USER MOD reduce.3.24.130724 H: found=0, std=0, add=698, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 698 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 57 GLN : amide:sc= -0.385 K(o=-0.13,f=-2.1!) USER MOD Set 1.2: A 88 GLN : amide:sc= 0.253 K(o=-0.13,f=-2.3) USER MOD Set 2.1: A 19 ASN : amide:sc= 1.69 K(o=2.3,f=-0.38) USER MOD Set 2.2: A 31 GLN : amide:sc= 0.588 K(o=2.3,f=0.52) USER MOD Single : A 17 HIS : no HD1:sc= -0.0429 X(o=-0.043,f=0) USER MOD Single : A 21 LYS NZ :NH3+ -151:sc= 1.3 (180deg=0.847) USER MOD Single : A 25 GLN : amide:sc= 2.01 K(o=2,f=-0.62) USER MOD Single : A 28 SER OG : rot -92:sc= 1.32 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 HIS : no HD1:sc= -0.0306 X(o=-0.031,f=-0.23) USER MOD Single : A 38 THR OG1 : rot -20:sc= -1.22 USER MOD Single : A 41 SER OG : rot -132:sc= 1.4 USER MOD Single : A 42 LYS NZ :NH3+ -121:sc= 0.846 (180deg=-1.63!) USER MOD Single : A 44 MET CE :methyl -177:sc= -0.399 (180deg=-0.42) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 CYS SG : rot -83:sc= -0.558 USER MOD Single : A 51 GLN : amide:sc= -0.162 X(o=-0.16,f=-0.16) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 55 MET CE :methyl 163:sc= -0.074 (180deg=-0.506) USER MOD Single : A 65 GLN : amide:sc= -0.24 X(o=-0.24,f=-0.59) USER MOD Single : A 68 ASN : amide:sc= 1.12 K(o=1.1,f=-0.0021) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 THR OG1 : rot 180:sc= -0.0161 USER MOD Single : A 75 GLN : amide:sc=-0.00626 K(o=-0.0063,f=-0.69) USER MOD Single : A 78 MET CE :methyl -111:sc= -0.966 (180deg=-1.78) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 GLN : amide:sc= -0.12 X(o=-0.12,f=-0.61) USER MOD Single : A 90 GLN : amide:sc= 0.0559 K(o=0.056,f=-2.9!) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0.0719 USER MOD Single : B 357 ASN : amide:sc= 0 K(o=0,f=-2.4!) USER MOD Single : B 358 ASN : amide:sc= -0.0383 X(o=-0.038,f=0) USER MOD Single : B 365 SER OG : rot 180:sc= 0 USER MOD Single : B 367 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 16 -6.081 15.958 11.762 1.00 10.00 N ATOM 2 CA ASP A 16 -6.359 14.687 12.478 1.00 10.00 C ATOM 3 C ASP A 16 -5.897 13.507 11.642 1.00 10.00 C ATOM 4 O ASP A 16 -5.284 13.685 10.588 1.00 10.00 O ATOM 5 CB ASP A 16 -7.857 14.543 12.769 1.00 10.00 C ATOM 6 CG ASP A 16 -8.322 15.415 13.916 1.00 10.00 C ATOM 7 OD1 ASP A 16 -7.850 15.214 15.053 1.00 10.00 O ATOM 8 OD2 ASP A 16 -9.169 16.302 13.685 1.00 10.00 O ATOM 0 HA ASP A 16 -5.815 14.704 13.422 1.00 10.00 H new ATOM 0 HB2 ASP A 16 -8.422 14.799 11.873 1.00 10.00 H new ATOM 0 HB3 ASP A 16 -8.079 13.501 12.999 1.00 10.00 H new ATOM 13 N HIS A 17 -6.184 12.304 12.117 1.00 10.00 N ATOM 14 CA HIS A 17 -5.819 11.091 11.400 1.00 10.00 C ATOM 15 C HIS A 17 -6.855 10.793 10.323 1.00 10.00 C ATOM 16 O HIS A 17 -7.980 11.289 10.386 1.00 10.00 O ATOM 17 CB HIS A 17 -5.716 9.907 12.365 1.00 10.00 C ATOM 18 CG HIS A 17 -4.431 9.862 13.140 1.00 10.00 C ATOM 19 ND1 HIS A 17 -4.209 10.692 14.212 1.00 10.00 N ATOM 20 CD2 HIS A 17 -3.350 9.065 12.967 1.00 10.00 C ATOM 21 CE1 HIS A 17 -3.004 10.387 14.662 1.00 10.00 C ATOM 22 NE2 HIS A 17 -2.443 9.406 13.940 1.00 10.00 N ATOM 0 H HIS A 17 -6.670 12.142 12.999 1.00 10.00 H new ATOM 0 HA HIS A 17 -4.847 11.244 10.931 1.00 10.00 H new ATOM 0 HB2 HIS A 17 -6.550 9.949 13.066 1.00 10.00 H new ATOM 0 HB3 HIS A 17 -5.820 8.981 11.800 1.00 10.00 H new ATOM 0 HD2 HIS A 17 -3.225 8.306 12.209 1.00 10.00 H new ATOM 0 HE1 HIS A 17 -2.531 10.868 15.505 1.00 10.00 H new ATOM 0 HE2 HIS A 17 -1.522 8.993 14.085 1.00 10.00 H new ATOM 30 N ILE A 18 -6.472 9.999 9.338 1.00 10.00 N ATOM 31 CA ILE A 18 -7.366 9.639 8.248 1.00 10.00 C ATOM 32 C ILE A 18 -7.595 8.129 8.225 1.00 10.00 C ATOM 33 O ILE A 18 -6.696 7.354 8.558 1.00 10.00 O ATOM 34 CB ILE A 18 -6.806 10.116 6.884 1.00 10.00 C ATOM 35 CG1 ILE A 18 -7.804 9.831 5.761 1.00 10.00 C ATOM 36 CG2 ILE A 18 -5.461 9.461 6.586 1.00 10.00 C ATOM 37 CD1 ILE A 18 -7.429 10.475 4.446 1.00 10.00 C ATOM 0 H ILE A 18 -5.541 9.588 9.270 1.00 10.00 H new ATOM 0 HA ILE A 18 -8.320 10.139 8.417 1.00 10.00 H new ATOM 0 HB ILE A 18 -6.652 11.193 6.942 1.00 10.00 H new ATOM 0 HG12 ILE A 18 -7.882 8.753 5.620 1.00 10.00 H new ATOM 0 HG13 ILE A 18 -8.790 10.185 6.062 1.00 10.00 H new ATOM 0 HG21 ILE A 18 -5.090 9.813 5.623 1.00 10.00 H new ATOM 0 HG22 ILE A 18 -4.748 9.723 7.367 1.00 10.00 H new ATOM 0 HG23 ILE A 18 -5.583 8.378 6.554 1.00 10.00 H new ATOM 0 HD11 ILE A 18 -8.180 10.232 3.694 1.00 10.00 H new ATOM 0 HD12 ILE A 18 -7.379 11.557 4.572 1.00 10.00 H new ATOM 0 HD13 ILE A 18 -6.457 10.102 4.122 1.00 10.00 H new ATOM 49 N ASN A 19 -8.800 7.714 7.855 1.00 10.00 N ATOM 50 CA ASN A 19 -9.138 6.297 7.806 1.00 10.00 C ATOM 51 C ASN A 19 -9.165 5.793 6.368 1.00 10.00 C ATOM 52 O ASN A 19 -10.081 6.106 5.605 1.00 10.00 O ATOM 53 CB ASN A 19 -10.497 6.045 8.467 1.00 10.00 C ATOM 54 CG ASN A 19 -10.575 6.596 9.880 1.00 10.00 C ATOM 55 OD1 ASN A 19 -10.231 5.915 10.847 1.00 10.00 O ATOM 56 ND2 ASN A 19 -11.038 7.831 10.007 1.00 10.00 N ATOM 0 H ASN A 19 -9.560 8.339 7.584 1.00 10.00 H new ATOM 0 HA ASN A 19 -8.369 5.752 8.353 1.00 10.00 H new ATOM 0 HB2 ASN A 19 -11.281 6.500 7.861 1.00 10.00 H new ATOM 0 HB3 ASN A 19 -10.692 4.973 8.489 1.00 10.00 H new ATOM 0 HD21 ASN A 19 -11.120 8.252 10.932 1.00 10.00 H new ATOM 0 HD22 ASN A 19 -11.312 8.361 9.179 1.00 10.00 H new ATOM 63 N LEU A 20 -8.151 5.026 6.001 1.00 10.00 N ATOM 64 CA LEU A 20 -8.053 4.469 4.659 1.00 10.00 C ATOM 65 C LEU A 20 -8.377 2.978 4.686 1.00 10.00 C ATOM 66 O LEU A 20 -8.074 2.291 5.660 1.00 10.00 O ATOM 67 CB LEU A 20 -6.649 4.696 4.093 1.00 10.00 C ATOM 68 CG LEU A 20 -6.205 6.160 4.040 1.00 10.00 C ATOM 69 CD1 LEU A 20 -4.720 6.259 3.733 1.00 10.00 C ATOM 70 CD2 LEU A 20 -7.017 6.925 3.006 1.00 10.00 C ATOM 0 H LEU A 20 -7.379 4.773 6.617 1.00 10.00 H new ATOM 0 HA LEU A 20 -8.774 4.973 4.015 1.00 10.00 H new ATOM 0 HB2 LEU A 20 -5.935 4.136 4.697 1.00 10.00 H new ATOM 0 HB3 LEU A 20 -6.608 4.282 3.085 1.00 10.00 H new ATOM 0 HG LEU A 20 -6.382 6.608 5.018 1.00 10.00 H new ATOM 0 HD11 LEU A 20 -4.424 7.308 3.700 1.00 10.00 H new ATOM 0 HD12 LEU A 20 -4.153 5.747 4.510 1.00 10.00 H new ATOM 0 HD13 LEU A 20 -4.516 5.794 2.769 1.00 10.00 H new ATOM 0 HD21 LEU A 20 -6.688 7.964 2.981 1.00 10.00 H new ATOM 0 HD22 LEU A 20 -6.872 6.475 2.024 1.00 10.00 H new ATOM 0 HD23 LEU A 20 -8.074 6.885 3.271 1.00 10.00 H new ATOM 82 N LYS A 21 -9.000 2.481 3.627 1.00 10.00 N ATOM 83 CA LYS A 21 -9.363 1.072 3.554 1.00 10.00 C ATOM 84 C LYS A 21 -8.444 0.311 2.609 1.00 10.00 C ATOM 85 O LYS A 21 -8.510 0.480 1.391 1.00 10.00 O ATOM 86 CB LYS A 21 -10.811 0.917 3.085 1.00 10.00 C ATOM 87 CG LYS A 21 -11.842 1.473 4.054 1.00 10.00 C ATOM 88 CD LYS A 21 -13.232 1.482 3.439 1.00 10.00 C ATOM 89 CE LYS A 21 -14.283 1.957 4.430 1.00 10.00 C ATOM 90 NZ LYS A 21 -15.624 2.094 3.802 1.00 10.00 N ATOM 0 H LYS A 21 -9.264 3.030 2.809 1.00 10.00 H new ATOM 0 HA LYS A 21 -9.256 0.654 4.555 1.00 10.00 H new ATOM 0 HB2 LYS A 21 -10.925 1.417 2.123 1.00 10.00 H new ATOM 0 HB3 LYS A 21 -11.017 -0.141 2.920 1.00 10.00 H new ATOM 0 HG2 LYS A 21 -11.849 0.873 4.964 1.00 10.00 H new ATOM 0 HG3 LYS A 21 -11.563 2.487 4.342 1.00 10.00 H new ATOM 0 HD2 LYS A 21 -13.238 2.131 2.563 1.00 10.00 H new ATOM 0 HD3 LYS A 21 -13.484 0.479 3.094 1.00 10.00 H new ATOM 0 HE2 LYS A 21 -14.342 1.253 5.260 1.00 10.00 H new ATOM 0 HE3 LYS A 21 -13.979 2.917 4.848 1.00 10.00 H new ATOM 0 HZ1 LYS A 21 -16.164 2.834 4.294 1.00 10.00 H new ATOM 0 HZ2 LYS A 21 -15.514 2.353 2.801 1.00 10.00 H new ATOM 0 HZ3 LYS A 21 -16.134 1.190 3.871 1.00 10.00 H new ATOM 104 N VAL A 22 -7.588 -0.523 3.175 1.00 10.00 N ATOM 105 CA VAL A 22 -6.675 -1.332 2.386 1.00 10.00 C ATOM 106 C VAL A 22 -7.230 -2.747 2.290 1.00 10.00 C ATOM 107 O VAL A 22 -7.116 -3.537 3.230 1.00 10.00 O ATOM 108 CB VAL A 22 -5.255 -1.371 2.993 1.00 10.00 C ATOM 109 CG1 VAL A 22 -4.292 -2.113 2.076 1.00 10.00 C ATOM 110 CG2 VAL A 22 -4.750 0.036 3.279 1.00 10.00 C ATOM 0 H VAL A 22 -7.506 -0.658 4.183 1.00 10.00 H new ATOM 0 HA VAL A 22 -6.592 -0.882 1.397 1.00 10.00 H new ATOM 0 HB VAL A 22 -5.308 -1.912 3.938 1.00 10.00 H new ATOM 0 HG11 VAL A 22 -3.299 -2.127 2.526 1.00 10.00 H new ATOM 0 HG12 VAL A 22 -4.640 -3.136 1.934 1.00 10.00 H new ATOM 0 HG13 VAL A 22 -4.246 -1.608 1.111 1.00 10.00 H new ATOM 0 HG21 VAL A 22 -3.748 -0.017 3.706 1.00 10.00 H new ATOM 0 HG22 VAL A 22 -4.719 0.607 2.351 1.00 10.00 H new ATOM 0 HG23 VAL A 22 -5.420 0.527 3.985 1.00 10.00 H new ATOM 120 N ALA A 23 -7.852 -3.055 1.166 1.00 10.00 N ATOM 121 CA ALA A 23 -8.449 -4.363 0.969 1.00 10.00 C ATOM 122 C ALA A 23 -7.717 -5.158 -0.099 1.00 10.00 C ATOM 123 O ALA A 23 -7.259 -4.605 -1.100 1.00 10.00 O ATOM 124 CB ALA A 23 -9.918 -4.217 0.606 1.00 10.00 C ATOM 0 H ALA A 23 -7.957 -2.418 0.377 1.00 10.00 H new ATOM 0 HA ALA A 23 -8.364 -4.914 1.906 1.00 10.00 H new ATOM 0 HB1 ALA A 23 -10.357 -5.204 0.460 1.00 10.00 H new ATOM 0 HB2 ALA A 23 -10.442 -3.702 1.411 1.00 10.00 H new ATOM 0 HB3 ALA A 23 -10.010 -3.640 -0.314 1.00 10.00 H new ATOM 130 N GLY A 24 -7.607 -6.458 0.129 1.00 10.00 N ATOM 131 CA GLY A 24 -6.945 -7.325 -0.821 1.00 10.00 C ATOM 132 C GLY A 24 -7.931 -7.897 -1.817 1.00 10.00 C ATOM 133 O GLY A 24 -9.114 -7.547 -1.797 1.00 10.00 O ATOM 0 H GLY A 24 -7.966 -6.929 0.959 1.00 10.00 H new ATOM 0 HA2 GLY A 24 -6.172 -6.767 -1.350 1.00 10.00 H new ATOM 0 HA3 GLY A 24 -6.447 -8.137 -0.291 1.00 10.00 H new ATOM 137 N GLN A 25 -7.463 -8.794 -2.667 1.00 10.00 N ATOM 138 CA GLN A 25 -8.318 -9.409 -3.677 1.00 10.00 C ATOM 139 C GLN A 25 -9.025 -10.634 -3.109 1.00 10.00 C ATOM 140 O GLN A 25 -9.174 -11.654 -3.781 1.00 10.00 O ATOM 141 CB GLN A 25 -7.494 -9.794 -4.907 1.00 10.00 C ATOM 142 CG GLN A 25 -6.667 -8.648 -5.460 1.00 10.00 C ATOM 143 CD GLN A 25 -7.489 -7.397 -5.703 1.00 10.00 C ATOM 144 OE1 GLN A 25 -8.651 -7.467 -6.108 1.00 10.00 O ATOM 145 NE2 GLN A 25 -6.896 -6.247 -5.439 1.00 10.00 N ATOM 0 H GLN A 25 -6.495 -9.116 -2.681 1.00 10.00 H new ATOM 0 HA GLN A 25 -9.074 -8.683 -3.976 1.00 10.00 H new ATOM 0 HB2 GLN A 25 -6.831 -10.619 -4.647 1.00 10.00 H new ATOM 0 HB3 GLN A 25 -8.165 -10.157 -5.686 1.00 10.00 H new ATOM 0 HG2 GLN A 25 -5.861 -8.418 -4.764 1.00 10.00 H new ATOM 0 HG3 GLN A 25 -6.202 -8.959 -6.395 1.00 10.00 H new ATOM 0 HE21 GLN A 25 -5.932 -6.235 -5.105 1.00 10.00 H new ATOM 0 HE22 GLN A 25 -7.402 -5.371 -5.569 1.00 10.00 H new ATOM 154 N ASP A 26 -9.467 -10.519 -1.867 1.00 10.00 N ATOM 155 CA ASP A 26 -10.157 -11.607 -1.191 1.00 10.00 C ATOM 156 C ASP A 26 -11.304 -11.071 -0.330 1.00 10.00 C ATOM 157 O ASP A 26 -12.383 -10.790 -0.850 1.00 10.00 O ATOM 158 CB ASP A 26 -9.175 -12.456 -0.359 1.00 10.00 C ATOM 159 CG ASP A 26 -8.247 -11.640 0.521 1.00 10.00 C ATOM 160 OD1 ASP A 26 -7.188 -11.200 0.034 1.00 10.00 O ATOM 161 OD2 ASP A 26 -8.569 -11.448 1.713 1.00 10.00 O ATOM 0 H ASP A 26 -9.359 -9.676 -1.302 1.00 10.00 H new ATOM 0 HA ASP A 26 -10.588 -12.259 -1.950 1.00 10.00 H new ATOM 0 HB2 ASP A 26 -9.745 -13.141 0.268 1.00 10.00 H new ATOM 0 HB3 ASP A 26 -8.575 -13.066 -1.035 1.00 10.00 H new ATOM 166 N GLY A 27 -11.072 -10.917 0.967 1.00 10.00 N ATOM 167 CA GLY A 27 -12.101 -10.415 1.854 1.00 10.00 C ATOM 168 C GLY A 27 -11.519 -9.763 3.093 1.00 10.00 C ATOM 169 O GLY A 27 -12.195 -9.637 4.116 1.00 10.00 O ATOM 0 H GLY A 27 -10.185 -11.132 1.422 1.00 10.00 H new ATOM 0 HA2 GLY A 27 -12.718 -9.692 1.320 1.00 10.00 H new ATOM 0 HA3 GLY A 27 -12.755 -11.235 2.150 1.00 10.00 H new ATOM 173 N SER A 28 -10.259 -9.359 3.006 1.00 10.00 N ATOM 174 CA SER A 28 -9.583 -8.711 4.121 1.00 10.00 C ATOM 175 C SER A 28 -9.569 -7.202 3.915 1.00 10.00 C ATOM 176 O SER A 28 -9.111 -6.722 2.875 1.00 10.00 O ATOM 177 CB SER A 28 -8.152 -9.243 4.247 1.00 10.00 C ATOM 178 OG SER A 28 -7.564 -9.420 2.968 1.00 10.00 O ATOM 0 H SER A 28 -9.683 -9.469 2.172 1.00 10.00 H new ATOM 0 HA SER A 28 -10.122 -8.934 5.042 1.00 10.00 H new ATOM 0 HB2 SER A 28 -7.552 -8.548 4.835 1.00 10.00 H new ATOM 0 HB3 SER A 28 -8.158 -10.192 4.783 1.00 10.00 H new ATOM 0 HG SER A 28 -7.716 -10.339 2.662 1.00 10.00 H new ATOM 184 N VAL A 29 -10.076 -6.454 4.890 1.00 10.00 N ATOM 185 CA VAL A 29 -10.112 -4.999 4.774 1.00 10.00 C ATOM 186 C VAL A 29 -9.508 -4.343 6.009 1.00 10.00 C ATOM 187 O VAL A 29 -10.168 -4.218 7.040 1.00 10.00 O ATOM 188 CB VAL A 29 -11.551 -4.464 4.579 1.00 10.00 C ATOM 189 CG1 VAL A 29 -11.527 -2.984 4.216 1.00 10.00 C ATOM 190 CG2 VAL A 29 -12.293 -5.259 3.513 1.00 10.00 C ATOM 0 H VAL A 29 -10.463 -6.824 5.758 1.00 10.00 H new ATOM 0 HA VAL A 29 -9.525 -4.745 3.892 1.00 10.00 H new ATOM 0 HB VAL A 29 -12.083 -4.584 5.523 1.00 10.00 H new ATOM 0 HG11 VAL A 29 -12.548 -2.625 4.083 1.00 10.00 H new ATOM 0 HG12 VAL A 29 -11.046 -2.421 5.016 1.00 10.00 H new ATOM 0 HG13 VAL A 29 -10.970 -2.846 3.289 1.00 10.00 H new ATOM 0 HG21 VAL A 29 -13.301 -4.861 3.398 1.00 10.00 H new ATOM 0 HG22 VAL A 29 -11.761 -5.181 2.565 1.00 10.00 H new ATOM 0 HG23 VAL A 29 -12.349 -6.306 3.812 1.00 10.00 H new ATOM 200 N VAL A 30 -8.255 -3.926 5.911 1.00 10.00 N ATOM 201 CA VAL A 30 -7.603 -3.287 7.039 1.00 10.00 C ATOM 202 C VAL A 30 -7.797 -1.776 6.982 1.00 10.00 C ATOM 203 O VAL A 30 -7.684 -1.151 5.923 1.00 10.00 O ATOM 204 CB VAL A 30 -6.097 -3.637 7.137 1.00 10.00 C ATOM 205 CG1 VAL A 30 -5.910 -5.136 7.324 1.00 10.00 C ATOM 206 CG2 VAL A 30 -5.329 -3.153 5.915 1.00 10.00 C ATOM 0 H VAL A 30 -7.678 -4.017 5.075 1.00 10.00 H new ATOM 0 HA VAL A 30 -8.077 -3.677 7.940 1.00 10.00 H new ATOM 0 HB VAL A 30 -5.693 -3.120 8.008 1.00 10.00 H new ATOM 0 HG11 VAL A 30 -4.846 -5.364 7.391 1.00 10.00 H new ATOM 0 HG12 VAL A 30 -6.408 -5.453 8.240 1.00 10.00 H new ATOM 0 HG13 VAL A 30 -6.342 -5.665 6.475 1.00 10.00 H new ATOM 0 HG21 VAL A 30 -4.276 -3.416 6.019 1.00 10.00 H new ATOM 0 HG22 VAL A 30 -5.734 -3.625 5.020 1.00 10.00 H new ATOM 0 HG23 VAL A 30 -5.426 -2.071 5.830 1.00 10.00 H new ATOM 216 N GLN A 31 -8.113 -1.205 8.128 1.00 10.00 N ATOM 217 CA GLN A 31 -8.347 0.219 8.251 1.00 10.00 C ATOM 218 C GLN A 31 -7.061 0.925 8.658 1.00 10.00 C ATOM 219 O GLN A 31 -6.634 0.857 9.811 1.00 10.00 O ATOM 220 CB GLN A 31 -9.448 0.463 9.286 1.00 10.00 C ATOM 221 CG GLN A 31 -9.863 1.918 9.437 1.00 10.00 C ATOM 222 CD GLN A 31 -10.957 2.092 10.475 1.00 10.00 C ATOM 223 OE1 GLN A 31 -11.783 1.203 10.678 1.00 10.00 O ATOM 224 NE2 GLN A 31 -10.971 3.232 11.145 1.00 10.00 N ATOM 0 H GLN A 31 -8.215 -1.719 9.003 1.00 10.00 H new ATOM 0 HA GLN A 31 -8.668 0.622 7.290 1.00 10.00 H new ATOM 0 HB2 GLN A 31 -10.324 -0.124 9.011 1.00 10.00 H new ATOM 0 HB3 GLN A 31 -9.108 0.094 10.253 1.00 10.00 H new ATOM 0 HG2 GLN A 31 -8.996 2.515 9.720 1.00 10.00 H new ATOM 0 HG3 GLN A 31 -10.211 2.297 8.476 1.00 10.00 H new ATOM 0 HE21 GLN A 31 -10.270 3.947 10.950 1.00 10.00 H new ATOM 0 HE22 GLN A 31 -11.683 3.396 11.857 1.00 10.00 H new ATOM 233 N PHE A 32 -6.440 1.587 7.703 1.00 10.00 N ATOM 234 CA PHE A 32 -5.205 2.295 7.963 1.00 10.00 C ATOM 235 C PHE A 32 -5.496 3.702 8.454 1.00 10.00 C ATOM 236 O PHE A 32 -5.943 4.557 7.690 1.00 10.00 O ATOM 237 CB PHE A 32 -4.336 2.337 6.710 1.00 10.00 C ATOM 238 CG PHE A 32 -2.946 1.837 6.957 1.00 10.00 C ATOM 239 CD1 PHE A 32 -2.538 0.608 6.470 1.00 10.00 C ATOM 240 CD2 PHE A 32 -2.050 2.596 7.690 1.00 10.00 C ATOM 241 CE1 PHE A 32 -1.258 0.144 6.710 1.00 10.00 C ATOM 242 CE2 PHE A 32 -0.773 2.139 7.931 1.00 10.00 C ATOM 243 CZ PHE A 32 -0.375 0.914 7.443 1.00 10.00 C ATOM 0 H PHE A 32 -6.771 1.649 6.740 1.00 10.00 H new ATOM 0 HA PHE A 32 -4.659 1.761 8.741 1.00 10.00 H new ATOM 0 HB2 PHE A 32 -4.801 1.735 5.929 1.00 10.00 H new ATOM 0 HB3 PHE A 32 -4.289 3.361 6.339 1.00 10.00 H new ATOM 0 HD1 PHE A 32 -3.226 0.005 5.897 1.00 10.00 H new ATOM 0 HD2 PHE A 32 -2.355 3.557 8.077 1.00 10.00 H new ATOM 0 HE1 PHE A 32 -0.949 -0.817 6.326 1.00 10.00 H new ATOM 0 HE2 PHE A 32 -0.083 2.742 8.503 1.00 10.00 H new ATOM 0 HZ PHE A 32 0.626 0.556 7.633 1.00 10.00 H new ATOM 253 N LYS A 33 -5.249 3.934 9.732 1.00 10.00 N ATOM 254 CA LYS A 33 -5.491 5.232 10.327 1.00 10.00 C ATOM 255 C LYS A 33 -4.171 5.957 10.569 1.00 10.00 C ATOM 256 O LYS A 33 -3.552 5.816 11.622 1.00 10.00 O ATOM 257 CB LYS A 33 -6.279 5.080 11.630 1.00 10.00 C ATOM 258 CG LYS A 33 -6.708 6.401 12.246 1.00 10.00 C ATOM 259 CD LYS A 33 -7.514 6.192 13.516 1.00 10.00 C ATOM 260 CE LYS A 33 -7.915 7.518 14.135 1.00 10.00 C ATOM 261 NZ LYS A 33 -8.758 7.337 15.343 1.00 10.00 N ATOM 0 H LYS A 33 -4.880 3.236 10.377 1.00 10.00 H new ATOM 0 HA LYS A 33 -6.086 5.831 9.638 1.00 10.00 H new ATOM 0 HB2 LYS A 33 -7.165 4.474 11.439 1.00 10.00 H new ATOM 0 HB3 LYS A 33 -5.669 4.535 12.351 1.00 10.00 H new ATOM 0 HG2 LYS A 33 -5.826 7.002 12.469 1.00 10.00 H new ATOM 0 HG3 LYS A 33 -7.303 6.963 11.526 1.00 10.00 H new ATOM 0 HD2 LYS A 33 -8.406 5.608 13.292 1.00 10.00 H new ATOM 0 HD3 LYS A 33 -6.927 5.616 14.232 1.00 10.00 H new ATOM 0 HE2 LYS A 33 -7.019 8.080 14.399 1.00 10.00 H new ATOM 0 HE3 LYS A 33 -8.458 8.111 13.400 1.00 10.00 H new ATOM 0 HZ1 LYS A 33 -9.009 8.268 15.734 1.00 10.00 H new ATOM 0 HZ2 LYS A 33 -9.625 6.823 15.087 1.00 10.00 H new ATOM 0 HZ3 LYS A 33 -8.231 6.793 16.056 1.00 10.00 H new ATOM 275 N ILE A 34 -3.740 6.715 9.576 1.00 10.00 N ATOM 276 CA ILE A 34 -2.493 7.463 9.667 1.00 10.00 C ATOM 277 C ILE A 34 -2.752 8.945 9.481 1.00 10.00 C ATOM 278 O ILE A 34 -3.898 9.369 9.381 1.00 10.00 O ATOM 279 CB ILE A 34 -1.468 7.001 8.609 1.00 10.00 C ATOM 280 CG1 ILE A 34 -2.110 6.937 7.218 1.00 10.00 C ATOM 281 CG2 ILE A 34 -0.891 5.655 9.000 1.00 10.00 C ATOM 282 CD1 ILE A 34 -1.113 6.700 6.099 1.00 10.00 C ATOM 0 H ILE A 34 -4.236 6.831 8.692 1.00 10.00 H new ATOM 0 HA ILE A 34 -2.080 7.275 10.658 1.00 10.00 H new ATOM 0 HB ILE A 34 -0.658 7.729 8.567 1.00 10.00 H new ATOM 0 HG12 ILE A 34 -2.853 6.139 7.206 1.00 10.00 H new ATOM 0 HG13 ILE A 34 -2.641 7.870 7.029 1.00 10.00 H new ATOM 0 HG21 ILE A 34 -0.169 5.336 8.248 1.00 10.00 H new ATOM 0 HG22 ILE A 34 -0.395 5.739 9.967 1.00 10.00 H new ATOM 0 HG23 ILE A 34 -1.694 4.920 9.066 1.00 10.00 H new ATOM 0 HD11 ILE A 34 -1.638 6.666 5.145 1.00 10.00 H new ATOM 0 HD12 ILE A 34 -0.384 7.510 6.084 1.00 10.00 H new ATOM 0 HD13 ILE A 34 -0.599 5.753 6.264 1.00 10.00 H new ATOM 294 N LYS A 35 -1.694 9.732 9.444 1.00 10.00 N ATOM 295 CA LYS A 35 -1.836 11.161 9.246 1.00 10.00 C ATOM 296 C LYS A 35 -1.826 11.453 7.750 1.00 10.00 C ATOM 297 O LYS A 35 -1.231 10.708 6.972 1.00 10.00 O ATOM 298 CB LYS A 35 -0.733 11.920 9.985 1.00 10.00 C ATOM 299 CG LYS A 35 -0.758 11.680 11.488 1.00 10.00 C ATOM 300 CD LYS A 35 0.265 12.531 12.221 1.00 10.00 C ATOM 301 CE LYS A 35 0.263 12.234 13.712 1.00 10.00 C ATOM 302 NZ LYS A 35 1.123 13.179 14.468 1.00 10.00 N ATOM 0 H LYS A 35 -0.732 9.408 9.548 1.00 10.00 H new ATOM 0 HA LYS A 35 -2.784 11.503 9.661 1.00 10.00 H new ATOM 0 HB2 LYS A 35 0.237 11.619 9.590 1.00 10.00 H new ATOM 0 HB3 LYS A 35 -0.839 12.987 9.790 1.00 10.00 H new ATOM 0 HG2 LYS A 35 -1.754 11.900 11.873 1.00 10.00 H new ATOM 0 HG3 LYS A 35 -0.563 10.627 11.690 1.00 10.00 H new ATOM 0 HD2 LYS A 35 1.258 12.343 11.812 1.00 10.00 H new ATOM 0 HD3 LYS A 35 0.047 13.587 12.058 1.00 10.00 H new ATOM 0 HE2 LYS A 35 -0.757 12.289 14.091 1.00 10.00 H new ATOM 0 HE3 LYS A 35 0.610 11.214 13.879 1.00 10.00 H new ATOM 0 HZ1 LYS A 35 1.093 12.942 15.480 1.00 10.00 H new ATOM 0 HZ2 LYS A 35 2.102 13.108 14.124 1.00 10.00 H new ATOM 0 HZ3 LYS A 35 0.777 14.150 14.330 1.00 10.00 H new ATOM 316 N ARG A 36 -2.474 12.535 7.347 1.00 10.00 N ATOM 317 CA ARG A 36 -2.573 12.890 5.933 1.00 10.00 C ATOM 318 C ARG A 36 -1.219 13.247 5.317 1.00 10.00 C ATOM 319 O ARG A 36 -1.089 13.324 4.094 1.00 10.00 O ATOM 320 CB ARG A 36 -3.567 14.039 5.749 1.00 10.00 C ATOM 321 CG ARG A 36 -4.994 13.661 6.120 1.00 10.00 C ATOM 322 CD ARG A 36 -5.973 14.792 5.845 1.00 10.00 C ATOM 323 NE ARG A 36 -6.088 15.087 4.415 1.00 10.00 N ATOM 324 CZ ARG A 36 -7.175 14.824 3.674 1.00 10.00 C ATOM 325 NH1 ARG A 36 -8.254 14.269 4.224 1.00 10.00 N ATOM 326 NH2 ARG A 36 -7.184 15.127 2.381 1.00 10.00 N ATOM 0 H ARG A 36 -2.941 13.186 7.978 1.00 10.00 H new ATOM 0 HA ARG A 36 -2.934 12.008 5.404 1.00 10.00 H new ATOM 0 HB2 ARG A 36 -3.252 14.885 6.359 1.00 10.00 H new ATOM 0 HB3 ARG A 36 -3.543 14.369 4.710 1.00 10.00 H new ATOM 0 HG2 ARG A 36 -5.293 12.777 5.556 1.00 10.00 H new ATOM 0 HG3 ARG A 36 -5.035 13.394 7.176 1.00 10.00 H new ATOM 0 HD2 ARG A 36 -6.954 14.526 6.240 1.00 10.00 H new ATOM 0 HD3 ARG A 36 -5.649 15.688 6.374 1.00 10.00 H new ATOM 0 HE ARG A 36 -5.289 15.521 3.952 1.00 10.00 H new ATOM 0 HH11 ARG A 36 -8.259 14.040 5.218 1.00 10.00 H new ATOM 0 HH12 ARG A 36 -9.075 14.073 3.651 1.00 10.00 H new ATOM 0 HH21 ARG A 36 -6.365 15.559 1.953 1.00 10.00 H new ATOM 0 HH22 ARG A 36 -8.010 14.928 1.816 1.00 10.00 H new ATOM 340 N HIS A 37 -0.213 13.448 6.156 1.00 10.00 N ATOM 341 CA HIS A 37 1.122 13.783 5.668 1.00 10.00 C ATOM 342 C HIS A 37 2.087 12.610 5.844 1.00 10.00 C ATOM 343 O HIS A 37 3.286 12.741 5.598 1.00 10.00 O ATOM 344 CB HIS A 37 1.666 15.031 6.376 1.00 10.00 C ATOM 345 CG HIS A 37 1.608 14.963 7.872 1.00 10.00 C ATOM 346 ND1 HIS A 37 2.577 14.321 8.601 1.00 10.00 N ATOM 347 CD2 HIS A 37 0.686 15.479 8.719 1.00 10.00 C ATOM 348 CE1 HIS A 37 2.227 14.459 9.865 1.00 10.00 C ATOM 349 NE2 HIS A 37 1.087 15.153 9.988 1.00 10.00 N ATOM 0 H HIS A 37 -0.292 13.386 7.171 1.00 10.00 H new ATOM 0 HA HIS A 37 1.038 13.997 4.603 1.00 10.00 H new ATOM 0 HB2 HIS A 37 2.701 15.186 6.070 1.00 10.00 H new ATOM 0 HB3 HIS A 37 1.101 15.901 6.041 1.00 10.00 H new ATOM 0 HD2 HIS A 37 -0.196 16.040 8.447 1.00 10.00 H new ATOM 0 HE1 HIS A 37 2.789 14.062 10.697 1.00 10.00 H new ATOM 0 HE2 HIS A 37 0.610 15.392 10.858 1.00 10.00 H new ATOM 357 N THR A 38 1.562 11.466 6.260 1.00 10.00 N ATOM 358 CA THR A 38 2.382 10.278 6.459 1.00 10.00 C ATOM 359 C THR A 38 2.620 9.553 5.131 1.00 10.00 C ATOM 360 O THR A 38 1.668 9.164 4.455 1.00 10.00 O ATOM 361 CB THR A 38 1.720 9.319 7.468 1.00 10.00 C ATOM 362 OG1 THR A 38 1.444 10.027 8.683 1.00 10.00 O ATOM 363 CG2 THR A 38 2.613 8.123 7.767 1.00 10.00 C ATOM 0 H THR A 38 0.572 11.335 6.466 1.00 10.00 H new ATOM 0 HA THR A 38 3.343 10.600 6.860 1.00 10.00 H new ATOM 0 HB THR A 38 0.794 8.947 7.030 1.00 10.00 H new ATOM 0 HG1 THR A 38 2.004 10.830 8.728 1.00 10.00 H new ATOM 0 HG21 THR A 38 2.116 7.467 8.482 1.00 10.00 H new ATOM 0 HG22 THR A 38 2.807 7.574 6.845 1.00 10.00 H new ATOM 0 HG23 THR A 38 3.557 8.470 8.188 1.00 10.00 H new ATOM 371 N PRO A 39 3.899 9.388 4.737 1.00 10.00 N ATOM 372 CA PRO A 39 4.268 8.715 3.484 1.00 10.00 C ATOM 373 C PRO A 39 3.638 7.332 3.338 1.00 10.00 C ATOM 374 O PRO A 39 3.718 6.496 4.242 1.00 10.00 O ATOM 375 CB PRO A 39 5.791 8.599 3.579 1.00 10.00 C ATOM 376 CG PRO A 39 6.204 9.702 4.484 1.00 10.00 C ATOM 377 CD PRO A 39 5.089 9.861 5.477 1.00 10.00 C ATOM 0 HA PRO A 39 3.916 9.271 2.615 1.00 10.00 H new ATOM 0 HB2 PRO A 39 6.089 7.629 3.977 1.00 10.00 H new ATOM 0 HB3 PRO A 39 6.256 8.698 2.598 1.00 10.00 H new ATOM 0 HG2 PRO A 39 7.142 9.465 4.985 1.00 10.00 H new ATOM 0 HG3 PRO A 39 6.365 10.625 3.927 1.00 10.00 H new ATOM 0 HD2 PRO A 39 5.264 9.270 6.376 1.00 10.00 H new ATOM 0 HD3 PRO A 39 4.979 10.898 5.794 1.00 10.00 H new ATOM 385 N LEU A 40 3.037 7.089 2.177 1.00 10.00 N ATOM 386 CA LEU A 40 2.385 5.815 1.895 1.00 10.00 C ATOM 387 C LEU A 40 3.409 4.694 1.749 1.00 10.00 C ATOM 388 O LEU A 40 3.050 3.518 1.715 1.00 10.00 O ATOM 389 CB LEU A 40 1.532 5.919 0.631 1.00 10.00 C ATOM 390 CG LEU A 40 0.345 6.881 0.728 1.00 10.00 C ATOM 391 CD1 LEU A 40 -0.324 7.038 -0.627 1.00 10.00 C ATOM 392 CD2 LEU A 40 -0.659 6.395 1.762 1.00 10.00 C ATOM 0 H LEU A 40 2.988 7.762 1.412 1.00 10.00 H new ATOM 0 HA LEU A 40 1.737 5.576 2.738 1.00 10.00 H new ATOM 0 HB2 LEU A 40 2.170 6.235 -0.194 1.00 10.00 H new ATOM 0 HB3 LEU A 40 1.156 4.927 0.382 1.00 10.00 H new ATOM 0 HG LEU A 40 0.720 7.854 1.045 1.00 10.00 H new ATOM 0 HD11 LEU A 40 -1.166 7.725 -0.540 1.00 10.00 H new ATOM 0 HD12 LEU A 40 0.395 7.434 -1.344 1.00 10.00 H new ATOM 0 HD13 LEU A 40 -0.682 6.068 -0.971 1.00 10.00 H new ATOM 0 HD21 LEU A 40 -1.494 7.093 1.815 1.00 10.00 H new ATOM 0 HD22 LEU A 40 -1.027 5.410 1.476 1.00 10.00 H new ATOM 0 HD23 LEU A 40 -0.176 6.333 2.737 1.00 10.00 H new ATOM 404 N SER A 41 4.681 5.066 1.667 1.00 10.00 N ATOM 405 CA SER A 41 5.759 4.099 1.548 1.00 10.00 C ATOM 406 C SER A 41 5.754 3.162 2.752 1.00 10.00 C ATOM 407 O SER A 41 5.932 1.950 2.620 1.00 10.00 O ATOM 408 CB SER A 41 7.090 4.840 1.455 1.00 10.00 C ATOM 409 OG SER A 41 6.866 6.231 1.272 1.00 10.00 O ATOM 0 H SER A 41 4.990 6.038 1.681 1.00 10.00 H new ATOM 0 HA SER A 41 5.618 3.502 0.647 1.00 10.00 H new ATOM 0 HB2 SER A 41 7.671 4.674 2.362 1.00 10.00 H new ATOM 0 HB3 SER A 41 7.676 4.446 0.625 1.00 10.00 H new ATOM 0 HG SER A 41 7.433 6.561 0.544 1.00 10.00 H new ATOM 415 N LYS A 42 5.519 3.734 3.927 1.00 10.00 N ATOM 416 CA LYS A 42 5.470 2.962 5.156 1.00 10.00 C ATOM 417 C LYS A 42 4.149 2.209 5.248 1.00 10.00 C ATOM 418 O LYS A 42 4.078 1.131 5.827 1.00 10.00 O ATOM 419 CB LYS A 42 5.653 3.881 6.368 1.00 10.00 C ATOM 420 CG LYS A 42 7.112 4.123 6.725 1.00 10.00 C ATOM 421 CD LYS A 42 7.402 5.597 6.966 1.00 10.00 C ATOM 422 CE LYS A 42 8.846 5.810 7.400 1.00 10.00 C ATOM 423 NZ LYS A 42 9.253 7.238 7.326 1.00 10.00 N ATOM 0 H LYS A 42 5.359 4.734 4.051 1.00 10.00 H new ATOM 0 HA LYS A 42 6.283 2.236 5.150 1.00 10.00 H new ATOM 0 HB2 LYS A 42 5.172 4.838 6.165 1.00 10.00 H new ATOM 0 HB3 LYS A 42 5.144 3.444 7.227 1.00 10.00 H new ATOM 0 HG2 LYS A 42 7.366 3.553 7.618 1.00 10.00 H new ATOM 0 HG3 LYS A 42 7.748 3.755 5.920 1.00 10.00 H new ATOM 0 HD2 LYS A 42 7.206 6.163 6.055 1.00 10.00 H new ATOM 0 HD3 LYS A 42 6.729 5.982 7.732 1.00 10.00 H new ATOM 0 HE2 LYS A 42 8.973 5.451 8.421 1.00 10.00 H new ATOM 0 HE3 LYS A 42 9.505 5.214 6.768 1.00 10.00 H new ATOM 0 HZ1 LYS A 42 10.064 7.335 6.682 1.00 10.00 H new ATOM 0 HZ2 LYS A 42 8.459 7.807 6.971 1.00 10.00 H new ATOM 0 HZ3 LYS A 42 9.522 7.572 8.274 1.00 10.00 H new ATOM 437 N LEU A 43 3.110 2.782 4.650 1.00 10.00 N ATOM 438 CA LEU A 43 1.786 2.168 4.641 1.00 10.00 C ATOM 439 C LEU A 43 1.816 0.863 3.846 1.00 10.00 C ATOM 440 O LEU A 43 1.308 -0.168 4.290 1.00 10.00 O ATOM 441 CB LEU A 43 0.761 3.143 4.035 1.00 10.00 C ATOM 442 CG LEU A 43 -0.639 2.572 3.767 1.00 10.00 C ATOM 443 CD1 LEU A 43 -1.707 3.594 4.120 1.00 10.00 C ATOM 444 CD2 LEU A 43 -0.782 2.153 2.309 1.00 10.00 C ATOM 0 H LEU A 43 3.160 3.676 4.162 1.00 10.00 H new ATOM 0 HA LEU A 43 1.492 1.942 5.666 1.00 10.00 H new ATOM 0 HB2 LEU A 43 0.661 3.996 4.706 1.00 10.00 H new ATOM 0 HB3 LEU A 43 1.162 3.522 3.095 1.00 10.00 H new ATOM 0 HG LEU A 43 -0.771 1.692 4.396 1.00 10.00 H new ATOM 0 HD11 LEU A 43 -2.693 3.173 3.924 1.00 10.00 H new ATOM 0 HD12 LEU A 43 -1.627 3.854 5.175 1.00 10.00 H new ATOM 0 HD13 LEU A 43 -1.568 4.489 3.514 1.00 10.00 H new ATOM 0 HD21 LEU A 43 -1.782 1.751 2.142 1.00 10.00 H new ATOM 0 HD22 LEU A 43 -0.626 3.018 1.665 1.00 10.00 H new ATOM 0 HD23 LEU A 43 -0.040 1.389 2.076 1.00 10.00 H new ATOM 456 N MET A 44 2.433 0.919 2.669 1.00 10.00 N ATOM 457 CA MET A 44 2.539 -0.245 1.796 1.00 10.00 C ATOM 458 C MET A 44 3.395 -1.327 2.442 1.00 10.00 C ATOM 459 O MET A 44 3.033 -2.505 2.440 1.00 10.00 O ATOM 460 CB MET A 44 3.132 0.155 0.442 1.00 10.00 C ATOM 461 CG MET A 44 2.267 1.135 -0.335 1.00 10.00 C ATOM 462 SD MET A 44 2.896 1.473 -1.991 1.00 10.00 S ATOM 463 CE MET A 44 4.427 2.319 -1.613 1.00 10.00 C ATOM 0 H MET A 44 2.869 1.763 2.297 1.00 10.00 H new ATOM 0 HA MET A 44 1.537 -0.644 1.638 1.00 10.00 H new ATOM 0 HB2 MET A 44 4.115 0.598 0.602 1.00 10.00 H new ATOM 0 HB3 MET A 44 3.281 -0.742 -0.159 1.00 10.00 H new ATOM 0 HG2 MET A 44 1.255 0.736 -0.411 1.00 10.00 H new ATOM 0 HG3 MET A 44 2.200 2.071 0.220 1.00 10.00 H new ATOM 0 HE1 MET A 44 4.904 2.639 -2.539 1.00 10.00 H new ATOM 0 HE2 MET A 44 4.218 3.191 -0.993 1.00 10.00 H new ATOM 0 HE3 MET A 44 5.093 1.644 -1.076 1.00 10.00 H new ATOM 473 N LYS A 45 4.523 -0.916 3.009 1.00 10.00 N ATOM 474 CA LYS A 45 5.433 -1.851 3.661 1.00 10.00 C ATOM 475 C LYS A 45 4.798 -2.459 4.903 1.00 10.00 C ATOM 476 O LYS A 45 5.066 -3.608 5.235 1.00 10.00 O ATOM 477 CB LYS A 45 6.752 -1.169 4.024 1.00 10.00 C ATOM 478 CG LYS A 45 7.635 -0.894 2.819 1.00 10.00 C ATOM 479 CD LYS A 45 9.076 -0.632 3.222 1.00 10.00 C ATOM 480 CE LYS A 45 9.228 0.696 3.945 1.00 10.00 C ATOM 481 NZ LYS A 45 10.608 0.888 4.460 1.00 10.00 N ATOM 0 H LYS A 45 4.829 0.057 3.031 1.00 10.00 H new ATOM 0 HA LYS A 45 5.641 -2.653 2.953 1.00 10.00 H new ATOM 0 HB2 LYS A 45 6.539 -0.229 4.533 1.00 10.00 H new ATOM 0 HB3 LYS A 45 7.296 -1.797 4.729 1.00 10.00 H new ATOM 0 HG2 LYS A 45 7.597 -1.745 2.139 1.00 10.00 H new ATOM 0 HG3 LYS A 45 7.248 -0.033 2.274 1.00 10.00 H new ATOM 0 HD2 LYS A 45 9.425 -1.439 3.866 1.00 10.00 H new ATOM 0 HD3 LYS A 45 9.708 -0.637 2.334 1.00 10.00 H new ATOM 0 HE2 LYS A 45 8.977 1.511 3.266 1.00 10.00 H new ATOM 0 HE3 LYS A 45 8.521 0.742 4.773 1.00 10.00 H new ATOM 0 HZ1 LYS A 45 10.672 1.805 4.947 1.00 10.00 H new ATOM 0 HZ2 LYS A 45 10.839 0.125 5.127 1.00 10.00 H new ATOM 0 HZ3 LYS A 45 11.280 0.869 3.667 1.00 10.00 H new ATOM 495 N ALA A 46 3.959 -1.688 5.585 1.00 10.00 N ATOM 496 CA ALA A 46 3.286 -2.168 6.786 1.00 10.00 C ATOM 497 C ALA A 46 2.375 -3.342 6.454 1.00 10.00 C ATOM 498 O ALA A 46 2.411 -4.383 7.114 1.00 10.00 O ATOM 499 CB ALA A 46 2.490 -1.047 7.432 1.00 10.00 C ATOM 0 H ALA A 46 3.729 -0.728 5.327 1.00 10.00 H new ATOM 0 HA ALA A 46 4.043 -2.507 7.493 1.00 10.00 H new ATOM 0 HB1 ALA A 46 1.994 -1.422 8.327 1.00 10.00 H new ATOM 0 HB2 ALA A 46 3.162 -0.233 7.704 1.00 10.00 H new ATOM 0 HB3 ALA A 46 1.742 -0.680 6.729 1.00 10.00 H new ATOM 505 N TYR A 47 1.559 -3.171 5.418 1.00 10.00 N ATOM 506 CA TYR A 47 0.650 -4.224 4.989 1.00 10.00 C ATOM 507 C TYR A 47 1.453 -5.430 4.520 1.00 10.00 C ATOM 508 O TYR A 47 1.130 -6.573 4.840 1.00 10.00 O ATOM 509 CB TYR A 47 -0.265 -3.727 3.866 1.00 10.00 C ATOM 510 CG TYR A 47 -1.360 -4.706 3.495 1.00 10.00 C ATOM 511 CD1 TYR A 47 -1.382 -5.321 2.249 1.00 10.00 C ATOM 512 CD2 TYR A 47 -2.371 -5.016 4.396 1.00 10.00 C ATOM 513 CE1 TYR A 47 -2.381 -6.217 1.913 1.00 10.00 C ATOM 514 CE2 TYR A 47 -3.372 -5.910 4.067 1.00 10.00 C ATOM 515 CZ TYR A 47 -3.373 -6.507 2.826 1.00 10.00 C ATOM 516 OH TYR A 47 -4.367 -7.400 2.495 1.00 10.00 O ATOM 0 H TYR A 47 1.510 -2.316 4.863 1.00 10.00 H new ATOM 0 HA TYR A 47 0.024 -4.513 5.833 1.00 10.00 H new ATOM 0 HB2 TYR A 47 -0.720 -2.785 4.170 1.00 10.00 H new ATOM 0 HB3 TYR A 47 0.339 -3.519 2.983 1.00 10.00 H new ATOM 0 HD1 TYR A 47 -0.607 -5.096 1.532 1.00 10.00 H new ATOM 0 HD2 TYR A 47 -2.375 -4.550 5.370 1.00 10.00 H new ATOM 0 HE1 TYR A 47 -2.384 -6.687 0.941 1.00 10.00 H new ATOM 0 HE2 TYR A 47 -4.150 -6.140 4.780 1.00 10.00 H new ATOM 0 HH TYR A 47 -4.986 -7.494 3.249 1.00 10.00 H new ATOM 526 N CYS A 48 2.522 -5.154 3.787 1.00 10.00 N ATOM 527 CA CYS A 48 3.394 -6.195 3.267 1.00 10.00 C ATOM 528 C CYS A 48 4.058 -6.972 4.403 1.00 10.00 C ATOM 529 O CYS A 48 4.250 -8.186 4.310 1.00 10.00 O ATOM 530 CB CYS A 48 4.459 -5.571 2.366 1.00 10.00 C ATOM 531 SG CYS A 48 5.216 -6.736 1.218 1.00 10.00 S ATOM 0 H CYS A 48 2.808 -4.207 3.537 1.00 10.00 H new ATOM 0 HA CYS A 48 2.791 -6.893 2.687 1.00 10.00 H new ATOM 0 HB2 CYS A 48 4.009 -4.757 1.798 1.00 10.00 H new ATOM 0 HB3 CYS A 48 5.238 -5.133 2.990 1.00 10.00 H new ATOM 0 HG CYS A 48 6.166 -7.386 1.823 1.00 10.00 H new ATOM 537 N GLU A 49 4.405 -6.261 5.472 1.00 10.00 N ATOM 538 CA GLU A 49 5.038 -6.863 6.641 1.00 10.00 C ATOM 539 C GLU A 49 4.128 -7.910 7.263 1.00 10.00 C ATOM 540 O GLU A 49 4.553 -9.024 7.569 1.00 10.00 O ATOM 541 CB GLU A 49 5.353 -5.784 7.677 1.00 10.00 C ATOM 542 CG GLU A 49 6.704 -5.123 7.487 1.00 10.00 C ATOM 543 CD GLU A 49 7.828 -5.909 8.123 1.00 10.00 C ATOM 544 OE1 GLU A 49 7.630 -6.448 9.228 1.00 10.00 O ATOM 545 OE2 GLU A 49 8.920 -5.978 7.524 1.00 10.00 O ATOM 0 H GLU A 49 4.256 -5.255 5.552 1.00 10.00 H new ATOM 0 HA GLU A 49 5.963 -7.344 6.321 1.00 10.00 H new ATOM 0 HB2 GLU A 49 4.577 -5.019 7.638 1.00 10.00 H new ATOM 0 HB3 GLU A 49 5.314 -6.227 8.672 1.00 10.00 H new ATOM 0 HG2 GLU A 49 6.902 -5.009 6.421 1.00 10.00 H new ATOM 0 HG3 GLU A 49 6.678 -4.121 7.915 1.00 10.00 H new ATOM 552 N ARG A 50 2.868 -7.543 7.429 1.00 10.00 N ATOM 553 CA ARG A 50 1.880 -8.431 8.020 1.00 10.00 C ATOM 554 C ARG A 50 1.623 -9.644 7.133 1.00 10.00 C ATOM 555 O ARG A 50 1.390 -10.745 7.632 1.00 10.00 O ATOM 556 CB ARG A 50 0.586 -7.671 8.276 1.00 10.00 C ATOM 557 CG ARG A 50 0.768 -6.512 9.239 1.00 10.00 C ATOM 558 CD ARG A 50 -0.565 -5.965 9.702 1.00 10.00 C ATOM 559 NE ARG A 50 -0.423 -5.052 10.830 1.00 10.00 N ATOM 560 CZ ARG A 50 -1.412 -4.766 11.670 1.00 10.00 C ATOM 561 NH1 ARG A 50 -2.584 -5.366 11.535 1.00 10.00 N ATOM 562 NH2 ARG A 50 -1.220 -3.905 12.661 1.00 10.00 N ATOM 0 H ARG A 50 2.503 -6.629 7.161 1.00 10.00 H new ATOM 0 HA ARG A 50 2.273 -8.795 8.970 1.00 10.00 H new ATOM 0 HB2 ARG A 50 0.197 -7.294 7.330 1.00 10.00 H new ATOM 0 HB3 ARG A 50 -0.160 -8.357 8.677 1.00 10.00 H new ATOM 0 HG2 ARG A 50 1.347 -6.841 10.102 1.00 10.00 H new ATOM 0 HG3 ARG A 50 1.339 -5.720 8.754 1.00 10.00 H new ATOM 0 HD2 ARG A 50 -1.050 -5.446 8.875 1.00 10.00 H new ATOM 0 HD3 ARG A 50 -1.217 -6.792 9.985 1.00 10.00 H new ATOM 0 HE ARG A 50 0.483 -4.610 10.982 1.00 10.00 H new ATOM 0 HH11 ARG A 50 -2.726 -6.046 10.788 1.00 10.00 H new ATOM 0 HH12 ARG A 50 -3.345 -5.149 12.178 1.00 10.00 H new ATOM 0 HH21 ARG A 50 -0.310 -3.460 12.780 1.00 10.00 H new ATOM 0 HH22 ARG A 50 -1.982 -3.689 13.303 1.00 10.00 H new ATOM 576 N GLN A 51 1.676 -9.439 5.824 1.00 10.00 N ATOM 577 CA GLN A 51 1.458 -10.524 4.875 1.00 10.00 C ATOM 578 C GLN A 51 2.684 -11.432 4.807 1.00 10.00 C ATOM 579 O GLN A 51 2.582 -12.605 4.441 1.00 10.00 O ATOM 580 CB GLN A 51 1.148 -9.968 3.482 1.00 10.00 C ATOM 581 CG GLN A 51 -0.100 -9.098 3.429 1.00 10.00 C ATOM 582 CD GLN A 51 -1.302 -9.750 4.082 1.00 10.00 C ATOM 583 OE1 GLN A 51 -1.577 -9.539 5.264 1.00 10.00 O ATOM 584 NE2 GLN A 51 -2.019 -10.559 3.322 1.00 10.00 N ATOM 0 H GLN A 51 1.868 -8.534 5.395 1.00 10.00 H new ATOM 0 HA GLN A 51 0.604 -11.108 5.220 1.00 10.00 H new ATOM 0 HB2 GLN A 51 2.001 -9.384 3.136 1.00 10.00 H new ATOM 0 HB3 GLN A 51 1.029 -10.800 2.788 1.00 10.00 H new ATOM 0 HG2 GLN A 51 0.104 -8.148 3.923 1.00 10.00 H new ATOM 0 HG3 GLN A 51 -0.336 -8.873 2.389 1.00 10.00 H new ATOM 0 HE21 GLN A 51 -1.758 -10.707 2.347 1.00 10.00 H new ATOM 0 HE22 GLN A 51 -2.833 -11.035 3.710 1.00 10.00 H new ATOM 593 N GLY A 52 3.839 -10.877 5.161 1.00 10.00 N ATOM 594 CA GLY A 52 5.074 -11.634 5.132 1.00 10.00 C ATOM 595 C GLY A 52 5.613 -11.779 3.726 1.00 10.00 C ATOM 596 O GLY A 52 6.139 -12.830 3.361 1.00 10.00 O ATOM 0 H GLY A 52 3.940 -9.910 5.469 1.00 10.00 H new ATOM 0 HA2 GLY A 52 5.818 -11.140 5.757 1.00 10.00 H new ATOM 0 HA3 GLY A 52 4.904 -12.622 5.560 1.00 10.00 H new ATOM 600 N LEU A 53 5.486 -10.724 2.935 1.00 10.00 N ATOM 601 CA LEU A 53 5.952 -10.742 1.555 1.00 10.00 C ATOM 602 C LEU A 53 6.897 -9.576 1.292 1.00 10.00 C ATOM 603 O LEU A 53 7.214 -8.806 2.201 1.00 10.00 O ATOM 604 CB LEU A 53 4.763 -10.674 0.592 1.00 10.00 C ATOM 605 CG LEU A 53 3.726 -11.791 0.749 1.00 10.00 C ATOM 606 CD1 LEU A 53 2.492 -11.492 -0.089 1.00 10.00 C ATOM 607 CD2 LEU A 53 4.319 -13.135 0.356 1.00 10.00 C ATOM 0 H LEU A 53 5.063 -9.842 3.225 1.00 10.00 H new ATOM 0 HA LEU A 53 6.492 -11.674 1.389 1.00 10.00 H new ATOM 0 HB2 LEU A 53 4.262 -9.715 0.727 1.00 10.00 H new ATOM 0 HB3 LEU A 53 5.143 -10.695 -0.429 1.00 10.00 H new ATOM 0 HG LEU A 53 3.432 -11.839 1.798 1.00 10.00 H new ATOM 0 HD11 LEU A 53 1.765 -12.295 0.034 1.00 10.00 H new ATOM 0 HD12 LEU A 53 2.050 -10.550 0.237 1.00 10.00 H new ATOM 0 HD13 LEU A 53 2.775 -11.416 -1.139 1.00 10.00 H new ATOM 0 HD21 LEU A 53 3.566 -13.914 0.475 1.00 10.00 H new ATOM 0 HD22 LEU A 53 4.643 -13.100 -0.684 1.00 10.00 H new ATOM 0 HD23 LEU A 53 5.174 -13.356 0.995 1.00 10.00 H new ATOM 619 N SER A 54 7.341 -9.450 0.050 1.00 10.00 N ATOM 620 CA SER A 54 8.241 -8.375 -0.340 1.00 10.00 C ATOM 621 C SER A 54 7.457 -7.272 -1.045 1.00 10.00 C ATOM 622 O SER A 54 6.507 -7.550 -1.780 1.00 10.00 O ATOM 623 CB SER A 54 9.346 -8.916 -1.251 1.00 10.00 C ATOM 624 OG SER A 54 10.353 -7.946 -1.474 1.00 10.00 O ATOM 0 H SER A 54 7.091 -10.083 -0.709 1.00 10.00 H new ATOM 0 HA SER A 54 8.706 -7.957 0.553 1.00 10.00 H new ATOM 0 HB2 SER A 54 9.788 -9.805 -0.801 1.00 10.00 H new ATOM 0 HB3 SER A 54 8.916 -9.222 -2.205 1.00 10.00 H new ATOM 0 HG SER A 54 11.045 -8.321 -2.058 1.00 10.00 H new ATOM 630 N MET A 55 7.860 -6.021 -0.832 1.00 10.00 N ATOM 631 CA MET A 55 7.180 -4.880 -1.439 1.00 10.00 C ATOM 632 C MET A 55 7.309 -4.917 -2.959 1.00 10.00 C ATOM 633 O MET A 55 6.440 -4.436 -3.681 1.00 10.00 O ATOM 634 CB MET A 55 7.751 -3.565 -0.896 1.00 10.00 C ATOM 635 CG MET A 55 6.953 -2.337 -1.312 1.00 10.00 C ATOM 636 SD MET A 55 7.619 -0.803 -0.636 1.00 10.00 S ATOM 637 CE MET A 55 9.225 -0.746 -1.427 1.00 10.00 C ATOM 0 H MET A 55 8.655 -5.772 -0.243 1.00 10.00 H new ATOM 0 HA MET A 55 6.123 -4.940 -1.180 1.00 10.00 H new ATOM 0 HB2 MET A 55 7.784 -3.615 0.192 1.00 10.00 H new ATOM 0 HB3 MET A 55 8.779 -3.455 -1.242 1.00 10.00 H new ATOM 0 HG2 MET A 55 6.937 -2.272 -2.400 1.00 10.00 H new ATOM 0 HG3 MET A 55 5.920 -2.454 -0.985 1.00 10.00 H new ATOM 0 HE1 MET A 55 9.629 0.264 -1.357 1.00 10.00 H new ATOM 0 HE2 MET A 55 9.900 -1.443 -0.930 1.00 10.00 H new ATOM 0 HE3 MET A 55 9.124 -1.025 -2.476 1.00 10.00 H new ATOM 647 N ARG A 56 8.389 -5.518 -3.438 1.00 10.00 N ATOM 648 CA ARG A 56 8.632 -5.626 -4.870 1.00 10.00 C ATOM 649 C ARG A 56 7.831 -6.782 -5.471 1.00 10.00 C ATOM 650 O ARG A 56 7.819 -6.984 -6.685 1.00 10.00 O ATOM 651 CB ARG A 56 10.129 -5.819 -5.136 1.00 10.00 C ATOM 652 CG ARG A 56 10.535 -5.540 -6.571 1.00 10.00 C ATOM 653 CD ARG A 56 12.034 -5.674 -6.758 1.00 10.00 C ATOM 654 NE ARG A 56 12.441 -5.319 -8.113 1.00 10.00 N ATOM 655 CZ ARG A 56 13.021 -4.166 -8.441 1.00 10.00 C ATOM 656 NH1 ARG A 56 13.266 -3.246 -7.512 1.00 10.00 N ATOM 657 NH2 ARG A 56 13.350 -3.932 -9.705 1.00 10.00 N ATOM 0 H ARG A 56 9.112 -5.939 -2.855 1.00 10.00 H new ATOM 0 HA ARG A 56 8.305 -4.702 -5.347 1.00 10.00 H new ATOM 0 HB2 ARG A 56 10.694 -5.163 -4.474 1.00 10.00 H new ATOM 0 HB3 ARG A 56 10.405 -6.842 -4.882 1.00 10.00 H new ATOM 0 HG2 ARG A 56 10.020 -6.232 -7.237 1.00 10.00 H new ATOM 0 HG3 ARG A 56 10.220 -4.535 -6.851 1.00 10.00 H new ATOM 0 HD2 ARG A 56 12.549 -5.032 -6.043 1.00 10.00 H new ATOM 0 HD3 ARG A 56 12.338 -6.699 -6.543 1.00 10.00 H new ATOM 0 HE ARG A 56 12.271 -5.997 -8.856 1.00 10.00 H new ATOM 0 HH11 ARG A 56 13.009 -3.421 -6.541 1.00 10.00 H new ATOM 0 HH12 ARG A 56 13.711 -2.365 -7.771 1.00 10.00 H new ATOM 0 HH21 ARG A 56 13.158 -4.634 -10.420 1.00 10.00 H new ATOM 0 HH22 ARG A 56 13.794 -3.050 -9.962 1.00 10.00 H new ATOM 671 N GLN A 57 7.142 -7.527 -4.616 1.00 10.00 N ATOM 672 CA GLN A 57 6.342 -8.663 -5.057 1.00 10.00 C ATOM 673 C GLN A 57 4.894 -8.250 -5.312 1.00 10.00 C ATOM 674 O GLN A 57 4.248 -8.743 -6.236 1.00 10.00 O ATOM 675 CB GLN A 57 6.392 -9.777 -4.009 1.00 10.00 C ATOM 676 CG GLN A 57 5.569 -10.999 -4.376 1.00 10.00 C ATOM 677 CD GLN A 57 5.385 -11.945 -3.208 1.00 10.00 C ATOM 678 OE1 GLN A 57 6.241 -12.044 -2.328 1.00 10.00 O ATOM 679 NE2 GLN A 57 4.255 -12.633 -3.183 1.00 10.00 N ATOM 0 H GLN A 57 7.121 -7.364 -3.609 1.00 10.00 H new ATOM 0 HA GLN A 57 6.761 -9.030 -5.994 1.00 10.00 H new ATOM 0 HB2 GLN A 57 7.429 -10.079 -3.862 1.00 10.00 H new ATOM 0 HB3 GLN A 57 6.037 -9.384 -3.057 1.00 10.00 H new ATOM 0 HG2 GLN A 57 4.592 -10.680 -4.738 1.00 10.00 H new ATOM 0 HG3 GLN A 57 6.056 -11.528 -5.195 1.00 10.00 H new ATOM 0 HE21 GLN A 57 3.573 -12.521 -3.933 1.00 10.00 H new ATOM 0 HE22 GLN A 57 4.066 -13.276 -2.414 1.00 10.00 H new ATOM 688 N ILE A 58 4.394 -7.334 -4.498 1.00 10.00 N ATOM 689 CA ILE A 58 3.021 -6.868 -4.630 1.00 10.00 C ATOM 690 C ILE A 58 2.965 -5.522 -5.342 1.00 10.00 C ATOM 691 O ILE A 58 4.000 -4.909 -5.608 1.00 10.00 O ATOM 692 CB ILE A 58 2.328 -6.752 -3.257 1.00 10.00 C ATOM 693 CG1 ILE A 58 3.148 -5.865 -2.312 1.00 10.00 C ATOM 694 CG2 ILE A 58 2.121 -8.137 -2.656 1.00 10.00 C ATOM 695 CD1 ILE A 58 2.487 -5.632 -0.972 1.00 10.00 C ATOM 0 H ILE A 58 4.917 -6.898 -3.739 1.00 10.00 H new ATOM 0 HA ILE A 58 2.490 -7.610 -5.227 1.00 10.00 H new ATOM 0 HB ILE A 58 1.353 -6.285 -3.395 1.00 10.00 H new ATOM 0 HG12 ILE A 58 4.123 -6.325 -2.151 1.00 10.00 H new ATOM 0 HG13 ILE A 58 3.324 -4.903 -2.793 1.00 10.00 H new ATOM 0 HG21 ILE A 58 1.631 -8.044 -1.687 1.00 10.00 H new ATOM 0 HG22 ILE A 58 1.497 -8.733 -3.322 1.00 10.00 H new ATOM 0 HG23 ILE A 58 3.087 -8.626 -2.529 1.00 10.00 H new ATOM 0 HD11 ILE A 58 3.125 -4.997 -0.357 1.00 10.00 H new ATOM 0 HD12 ILE A 58 1.524 -5.144 -1.121 1.00 10.00 H new ATOM 0 HD13 ILE A 58 2.335 -6.588 -0.470 1.00 10.00 H new ATOM 707 N ARG A 59 1.757 -5.080 -5.668 1.00 10.00 N ATOM 708 CA ARG A 59 1.550 -3.807 -6.351 1.00 10.00 C ATOM 709 C ARG A 59 0.376 -3.061 -5.727 1.00 10.00 C ATOM 710 O ARG A 59 -0.698 -3.630 -5.548 1.00 10.00 O ATOM 711 CB ARG A 59 1.279 -4.030 -7.845 1.00 10.00 C ATOM 712 CG ARG A 59 2.431 -4.677 -8.604 1.00 10.00 C ATOM 713 CD ARG A 59 3.682 -3.813 -8.576 1.00 10.00 C ATOM 714 NE ARG A 59 4.744 -4.363 -9.411 1.00 10.00 N ATOM 715 CZ ARG A 59 5.720 -5.151 -8.961 1.00 10.00 C ATOM 716 NH1 ARG A 59 5.771 -5.488 -7.677 1.00 10.00 N ATOM 717 NH2 ARG A 59 6.645 -5.606 -9.800 1.00 10.00 N ATOM 0 H ARG A 59 0.897 -5.590 -5.468 1.00 10.00 H new ATOM 0 HA ARG A 59 2.457 -3.212 -6.243 1.00 10.00 H new ATOM 0 HB2 ARG A 59 0.393 -4.656 -7.952 1.00 10.00 H new ATOM 0 HB3 ARG A 59 1.049 -3.070 -8.307 1.00 10.00 H new ATOM 0 HG2 ARG A 59 2.652 -5.651 -8.168 1.00 10.00 H new ATOM 0 HG3 ARG A 59 2.133 -4.851 -9.638 1.00 10.00 H new ATOM 0 HD2 ARG A 59 3.436 -2.808 -8.918 1.00 10.00 H new ATOM 0 HD3 ARG A 59 4.038 -3.723 -7.550 1.00 10.00 H new ATOM 0 HE ARG A 59 4.739 -4.129 -10.404 1.00 10.00 H new ATOM 0 HH11 ARG A 59 5.061 -5.143 -7.031 1.00 10.00 H new ATOM 0 HH12 ARG A 59 6.520 -6.091 -7.337 1.00 10.00 H new ATOM 0 HH21 ARG A 59 6.607 -5.352 -10.787 1.00 10.00 H new ATOM 0 HH22 ARG A 59 7.392 -6.209 -9.457 1.00 10.00 H new ATOM 731 N PHE A 60 0.580 -1.794 -5.397 1.00 10.00 N ATOM 732 CA PHE A 60 -0.473 -0.984 -4.794 1.00 10.00 C ATOM 733 C PHE A 60 -1.098 -0.050 -5.824 1.00 10.00 C ATOM 734 O PHE A 60 -0.391 0.611 -6.589 1.00 10.00 O ATOM 735 CB PHE A 60 0.078 -0.175 -3.617 1.00 10.00 C ATOM 736 CG PHE A 60 -0.079 -0.864 -2.291 1.00 10.00 C ATOM 737 CD1 PHE A 60 0.726 -1.938 -1.948 1.00 10.00 C ATOM 738 CD2 PHE A 60 -1.033 -0.434 -1.385 1.00 10.00 C ATOM 739 CE1 PHE A 60 0.581 -2.568 -0.726 1.00 10.00 C ATOM 740 CE2 PHE A 60 -1.181 -1.061 -0.162 1.00 10.00 C ATOM 741 CZ PHE A 60 -0.374 -2.129 0.166 1.00 10.00 C ATOM 0 H PHE A 60 1.463 -1.303 -5.536 1.00 10.00 H new ATOM 0 HA PHE A 60 -1.246 -1.658 -4.426 1.00 10.00 H new ATOM 0 HB2 PHE A 60 1.135 0.028 -3.789 1.00 10.00 H new ATOM 0 HB3 PHE A 60 -0.430 0.789 -3.579 1.00 10.00 H new ATOM 0 HD1 PHE A 60 1.475 -2.287 -2.643 1.00 10.00 H new ATOM 0 HD2 PHE A 60 -1.669 0.401 -1.637 1.00 10.00 H new ATOM 0 HE1 PHE A 60 1.216 -3.404 -0.470 1.00 10.00 H new ATOM 0 HE2 PHE A 60 -1.929 -0.714 0.536 1.00 10.00 H new ATOM 0 HZ PHE A 60 -0.490 -2.621 1.120 1.00 10.00 H new ATOM 751 N ARG A 61 -2.423 -0.003 -5.840 1.00 10.00 N ATOM 752 CA ARG A 61 -3.156 0.837 -6.777 1.00 10.00 C ATOM 753 C ARG A 61 -4.154 1.729 -6.047 1.00 10.00 C ATOM 754 O ARG A 61 -4.938 1.254 -5.228 1.00 10.00 O ATOM 755 CB ARG A 61 -3.903 -0.034 -7.794 1.00 10.00 C ATOM 756 CG ARG A 61 -3.004 -0.707 -8.819 1.00 10.00 C ATOM 757 CD ARG A 61 -2.769 0.189 -10.024 1.00 10.00 C ATOM 758 NE ARG A 61 -2.004 -0.486 -11.069 1.00 10.00 N ATOM 759 CZ ARG A 61 -2.184 -0.285 -12.375 1.00 10.00 C ATOM 760 NH1 ARG A 61 -3.090 0.586 -12.804 1.00 10.00 N ATOM 761 NH2 ARG A 61 -1.451 -0.957 -13.251 1.00 10.00 N ATOM 0 H ARG A 61 -3.016 -0.542 -5.209 1.00 10.00 H new ATOM 0 HA ARG A 61 -2.435 1.469 -7.295 1.00 10.00 H new ATOM 0 HB2 ARG A 61 -4.461 -0.801 -7.258 1.00 10.00 H new ATOM 0 HB3 ARG A 61 -4.633 0.584 -8.317 1.00 10.00 H new ATOM 0 HG2 ARG A 61 -2.048 -0.958 -8.358 1.00 10.00 H new ATOM 0 HG3 ARG A 61 -3.457 -1.644 -9.143 1.00 10.00 H new ATOM 0 HD2 ARG A 61 -3.729 0.511 -10.428 1.00 10.00 H new ATOM 0 HD3 ARG A 61 -2.238 1.087 -9.709 1.00 10.00 H new ATOM 0 HE ARG A 61 -1.287 -1.153 -10.782 1.00 10.00 H new ATOM 0 HH11 ARG A 61 -3.654 1.107 -12.133 1.00 10.00 H new ATOM 0 HH12 ARG A 61 -3.222 0.734 -13.805 1.00 10.00 H new ATOM 0 HH21 ARG A 61 -0.752 -1.625 -12.925 1.00 10.00 H new ATOM 0 HH22 ARG A 61 -1.586 -0.806 -14.251 1.00 10.00 H new ATOM 775 N PHE A 62 -4.118 3.020 -6.340 1.00 10.00 N ATOM 776 CA PHE A 62 -5.042 3.961 -5.725 1.00 10.00 C ATOM 777 C PHE A 62 -5.881 4.622 -6.803 1.00 10.00 C ATOM 778 O PHE A 62 -5.337 5.270 -7.698 1.00 10.00 O ATOM 779 CB PHE A 62 -4.302 5.031 -4.914 1.00 10.00 C ATOM 780 CG PHE A 62 -5.192 6.168 -4.488 1.00 10.00 C ATOM 781 CD1 PHE A 62 -6.167 5.977 -3.522 1.00 10.00 C ATOM 782 CD2 PHE A 62 -5.062 7.421 -5.066 1.00 10.00 C ATOM 783 CE1 PHE A 62 -6.996 7.015 -3.139 1.00 10.00 C ATOM 784 CE2 PHE A 62 -5.886 8.465 -4.686 1.00 10.00 C ATOM 785 CZ PHE A 62 -6.856 8.261 -3.722 1.00 10.00 C ATOM 0 H PHE A 62 -3.461 3.439 -6.998 1.00 10.00 H new ATOM 0 HA PHE A 62 -5.684 3.408 -5.039 1.00 10.00 H new ATOM 0 HB2 PHE A 62 -3.863 4.569 -4.029 1.00 10.00 H new ATOM 0 HB3 PHE A 62 -3.478 5.425 -5.509 1.00 10.00 H new ATOM 0 HD1 PHE A 62 -6.281 5.006 -3.063 1.00 10.00 H new ATOM 0 HD2 PHE A 62 -4.308 7.584 -5.822 1.00 10.00 H new ATOM 0 HE1 PHE A 62 -7.752 6.853 -2.385 1.00 10.00 H new ATOM 0 HE2 PHE A 62 -5.772 9.438 -5.141 1.00 10.00 H new ATOM 0 HZ PHE A 62 -7.503 9.073 -3.425 1.00 10.00 H new ATOM 795 N ASP A 63 -7.201 4.436 -6.713 1.00 10.00 N ATOM 796 CA ASP A 63 -8.159 4.998 -7.674 1.00 10.00 C ATOM 797 C ASP A 63 -8.058 4.289 -9.026 1.00 10.00 C ATOM 798 O ASP A 63 -9.051 3.782 -9.550 1.00 10.00 O ATOM 799 CB ASP A 63 -7.946 6.508 -7.844 1.00 10.00 C ATOM 800 CG ASP A 63 -9.020 7.162 -8.688 1.00 10.00 C ATOM 801 OD1 ASP A 63 -10.076 7.532 -8.131 1.00 10.00 O ATOM 802 OD2 ASP A 63 -8.808 7.330 -9.904 1.00 10.00 O ATOM 0 H ASP A 63 -7.638 3.890 -5.970 1.00 10.00 H new ATOM 0 HA ASP A 63 -9.161 4.837 -7.276 1.00 10.00 H new ATOM 0 HB2 ASP A 63 -7.925 6.980 -6.862 1.00 10.00 H new ATOM 0 HB3 ASP A 63 -6.973 6.683 -8.303 1.00 10.00 H new ATOM 807 N GLY A 64 -6.855 4.254 -9.574 1.00 10.00 N ATOM 808 CA GLY A 64 -6.615 3.603 -10.843 1.00 10.00 C ATOM 809 C GLY A 64 -5.135 3.421 -11.098 1.00 10.00 C ATOM 810 O GLY A 64 -4.683 2.326 -11.429 1.00 10.00 O ATOM 0 H GLY A 64 -6.026 4.673 -9.153 1.00 10.00 H new ATOM 0 HA2 GLY A 64 -7.110 2.632 -10.855 1.00 10.00 H new ATOM 0 HA3 GLY A 64 -7.054 4.195 -11.646 1.00 10.00 H new ATOM 814 N GLN A 65 -4.382 4.495 -10.921 1.00 10.00 N ATOM 815 CA GLN A 65 -2.941 4.467 -11.126 1.00 10.00 C ATOM 816 C GLN A 65 -2.219 3.900 -9.899 1.00 10.00 C ATOM 817 O GLN A 65 -2.735 3.958 -8.780 1.00 10.00 O ATOM 818 CB GLN A 65 -2.430 5.878 -11.435 1.00 10.00 C ATOM 819 CG GLN A 65 -2.750 6.342 -12.848 1.00 10.00 C ATOM 820 CD GLN A 65 -2.095 5.473 -13.904 1.00 10.00 C ATOM 821 OE1 GLN A 65 -2.659 4.467 -14.340 1.00 10.00 O ATOM 822 NE2 GLN A 65 -0.896 5.850 -14.324 1.00 10.00 N ATOM 0 H GLN A 65 -4.747 5.403 -10.634 1.00 10.00 H new ATOM 0 HA GLN A 65 -2.729 3.814 -11.973 1.00 10.00 H new ATOM 0 HB2 GLN A 65 -2.867 6.578 -10.723 1.00 10.00 H new ATOM 0 HB3 GLN A 65 -1.350 5.906 -11.288 1.00 10.00 H new ATOM 0 HG2 GLN A 65 -3.830 6.335 -12.994 1.00 10.00 H new ATOM 0 HG3 GLN A 65 -2.419 7.373 -12.973 1.00 10.00 H new ATOM 0 HE21 GLN A 65 -0.461 6.689 -13.939 1.00 10.00 H new ATOM 0 HE22 GLN A 65 -0.408 5.301 -15.032 1.00 10.00 H new ATOM 831 N PRO A 66 -1.028 3.309 -10.099 1.00 10.00 N ATOM 832 CA PRO A 66 -0.240 2.738 -9.004 1.00 10.00 C ATOM 833 C PRO A 66 0.348 3.807 -8.082 1.00 10.00 C ATOM 834 O PRO A 66 0.654 4.924 -8.512 1.00 10.00 O ATOM 835 CB PRO A 66 0.873 1.971 -9.722 1.00 10.00 C ATOM 836 CG PRO A 66 1.004 2.627 -11.050 1.00 10.00 C ATOM 837 CD PRO A 66 -0.366 3.133 -11.408 1.00 10.00 C ATOM 0 HA PRO A 66 -0.850 2.113 -8.352 1.00 10.00 H new ATOM 0 HB2 PRO A 66 1.808 2.020 -9.164 1.00 10.00 H new ATOM 0 HB3 PRO A 66 0.620 0.916 -9.827 1.00 10.00 H new ATOM 0 HG2 PRO A 66 1.723 3.446 -11.010 1.00 10.00 H new ATOM 0 HG3 PRO A 66 1.366 1.922 -11.798 1.00 10.00 H new ATOM 0 HD2 PRO A 66 -0.315 4.071 -11.960 1.00 10.00 H new ATOM 0 HD3 PRO A 66 -0.904 2.423 -12.036 1.00 10.00 H new ATOM 845 N ILE A 67 0.515 3.453 -6.817 1.00 10.00 N ATOM 846 CA ILE A 67 1.055 4.373 -5.825 1.00 10.00 C ATOM 847 C ILE A 67 2.584 4.384 -5.870 1.00 10.00 C ATOM 848 O ILE A 67 3.210 3.364 -6.163 1.00 10.00 O ATOM 849 CB ILE A 67 0.596 3.989 -4.400 1.00 10.00 C ATOM 850 CG1 ILE A 67 -0.925 3.824 -4.354 1.00 10.00 C ATOM 851 CG2 ILE A 67 1.049 5.031 -3.385 1.00 10.00 C ATOM 852 CD1 ILE A 67 -1.459 3.459 -2.983 1.00 10.00 C ATOM 0 H ILE A 67 0.283 2.530 -6.451 1.00 10.00 H new ATOM 0 HA ILE A 67 0.677 5.367 -6.066 1.00 10.00 H new ATOM 0 HB ILE A 67 1.057 3.037 -4.139 1.00 10.00 H new ATOM 0 HG12 ILE A 67 -1.392 4.753 -4.680 1.00 10.00 H new ATOM 0 HG13 ILE A 67 -1.219 3.053 -5.066 1.00 10.00 H new ATOM 0 HG21 ILE A 67 0.714 4.739 -2.390 1.00 10.00 H new ATOM 0 HG22 ILE A 67 2.137 5.101 -3.396 1.00 10.00 H new ATOM 0 HG23 ILE A 67 0.621 6.000 -3.642 1.00 10.00 H new ATOM 0 HD11 ILE A 67 -2.543 3.359 -3.030 1.00 10.00 H new ATOM 0 HD12 ILE A 67 -1.021 2.514 -2.662 1.00 10.00 H new ATOM 0 HD13 ILE A 67 -1.197 4.241 -2.270 1.00 10.00 H new ATOM 864 N ASN A 68 3.171 5.543 -5.600 1.00 10.00 N ATOM 865 CA ASN A 68 4.622 5.681 -5.593 1.00 10.00 C ATOM 866 C ASN A 68 5.143 5.622 -4.163 1.00 10.00 C ATOM 867 O ASN A 68 4.402 5.871 -3.210 1.00 10.00 O ATOM 868 CB ASN A 68 5.049 7.004 -6.233 1.00 10.00 C ATOM 869 CG ASN A 68 4.613 7.130 -7.676 1.00 10.00 C ATOM 870 OD1 ASN A 68 5.285 6.648 -8.588 1.00 10.00 O ATOM 871 ND2 ASN A 68 3.485 7.784 -7.894 1.00 10.00 N ATOM 0 H ASN A 68 2.665 6.401 -5.383 1.00 10.00 H new ATOM 0 HA ASN A 68 5.043 4.859 -6.173 1.00 10.00 H new ATOM 0 HB2 ASN A 68 4.630 7.831 -5.659 1.00 10.00 H new ATOM 0 HB3 ASN A 68 6.134 7.095 -6.178 1.00 10.00 H new ATOM 0 HD21 ASN A 68 3.141 7.905 -8.847 1.00 10.00 H new ATOM 0 HD22 ASN A 68 2.958 8.168 -7.109 1.00 10.00 H new ATOM 878 N GLU A 69 6.428 5.330 -4.019 1.00 10.00 N ATOM 879 CA GLU A 69 7.054 5.242 -2.703 1.00 10.00 C ATOM 880 C GLU A 69 7.324 6.632 -2.129 1.00 10.00 C ATOM 881 O GLU A 69 7.994 6.777 -1.106 1.00 10.00 O ATOM 882 CB GLU A 69 8.356 4.452 -2.796 1.00 10.00 C ATOM 883 CG GLU A 69 8.165 3.016 -3.257 1.00 10.00 C ATOM 884 CD GLU A 69 9.401 2.454 -3.923 1.00 10.00 C ATOM 885 OE1 GLU A 69 10.268 1.902 -3.214 1.00 10.00 O ATOM 886 OE2 GLU A 69 9.517 2.574 -5.161 1.00 10.00 O ATOM 0 H GLU A 69 7.061 5.149 -4.798 1.00 10.00 H new ATOM 0 HA GLU A 69 6.367 4.725 -2.033 1.00 10.00 H new ATOM 0 HB2 GLU A 69 9.031 4.959 -3.486 1.00 10.00 H new ATOM 0 HB3 GLU A 69 8.841 4.450 -1.820 1.00 10.00 H new ATOM 0 HG2 GLU A 69 7.903 2.394 -2.401 1.00 10.00 H new ATOM 0 HG3 GLU A 69 7.328 2.969 -3.953 1.00 10.00 H new ATOM 893 N THR A 70 6.811 7.648 -2.802 1.00 10.00 N ATOM 894 CA THR A 70 6.976 9.021 -2.367 1.00 10.00 C ATOM 895 C THR A 70 5.631 9.738 -2.334 1.00 10.00 C ATOM 896 O THR A 70 5.567 10.967 -2.307 1.00 10.00 O ATOM 897 CB THR A 70 7.934 9.775 -3.307 1.00 10.00 C ATOM 898 OG1 THR A 70 7.797 9.270 -4.643 1.00 10.00 O ATOM 899 CG2 THR A 70 9.375 9.624 -2.844 1.00 10.00 C ATOM 0 H THR A 70 6.271 7.543 -3.661 1.00 10.00 H new ATOM 0 HA THR A 70 7.398 9.006 -1.362 1.00 10.00 H new ATOM 0 HB THR A 70 7.676 10.834 -3.289 1.00 10.00 H new ATOM 0 HG1 THR A 70 8.407 9.753 -5.239 1.00 10.00 H new ATOM 0 HG21 THR A 70 10.034 10.165 -3.523 1.00 10.00 H new ATOM 0 HG22 THR A 70 9.478 10.030 -1.838 1.00 10.00 H new ATOM 0 HG23 THR A 70 9.647 8.568 -2.839 1.00 10.00 H new ATOM 907 N ASP A 71 4.553 8.965 -2.333 1.00 10.00 N ATOM 908 CA ASP A 71 3.210 9.534 -2.316 1.00 10.00 C ATOM 909 C ASP A 71 2.668 9.623 -0.895 1.00 10.00 C ATOM 910 O ASP A 71 3.078 8.867 -0.008 1.00 10.00 O ATOM 911 CB ASP A 71 2.258 8.704 -3.183 1.00 10.00 C ATOM 912 CG ASP A 71 2.277 9.127 -4.640 1.00 10.00 C ATOM 913 OD1 ASP A 71 2.480 10.329 -4.908 1.00 10.00 O ATOM 914 OD2 ASP A 71 2.091 8.256 -5.521 1.00 10.00 O ATOM 0 H ASP A 71 4.581 7.945 -2.344 1.00 10.00 H new ATOM 0 HA ASP A 71 3.275 10.542 -2.726 1.00 10.00 H new ATOM 0 HB2 ASP A 71 2.531 7.651 -3.111 1.00 10.00 H new ATOM 0 HB3 ASP A 71 1.244 8.798 -2.795 1.00 10.00 H new ATOM 919 N THR A 72 1.759 10.564 -0.686 1.00 10.00 N ATOM 920 CA THR A 72 1.131 10.773 0.608 1.00 10.00 C ATOM 921 C THR A 72 -0.372 10.949 0.422 1.00 10.00 C ATOM 922 O THR A 72 -0.819 11.281 -0.681 1.00 10.00 O ATOM 923 CB THR A 72 1.704 12.020 1.316 1.00 10.00 C ATOM 924 OG1 THR A 72 1.982 13.042 0.355 1.00 10.00 O ATOM 925 CG2 THR A 72 2.974 11.682 2.080 1.00 10.00 C ATOM 0 H THR A 72 1.436 11.205 -1.411 1.00 10.00 H new ATOM 0 HA THR A 72 1.336 9.900 1.228 1.00 10.00 H new ATOM 0 HB THR A 72 0.958 12.377 2.027 1.00 10.00 H new ATOM 0 HG1 THR A 72 2.343 13.830 0.811 1.00 10.00 H new ATOM 0 HG21 THR A 72 3.355 12.579 2.568 1.00 10.00 H new ATOM 0 HG22 THR A 72 2.755 10.924 2.833 1.00 10.00 H new ATOM 0 HG23 THR A 72 3.724 11.300 1.388 1.00 10.00 H new ATOM 933 N PRO A 73 -1.174 10.721 1.477 1.00 10.00 N ATOM 934 CA PRO A 73 -2.631 10.872 1.402 1.00 10.00 C ATOM 935 C PRO A 73 -3.040 12.250 0.898 1.00 10.00 C ATOM 936 O PRO A 73 -3.914 12.373 0.044 1.00 10.00 O ATOM 937 CB PRO A 73 -3.095 10.664 2.848 1.00 10.00 C ATOM 938 CG PRO A 73 -2.017 9.861 3.483 1.00 10.00 C ATOM 939 CD PRO A 73 -0.735 10.278 2.813 1.00 10.00 C ATOM 0 HA PRO A 73 -3.077 10.168 0.700 1.00 10.00 H new ATOM 0 HB2 PRO A 73 -3.232 11.616 3.360 1.00 10.00 H new ATOM 0 HB3 PRO A 73 -4.051 10.142 2.885 1.00 10.00 H new ATOM 0 HG2 PRO A 73 -1.974 10.046 4.556 1.00 10.00 H new ATOM 0 HG3 PRO A 73 -2.197 8.794 3.351 1.00 10.00 H new ATOM 0 HD2 PRO A 73 -0.239 11.080 3.359 1.00 10.00 H new ATOM 0 HD3 PRO A 73 -0.028 9.451 2.750 1.00 10.00 H new ATOM 947 N ALA A 74 -2.388 13.284 1.417 1.00 10.00 N ATOM 948 CA ALA A 74 -2.685 14.653 1.015 1.00 10.00 C ATOM 949 C ALA A 74 -2.287 14.905 -0.438 1.00 10.00 C ATOM 950 O ALA A 74 -2.943 15.670 -1.144 1.00 10.00 O ATOM 951 CB ALA A 74 -1.983 15.638 1.937 1.00 10.00 C ATOM 0 H ALA A 74 -1.651 13.200 2.117 1.00 10.00 H new ATOM 0 HA ALA A 74 -3.762 14.800 1.095 1.00 10.00 H new ATOM 0 HB1 ALA A 74 -2.214 16.657 1.625 1.00 10.00 H new ATOM 0 HB2 ALA A 74 -2.325 15.486 2.961 1.00 10.00 H new ATOM 0 HB3 ALA A 74 -0.906 15.479 1.887 1.00 10.00 H new ATOM 957 N GLN A 75 -1.221 14.252 -0.883 1.00 10.00 N ATOM 958 CA GLN A 75 -0.742 14.414 -2.252 1.00 10.00 C ATOM 959 C GLN A 75 -1.733 13.822 -3.249 1.00 10.00 C ATOM 960 O GLN A 75 -2.133 14.482 -4.206 1.00 10.00 O ATOM 961 CB GLN A 75 0.626 13.741 -2.422 1.00 10.00 C ATOM 962 CG GLN A 75 1.142 13.764 -3.854 1.00 10.00 C ATOM 963 CD GLN A 75 1.553 15.152 -4.303 1.00 10.00 C ATOM 964 OE1 GLN A 75 2.073 15.944 -3.517 1.00 10.00 O ATOM 965 NE2 GLN A 75 1.308 15.459 -5.566 1.00 10.00 N ATOM 0 H GLN A 75 -0.671 13.605 -0.317 1.00 10.00 H new ATOM 0 HA GLN A 75 -0.644 15.481 -2.450 1.00 10.00 H new ATOM 0 HB2 GLN A 75 1.349 14.239 -1.776 1.00 10.00 H new ATOM 0 HB3 GLN A 75 0.557 12.706 -2.086 1.00 10.00 H new ATOM 0 HG2 GLN A 75 1.995 13.091 -3.940 1.00 10.00 H new ATOM 0 HG3 GLN A 75 0.368 13.385 -4.521 1.00 10.00 H new ATOM 0 HE21 GLN A 75 0.875 14.772 -6.183 1.00 10.00 H new ATOM 0 HE22 GLN A 75 1.552 16.383 -5.923 1.00 10.00 H new ATOM 974 N LEU A 76 -2.143 12.586 -3.003 1.00 10.00 N ATOM 975 CA LEU A 76 -3.075 11.896 -3.888 1.00 10.00 C ATOM 976 C LEU A 76 -4.519 12.308 -3.618 1.00 10.00 C ATOM 977 O LEU A 76 -5.447 11.752 -4.208 1.00 10.00 O ATOM 978 CB LEU A 76 -2.927 10.381 -3.729 1.00 10.00 C ATOM 979 CG LEU A 76 -1.546 9.819 -4.076 1.00 10.00 C ATOM 980 CD1 LEU A 76 -1.524 8.309 -3.896 1.00 10.00 C ATOM 981 CD2 LEU A 76 -1.154 10.197 -5.498 1.00 10.00 C ATOM 0 H LEU A 76 -1.845 12.038 -2.196 1.00 10.00 H new ATOM 0 HA LEU A 76 -2.832 12.181 -4.912 1.00 10.00 H new ATOM 0 HB2 LEU A 76 -3.160 10.116 -2.698 1.00 10.00 H new ATOM 0 HB3 LEU A 76 -3.669 9.892 -4.360 1.00 10.00 H new ATOM 0 HG LEU A 76 -0.816 10.256 -3.394 1.00 10.00 H new ATOM 0 HD11 LEU A 76 -0.535 7.927 -4.147 1.00 10.00 H new ATOM 0 HD12 LEU A 76 -1.756 8.063 -2.860 1.00 10.00 H new ATOM 0 HD13 LEU A 76 -2.266 7.854 -4.552 1.00 10.00 H new ATOM 0 HD21 LEU A 76 -0.169 9.788 -5.725 1.00 10.00 H new ATOM 0 HD22 LEU A 76 -1.885 9.791 -6.197 1.00 10.00 H new ATOM 0 HD23 LEU A 76 -1.126 11.283 -5.591 1.00 10.00 H new ATOM 993 N GLU A 77 -4.697 13.284 -2.728 1.00 10.00 N ATOM 994 CA GLU A 77 -6.020 13.790 -2.369 1.00 10.00 C ATOM 995 C GLU A 77 -6.915 12.665 -1.859 1.00 10.00 C ATOM 996 O GLU A 77 -8.085 12.570 -2.223 1.00 10.00 O ATOM 997 CB GLU A 77 -6.675 14.482 -3.567 1.00 10.00 C ATOM 998 CG GLU A 77 -5.887 15.669 -4.092 1.00 10.00 C ATOM 999 CD GLU A 77 -6.737 16.912 -4.222 1.00 10.00 C ATOM 1000 OE1 GLU A 77 -6.544 17.854 -3.428 1.00 10.00 O ATOM 1001 OE2 GLU A 77 -7.612 16.947 -5.111 1.00 10.00 O ATOM 0 H GLU A 77 -3.930 13.744 -2.237 1.00 10.00 H new ATOM 0 HA GLU A 77 -5.894 14.519 -1.568 1.00 10.00 H new ATOM 0 HB2 GLU A 77 -6.800 13.756 -4.371 1.00 10.00 H new ATOM 0 HB3 GLU A 77 -7.672 14.817 -3.281 1.00 10.00 H new ATOM 0 HG2 GLU A 77 -5.051 15.872 -3.422 1.00 10.00 H new ATOM 0 HG3 GLU A 77 -5.463 15.419 -5.064 1.00 10.00 H new ATOM 1008 N MET A 78 -6.348 11.814 -1.021 1.00 10.00 N ATOM 1009 CA MET A 78 -7.080 10.690 -0.457 1.00 10.00 C ATOM 1010 C MET A 78 -7.940 11.171 0.696 1.00 10.00 C ATOM 1011 O MET A 78 -7.446 11.844 1.602 1.00 10.00 O ATOM 1012 CB MET A 78 -6.115 9.609 0.036 1.00 10.00 C ATOM 1013 CG MET A 78 -5.027 9.269 -0.964 1.00 10.00 C ATOM 1014 SD MET A 78 -3.780 8.150 -0.295 1.00 10.00 S ATOM 1015 CE MET A 78 -4.717 6.630 -0.180 1.00 10.00 C ATOM 0 H MET A 78 -5.378 11.880 -0.714 1.00 10.00 H new ATOM 0 HA MET A 78 -7.713 10.261 -1.234 1.00 10.00 H new ATOM 0 HB2 MET A 78 -5.653 9.942 0.965 1.00 10.00 H new ATOM 0 HB3 MET A 78 -6.680 8.706 0.267 1.00 10.00 H new ATOM 0 HG2 MET A 78 -5.480 8.814 -1.845 1.00 10.00 H new ATOM 0 HG3 MET A 78 -4.543 10.189 -1.293 1.00 10.00 H new ATOM 0 HE1 MET A 78 -4.880 6.382 0.869 1.00 10.00 H new ATOM 0 HE2 MET A 78 -5.679 6.757 -0.677 1.00 10.00 H new ATOM 0 HE3 MET A 78 -4.164 5.824 -0.662 1.00 10.00 H new ATOM 1025 N GLU A 79 -9.219 10.839 0.661 1.00 10.00 N ATOM 1026 CA GLU A 79 -10.127 11.251 1.713 1.00 10.00 C ATOM 1027 C GLU A 79 -10.498 10.077 2.611 1.00 10.00 C ATOM 1028 O GLU A 79 -10.032 8.953 2.410 1.00 10.00 O ATOM 1029 CB GLU A 79 -11.382 11.892 1.122 1.00 10.00 C ATOM 1030 CG GLU A 79 -11.133 13.278 0.546 1.00 10.00 C ATOM 1031 CD GLU A 79 -10.279 14.141 1.454 1.00 10.00 C ATOM 1032 OE1 GLU A 79 -9.390 14.855 0.947 1.00 10.00 O ATOM 1033 OE2 GLU A 79 -10.488 14.110 2.688 1.00 10.00 O ATOM 0 H GLU A 79 -9.649 10.288 -0.082 1.00 10.00 H new ATOM 0 HA GLU A 79 -9.615 11.994 2.325 1.00 10.00 H new ATOM 0 HB2 GLU A 79 -11.778 11.246 0.338 1.00 10.00 H new ATOM 0 HB3 GLU A 79 -12.147 11.959 1.896 1.00 10.00 H new ATOM 0 HG2 GLU A 79 -10.644 13.182 -0.424 1.00 10.00 H new ATOM 0 HG3 GLU A 79 -12.089 13.773 0.374 1.00 10.00 H new ATOM 1040 N ASP A 80 -11.339 10.351 3.597 1.00 10.00 N ATOM 1041 CA ASP A 80 -11.770 9.341 4.556 1.00 10.00 C ATOM 1042 C ASP A 80 -12.616 8.261 3.890 1.00 10.00 C ATOM 1043 O ASP A 80 -13.428 8.551 3.005 1.00 10.00 O ATOM 1044 CB ASP A 80 -12.564 10.006 5.681 1.00 10.00 C ATOM 1045 CG ASP A 80 -12.521 9.219 6.972 1.00 10.00 C ATOM 1046 OD1 ASP A 80 -13.593 8.807 7.463 1.00 10.00 O ATOM 1047 OD2 ASP A 80 -11.412 9.029 7.519 1.00 10.00 O ATOM 0 H ASP A 80 -11.741 11.275 3.756 1.00 10.00 H new ATOM 0 HA ASP A 80 -10.881 8.862 4.966 1.00 10.00 H new ATOM 0 HB2 ASP A 80 -12.168 11.006 5.857 1.00 10.00 H new ATOM 0 HB3 ASP A 80 -13.601 10.124 5.367 1.00 10.00 H new ATOM 1052 N GLU A 81 -12.387 7.015 4.310 1.00 10.00 N ATOM 1053 CA GLU A 81 -13.116 5.845 3.806 1.00 10.00 C ATOM 1054 C GLU A 81 -12.734 5.489 2.370 1.00 10.00 C ATOM 1055 O GLU A 81 -13.439 4.716 1.715 1.00 10.00 O ATOM 1056 CB GLU A 81 -14.632 6.048 3.901 1.00 10.00 C ATOM 1057 CG GLU A 81 -15.193 5.865 5.300 1.00 10.00 C ATOM 1058 CD GLU A 81 -16.510 5.117 5.296 1.00 10.00 C ATOM 1059 OE1 GLU A 81 -17.550 5.731 4.978 1.00 10.00 O ATOM 1060 OE2 GLU A 81 -16.509 3.905 5.592 1.00 10.00 O ATOM 0 H GLU A 81 -11.686 6.786 5.014 1.00 10.00 H new ATOM 0 HA GLU A 81 -12.826 5.011 4.446 1.00 10.00 H new ATOM 0 HB2 GLU A 81 -14.877 7.051 3.551 1.00 10.00 H new ATOM 0 HB3 GLU A 81 -15.125 5.346 3.228 1.00 10.00 H new ATOM 0 HG2 GLU A 81 -14.471 5.323 5.911 1.00 10.00 H new ATOM 0 HG3 GLU A 81 -15.333 6.841 5.764 1.00 10.00 H new ATOM 1067 N ASP A 82 -11.623 6.029 1.879 1.00 10.00 N ATOM 1068 CA ASP A 82 -11.188 5.728 0.517 1.00 10.00 C ATOM 1069 C ASP A 82 -10.691 4.287 0.427 1.00 10.00 C ATOM 1070 O ASP A 82 -10.456 3.642 1.450 1.00 10.00 O ATOM 1071 CB ASP A 82 -10.099 6.691 0.052 1.00 10.00 C ATOM 1072 CG ASP A 82 -10.225 7.016 -1.423 1.00 10.00 C ATOM 1073 OD1 ASP A 82 -10.153 6.084 -2.254 1.00 10.00 O ATOM 1074 OD2 ASP A 82 -10.404 8.205 -1.759 1.00 10.00 O ATOM 0 H ASP A 82 -11.015 6.667 2.393 1.00 10.00 H new ATOM 0 HA ASP A 82 -12.047 5.852 -0.142 1.00 10.00 H new ATOM 0 HB2 ASP A 82 -10.156 7.612 0.633 1.00 10.00 H new ATOM 0 HB3 ASP A 82 -9.120 6.253 0.245 1.00 10.00 H new ATOM 1079 N THR A 83 -10.509 3.793 -0.787 1.00 10.00 N ATOM 1080 CA THR A 83 -10.079 2.416 -0.984 1.00 10.00 C ATOM 1081 C THR A 83 -8.706 2.318 -1.641 1.00 10.00 C ATOM 1082 O THR A 83 -8.376 3.082 -2.547 1.00 10.00 O ATOM 1083 CB THR A 83 -11.094 1.647 -1.851 1.00 10.00 C ATOM 1084 OG1 THR A 83 -12.395 2.234 -1.713 1.00 10.00 O ATOM 1085 CG2 THR A 83 -11.148 0.179 -1.456 1.00 10.00 C ATOM 0 H THR A 83 -10.651 4.321 -1.648 1.00 10.00 H new ATOM 0 HA THR A 83 -10.016 1.973 0.010 1.00 10.00 H new ATOM 0 HB THR A 83 -10.773 1.711 -2.891 1.00 10.00 H new ATOM 0 HG1 THR A 83 -13.036 1.742 -2.268 1.00 10.00 H new ATOM 0 HG21 THR A 83 -11.872 -0.340 -2.084 1.00 10.00 H new ATOM 0 HG22 THR A 83 -10.164 -0.270 -1.590 1.00 10.00 H new ATOM 0 HG23 THR A 83 -11.447 0.094 -0.411 1.00 10.00 H new ATOM 1093 N ILE A 84 -7.909 1.378 -1.156 1.00 10.00 N ATOM 1094 CA ILE A 84 -6.584 1.129 -1.696 1.00 10.00 C ATOM 1095 C ILE A 84 -6.509 -0.319 -2.168 1.00 10.00 C ATOM 1096 O ILE A 84 -6.627 -1.246 -1.364 1.00 10.00 O ATOM 1097 CB ILE A 84 -5.480 1.395 -0.650 1.00 10.00 C ATOM 1098 CG1 ILE A 84 -5.636 2.796 -0.051 1.00 10.00 C ATOM 1099 CG2 ILE A 84 -4.107 1.234 -1.282 1.00 10.00 C ATOM 1100 CD1 ILE A 84 -4.688 3.085 1.092 1.00 10.00 C ATOM 0 H ILE A 84 -8.163 0.768 -0.379 1.00 10.00 H new ATOM 0 HA ILE A 84 -6.417 1.812 -2.529 1.00 10.00 H new ATOM 0 HB ILE A 84 -5.579 0.666 0.154 1.00 10.00 H new ATOM 0 HG12 ILE A 84 -5.478 3.535 -0.836 1.00 10.00 H new ATOM 0 HG13 ILE A 84 -6.661 2.918 0.300 1.00 10.00 H new ATOM 0 HG21 ILE A 84 -3.337 1.424 -0.534 1.00 10.00 H new ATOM 0 HG22 ILE A 84 -3.999 0.219 -1.664 1.00 10.00 H new ATOM 0 HG23 ILE A 84 -3.999 1.943 -2.102 1.00 10.00 H new ATOM 0 HD11 ILE A 84 -4.861 4.096 1.461 1.00 10.00 H new ATOM 0 HD12 ILE A 84 -4.860 2.370 1.897 1.00 10.00 H new ATOM 0 HD13 ILE A 84 -3.659 2.997 0.742 1.00 10.00 H new ATOM 1112 N ASP A 85 -6.330 -0.507 -3.469 1.00 10.00 N ATOM 1113 CA ASP A 85 -6.277 -1.844 -4.051 1.00 10.00 C ATOM 1114 C ASP A 85 -4.874 -2.428 -3.979 1.00 10.00 C ATOM 1115 O ASP A 85 -3.882 -1.732 -4.221 1.00 10.00 O ATOM 1116 CB ASP A 85 -6.740 -1.809 -5.507 1.00 10.00 C ATOM 1117 CG ASP A 85 -7.982 -2.646 -5.749 1.00 10.00 C ATOM 1118 OD1 ASP A 85 -8.046 -3.790 -5.248 1.00 10.00 O ATOM 1119 OD2 ASP A 85 -8.899 -2.161 -6.446 1.00 10.00 O ATOM 0 H ASP A 85 -6.219 0.250 -4.143 1.00 10.00 H new ATOM 0 HA ASP A 85 -6.945 -2.480 -3.471 1.00 10.00 H new ATOM 0 HB2 ASP A 85 -6.941 -0.777 -5.795 1.00 10.00 H new ATOM 0 HB3 ASP A 85 -5.935 -2.168 -6.148 1.00 10.00 H new ATOM 1124 N VAL A 86 -4.796 -3.708 -3.646 1.00 10.00 N ATOM 1125 CA VAL A 86 -3.522 -4.405 -3.551 1.00 10.00 C ATOM 1126 C VAL A 86 -3.499 -5.585 -4.513 1.00 10.00 C ATOM 1127 O VAL A 86 -4.339 -6.482 -4.426 1.00 10.00 O ATOM 1128 CB VAL A 86 -3.250 -4.921 -2.120 1.00 10.00 C ATOM 1129 CG1 VAL A 86 -1.801 -5.363 -1.977 1.00 10.00 C ATOM 1130 CG2 VAL A 86 -3.594 -3.859 -1.085 1.00 10.00 C ATOM 0 H VAL A 86 -5.607 -4.289 -3.435 1.00 10.00 H new ATOM 0 HA VAL A 86 -2.743 -3.688 -3.812 1.00 10.00 H new ATOM 0 HB VAL A 86 -3.891 -5.784 -1.943 1.00 10.00 H new ATOM 0 HG11 VAL A 86 -1.629 -5.723 -0.963 1.00 10.00 H new ATOM 0 HG12 VAL A 86 -1.593 -6.164 -2.687 1.00 10.00 H new ATOM 0 HG13 VAL A 86 -1.142 -4.519 -2.179 1.00 10.00 H new ATOM 0 HG21 VAL A 86 -3.394 -4.246 -0.086 1.00 10.00 H new ATOM 0 HG22 VAL A 86 -2.986 -2.971 -1.259 1.00 10.00 H new ATOM 0 HG23 VAL A 86 -4.649 -3.598 -1.168 1.00 10.00 H new ATOM 1140 N PHE A 87 -2.552 -5.574 -5.436 1.00 10.00 N ATOM 1141 CA PHE A 87 -2.417 -6.641 -6.418 1.00 10.00 C ATOM 1142 C PHE A 87 -1.066 -7.328 -6.271 1.00 10.00 C ATOM 1143 O PHE A 87 -0.250 -6.933 -5.436 1.00 10.00 O ATOM 1144 CB PHE A 87 -2.557 -6.083 -7.839 1.00 10.00 C ATOM 1145 CG PHE A 87 -3.932 -5.576 -8.163 1.00 10.00 C ATOM 1146 CD1 PHE A 87 -4.928 -6.450 -8.568 1.00 10.00 C ATOM 1147 CD2 PHE A 87 -4.224 -4.223 -8.075 1.00 10.00 C ATOM 1148 CE1 PHE A 87 -6.191 -5.984 -8.880 1.00 10.00 C ATOM 1149 CE2 PHE A 87 -5.484 -3.754 -8.383 1.00 10.00 C ATOM 1150 CZ PHE A 87 -6.470 -4.634 -8.787 1.00 10.00 C ATOM 0 H PHE A 87 -1.859 -4.831 -5.527 1.00 10.00 H new ATOM 0 HA PHE A 87 -3.209 -7.368 -6.242 1.00 10.00 H new ATOM 0 HB2 PHE A 87 -1.841 -5.272 -7.972 1.00 10.00 H new ATOM 0 HB3 PHE A 87 -2.291 -6.863 -8.552 1.00 10.00 H new ATOM 0 HD1 PHE A 87 -4.715 -7.506 -8.641 1.00 10.00 H new ATOM 0 HD2 PHE A 87 -3.457 -3.530 -7.762 1.00 10.00 H new ATOM 0 HE1 PHE A 87 -6.959 -6.674 -9.196 1.00 10.00 H new ATOM 0 HE2 PHE A 87 -5.700 -2.698 -8.308 1.00 10.00 H new ATOM 0 HZ PHE A 87 -7.456 -4.267 -9.029 1.00 10.00 H new ATOM 1160 N GLN A 88 -0.830 -8.349 -7.084 1.00 10.00 N ATOM 1161 CA GLN A 88 0.429 -9.080 -7.053 1.00 10.00 C ATOM 1162 C GLN A 88 1.075 -9.055 -8.430 1.00 10.00 C ATOM 1163 O GLN A 88 0.396 -8.841 -9.436 1.00 10.00 O ATOM 1164 CB GLN A 88 0.218 -10.530 -6.613 1.00 10.00 C ATOM 1165 CG GLN A 88 -0.195 -10.684 -5.157 1.00 10.00 C ATOM 1166 CD GLN A 88 0.608 -11.749 -4.432 1.00 10.00 C ATOM 1167 OE1 GLN A 88 1.804 -11.919 -4.672 1.00 10.00 O ATOM 1168 NE2 GLN A 88 -0.051 -12.493 -3.557 1.00 10.00 N ATOM 0 H GLN A 88 -1.497 -8.691 -7.776 1.00 10.00 H new ATOM 0 HA GLN A 88 1.083 -8.594 -6.329 1.00 10.00 H new ATOM 0 HB2 GLN A 88 -0.545 -10.983 -7.246 1.00 10.00 H new ATOM 0 HB3 GLN A 88 1.141 -11.086 -6.779 1.00 10.00 H new ATOM 0 HG2 GLN A 88 -0.071 -9.730 -4.645 1.00 10.00 H new ATOM 0 HG3 GLN A 88 -1.254 -10.937 -5.108 1.00 10.00 H new ATOM 0 HE21 GLN A 88 -1.042 -12.321 -3.385 1.00 10.00 H new ATOM 0 HE22 GLN A 88 0.432 -13.238 -3.055 1.00 10.00 H new ATOM 1177 N GLN A 89 2.380 -9.261 -8.472 1.00 10.00 N ATOM 1178 CA GLN A 89 3.099 -9.267 -9.733 1.00 10.00 C ATOM 1179 C GLN A 89 3.101 -10.674 -10.322 1.00 10.00 C ATOM 1180 O GLN A 89 3.206 -11.662 -9.591 1.00 10.00 O ATOM 1181 CB GLN A 89 4.532 -8.771 -9.527 1.00 10.00 C ATOM 1182 CG GLN A 89 5.324 -8.633 -10.819 1.00 10.00 C ATOM 1183 CD GLN A 89 4.670 -7.693 -11.814 1.00 10.00 C ATOM 1184 OE1 GLN A 89 4.032 -6.710 -11.438 1.00 10.00 O ATOM 1185 NE2 GLN A 89 4.827 -7.991 -13.094 1.00 10.00 N ATOM 0 H GLN A 89 2.961 -9.426 -7.650 1.00 10.00 H new ATOM 0 HA GLN A 89 2.599 -8.595 -10.431 1.00 10.00 H new ATOM 0 HB2 GLN A 89 4.504 -7.805 -9.024 1.00 10.00 H new ATOM 0 HB3 GLN A 89 5.054 -9.461 -8.863 1.00 10.00 H new ATOM 0 HG2 GLN A 89 6.326 -8.270 -10.588 1.00 10.00 H new ATOM 0 HG3 GLN A 89 5.438 -9.616 -11.276 1.00 10.00 H new ATOM 0 HE21 GLN A 89 5.364 -8.815 -13.364 1.00 10.00 H new ATOM 0 HE22 GLN A 89 4.411 -7.396 -13.811 1.00 10.00 H new ATOM 1194 N GLN A 90 2.957 -10.756 -11.641 1.00 10.00 N ATOM 1195 CA GLN A 90 2.944 -12.034 -12.342 1.00 10.00 C ATOM 1196 C GLN A 90 4.242 -12.798 -12.101 1.00 10.00 C ATOM 1197 O GLN A 90 5.335 -12.229 -12.180 1.00 10.00 O ATOM 1198 CB GLN A 90 2.735 -11.820 -13.845 1.00 10.00 C ATOM 1199 CG GLN A 90 1.291 -11.542 -14.237 1.00 10.00 C ATOM 1200 CD GLN A 90 0.793 -10.196 -13.746 1.00 10.00 C ATOM 1201 OE1 GLN A 90 1.554 -9.233 -13.649 1.00 10.00 O ATOM 1202 NE2 GLN A 90 -0.486 -10.128 -13.423 1.00 10.00 N ATOM 0 H GLN A 90 2.847 -9.945 -12.250 1.00 10.00 H new ATOM 0 HA GLN A 90 2.116 -12.624 -11.951 1.00 10.00 H new ATOM 0 HB2 GLN A 90 3.356 -10.986 -14.172 1.00 10.00 H new ATOM 0 HB3 GLN A 90 3.082 -12.705 -14.379 1.00 10.00 H new ATOM 0 HG2 GLN A 90 1.201 -11.583 -15.322 1.00 10.00 H new ATOM 0 HG3 GLN A 90 0.653 -12.328 -13.834 1.00 10.00 H new ATOM 0 HE21 GLN A 90 -1.081 -10.951 -13.519 1.00 10.00 H new ATOM 0 HE22 GLN A 90 -0.879 -9.252 -13.077 1.00 10.00 H new ATOM 1211 N THR A 91 4.116 -14.080 -11.806 1.00 10.00 N ATOM 1212 CA THR A 91 5.272 -14.922 -11.546 1.00 10.00 C ATOM 1213 C THR A 91 5.879 -15.448 -12.846 1.00 10.00 C ATOM 1214 O THR A 91 5.915 -16.656 -13.087 1.00 10.00 O ATOM 1215 CB THR A 91 4.889 -16.101 -10.636 1.00 10.00 C ATOM 1216 OG1 THR A 91 3.493 -16.027 -10.309 1.00 10.00 O ATOM 1217 CG2 THR A 91 5.715 -16.087 -9.359 1.00 10.00 C ATOM 0 H THR A 91 3.220 -14.563 -11.740 1.00 10.00 H new ATOM 0 HA THR A 91 6.018 -14.309 -11.041 1.00 10.00 H new ATOM 0 HB THR A 91 5.091 -17.030 -11.170 1.00 10.00 H new ATOM 0 HG1 THR A 91 3.252 -16.781 -9.731 1.00 10.00 H new ATOM 0 HG21 THR A 91 5.427 -16.930 -8.730 1.00 10.00 H new ATOM 0 HG22 THR A 91 6.773 -16.165 -9.609 1.00 10.00 H new ATOM 0 HG23 THR A 91 5.537 -15.156 -8.821 1.00 10.00 H new ATOM 1225 N GLY A 92 6.347 -14.533 -13.681 1.00 10.00 N ATOM 1226 CA GLY A 92 6.949 -14.916 -14.939 1.00 10.00 C ATOM 1227 C GLY A 92 5.927 -15.016 -16.048 1.00 10.00 C ATOM 1228 O GLY A 92 4.920 -14.279 -15.999 1.00 10.00 O ATOM 0 H GLY A 92 6.320 -13.528 -13.508 1.00 10.00 H new ATOM 0 HA2 GLY A 92 7.711 -14.187 -15.213 1.00 10.00 H new ATOM 0 HA3 GLY A 92 7.453 -15.875 -14.823 1.00 10.00 H new TER 1232 GLY A 92 ATOM 1233 N ASN B 357 -15.668 -11.149 7.597 1.00 10.00 N ATOM 1234 CA ASN B 357 -14.940 -9.908 7.260 1.00 10.00 C ATOM 1235 C ASN B 357 -13.792 -9.701 8.222 1.00 10.00 C ATOM 1236 O ASN B 357 -13.911 -10.020 9.403 1.00 10.00 O ATOM 1237 CB ASN B 357 -15.879 -8.703 7.356 1.00 10.00 C ATOM 1238 CG ASN B 357 -15.583 -7.648 6.310 1.00 10.00 C ATOM 1239 OD1 ASN B 357 -14.439 -7.479 5.889 1.00 10.00 O ATOM 1240 ND2 ASN B 357 -16.609 -6.924 5.889 1.00 10.00 N ATOM 0 HA ASN B 357 -14.559 -10.001 6.243 1.00 10.00 H new ATOM 0 HB2 ASN B 357 -16.909 -9.040 7.245 1.00 10.00 H new ATOM 0 HB3 ASN B 357 -15.794 -8.259 8.348 1.00 10.00 H new ATOM 0 HD21 ASN B 357 -16.466 -6.195 5.190 1.00 10.00 H new ATOM 0 HD22 ASN B 357 -17.542 -7.096 6.263 1.00 10.00 H new ATOM 1247 N ASN B 358 -12.666 -9.203 7.735 1.00 10.00 N ATOM 1248 CA ASN B 358 -11.549 -8.937 8.623 1.00 10.00 C ATOM 1249 C ASN B 358 -11.194 -7.471 8.574 1.00 10.00 C ATOM 1250 O ASN B 358 -10.877 -6.946 7.512 1.00 10.00 O ATOM 1251 CB ASN B 358 -10.326 -9.775 8.226 1.00 10.00 C ATOM 1252 CG ASN B 358 -10.466 -11.237 8.598 1.00 10.00 C ATOM 1253 OD1 ASN B 358 -10.411 -12.117 7.743 1.00 10.00 O ATOM 1254 ND2 ASN B 358 -10.636 -11.501 9.881 1.00 10.00 N ATOM 0 H ASN B 358 -12.504 -8.980 6.753 1.00 10.00 H new ATOM 0 HA ASN B 358 -11.844 -9.209 9.637 1.00 10.00 H new ATOM 0 HB2 ASN B 358 -10.169 -9.693 7.150 1.00 10.00 H new ATOM 0 HB3 ASN B 358 -9.439 -9.366 8.710 1.00 10.00 H new ATOM 0 HD21 ASN B 358 -10.727 -12.467 10.195 1.00 10.00 H new ATOM 0 HD22 ASN B 358 -10.676 -10.739 10.558 1.00 10.00 H new ATOM 1261 N ARG B 359 -11.281 -6.808 9.717 1.00 10.00 N ATOM 1262 CA ARG B 359 -10.928 -5.403 9.796 1.00 10.00 C ATOM 1263 C ARG B 359 -9.958 -5.153 10.942 1.00 10.00 C ATOM 1264 O ARG B 359 -10.232 -5.499 12.093 1.00 10.00 O ATOM 1265 CB ARG B 359 -12.180 -4.524 9.945 1.00 10.00 C ATOM 1266 CG ARG B 359 -13.143 -5.009 11.012 1.00 10.00 C ATOM 1267 CD ARG B 359 -14.284 -4.029 11.246 1.00 10.00 C ATOM 1268 NE ARG B 359 -15.173 -4.486 12.312 1.00 10.00 N ATOM 1269 CZ ARG B 359 -16.502 -4.570 12.219 1.00 10.00 C ATOM 1270 NH1 ARG B 359 -17.135 -4.188 11.112 1.00 10.00 N ATOM 1271 NH2 ARG B 359 -17.198 -5.030 13.252 1.00 10.00 N ATOM 0 H ARG B 359 -11.592 -7.219 10.597 1.00 10.00 H new ATOM 0 HA ARG B 359 -10.435 -5.131 8.863 1.00 10.00 H new ATOM 0 HB2 ARG B 359 -11.872 -3.506 10.182 1.00 10.00 H new ATOM 0 HB3 ARG B 359 -12.701 -4.485 8.989 1.00 10.00 H new ATOM 0 HG2 ARG B 359 -13.551 -5.976 10.718 1.00 10.00 H new ATOM 0 HG3 ARG B 359 -12.601 -5.162 11.945 1.00 10.00 H new ATOM 0 HD2 ARG B 359 -13.878 -3.051 11.504 1.00 10.00 H new ATOM 0 HD3 ARG B 359 -14.853 -3.905 10.325 1.00 10.00 H new ATOM 0 HE ARG B 359 -14.745 -4.762 13.196 1.00 10.00 H new ATOM 0 HH11 ARG B 359 -16.604 -3.825 10.320 1.00 10.00 H new ATOM 0 HH12 ARG B 359 -18.151 -4.258 11.056 1.00 10.00 H new ATOM 0 HH21 ARG B 359 -16.717 -5.315 14.105 1.00 10.00 H new ATOM 0 HH22 ARG B 359 -18.214 -5.099 13.192 1.00 10.00 H new ATOM 1285 N ASP B 360 -8.825 -4.584 10.618 1.00 10.00 N ATOM 1286 CA ASP B 360 -7.835 -4.227 11.622 1.00 10.00 C ATOM 1287 C ASP B 360 -7.446 -2.770 11.448 1.00 10.00 C ATOM 1288 O ASP B 360 -7.203 -2.345 10.321 1.00 10.00 O ATOM 1289 CB ASP B 360 -6.595 -5.120 11.581 1.00 10.00 C ATOM 1290 CG ASP B 360 -5.744 -4.936 12.825 1.00 10.00 C ATOM 1291 OD1 ASP B 360 -4.632 -4.391 12.718 1.00 10.00 O ATOM 1292 OD2 ASP B 360 -6.201 -5.311 13.928 1.00 10.00 O ATOM 0 H ASP B 360 -8.557 -4.353 9.661 1.00 10.00 H new ATOM 0 HA ASP B 360 -8.290 -4.380 12.601 1.00 10.00 H new ATOM 0 HB2 ASP B 360 -6.898 -6.164 11.496 1.00 10.00 H new ATOM 0 HB3 ASP B 360 -6.004 -4.886 10.695 1.00 10.00 H new ATOM 1297 N PRO B 361 -7.361 -1.972 12.516 1.00 10.00 N ATOM 1298 CA PRO B 361 -6.984 -0.586 12.377 1.00 10.00 C ATOM 1299 C PRO B 361 -5.560 -0.367 12.858 1.00 10.00 C ATOM 1300 O PRO B 361 -5.186 -0.706 13.983 1.00 10.00 O ATOM 1301 CB PRO B 361 -7.976 0.098 13.322 1.00 10.00 C ATOM 1302 CG PRO B 361 -8.292 -0.930 14.378 1.00 10.00 C ATOM 1303 CD PRO B 361 -7.757 -2.267 13.893 1.00 10.00 C ATOM 0 HA PRO B 361 -7.012 -0.218 11.351 1.00 10.00 H new ATOM 0 HB2 PRO B 361 -7.543 0.996 13.764 1.00 10.00 H new ATOM 0 HB3 PRO B 361 -8.877 0.406 12.791 1.00 10.00 H new ATOM 0 HG2 PRO B 361 -7.833 -0.656 15.328 1.00 10.00 H new ATOM 0 HG3 PRO B 361 -9.367 -0.987 14.548 1.00 10.00 H new ATOM 0 HD2 PRO B 361 -6.913 -2.608 14.493 1.00 10.00 H new ATOM 0 HD3 PRO B 361 -8.516 -3.048 13.938 1.00 10.00 H new ATOM 1311 N ILE B 362 -4.768 0.213 11.976 1.00 10.00 N ATOM 1312 CA ILE B 362 -3.366 0.455 12.243 1.00 10.00 C ATOM 1313 C ILE B 362 -3.070 1.936 12.195 1.00 10.00 C ATOM 1314 O ILE B 362 -3.491 2.626 11.274 1.00 10.00 O ATOM 1315 CB ILE B 362 -2.459 -0.254 11.211 1.00 10.00 C ATOM 1316 CG1 ILE B 362 -3.054 -1.610 10.811 1.00 10.00 C ATOM 1317 CG2 ILE B 362 -1.042 -0.427 11.757 1.00 10.00 C ATOM 1318 CD1 ILE B 362 -2.646 -2.061 9.424 1.00 10.00 C ATOM 0 H ILE B 362 -5.079 0.528 11.057 1.00 10.00 H new ATOM 0 HA ILE B 362 -3.157 0.057 13.236 1.00 10.00 H new ATOM 0 HB ILE B 362 -2.404 0.373 10.321 1.00 10.00 H new ATOM 0 HG12 ILE B 362 -2.743 -2.363 11.536 1.00 10.00 H new ATOM 0 HG13 ILE B 362 -4.141 -1.550 10.860 1.00 10.00 H new ATOM 0 HG21 ILE B 362 -0.424 -0.928 11.012 1.00 10.00 H new ATOM 0 HG22 ILE B 362 -0.617 0.551 11.983 1.00 10.00 H new ATOM 0 HG23 ILE B 362 -1.073 -1.027 12.666 1.00 10.00 H new ATOM 0 HD11 ILE B 362 -3.102 -3.027 9.207 1.00 10.00 H new ATOM 0 HD12 ILE B 362 -2.981 -1.328 8.690 1.00 10.00 H new ATOM 0 HD13 ILE B 362 -1.561 -2.153 9.376 1.00 10.00 H new ATOM 1330 N VAL B 363 -2.359 2.421 13.192 1.00 10.00 N ATOM 1331 CA VAL B 363 -2.004 3.822 13.237 1.00 10.00 C ATOM 1332 C VAL B 363 -0.495 3.943 13.164 1.00 10.00 C ATOM 1333 O VAL B 363 0.225 3.364 13.979 1.00 10.00 O ATOM 1334 CB VAL B 363 -2.496 4.484 14.542 1.00 10.00 C ATOM 1335 CG1 VAL B 363 -2.146 5.964 14.564 1.00 10.00 C ATOM 1336 CG2 VAL B 363 -3.991 4.279 14.725 1.00 10.00 C ATOM 0 H VAL B 363 -2.018 1.868 13.978 1.00 10.00 H new ATOM 0 HA VAL B 363 -2.478 4.328 12.396 1.00 10.00 H new ATOM 0 HB VAL B 363 -1.985 4.003 15.376 1.00 10.00 H new ATOM 0 HG11 VAL B 363 -2.503 6.408 15.493 1.00 10.00 H new ATOM 0 HG12 VAL B 363 -1.065 6.083 14.497 1.00 10.00 H new ATOM 0 HG13 VAL B 363 -2.619 6.462 13.718 1.00 10.00 H new ATOM 0 HG21 VAL B 363 -4.313 4.755 15.651 1.00 10.00 H new ATOM 0 HG22 VAL B 363 -4.525 4.723 13.885 1.00 10.00 H new ATOM 0 HG23 VAL B 363 -4.209 3.212 14.770 1.00 10.00 H new ATOM 1346 N ILE B 364 -0.025 4.699 12.193 1.00 10.00 N ATOM 1347 CA ILE B 364 1.397 4.910 12.003 1.00 10.00 C ATOM 1348 C ILE B 364 1.714 6.396 12.066 1.00 10.00 C ATOM 1349 O ILE B 364 1.043 7.213 11.439 1.00 10.00 O ATOM 1350 CB ILE B 364 1.906 4.305 10.663 1.00 10.00 C ATOM 1351 CG1 ILE B 364 1.886 2.771 10.728 1.00 10.00 C ATOM 1352 CG2 ILE B 364 3.306 4.803 10.325 1.00 10.00 C ATOM 1353 CD1 ILE B 364 2.523 2.091 9.527 1.00 10.00 C ATOM 0 H ILE B 364 -0.614 5.183 11.516 1.00 10.00 H new ATOM 0 HA ILE B 364 1.918 4.392 12.809 1.00 10.00 H new ATOM 0 HB ILE B 364 1.234 4.634 9.871 1.00 10.00 H new ATOM 0 HG12 ILE B 364 2.404 2.449 11.631 1.00 10.00 H new ATOM 0 HG13 ILE B 364 0.853 2.435 10.817 1.00 10.00 H new ATOM 0 HG21 ILE B 364 3.632 4.361 9.383 1.00 10.00 H new ATOM 0 HG22 ILE B 364 3.293 5.889 10.231 1.00 10.00 H new ATOM 0 HG23 ILE B 364 3.996 4.515 11.118 1.00 10.00 H new ATOM 0 HD11 ILE B 364 2.468 1.009 9.650 1.00 10.00 H new ATOM 0 HD12 ILE B 364 1.991 2.380 8.621 1.00 10.00 H new ATOM 0 HD13 ILE B 364 3.567 2.395 9.448 1.00 10.00 H new ATOM 1365 N SER B 365 2.718 6.729 12.845 1.00 10.00 N ATOM 1366 CA SER B 365 3.148 8.102 13.000 1.00 10.00 C ATOM 1367 C SER B 365 4.572 8.223 12.481 1.00 10.00 C ATOM 1368 O SER B 365 5.428 7.398 12.803 1.00 10.00 O ATOM 1369 CB SER B 365 3.056 8.525 14.468 1.00 10.00 C ATOM 1370 OG SER B 365 1.738 8.349 14.966 1.00 10.00 O ATOM 0 H SER B 365 3.260 6.057 13.389 1.00 10.00 H new ATOM 0 HA SER B 365 2.499 8.766 12.428 1.00 10.00 H new ATOM 0 HB2 SER B 365 3.755 7.938 15.064 1.00 10.00 H new ATOM 0 HB3 SER B 365 3.350 9.570 14.568 1.00 10.00 H new ATOM 0 HG SER B 365 1.704 8.624 15.906 1.00 10.00 H new ATOM 1376 N ASP B 366 4.827 9.245 11.682 1.00 10.00 N ATOM 1377 CA ASP B 366 6.152 9.429 11.096 1.00 10.00 C ATOM 1378 C ASP B 366 6.764 10.700 11.639 1.00 10.00 C ATOM 1379 O ASP B 366 6.108 11.740 11.690 1.00 10.00 O ATOM 1380 CB ASP B 366 6.071 9.491 9.565 1.00 10.00 C ATOM 1381 CG ASP B 366 7.370 9.092 8.890 1.00 10.00 C ATOM 1382 OD1 ASP B 366 7.464 9.213 7.656 1.00 10.00 O ATOM 1383 OD2 ASP B 366 8.295 8.626 9.587 1.00 10.00 O ATOM 0 H ASP B 366 4.144 9.957 11.423 1.00 10.00 H new ATOM 0 HA ASP B 366 6.778 8.578 11.364 1.00 10.00 H new ATOM 0 HB2 ASP B 366 5.272 8.834 9.221 1.00 10.00 H new ATOM 0 HB3 ASP B 366 5.805 10.503 9.261 1.00 10.00 H new ATOM 1388 N SER B 367 7.996 10.588 12.104 1.00 10.00 N ATOM 1389 CA SER B 367 8.710 11.707 12.683 1.00 10.00 C ATOM 1390 C SER B 367 9.742 12.293 11.719 1.00 10.00 C ATOM 1391 O SER B 367 10.874 11.805 11.641 1.00 10.00 O ATOM 1392 CB SER B 367 9.409 11.242 13.956 1.00 10.00 C ATOM 1393 OG SER B 367 8.765 10.102 14.502 1.00 10.00 O ATOM 0 H SER B 367 8.528 9.718 12.090 1.00 10.00 H new ATOM 0 HA SER B 367 7.986 12.492 12.904 1.00 10.00 H new ATOM 0 HB2 SER B 367 10.451 11.006 13.738 1.00 10.00 H new ATOM 0 HB3 SER B 367 9.412 12.049 14.689 1.00 10.00 H new ATOM 0 HG SER B 367 9.232 9.821 15.317 1.00 10.00 H new ATOM 1399 N PRO B 368 9.374 13.340 10.965 1.00 10.00 N ATOM 1400 CA PRO B 368 10.273 13.997 10.039 1.00 10.00 C ATOM 1401 C PRO B 368 10.989 15.171 10.699 1.00 10.00 C ATOM 1402 O PRO B 368 12.053 14.954 11.318 1.00 10.00 O ATOM 1403 CB PRO B 368 9.337 14.490 8.927 1.00 10.00 C ATOM 1404 CG PRO B 368 7.941 14.370 9.468 1.00 10.00 C ATOM 1405 CD PRO B 368 8.052 13.957 10.914 1.00 10.00 C ATOM 0 HA PRO B 368 11.062 13.337 9.679 1.00 10.00 H new ATOM 0 HB2 PRO B 368 9.562 15.522 8.658 1.00 10.00 H new ATOM 0 HB3 PRO B 368 9.457 13.892 8.024 1.00 10.00 H new ATOM 0 HG2 PRO B 368 7.412 15.319 9.379 1.00 10.00 H new ATOM 0 HG3 PRO B 368 7.372 13.634 8.901 1.00 10.00 H new ATOM 0 HD2 PRO B 368 7.976 14.811 11.587 1.00 10.00 H new ATOM 0 HD3 PRO B 368 7.266 13.257 11.198 1.00 10.00 H new TER 1413 PRO B 368