HG2 ARG A 67 27.294 32.804 18.797 1.00 0.00 H new ATOM 0 HG3 ARG A 67 26.922 34.263 17.900 1.00 0.00 H new ATOM 0 HD2 ARG A 67 25.888 35.155 20.159 1.00 0.00 H new ATOM 0 HD3 ARG A 67 26.754 33.837 20.922 1.00 0.00 H new ATOM 0 HE ARG A 67 28.831 34.953 20.440 1.00 0.00 H new ATOM 0 HH11 ARG A 67 26.175 36.148 18.466 1.00 0.00 H new ATOM 0 HH12 ARG A 67 27.138 37.451 17.760 1.00 0.00 H new ATOM 0 HH21 ARG A 67 30.035 36.620 19.528 1.00 0.00 H new ATOM 0 HH22 ARG A 67 29.295 37.714 18.354 1.00 0.00 H new ATOM 1040 N PRO A 68 24.511 30.521 20.836 1.00 0.00 N ATOM 1041 CA PRO A 68 23.597 30.101 21.922 1.00 0.00 C ATOM 1042 C PRO A 68 23.123 31.306 22.735 1.00 0.00 C ATOM 1043 O PRO A 68 23.894 32.201 23.076 1.00 0.00 O ATOM 1044 CB PRO A 68 24.434 29.113 22.737 1.00 0.00 C ATOM 1045 CG PRO A 68 25.854 29.453 22.415 1.00 0.00 C ATOM 1046 CD PRO A 68 25.853 29.950 20.994 1.00 0.00 C ATOM 0 HA PRO A 68 22.675 29.641 21.565 1.00 0.00 H new ATOM 0 HB2 PRO A 68 24.236 29.214 23.804 1.00 0.00 H new ATOM 0 HB3 PRO A 68 24.203 28.083 22.466 1.00 0.00 H new ATOM 0 HG2 PRO A 68 26.236 30.215 23.094 1.00 0.00 H new ATOM 0 HG3 PRO A 68 26.498 28.580 22.522 1.00 0.00 H new ATOM 0 HD2 PRO A 68 26.630 30.697 20.829 1.00 0.00 H new ATOM 0 HD3 PRO A 68 26.032 29.142 20.285 1.00 0.00 H new ATOM 1054 N CYS A 69 21.850 31.345 23.025 1.00 0.00 N ATOM 1055 CA CYS A 69 21.274 32.484 23.787 1.00 0.00 C ATOM 1056 C CYS A 69 21.912 32.551 25.179 1.00 0.00 C ATOM 1057 O CYS A 69 21.793 31.629 25.980 1.00 0.00 O ATOM 1058 CB CYS A 69 19.778 32.169 23.837 1.00 0.00 C ATOM 1059 SG CYS A 69 18.903 33.169 25.081 1.00 0.00 S ATOM 0 H CYS A 69 21.178 30.624 22.761 1.00 0.00 H new ATOM 0 HA CYS A 69 21.457 33.460 23.337 1.00 0.00 H new ATOM 0 HB2 CYS A 69 19.338 32.348 22.856 1.00 0.00 H new ATOM 0 HB3 CYS A 69 19.639 31.111 24.061 1.00 0.00 H new ATOM 0 HG CYS A 69 18.060 32.419 25.726 1.00 0.00 H new ATOM 1064 N LYS A 70 22.590 33.629 25.477 1.00 0.00 N ATOM 1065 CA LYS A 70 23.258 33.764 26.814 1.00 0.00 C ATOM 1066 C LYS A 70 22.256 33.585 27.961 1.00 0.00 C ATOM 1067 O LYS A 70 22.621 33.603 29.133 1.00 0.00 O ATOM 1068 CB LYS A 70 23.837 35.176 26.829 1.00 0.00 C ATOM 1069 CG LYS A 70 25.071 35.213 27.736 1.00 0.00 C ATOM 1070 CD LYS A 70 24.677 35.730 29.122 1.00 0.00 C ATOM 1071 CE LYS A 70 25.467 34.976 30.194 1.00 0.00 C ATOM 1072 NZ LYS A 70 26.569 35.900 30.582 1.00 0.00 N ATOM 0 H LYS A 70 22.712 34.426 24.853 1.00 0.00 H new ATOM 0 HA LYS A 70 24.023 33.000 26.956 1.00 0.00 H new ATOM 0 HB2 LYS A 70 24.107 35.481 25.818 1.00 0.00 H new ATOM 0 HB3 LYS A 70 23.089 35.884 27.186 1.00 0.00 H new ATOM 0 HG2 LYS A 70 25.504 34.216 27.819 1.00 0.00 H new ATOM 0 HG3 LYS A 70 25.835 35.857 27.301 1.00 0.00 H new ATOM 0 HD2 LYS A 70 24.877 36.799 29.193 1.00 0.00 H new ATOM 0 HD3 LYS A 70 23.607 35.595 29.281 1.00 0.00 H new ATOM 0 HE2 LYS A 70 24.837 34.732 31.049 1.00 0.00 H new ATOM 0 HE3 LYS A 70 25.859 34.035 29.807 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 27.155 35.452 31.315 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 27.156 36.110 29.749 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 26.166 36.784 30.953 1.00 0.00 H new ATOM 1086 N ARG A 71 21.008 33.410 27.646 1.00 0.00 N ATOM 1087 CA ARG A 71 19.978 33.223 28.698 1.00 0.00 C ATOM 1088 C ARG A 71 19.649 31.736 28.771 1.00 0.00 C ATOM 1089 O ARG A 71 19.428 31.164 29.834 1.00 0.00 O ATOM 1090 CB ARG A 71 18.778 33.994 28.171 1.00 0.00 C ATOM 1091 CG ARG A 71 17.961 34.556 29.340 1.00 0.00 C ATOM 1092 CD ARG A 71 17.476 35.971 28.999 1.00 0.00 C ATOM 1093 NE ARG A 71 18.565 36.883 29.472 1.00 0.00 N ATOM 1094 CZ ARG A 71 18.318 37.860 30.312 1.00 0.00 C ATOM 1095 NH1 ARG A 71 17.108 38.076 30.768 1.00 0.00 N ATOM 1096 NH2 ARG A 71 19.297 38.630 30.700 1.00 0.00 N ATOM 0 H ARG A 71 20.653 33.388 26.690 1.00 0.00 H new ATOM 0 HA ARG A 71 20.284 33.559 29.689 1.00 0.00 H new ATOM 0 HB2 ARG A 71 19.112 34.807 27.526 1.00 0.00 H new ATOM 0 HB3 ARG A 71 18.154 33.340 27.562 1.00 0.00 H new ATOM 0 HG2 ARG A 71 17.108 33.908 29.545 1.00 0.00 H new ATOM 0 HG3 ARG A 71 18.569 34.578 30.244 1.00 0.00 H new ATOM 0 HD2 ARG A 71 17.307 36.082 27.928 1.00 0.00 H new ATOM 0 HD3 ARG A 71 16.532 36.194 29.496 1.00 0.00 H new ATOM 0 HE ARG A 71 19.517 36.742 29.135 1.00 0.00 H new ATOM 0 HH11 ARG A 71 16.337 37.479 30.470 1.00 0.00 H new ATOM 0 HH12 ARG A 71 16.938 38.841 31.421 1.00 0.00 H new ATOM 0 HH21 ARG A 71 20.242 38.469 30.351 1.00 0.00 H new ATOM 0 HH22 ARG A 71 19.118 39.393 31.353 1.00 0.00 H new ATOM 1110 N CYS A 72 19.626 31.116 27.626 1.00 0.00 N ATOM 1111 CA CYS A 72 19.326 29.655 27.533 1.00 0.00 C ATOM 1112 C CYS A 72 20.619 28.848 27.431 1.00 0.00 C ATOM 1113 O CYS A 72 20.595 27.629 27.300 1.00 0.00 O ATOM 1114 CB CYS A 72 18.525 29.481 26.247 1.00 0.00 C ATOM 1115 SG CYS A 72 16.879 30.181 26.457 1.00 0.00 S ATOM 0 H CYS A 72 19.806 31.568 26.729 1.00 0.00 H new ATOM 0 HA CYS A 72 18.784 29.307 28.413 1.00 0.00 H new ATOM 0 HB2 CYS A 72 19.037 29.972 25.419 1.00 0.00 H new ATOM 0 HB3 CYS A 72 18.451 28.423 25.993 1.00 0.00 H new ATOM 0 HG CYS A 72 15.987 29.316 26.075 1.00 0.00 H new ATOM 1120 N GLN A 73 21.745 29.502 27.444 1.00 0.00 N ATOM 1121 CA GLN A 73 23.029 28.760 27.313 1.00 0.00 C ATOM 1122 C GLN A 73 23.689 28.518 28.691 1.00 0.00 C ATOM 1123 O GLN A 73 24.109 27.398 28.976 1.00 0.00 O ATOM 1124 CB GLN A 73 23.886 29.644 26.397 1.00 0.00 C ATOM 1125 CG GLN A 73 25.334 29.138 26.366 1.00 0.00 C ATOM 1126 CD GLN A 73 26.270 30.231 26.887 1.00 0.00 C ATOM 1127 OE1 GLN A 73 26.946 30.048 27.897 1.00 0.00 O ATOM 1128 NE2 GLN A 73 26.349 31.365 26.246 1.00 0.00 N ATOM 0 H GLN A 73 21.833 30.514 27.539 1.00 0.00 H new ATOM 0 HA GLN A 73 22.896 27.761 26.898 1.00 0.00 H new ATOM 0 HB2 GLN A 73 23.472 29.642 25.389 1.00 0.00 H new ATOM 0 HB3 GLN A 73 23.862 30.675 26.750 1.00 0.00 H new ATOM 0 HG2 GLN A 73 25.430 28.241 26.978 1.00 0.00 H new ATOM 0 HG3 GLN A 73 25.612 28.861 25.349 1.00 0.00 H new ATOM 0 HE21 GLN A 73 25.788 31.517 25.408 1.00 0.00 H new ATOM 0 HE22 GLN A 73 26.972 32.099 26.583 1.00 0.00 H new ATOM 1137 N PRO A 74 23.781 29.543 29.509 1.00 0.00 N ATOM 1138 CA PRO A 74 24.411 29.384 30.844 1.00 0.00 C ATOM 1139 C PRO A 74 23.406 28.890 31.898 1.00 0.00 C ATOM 1140 O PRO A 74 23.791 28.361 32.938 1.00 0.00 O ATOM 1141 CB PRO A 74 24.871 30.795 31.182 1.00 0.00 C ATOM 1142 CG PRO A 74 23.972 31.712 30.406 1.00 0.00 C ATOM 1143 CD PRO A 74 23.334 30.920 29.286 1.00 0.00 C ATOM 0 HA PRO A 74 25.213 28.646 30.835 1.00 0.00 H new ATOM 0 HB2 PRO A 74 24.795 30.986 32.252 1.00 0.00 H new ATOM 0 HB3 PRO A 74 25.915 30.943 30.905 1.00 0.00 H new ATOM 0 HG2 PRO A 74 23.206 32.133 31.057 1.00 0.00 H new ATOM 0 HG3 PRO A 74 24.541 32.549 30.002 1.00 0.00 H new ATOM 0 HD2 PRO A 74 22.247 30.994 29.317 1.00 0.00 H new ATOM 0 HD3 PRO A 74 23.651 31.287 28.310 1.00 0.00 H new ATOM 1151 N ASP A 75 22.132 29.063 31.665 1.00 0.00 N ATOM 1152 CA ASP A 75 21.114 28.616 32.669 1.00 0.00 C ATOM 1153 C ASP A 75 20.965 27.092 32.646 1.00 0.00 C ATOM 1154 O ASP A 75 21.609 26.402 31.857 1.00 0.00 O ATOM 1155 CB ASP A 75 19.806 29.286 32.242 1.00 0.00 C ATOM 1156 CG ASP A 75 19.365 28.710 30.898 1.00 0.00 C ATOM 1157 OD1 ASP A 75 20.160 28.743 29.979 1.00 0.00 O ATOM 1158 OD2 ASP A 75 18.245 28.230 30.817 1.00 0.00 O ATOM 0 H ASP A 75 21.749 29.494 30.824 1.00 0.00 H new ATOM 0 HA ASP A 75 21.401 28.889 33.685 1.00 0.00 H new ATOM 0 HB2 ASP A 75 19.035 29.119 32.994 1.00 0.00 H new ATOM 0 HB3 ASP A 75 19.944 30.364 32.162 1.00 0.00 H new ATOM 1163 N LYS A 76 20.129 26.552 33.495 1.00 0.00 N ATOM 1164 CA LYS A 76 19.937 25.075 33.519 1.00 0.00 C ATOM 1165 C LYS A 76 18.526 24.693 33.034 1.00 0.00 C ATOM 1166 O LYS A 76 17.527 25.293 33.424 1.00 0.00 O ATOM 1167 CB LYS A 76 20.127 24.695 34.981 1.00 0.00 C ATOM 1168 CG LYS A 76 21.609 24.800 35.348 1.00 0.00 C ATOM 1169 CD LYS A 76 22.357 23.571 34.823 1.00 0.00 C ATOM 1170 CE LYS A 76 23.844 23.687 35.175 1.00 0.00 C ATOM 1171 NZ LYS A 76 24.527 23.987 33.884 1.00 0.00 N ATOM 0 H LYS A 76 19.572 27.072 34.172 1.00 0.00 H new ATOM 0 HA LYS A 76 20.632 24.557 32.859 1.00 0.00 H new ATOM 0 HB2 LYS A 76 19.536 25.353 35.618 1.00 0.00 H new ATOM 0 HB3 LYS A 76 19.770 23.680 35.153 1.00 0.00 H new ATOM 0 HG2 LYS A 76 22.036 25.708 34.922 1.00 0.00 H new ATOM 0 HG3 LYS A 76 21.722 24.872 36.430 1.00 0.00 H new ATOM 0 HD2 LYS A 76 21.939 22.664 35.260 1.00 0.00 H new ATOM 0 HD3 LYS A 76 22.233 23.491 33.743 1.00 0.00 H new ATOM 0 HE2 LYS A 76 24.016 24.478 35.905 1.00 0.00 H new ATOM 0 HE3 LYS A 76 24.219 22.762 35.613 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 25.550 24.080 34.046 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 24.352 23.214 33.211 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 24.156 24.876 33.493 1.00 0.00 H new ATOM 1185 N ALA A 77 18.442 23.702 32.186 1.00 0.00 N ATOM 1186 CA ALA A 77 17.118 23.243 31.645 1.00 0.00 C ATOM 1187 C ALA A 77 16.568 22.102 32.526 1.00 0.00 C ATOM 1188 O ALA A 77 16.419 22.272 33.726 1.00 0.00 O ATOM 1189 CB ALA A 77 17.478 22.761 30.245 1.00 0.00 C ATOM 0 H ALA A 77 19.246 23.180 31.837 1.00 0.00 H new ATOM 0 HA ALA A 77 16.342 24.008 31.632 1.00 0.00 H new ATOM 0 HB1 ALA A 77 16.581 22.397 29.744 1.00 0.00 H new ATOM 0 HB2 ALA A 77 17.903 23.586 29.674 1.00 0.00 H new ATOM 0 HB3 ALA A 77 18.208 21.954 30.314 1.00 0.00 H new ATOM 1195 N ASN A 78 16.311 20.919 31.993 1.00 0.00 N ATOM 1196 CA ASN A 78 15.850 19.816 32.889 1.00 0.00 C ATOM 1197 C ASN A 78 16.911 19.588 33.973 1.00 0.00 C ATOM 1198 O ASN A 78 16.578 19.256 35.108 1.00 0.00 O ATOM 1199 CB ASN A 78 15.692 18.558 32.024 1.00 0.00 C ATOM 1200 CG ASN A 78 14.357 18.578 31.266 1.00 0.00 C ATOM 1201 OD1 ASN A 78 13.298 19.104 31.822 1.00 0.00 O flip ATOM 1202 ND2 ASN A 78 14.277 18.094 30.140 1.00 0.00 N flip ATOM 0 H ASN A 78 16.400 20.682 31.005 1.00 0.00 H new ATOM 0 HA ASN A 78 14.903 20.059 33.371 1.00 0.00 H new ATOM 0 HB2 ASN A 78 16.517 18.494 31.314 1.00 0.00 H new ATOM 0 HB3 ASN A 78 15.744 17.670 32.654 1.00 0.00 H new ATOM 0 HD21 ASN A 78 15.101 17.682 29.702 1.00 0.00 H new ATOM 0 HD22 ASN A 78 13.386 18.104 29.643 1.00 0.00 H new ATOM 1209 N PRO A 79 18.155 19.841 33.623 1.00 0.00 N ATOM 1210 CA PRO A 79 19.264 19.736 34.615 1.00 0.00 C ATOM 1211 C PRO A 79 18.999 20.762 35.724 1.00 0.00 C ATOM 1212 O PRO A 79 19.528 20.668 36.829 1.00 0.00 O ATOM 1213 CB PRO A 79 20.489 20.101 33.757 1.00 0.00 C ATOM 1214 CG PRO A 79 19.922 20.939 32.680 1.00 0.00 C ATOM 1215 CD PRO A 79 18.673 20.232 32.306 1.00 0.00 C ATOM 0 HA PRO A 79 19.383 18.771 35.108 1.00 0.00 H new ATOM 0 HB2 PRO A 79 21.236 20.644 34.336 1.00 0.00 H new ATOM 0 HB3 PRO A 79 20.978 19.212 33.358 1.00 0.00 H new ATOM 0 HG2 PRO A 79 19.720 21.953 33.026 1.00 0.00 H new ATOM 0 HG3 PRO A 79 20.605 21.020 31.834 1.00 0.00 H new ATOM 0 HD2 PRO A 79 17.980 20.879 31.768 1.00 0.00 H new ATOM 0 HD3 PRO A 79 18.865 19.370 31.668 1.00 0.00 H new ATOM 1223 N ARG A 80 18.159 21.740 35.435 1.00 0.00 N ATOM 1224 CA ARG A 80 17.811 22.773 36.437 1.00 0.00 C ATOM 1225 C ARG A 80 17.480 22.109 37.774 1.00 0.00 C ATOM 1226 O ARG A 80 18.213 22.230 38.753 1.00 0.00 O ATOM 1227 CB ARG A 80 16.568 23.489 35.910 1.00 0.00 C ATOM 1228 CG ARG A 80 16.204 24.644 36.849 1.00 0.00 C ATOM 1229 CD ARG A 80 17.079 25.861 36.530 1.00 0.00 C ATOM 1230 NE ARG A 80 16.153 27.030 36.586 1.00 0.00 N ATOM 1231 CZ ARG A 80 15.242 27.211 35.661 1.00 0.00 C ATOM 1232 NH1 ARG A 80 15.122 26.368 34.666 1.00 0.00 N ATOM 1233 NH2 ARG A 80 14.444 28.242 35.733 1.00 0.00 N ATOM 0 H ARG A 80 17.702 21.854 34.530 1.00 0.00 H new ATOM 0 HA ARG A 80 18.639 23.465 36.590 1.00 0.00 H new ATOM 0 HB2 ARG A 80 16.753 23.868 34.905 1.00 0.00 H new ATOM 0 HB3 ARG A 80 15.736 22.789 35.838 1.00 0.00 H new ATOM 0 HG2 ARG A 80 15.151 24.901 36.735 1.00 0.00 H new ATOM 0 HG3 ARG A 80 16.348 24.342 37.886 1.00 0.00 H new ATOM 0 HD2 ARG A 80 17.889 25.965 37.252 1.00 0.00 H new ATOM 0 HD3 ARG A 80 17.539 25.769 35.546 1.00 0.00 H new ATOM 0 HE ARG A 80 16.230 27.697 37.354 1.00 0.00 H new ATOM 0 HH11 ARG A 80 15.741 25.560 34.605 1.00 0.00 H new ATOM 0 HH12 ARG A 80 14.409 26.520 33.952 1.00 0.00 H new ATOM 0 HH21 ARG A 80 14.531 28.902 36.506 1.00 0.00 H new ATOM 0 HH22 ARG A 80 13.733 28.388 35.016 1.00 0.00 H new ATOM 1247 N GLN A 81 16.376 21.416 37.827 1.00 0.00 N ATOM 1248 CA GLN A 81 15.950 20.737 39.090 1.00 0.00 C ATOM 1249 C GLN A 81 17.090 19.907 39.721 1.00 0.00 C ATOM 1250 O GLN A 81 17.197 19.809 40.944 1.00 0.00 O ATOM 1251 CB GLN A 81 14.799 19.821 38.671 1.00 0.00 C ATOM 1252 CG GLN A 81 13.586 20.669 38.281 1.00 0.00 C ATOM 1253 CD GLN A 81 12.660 20.821 39.490 1.00 0.00 C ATOM 1254 OE1 GLN A 81 13.113 20.792 40.632 1.00 0.00 O ATOM 1255 NE2 GLN A 81 11.379 20.980 39.300 1.00 0.00 N ATOM 0 H GLN A 81 15.740 21.288 37.040 1.00 0.00 H new ATOM 0 HA GLN A 81 15.662 21.465 39.848 1.00 0.00 H new ATOM 0 HB2 GLN A 81 15.104 19.197 37.831 1.00 0.00 H new ATOM 0 HB3 GLN A 81 14.538 19.150 39.489 1.00 0.00 H new ATOM 0 HG2 GLN A 81 13.911 21.649 37.933 1.00 0.00 H new ATOM 0 HG3 GLN A 81 13.050 20.199 37.456 1.00 0.00 H new ATOM 0 HE21 GLN A 81 11.003 21.004 38.352 1.00 0.00 H new ATOM 0 HE22 GLN A 81 10.753 21.080 40.099 1.00 0.00 H new ATOM 1264 N HIS A 82 17.934 19.303 38.919 1.00 0.00 N ATOM 1265 CA HIS A 82 19.047 18.473 39.483 1.00 0.00 C ATOM 1266 C HIS A 82 20.082 19.377 40.172 1.00 0.00 C ATOM 1267 O HIS A 82 20.527 19.110 41.297 1.00 0.00 O ATOM 1268 CB HIS A 82 19.669 17.770 38.272 1.00 0.00 C ATOM 1269 CG HIS A 82 20.881 16.989 38.705 1.00 0.00 C ATOM 1270 ND1 HIS A 82 20.798 15.681 39.158 1.00 0.00 N ATOM 1271 CD2 HIS A 82 22.213 17.320 38.761 1.00 0.00 C ATOM 1272 CE1 HIS A 82 22.044 15.277 39.464 1.00 0.00 C ATOM 1273 NE2 HIS A 82 22.945 16.237 39.240 1.00 0.00 N ATOM 0 H HIS A 82 17.901 19.348 37.901 1.00 0.00 H new ATOM 0 HA HIS A 82 18.697 17.762 40.231 1.00 0.00 H new ATOM 0 HB2 HIS A 82 18.940 17.103 37.813 1.00 0.00 H new ATOM 0 HB3 HIS A 82 19.949 18.505 37.517 1.00 0.00 H new ATOM 0 HD2 HIS A 82 22.629 18.275 38.477 1.00 0.00 H new ATOM 0 HE1 HIS A 82 22.286 14.296 39.845 1.00 0.00 H new ATOM 0 HE2 HIS A 82 23.953 16.187 39.388 1.00 0.00 H new ATOM 1281 N ARG A 83 20.464 20.450 39.535 1.00 0.00 N ATOM 1282 CA ARG A 83 21.457 21.361 40.166 1.00 0.00 C ATOM 1283 C ARG A 83 20.817 22.023 41.386 1.00 0.00 C ATOM 1284 O ARG A 83 21.503 22.438 42.333 1.00 0.00 O ATOM 1285 CB ARG A 83 21.793 22.403 39.096 1.00 0.00 C ATOM 1286 CG ARG A 83 23.066 23.154 39.496 1.00 0.00 C ATOM 1287 CD ARG A 83 22.898 24.648 39.210 1.00 0.00 C ATOM 1288 NE ARG A 83 24.289 25.167 39.049 1.00 0.00 N ATOM 1289 CZ ARG A 83 24.510 26.315 38.454 1.00 0.00 C ATOM 1290 NH1 ARG A 83 23.519 27.032 37.988 1.00 0.00 N ATOM 1291 NH2 ARG A 83 25.735 26.750 38.325 1.00 0.00 N ATOM 0 H ARG A 83 20.134 20.733 38.612 1.00 0.00 H new ATOM 0 HA ARG A 83 22.354 20.842 40.502 1.00 0.00 H new ATOM 0 HB2 ARG A 83 21.933 21.916 38.131 1.00 0.00 H new ATOM 0 HB3 ARG A 83 20.965 23.103 38.983 1.00 0.00 H new ATOM 0 HG2 ARG A 83 23.274 22.998 40.555 1.00 0.00 H new ATOM 0 HG3 ARG A 83 23.919 22.762 38.943 1.00 0.00 H new ATOM 0 HD2 ARG A 83 22.308 24.814 38.309 1.00 0.00 H new ATOM 0 HD3 ARG A 83 22.381 25.151 40.027 1.00 0.00 H new ATOM 0 HE ARG A 83 25.075 24.623 39.405 1.00 0.00 H new ATOM 0 HH11 ARG A 83 22.559 26.700 38.085 1.00 0.00 H new ATOM 0 HH12 ARG A 83 23.706 27.923 37.528 1.00 0.00 H new ATOM 0 HH21 ARG A 83 26.513 26.198 38.686 1.00 0.00 H new ATOM 0 HH22 ARG A 83 25.914 27.642 37.863 1.00 0.00 H new ATOM 1305 N LEU A 84 19.510 22.106 41.410 1.00 0.00 N ATOM 1306 CA LEU A 84 18.871 22.712 42.572 1.00 0.00 C ATOM 1307 C LEU A 84 18.853 21.694 43.706 1.00 0.00 C ATOM 1308 O LEU A 84 18.988 22.049 44.880 1.00 0.00 O ATOM 1309 CB LEU A 84 17.471 23.119 42.160 1.00 0.00 C ATOM 1310 CG LEU A 84 17.440 24.636 41.952 1.00 0.00 C ATOM 1311 CD1 LEU A 84 17.994 25.392 43.193 1.00 0.00 C ATOM 1312 CD2 LEU A 84 18.293 24.969 40.737 1.00 0.00 C ATOM 0 H LEU A 84 18.882 21.779 40.676 1.00 0.00 H new ATOM 0 HA LEU A 84 19.409 23.593 42.923 1.00 0.00 H new ATOM 0 HB2 LEU A 84 17.183 22.606 41.242 1.00 0.00 H new ATOM 0 HB3 LEU A 84 16.752 22.828 42.926 1.00 0.00 H new ATOM 0 HG LEU A 84 16.407 24.951 41.803 1.00 0.00 H new ATOM 0 HD11 LEU A 84 17.957 26.466 43.011 1.00 0.00 H new ATOM 0 HD12 LEU A 84 17.388 25.151 44.066 1.00 0.00 H new ATOM 0 HD13 LEU A 84 19.026 25.089 43.373 1.00 0.00 H new ATOM 0 HD21 LEU A 84 18.285 26.046 40.571 1.00 0.00 H new ATOM 0 HD22 LEU A 84 19.317 24.636 40.909 1.00 0.00 H new ATOM 0 HD23 LEU A 84 17.890 24.463 39.860 1.00 0.00 H new ATOM 1324 N ASP A 85 18.762 20.428 43.389 1.00 0.00 N ATOM 1325 CA ASP A 85 18.822 19.407 44.472 1.00 0.00 C ATOM 1326 C ASP A 85 20.179 19.554 45.169 1.00 0.00 C ATOM 1327 O ASP A 85 20.309 19.451 46.395 1.00 0.00 O ATOM 1328 CB ASP A 85 18.737 18.064 43.755 1.00 0.00 C ATOM 1329 CG ASP A 85 17.275 17.634 43.629 1.00 0.00 C ATOM 1330 OD1 ASP A 85 16.733 17.153 44.610 1.00 0.00 O ATOM 1331 OD2 ASP A 85 16.722 17.792 42.553 1.00 0.00 O ATOM 0 H ASP A 85 18.651 20.063 42.443 1.00 0.00 H new ATOM 0 HA ASP A 85 18.031 19.507 45.216 1.00 0.00 H new ATOM 0 HB2 ASP A 85 19.189 18.140 42.766 1.00 0.00 H new ATOM 0 HB3 ASP A 85 19.301 17.311 44.306 1.00 0.00 H new ATOM 1336 N LYS A 86 21.188 19.835 44.390 1.00 0.00 N ATOM 1337 CA LYS A 86 22.558 20.034 44.957 1.00 0.00 C ATOM 1338 C LYS A 86 22.570 21.197 45.976 1.00 0.00 C ATOM 1339 O LYS A 86 23.049 21.052 47.105 1.00 0.00 O ATOM 1340 CB LYS A 86 23.436 20.374 43.751 1.00 0.00 C ATOM 1341 CG LYS A 86 24.907 20.405 44.175 1.00 0.00 C ATOM 1342 CD LYS A 86 25.717 19.448 43.297 1.00 0.00 C ATOM 1343 CE LYS A 86 27.173 19.916 43.237 1.00 0.00 C ATOM 1344 NZ LYS A 86 27.538 19.857 41.795 1.00 0.00 N ATOM 0 H LYS A 86 21.124 19.937 43.377 1.00 0.00 H new ATOM 0 HA LYS A 86 22.909 19.151 45.491 1.00 0.00 H new ATOM 0 HB2 LYS A 86 23.290 19.635 42.963 1.00 0.00 H new ATOM 0 HB3 LYS A 86 23.146 21.341 43.339 1.00 0.00 H new ATOM 0 HG2 LYS A 86 25.300 21.418 44.085 1.00 0.00 H new ATOM 0 HG3 LYS A 86 25.000 20.119 45.223 1.00 0.00 H new ATOM 0 HD2 LYS A 86 25.666 18.437 43.700 1.00 0.00 H new ATOM 0 HD3 LYS A 86 25.294 19.413 42.293 1.00 0.00 H new ATOM 0 HE2 LYS A 86 27.279 20.927 43.630 1.00 0.00 H new ATOM 0 HE3 LYS A 86 27.819 19.273 43.834 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 28.524 20.164 41.674 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 27.434 18.881 41.450 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 26.911 20.484 41.252 1.00 0.00 H new ATOM 1358 N ILE A 87 22.060 22.348 45.605 1.00 0.00 N ATOM 1359 CA ILE A 87 22.062 23.512 46.565 1.00 0.00 C ATOM 1360 C ILE A 87 21.264 23.163 47.849 1.00 0.00 C ATOM 1361 O ILE A 87 21.657 23.515 48.960 1.00 0.00 O ATOM 1362 CB ILE A 87 21.464 24.711 45.808 1.00 0.00 C ATOM 1363 CG1 ILE A 87 21.942 24.706 44.337 1.00 0.00 C ATOM 1364 CG2 ILE A 87 21.947 25.994 46.491 1.00 0.00 C ATOM 1365 CD1 ILE A 87 22.474 26.088 43.930 1.00 0.00 C ATOM 0 H ILE A 87 21.646 22.536 44.692 1.00 0.00 H new ATOM 0 HA ILE A 87 23.070 23.754 46.900 1.00 0.00 H new ATOM 0 HB ILE A 87 20.376 24.652 45.822 1.00 0.00 H new ATOM 0 HG12 ILE A 87 22.724 23.958 44.207 1.00 0.00 H new ATOM 0 HG13 ILE A 87 21.117 24.422 43.683 1.00 0.00 H new ATOM 0 HG21 ILE A 87 21.536 26.860 45.972 1.00 0.00 H new ATOM 0 HG22 ILE A 87 21.614 26.001 47.529 1.00 0.00 H new ATOM 0 HG23 ILE A 87 23.036 26.035 46.459 1.00 0.00 H new ATOM 0 HD11 ILE A 87 22.804 26.059 42.892 1.00 0.00 H new ATOM 0 HD12 ILE A 87 21.682 26.829 44.039 1.00 0.00 H new ATOM 0 HD13 ILE A 87 23.314 26.358 44.570 1.00 0.00 H new ATOM 1377 N THR A 88 20.180 22.433 47.735 1.00 0.00 N ATOM 1378 CA THR A 88 19.429 22.026 48.962 1.00 0.00 C ATOM 1379 C THR A 88 20.423 21.326 49.895 1.00 0.00 C ATOM 1380 O THR A 88 20.505 21.613 51.094 1.00 0.00 O ATOM 1381 CB THR A 88 18.353 21.050 48.478 1.00 0.00 C ATOM 1382 OG1 THR A 88 17.599 21.657 47.437 1.00 0.00 O ATOM 1383 CG2 THR A 88 17.426 20.693 49.640 1.00 0.00 C ATOM 0 H THR A 88 19.787 22.104 46.853 1.00 0.00 H new ATOM 0 HA THR A 88 18.974 22.860 49.497 1.00 0.00 H new ATOM 0 HB THR A 88 18.827 20.143 48.103 1.00 0.00 H new ATOM 0 HG1 THR A 88 16.911 21.033 47.125 1.00 0.00 H new ATOM 0 HG21 THR A 88 16.660 19.998 49.294 1.00 0.00 H new ATOM 0 HG22 THR A 88 18.005 20.228 50.438 1.00 0.00 H new ATOM 0 HG23 THR A 88 16.951 21.598 50.018 1.00 0.00 H new ATOM 1391 N HIS A 89 21.225 20.444 49.342 1.00 0.00 N ATOM 1392 CA HIS A 89 22.266 19.765 50.168 1.00 0.00 C ATOM 1393 C HIS A 89 23.134 20.851 50.812 1.00 0.00 C ATOM 1394 O HIS A 89 23.536 20.754 51.970 1.00 0.00 O ATOM 1395 CB HIS A 89 23.084 18.921 49.188 1.00 0.00 C ATOM 1396 CG HIS A 89 23.612 17.706 49.901 1.00 0.00 C ATOM 1397 ND1 HIS A 89 23.912 17.714 51.254 1.00 0.00 N ATOM 1398 CD2 HIS A 89 23.885 16.434 49.464 1.00 0.00 C ATOM 1399 CE1 HIS A 89 24.344 16.482 51.580 1.00 0.00 C ATOM 1400 NE2 HIS A 89 24.348 15.663 50.527 1.00 0.00 N ATOM 0 H HIS A 89 21.201 20.169 48.360 1.00 0.00 H new ATOM 0 HA HIS A 89 21.853 19.139 50.959 1.00 0.00 H new ATOM 0 HB2 HIS A 89 22.464 18.621 48.343 1.00 0.00 H new ATOM 0 HB3 HIS A 89 23.909 19.508 48.785 1.00 0.00 H new ATOM 0 HD1 HIS A 89 23.822 18.509 51.887 1.00 0.00 H new ATOM 0 HD2 HIS A 89 23.760 16.084 48.450 1.00 0.00 H new ATOM 0 HE1 HIS A 89 24.650 16.191 52.574 1.00 0.00 H new ATOM 1408 N ALA A 90 23.383 21.917 50.080 1.00 0.00 N ATOM 1409 CA ALA A 90 24.171 23.053 50.637 1.00 0.00 C ATOM 1410 C ALA A 90 23.493 23.493 51.919 1.00 0.00 C ATOM 1411 O ALA A 90 24.150 23.780 52.917 1.00 0.00 O ATOM 1412 CB ALA A 90 24.099 24.190 49.589 1.00 0.00 C ATOM 0 H ALA A 90 23.070 22.043 49.117 1.00 0.00 H new ATOM 0 HA ALA A 90 25.207 22.787 50.845 1.00 0.00 H new ATOM 0 HB1 ALA A 90 24.662 25.052 49.948 1.00 0.00 H new ATOM 0 HB2 ALA A 90 24.525 23.844 48.647 1.00 0.00 H new ATOM 0 HB3 ALA A 90 23.059 24.476 49.433 1.00 0.00 H new ATOM 1418 N CYS A 91 22.178 23.522 51.934 1.00 0.00 N ATOM 1419 CA CYS A 91 21.511 23.931 53.194 1.00 0.00 C ATOM 1420 C CYS A 91 21.865 22.926 54.288 1.00 0.00 C ATOM 1421 O CYS A 91 22.254 23.300 55.395 1.00 0.00 O ATOM 1422 CB CYS A 91 20.001 23.941 52.997 1.00 0.00 C ATOM 1423 SG CYS A 91 19.263 24.527 54.556 1.00 0.00 S ATOM 0 H CYS A 91 21.564 23.288 51.154 1.00 0.00 H new ATOM 0 HA CYS A 91 21.845 24.929 53.477 1.00 0.00 H new ATOM 0 HB2 CYS A 91 19.725 24.595 52.170 1.00 0.00 H new ATOM 0 HB3 CYS A 91 19.638 22.943 52.750 1.00 0.00 H new ATOM 0 HG CYS A 91 19.220 23.548 55.411 1.00 0.00 H new ATOM 1429 N ARG A 92 21.749 21.657 54.002 1.00 0.00 N ATOM 1430 CA ARG A 92 22.095 20.629 55.032 1.00 0.00 C ATOM 1431 C ARG A 92 23.454 20.966 55.666 1.00 0.00 C ATOM 1432 O ARG A 92 23.577 21.096 56.878 1.00 0.00 O ATOM 1433 CB ARG A 92 22.166 19.306 54.265 1.00 0.00 C ATOM 1434 CG ARG A 92 21.772 18.154 55.192 1.00 0.00 C ATOM 1435 CD ARG A 92 21.603 16.869 54.373 1.00 0.00 C ATOM 1436 NE ARG A 92 20.135 16.770 54.110 1.00 0.00 N ATOM 1437 CZ ARG A 92 19.616 17.221 52.992 1.00 0.00 C ATOM 1438 NH1 ARG A 92 20.368 17.770 52.074 1.00 0.00 N ATOM 1439 NH2 ARG A 92 18.330 17.119 52.793 1.00 0.00 N ATOM 0 H ARG A 92 21.432 21.287 53.106 1.00 0.00 H new ATOM 0 HA ARG A 92 21.367 20.585 55.842 1.00 0.00 H new ATOM 0 HB2 ARG A 92 21.499 19.337 53.403 1.00 0.00 H new ATOM 0 HB3 ARG A 92 23.174 19.150 53.882 1.00 0.00 H new ATOM 0 HG2 ARG A 92 22.536 18.012 55.957 1.00 0.00 H new ATOM 0 HG3 ARG A 92 20.843 18.392 55.710 1.00 0.00 H new ATOM 0 HD2 ARG A 92 22.169 16.916 53.442 1.00 0.00 H new ATOM 0 HD3 ARG A 92 21.965 16.000 54.922 1.00 0.00 H new ATOM 0 HE ARG A 92 19.527 16.345 54.810 1.00 0.00 H new ATOM 0 HH11 ARG A 92 21.374 17.853 52.221 1.00 0.00 H new ATOM 0 HH12 ARG A 92 19.949 18.115 51.211 1.00 0.00 H new ATOM 0 HH21 ARG A 92 17.736 16.691 53.504 1.00 0.00 H new ATOM 0 HH22 ARG A 92 17.919 17.467 51.927 1.00 0.00 H new ATOM 1453 N LEU A 93 24.466 21.127 54.857 1.00 0.00 N ATOM 1454 CA LEU A 93 25.827 21.475 55.378 1.00 0.00 C ATOM 1455 C LEU A 93 25.785 22.761 56.223 1.00 0.00 C ATOM 1456 O LEU A 93 26.503 22.891 57.228 1.00 0.00 O ATOM 1457 CB LEU A 93 26.680 21.687 54.126 1.00 0.00 C ATOM 1458 CG LEU A 93 27.494 20.425 53.839 1.00 0.00 C ATOM 1459 CD1 LEU A 93 26.703 19.512 52.900 1.00 0.00 C ATOM 1460 CD2 LEU A 93 28.815 20.815 53.172 1.00 0.00 C ATOM 0 H LEU A 93 24.410 21.032 53.843 1.00 0.00 H new ATOM 0 HA LEU A 93 26.225 20.695 56.027 1.00 0.00 H new ATOM 0 HB2 LEU A 93 26.041 21.921 53.274 1.00 0.00 H new ATOM 0 HB3 LEU A 93 27.347 22.537 54.268 1.00 0.00 H new ATOM 0 HG LEU A 93 27.696 19.901 54.773 1.00 0.00 H new ATOM 0 HD11 LEU A 93 27.282 18.612 52.694 1.00 0.00 H new ATOM 0 HD12 LEU A 93 25.759 19.237 53.370 1.00 0.00 H new ATOM 0 HD13 LEU A 93 26.504 20.036 51.965 1.00 0.00 H new ATOM 0 HD21 LEU A 93 29.398 19.917 52.966 1.00 0.00 H new ATOM 0 HD22 LEU A 93 28.610 21.337 52.237 1.00 0.00 H new ATOM 0 HD23 LEU A 93 29.379 21.469 53.837 1.00 0.00 H new ATOM 1472 N LEU A 94 24.958 23.710 55.825 1.00 0.00 N ATOM 1473 CA LEU A 94 24.852 25.027 56.546 1.00 0.00 C ATOM 1474 C LEU A 94 24.214 24.822 57.934 1.00 0.00 C ATOM 1475 O LEU A 94 24.215 25.714 58.778 1.00 0.00 O ATOM 1476 CB LEU A 94 23.871 25.852 55.656 1.00 0.00 C ATOM 1477 CG LEU A 94 24.606 26.850 54.742 1.00 0.00 C ATOM 1478 CD1 LEU A 94 24.677 26.294 53.314 1.00 0.00 C ATOM 1479 CD2 LEU A 94 23.817 28.166 54.694 1.00 0.00 C ATOM 0 H LEU A 94 24.342 23.624 55.016 1.00 0.00 H new ATOM 0 HA LEU A 94 25.821 25.505 56.694 1.00 0.00 H new ATOM 0 HB2 LEU A 94 23.279 25.171 55.044 1.00 0.00 H new ATOM 0 HB3 LEU A 94 23.174 26.394 56.295 1.00 0.00 H new ATOM 0 HG LEU A 94 25.610 27.013 55.134 1.00 0.00 H new ATOM 0 HD11 LEU A 94 25.198 27.005 52.672 1.00 0.00 H new ATOM 0 HD12 LEU A 94 25.216 25.347 53.319 1.00 0.00 H new ATOM 0 HD13 LEU A 94 23.668 26.135 52.935 1.00 0.00 H new ATOM 0 HD21 LEU A 94 24.333 28.876 54.048 1.00 0.00 H new ATOM 0 HD22 LEU A 94 22.818 27.977 54.301 1.00 0.00 H new ATOM 0 HD23 LEU A 94 23.739 28.580 55.699 1.00 0.00 H new ATOM 1491 N GLU A 95 23.687 23.652 58.177 1.00 0.00 N ATOM 1492 CA GLU A 95 23.067 23.363 59.499 1.00 0.00 C ATOM 1493 C GLU A 95 23.590 22.027 60.038 1.00 0.00 C ATOM 1494 O GLU A 95 23.343 21.664 61.186 1.00 0.00 O ATOM 1495 CB GLU A 95 21.562 23.283 59.230 1.00 0.00 C ATOM 1496 CG GLU A 95 20.823 22.853 60.506 1.00 0.00 C ATOM 1497 CD GLU A 95 21.198 23.777 61.671 1.00 0.00 C ATOM 1498 OE1 GLU A 95 21.586 24.904 61.411 1.00 0.00 O ATOM 1499 OE2 GLU A 95 21.089 23.340 62.805 1.00 0.00 O ATOM 0 H GLU A 95 23.660 22.880 57.511 1.00 0.00 H new ATOM 0 HA GLU A 95 23.302 24.125 60.242 1.00 0.00 H new ATOM 0 HB2 GLU A 95 21.192 24.252 58.895 1.00 0.00 H new ATOM 0 HB3 GLU A 95 21.365 22.571 58.428 1.00 0.00 H new ATOM 0 HG2 GLU A 95 19.746 22.884 60.340 1.00 0.00 H new ATOM 0 HG3 GLU A 95 21.078 21.822 60.753 1.00 0.00 H new ATOM 1506 N GLN A 96 24.308 21.289 59.231 1.00 0.00 N ATOM 1507 CA GLN A 96 24.845 19.986 59.696 1.00 0.00 C ATOM 1508 C GLN A 96 26.081 20.220 60.556 1.00 0.00 C ATOM 1509 O GLN A 96 26.197 19.676 61.653 1.00 0.00 O ATOM 1510 CB GLN A 96 25.209 19.219 58.425 1.00 0.00 C ATOM 1511 CG GLN A 96 25.524 17.765 58.783 1.00 0.00 C ATOM 1512 CD GLN A 96 25.655 16.939 57.502 1.00 0.00 C ATOM 1513 OE1 GLN A 96 26.683 16.987 56.830 1.00 0.00 O ATOM 1514 NE2 GLN A 96 24.665 16.178 57.126 1.00 0.00 N ATOM 0 H GLN A 96 24.543 21.537 58.270 1.00 0.00 H new ATOM 0 HA GLN A 96 24.127 19.433 60.302 1.00 0.00 H new ATOM 0 HB2 GLN A 96 24.384 19.260 57.713 1.00 0.00 H new ATOM 0 HB3 GLN A 96 26.070 19.681 57.942 1.00 0.00 H new ATOM 0 HG2 GLN A 96 26.449 17.713 59.357 1.00 0.00 H new ATOM 0 HG3 GLN A 96 24.734 17.355 59.413 1.00 0.00 H new ATOM 0 HE21 GLN A 96 23.812 16.138 57.684 1.00 0.00 H new ATOM 0 HE22 GLN A 96 24.744 15.623 56.274 1.00 0.00 H new ATOM 1523 N GLU A 97 27.008 21.025 60.096 1.00 0.00 N ATOM 1524 CA GLU A 97 28.219 21.273 60.935 1.00 0.00 C ATOM 1525 C GLU A 97 27.951 22.435 61.899 1.00 0.00 C ATOM 1526 O GLU A 97 26.804 22.741 62.220 1.00 0.00 O ATOM 1527 CB GLU A 97 29.333 21.618 59.943 1.00 0.00 C ATOM 1528 CG GLU A 97 29.074 22.991 59.320 1.00 0.00 C ATOM 1529 CD GLU A 97 29.771 23.077 57.963 1.00 0.00 C ATOM 1530 OE1 GLU A 97 29.390 22.334 57.074 1.00 0.00 O ATOM 1531 OE2 GLU A 97 30.678 23.885 57.835 1.00 0.00 O ATOM 0 H GLU A 97 26.981 21.510 59.199 1.00 0.00 H new ATOM 0 HA GLU A 97 28.490 20.413 61.547 1.00 0.00 H new ATOM 0 HB2 GLU A 97 30.297 21.617 60.452 1.00 0.00 H new ATOM 0 HB3 GLU A 97 29.383 20.859 59.162 1.00 0.00 H new ATOM 0 HG2 GLU A 97 28.002 23.151 59.201 1.00 0.00 H new ATOM 0 HG3 GLU A 97 29.442 23.776 59.980 1.00 0.00 H new ATOM 1538 N THR A 98 28.979 23.106 62.343 1.00 0.00 N ATOM 1539 CA THR A 98 28.768 24.265 63.258 1.00 0.00 C ATOM 1540 C THR A 98 28.828 25.560 62.430 1.00 0.00 C ATOM 1541 O THR A 98 27.813 26.234 62.271 1.00 0.00 O ATOM 1542 CB THR A 98 29.886 24.181 64.310 1.00 0.00 C ATOM 1543 OG1 THR A 98 29.535 23.206 65.282 1.00 0.00 O ATOM 1544 CG2 THR A 98 30.066 25.538 64.998 1.00 0.00 C ATOM 0 H THR A 98 29.952 22.903 62.113 1.00 0.00 H new ATOM 0 HA THR A 98 27.799 24.254 63.757 1.00 0.00 H new ATOM 0 HB THR A 98 30.820 23.904 63.821 1.00 0.00 H new ATOM 0 HG1 THR A 98 30.244 23.145 65.956 1.00 0.00 H new ATOM 0 HG21 THR A 98 30.860 25.467 65.741 1.00 0.00 H new ATOM 0 HG22 THR A 98 30.331 26.290 64.255 1.00 0.00 H new ATOM 0 HG23 THR A 98 29.135 25.824 65.488 1.00 0.00 H new ATOM 1552 N PRO A 99 29.968 25.829 61.834 1.00 0.00 N ATOM 1553 CA PRO A 99 30.088 26.999 60.930 1.00 0.00 C ATOM 1554 C PRO A 99 29.188 26.755 59.712 1.00 0.00 C ATOM 1555 O PRO A 99 29.076 25.632 59.236 1.00 0.00 O ATOM 1556 CB PRO A 99 31.568 27.023 60.552 1.00 0.00 C ATOM 1557 CG PRO A 99 32.026 25.619 60.752 1.00 0.00 C ATOM 1558 CD PRO A 99 31.236 25.088 61.918 1.00 0.00 C ATOM 0 HA PRO A 99 29.781 27.948 61.370 1.00 0.00 H new ATOM 0 HB2 PRO A 99 31.709 27.343 59.520 1.00 0.00 H new ATOM 0 HB3 PRO A 99 32.127 27.716 61.180 1.00 0.00 H new ATOM 0 HG2 PRO A 99 31.852 25.021 59.858 1.00 0.00 H new ATOM 0 HG3 PRO A 99 33.096 25.583 60.957 1.00 0.00 H new ATOM 0 HD2 PRO A 99 31.079 24.012 61.841 1.00 0.00 H new ATOM 0 HD3 PRO A 99 31.745 25.269 62.865 1.00 0.00 H new ATOM 1566 N VAL A 100 28.521 27.752 59.208 1.00 0.00 N ATOM 1567 CA VAL A 100 27.615 27.502 58.041 1.00 0.00 C ATOM 1568 C VAL A 100 28.461 27.378 56.772 1.00 0.00 C ATOM 1569 O VAL A 100 29.545 27.953 56.685 1.00 0.00 O ATOM 1570 CB VAL A 100 26.715 28.740 57.971 1.00 0.00 C ATOM 1571 CG1 VAL A 100 25.531 28.462 57.052 1.00 0.00 C ATOM 1572 CG2 VAL A 100 26.191 29.090 59.368 1.00 0.00 C ATOM 0 H VAL A 100 28.557 28.715 59.542 1.00 0.00 H new ATOM 0 HA VAL A 100 27.031 26.587 58.139 1.00 0.00 H new ATOM 0 HB VAL A 100 27.297 29.575 57.582 1.00 0.00 H new ATOM 0 HG11 VAL A 100 24.893 29.344 57.004 1.00 0.00 H new ATOM 0 HG12 VAL A 100 25.894 28.222 56.053 1.00 0.00 H new ATOM 0 HG13 VAL A 100 24.958 27.620 57.441 1.00 0.00 H new ATOM 0 HG21 VAL A 100 25.553 29.971 59.307 1.00 0.00 H new ATOM 0 HG22 VAL A 100 25.616 28.252 59.761 1.00 0.00 H new ATOM 0 HG23 VAL A 100 27.031 29.296 60.031 1.00 0.00 H new ATOM 1582 N THR A 101 28.027 26.605 55.797 1.00 0.00 N ATOM 1583 CA THR A 101 28.884 26.443 54.585 1.00 0.00 C ATOM 1584 C THR A 101 28.301 27.131 53.347 1.00 0.00 C ATOM 1585 O THR A 101 27.481 26.603 52.599 1.00 0.00 O ATOM 1586 CB THR A 101 28.971 24.939 54.343 1.00 0.00 C ATOM 1587 OG1 THR A 101 28.129 24.253 55.261 1.00 0.00 O ATOM 1588 CG2 THR A 101 30.415 24.470 54.528 1.00 0.00 C ATOM 0 H THR A 101 27.143 26.096 55.791 1.00 0.00 H new ATOM 0 HA THR A 101 29.856 26.907 54.753 1.00 0.00 H new ATOM 0 HB THR A 101 28.646 24.723 53.325 1.00 0.00 H new ATOM 0 HG1 THR A 101 28.643 23.554 55.717 1.00 0.00 H new ATOM 0 HG21 THR A 101 30.474 23.395 54.354 1.00 0.00 H new ATOM 0 HG22 THR A 101 31.060 24.988 53.818 1.00 0.00 H new ATOM 0 HG23 THR A 101 30.742 24.692 55.544 1.00 0.00 H new ATOM 1596 N LEU A 102 28.815 28.283 53.131 1.00 0.00 N ATOM 1597 CA LEU A 102 28.509 29.134 51.985 1.00 0.00 C ATOM 1598 C LEU A 102 29.872 29.570 51.480 1.00 0.00 C ATOM 1599 O LEU A 102 30.099 29.761 50.290 1.00 0.00 O ATOM 1600 CB LEU A 102 27.700 30.308 52.551 1.00 0.00 C ATOM 1601 CG LEU A 102 26.903 30.999 51.436 1.00 0.00 C ATOM 1602 CD1 LEU A 102 27.825 31.296 50.252 1.00 0.00 C ATOM 1603 CD2 LEU A 102 25.744 30.098 50.982 1.00 0.00 C ATOM 0 H LEU A 102 29.496 28.702 53.764 1.00 0.00 H new ATOM 0 HA LEU A 102 27.939 28.673 51.179 1.00 0.00 H new ATOM 0 HB2 LEU A 102 27.020 29.950 53.324 1.00 0.00 H new ATOM 0 HB3 LEU A 102 28.371 31.025 53.024 1.00 0.00 H new ATOM 0 HG LEU A 102 26.494 31.935 51.817 1.00 0.00 H new ATOM 0 HD11 LEU A 102 27.256 31.787 49.462 1.00 0.00 H new ATOM 0 HD12 LEU A 102 28.634 31.950 50.576 1.00 0.00 H new ATOM 0 HD13 LEU A 102 28.242 30.363 49.873 1.00 0.00 H new ATOM 0 HD21 LEU A 102 25.184 30.596 50.191 1.00 0.00 H new ATOM 0 HD22 LEU A 102 26.142 29.155 50.607 1.00 0.00 H new ATOM 0 HD23 LEU A 102 25.083 29.902 51.826 1.00 0.00 H new ATOM 1615 N GLU A 103 30.794 29.740 52.424 1.00 0.00 N ATOM 1616 CA GLU A 103 32.181 30.180 52.124 1.00 0.00 C ATOM 1617 C GLU A 103 32.717 29.632 50.795 1.00 0.00 C ATOM 1618 O GLU A 103 33.317 30.378 50.025 1.00 0.00 O ATOM 1619 CB GLU A 103 33.016 29.642 53.287 1.00 0.00 C ATOM 1620 CG GLU A 103 34.272 30.499 53.458 1.00 0.00 C ATOM 1621 CD GLU A 103 35.462 29.805 52.792 1.00 0.00 C ATOM 1622 OE1 GLU A 103 35.920 28.811 53.332 1.00 0.00 O ATOM 1623 OE2 GLU A 103 35.894 30.277 51.754 1.00 0.00 O ATOM 0 H GLU A 103 30.617 29.582 53.416 1.00 0.00 H new ATOM 0 HA GLU A 103 32.222 31.264 52.020 1.00 0.00 H new ATOM 0 HB2 GLU A 103 32.429 29.653 54.205 1.00 0.00 H new ATOM 0 HB3 GLU A 103 33.294 28.605 53.099 1.00 0.00 H new ATOM 0 HG2 GLU A 103 34.117 31.482 53.014 1.00 0.00 H new ATOM 0 HG3 GLU A 103 34.476 30.656 54.517 1.00 0.00 H new ATOM 1630 N ALA A 104 32.557 28.364 50.495 1.00 0.00 N ATOM 1631 CA ALA A 104 33.123 27.865 49.203 1.00 0.00 C ATOM 1632 C ALA A 104 32.309 28.427 48.031 1.00 0.00 C ATOM 1633 O ALA A 104 32.862 28.838 47.010 1.00 0.00 O ATOM 1634 CB ALA A 104 32.994 26.342 49.270 1.00 0.00 C ATOM 0 H ALA A 104 32.075 27.673 51.069 1.00 0.00 H new ATOM 0 HA ALA A 104 34.158 28.173 49.054 1.00 0.00 H new ATOM 0 HB1 ALA A 104 33.390 25.903 48.354 1.00 0.00 H new ATOM 0 HB2 ALA A 104 33.556 25.966 50.125 1.00 0.00 H new ATOM 0 HB3 ALA A 104 31.944 26.070 49.379 1.00 0.00 H new ATOM 1640 N LEU A 105 31.005 28.463 48.160 1.00 0.00 N ATOM 1641 CA LEU A 105 30.166 29.006 47.052 1.00 0.00 C ATOM 1642 C LEU A 105 30.374 30.522 46.940 1.00 0.00 C ATOM 1643 O LEU A 105 30.473 31.073 45.844 1.00 0.00 O ATOM 1644 CB LEU A 105 28.715 28.675 47.423 1.00 0.00 C ATOM 1645 CG LEU A 105 28.203 27.529 46.537 1.00 0.00 C ATOM 1646 CD1 LEU A 105 28.162 26.231 47.347 1.00 0.00 C ATOM 1647 CD2 LEU A 105 26.790 27.853 46.027 1.00 0.00 C ATOM 0 H LEU A 105 30.490 28.142 48.980 1.00 0.00 H new ATOM 0 HA LEU A 105 30.429 28.573 46.087 1.00 0.00 H new ATOM 0 HB2 LEU A 105 28.654 28.391 48.473 1.00 0.00 H new ATOM 0 HB3 LEU A 105 28.086 29.556 47.294 1.00 0.00 H new ATOM 0 HG LEU A 105 28.876 27.410 45.688 1.00 0.00 H new ATOM 0 HD11 LEU A 105 27.798 25.420 46.716 1.00 0.00 H new ATOM 0 HD12 LEU A 105 29.164 25.993 47.703 1.00 0.00 H new ATOM 0 HD13 LEU A 105 27.494 26.355 48.199 1.00 0.00 H new ATOM 0 HD21 LEU A 105 26.433 27.036 45.400 1.00 0.00 H new ATOM 0 HD22 LEU A 105 26.117 27.979 46.875 1.00 0.00 H new ATOM 0 HD23 LEU A 105 26.816 28.774 45.444 1.00 0.00 H new ATOM 1659 N ALA A 106 30.461 31.202 48.052 1.00 0.00 N ATOM 1660 CA ALA A 106 30.682 32.678 48.016 1.00 0.00 C ATOM 1661 C ALA A 106 32.088 32.969 47.486 1.00 0.00 C ATOM 1662 O ALA A 106 32.304 33.921 46.734 1.00 0.00 O ATOM 1663 CB ALA A 106 30.547 33.139 49.467 1.00 0.00 C ATOM 0 H ALA A 106 30.388 30.798 48.986 1.00 0.00 H new ATOM 0 HA ALA A 106 29.975 33.193 47.366 1.00 0.00 H new ATOM 0 HB1 ALA A 106 30.697 34.217 49.522 1.00 0.00 H new ATOM 0 HB2 ALA A 106 29.552 32.892 49.836 1.00 0.00 H new ATOM 0 HB3 ALA A 106 31.296 32.637 50.079 1.00 0.00 H new ATOM 1669 N ASP A 107 33.044 32.150 47.853 1.00 0.00 N ATOM 1670 CA ASP A 107 34.429 32.347 47.368 1.00 0.00 C ATOM 1671 C ASP A 107 34.467 32.171 45.849 1.00 0.00 C ATOM 1672 O ASP A 107 35.176 32.882 45.139 1.00 0.00 O ATOM 1673 CB ASP A 107 35.218 31.248 48.071 1.00 0.00 C ATOM 1674 CG ASP A 107 35.750 31.770 49.406 1.00 0.00 C ATOM 1675 OD1 ASP A 107 34.989 32.407 50.117 1.00 0.00 O ATOM 1676 OD2 ASP A 107 36.909 31.524 49.696 1.00 0.00 O ATOM 0 H ASP A 107 32.914 31.350 48.473 1.00 0.00 H new ATOM 0 HA ASP A 107 34.831 33.338 47.577 1.00 0.00 H new ATOM 0 HB2 ASP A 107 34.581 30.379 48.237 1.00 0.00 H new ATOM 0 HB3 ASP A 107 36.046 30.921 47.441 1.00 0.00 H new ATOM 1681 N GLN A 108 33.707 31.238 45.339 1.00 0.00 N ATOM 1682 CA GLN A 108 33.682 31.016 43.864 1.00 0.00 C ATOM 1683 C GLN A 108 33.061 32.229 43.163 1.00 0.00 C ATOM 1684 O GLN A 108 33.615 32.764 42.206 1.00 0.00 O ATOM 1685 CB GLN A 108 32.807 29.777 43.666 1.00 0.00 C ATOM 1686 CG GLN A 108 32.906 29.306 42.213 1.00 0.00 C ATOM 1687 CD GLN A 108 32.099 28.018 42.039 1.00 0.00 C ATOM 1688 OE1 GLN A 108 32.599 27.034 41.499 1.00 0.00 O ATOM 1689 NE2 GLN A 108 30.869 27.970 42.473 1.00 0.00 N ATOM 0 H GLN A 108 33.102 30.620 45.881 1.00 0.00 H new ATOM 0 HA GLN A 108 34.680 30.881 43.447 1.00 0.00 H new ATOM 0 HB2 GLN A 108 33.127 28.982 44.339 1.00 0.00 H new ATOM 0 HB3 GLN A 108 31.771 30.007 43.915 1.00 0.00 H new ATOM 0 HG2 GLN A 108 32.528 30.078 41.543 1.00 0.00 H new ATOM 0 HG3 GLN A 108 33.949 29.134 41.945 1.00 0.00 H new ATOM 0 HE21 GLN A 108 30.454 28.787 42.921 1.00 0.00 H new ATOM 0 HE22 GLN A 108 30.323 27.116 42.364 1.00 0.00 H new ATOM 1698 N VAL A 109 31.920 32.672 43.624 1.00 0.00 N ATOM 1699 CA VAL A 109 31.260 33.853 42.987 1.00 0.00 C ATOM 1700 C VAL A 109 32.040 35.138 43.300 1.00 0.00 C ATOM 1701 O VAL A 109 31.867 36.158 42.636 1.00 0.00 O ATOM 1702 CB VAL A 109 29.861 33.915 43.602 1.00 0.00 C ATOM 1703 CG1 VAL A 109 29.068 35.048 42.948 1.00 0.00 C ATOM 1704 CG2 VAL A 109 29.135 32.586 43.367 1.00 0.00 C ATOM 0 H VAL A 109 31.416 32.268 44.414 1.00 0.00 H new ATOM 0 HA VAL A 109 31.224 33.761 41.902 1.00 0.00 H new ATOM 0 HB VAL A 109 29.945 34.097 44.673 1.00 0.00 H new ATOM 0 HG11 VAL A 109 28.071 35.094 43.385 1.00 0.00 H new ATOM 0 HG12 VAL A 109 29.581 35.995 43.115 1.00 0.00 H new ATOM 0 HG13 VAL A 109 28.986 34.864 41.877 1.00 0.00 H new ATOM 0 HG21 VAL A 109 28.139 32.633 43.806 1.00 0.00 H new ATOM 0 HG22 VAL A 109 29.051 32.402 42.296 1.00 0.00 H new ATOM 0 HG23 VAL A 109 29.698 31.777 43.831 1.00 0.00 H new ATOM 1714 N ALA A 110 32.891 35.104 44.300 1.00 0.00 N ATOM 1715 CA ALA A 110 33.703 36.311 44.682 1.00 0.00 C ATOM 1716 C ALA A 110 32.864 37.291 45.513 1.00 0.00 C ATOM 1717 O ALA A 110 33.177 38.477 45.597 1.00 0.00 O ATOM 1718 CB ALA A 110 34.162 36.963 43.370 1.00 0.00 C ATOM 0 H ALA A 110 33.061 34.280 44.877 1.00 0.00 H new ATOM 0 HA ALA A 110 34.557 36.028 45.297 1.00 0.00 H new ATOM 0 HB1 ALA A 110 34.758 37.848 43.593 1.00 0.00 H new ATOM 0 HB2 ALA A 110 34.764 36.253 42.802 1.00 0.00 H new ATOM 0 HB3 ALA A 110 33.290 37.251 42.782 1.00 0.00 H new ATOM 1724 N MET A 111 31.808 36.820 46.135 1.00 0.00 N ATOM 1725 CA MET A 111 30.968 37.745 46.961 1.00 0.00 C ATOM 1726 C MET A 111 30.484 37.074 48.269 1.00 0.00 C ATOM 1727 O MET A 111 30.884 35.964 48.608 1.00 0.00 O ATOM 1728 CB MET A 111 29.795 38.162 46.063 1.00 0.00 C ATOM 1729 CG MET A 111 29.267 36.966 45.258 1.00 0.00 C ATOM 1730 SD MET A 111 28.378 35.836 46.354 1.00 0.00 S ATOM 1731 CE MET A 111 27.303 37.079 47.106 1.00 0.00 C ATOM 0 H MET A 111 31.495 35.850 46.108 1.00 0.00 H new ATOM 0 HA MET A 111 31.542 38.613 47.285 1.00 0.00 H new ATOM 0 HB2 MET A 111 28.993 38.576 46.675 1.00 0.00 H new ATOM 0 HB3 MET A 111 30.116 38.950 45.382 1.00 0.00 H new ATOM 0 HG2 MET A 111 28.605 37.313 44.464 1.00 0.00 H new ATOM 0 HG3 MET A 111 30.095 36.445 44.777 1.00 0.00 H new ATOM 0 HE1 MET A 111 26.410 36.596 47.502 1.00 0.00 H new ATOM 0 HE2 MET A 111 27.835 37.578 47.916 1.00 0.00 H new ATOM 0 HE3 MET A 111 27.015 37.814 46.354 1.00 0.00 H new ATOM 1741 N SER A 112 29.657 37.769 49.017 1.00 0.00 N ATOM 1742 CA SER A 112 29.145 37.251 50.340 1.00 0.00 C ATOM 1743 C SER A 112 28.086 36.119 50.220 1.00 0.00 C ATOM 1744 O SER A 112 27.576 35.825 49.148 1.00 0.00 O ATOM 1745 CB SER A 112 28.519 38.483 51.002 1.00 0.00 C ATOM 1746 OG SER A 112 29.089 39.666 50.452 1.00 0.00 O ATOM 0 H SER A 112 29.305 38.693 48.765 1.00 0.00 H new ATOM 0 HA SER A 112 29.959 36.797 50.905 1.00 0.00 H new ATOM 0 HB2 SER A 112 27.440 38.482 50.847 1.00 0.00 H new ATOM 0 HB3 SER A 112 28.687 38.454 52.079 1.00 0.00 H new ATOM 0 HG SER A 112 28.685 40.452 50.876 1.00 0.00 H new ATOM 1752 N PRO A 113 27.793 35.526 51.360 1.00 0.00 N ATOM 1753 CA PRO A 113 26.794 34.430 51.472 1.00 0.00 C ATOM 1754 C PRO A 113 25.376 34.908 51.162 1.00 0.00 C ATOM 1755 O PRO A 113 24.534 34.118 50.731 1.00 0.00 O ATOM 1756 CB PRO A 113 26.915 33.960 52.919 1.00 0.00 C ATOM 1757 CG PRO A 113 27.476 35.128 53.650 1.00 0.00 C ATOM 1758 CD PRO A 113 28.376 35.838 52.678 1.00 0.00 C ATOM 0 HA PRO A 113 26.984 33.633 50.753 1.00 0.00 H new ATOM 0 HB2 PRO A 113 25.946 33.668 53.323 1.00 0.00 H new ATOM 0 HB3 PRO A 113 27.568 33.091 53.000 1.00 0.00 H new ATOM 0 HG2 PRO A 113 26.681 35.788 53.998 1.00 0.00 H new ATOM 0 HG3 PRO A 113 28.031 34.806 54.531 1.00 0.00 H new ATOM 0 HD2 PRO A 113 28.394 36.912 52.862 1.00 0.00 H new ATOM 0 HD3 PRO A 113 29.404 35.484 52.754 1.00 0.00 H new ATOM 1766 N PHE A 114 25.063 36.163 51.386 1.00 0.00 N ATOM 1767 CA PHE A 114 23.667 36.598 51.116 1.00 0.00 C ATOM 1768 C PHE A 114 23.372 36.569 49.624 1.00 0.00 C ATOM 1769 O PHE A 114 22.327 36.046 49.232 1.00 0.00 O ATOM 1770 CB PHE A 114 23.503 38.012 51.669 1.00 0.00 C ATOM 1771 CG PHE A 114 23.496 38.004 53.184 1.00 0.00 C ATOM 1772 CD1 PHE A 114 23.756 36.830 53.905 1.00 0.00 C ATOM 1773 CD2 PHE A 114 23.232 39.193 53.866 1.00 0.00 C ATOM 1774 CE1 PHE A 114 23.758 36.854 55.305 1.00 0.00 C ATOM 1775 CE2 PHE A 114 23.228 39.217 55.264 1.00 0.00 C ATOM 1776 CZ PHE A 114 23.497 38.049 55.985 1.00 0.00 C ATOM 0 H PHE A 114 25.697 36.882 51.734 1.00 0.00 H new ATOM 0 HA PHE A 114 22.963 35.920 51.599 1.00 0.00 H new ATOM 0 HB2 PHE A 114 24.315 38.644 51.309 1.00 0.00 H new ATOM 0 HB3 PHE A 114 22.574 38.445 51.300 1.00 0.00 H new ATOM 0 HD1 PHE A 114 23.955 35.907 53.381 1.00 0.00 H new ATOM 0 HD2 PHE A 114 23.030 40.098 53.312 1.00 0.00 H new ATOM 0 HE1 PHE A 114 23.961 35.950 55.860 1.00 0.00 H new ATOM 0 HE2 PHE A 114 23.017 40.138 55.787 1.00 0.00 H new ATOM 0 HZ PHE A 114 23.503 38.069 57.065 1.00 0.00 H new ATOM 1786 N HIS A 115 24.216 37.066 48.750 1.00 0.00 N ATOM 1787 CA HIS A 115 23.803 36.939 47.335 1.00 0.00 C ATOM 1788 C HIS A 115 23.881 35.467 46.863 1.00 0.00 C ATOM 1789 O HIS A 115 23.187 35.076 45.927 1.00 0.00 O ATOM 1790 CB HIS A 115 24.566 37.876 46.422 1.00 0.00 C ATOM 1791 CG HIS A 115 23.583 38.175 45.331 1.00 0.00 C ATOM 1792 ND1 HIS A 115 23.505 37.396 44.190 1.00 0.00 N ATOM 1793 CD2 HIS A 115 22.511 39.027 45.284 1.00 0.00 C ATOM 1794 CE1 HIS A 115 22.406 37.779 43.517 1.00 0.00 C ATOM 1795 NE2 HIS A 115 21.757 38.775 44.138 1.00 0.00 N ATOM 0 H HIS A 115 25.108 37.521 48.942 1.00 0.00 H new ATOM 0 HA HIS A 115 22.759 37.248 47.274 1.00 0.00 H new ATOM 0 HB2 HIS A 115 24.875 38.782 46.944 1.00 0.00 H new ATOM 0 HB3 HIS A 115 25.470 37.409 46.031 1.00 0.00 H new ATOM 0 HD2 HIS A 115 22.284 39.781 46.023 1.00 0.00 H new ATOM 0 HE1 HIS A 115 22.084 37.337 42.586 1.00 0.00 H new ATOM 0 HE2 HIS A 115 20.902 39.244 43.839 1.00 0.00 H new ATOM 1803 N LEU A 116 24.646 34.628 47.526 1.00 0.00 N ATOM 1804 CA LEU A 116 24.669 33.183 47.138 1.00 0.00 C ATOM 1805 C LEU A 116 23.288 32.606 47.457 1.00 0.00 C ATOM 1806 O LEU A 116 22.731 31.817 46.698 1.00 0.00 O ATOM 1807 CB LEU A 116 25.752 32.552 48.013 1.00 0.00 C ATOM 1808 CG LEU A 116 26.064 31.127 47.540 1.00 0.00 C ATOM 1809 CD1 LEU A 116 24.877 30.208 47.836 1.00 0.00 C ATOM 1810 CD2 LEU A 116 26.351 31.126 46.033 1.00 0.00 C ATOM 0 H LEU A 116 25.248 34.880 48.310 1.00 0.00 H new ATOM 0 HA LEU A 116 24.881 33.005 46.084 1.00 0.00 H new ATOM 0 HB2 LEU A 116 26.656 33.159 47.977 1.00 0.00 H new ATOM 0 HB3 LEU A 116 25.423 32.532 49.052 1.00 0.00 H new ATOM 0 HG LEU A 116 26.943 30.763 48.073 1.00 0.00 H new ATOM 0 HD11 LEU A 116 25.106 29.198 47.497 1.00 0.00 H new ATOM 0 HD12 LEU A 116 24.685 30.196 48.909 1.00 0.00 H new ATOM 0 HD13 LEU A 116 23.994 30.575 47.313 1.00 0.00 H new ATOM 0 HD21 LEU A 116 26.572 30.110 45.705 1.00 0.00 H new ATOM 0 HD22 LEU A 116 25.479 31.499 45.496 1.00 0.00 H new ATOM 0 HD23 LEU A 116 27.207 31.768 45.825 1.00 0.00 H new ATOM 1822 N HIS A 117 22.704 33.040 48.547 1.00 0.00 N ATOM 1823 CA HIS A 117 21.331 32.581 48.897 1.00 0.00 C ATOM 1824 C HIS A 117 20.363 33.159 47.843 1.00 0.00 C ATOM 1825 O HIS A 117 19.429 32.492 47.392 1.00 0.00 O ATOM 1826 CB HIS A 117 21.067 33.133 50.298 1.00 0.00 C ATOM 1827 CG HIS A 117 22.075 32.531 51.241 1.00 0.00 C ATOM 1828 ND1 HIS A 117 22.731 33.277 52.205 1.00 0.00 N ATOM 1829 CD2 HIS A 117 22.567 31.253 51.361 1.00 0.00 C ATOM 1830 CE1 HIS A 117 23.573 32.453 52.854 1.00 0.00 C ATOM 1831 NE2 HIS A 117 23.511 31.208 52.380 1.00 0.00 N ATOM 0 H HIS A 117 23.123 33.694 49.209 1.00 0.00 H new ATOM 0 HA HIS A 117 21.204 31.498 48.899 1.00 0.00 H new ATOM 0 HB2 HIS A 117 21.148 34.220 50.299 1.00 0.00 H new ATOM 0 HB3 HIS A 117 20.054 32.888 50.618 1.00 0.00 H new ATOM 0 HD1 HIS A 117 22.600 34.271 52.390 1.00 0.00 H new ATOM 0 HD2 HIS A 117 22.266 30.411 50.755 1.00 0.00 H new ATOM 0 HE1 HIS A 117 24.221 32.762 53.661 1.00 0.00 H new ATOM 1839 N ARG A 118 20.626 34.367 47.386 1.00 0.00 N ATOM 1840 CA ARG A 118 19.786 34.988 46.302 1.00 0.00 C ATOM 1841 C ARG A 118 19.923 34.143 45.013 1.00 0.00 C ATOM 1842 O ARG A 118 18.969 33.981 44.255 1.00 0.00 O ATOM 1843 CB ARG A 118 20.361 36.391 46.094 1.00 0.00 C ATOM 1844 CG ARG A 118 19.225 37.421 46.125 1.00 0.00 C ATOM 1845 CD ARG A 118 19.333 38.275 47.393 1.00 0.00 C ATOM 1846 NE ARG A 118 18.059 38.038 48.134 1.00 0.00 N ATOM 1847 CZ ARG A 118 17.970 37.102 49.050 1.00 0.00 C ATOM 1848 NH1 ARG A 118 18.996 36.344 49.345 1.00 0.00 N ATOM 1849 NH2 ARG A 118 16.840 36.924 49.677 1.00 0.00 N ATOM 0 H ARG A 118 21.391 34.953 47.720 1.00 0.00 H new ATOM 0 HA ARG A 118 18.728 35.031 46.560 1.00 0.00 H new ATOM 0 HB2 ARG A 118 21.090 36.615 46.872 1.00 0.00 H new ATOM 0 HB3 ARG A 118 20.886 36.442 45.140 1.00 0.00 H new ATOM 0 HG2 ARG A 118 19.275 38.057 45.242 1.00 0.00 H new ATOM 0 HG3 ARG A 118 18.261 36.913 46.098 1.00 0.00 H new ATOM 0 HD2 ARG A 118 20.196 37.984 47.991 1.00 0.00 H new ATOM 0 HD3 ARG A 118 19.456 39.330 47.148 1.00 0.00 H new ATOM 0 HE ARG A 118 17.243 38.614 47.925 1.00 0.00 H new ATOM 0 HH11 ARG A 118 19.884 36.476 48.860 1.00 0.00 H new ATOM 0 HH12 ARG A 118 18.908 35.622 50.060 1.00 0.00 H new ATOM 0 HH21 ARG A 118 16.035 37.510 49.454 1.00 0.00 H new ATOM 0 HH22 ARG A 118 16.761 36.199 50.390 1.00 0.00 H new ATOM 1863 N LEU A 119 21.082 33.548 44.789 1.00 0.00 N ATOM 1864 CA LEU A 119 21.285 32.645 43.595 1.00 0.00 C ATOM 1865 C LEU A 119 20.464 31.345 43.816 1.00 0.00 C ATOM 1866 O LEU A 119 19.736 30.886 42.937 1.00 0.00 O ATOM 1867 CB LEU A 119 22.799 32.366 43.582 1.00 0.00 C ATOM 1868 CG LEU A 119 23.163 31.276 42.561 1.00 0.00 C ATOM 1869 CD1 LEU A 119 23.003 29.897 43.204 1.00 0.00 C ATOM 1870 CD2 LEU A 119 22.262 31.376 41.325 1.00 0.00 C ATOM 0 H LEU A 119 21.902 33.650 45.387 1.00 0.00 H new ATOM 0 HA LEU A 119 20.957 33.075 42.649 1.00 0.00 H new ATOM 0 HB2 LEU A 119 23.337 33.284 43.343 1.00 0.00 H new ATOM 0 HB3 LEU A 119 23.121 32.057 44.576 1.00 0.00 H new ATOM 0 HG LEU A 119 24.198 31.418 42.251 1.00 0.00 H new ATOM 0 HD11 LEU A 119 23.261 29.125 42.479 1.00 0.00 H new ATOM 0 HD12 LEU A 119 23.664 29.819 44.068 1.00 0.00 H new ATOM 0 HD13 LEU A 119 21.970 29.763 43.524 1.00 0.00 H new ATOM 0 HD21 LEU A 119 22.534 30.597 40.613 1.00 0.00 H new ATOM 0 HD22 LEU A 119 21.221 31.249 41.622 1.00 0.00 H new ATOM 0 HD23 LEU A 119 22.390 32.353 40.860 1.00 0.00 H new ATOM 1882 N PHE A 120 20.536 30.788 45.015 1.00 0.00 N ATOM 1883 CA PHE A 120 19.734 29.552 45.393 1.00 0.00 C ATOM 1884 C PHE A 120 18.249 29.806 44.987 1.00 0.00 C ATOM 1885 O PHE A 120 17.585 28.942 44.424 1.00 0.00 O ATOM 1886 CB PHE A 120 19.931 29.504 46.949 1.00 0.00 C ATOM 1887 CG PHE A 120 19.929 28.089 47.566 1.00 0.00 C ATOM 1888 CD1 PHE A 120 19.208 27.048 46.971 1.00 0.00 C ATOM 1889 CD2 PHE A 120 20.602 27.839 48.804 1.00 0.00 C ATOM 1890 CE1 PHE A 120 19.154 25.785 47.570 1.00 0.00 C ATOM 1891 CE2 PHE A 120 20.525 26.573 49.406 1.00 0.00 C ATOM 1892 CZ PHE A 120 19.801 25.550 48.786 1.00 0.00 C ATOM 0 H PHE A 120 21.128 31.143 45.766 1.00 0.00 H new ATOM 0 HA PHE A 120 20.030 28.618 44.915 1.00 0.00 H new ATOM 0 HB2 PHE A 120 20.875 29.990 47.195 1.00 0.00 H new ATOM 0 HB3 PHE A 120 19.140 30.089 47.418 1.00 0.00 H new ATOM 0 HD1 PHE A 120 18.688 27.221 46.040 1.00 0.00 H new ATOM 0 HD2 PHE A 120 21.171 28.626 49.276 1.00 0.00 H new ATOM 0 HE1 PHE A 120 18.609 24.986 47.089 1.00 0.00 H new ATOM 0 HE2 PHE A 120 21.024 26.390 50.346 1.00 0.00 H new ATOM 0 HZ PHE A 120 19.742 24.576 49.248 1.00 0.00 H new ATOM 1902 N LYS A 121 17.765 31.009 45.208 1.00 0.00 N ATOM 1903 CA LYS A 121 16.363 31.428 44.797 1.00 0.00 C ATOM 1904 C LYS A 121 16.246 31.536 43.275 1.00 0.00 C ATOM 1905 O LYS A 121 15.284 31.074 42.667 1.00 0.00 O ATOM 1906 CB LYS A 121 16.245 32.827 45.410 1.00 0.00 C ATOM 1907 CG LYS A 121 15.343 33.758 44.584 1.00 0.00 C ATOM 1908 CD LYS A 121 13.909 33.245 44.540 1.00 0.00 C ATOM 1909 CE LYS A 121 13.036 34.292 43.840 1.00 0.00 C ATOM 1910 NZ LYS A 121 13.137 33.974 42.388 1.00 0.00 N ATOM 0 H LYS A 121 18.295 31.748 45.671 1.00 0.00 H new ATOM 0 HA LYS A 121 15.597 30.723 45.120 1.00 0.00 H new ATOM 0 HB2 LYS A 121 15.847 32.744 46.421 1.00 0.00 H new ATOM 0 HB3 LYS A 121 17.238 33.269 45.493 1.00 0.00 H new ATOM 0 HG2 LYS A 121 15.360 34.760 45.014 1.00 0.00 H new ATOM 0 HG3 LYS A 121 15.733 33.840 43.570 1.00 0.00 H new ATOM 0 HD2 LYS A 121 13.863 32.296 44.006 1.00 0.00 H new ATOM 0 HD3 LYS A 121 13.542 33.061 45.550 1.00 0.00 H new ATOM 0 HE2 LYS A 121 12.003 34.238 44.184 1.00 0.00 H new ATOM 0 HE3 LYS A 121 13.389 35.302 44.048 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 12.948 34.832 41.831 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 14.094 33.627 42.174 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 12.440 33.242 42.144 1.00 0.00 H new ATOM 1924 N ALA A 122 17.214 32.157 42.660 1.00 0.00 N ATOM 1925 CA ALA A 122 17.184 32.325 41.180 1.00 0.00 C ATOM 1926 C ALA A 122 17.113 30.958 40.504 1.00 0.00 C ATOM 1927 O ALA A 122 16.251 30.702 39.664 1.00 0.00 O ATOM 1928 CB ALA A 122 18.497 33.027 40.833 1.00 0.00 C ATOM 0 H ALA A 122 18.030 32.558 43.122 1.00 0.00 H new ATOM 0 HA ALA A 122 16.318 32.896 40.844 1.00 0.00 H new ATOM 0 HB1 ALA A 122 18.550 33.187 39.756 1.00 0.00 H new ATOM 0 HB2 ALA A 122 18.542 33.988 41.345 1.00 0.00 H new ATOM 0 HB3 ALA A 122 19.336 32.407 41.150 1.00 0.00 H new ATOM 1934 N THR A 123 18.015 30.080 40.844 1.00 0.00 N ATOM 1935 CA THR A 123 18.013 28.727 40.210 1.00 0.00 C ATOM 1936 C THR A 123 16.783 27.917 40.707 1.00 0.00 C ATOM 1937 O THR A 123 15.921 27.537 39.918 1.00 0.00 O ATOM 1938 CB THR A 123 19.341 28.086 40.632 1.00 0.00 C ATOM 1939 OG1 THR A 123 20.334 29.097 40.725 1.00 0.00 O ATOM 1940 CG2 THR A 123 19.787 27.096 39.555 1.00 0.00 C ATOM 0 H THR A 123 18.752 30.238 41.531 1.00 0.00 H new ATOM 0 HA THR A 123 17.932 28.763 39.124 1.00 0.00 H new ATOM 0 HB THR A 123 19.210 27.581 41.589 1.00 0.00 H new ATOM 0 HG1 THR A 123 21.186 28.695 40.996 1.00 0.00 H new ATOM 0 HG21 THR A 123 20.731 26.638 39.850 1.00 0.00 H new ATOM 0 HG22 THR A 123 19.029 26.322 39.436 1.00 0.00 H new ATOM 0 HG23 THR A 123 19.919 27.622 38.610 1.00 0.00 H new ATOM 1948 N THR A 124 16.657 27.696 42.004 1.00 0.00 N ATOM 1949 CA THR A 124 15.451 26.971 42.566 1.00 0.00 C ATOM 1950 C THR A 124 14.193 27.644 42.029 1.00 0.00 C ATOM 1951 O THR A 124 13.178 27.000 41.773 1.00 0.00 O ATOM 1952 CB THR A 124 15.555 27.096 44.097 1.00 0.00 C ATOM 1953 OG1 THR A 124 14.847 26.022 44.699 1.00 0.00 O ATOM 1954 CG2 THR A 124 14.957 28.424 44.579 1.00 0.00 C ATOM 0 H THR A 124 17.340 27.987 42.703 1.00 0.00 H new ATOM 0 HA THR A 124 15.411 25.920 42.281 1.00 0.00 H new ATOM 0 HB THR A 124 16.607 27.065 44.379 1.00 0.00 H new ATOM 0 HG1 THR A 124 14.858 26.128 45.673 1.00 0.00 H new ATOM 0 HG21 THR A 124 15.042 28.489 45.664 1.00 0.00 H new ATOM 0 HG22 THR A 124 15.497 29.253 44.122 1.00 0.00 H new ATOM 0 HG23 THR A 124 13.906 28.475 44.294 1.00 0.00 H new ATOM 1962 N GLY A 125 14.255 28.936 41.824 1.00 0.00 N ATOM 1963 CA GLY A 125 13.085 29.678 41.269 1.00 0.00 C ATOM 1964 C GLY A 125 12.405 30.623 42.279 1.00 0.00 C ATOM 1965 O GLY A 125 12.035 31.726 41.884 1.00 0.00 O ATOM 0 H GLY A 125 15.074 29.512 42.020 1.00 0.00 H new ATOM 0 HA2 GLY A 125 13.412 30.259 40.407 1.00 0.00 H new ATOM 0 HA3 GLY A 125 12.350 28.959 40.908 1.00 0.00 H new ATOM 1969 N MET A 126 12.219 30.294 43.542 1.00 0.00 N ATOM 1970 CA MET A 126 11.545 31.326 44.416 1.00 0.00 C ATOM 1971 C MET A 126 11.815 31.184 45.927 1.00 0.00 C ATOM 1972 O MET A 126 10.885 31.272 46.726 1.00 0.00 O ATOM 1973 CB MET A 126 10.049 31.126 44.154 1.00 0.00 C ATOM 1974 CG MET A 126 9.629 31.920 42.915 1.00 0.00 C ATOM 1975 SD MET A 126 7.984 32.630 43.165 1.00 0.00 S ATOM 1976 CE MET A 126 8.043 33.791 41.779 1.00 0.00 C ATOM 0 H MET A 126 12.484 29.415 43.987 1.00 0.00 H new ATOM 0 HA MET A 126 11.932 32.313 44.164 1.00 0.00 H new ATOM 0 HB2 MET A 126 9.834 30.067 44.009 1.00 0.00 H new ATOM 0 HB3 MET A 126 9.472 31.452 45.019 1.00 0.00 H new ATOM 0 HG2 MET A 126 10.351 32.713 42.719 1.00 0.00 H new ATOM 0 HG3 MET A 126 9.625 31.270 42.040 1.00 0.00 H new ATOM 0 HE1 MET A 126 7.110 34.353 41.735 1.00 0.00 H new ATOM 0 HE2 MET A 126 8.876 34.480 41.917 1.00 0.00 H new ATOM 0 HE3 MET A 126 8.178 33.240 40.848 1.00 0.00 H new ATOM 1986 N THR A 127 13.048 31.038 46.359 1.00 0.00 N ATOM 1987 CA THR A 127 13.317 30.966 47.828 1.00 0.00 C ATOM 1988 C THR A 127 14.826 31.021 48.125 1.00 0.00 C ATOM 1989 O THR A 127 15.444 29.977 48.303 1.00 0.00 O ATOM 1990 CB THR A 127 12.759 29.623 48.287 1.00 0.00 C ATOM 1991 OG1 THR A 127 11.589 29.281 47.558 1.00 0.00 O ATOM 1992 CG2 THR A 127 12.421 29.744 49.755 1.00 0.00 C ATOM 0 H THR A 127 13.871 30.966 45.761 1.00 0.00 H new ATOM 0 HA THR A 127 12.857 31.809 48.345 1.00 0.00 H new ATOM 0 HB THR A 127 13.499 28.841 48.116 1.00 0.00 H new ATOM 0 HG1 THR A 127 10.921 29.991 47.659 1.00 0.00 H new ATOM 0 HG21 THR A 127 12.018 28.797 50.115 1.00 0.00 H new ATOM 0 HG22 THR A 127 13.322 29.992 50.317 1.00 0.00 H new ATOM 0 HG23 THR A 127 11.679 30.530 49.894 1.00 0.00 H new ATOM 2000 N PRO A 128 15.404 32.196 48.191 1.00 0.00 N ATOM 2001 CA PRO A 128 16.866 32.257 48.460 1.00 0.00 C ATOM 2002 C PRO A 128 17.239 31.887 49.897 1.00 0.00 C ATOM 2003 O PRO A 128 17.193 30.721 50.283 1.00 0.00 O ATOM 2004 CB PRO A 128 17.200 33.723 48.156 1.00 0.00 C ATOM 2005 CG PRO A 128 15.919 34.474 48.360 1.00 0.00 C ATOM 2006 CD PRO A 128 14.787 33.524 48.060 1.00 0.00 C ATOM 0 HA PRO A 128 17.424 31.537 47.861 1.00 0.00 H new ATOM 0 HB2 PRO A 128 17.982 34.093 48.819 1.00 0.00 H new ATOM 0 HB3 PRO A 128 17.565 33.839 47.136 1.00 0.00 H new ATOM 0 HG2 PRO A 128 15.849 34.843 49.383 1.00 0.00 H new ATOM 0 HG3 PRO A 128 15.875 35.343 47.704 1.00 0.00 H new ATOM 0 HD2 PRO A 128 13.960 33.652 48.759 1.00 0.00 H new ATOM 0 HD3 PRO A 128 14.386 33.682 47.059 1.00 0.00 H new ATOM 2014 N LYS A 129 17.640 32.850 50.690 1.00 0.00 N ATOM 2015 CA LYS A 129 18.053 32.547 52.082 1.00 0.00 C ATOM 2016 C LYS A 129 16.899 31.890 52.864 1.00 0.00 C ATOM 2017 O LYS A 129 17.124 31.177 53.840 1.00 0.00 O ATOM 2018 CB LYS A 129 18.479 33.894 52.670 1.00 0.00 C ATOM 2019 CG LYS A 129 18.963 33.702 54.111 1.00 0.00 C ATOM 2020 CD LYS A 129 20.490 33.785 54.158 1.00 0.00 C ATOM 2021 CE LYS A 129 21.054 32.539 54.850 1.00 0.00 C ATOM 2022 NZ LYS A 129 22.183 33.035 55.691 1.00 0.00 N ATOM 0 H LYS A 129 17.697 33.834 50.426 1.00 0.00 H new ATOM 0 HA LYS A 129 18.871 31.828 52.133 1.00 0.00 H new ATOM 0 HB2 LYS A 129 19.274 34.330 52.065 1.00 0.00 H new ATOM 0 HB3 LYS A 129 17.642 34.592 52.648 1.00 0.00 H new ATOM 0 HG2 LYS A 129 18.528 34.466 54.756 1.00 0.00 H new ATOM 0 HG3 LYS A 129 18.630 32.736 54.491 1.00 0.00 H new ATOM 0 HD2 LYS A 129 20.891 33.864 53.147 1.00 0.00 H new ATOM 0 HD3 LYS A 129 20.799 34.682 54.695 1.00 0.00 H new ATOM 0 HE2 LYS A 129 20.294 32.049 55.460 1.00 0.00 H new ATOM 0 HE3 LYS A 129 21.399 31.806 54.121 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 22.752 32.229 56.019 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 22.780 33.675 55.129 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 21.805 33.548 56.513 1.00 0.00 H new ATOM 2036 N ALA A 130 15.677 32.075 52.430 1.00 0.00 N ATOM 2037 CA ALA A 130 14.524 31.412 53.125 1.00 0.00 C ATOM 2038 C ALA A 130 14.584 29.895 52.875 1.00 0.00 C ATOM 2039 O ALA A 130 14.318 29.103 53.777 1.00 0.00 O ATOM 2040 CB ALA A 130 13.271 32.015 52.490 1.00 0.00 C ATOM 0 H ALA A 130 15.426 32.653 51.628 1.00 0.00 H new ATOM 0 HA ALA A 130 14.537 31.567 54.204 1.00 0.00 H new ATOM 0 HB1 ALA A 130 12.384 31.577 52.948 1.00 0.00 H new ATOM 0 HB2 ALA A 130 13.266 33.094 52.648 1.00 0.00 H new ATOM 0 HB3 ALA A 130 13.268 31.805 51.421 1.00 0.00 H new ATOM 2046 N TRP A 131 14.975 29.459 51.682 1.00 0.00 N ATOM 2047 CA TRP A 131 15.086 27.986 51.457 1.00 0.00 C ATOM 2048 C TRP A 131 16.173 27.458 52.374 1.00 0.00 C ATOM 2049 O TRP A 131 16.079 26.352 52.907 1.00 0.00 O ATOM 2050 CB TRP A 131 15.503 27.801 50.000 1.00 0.00 C ATOM 2051 CG TRP A 131 14.565 26.882 49.268 1.00 0.00 C ATOM 2052 CD1 TRP A 131 14.932 26.145 48.193 1.00 0.00 C ATOM 2053 CD2 TRP A 131 13.152 26.565 49.516 1.00 0.00 C ATOM 2054 NE1 TRP A 131 13.846 25.412 47.756 1.00 0.00 N ATOM 2055 CE2 TRP A 131 12.729 25.633 48.534 1.00 0.00 C ATOM 2056 CE3 TRP A 131 12.204 26.983 50.472 1.00 0.00 C ATOM 2057 CZ2 TRP A 131 11.424 25.139 48.503 1.00 0.00 C ATOM 2058 CZ3 TRP A 131 10.890 26.486 50.440 1.00 0.00 C ATOM 2059 CH2 TRP A 131 10.502 25.566 49.458 1.00 0.00 C ATOM 0 H TRP A 131 15.213 30.049 50.885 1.00 0.00 H new ATOM 0 HA TRP A 131 14.153 27.460 51.660 1.00 0.00 H new ATOM 0 HB2 TRP A 131 15.526 28.770 49.502 1.00 0.00 H new ATOM 0 HB3 TRP A 131 16.515 27.397 49.959 1.00 0.00 H new ATOM 0 HD1 TRP A 131 15.916 26.132 47.749 1.00 0.00 H new ATOM 0 HE1 TRP A 131 13.868 24.782 46.954 1.00 0.00 H new ATOM 0 HE3 TRP A 131 12.490 27.691 51.236 1.00 0.00 H new ATOM 0 HZ2 TRP A 131 11.130 24.430 47.743 1.00 0.00 H new ATOM 0 HZ3 TRP A 131 10.174 26.816 51.178 1.00 0.00 H new ATOM 0 HH2 TRP A 131 9.490 25.188 49.440 1.00 0.00 H new ATOM 2070 N GLN A 132 17.187 28.244 52.611 1.00 0.00 N ATOM 2071 CA GLN A 132 18.268 27.802 53.543 1.00 0.00 C ATOM 2072 C GLN A 132 17.709 27.726 54.973 1.00 0.00 C ATOM 2073 O GLN A 132 17.909 26.747 55.689 1.00 0.00 O ATOM 2074 CB GLN A 132 19.353 28.889 53.419 1.00 0.00 C ATOM 2075 CG GLN A 132 20.135 29.055 54.736 1.00 0.00 C ATOM 2076 CD GLN A 132 20.584 27.694 55.274 1.00 0.00 C ATOM 2077 OE1 GLN A 132 21.230 26.877 54.496 1.00 0.00 O flip ATOM 2078 NE2 GLN A 132 20.340 27.371 56.435 1.00 0.00 N flip ATOM 0 H GLN A 132 17.316 29.170 52.203 1.00 0.00 H new ATOM 0 HA GLN A 132 18.665 26.814 53.309 1.00 0.00 H new ATOM 0 HB2 GLN A 132 20.042 28.628 52.616 1.00 0.00 H new ATOM 0 HB3 GLN A 132 18.890 29.838 53.147 1.00 0.00 H new ATOM 0 HG2 GLN A 132 21.005 29.691 54.571 1.00 0.00 H new ATOM 0 HG3 GLN A 132 19.510 29.556 55.475 1.00 0.00 H new ATOM 0 HE21 GLN A 132 19.833 28.011 57.047 1.00 0.00 H new ATOM 0 HE22 GLN A 132 20.644 26.463 56.786 1.00 0.00 H new ATOM 2087 N GLN A 133 17.019 28.748 55.403 1.00 0.00 N ATOM 2088 CA GLN A 133 16.457 28.749 56.787 1.00 0.00 C ATOM 2089 C GLN A 133 15.449 27.610 56.974 1.00 0.00 C ATOM 2090 O GLN A 133 15.443 26.933 57.999 1.00 0.00 O ATOM 2091 CB GLN A 133 15.763 30.105 56.931 1.00 0.00 C ATOM 2092 CG GLN A 133 15.194 30.241 58.344 1.00 0.00 C ATOM 2093 CD GLN A 133 16.335 30.494 59.328 1.00 0.00 C ATOM 2094 OE1 GLN A 133 17.034 29.566 59.725 1.00 0.00 O ATOM 2095 NE2 GLN A 133 16.564 31.709 59.746 1.00 0.00 N ATOM 0 H GLN A 133 16.819 29.585 54.855 1.00 0.00 H new ATOM 0 HA GLN A 133 17.233 28.599 57.537 1.00 0.00 H new ATOM 0 HB2 GLN A 133 16.471 30.910 56.734 1.00 0.00 H new ATOM 0 HB3 GLN A 133 14.964 30.196 56.196 1.00 0.00 H new ATOM 0 HG2 GLN A 133 14.478 31.062 58.382 1.00 0.00 H new ATOM 0 HG3 GLN A 133 14.655 29.334 58.620 1.00 0.00 H new ATOM 0 HE21 GLN A 133 15.983 32.480 59.416 1.00 0.00 H new ATOM 0 HE22 GLN A 133 17.324 31.888 60.403 1.00 0.00 H new ATOM 2104 N ALA A 134 14.585 27.395 56.019 1.00 0.00 N ATOM 2105 CA ALA A 134 13.569 26.309 56.169 1.00 0.00 C ATOM 2106 C ALA A 134 14.237 24.938 56.193 1.00 0.00 C ATOM 2107 O ALA A 134 14.130 24.198 57.172 1.00 0.00 O ATOM 2108 CB ALA A 134 12.652 26.444 54.953 1.00 0.00 C ATOM 0 H ALA A 134 14.537 27.920 55.146 1.00 0.00 H new ATOM 0 HA ALA A 134 13.018 26.398 57.105 1.00 0.00 H new ATOM 0 HB1 ALA A 134 11.878 25.677 54.994 1.00 0.00 H new ATOM 0 HB2 ALA A 134 12.187 27.430 54.956 1.00 0.00 H new ATOM 0 HB3 ALA A 134 13.236 26.321 54.041 1.00 0.00 H new ATOM 2114 N TRP A 135 14.931 24.586 55.149 1.00 0.00 N ATOM 2115 CA TRP A 135 15.625 23.260 55.119 1.00 0.00 C ATOM 2116 C TRP A 135 16.379 23.032 56.440 1.00 0.00 C ATOM 2117 O TRP A 135 16.249 21.990 57.080 1.00 0.00 O ATOM 2118 CB TRP A 135 16.605 23.418 53.991 1.00 0.00 C ATOM 2119 CG TRP A 135 15.926 23.467 52.674 1.00 0.00 C ATOM 2120 CD1 TRP A 135 16.565 23.815 51.555 1.00 0.00 C ATOM 2121 CD2 TRP A 135 14.552 23.148 52.291 1.00 0.00 C ATOM 2122 NE1 TRP A 135 15.684 23.761 50.492 1.00 0.00 N ATOM 2123 CE2 TRP A 135 14.429 23.345 50.893 1.00 0.00 C ATOM 2124 CE3 TRP A 135 13.413 22.718 53.001 1.00 0.00 C ATOM 2125 CZ2 TRP A 135 13.224 23.125 50.226 1.00 0.00 C ATOM 2126 CZ3 TRP A 135 12.199 22.493 52.329 1.00 0.00 C ATOM 2127 CH2 TRP A 135 12.105 22.697 50.946 1.00 0.00 C ATOM 0 H TRP A 135 15.051 25.156 54.312 1.00 0.00 H new ATOM 0 HA TRP A 135 14.946 22.417 54.991 1.00 0.00 H new ATOM 0 HB2 TRP A 135 17.182 24.331 54.136 1.00 0.00 H new ATOM 0 HB3 TRP A 135 17.312 22.588 54.005 1.00 0.00 H new ATOM 0 HD1 TRP A 135 17.606 24.095 51.491 1.00 0.00 H new ATOM 0 HE1 TRP A 135 15.930 23.999 49.531 1.00 0.00 H new ATOM 0 HE3 TRP A 135 13.473 22.560 54.068 1.00 0.00 H new ATOM 0 HZ2 TRP A 135 13.156 23.284 49.160 1.00 0.00 H new ATOM 0 HZ3 TRP A 135 11.333 22.161 52.882 1.00 0.00 H new ATOM 0 HH2 TRP A 135 11.169 22.524 50.437 1.00 0.00 H new ATOM 2138 N ARG A 136 17.138 24.005 56.863 1.00 0.00 N ATOM 2139 CA ARG A 136 17.887 23.884 58.166 1.00 0.00 C ATOM 2140 C ARG A 136 16.886 23.657 59.318 1.00 0.00 C ATOM 2141 O ARG A 136 17.146 22.905 60.255 1.00 0.00 O ATOM 2142 CB ARG A 136 18.610 25.236 58.314 1.00 0.00 C ATOM 2143 CG ARG A 136 18.976 25.516 59.783 1.00 0.00 C ATOM 2144 CD ARG A 136 18.974 27.029 60.028 1.00 0.00 C ATOM 2145 NE ARG A 136 19.536 27.204 61.402 1.00 0.00 N ATOM 2146 CZ ARG A 136 19.420 28.350 62.034 1.00 0.00 C ATOM 2147 NH1 ARG A 136 18.808 29.361 61.474 1.00 0.00 N ATOM 2148 NH2 ARG A 136 19.918 28.483 63.233 1.00 0.00 N ATOM 0 H ARG A 136 17.278 24.885 56.367 1.00 0.00 H new ATOM 0 HA ARG A 136 18.585 23.047 58.188 1.00 0.00 H new ATOM 0 HB2 ARG A 136 19.514 25.236 57.705 1.00 0.00 H new ATOM 0 HB3 ARG A 136 17.972 26.035 57.937 1.00 0.00 H new ATOM 0 HG2 ARG A 136 18.262 25.028 60.447 1.00 0.00 H new ATOM 0 HG3 ARG A 136 19.958 25.101 60.010 1.00 0.00 H new ATOM 0 HD2 ARG A 136 19.580 27.549 59.286 1.00 0.00 H new ATOM 0 HD3 ARG A 136 17.966 27.438 59.960 1.00 0.00 H new ATOM 0 HE ARG A 136 20.015 26.425 61.854 1.00 0.00 H new ATOM 0 HH11 ARG A 136 18.415 29.264 60.538 1.00 0.00 H new ATOM 0 HH12 ARG A 136 18.724 30.246 61.974 1.00 0.00 H new ATOM 0 HH21 ARG A 136 20.396 27.699 63.677 1.00 0.00 H new ATOM 0 HH22 ARG A 136 19.830 29.371 63.726 1.00 0.00 H new ATOM 2162 N ALA A 137 15.748 24.306 59.255 1.00 0.00 N ATOM 2163 CA ALA A 137 14.720 24.152 60.332 1.00 0.00 C ATOM 2164 C ALA A 137 14.224 22.708 60.381 1.00 0.00 C ATOM 2165 O ALA A 137 13.912 22.174 61.443 1.00 0.00 O ATOM 2166 CB ALA A 137 13.582 25.096 59.941 1.00 0.00 C ATOM 0 H ALA A 137 15.486 24.939 58.499 1.00 0.00 H new ATOM 0 HA ALA A 137 15.120 24.387 61.318 1.00 0.00 H new ATOM 0 HB1 ALA A 137 12.789 25.038 60.686 1.00 0.00 H new ATOM 0 HB2 ALA A 137 13.958 26.118 59.891 1.00 0.00 H new ATOM 0 HB3 ALA A 137 13.187 24.806 58.967 1.00 0.00 H new ATOM 2172 N ARG A 138 14.181 22.056 59.253 1.00 0.00 N ATOM 2173 CA ARG A 138 13.751 20.633 59.231 1.00 0.00 C ATOM 2174 C ARG A 138 14.987 19.768 59.449 1.00 0.00 C ATOM 2175 O ARG A 138 14.892 18.630 59.904 1.00 0.00 O ATOM 2176 CB ARG A 138 13.165 20.409 57.836 1.00 0.00 C ATOM 2177 CG ARG A 138 12.078 19.334 57.905 1.00 0.00 C ATOM 2178 CD ARG A 138 11.230 19.383 56.630 1.00 0.00 C ATOM 2179 NE ARG A 138 9.844 19.049 57.073 1.00 0.00 N ATOM 2180 CZ ARG A 138 8.867 18.958 56.201 1.00 0.00 C ATOM 2181 NH1 ARG A 138 9.087 19.157 54.925 1.00 0.00 N ATOM 2182 NH2 ARG A 138 7.663 18.665 56.609 1.00 0.00 N ATOM 0 H ARG A 138 14.426 22.449 58.344 1.00 0.00 H new ATOM 0 HA ARG A 138 13.020 20.385 60.000 1.00 0.00 H new ATOM 0 HB2 ARG A 138 12.747 21.340 57.452 1.00 0.00 H new ATOM 0 HB3 ARG A 138 13.950 20.103 57.145 1.00 0.00 H new ATOM 0 HG2 ARG A 138 12.532 18.349 58.015 1.00 0.00 H new ATOM 0 HG3 ARG A 138 11.448 19.494 58.780 1.00 0.00 H new ATOM 0 HD2 ARG A 138 11.269 20.369 56.168 1.00 0.00 H new ATOM 0 HD3 ARG A 138 11.590 18.669 55.889 1.00 0.00 H new ATOM 0 HE ARG A 138 9.654 18.890 58.063 1.00 0.00 H new ATOM 0 HH11 ARG A 138 10.026 19.386 54.599 1.00 0.00 H new ATOM 0 HH12 ARG A 138 8.319 19.083 54.258 1.00 0.00 H new ATOM 0 HH21 ARG A 138 7.485 18.508 57.601 1.00 0.00 H new ATOM 0 HH22 ARG A 138 6.900 18.593 55.936 1.00 0.00 H new ATOM 2196 N ARG A 139 16.152 20.290 59.162 1.00 0.00 N ATOM 2197 CA ARG A 139 17.398 19.501 59.383 1.00 0.00 C ATOM 2198 C ARG A 139 18.566 20.437 59.703 1.00 0.00 C ATOM 2199 O ARG A 139 18.841 20.629 60.876 1.00 0.00 O ATOM 2200 CB ARG A 139 17.646 18.757 58.075 1.00 0.00 C ATOM 2201 CG ARG A 139 18.466 17.499 58.368 1.00 0.00 C ATOM 2202 CD ARG A 139 18.119 16.409 57.353 1.00 0.00 C ATOM 2203 NE ARG A 139 18.411 15.126 58.058 1.00 0.00 N ATOM 2204 CZ ARG A 139 18.622 14.022 57.383 1.00 0.00 C ATOM 2205 NH1 ARG A 139 18.584 14.017 56.074 1.00 0.00 N ATOM 2206 NH2 ARG A 139 18.875 12.913 58.023 1.00 0.00 N ATOM 2207 OXT ARG A 139 19.164 20.944 58.769 1.00 0.00 O ATOM 0 H ARG A 139 16.293 21.227 58.785 1.00 0.00 H new ATOM 0 HA ARG A 139 17.303 18.813 60.223 1.00 0.00 H new ATOM 0 HB2 ARG A 139 16.698 18.489 57.608 1.00 0.00 H new ATOM 0 HB3 ARG A 139 18.177 19.398 57.372 1.00 0.00 H new ATOM 0 HG2 ARG A 139 19.531 17.728 58.320 1.00 0.00 H new ATOM 0 HG3 ARG A 139 18.261 17.147 59.379 1.00 0.00 H new ATOM 0 HD2 ARG A 139 17.073 16.466 57.053 1.00 0.00 H new ATOM 0 HD3 ARG A 139 18.717 16.507 56.447 1.00 0.00 H new ATOM 0 HE ARG A 139 18.447 15.108 59.077 1.00 0.00 H new ATOM 0 HH11 ARG A 139 18.388 14.880 55.566 1.00 0.00 H new ATOM 0 HH12 ARG A 139 18.750 13.150 55.562 1.00 0.00 H new ATOM 0 HH21 ARG A 139 18.908 12.909 59.042 1.00 0.00 H new ATOM 0 HH22 ARG A 139 19.040 12.051 57.504 1.00 0.00 H new