USER MOD reduce.3.24.130724 H: found=0, std=0, add=1240, rem=0, adj=46 USER MOD reduce.3.24.130724 removed 1238 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 35 LYS NZ :NH3+ -131:sc= -0.0324 (180deg=-0.411) USER MOD Set 1.2: B 14 ASN :FLIP amide:sc= -3.63! C(o=-5.9!,f=-3.7!) USER MOD Set 2.1: A 14 ASN :FLIP amide:sc= -3.57! C(o=-5.8!,f=-3.6!) USER MOD Set 2.2: B 35 LYS NZ :NH3+ -130:sc= -0.0729 (180deg=-0.423) USER MOD Single : A 1 GLN : amide:sc= -0.37 X(o=-0.37,f=-0.097) USER MOD Single : A 1 GLN N :NH3+ 153:sc= -0.307 (180deg=-1.95!) USER MOD Single : A 6 ASN :FLIP amide:sc= -4.09! F(o=-5.1,f=-4.1!) USER MOD Single : A 10 THR OG1 : rot 180:sc= -0.108 USER MOD Single : A 13 TYR OH : rot 129:sc= -1.05! USER MOD Single : A 16 THR OG1 : rot -83:sc= 0.327 USER MOD Single : A 17 ASN : amide:sc= -1.09! C(o=-1.1!,f=-7.5!) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 23 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 28 TYR OH : rot 30:sc= -0.0513 USER MOD Single : A 32 THR OG1 : rot 180:sc= -1 USER MOD Single : A 33 SER OG : rot 150:sc= 0.187 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 THR OG1 : rot -85:sc= -1.33 USER MOD Single : A 49 LYS NZ :NH3+ -126:sc= 0.896 (180deg=-0.0179) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 GLN : amide:sc= -3.43 K(o=-3.4,f=-4.1!) USER MOD Single : A 58 LYS NZ :NH3+ -146:sc= -0.128 (180deg=-0.887) USER MOD Single : A 61 GLN : amide:sc= -0.229 K(o=-0.23,f=-1.8!) USER MOD Single : A 63 SER OG : rot 92:sc= 1.16 USER MOD Single : A 64 MET CE :methyl -154:sc= -0.514 (180deg=-2.57!) USER MOD Single : A 66 HIS :FLIP no HD1:sc= -1.74! C(o=-2.9!,f=-1.7!) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 GLN : amide:sc= -0.419 X(o=-0.42,f=-0.1) USER MOD Single : A 71 THR OG1 : rot -60:sc= 1.09 USER MOD Single : A 72 GLN : amide:sc= -0.26 K(o=-0.26,f=-1.7!) USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ 163:sc= -0.0198 (180deg=-0.371) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : B 1 GLN : amide:sc= -0.409 X(o=-0.41,f=-0.051) USER MOD Single : B 1 GLN N :NH3+ 140:sc= -0.377 (180deg=-1.97!) USER MOD Single : B 6 ASN :FLIP amide:sc= -4.25! F(o=-5.3,f=-4.2!) USER MOD Single : B 10 THR OG1 : rot 180:sc= -0.114 USER MOD Single : B 13 TYR OH : rot 130:sc= -1.05 USER MOD Single : B 16 THR OG1 : rot -79:sc= 0.378 USER MOD Single : B 17 ASN : amide:sc= -1.08! C(o=-1.1!,f=-7.8!) USER MOD Single : B 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 21 SER OG : rot 180:sc= 0 USER MOD Single : B 23 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 27 SER OG : rot 180:sc= 0 USER MOD Single : B 28 TYR OH : rot 30:sc= -0.065 USER MOD Single : B 32 THR OG1 : rot 180:sc= -1.02! USER MOD Single : B 33 SER OG : rot 150:sc= 0.186 USER MOD Single : B 34 SER OG : rot 180:sc= 0 USER MOD Single : B 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 45 THR OG1 : rot -88:sc= -1.37 USER MOD Single : B 49 LYS NZ :NH3+ -126:sc= 0.864 (180deg=-0.021) USER MOD Single : B 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 57 GLN : amide:sc= -3.4 K(o=-3.4,f=-3.9!) USER MOD Single : B 58 LYS NZ :NH3+ -145:sc= -0.182 (180deg=-0.893) USER MOD Single : B 61 GLN : amide:sc= -0.306 K(o=-0.31,f=-1.6!) USER MOD Single : B 63 SER OG : rot 93:sc= 1.21 USER MOD Single : B 64 MET CE :methyl -150:sc= -0.486 (180deg=-2.46!) USER MOD Single : B 66 HIS :FLIP no HD1:sc= -1.78! C(o=-2.9!,f=-1.8!) USER MOD Single : B 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 70 GLN : amide:sc= -0.424 X(o=-0.42,f=-0.11) USER MOD Single : B 71 THR OG1 : rot -61:sc= 1.12 USER MOD Single : B 72 GLN : amide:sc= -0.4 K(o=-0.4,f=-1.7!) USER MOD Single : B 73 THR OG1 : rot 180:sc= 0 USER MOD Single : B 75 LYS NZ :NH3+ 161:sc=-0.00486 (180deg=-0.365) USER MOD Single : B 76 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLN A 1 63.323 -22.813 -3.601 1.00 0.00 N ATOM 2 CA GLN A 1 64.525 -21.990 -3.287 1.00 0.00 C ATOM 3 C GLN A 1 64.226 -20.511 -3.587 1.00 0.00 C ATOM 4 O GLN A 1 63.350 -20.208 -4.372 1.00 0.00 O ATOM 5 CB GLN A 1 65.701 -22.457 -4.147 1.00 0.00 C ATOM 6 CG GLN A 1 65.280 -22.483 -5.617 1.00 0.00 C ATOM 7 CD GLN A 1 66.182 -23.446 -6.390 1.00 0.00 C ATOM 8 OE1 GLN A 1 66.723 -23.097 -7.420 1.00 0.00 O ATOM 9 NE2 GLN A 1 66.368 -24.655 -5.934 1.00 0.00 N ATOM 0 H1 GLN A 1 63.618 -23.780 -3.845 1.00 0.00 H new ATOM 0 H2 GLN A 1 62.696 -22.842 -2.772 1.00 0.00 H new ATOM 0 H3 GLN A 1 62.815 -22.393 -4.405 1.00 0.00 H new ATOM 0 HA GLN A 1 64.778 -22.103 -2.233 1.00 0.00 H new ATOM 0 HB2 GLN A 1 66.551 -21.788 -4.013 1.00 0.00 H new ATOM 0 HB3 GLN A 1 66.024 -23.450 -3.833 1.00 0.00 H new ATOM 0 HG2 GLN A 1 64.239 -22.795 -5.703 1.00 0.00 H new ATOM 0 HG3 GLN A 1 65.349 -21.482 -6.044 1.00 0.00 H new ATOM 0 HE21 GLN A 1 65.914 -24.949 -5.069 1.00 0.00 H new ATOM 0 HE22 GLN A 1 66.967 -25.305 -6.443 1.00 0.00 H new ATOM 20 N PRO A 2 64.971 -19.627 -2.946 1.00 0.00 N ATOM 21 CA PRO A 2 64.791 -18.187 -3.136 1.00 0.00 C ATOM 22 C PRO A 2 65.042 -17.807 -4.598 1.00 0.00 C ATOM 23 O PRO A 2 66.151 -17.495 -4.986 1.00 0.00 O ATOM 24 CB PRO A 2 65.840 -17.529 -2.221 1.00 0.00 C ATOM 25 CG PRO A 2 66.617 -18.678 -1.502 1.00 0.00 C ATOM 26 CD PRO A 2 66.027 -20.010 -1.999 1.00 0.00 C ATOM 0 HA PRO A 2 63.778 -17.864 -2.895 1.00 0.00 H new ATOM 0 HB2 PRO A 2 66.522 -16.909 -2.803 1.00 0.00 H new ATOM 0 HB3 PRO A 2 65.359 -16.876 -1.493 1.00 0.00 H new ATOM 0 HG2 PRO A 2 67.682 -18.621 -1.727 1.00 0.00 H new ATOM 0 HG3 PRO A 2 66.515 -18.592 -0.420 1.00 0.00 H new ATOM 0 HD2 PRO A 2 66.788 -20.623 -2.483 1.00 0.00 H new ATOM 0 HD3 PRO A 2 65.623 -20.596 -1.173 1.00 0.00 H new ATOM 34 N ASP A 3 64.021 -17.830 -5.412 1.00 0.00 N ATOM 35 CA ASP A 3 64.198 -17.468 -6.838 1.00 0.00 C ATOM 36 C ASP A 3 64.011 -15.960 -7.008 1.00 0.00 C ATOM 37 O ASP A 3 63.272 -15.504 -7.858 1.00 0.00 O ATOM 38 CB ASP A 3 63.167 -18.213 -7.686 1.00 0.00 C ATOM 39 CG ASP A 3 63.348 -17.838 -9.158 1.00 0.00 C ATOM 40 OD1 ASP A 3 64.483 -17.810 -9.606 1.00 0.00 O ATOM 41 OD2 ASP A 3 62.350 -17.584 -9.812 1.00 0.00 O ATOM 0 H ASP A 3 63.070 -18.086 -5.145 1.00 0.00 H new ATOM 0 HA ASP A 3 65.201 -17.747 -7.162 1.00 0.00 H new ATOM 0 HB2 ASP A 3 63.284 -19.289 -7.557 1.00 0.00 H new ATOM 0 HB3 ASP A 3 62.159 -17.960 -7.357 1.00 0.00 H new ATOM 46 N ALA A 4 64.678 -15.185 -6.203 1.00 0.00 N ATOM 47 CA ALA A 4 64.550 -13.704 -6.302 1.00 0.00 C ATOM 48 C ALA A 4 65.529 -13.062 -5.324 1.00 0.00 C ATOM 49 O ALA A 4 65.153 -12.590 -4.270 1.00 0.00 O ATOM 50 CB ALA A 4 63.121 -13.287 -5.947 1.00 0.00 C ATOM 0 H ALA A 4 65.311 -15.515 -5.475 1.00 0.00 H new ATOM 0 HA ALA A 4 64.773 -13.379 -7.318 1.00 0.00 H new ATOM 0 HB1 ALA A 4 63.029 -12.203 -6.020 1.00 0.00 H new ATOM 0 HB2 ALA A 4 62.422 -13.758 -6.639 1.00 0.00 H new ATOM 0 HB3 ALA A 4 62.892 -13.603 -4.929 1.00 0.00 H new ATOM 56 N ILE A 5 66.790 -13.066 -5.653 1.00 0.00 N ATOM 57 CA ILE A 5 67.802 -12.485 -4.735 1.00 0.00 C ATOM 58 C ILE A 5 68.132 -11.054 -5.156 1.00 0.00 C ATOM 59 O ILE A 5 68.708 -10.296 -4.400 1.00 0.00 O ATOM 60 CB ILE A 5 69.062 -13.341 -4.773 1.00 0.00 C ATOM 61 CG1 ILE A 5 68.767 -14.704 -4.150 1.00 0.00 C ATOM 62 CG2 ILE A 5 70.166 -12.655 -3.988 1.00 0.00 C ATOM 63 CD1 ILE A 5 69.204 -15.804 -5.113 1.00 0.00 C ATOM 0 H ILE A 5 67.163 -13.449 -6.522 1.00 0.00 H new ATOM 0 HA ILE A 5 67.403 -12.467 -3.721 1.00 0.00 H new ATOM 0 HB ILE A 5 69.381 -13.473 -5.807 1.00 0.00 H new ATOM 0 HG12 ILE A 5 69.294 -14.805 -3.201 1.00 0.00 H new ATOM 0 HG13 ILE A 5 67.702 -14.795 -3.934 1.00 0.00 H new ATOM 0 HG21 ILE A 5 71.067 -13.268 -4.016 1.00 0.00 H new ATOM 0 HG22 ILE A 5 70.376 -11.681 -4.430 1.00 0.00 H new ATOM 0 HG23 ILE A 5 69.849 -12.523 -2.954 1.00 0.00 H new ATOM 0 HD11 ILE A 5 68.995 -16.778 -4.671 1.00 0.00 H new ATOM 0 HD12 ILE A 5 68.657 -15.705 -6.050 1.00 0.00 H new ATOM 0 HD13 ILE A 5 70.273 -15.715 -5.306 1.00 0.00 H new ATOM 75 N ASN A 6 67.750 -10.663 -6.330 1.00 0.00 N ATOM 76 CA ASN A 6 68.012 -9.266 -6.756 1.00 0.00 C ATOM 77 C ASN A 6 66.817 -8.437 -6.329 1.00 0.00 C ATOM 78 O ASN A 6 66.086 -7.925 -7.140 1.00 0.00 O ATOM 79 CB ASN A 6 68.194 -9.152 -8.294 1.00 0.00 C ATOM 80 CG ASN A 6 67.995 -10.510 -8.985 1.00 0.00 C ATOM 81 OD1 ASN A 6 66.788 -10.999 -9.099 1.00 0.00 O flip ATOM 82 ND2 ASN A 6 68.945 -11.129 -9.420 1.00 0.00 N flip ATOM 0 H ASN A 6 67.268 -11.247 -7.014 1.00 0.00 H new ATOM 0 HA ASN A 6 68.936 -8.916 -6.296 1.00 0.00 H new ATOM 0 HB2 ASN A 6 67.481 -8.431 -8.694 1.00 0.00 H new ATOM 0 HB3 ASN A 6 69.191 -8.772 -8.517 1.00 0.00 H new ATOM 0 HD21 ASN A 6 69.887 -10.747 -9.331 1.00 0.00 H new ATOM 0 HD22 ASN A 6 68.801 -12.031 -9.875 1.00 0.00 H new ATOM 89 N ALA A 7 66.568 -8.372 -5.058 1.00 0.00 N ATOM 90 CA ALA A 7 65.375 -7.633 -4.573 1.00 0.00 C ATOM 91 C ALA A 7 65.785 -6.345 -3.854 1.00 0.00 C ATOM 92 O ALA A 7 66.719 -6.349 -3.077 1.00 0.00 O ATOM 93 CB ALA A 7 64.618 -8.501 -3.570 1.00 0.00 C ATOM 0 H ALA A 7 67.140 -8.800 -4.330 1.00 0.00 H new ATOM 0 HA ALA A 7 64.754 -7.391 -5.436 1.00 0.00 H new ATOM 0 HB1 ALA A 7 63.741 -7.962 -3.211 1.00 0.00 H new ATOM 0 HB2 ALA A 7 64.303 -9.425 -4.054 1.00 0.00 H new ATOM 0 HB3 ALA A 7 65.269 -8.736 -2.728 1.00 0.00 H new ATOM 99 N PRO A 8 65.008 -5.290 -4.058 1.00 0.00 N ATOM 100 CA PRO A 8 65.226 -4.047 -3.345 1.00 0.00 C ATOM 101 C PRO A 8 64.875 -4.291 -1.891 1.00 0.00 C ATOM 102 O PRO A 8 63.718 -4.359 -1.525 1.00 0.00 O ATOM 103 CB PRO A 8 64.258 -3.043 -3.969 1.00 0.00 C ATOM 104 CG PRO A 8 63.377 -3.829 -4.986 1.00 0.00 C ATOM 105 CD PRO A 8 63.894 -5.276 -5.012 1.00 0.00 C ATOM 0 HA PRO A 8 66.251 -3.682 -3.405 1.00 0.00 H new ATOM 0 HB2 PRO A 8 63.639 -2.577 -3.202 1.00 0.00 H new ATOM 0 HB3 PRO A 8 64.803 -2.242 -4.469 1.00 0.00 H new ATOM 0 HG2 PRO A 8 62.329 -3.800 -4.689 1.00 0.00 H new ATOM 0 HG3 PRO A 8 63.440 -3.380 -5.977 1.00 0.00 H new ATOM 0 HD2 PRO A 8 63.115 -5.980 -4.721 1.00 0.00 H new ATOM 0 HD3 PRO A 8 64.224 -5.561 -6.011 1.00 0.00 H new ATOM 113 N VAL A 9 65.848 -4.504 -1.079 1.00 0.00 N ATOM 114 CA VAL A 9 65.568 -4.841 0.332 1.00 0.00 C ATOM 115 C VAL A 9 65.441 -3.558 1.162 1.00 0.00 C ATOM 116 O VAL A 9 66.414 -2.905 1.480 1.00 0.00 O ATOM 117 CB VAL A 9 66.719 -5.690 0.844 1.00 0.00 C ATOM 118 CG1 VAL A 9 68.005 -4.895 0.720 1.00 0.00 C ATOM 119 CG2 VAL A 9 66.476 -6.072 2.295 1.00 0.00 C ATOM 0 H VAL A 9 66.836 -4.460 -1.328 1.00 0.00 H new ATOM 0 HA VAL A 9 64.630 -5.390 0.415 1.00 0.00 H new ATOM 0 HB VAL A 9 66.796 -6.604 0.255 1.00 0.00 H new ATOM 0 HG11 VAL A 9 68.840 -5.494 1.085 1.00 0.00 H new ATOM 0 HG12 VAL A 9 68.173 -4.636 -0.325 1.00 0.00 H new ATOM 0 HG13 VAL A 9 67.927 -3.983 1.312 1.00 0.00 H new ATOM 0 HG21 VAL A 9 67.306 -6.681 2.655 1.00 0.00 H new ATOM 0 HG22 VAL A 9 66.399 -5.169 2.901 1.00 0.00 H new ATOM 0 HG23 VAL A 9 65.549 -6.641 2.371 1.00 0.00 H new ATOM 129 N THR A 10 64.240 -3.189 1.509 1.00 0.00 N ATOM 130 CA THR A 10 64.049 -1.948 2.306 1.00 0.00 C ATOM 131 C THR A 10 64.658 -2.130 3.693 1.00 0.00 C ATOM 132 O THR A 10 64.136 -2.848 4.522 1.00 0.00 O ATOM 133 CB THR A 10 62.556 -1.648 2.441 1.00 0.00 C ATOM 134 OG1 THR A 10 61.923 -1.823 1.181 1.00 0.00 O ATOM 135 CG2 THR A 10 62.372 -0.207 2.913 1.00 0.00 C ATOM 0 H THR A 10 63.384 -3.693 1.275 1.00 0.00 H new ATOM 0 HA THR A 10 64.541 -1.117 1.800 1.00 0.00 H new ATOM 0 HB THR A 10 62.109 -2.328 3.166 1.00 0.00 H new ATOM 0 HG1 THR A 10 60.965 -1.633 1.267 1.00 0.00 H new ATOM 0 HG21 THR A 10 61.308 0.011 3.011 1.00 0.00 H new ATOM 0 HG22 THR A 10 62.859 -0.076 3.879 1.00 0.00 H new ATOM 0 HG23 THR A 10 62.817 0.473 2.187 1.00 0.00 H new ATOM 143 N CYS A 11 65.754 -1.475 3.958 1.00 0.00 N ATOM 144 CA CYS A 11 66.388 -1.605 5.302 1.00 0.00 C ATOM 145 C CYS A 11 66.675 -0.216 5.870 1.00 0.00 C ATOM 146 O CYS A 11 66.314 0.791 5.293 1.00 0.00 O ATOM 147 CB CYS A 11 67.696 -2.384 5.186 1.00 0.00 C ATOM 148 SG CYS A 11 67.408 -3.900 4.252 1.00 0.00 S ATOM 0 H CYS A 11 66.237 -0.857 3.306 1.00 0.00 H new ATOM 0 HA CYS A 11 65.708 -2.138 5.966 1.00 0.00 H new ATOM 0 HB2 CYS A 11 68.452 -1.776 4.689 1.00 0.00 H new ATOM 0 HB3 CYS A 11 68.080 -2.622 6.178 1.00 0.00 H new ATOM 153 N CYS A 12 67.316 -0.156 7.002 1.00 0.00 N ATOM 154 CA CYS A 12 67.622 1.168 7.623 1.00 0.00 C ATOM 155 C CYS A 12 69.129 1.272 7.884 1.00 0.00 C ATOM 156 O CYS A 12 69.894 0.396 7.533 1.00 0.00 O ATOM 157 CB CYS A 12 66.880 1.306 8.966 1.00 0.00 C ATOM 158 SG CYS A 12 65.309 0.399 8.919 1.00 0.00 S ATOM 0 H CYS A 12 67.643 -0.967 7.528 1.00 0.00 H new ATOM 0 HA CYS A 12 67.301 1.958 6.944 1.00 0.00 H new ATOM 0 HB2 CYS A 12 67.504 0.923 9.774 1.00 0.00 H new ATOM 0 HB3 CYS A 12 66.693 2.359 9.179 1.00 0.00 H new ATOM 163 N TYR A 13 69.553 2.323 8.533 1.00 0.00 N ATOM 164 CA TYR A 13 71.002 2.475 8.861 1.00 0.00 C ATOM 165 C TYR A 13 71.128 3.001 10.291 1.00 0.00 C ATOM 166 O TYR A 13 71.912 2.515 11.081 1.00 0.00 O ATOM 167 CB TYR A 13 71.659 3.474 7.901 1.00 0.00 C ATOM 168 CG TYR A 13 71.767 2.871 6.519 1.00 0.00 C ATOM 169 CD1 TYR A 13 72.097 1.508 6.376 1.00 0.00 C ATOM 170 CD2 TYR A 13 71.539 3.666 5.369 1.00 0.00 C ATOM 171 CE1 TYR A 13 72.195 0.937 5.091 1.00 0.00 C ATOM 172 CE2 TYR A 13 71.642 3.095 4.083 1.00 0.00 C ATOM 173 CZ TYR A 13 71.971 1.731 3.945 1.00 0.00 C ATOM 174 OH TYR A 13 72.072 1.172 2.689 1.00 0.00 O ATOM 0 H TYR A 13 68.956 3.086 8.852 1.00 0.00 H new ATOM 0 HA TYR A 13 71.498 1.509 8.764 1.00 0.00 H new ATOM 0 HB2 TYR A 13 71.072 4.392 7.861 1.00 0.00 H new ATOM 0 HB3 TYR A 13 72.650 3.744 8.267 1.00 0.00 H new ATOM 0 HD1 TYR A 13 72.275 0.901 7.251 1.00 0.00 H new ATOM 0 HD2 TYR A 13 71.286 4.710 5.477 1.00 0.00 H new ATOM 0 HE1 TYR A 13 72.442 -0.109 4.983 1.00 0.00 H new ATOM 0 HE2 TYR A 13 71.469 3.701 3.206 1.00 0.00 H new ATOM 0 HH TYR A 13 71.269 1.387 2.170 1.00 0.00 H new ATOM 184 N ASN A 14 70.345 3.989 10.629 1.00 0.00 N ATOM 185 CA ASN A 14 70.394 4.554 12.005 1.00 0.00 C ATOM 186 C ASN A 14 69.037 4.346 12.671 1.00 0.00 C ATOM 187 O ASN A 14 68.176 3.673 12.139 1.00 0.00 O ATOM 188 CB ASN A 14 70.702 6.049 11.928 1.00 0.00 C ATOM 189 CG ASN A 14 72.043 6.254 11.225 1.00 0.00 C ATOM 190 OD1 ASN A 14 72.058 6.575 9.963 1.00 0.00 O flip ATOM 191 ND2 ASN A 14 73.087 6.120 11.832 1.00 0.00 N flip ATOM 0 H ASN A 14 69.669 4.431 10.006 1.00 0.00 H new ATOM 0 HA ASN A 14 71.171 4.056 12.585 1.00 0.00 H new ATOM 0 HB2 ASN A 14 69.911 6.567 11.385 1.00 0.00 H new ATOM 0 HB3 ASN A 14 70.735 6.477 12.930 1.00 0.00 H new ATOM 0 HD21 ASN A 14 73.074 5.869 12.820 1.00 0.00 H new ATOM 0 HD22 ASN A 14 73.977 6.259 11.353 1.00 0.00 H new ATOM 198 N PHE A 15 68.830 4.915 13.825 1.00 0.00 N ATOM 199 CA PHE A 15 67.516 4.734 14.501 1.00 0.00 C ATOM 200 C PHE A 15 67.178 5.962 15.340 1.00 0.00 C ATOM 201 O PHE A 15 67.887 6.309 16.264 1.00 0.00 O ATOM 202 CB PHE A 15 67.566 3.505 15.412 1.00 0.00 C ATOM 203 CG PHE A 15 67.878 2.273 14.597 1.00 0.00 C ATOM 204 CD1 PHE A 15 69.219 1.944 14.300 1.00 0.00 C ATOM 205 CD2 PHE A 15 66.829 1.456 14.119 1.00 0.00 C ATOM 206 CE1 PHE A 15 69.512 0.797 13.530 1.00 0.00 C ATOM 207 CE2 PHE A 15 67.122 0.309 13.347 1.00 0.00 C ATOM 208 CZ PHE A 15 68.464 -0.020 13.053 1.00 0.00 C ATOM 0 H PHE A 15 69.506 5.492 14.325 1.00 0.00 H new ATOM 0 HA PHE A 15 66.750 4.597 13.738 1.00 0.00 H new ATOM 0 HB2 PHE A 15 68.324 3.643 16.183 1.00 0.00 H new ATOM 0 HB3 PHE A 15 66.611 3.381 15.923 1.00 0.00 H new ATOM 0 HD1 PHE A 15 70.021 2.570 14.662 1.00 0.00 H new ATOM 0 HD2 PHE A 15 65.803 1.708 14.344 1.00 0.00 H new ATOM 0 HE1 PHE A 15 70.538 0.545 13.306 1.00 0.00 H new ATOM 0 HE2 PHE A 15 66.320 -0.316 12.982 1.00 0.00 H new ATOM 0 HZ PHE A 15 68.688 -0.897 12.463 1.00 0.00 H new ATOM 218 N THR A 16 66.069 6.601 15.055 1.00 0.00 N ATOM 219 CA THR A 16 65.655 7.788 15.882 1.00 0.00 C ATOM 220 C THR A 16 65.706 7.388 17.359 1.00 0.00 C ATOM 221 O THR A 16 64.805 6.760 17.865 1.00 0.00 O ATOM 222 CB THR A 16 64.212 8.227 15.527 1.00 0.00 C ATOM 223 OG1 THR A 16 63.612 8.839 16.663 1.00 0.00 O ATOM 224 CG2 THR A 16 63.383 7.014 15.112 1.00 0.00 C ATOM 0 H THR A 16 65.435 6.358 14.294 1.00 0.00 H new ATOM 0 HA THR A 16 66.330 8.619 15.680 1.00 0.00 H new ATOM 0 HB THR A 16 64.249 8.936 14.700 1.00 0.00 H new ATOM 0 HG1 THR A 16 63.258 8.146 17.259 1.00 0.00 H new ATOM 0 HG21 THR A 16 62.370 7.333 14.864 1.00 0.00 H new ATOM 0 HG22 THR A 16 63.838 6.543 14.241 1.00 0.00 H new ATOM 0 HG23 THR A 16 63.348 6.299 15.934 1.00 0.00 H new ATOM 232 N ASN A 17 66.762 7.713 18.043 1.00 0.00 N ATOM 233 CA ASN A 17 66.857 7.312 19.473 1.00 0.00 C ATOM 234 C ASN A 17 66.307 8.423 20.370 1.00 0.00 C ATOM 235 O ASN A 17 66.374 8.342 21.580 1.00 0.00 O ATOM 236 CB ASN A 17 68.319 7.038 19.830 1.00 0.00 C ATOM 237 CG ASN A 17 69.136 8.321 19.659 1.00 0.00 C ATOM 238 OD1 ASN A 17 68.595 9.364 19.353 1.00 0.00 O ATOM 239 ND2 ASN A 17 70.427 8.286 19.846 1.00 0.00 N ATOM 0 H ASN A 17 67.559 8.235 17.679 1.00 0.00 H new ATOM 0 HA ASN A 17 66.268 6.408 19.629 1.00 0.00 H new ATOM 0 HB2 ASN A 17 68.393 6.682 20.857 1.00 0.00 H new ATOM 0 HB3 ASN A 17 68.719 6.251 19.190 1.00 0.00 H new ATOM 0 HD21 ASN A 17 70.982 9.135 19.735 1.00 0.00 H new ATOM 0 HD22 ASN A 17 70.882 7.410 20.103 1.00 0.00 H new ATOM 246 N ARG A 18 65.743 9.448 19.795 1.00 0.00 N ATOM 247 CA ARG A 18 65.171 10.536 20.629 1.00 0.00 C ATOM 248 C ARG A 18 63.683 10.273 20.825 1.00 0.00 C ATOM 249 O ARG A 18 62.980 9.932 19.897 1.00 0.00 O ATOM 250 CB ARG A 18 65.367 11.880 19.928 1.00 0.00 C ATOM 251 CG ARG A 18 66.705 12.487 20.352 1.00 0.00 C ATOM 252 CD ARG A 18 67.306 13.268 19.183 1.00 0.00 C ATOM 253 NE ARG A 18 67.734 14.620 19.654 1.00 0.00 N ATOM 254 CZ ARG A 18 68.008 15.573 18.790 1.00 0.00 C ATOM 255 NH1 ARG A 18 67.915 15.353 17.500 1.00 0.00 N ATOM 256 NH2 ARG A 18 68.378 16.748 19.220 1.00 0.00 N ATOM 0 H ARG A 18 65.654 9.578 18.787 1.00 0.00 H new ATOM 0 HA ARG A 18 65.673 10.564 21.596 1.00 0.00 H new ATOM 0 HB2 ARG A 18 65.343 11.745 18.847 1.00 0.00 H new ATOM 0 HB3 ARG A 18 64.552 12.557 20.182 1.00 0.00 H new ATOM 0 HG2 ARG A 18 66.562 13.146 21.208 1.00 0.00 H new ATOM 0 HG3 ARG A 18 67.390 11.700 20.667 1.00 0.00 H new ATOM 0 HD2 ARG A 18 68.159 12.728 18.771 1.00 0.00 H new ATOM 0 HD3 ARG A 18 66.573 13.365 18.382 1.00 0.00 H new ATOM 0 HE ARG A 18 67.814 14.805 20.654 1.00 0.00 H new ATOM 0 HH11 ARG A 18 67.628 14.436 17.158 1.00 0.00 H new ATOM 0 HH12 ARG A 18 68.130 16.099 16.839 1.00 0.00 H new ATOM 0 HH21 ARG A 18 68.454 16.924 20.222 1.00 0.00 H new ATOM 0 HH22 ARG A 18 68.592 17.491 18.554 1.00 0.00 H new ATOM 270 N LYS A 19 63.195 10.414 22.026 1.00 0.00 N ATOM 271 CA LYS A 19 61.748 10.159 22.274 1.00 0.00 C ATOM 272 C LYS A 19 60.912 10.996 21.308 1.00 0.00 C ATOM 273 O LYS A 19 60.601 12.142 21.569 1.00 0.00 O ATOM 274 CB LYS A 19 61.397 10.536 23.715 1.00 0.00 C ATOM 275 CG LYS A 19 62.404 9.892 24.673 1.00 0.00 C ATOM 276 CD LYS A 19 61.768 9.743 26.056 1.00 0.00 C ATOM 277 CE LYS A 19 62.578 8.747 26.886 1.00 0.00 C ATOM 278 NZ LYS A 19 62.297 8.962 28.334 1.00 0.00 N ATOM 0 H LYS A 19 63.734 10.694 22.845 1.00 0.00 H new ATOM 0 HA LYS A 19 61.535 9.101 22.118 1.00 0.00 H new ATOM 0 HB2 LYS A 19 61.410 11.620 23.832 1.00 0.00 H new ATOM 0 HB3 LYS A 19 60.387 10.202 23.954 1.00 0.00 H new ATOM 0 HG2 LYS A 19 62.710 8.917 24.295 1.00 0.00 H new ATOM 0 HG3 LYS A 19 63.303 10.505 24.738 1.00 0.00 H new ATOM 0 HD2 LYS A 19 61.735 10.710 26.559 1.00 0.00 H new ATOM 0 HD3 LYS A 19 60.738 9.399 25.959 1.00 0.00 H new ATOM 0 HE2 LYS A 19 62.320 7.727 26.602 1.00 0.00 H new ATOM 0 HE3 LYS A 19 63.642 8.874 26.688 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 62.848 8.285 28.899 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 62.564 9.932 28.599 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 61.283 8.820 28.516 1.00 0.00 H new ATOM 292 N ILE A 20 60.549 10.431 20.196 1.00 0.00 N ATOM 293 CA ILE A 20 59.742 11.176 19.211 1.00 0.00 C ATOM 294 C ILE A 20 58.280 11.136 19.640 1.00 0.00 C ATOM 295 O ILE A 20 57.694 10.085 19.806 1.00 0.00 O ATOM 296 CB ILE A 20 59.935 10.540 17.813 1.00 0.00 C ATOM 297 CG1 ILE A 20 60.929 11.390 17.018 1.00 0.00 C ATOM 298 CG2 ILE A 20 58.601 10.461 17.044 1.00 0.00 C ATOM 299 CD1 ILE A 20 60.964 10.904 15.574 1.00 0.00 C ATOM 0 H ILE A 20 60.782 9.475 19.929 1.00 0.00 H new ATOM 0 HA ILE A 20 60.060 12.217 19.160 1.00 0.00 H new ATOM 0 HB ILE A 20 60.313 9.525 17.941 1.00 0.00 H new ATOM 0 HG12 ILE A 20 60.638 12.440 17.054 1.00 0.00 H new ATOM 0 HG13 ILE A 20 61.922 11.320 17.462 1.00 0.00 H new ATOM 0 HG21 ILE A 20 58.771 10.010 16.066 1.00 0.00 H new ATOM 0 HG22 ILE A 20 57.892 9.853 17.606 1.00 0.00 H new ATOM 0 HG23 ILE A 20 58.195 11.464 16.915 1.00 0.00 H new ATOM 0 HD11 ILE A 20 61.671 11.507 15.004 1.00 0.00 H new ATOM 0 HD12 ILE A 20 61.275 9.860 15.549 1.00 0.00 H new ATOM 0 HD13 ILE A 20 59.971 10.997 15.135 1.00 0.00 H new ATOM 311 N SER A 21 57.700 12.273 19.814 1.00 0.00 N ATOM 312 CA SER A 21 56.272 12.345 20.227 1.00 0.00 C ATOM 313 C SER A 21 55.431 11.401 19.363 1.00 0.00 C ATOM 314 O SER A 21 55.480 11.445 18.150 1.00 0.00 O ATOM 315 CB SER A 21 55.777 13.774 20.038 1.00 0.00 C ATOM 316 OG SER A 21 54.845 14.092 21.063 1.00 0.00 O ATOM 0 H SER A 21 58.155 13.177 19.688 1.00 0.00 H new ATOM 0 HA SER A 21 56.179 12.050 21.272 1.00 0.00 H new ATOM 0 HB2 SER A 21 56.617 14.468 20.067 1.00 0.00 H new ATOM 0 HB3 SER A 21 55.309 13.882 19.060 1.00 0.00 H new ATOM 0 HG SER A 21 54.528 15.011 20.943 1.00 0.00 H new ATOM 322 N VAL A 22 54.652 10.553 19.978 1.00 0.00 N ATOM 323 CA VAL A 22 53.802 9.621 19.195 1.00 0.00 C ATOM 324 C VAL A 22 52.810 10.424 18.344 1.00 0.00 C ATOM 325 O VAL A 22 52.185 9.899 17.443 1.00 0.00 O ATOM 326 CB VAL A 22 53.033 8.707 20.150 1.00 0.00 C ATOM 327 CG1 VAL A 22 52.151 9.555 21.067 1.00 0.00 C ATOM 328 CG2 VAL A 22 52.155 7.750 19.341 1.00 0.00 C ATOM 0 H VAL A 22 54.570 10.468 20.991 1.00 0.00 H new ATOM 0 HA VAL A 22 54.432 9.016 18.543 1.00 0.00 H new ATOM 0 HB VAL A 22 53.738 8.134 20.752 1.00 0.00 H new ATOM 0 HG11 VAL A 22 51.603 8.904 21.748 1.00 0.00 H new ATOM 0 HG12 VAL A 22 52.775 10.238 21.642 1.00 0.00 H new ATOM 0 HG13 VAL A 22 51.445 10.128 20.465 1.00 0.00 H new ATOM 0 HG21 VAL A 22 51.606 7.098 20.020 1.00 0.00 H new ATOM 0 HG22 VAL A 22 51.450 8.324 18.740 1.00 0.00 H new ATOM 0 HG23 VAL A 22 52.783 7.146 18.686 1.00 0.00 H new ATOM 338 N GLN A 23 52.663 11.694 18.622 1.00 0.00 N ATOM 339 CA GLN A 23 51.734 12.523 17.846 1.00 0.00 C ATOM 340 C GLN A 23 52.245 12.614 16.418 1.00 0.00 C ATOM 341 O GLN A 23 51.489 12.608 15.468 1.00 0.00 O ATOM 342 CB GLN A 23 51.668 13.926 18.500 1.00 0.00 C ATOM 343 CG GLN A 23 52.077 15.032 17.512 1.00 0.00 C ATOM 344 CD GLN A 23 51.761 16.401 18.116 1.00 0.00 C ATOM 345 OE1 GLN A 23 50.743 16.991 17.813 1.00 0.00 O ATOM 346 NE2 GLN A 23 52.596 16.935 18.965 1.00 0.00 N ATOM 0 H GLN A 23 53.160 12.185 19.366 1.00 0.00 H new ATOM 0 HA GLN A 23 50.733 12.091 17.834 1.00 0.00 H new ATOM 0 HB2 GLN A 23 50.656 14.114 18.858 1.00 0.00 H new ATOM 0 HB3 GLN A 23 52.324 13.954 19.370 1.00 0.00 H new ATOM 0 HG2 GLN A 23 53.141 14.959 17.288 1.00 0.00 H new ATOM 0 HG3 GLN A 23 51.544 14.907 16.569 1.00 0.00 H new ATOM 0 HE21 GLN A 23 53.451 16.440 19.220 1.00 0.00 H new ATOM 0 HE22 GLN A 23 52.394 17.847 19.374 1.00 0.00 H new ATOM 355 N ARG A 24 53.529 12.726 16.266 1.00 0.00 N ATOM 356 CA ARG A 24 54.096 12.848 14.915 1.00 0.00 C ATOM 357 C ARG A 24 54.019 11.511 14.222 1.00 0.00 C ATOM 358 O ARG A 24 53.904 11.429 13.018 1.00 0.00 O ATOM 359 CB ARG A 24 55.563 13.288 14.990 1.00 0.00 C ATOM 360 CG ARG A 24 55.732 14.406 16.021 1.00 0.00 C ATOM 361 CD ARG A 24 55.836 15.750 15.306 1.00 0.00 C ATOM 362 NE ARG A 24 54.466 16.269 15.014 1.00 0.00 N ATOM 363 CZ ARG A 24 54.295 17.272 14.179 1.00 0.00 C ATOM 364 NH1 ARG A 24 55.332 17.822 13.610 1.00 0.00 N ATOM 365 NH2 ARG A 24 53.092 17.721 13.912 1.00 0.00 N ATOM 0 H ARG A 24 54.208 12.738 17.027 1.00 0.00 H new ATOM 0 HA ARG A 24 53.528 13.594 14.360 1.00 0.00 H new ATOM 0 HB2 ARG A 24 56.191 12.439 15.259 1.00 0.00 H new ATOM 0 HB3 ARG A 24 55.896 13.634 14.011 1.00 0.00 H new ATOM 0 HG2 ARG A 24 54.885 14.412 16.708 1.00 0.00 H new ATOM 0 HG3 ARG A 24 56.626 14.231 16.619 1.00 0.00 H new ATOM 0 HD2 ARG A 24 56.381 16.462 15.926 1.00 0.00 H new ATOM 0 HD3 ARG A 24 56.399 15.638 14.379 1.00 0.00 H new ATOM 0 HE ARG A 24 53.657 15.843 15.465 1.00 0.00 H new ATOM 0 HH11 ARG A 24 56.269 17.474 13.813 1.00 0.00 H new ATOM 0 HH12 ARG A 24 55.206 18.600 12.962 1.00 0.00 H new ATOM 0 HH21 ARG A 24 52.278 17.292 14.353 1.00 0.00 H new ATOM 0 HH22 ARG A 24 52.970 18.499 13.263 1.00 0.00 H new ATOM 379 N LEU A 25 54.102 10.462 14.969 1.00 0.00 N ATOM 380 CA LEU A 25 54.069 9.115 14.363 1.00 0.00 C ATOM 381 C LEU A 25 52.732 8.877 13.678 1.00 0.00 C ATOM 382 O LEU A 25 51.788 8.397 14.275 1.00 0.00 O ATOM 383 CB LEU A 25 54.290 8.064 15.445 1.00 0.00 C ATOM 384 CG LEU A 25 55.613 8.350 16.186 1.00 0.00 C ATOM 385 CD1 LEU A 25 55.981 7.152 17.053 1.00 0.00 C ATOM 386 CD2 LEU A 25 56.741 8.601 15.176 1.00 0.00 C ATOM 0 H LEU A 25 54.192 10.478 15.985 1.00 0.00 H new ATOM 0 HA LEU A 25 54.861 9.042 13.618 1.00 0.00 H new ATOM 0 HB2 LEU A 25 53.458 8.073 16.149 1.00 0.00 H new ATOM 0 HB3 LEU A 25 54.319 7.070 14.999 1.00 0.00 H new ATOM 0 HG LEU A 25 55.483 9.235 16.809 1.00 0.00 H new ATOM 0 HD11 LEU A 25 56.916 7.355 17.576 1.00 0.00 H new ATOM 0 HD12 LEU A 25 55.189 6.973 17.781 1.00 0.00 H new ATOM 0 HD13 LEU A 25 56.102 6.270 16.423 1.00 0.00 H new ATOM 0 HD21 LEU A 25 57.670 8.802 15.710 1.00 0.00 H new ATOM 0 HD22 LEU A 25 56.868 7.721 14.546 1.00 0.00 H new ATOM 0 HD23 LEU A 25 56.488 9.459 14.554 1.00 0.00 H new ATOM 398 N ALA A 26 52.645 9.207 12.427 1.00 0.00 N ATOM 399 CA ALA A 26 51.377 9.006 11.688 1.00 0.00 C ATOM 400 C ALA A 26 51.137 7.510 11.450 1.00 0.00 C ATOM 401 O ALA A 26 50.031 7.086 11.177 1.00 0.00 O ATOM 402 CB ALA A 26 51.461 9.714 10.338 1.00 0.00 C ATOM 0 H ALA A 26 53.405 9.611 11.880 1.00 0.00 H new ATOM 0 HA ALA A 26 50.556 9.415 12.276 1.00 0.00 H new ATOM 0 HB1 ALA A 26 50.529 9.568 9.792 1.00 0.00 H new ATOM 0 HB2 ALA A 26 51.626 10.780 10.496 1.00 0.00 H new ATOM 0 HB3 ALA A 26 52.288 9.301 9.761 1.00 0.00 H new ATOM 408 N SER A 27 52.163 6.714 11.535 1.00 0.00 N ATOM 409 CA SER A 27 51.995 5.248 11.295 1.00 0.00 C ATOM 410 C SER A 27 53.300 4.524 11.632 1.00 0.00 C ATOM 411 O SER A 27 54.277 5.136 12.014 1.00 0.00 O ATOM 412 CB SER A 27 51.645 5.010 9.825 1.00 0.00 C ATOM 413 OG SER A 27 50.534 4.126 9.742 1.00 0.00 O ATOM 0 H SER A 27 53.113 7.011 11.760 1.00 0.00 H new ATOM 0 HA SER A 27 51.193 4.865 11.926 1.00 0.00 H new ATOM 0 HB2 SER A 27 51.408 5.956 9.338 1.00 0.00 H new ATOM 0 HB3 SER A 27 52.501 4.587 9.300 1.00 0.00 H new ATOM 0 HG SER A 27 50.307 3.973 8.801 1.00 0.00 H new ATOM 419 N TYR A 28 53.321 3.221 11.516 1.00 0.00 N ATOM 420 CA TYR A 28 54.562 2.468 11.853 1.00 0.00 C ATOM 421 C TYR A 28 54.606 1.155 11.031 1.00 0.00 C ATOM 422 O TYR A 28 53.674 0.376 11.041 1.00 0.00 O ATOM 423 CB TYR A 28 54.559 2.199 13.384 1.00 0.00 C ATOM 424 CG TYR A 28 54.641 0.725 13.704 1.00 0.00 C ATOM 425 CD1 TYR A 28 53.472 -0.065 13.688 1.00 0.00 C ATOM 426 CD2 TYR A 28 55.890 0.134 13.983 1.00 0.00 C ATOM 427 CE1 TYR A 28 53.550 -1.446 13.957 1.00 0.00 C ATOM 428 CE2 TYR A 28 55.973 -1.247 14.249 1.00 0.00 C ATOM 429 CZ TYR A 28 54.802 -2.041 14.237 1.00 0.00 C ATOM 430 OH TYR A 28 54.882 -3.393 14.497 1.00 0.00 O ATOM 0 H TYR A 28 52.536 2.650 11.204 1.00 0.00 H new ATOM 0 HA TYR A 28 55.456 3.039 11.600 1.00 0.00 H new ATOM 0 HB2 TYR A 28 55.401 2.716 13.844 1.00 0.00 H new ATOM 0 HB3 TYR A 28 53.652 2.614 13.822 1.00 0.00 H new ATOM 0 HD1 TYR A 28 52.517 0.389 13.469 1.00 0.00 H new ATOM 0 HD2 TYR A 28 56.784 0.740 13.993 1.00 0.00 H new ATOM 0 HE1 TYR A 28 52.654 -2.050 13.949 1.00 0.00 H new ATOM 0 HE2 TYR A 28 56.930 -1.699 14.462 1.00 0.00 H new ATOM 0 HH TYR A 28 54.170 -3.862 14.014 1.00 0.00 H new ATOM 440 N ARG A 29 55.684 0.917 10.321 1.00 0.00 N ATOM 441 CA ARG A 29 55.783 -0.335 9.500 1.00 0.00 C ATOM 442 C ARG A 29 57.035 -1.118 9.908 1.00 0.00 C ATOM 443 O ARG A 29 58.045 -1.075 9.244 1.00 0.00 O ATOM 444 CB ARG A 29 55.877 0.032 8.024 1.00 0.00 C ATOM 445 CG ARG A 29 55.137 -1.016 7.190 1.00 0.00 C ATOM 446 CD ARG A 29 54.362 -0.321 6.070 1.00 0.00 C ATOM 447 NE ARG A 29 52.978 -0.882 6.001 1.00 0.00 N ATOM 448 CZ ARG A 29 52.218 -0.660 4.951 1.00 0.00 C ATOM 449 NH1 ARG A 29 52.659 0.061 3.949 1.00 0.00 N ATOM 450 NH2 ARG A 29 51.014 -1.162 4.907 1.00 0.00 N ATOM 0 H ARG A 29 56.497 1.532 10.274 1.00 0.00 H new ATOM 0 HA ARG A 29 54.898 -0.949 9.669 1.00 0.00 H new ATOM 0 HB2 ARG A 29 55.445 1.018 7.855 1.00 0.00 H new ATOM 0 HB3 ARG A 29 56.922 0.085 7.717 1.00 0.00 H new ATOM 0 HG2 ARG A 29 55.846 -1.728 6.768 1.00 0.00 H new ATOM 0 HG3 ARG A 29 54.454 -1.583 7.822 1.00 0.00 H new ATOM 0 HD2 ARG A 29 54.322 0.753 6.253 1.00 0.00 H new ATOM 0 HD3 ARG A 29 54.872 -0.464 5.117 1.00 0.00 H new ATOM 0 HE ARG A 29 52.620 -1.442 6.775 1.00 0.00 H new ATOM 0 HH11 ARG A 29 53.599 0.455 3.979 1.00 0.00 H new ATOM 0 HH12 ARG A 29 52.062 0.228 3.139 1.00 0.00 H new ATOM 0 HH21 ARG A 29 50.667 -1.723 5.685 1.00 0.00 H new ATOM 0 HH22 ARG A 29 50.420 -0.993 4.095 1.00 0.00 H new ATOM 464 N ARG A 30 56.968 -1.819 11.003 1.00 0.00 N ATOM 465 CA ARG A 30 58.156 -2.599 11.500 1.00 0.00 C ATOM 466 C ARG A 30 58.898 -3.300 10.348 1.00 0.00 C ATOM 467 O ARG A 30 58.428 -4.274 9.794 1.00 0.00 O ATOM 468 CB ARG A 30 57.675 -3.653 12.500 1.00 0.00 C ATOM 469 CG ARG A 30 58.880 -4.249 13.230 1.00 0.00 C ATOM 470 CD ARG A 30 58.531 -4.458 14.704 1.00 0.00 C ATOM 471 NE ARG A 30 59.611 -5.250 15.365 1.00 0.00 N ATOM 472 CZ ARG A 30 59.411 -5.806 16.538 1.00 0.00 C ATOM 473 NH1 ARG A 30 58.260 -5.671 17.154 1.00 0.00 N ATOM 474 NH2 ARG A 30 60.365 -6.500 17.098 1.00 0.00 N ATOM 0 H ARG A 30 56.136 -1.892 11.588 1.00 0.00 H new ATOM 0 HA ARG A 30 58.848 -1.902 11.973 1.00 0.00 H new ATOM 0 HB2 ARG A 30 56.988 -3.203 13.217 1.00 0.00 H new ATOM 0 HB3 ARG A 30 57.125 -4.438 11.981 1.00 0.00 H new ATOM 0 HG2 ARG A 30 59.162 -5.198 12.774 1.00 0.00 H new ATOM 0 HG3 ARG A 30 59.739 -3.584 13.139 1.00 0.00 H new ATOM 0 HD2 ARG A 30 58.416 -3.495 15.201 1.00 0.00 H new ATOM 0 HD3 ARG A 30 57.578 -4.979 14.793 1.00 0.00 H new ATOM 0 HE ARG A 30 60.513 -5.360 14.901 1.00 0.00 H new ATOM 0 HH11 ARG A 30 57.511 -5.130 16.722 1.00 0.00 H new ATOM 0 HH12 ARG A 30 58.115 -6.107 18.065 1.00 0.00 H new ATOM 0 HH21 ARG A 30 61.262 -6.609 16.625 1.00 0.00 H new ATOM 0 HH22 ARG A 30 60.213 -6.933 18.009 1.00 0.00 H new ATOM 488 N ILE A 31 60.089 -2.840 10.027 1.00 0.00 N ATOM 489 CA ILE A 31 60.894 -3.516 8.964 1.00 0.00 C ATOM 490 C ILE A 31 61.459 -4.819 9.546 1.00 0.00 C ATOM 491 O ILE A 31 61.573 -4.968 10.743 1.00 0.00 O ATOM 492 CB ILE A 31 62.062 -2.587 8.515 1.00 0.00 C ATOM 493 CG1 ILE A 31 61.594 -1.699 7.348 1.00 0.00 C ATOM 494 CG2 ILE A 31 63.273 -3.429 8.054 1.00 0.00 C ATOM 495 CD1 ILE A 31 62.787 -0.906 6.782 1.00 0.00 C ATOM 0 H ILE A 31 60.533 -2.028 10.456 1.00 0.00 H new ATOM 0 HA ILE A 31 60.269 -3.731 8.098 1.00 0.00 H new ATOM 0 HB ILE A 31 62.359 -1.966 9.360 1.00 0.00 H new ATOM 0 HG12 ILE A 31 61.152 -2.315 6.565 1.00 0.00 H new ATOM 0 HG13 ILE A 31 60.819 -1.013 7.690 1.00 0.00 H new ATOM 0 HG21 ILE A 31 64.080 -2.766 7.744 1.00 0.00 H new ATOM 0 HG22 ILE A 31 63.615 -4.056 8.877 1.00 0.00 H new ATOM 0 HG23 ILE A 31 62.979 -4.060 7.215 1.00 0.00 H new ATOM 0 HD11 ILE A 31 62.449 -0.280 5.956 1.00 0.00 H new ATOM 0 HD12 ILE A 31 63.210 -0.277 7.565 1.00 0.00 H new ATOM 0 HD13 ILE A 31 63.548 -1.600 6.423 1.00 0.00 H new ATOM 507 N THR A 32 61.834 -5.744 8.706 1.00 0.00 N ATOM 508 CA THR A 32 62.417 -7.023 9.212 1.00 0.00 C ATOM 509 C THR A 32 62.618 -7.993 8.050 1.00 0.00 C ATOM 510 O THR A 32 62.421 -9.184 8.183 1.00 0.00 O ATOM 511 CB THR A 32 61.479 -7.654 10.242 1.00 0.00 C ATOM 512 OG1 THR A 32 60.178 -7.099 10.105 1.00 0.00 O ATOM 513 CG2 THR A 32 62.011 -7.388 11.648 1.00 0.00 C ATOM 0 H THR A 32 61.763 -5.671 7.691 1.00 0.00 H new ATOM 0 HA THR A 32 63.378 -6.812 9.682 1.00 0.00 H new ATOM 0 HB THR A 32 61.428 -8.730 10.076 1.00 0.00 H new ATOM 0 HG1 THR A 32 59.578 -7.505 10.765 1.00 0.00 H new ATOM 0 HG21 THR A 32 61.342 -7.838 12.381 1.00 0.00 H new ATOM 0 HG22 THR A 32 63.005 -7.823 11.749 1.00 0.00 H new ATOM 0 HG23 THR A 32 62.066 -6.313 11.819 1.00 0.00 H new ATOM 521 N SER A 33 63.022 -7.497 6.916 1.00 0.00 N ATOM 522 CA SER A 33 63.250 -8.400 5.757 1.00 0.00 C ATOM 523 C SER A 33 64.404 -9.349 6.083 1.00 0.00 C ATOM 524 O SER A 33 65.306 -9.011 6.824 1.00 0.00 O ATOM 525 CB SER A 33 63.601 -7.568 4.522 1.00 0.00 C ATOM 526 OG SER A 33 64.117 -8.422 3.510 1.00 0.00 O ATOM 0 H SER A 33 63.204 -6.509 6.742 1.00 0.00 H new ATOM 0 HA SER A 33 62.347 -8.977 5.555 1.00 0.00 H new ATOM 0 HB2 SER A 33 62.716 -7.047 4.157 1.00 0.00 H new ATOM 0 HB3 SER A 33 64.336 -6.806 4.780 1.00 0.00 H new ATOM 0 HG SER A 33 63.900 -8.053 2.628 1.00 0.00 H new ATOM 532 N SER A 34 64.385 -10.534 5.542 1.00 0.00 N ATOM 533 CA SER A 34 65.482 -11.501 5.828 1.00 0.00 C ATOM 534 C SER A 34 66.799 -10.993 5.224 1.00 0.00 C ATOM 535 O SER A 34 67.859 -11.524 5.491 1.00 0.00 O ATOM 536 CB SER A 34 65.134 -12.859 5.218 1.00 0.00 C ATOM 537 OG SER A 34 65.220 -12.776 3.802 1.00 0.00 O ATOM 0 H SER A 34 63.658 -10.876 4.914 1.00 0.00 H new ATOM 0 HA SER A 34 65.598 -11.601 6.907 1.00 0.00 H new ATOM 0 HB2 SER A 34 65.816 -13.623 5.591 1.00 0.00 H new ATOM 0 HB3 SER A 34 64.129 -13.157 5.516 1.00 0.00 H new ATOM 0 HG SER A 34 64.999 -13.646 3.409 1.00 0.00 H new ATOM 543 N LYS A 35 66.741 -9.977 4.402 1.00 0.00 N ATOM 544 CA LYS A 35 67.988 -9.453 3.779 1.00 0.00 C ATOM 545 C LYS A 35 68.471 -8.198 4.523 1.00 0.00 C ATOM 546 O LYS A 35 69.578 -7.738 4.319 1.00 0.00 O ATOM 547 CB LYS A 35 67.710 -9.109 2.313 1.00 0.00 C ATOM 548 CG LYS A 35 68.657 -9.904 1.411 1.00 0.00 C ATOM 549 CD LYS A 35 68.082 -9.967 -0.005 1.00 0.00 C ATOM 550 CE LYS A 35 68.763 -11.095 -0.782 1.00 0.00 C ATOM 551 NZ LYS A 35 70.235 -10.866 -0.801 1.00 0.00 N ATOM 0 H LYS A 35 65.885 -9.490 4.137 1.00 0.00 H new ATOM 0 HA LYS A 35 68.766 -10.214 3.840 1.00 0.00 H new ATOM 0 HB2 LYS A 35 66.674 -9.341 2.065 1.00 0.00 H new ATOM 0 HB3 LYS A 35 67.846 -8.040 2.148 1.00 0.00 H new ATOM 0 HG2 LYS A 35 69.640 -9.434 1.395 1.00 0.00 H new ATOM 0 HG3 LYS A 35 68.791 -10.911 1.805 1.00 0.00 H new ATOM 0 HD2 LYS A 35 67.006 -10.137 0.035 1.00 0.00 H new ATOM 0 HD3 LYS A 35 68.236 -9.016 -0.514 1.00 0.00 H new ATOM 0 HE2 LYS A 35 68.540 -12.056 -0.319 1.00 0.00 H new ATOM 0 HE3 LYS A 35 68.377 -11.134 -1.801 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 70.589 -10.961 -1.774 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 70.442 -9.909 -0.449 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 70.703 -11.567 -0.193 1.00 0.00 H new ATOM 565 N CYS A 36 67.660 -7.638 5.385 1.00 0.00 N ATOM 566 CA CYS A 36 68.097 -6.413 6.123 1.00 0.00 C ATOM 567 C CYS A 36 69.026 -6.806 7.282 1.00 0.00 C ATOM 568 O CYS A 36 68.717 -7.704 8.041 1.00 0.00 O ATOM 569 CB CYS A 36 66.874 -5.670 6.672 1.00 0.00 C ATOM 570 SG CYS A 36 65.979 -4.875 5.308 1.00 0.00 S ATOM 0 H CYS A 36 66.723 -7.972 5.609 1.00 0.00 H new ATOM 0 HA CYS A 36 68.635 -5.759 5.437 1.00 0.00 H new ATOM 0 HB2 CYS A 36 66.217 -6.366 7.194 1.00 0.00 H new ATOM 0 HB3 CYS A 36 67.187 -4.921 7.399 1.00 0.00 H new ATOM 575 N PRO A 37 70.155 -6.119 7.376 1.00 0.00 N ATOM 576 CA PRO A 37 71.139 -6.390 8.418 1.00 0.00 C ATOM 577 C PRO A 37 70.570 -6.073 9.800 1.00 0.00 C ATOM 578 O PRO A 37 71.094 -6.503 10.809 1.00 0.00 O ATOM 579 CB PRO A 37 72.310 -5.446 8.112 1.00 0.00 C ATOM 580 CG PRO A 37 71.906 -4.575 6.886 1.00 0.00 C ATOM 581 CD PRO A 37 70.516 -5.039 6.443 1.00 0.00 C ATOM 0 HA PRO A 37 71.435 -7.439 8.428 1.00 0.00 H new ATOM 0 HB2 PRO A 37 72.529 -4.816 8.974 1.00 0.00 H new ATOM 0 HB3 PRO A 37 73.214 -6.015 7.896 1.00 0.00 H new ATOM 0 HG2 PRO A 37 71.893 -3.518 7.152 1.00 0.00 H new ATOM 0 HG3 PRO A 37 72.627 -4.691 6.077 1.00 0.00 H new ATOM 0 HD2 PRO A 37 69.795 -4.222 6.488 1.00 0.00 H new ATOM 0 HD3 PRO A 37 70.530 -5.396 5.413 1.00 0.00 H new ATOM 589 N LYS A 38 69.528 -5.299 9.861 1.00 0.00 N ATOM 590 CA LYS A 38 68.965 -4.930 11.181 1.00 0.00 C ATOM 591 C LYS A 38 67.459 -4.671 11.073 1.00 0.00 C ATOM 592 O LYS A 38 66.991 -4.040 10.146 1.00 0.00 O ATOM 593 CB LYS A 38 69.656 -3.659 11.680 1.00 0.00 C ATOM 594 CG LYS A 38 70.851 -4.034 12.558 1.00 0.00 C ATOM 595 CD LYS A 38 70.877 -3.136 13.796 1.00 0.00 C ATOM 596 CE LYS A 38 70.987 -4.000 15.055 1.00 0.00 C ATOM 597 NZ LYS A 38 72.327 -3.802 15.677 1.00 0.00 N ATOM 0 H LYS A 38 69.043 -4.907 9.054 1.00 0.00 H new ATOM 0 HA LYS A 38 69.131 -5.752 11.877 1.00 0.00 H new ATOM 0 HB2 LYS A 38 69.988 -3.058 10.834 1.00 0.00 H new ATOM 0 HB3 LYS A 38 68.952 -3.050 12.247 1.00 0.00 H new ATOM 0 HG2 LYS A 38 70.783 -5.080 12.856 1.00 0.00 H new ATOM 0 HG3 LYS A 38 71.778 -3.923 11.996 1.00 0.00 H new ATOM 0 HD2 LYS A 38 71.720 -2.447 13.741 1.00 0.00 H new ATOM 0 HD3 LYS A 38 69.972 -2.530 13.837 1.00 0.00 H new ATOM 0 HE2 LYS A 38 70.202 -3.732 15.763 1.00 0.00 H new ATOM 0 HE3 LYS A 38 70.843 -5.050 14.802 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 72.403 -4.389 16.532 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 73.068 -4.078 15.001 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 72.447 -2.801 15.932 1.00 0.00 H new ATOM 611 N GLU A 39 66.705 -5.116 12.044 1.00 0.00 N ATOM 612 CA GLU A 39 65.239 -4.854 12.035 1.00 0.00 C ATOM 613 C GLU A 39 65.010 -3.388 12.409 1.00 0.00 C ATOM 614 O GLU A 39 65.948 -2.658 12.664 1.00 0.00 O ATOM 615 CB GLU A 39 64.554 -5.754 13.065 1.00 0.00 C ATOM 616 CG GLU A 39 65.054 -7.190 12.902 1.00 0.00 C ATOM 617 CD GLU A 39 64.257 -8.116 13.823 1.00 0.00 C ATOM 618 OE1 GLU A 39 63.154 -7.747 14.191 1.00 0.00 O ATOM 619 OE2 GLU A 39 64.764 -9.179 14.145 1.00 0.00 O ATOM 0 H GLU A 39 67.044 -5.651 12.844 1.00 0.00 H new ATOM 0 HA GLU A 39 64.826 -5.061 11.048 1.00 0.00 H new ATOM 0 HB2 GLU A 39 64.765 -5.397 14.073 1.00 0.00 H new ATOM 0 HB3 GLU A 39 63.473 -5.717 12.933 1.00 0.00 H new ATOM 0 HG2 GLU A 39 64.945 -7.509 11.865 1.00 0.00 H new ATOM 0 HG3 GLU A 39 66.116 -7.246 13.143 1.00 0.00 H new ATOM 626 N ALA A 40 63.784 -2.943 12.449 1.00 0.00 N ATOM 627 CA ALA A 40 63.539 -1.520 12.814 1.00 0.00 C ATOM 628 C ALA A 40 62.045 -1.219 12.801 1.00 0.00 C ATOM 629 O ALA A 40 61.227 -2.074 12.531 1.00 0.00 O ATOM 630 CB ALA A 40 64.235 -0.614 11.799 1.00 0.00 C ATOM 0 H ALA A 40 62.951 -3.496 12.247 1.00 0.00 H new ATOM 0 HA ALA A 40 63.932 -1.340 13.815 1.00 0.00 H new ATOM 0 HB1 ALA A 40 64.059 0.429 12.062 1.00 0.00 H new ATOM 0 HB2 ALA A 40 65.306 -0.814 11.807 1.00 0.00 H new ATOM 0 HB3 ALA A 40 63.837 -0.810 10.803 1.00 0.00 H new ATOM 636 N VAL A 41 61.694 0.008 13.057 1.00 0.00 N ATOM 637 CA VAL A 41 60.267 0.407 13.021 1.00 0.00 C ATOM 638 C VAL A 41 60.138 1.578 12.074 1.00 0.00 C ATOM 639 O VAL A 41 60.795 2.575 12.232 1.00 0.00 O ATOM 640 CB VAL A 41 59.793 0.819 14.434 1.00 0.00 C ATOM 641 CG1 VAL A 41 58.866 2.051 14.355 1.00 0.00 C ATOM 642 CG2 VAL A 41 59.026 -0.336 15.055 1.00 0.00 C ATOM 0 H VAL A 41 62.344 0.758 13.292 1.00 0.00 H new ATOM 0 HA VAL A 41 59.651 -0.427 12.685 1.00 0.00 H new ATOM 0 HB VAL A 41 60.664 1.068 15.040 1.00 0.00 H new ATOM 0 HG11 VAL A 41 58.542 2.327 15.358 1.00 0.00 H new ATOM 0 HG12 VAL A 41 59.406 2.884 13.906 1.00 0.00 H new ATOM 0 HG13 VAL A 41 57.995 1.812 13.745 1.00 0.00 H new ATOM 0 HG21 VAL A 41 58.688 -0.054 16.052 1.00 0.00 H new ATOM 0 HG22 VAL A 41 58.163 -0.576 14.434 1.00 0.00 H new ATOM 0 HG23 VAL A 41 59.676 -1.208 15.125 1.00 0.00 H new ATOM 652 N ILE A 42 59.297 1.489 11.111 1.00 0.00 N ATOM 653 CA ILE A 42 59.159 2.624 10.192 1.00 0.00 C ATOM 654 C ILE A 42 58.135 3.601 10.743 1.00 0.00 C ATOM 655 O ILE A 42 57.032 3.693 10.256 1.00 0.00 O ATOM 656 CB ILE A 42 58.728 2.137 8.827 1.00 0.00 C ATOM 657 CG1 ILE A 42 59.606 0.945 8.419 1.00 0.00 C ATOM 658 CG2 ILE A 42 58.887 3.280 7.824 1.00 0.00 C ATOM 659 CD1 ILE A 42 61.030 1.418 8.149 1.00 0.00 C ATOM 0 H ILE A 42 58.700 0.685 10.918 1.00 0.00 H new ATOM 0 HA ILE A 42 60.121 3.127 10.096 1.00 0.00 H new ATOM 0 HB ILE A 42 57.686 1.819 8.848 1.00 0.00 H new ATOM 0 HG12 ILE A 42 59.606 0.195 9.210 1.00 0.00 H new ATOM 0 HG13 ILE A 42 59.197 0.469 7.528 1.00 0.00 H new ATOM 0 HG21 ILE A 42 58.579 2.941 6.835 1.00 0.00 H new ATOM 0 HG22 ILE A 42 58.265 4.121 8.129 1.00 0.00 H new ATOM 0 HG23 ILE A 42 59.931 3.593 7.792 1.00 0.00 H new ATOM 0 HD11 ILE A 42 61.647 0.567 7.860 1.00 0.00 H new ATOM 0 HD12 ILE A 42 61.023 2.152 7.343 1.00 0.00 H new ATOM 0 HD13 ILE A 42 61.439 1.874 9.051 1.00 0.00 H new ATOM 671 N PHE A 43 58.505 4.339 11.752 1.00 0.00 N ATOM 672 CA PHE A 43 57.575 5.334 12.341 1.00 0.00 C ATOM 673 C PHE A 43 57.255 6.405 11.293 1.00 0.00 C ATOM 674 O PHE A 43 57.867 7.452 11.265 1.00 0.00 O ATOM 675 CB PHE A 43 58.244 6.001 13.545 1.00 0.00 C ATOM 676 CG PHE A 43 58.050 5.153 14.781 1.00 0.00 C ATOM 677 CD1 PHE A 43 56.778 4.615 15.087 1.00 0.00 C ATOM 678 CD2 PHE A 43 59.143 4.908 15.639 1.00 0.00 C ATOM 679 CE1 PHE A 43 56.607 3.831 16.252 1.00 0.00 C ATOM 680 CE2 PHE A 43 58.967 4.127 16.802 1.00 0.00 C ATOM 681 CZ PHE A 43 57.699 3.589 17.105 1.00 0.00 C ATOM 0 H PHE A 43 59.422 4.292 12.196 1.00 0.00 H new ATOM 0 HA PHE A 43 56.658 4.836 12.656 1.00 0.00 H new ATOM 0 HB2 PHE A 43 59.308 6.137 13.351 1.00 0.00 H new ATOM 0 HB3 PHE A 43 57.820 6.992 13.704 1.00 0.00 H new ATOM 0 HD1 PHE A 43 55.939 4.802 14.433 1.00 0.00 H new ATOM 0 HD2 PHE A 43 60.115 5.318 15.406 1.00 0.00 H new ATOM 0 HE1 PHE A 43 55.637 3.418 16.487 1.00 0.00 H new ATOM 0 HE2 PHE A 43 59.803 3.942 17.460 1.00 0.00 H new ATOM 0 HZ PHE A 43 57.566 2.990 17.994 1.00 0.00 H new ATOM 691 N LYS A 44 56.297 6.164 10.437 1.00 0.00 N ATOM 692 CA LYS A 44 55.957 7.186 9.414 1.00 0.00 C ATOM 693 C LYS A 44 55.405 8.406 10.124 1.00 0.00 C ATOM 694 O LYS A 44 54.263 8.428 10.518 1.00 0.00 O ATOM 695 CB LYS A 44 54.893 6.634 8.459 1.00 0.00 C ATOM 696 CG LYS A 44 55.453 6.592 7.036 1.00 0.00 C ATOM 697 CD LYS A 44 54.362 7.004 6.046 1.00 0.00 C ATOM 698 CE LYS A 44 54.616 6.329 4.697 1.00 0.00 C ATOM 699 NZ LYS A 44 53.519 5.361 4.413 1.00 0.00 N ATOM 0 H LYS A 44 55.741 5.309 10.405 1.00 0.00 H new ATOM 0 HA LYS A 44 56.847 7.447 8.841 1.00 0.00 H new ATOM 0 HB2 LYS A 44 54.592 5.634 8.772 1.00 0.00 H new ATOM 0 HB3 LYS A 44 54.001 7.260 8.491 1.00 0.00 H new ATOM 0 HG2 LYS A 44 56.308 7.262 6.951 1.00 0.00 H new ATOM 0 HG3 LYS A 44 55.810 5.589 6.804 1.00 0.00 H new ATOM 0 HD2 LYS A 44 53.382 6.719 6.429 1.00 0.00 H new ATOM 0 HD3 LYS A 44 54.354 8.087 5.927 1.00 0.00 H new ATOM 0 HE2 LYS A 44 54.668 7.078 3.907 1.00 0.00 H new ATOM 0 HE3 LYS A 44 55.576 5.813 4.711 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 53.690 4.901 3.496 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 53.490 4.640 5.162 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 52.610 5.865 4.383 1.00 0.00 H new ATOM 713 N THR A 45 56.211 9.413 10.317 1.00 0.00 N ATOM 714 CA THR A 45 55.726 10.622 11.033 1.00 0.00 C ATOM 715 C THR A 45 54.532 11.229 10.264 1.00 0.00 C ATOM 716 O THR A 45 53.849 10.542 9.534 1.00 0.00 O ATOM 717 CB THR A 45 56.870 11.633 11.147 1.00 0.00 C ATOM 718 OG1 THR A 45 57.588 11.678 9.926 1.00 0.00 O ATOM 719 CG2 THR A 45 57.801 11.201 12.277 1.00 0.00 C ATOM 0 H THR A 45 57.183 9.449 10.010 1.00 0.00 H new ATOM 0 HA THR A 45 55.393 10.356 12.036 1.00 0.00 H new ATOM 0 HB THR A 45 56.469 12.624 11.360 1.00 0.00 H new ATOM 0 HG1 THR A 45 58.262 10.967 9.916 1.00 0.00 H new ATOM 0 HG21 THR A 45 58.620 11.915 12.367 1.00 0.00 H new ATOM 0 HG22 THR A 45 57.245 11.167 13.214 1.00 0.00 H new ATOM 0 HG23 THR A 45 58.204 10.212 12.058 1.00 0.00 H new ATOM 727 N ILE A 46 54.279 12.503 10.409 1.00 0.00 N ATOM 728 CA ILE A 46 53.132 13.116 9.678 1.00 0.00 C ATOM 729 C ILE A 46 53.618 13.668 8.377 1.00 0.00 C ATOM 730 O ILE A 46 52.885 13.759 7.411 1.00 0.00 O ATOM 731 CB ILE A 46 52.531 14.260 10.489 1.00 0.00 C ATOM 732 CG1 ILE A 46 53.665 15.178 11.020 1.00 0.00 C ATOM 733 CG2 ILE A 46 51.696 13.695 11.651 1.00 0.00 C ATOM 734 CD1 ILE A 46 54.096 14.757 12.430 1.00 0.00 C ATOM 0 H ILE A 46 54.813 13.142 10.998 1.00 0.00 H new ATOM 0 HA ILE A 46 52.374 12.350 9.515 1.00 0.00 H new ATOM 0 HB ILE A 46 51.875 14.853 9.851 1.00 0.00 H new ATOM 0 HG12 ILE A 46 54.520 15.133 10.346 1.00 0.00 H new ATOM 0 HG13 ILE A 46 53.324 16.213 11.034 1.00 0.00 H new ATOM 0 HG21 ILE A 46 51.270 14.517 12.226 1.00 0.00 H new ATOM 0 HG22 ILE A 46 50.892 13.075 11.254 1.00 0.00 H new ATOM 0 HG23 ILE A 46 52.334 13.092 12.298 1.00 0.00 H new ATOM 0 HD11 ILE A 46 54.891 15.416 12.779 1.00 0.00 H new ATOM 0 HD12 ILE A 46 53.244 14.826 13.107 1.00 0.00 H new ATOM 0 HD13 ILE A 46 54.459 13.730 12.408 1.00 0.00 H new ATOM 746 N VAL A 47 54.847 14.032 8.329 1.00 0.00 N ATOM 747 CA VAL A 47 55.392 14.571 7.093 1.00 0.00 C ATOM 748 C VAL A 47 55.932 13.418 6.244 1.00 0.00 C ATOM 749 O VAL A 47 56.668 13.618 5.298 1.00 0.00 O ATOM 750 CB VAL A 47 56.494 15.559 7.442 1.00 0.00 C ATOM 751 CG1 VAL A 47 57.724 14.820 7.980 1.00 0.00 C ATOM 752 CG2 VAL A 47 56.860 16.343 6.205 1.00 0.00 C ATOM 0 H VAL A 47 55.504 13.976 9.108 1.00 0.00 H new ATOM 0 HA VAL A 47 54.624 15.090 6.520 1.00 0.00 H new ATOM 0 HB VAL A 47 56.138 16.239 8.216 1.00 0.00 H new ATOM 0 HG11 VAL A 47 58.504 15.541 8.225 1.00 0.00 H new ATOM 0 HG12 VAL A 47 57.451 14.263 8.876 1.00 0.00 H new ATOM 0 HG13 VAL A 47 58.094 14.129 7.222 1.00 0.00 H new ATOM 0 HG21 VAL A 47 57.650 17.054 6.446 1.00 0.00 H new ATOM 0 HG22 VAL A 47 57.210 15.660 5.432 1.00 0.00 H new ATOM 0 HG23 VAL A 47 55.984 16.882 5.843 1.00 0.00 H new ATOM 762 N ALA A 48 55.541 12.204 6.566 1.00 0.00 N ATOM 763 CA ALA A 48 55.990 11.037 5.778 1.00 0.00 C ATOM 764 C ALA A 48 57.476 10.787 6.022 1.00 0.00 C ATOM 765 O ALA A 48 58.146 10.154 5.230 1.00 0.00 O ATOM 766 CB ALA A 48 55.745 11.309 4.305 1.00 0.00 C ATOM 0 H ALA A 48 54.926 11.983 7.349 1.00 0.00 H new ATOM 0 HA ALA A 48 55.431 10.152 6.083 1.00 0.00 H new ATOM 0 HB1 ALA A 48 56.074 10.452 3.717 1.00 0.00 H new ATOM 0 HB2 ALA A 48 54.681 11.477 4.138 1.00 0.00 H new ATOM 0 HB3 ALA A 48 56.304 12.194 4.001 1.00 0.00 H new ATOM 772 N LYS A 49 57.991 11.257 7.120 1.00 0.00 N ATOM 773 CA LYS A 49 59.425 11.023 7.425 1.00 0.00 C ATOM 774 C LYS A 49 59.581 9.635 8.043 1.00 0.00 C ATOM 775 O LYS A 49 59.710 9.489 9.242 1.00 0.00 O ATOM 776 CB LYS A 49 59.921 12.079 8.406 1.00 0.00 C ATOM 777 CG LYS A 49 61.081 12.856 7.780 1.00 0.00 C ATOM 778 CD LYS A 49 61.143 14.259 8.387 1.00 0.00 C ATOM 779 CE LYS A 49 61.899 14.208 9.717 1.00 0.00 C ATOM 780 NZ LYS A 49 62.644 15.484 9.914 1.00 0.00 N ATOM 0 H LYS A 49 57.480 11.794 7.820 1.00 0.00 H new ATOM 0 HA LYS A 49 60.011 11.087 6.508 1.00 0.00 H new ATOM 0 HB2 LYS A 49 59.110 12.761 8.663 1.00 0.00 H new ATOM 0 HB3 LYS A 49 60.245 11.605 9.333 1.00 0.00 H new ATOM 0 HG2 LYS A 49 62.020 12.331 7.954 1.00 0.00 H new ATOM 0 HG3 LYS A 49 60.948 12.921 6.700 1.00 0.00 H new ATOM 0 HD2 LYS A 49 61.641 14.942 7.699 1.00 0.00 H new ATOM 0 HD3 LYS A 49 60.135 14.644 8.544 1.00 0.00 H new ATOM 0 HE2 LYS A 49 61.200 14.052 10.539 1.00 0.00 H new ATOM 0 HE3 LYS A 49 62.591 13.366 9.722 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 63.647 15.276 10.094 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 62.560 16.070 9.059 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 62.245 15.997 10.726 1.00 0.00 H new ATOM 794 N GLU A 50 59.565 8.611 7.234 1.00 0.00 N ATOM 795 CA GLU A 50 59.705 7.230 7.773 1.00 0.00 C ATOM 796 C GLU A 50 60.952 7.156 8.653 1.00 0.00 C ATOM 797 O GLU A 50 62.060 7.326 8.186 1.00 0.00 O ATOM 798 CB GLU A 50 59.838 6.240 6.613 1.00 0.00 C ATOM 799 CG GLU A 50 58.507 6.151 5.863 1.00 0.00 C ATOM 800 CD GLU A 50 58.634 5.152 4.713 1.00 0.00 C ATOM 801 OE1 GLU A 50 59.360 5.444 3.777 1.00 0.00 O ATOM 802 OE2 GLU A 50 58.004 4.108 4.787 1.00 0.00 O ATOM 0 H GLU A 50 59.461 8.672 6.221 1.00 0.00 H new ATOM 0 HA GLU A 50 58.825 6.977 8.365 1.00 0.00 H new ATOM 0 HB2 GLU A 50 60.629 6.562 5.935 1.00 0.00 H new ATOM 0 HB3 GLU A 50 60.122 5.257 6.990 1.00 0.00 H new ATOM 0 HG2 GLU A 50 57.714 5.839 6.543 1.00 0.00 H new ATOM 0 HG3 GLU A 50 58.229 7.132 5.477 1.00 0.00 H new ATOM 809 N ILE A 51 60.784 6.923 9.925 1.00 0.00 N ATOM 810 CA ILE A 51 61.978 6.862 10.825 1.00 0.00 C ATOM 811 C ILE A 51 62.186 5.436 11.323 1.00 0.00 C ATOM 812 O ILE A 51 61.407 4.916 12.089 1.00 0.00 O ATOM 813 CB ILE A 51 61.798 7.777 12.034 1.00 0.00 C ATOM 814 CG1 ILE A 51 60.750 8.848 11.754 1.00 0.00 C ATOM 815 CG2 ILE A 51 63.126 8.457 12.343 1.00 0.00 C ATOM 816 CD1 ILE A 51 60.580 9.697 13.003 1.00 0.00 C ATOM 0 H ILE A 51 59.883 6.773 10.380 1.00 0.00 H new ATOM 0 HA ILE A 51 62.844 7.190 10.250 1.00 0.00 H new ATOM 0 HB ILE A 51 61.467 7.175 12.880 1.00 0.00 H new ATOM 0 HG12 ILE A 51 61.059 9.469 10.913 1.00 0.00 H new ATOM 0 HG13 ILE A 51 59.802 8.387 11.478 1.00 0.00 H new ATOM 0 HG21 ILE A 51 63.007 9.113 13.205 1.00 0.00 H new ATOM 0 HG22 ILE A 51 63.879 7.701 12.563 1.00 0.00 H new ATOM 0 HG23 ILE A 51 63.443 9.045 11.481 1.00 0.00 H new ATOM 0 HD11 ILE A 51 59.833 10.469 12.819 1.00 0.00 H new ATOM 0 HD12 ILE A 51 60.254 9.066 13.830 1.00 0.00 H new ATOM 0 HD13 ILE A 51 61.531 10.166 13.257 1.00 0.00 H new ATOM 828 N CYS A 52 63.247 4.816 10.914 1.00 0.00 N ATOM 829 CA CYS A 52 63.535 3.433 11.373 1.00 0.00 C ATOM 830 C CYS A 52 63.991 3.457 12.826 1.00 0.00 C ATOM 831 O CYS A 52 65.162 3.481 13.117 1.00 0.00 O ATOM 832 CB CYS A 52 64.637 2.856 10.526 1.00 0.00 C ATOM 833 SG CYS A 52 63.917 1.817 9.232 1.00 0.00 S ATOM 0 H CYS A 52 63.937 5.210 10.274 1.00 0.00 H new ATOM 0 HA CYS A 52 62.633 2.827 11.285 1.00 0.00 H new ATOM 0 HB2 CYS A 52 65.225 3.658 10.079 1.00 0.00 H new ATOM 0 HB3 CYS A 52 65.316 2.269 11.144 1.00 0.00 H new ATOM 838 N ALA A 53 63.076 3.448 13.728 1.00 0.00 N ATOM 839 CA ALA A 53 63.435 3.481 15.170 1.00 0.00 C ATOM 840 C ALA A 53 63.666 2.053 15.678 1.00 0.00 C ATOM 841 O ALA A 53 63.023 1.119 15.248 1.00 0.00 O ATOM 842 CB ALA A 53 62.287 4.121 15.947 1.00 0.00 C ATOM 0 H ALA A 53 62.075 3.419 13.535 1.00 0.00 H new ATOM 0 HA ALA A 53 64.348 4.060 15.311 1.00 0.00 H new ATOM 0 HB1 ALA A 53 62.538 4.151 17.007 1.00 0.00 H new ATOM 0 HB2 ALA A 53 62.123 5.135 15.584 1.00 0.00 H new ATOM 0 HB3 ALA A 53 61.380 3.534 15.805 1.00 0.00 H new ATOM 848 N ASP A 54 64.592 1.879 16.581 1.00 0.00 N ATOM 849 CA ASP A 54 64.881 0.512 17.104 1.00 0.00 C ATOM 850 C ASP A 54 63.732 0.049 18.028 1.00 0.00 C ATOM 851 O ASP A 54 63.450 0.696 19.019 1.00 0.00 O ATOM 852 CB ASP A 54 66.189 0.541 17.899 1.00 0.00 C ATOM 853 CG ASP A 54 66.512 -0.867 18.399 1.00 0.00 C ATOM 854 OD1 ASP A 54 66.310 -1.803 17.642 1.00 0.00 O ATOM 855 OD2 ASP A 54 66.955 -0.988 19.529 1.00 0.00 O ATOM 0 H ASP A 54 65.162 2.625 16.980 1.00 0.00 H new ATOM 0 HA ASP A 54 64.971 -0.181 16.268 1.00 0.00 H new ATOM 0 HB2 ASP A 54 67.000 0.911 17.272 1.00 0.00 H new ATOM 0 HB3 ASP A 54 66.100 1.226 18.742 1.00 0.00 H new ATOM 860 N PRO A 55 63.105 -1.072 17.685 1.00 0.00 N ATOM 861 CA PRO A 55 62.009 -1.617 18.493 1.00 0.00 C ATOM 862 C PRO A 55 62.517 -2.011 19.886 1.00 0.00 C ATOM 863 O PRO A 55 61.744 -2.260 20.790 1.00 0.00 O ATOM 864 CB PRO A 55 61.530 -2.865 17.729 1.00 0.00 C ATOM 865 CG PRO A 55 62.440 -3.019 16.471 1.00 0.00 C ATOM 866 CD PRO A 55 63.440 -1.849 16.483 1.00 0.00 C ATOM 0 HA PRO A 55 61.209 -0.891 18.638 1.00 0.00 H new ATOM 0 HB2 PRO A 55 61.596 -3.751 18.361 1.00 0.00 H new ATOM 0 HB3 PRO A 55 60.485 -2.759 17.437 1.00 0.00 H new ATOM 0 HG2 PRO A 55 62.965 -3.974 16.491 1.00 0.00 H new ATOM 0 HG3 PRO A 55 61.842 -3.004 15.560 1.00 0.00 H new ATOM 0 HD2 PRO A 55 64.468 -2.209 16.520 1.00 0.00 H new ATOM 0 HD3 PRO A 55 63.347 -1.242 15.582 1.00 0.00 H new ATOM 874 N LYS A 56 63.812 -2.076 20.065 1.00 0.00 N ATOM 875 CA LYS A 56 64.363 -2.459 21.387 1.00 0.00 C ATOM 876 C LYS A 56 64.506 -1.218 22.276 1.00 0.00 C ATOM 877 O LYS A 56 65.178 -1.246 23.289 1.00 0.00 O ATOM 878 CB LYS A 56 65.734 -3.110 21.198 1.00 0.00 C ATOM 879 CG LYS A 56 65.618 -4.621 21.411 1.00 0.00 C ATOM 880 CD LYS A 56 66.088 -5.351 20.151 1.00 0.00 C ATOM 881 CE LYS A 56 66.142 -6.855 20.423 1.00 0.00 C ATOM 882 NZ LYS A 56 67.336 -7.440 19.750 1.00 0.00 N ATOM 0 H LYS A 56 64.508 -1.879 19.346 1.00 0.00 H new ATOM 0 HA LYS A 56 63.684 -3.165 21.866 1.00 0.00 H new ATOM 0 HB2 LYS A 56 66.112 -2.902 20.197 1.00 0.00 H new ATOM 0 HB3 LYS A 56 66.449 -2.687 21.903 1.00 0.00 H new ATOM 0 HG2 LYS A 56 66.220 -4.926 22.267 1.00 0.00 H new ATOM 0 HG3 LYS A 56 64.586 -4.889 21.636 1.00 0.00 H new ATOM 0 HD2 LYS A 56 65.409 -5.144 19.324 1.00 0.00 H new ATOM 0 HD3 LYS A 56 67.072 -4.989 19.854 1.00 0.00 H new ATOM 0 HE2 LYS A 56 66.190 -7.040 21.496 1.00 0.00 H new ATOM 0 HE3 LYS A 56 65.234 -7.334 20.057 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 67.373 -8.463 19.935 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 67.272 -7.276 18.725 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 68.198 -6.990 20.120 1.00 0.00 H new ATOM 896 N GLN A 57 63.882 -0.128 21.912 1.00 0.00 N ATOM 897 CA GLN A 57 63.989 1.101 22.741 1.00 0.00 C ATOM 898 C GLN A 57 62.876 1.101 23.792 1.00 0.00 C ATOM 899 O GLN A 57 61.984 0.276 23.763 1.00 0.00 O ATOM 900 CB GLN A 57 63.847 2.329 21.843 1.00 0.00 C ATOM 901 CG GLN A 57 65.213 3.000 21.674 1.00 0.00 C ATOM 902 CD GLN A 57 65.345 4.152 22.672 1.00 0.00 C ATOM 903 OE1 GLN A 57 65.171 3.964 23.859 1.00 0.00 O ATOM 904 NE2 GLN A 57 65.651 5.343 22.238 1.00 0.00 N ATOM 0 H GLN A 57 63.304 -0.039 21.076 1.00 0.00 H new ATOM 0 HA GLN A 57 64.958 1.126 23.240 1.00 0.00 H new ATOM 0 HB2 GLN A 57 63.451 2.037 20.870 1.00 0.00 H new ATOM 0 HB3 GLN A 57 63.137 3.031 22.279 1.00 0.00 H new ATOM 0 HG2 GLN A 57 66.009 2.273 21.835 1.00 0.00 H new ATOM 0 HG3 GLN A 57 65.323 3.373 20.656 1.00 0.00 H new ATOM 0 HE21 GLN A 57 65.797 5.501 21.241 1.00 0.00 H new ATOM 0 HE22 GLN A 57 65.744 6.117 22.896 1.00 0.00 H new ATOM 913 N LYS A 58 62.925 2.009 24.725 1.00 0.00 N ATOM 914 CA LYS A 58 61.875 2.049 25.782 1.00 0.00 C ATOM 915 C LYS A 58 60.780 3.041 25.390 1.00 0.00 C ATOM 916 O LYS A 58 59.679 2.991 25.900 1.00 0.00 O ATOM 917 CB LYS A 58 62.503 2.483 27.109 1.00 0.00 C ATOM 918 CG LYS A 58 61.430 2.503 28.200 1.00 0.00 C ATOM 919 CD LYS A 58 60.718 3.859 28.193 1.00 0.00 C ATOM 920 CE LYS A 58 61.000 4.592 29.506 1.00 0.00 C ATOM 921 NZ LYS A 58 60.500 3.777 30.648 1.00 0.00 N ATOM 0 H LYS A 58 63.646 2.726 24.802 1.00 0.00 H new ATOM 0 HA LYS A 58 61.438 1.056 25.890 1.00 0.00 H new ATOM 0 HB2 LYS A 58 63.305 1.798 27.385 1.00 0.00 H new ATOM 0 HB3 LYS A 58 62.950 3.472 27.006 1.00 0.00 H new ATOM 0 HG2 LYS A 58 60.710 1.702 28.032 1.00 0.00 H new ATOM 0 HG3 LYS A 58 61.884 2.324 29.175 1.00 0.00 H new ATOM 0 HD2 LYS A 58 61.062 4.457 27.349 1.00 0.00 H new ATOM 0 HD3 LYS A 58 59.645 3.717 28.067 1.00 0.00 H new ATOM 0 HE2 LYS A 58 62.070 4.769 29.613 1.00 0.00 H new ATOM 0 HE3 LYS A 58 60.514 5.568 29.502 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 60.152 4.407 31.398 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 59.725 3.164 30.324 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 61.273 3.190 31.020 1.00 0.00 H new ATOM 935 N TRP A 59 61.059 3.930 24.477 1.00 0.00 N ATOM 936 CA TRP A 59 60.018 4.899 24.060 1.00 0.00 C ATOM 937 C TRP A 59 59.329 4.367 22.809 1.00 0.00 C ATOM 938 O TRP A 59 58.183 4.660 22.546 1.00 0.00 O ATOM 939 CB TRP A 59 60.662 6.272 23.785 1.00 0.00 C ATOM 940 CG TRP A 59 61.433 6.238 22.503 1.00 0.00 C ATOM 941 CD1 TRP A 59 62.711 5.805 22.370 1.00 0.00 C ATOM 942 CD2 TRP A 59 60.998 6.649 21.181 1.00 0.00 C ATOM 943 NE1 TRP A 59 63.088 5.926 21.041 1.00 0.00 N ATOM 944 CE2 TRP A 59 62.067 6.441 20.267 1.00 0.00 C ATOM 945 CE3 TRP A 59 59.782 7.182 20.681 1.00 0.00 C ATOM 946 CZ2 TRP A 59 61.937 6.751 18.902 1.00 0.00 C ATOM 947 CZ3 TRP A 59 59.652 7.494 19.305 1.00 0.00 C ATOM 948 CH2 TRP A 59 60.734 7.276 18.423 1.00 0.00 C ATOM 0 H TRP A 59 61.959 4.024 24.006 1.00 0.00 H new ATOM 0 HA TRP A 59 59.280 5.023 24.853 1.00 0.00 H new ATOM 0 HB2 TRP A 59 59.890 7.039 23.732 1.00 0.00 H new ATOM 0 HB3 TRP A 59 61.324 6.542 24.608 1.00 0.00 H new ATOM 0 HD1 TRP A 59 63.333 5.428 23.168 1.00 0.00 H new ATOM 0 HE1 TRP A 59 64.006 5.667 20.680 1.00 0.00 H new ATOM 0 HE3 TRP A 59 58.952 7.351 21.352 1.00 0.00 H new ATOM 0 HZ2 TRP A 59 62.763 6.584 18.227 1.00 0.00 H new ATOM 0 HZ3 TRP A 59 58.724 7.899 18.930 1.00 0.00 H new ATOM 0 HH2 TRP A 59 60.631 7.516 17.375 1.00 0.00 H new ATOM 959 N VAL A 60 60.013 3.553 22.053 1.00 0.00 N ATOM 960 CA VAL A 60 59.391 2.965 20.848 1.00 0.00 C ATOM 961 C VAL A 60 58.484 1.803 21.275 1.00 0.00 C ATOM 962 O VAL A 60 57.675 1.326 20.513 1.00 0.00 O ATOM 963 CB VAL A 60 60.487 2.463 19.907 1.00 0.00 C ATOM 964 CG1 VAL A 60 59.857 1.706 18.738 1.00 0.00 C ATOM 965 CG2 VAL A 60 61.266 3.659 19.369 1.00 0.00 C ATOM 0 H VAL A 60 60.979 3.273 22.224 1.00 0.00 H new ATOM 0 HA VAL A 60 58.795 3.714 20.327 1.00 0.00 H new ATOM 0 HB VAL A 60 61.156 1.795 20.450 1.00 0.00 H new ATOM 0 HG11 VAL A 60 60.641 1.350 18.070 1.00 0.00 H new ATOM 0 HG12 VAL A 60 59.291 0.856 19.118 1.00 0.00 H new ATOM 0 HG13 VAL A 60 59.189 2.372 18.191 1.00 0.00 H new ATOM 0 HG21 VAL A 60 62.050 3.310 18.697 1.00 0.00 H new ATOM 0 HG22 VAL A 60 60.590 4.319 18.826 1.00 0.00 H new ATOM 0 HG23 VAL A 60 61.716 4.204 20.199 1.00 0.00 H new ATOM 975 N GLN A 61 58.589 1.367 22.501 1.00 0.00 N ATOM 976 CA GLN A 61 57.698 0.277 22.973 1.00 0.00 C ATOM 977 C GLN A 61 56.334 0.879 23.292 1.00 0.00 C ATOM 978 O GLN A 61 55.314 0.224 23.201 1.00 0.00 O ATOM 979 CB GLN A 61 58.287 -0.364 24.232 1.00 0.00 C ATOM 980 CG GLN A 61 59.011 -1.659 23.855 1.00 0.00 C ATOM 981 CD GLN A 61 58.187 -2.859 24.324 1.00 0.00 C ATOM 982 OE1 GLN A 61 56.996 -2.748 24.538 1.00 0.00 O ATOM 983 NE2 GLN A 61 58.774 -4.012 24.493 1.00 0.00 N ATOM 0 H GLN A 61 59.252 1.719 23.192 1.00 0.00 H new ATOM 0 HA GLN A 61 57.601 -0.489 22.203 1.00 0.00 H new ATOM 0 HB2 GLN A 61 58.980 0.326 24.714 1.00 0.00 H new ATOM 0 HB3 GLN A 61 57.495 -0.574 24.951 1.00 0.00 H new ATOM 0 HG2 GLN A 61 59.158 -1.705 22.776 1.00 0.00 H new ATOM 0 HG3 GLN A 61 60.000 -1.682 24.313 1.00 0.00 H new ATOM 0 HE21 GLN A 61 59.774 -4.106 24.314 1.00 0.00 H new ATOM 0 HE22 GLN A 61 58.233 -4.819 24.804 1.00 0.00 H new ATOM 992 N ASP A 62 56.309 2.136 23.652 1.00 0.00 N ATOM 993 CA ASP A 62 55.019 2.797 23.961 1.00 0.00 C ATOM 994 C ASP A 62 54.429 3.384 22.674 1.00 0.00 C ATOM 995 O ASP A 62 53.239 3.314 22.435 1.00 0.00 O ATOM 996 CB ASP A 62 55.250 3.920 24.975 1.00 0.00 C ATOM 997 CG ASP A 62 53.947 4.207 25.724 1.00 0.00 C ATOM 998 OD1 ASP A 62 52.916 4.273 25.075 1.00 0.00 O ATOM 999 OD2 ASP A 62 54.003 4.357 26.933 1.00 0.00 O ATOM 0 H ASP A 62 57.133 2.730 23.744 1.00 0.00 H new ATOM 0 HA ASP A 62 54.327 2.067 24.381 1.00 0.00 H new ATOM 0 HB2 ASP A 62 56.031 3.634 25.679 1.00 0.00 H new ATOM 0 HB3 ASP A 62 55.595 4.820 24.465 1.00 0.00 H new ATOM 1004 N SER A 63 55.256 3.954 21.839 1.00 0.00 N ATOM 1005 CA SER A 63 54.758 4.537 20.563 1.00 0.00 C ATOM 1006 C SER A 63 54.392 3.410 19.606 1.00 0.00 C ATOM 1007 O SER A 63 53.295 3.340 19.099 1.00 0.00 O ATOM 1008 CB SER A 63 55.861 5.377 19.938 1.00 0.00 C ATOM 1009 OG SER A 63 56.634 5.984 20.964 1.00 0.00 O ATOM 0 H SER A 63 56.261 4.040 21.989 1.00 0.00 H new ATOM 0 HA SER A 63 53.882 5.156 20.758 1.00 0.00 H new ATOM 0 HB2 SER A 63 56.497 4.753 19.310 1.00 0.00 H new ATOM 0 HB3 SER A 63 55.429 6.142 19.293 1.00 0.00 H new ATOM 0 HG SER A 63 57.391 5.404 21.190 1.00 0.00 H new ATOM 1015 N MET A 64 55.317 2.527 19.352 1.00 0.00 N ATOM 1016 CA MET A 64 55.047 1.391 18.426 1.00 0.00 C ATOM 1017 C MET A 64 53.737 0.708 18.822 1.00 0.00 C ATOM 1018 O MET A 64 53.071 0.112 18.007 1.00 0.00 O ATOM 1019 CB MET A 64 56.193 0.385 18.517 1.00 0.00 C ATOM 1020 CG MET A 64 55.944 -0.775 17.551 1.00 0.00 C ATOM 1021 SD MET A 64 56.266 -2.348 18.394 1.00 0.00 S ATOM 1022 CE MET A 64 57.848 -1.890 19.154 1.00 0.00 C ATOM 0 H MET A 64 56.256 2.544 19.749 1.00 0.00 H new ATOM 0 HA MET A 64 54.966 1.763 17.405 1.00 0.00 H new ATOM 0 HB2 MET A 64 57.137 0.873 18.277 1.00 0.00 H new ATOM 0 HB3 MET A 64 56.279 0.009 19.537 1.00 0.00 H new ATOM 0 HG2 MET A 64 54.915 -0.748 17.191 1.00 0.00 H new ATOM 0 HG3 MET A 64 56.590 -0.680 16.678 1.00 0.00 H new ATOM 0 HE1 MET A 64 58.443 -2.787 19.324 1.00 0.00 H new ATOM 0 HE2 MET A 64 58.389 -1.216 18.490 1.00 0.00 H new ATOM 0 HE3 MET A 64 57.664 -1.391 20.105 1.00 0.00 H new ATOM 1032 N ASP A 65 53.360 0.805 20.072 1.00 0.00 N ATOM 1033 CA ASP A 65 52.096 0.183 20.519 1.00 0.00 C ATOM 1034 C ASP A 65 50.950 1.128 20.206 1.00 0.00 C ATOM 1035 O ASP A 65 49.888 0.722 19.778 1.00 0.00 O ATOM 1036 CB ASP A 65 52.154 -0.073 22.027 1.00 0.00 C ATOM 1037 CG ASP A 65 52.342 -1.570 22.284 1.00 0.00 C ATOM 1038 OD1 ASP A 65 51.788 -2.354 21.531 1.00 0.00 O ATOM 1039 OD2 ASP A 65 53.036 -1.907 23.229 1.00 0.00 O ATOM 0 H ASP A 65 53.883 1.293 20.799 1.00 0.00 H new ATOM 0 HA ASP A 65 51.946 -0.765 20.003 1.00 0.00 H new ATOM 0 HB2 ASP A 65 52.976 0.489 22.471 1.00 0.00 H new ATOM 0 HB3 ASP A 65 51.237 0.276 22.501 1.00 0.00 H new ATOM 1044 N HIS A 66 51.167 2.395 20.396 1.00 0.00 N ATOM 1045 CA HIS A 66 50.108 3.386 20.090 1.00 0.00 C ATOM 1046 C HIS A 66 49.710 3.243 18.624 1.00 0.00 C ATOM 1047 O HIS A 66 48.583 3.491 18.246 1.00 0.00 O ATOM 1048 CB HIS A 66 50.638 4.799 20.343 1.00 0.00 C ATOM 1049 CG HIS A 66 49.530 5.795 20.136 1.00 0.00 C ATOM 1050 ND1 HIS A 66 49.284 6.697 19.131 1.00 0.00 N flip ATOM 1051 CD2 HIS A 66 48.493 5.947 21.043 1.00 0.00 C flip ATOM 1052 CE1 HIS A 66 48.116 7.398 19.406 1.00 0.00 C flip ATOM 1053 NE2 HIS A 66 47.678 6.908 20.570 1.00 0.00 N flip ATOM 0 H HIS A 66 52.038 2.788 20.752 1.00 0.00 H new ATOM 0 HA HIS A 66 49.242 3.211 20.728 1.00 0.00 H new ATOM 0 HB2 HIS A 66 51.026 4.877 21.359 1.00 0.00 H new ATOM 0 HB3 HIS A 66 51.466 5.015 19.668 1.00 0.00 H new ATOM 0 HD2 HIS A 66 48.363 5.395 21.962 1.00 0.00 H new ATOM 0 HE1 HIS A 66 47.660 8.173 18.807 1.00 0.00 H new ATOM 0 HE2 HIS A 66 46.830 7.224 21.042 1.00 0.00 H new ATOM 1061 N LEU A 67 50.628 2.823 17.800 1.00 0.00 N ATOM 1062 CA LEU A 67 50.315 2.635 16.360 1.00 0.00 C ATOM 1063 C LEU A 67 49.886 1.193 16.148 1.00 0.00 C ATOM 1064 O LEU A 67 49.079 0.890 15.292 1.00 0.00 O ATOM 1065 CB LEU A 67 51.560 2.940 15.511 1.00 0.00 C ATOM 1066 CG LEU A 67 52.285 4.172 16.073 1.00 0.00 C ATOM 1067 CD1 LEU A 67 53.658 4.300 15.430 1.00 0.00 C ATOM 1068 CD2 LEU A 67 51.481 5.418 15.762 1.00 0.00 C ATOM 0 H LEU A 67 51.587 2.601 18.066 1.00 0.00 H new ATOM 0 HA LEU A 67 49.515 3.311 16.059 1.00 0.00 H new ATOM 0 HB2 LEU A 67 52.231 2.081 15.511 1.00 0.00 H new ATOM 0 HB3 LEU A 67 51.270 3.118 14.475 1.00 0.00 H new ATOM 0 HG LEU A 67 52.394 4.059 17.152 1.00 0.00 H new ATOM 0 HD11 LEU A 67 54.168 5.175 15.832 1.00 0.00 H new ATOM 0 HD12 LEU A 67 54.245 3.407 15.645 1.00 0.00 H new ATOM 0 HD13 LEU A 67 53.546 4.409 14.351 1.00 0.00 H new ATOM 0 HD21 LEU A 67 51.996 6.292 16.161 1.00 0.00 H new ATOM 0 HD22 LEU A 67 51.373 5.522 14.682 1.00 0.00 H new ATOM 0 HD23 LEU A 67 50.495 5.338 16.219 1.00 0.00 H new ATOM 1080 N ASP A 68 50.388 0.301 16.954 1.00 0.00 N ATOM 1081 CA ASP A 68 49.978 -1.111 16.842 1.00 0.00 C ATOM 1082 C ASP A 68 48.502 -1.229 17.222 1.00 0.00 C ATOM 1083 O ASP A 68 47.868 -2.235 16.974 1.00 0.00 O ATOM 1084 CB ASP A 68 50.829 -1.965 17.786 1.00 0.00 C ATOM 1085 CG ASP A 68 51.559 -3.042 16.982 1.00 0.00 C ATOM 1086 OD1 ASP A 68 51.016 -3.473 15.978 1.00 0.00 O ATOM 1087 OD2 ASP A 68 52.649 -3.417 17.382 1.00 0.00 O ATOM 0 H ASP A 68 51.069 0.498 17.688 1.00 0.00 H new ATOM 0 HA ASP A 68 50.121 -1.461 15.820 1.00 0.00 H new ATOM 0 HB2 ASP A 68 51.549 -1.338 18.311 1.00 0.00 H new ATOM 0 HB3 ASP A 68 50.197 -2.428 18.544 1.00 0.00 H new ATOM 1092 N LYS A 69 47.942 -0.198 17.808 1.00 0.00 N ATOM 1093 CA LYS A 69 46.517 -0.248 18.175 1.00 0.00 C ATOM 1094 C LYS A 69 45.860 1.087 17.842 1.00 0.00 C ATOM 1095 O LYS A 69 45.027 1.585 18.573 1.00 0.00 O ATOM 1096 CB LYS A 69 46.374 -0.546 19.674 1.00 0.00 C ATOM 1097 CG LYS A 69 46.926 0.628 20.490 1.00 0.00 C ATOM 1098 CD LYS A 69 47.417 0.122 21.847 1.00 0.00 C ATOM 1099 CE LYS A 69 47.005 1.110 22.940 1.00 0.00 C ATOM 1100 NZ LYS A 69 48.005 1.074 24.044 1.00 0.00 N ATOM 0 H LYS A 69 48.422 0.671 18.043 1.00 0.00 H new ATOM 0 HA LYS A 69 46.025 -1.041 17.611 1.00 0.00 H new ATOM 0 HB2 LYS A 69 45.326 -0.713 19.923 1.00 0.00 H new ATOM 0 HB3 LYS A 69 46.911 -1.460 19.926 1.00 0.00 H new ATOM 0 HG2 LYS A 69 47.744 1.106 19.951 1.00 0.00 H new ATOM 0 HG3 LYS A 69 46.152 1.383 20.630 1.00 0.00 H new ATOM 0 HD2 LYS A 69 46.996 -0.862 22.054 1.00 0.00 H new ATOM 0 HD3 LYS A 69 48.501 0.009 21.834 1.00 0.00 H new ATOM 0 HE2 LYS A 69 46.938 2.117 22.528 1.00 0.00 H new ATOM 0 HE3 LYS A 69 46.016 0.855 23.322 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 47.726 1.745 24.787 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 48.048 0.114 24.442 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 48.941 1.337 23.674 1.00 0.00 H new ATOM 1114 N GLN A 70 46.227 1.664 16.739 1.00 0.00 N ATOM 1115 CA GLN A 70 45.635 2.955 16.343 1.00 0.00 C ATOM 1116 C GLN A 70 44.356 2.711 15.539 1.00 0.00 C ATOM 1117 O GLN A 70 43.534 3.591 15.377 1.00 0.00 O ATOM 1118 CB GLN A 70 46.636 3.737 15.490 1.00 0.00 C ATOM 1119 CG GLN A 70 47.211 4.895 16.308 1.00 0.00 C ATOM 1120 CD GLN A 70 46.998 6.208 15.555 1.00 0.00 C ATOM 1121 OE1 GLN A 70 47.889 7.031 15.481 1.00 0.00 O ATOM 1122 NE2 GLN A 70 45.845 6.442 14.989 1.00 0.00 N ATOM 0 H GLN A 70 46.920 1.289 16.091 1.00 0.00 H new ATOM 0 HA GLN A 70 45.394 3.530 17.237 1.00 0.00 H new ATOM 0 HB2 GLN A 70 47.439 3.079 15.158 1.00 0.00 H new ATOM 0 HB3 GLN A 70 46.146 4.119 14.594 1.00 0.00 H new ATOM 0 HG2 GLN A 70 46.727 4.940 17.283 1.00 0.00 H new ATOM 0 HG3 GLN A 70 48.274 4.735 16.487 1.00 0.00 H new ATOM 0 HE21 GLN A 70 45.097 5.751 15.051 1.00 0.00 H new ATOM 0 HE22 GLN A 70 45.692 7.315 14.485 1.00 0.00 H new ATOM 1131 N THR A 71 44.184 1.524 15.031 1.00 0.00 N ATOM 1132 CA THR A 71 42.971 1.221 14.240 1.00 0.00 C ATOM 1133 C THR A 71 42.119 0.191 14.983 1.00 0.00 C ATOM 1134 O THR A 71 41.563 -0.714 14.392 1.00 0.00 O ATOM 1135 CB THR A 71 43.379 0.656 12.879 1.00 0.00 C ATOM 1136 OG1 THR A 71 42.215 0.304 12.144 1.00 0.00 O ATOM 1137 CG2 THR A 71 44.249 -0.584 13.084 1.00 0.00 C ATOM 0 H THR A 71 44.839 0.749 15.133 1.00 0.00 H new ATOM 0 HA THR A 71 42.394 2.135 14.098 1.00 0.00 H new ATOM 0 HB THR A 71 43.943 1.408 12.326 1.00 0.00 H new ATOM 0 HG1 THR A 71 41.711 -0.377 12.636 1.00 0.00 H new ATOM 0 HG21 THR A 71 44.541 -0.988 12.115 1.00 0.00 H new ATOM 0 HG22 THR A 71 45.142 -0.313 13.648 1.00 0.00 H new ATOM 0 HG23 THR A 71 43.686 -1.336 13.636 1.00 0.00 H new ATOM 1145 N GLN A 72 42.018 0.314 16.277 1.00 0.00 N ATOM 1146 CA GLN A 72 41.215 -0.657 17.056 1.00 0.00 C ATOM 1147 C GLN A 72 39.764 -0.177 17.133 1.00 0.00 C ATOM 1148 O GLN A 72 39.434 0.716 17.889 1.00 0.00 O ATOM 1149 CB GLN A 72 41.788 -0.777 18.469 1.00 0.00 C ATOM 1150 CG GLN A 72 42.864 -1.865 18.492 1.00 0.00 C ATOM 1151 CD GLN A 72 42.430 -2.992 19.431 1.00 0.00 C ATOM 1152 OE1 GLN A 72 41.708 -2.763 20.381 1.00 0.00 O ATOM 1153 NE2 GLN A 72 42.843 -4.209 19.203 1.00 0.00 N ATOM 0 H GLN A 72 42.461 1.050 16.827 1.00 0.00 H new ATOM 0 HA GLN A 72 41.249 -1.630 16.566 1.00 0.00 H new ATOM 0 HB2 GLN A 72 42.213 0.176 18.783 1.00 0.00 H new ATOM 0 HB3 GLN A 72 40.994 -1.020 19.175 1.00 0.00 H new ATOM 0 HG2 GLN A 72 43.023 -2.256 17.487 1.00 0.00 H new ATOM 0 HG3 GLN A 72 43.813 -1.445 18.825 1.00 0.00 H new ATOM 0 HE21 GLN A 72 43.449 -4.401 18.405 1.00 0.00 H new ATOM 0 HE22 GLN A 72 42.560 -4.968 19.822 1.00 0.00 H new ATOM 1162 N THR A 73 38.895 -0.763 16.357 1.00 0.00 N ATOM 1163 CA THR A 73 37.467 -0.342 16.384 1.00 0.00 C ATOM 1164 C THR A 73 36.605 -1.492 16.935 1.00 0.00 C ATOM 1165 O THR A 73 36.111 -2.305 16.179 1.00 0.00 O ATOM 1166 CB THR A 73 37.012 0.000 14.964 1.00 0.00 C ATOM 1167 OG1 THR A 73 37.790 1.078 14.465 1.00 0.00 O ATOM 1168 CG2 THR A 73 35.537 0.400 14.984 1.00 0.00 C ATOM 0 H THR A 73 39.113 -1.516 15.705 1.00 0.00 H new ATOM 0 HA THR A 73 37.357 0.534 17.023 1.00 0.00 H new ATOM 0 HB THR A 73 37.143 -0.870 14.320 1.00 0.00 H new ATOM 0 HG1 THR A 73 37.500 1.297 13.555 1.00 0.00 H new ATOM 0 HG21 THR A 73 35.212 0.644 13.972 1.00 0.00 H new ATOM 0 HG22 THR A 73 34.941 -0.428 15.367 1.00 0.00 H new ATOM 0 HG23 THR A 73 35.405 1.270 15.627 1.00 0.00 H new ATOM 1176 N PRO A 74 36.451 -1.529 18.249 1.00 0.00 N ATOM 1177 CA PRO A 74 35.656 -2.573 18.901 1.00 0.00 C ATOM 1178 C PRO A 74 34.211 -2.532 18.396 1.00 0.00 C ATOM 1179 O PRO A 74 33.423 -1.702 18.805 1.00 0.00 O ATOM 1180 CB PRO A 74 35.713 -2.241 20.402 1.00 0.00 C ATOM 1181 CG PRO A 74 36.595 -0.961 20.562 1.00 0.00 C ATOM 1182 CD PRO A 74 37.053 -0.541 19.154 1.00 0.00 C ATOM 0 HA PRO A 74 36.037 -3.572 18.691 1.00 0.00 H new ATOM 0 HB2 PRO A 74 34.711 -2.069 20.796 1.00 0.00 H new ATOM 0 HB3 PRO A 74 36.138 -3.073 20.964 1.00 0.00 H new ATOM 0 HG2 PRO A 74 36.027 -0.160 21.036 1.00 0.00 H new ATOM 0 HG3 PRO A 74 37.454 -1.164 21.201 1.00 0.00 H new ATOM 0 HD2 PRO A 74 36.719 0.469 18.915 1.00 0.00 H new ATOM 0 HD3 PRO A 74 38.140 -0.544 19.075 1.00 0.00 H new ATOM 1190 N LYS A 75 33.858 -3.422 17.510 1.00 0.00 N ATOM 1191 CA LYS A 75 32.464 -3.435 16.981 1.00 0.00 C ATOM 1192 C LYS A 75 31.484 -3.693 18.127 1.00 0.00 C ATOM 1193 O LYS A 75 31.356 -4.802 18.608 1.00 0.00 O ATOM 1194 CB LYS A 75 32.328 -4.542 15.933 1.00 0.00 C ATOM 1195 CG LYS A 75 32.616 -3.970 14.544 1.00 0.00 C ATOM 1196 CD LYS A 75 32.821 -5.117 13.553 1.00 0.00 C ATOM 1197 CE LYS A 75 34.317 -5.400 13.404 1.00 0.00 C ATOM 1198 NZ LYS A 75 34.699 -6.537 14.290 1.00 0.00 N ATOM 0 H LYS A 75 34.474 -4.141 17.129 1.00 0.00 H new ATOM 0 HA LYS A 75 32.240 -2.471 16.524 1.00 0.00 H new ATOM 0 HB2 LYS A 75 33.021 -5.354 16.154 1.00 0.00 H new ATOM 0 HB3 LYS A 75 31.323 -4.964 15.963 1.00 0.00 H new ATOM 0 HG2 LYS A 75 31.788 -3.339 14.220 1.00 0.00 H new ATOM 0 HG3 LYS A 75 33.504 -3.339 14.576 1.00 0.00 H new ATOM 0 HD2 LYS A 75 32.304 -6.011 13.902 1.00 0.00 H new ATOM 0 HD3 LYS A 75 32.391 -4.857 12.586 1.00 0.00 H new ATOM 0 HE2 LYS A 75 34.551 -5.639 12.367 1.00 0.00 H new ATOM 0 HE3 LYS A 75 34.894 -4.512 13.665 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 35.619 -6.917 13.990 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 34.766 -6.204 15.273 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 33.979 -7.284 14.226 1.00 0.00 H new ATOM 1212 N THR A 76 30.794 -2.679 18.569 1.00 0.00 N ATOM 1213 CA THR A 76 29.824 -2.867 19.683 1.00 0.00 C ATOM 1214 C THR A 76 28.403 -2.932 19.118 1.00 0.00 C ATOM 1215 O THR A 76 28.092 -2.125 18.257 1.00 0.00 O ATOM 1216 CB THR A 76 29.932 -1.693 20.659 1.00 0.00 C ATOM 1217 OG1 THR A 76 31.286 -1.269 20.739 1.00 0.00 O ATOM 1218 CG2 THR A 76 29.451 -2.131 22.043 1.00 0.00 C ATOM 1219 OXT THR A 76 27.651 -3.786 19.557 1.00 0.00 O ATOM 0 H THR A 76 30.860 -1.728 18.207 1.00 0.00 H new ATOM 0 HA THR A 76 30.049 -3.796 20.207 1.00 0.00 H new ATOM 0 HB THR A 76 29.312 -0.869 20.306 1.00 0.00 H new ATOM 0 HG1 THR A 76 31.357 -0.516 21.362 1.00 0.00 H new ATOM 0 HG21 THR A 76 29.529 -1.294 22.737 1.00 0.00 H new ATOM 0 HG22 THR A 76 28.412 -2.456 21.981 1.00 0.00 H new ATOM 0 HG23 THR A 76 30.069 -2.956 22.399 1.00 0.00 H new TER 1227 THR A 76 ATOM 1228 N GLN B 1 70.353 21.204 7.386 1.00 0.00 N ATOM 1229 CA GLN B 1 71.125 19.942 7.567 1.00 0.00 C ATOM 1230 C GLN B 1 70.161 18.745 7.550 1.00 0.00 C ATOM 1231 O GLN B 1 68.986 18.898 7.821 1.00 0.00 O ATOM 1232 CB GLN B 1 71.863 19.984 8.907 1.00 0.00 C ATOM 1233 CG GLN B 1 70.873 20.324 10.024 1.00 0.00 C ATOM 1234 CD GLN B 1 71.629 20.919 11.213 1.00 0.00 C ATOM 1235 OE1 GLN B 1 71.456 20.487 12.335 1.00 0.00 O ATOM 1236 NE2 GLN B 1 72.467 21.900 11.013 1.00 0.00 N ATOM 0 H1 GLN B 1 70.741 21.941 8.009 1.00 0.00 H new ATOM 0 H2 GLN B 1 70.424 21.515 6.396 1.00 0.00 H new ATOM 0 H3 GLN B 1 69.355 21.038 7.626 1.00 0.00 H new ATOM 0 HA GLN B 1 71.847 19.838 6.757 1.00 0.00 H new ATOM 0 HB2 GLN B 1 72.335 19.021 9.105 1.00 0.00 H new ATOM 0 HB3 GLN B 1 72.659 20.728 8.873 1.00 0.00 H new ATOM 0 HG2 GLN B 1 70.129 21.033 9.661 1.00 0.00 H new ATOM 0 HG3 GLN B 1 70.335 19.428 10.333 1.00 0.00 H new ATOM 0 HE21 GLN B 1 72.612 22.263 10.071 1.00 0.00 H new ATOM 0 HE22 GLN B 1 72.977 22.304 11.799 1.00 0.00 H new ATOM 1247 N PRO B 2 70.690 17.578 7.228 1.00 0.00 N ATOM 1248 CA PRO B 2 69.886 16.355 7.171 1.00 0.00 C ATOM 1249 C PRO B 2 69.274 16.056 8.543 1.00 0.00 C ATOM 1250 O PRO B 2 69.858 15.367 9.356 1.00 0.00 O ATOM 1251 CB PRO B 2 70.873 15.246 6.767 1.00 0.00 C ATOM 1252 CG PRO B 2 72.276 15.909 6.596 1.00 0.00 C ATOM 1253 CD PRO B 2 72.113 17.409 6.904 1.00 0.00 C ATOM 0 HA PRO B 2 69.058 16.440 6.467 1.00 0.00 H new ATOM 0 HB2 PRO B 2 70.907 14.467 7.528 1.00 0.00 H new ATOM 0 HB3 PRO B 2 70.557 14.771 5.838 1.00 0.00 H new ATOM 0 HG2 PRO B 2 73.001 15.454 7.271 1.00 0.00 H new ATOM 0 HG3 PRO B 2 72.649 15.763 5.582 1.00 0.00 H new ATOM 0 HD2 PRO B 2 72.746 17.712 7.738 1.00 0.00 H new ATOM 0 HD3 PRO B 2 72.398 18.021 6.048 1.00 0.00 H new ATOM 1261 N ASP B 3 68.101 16.567 8.806 1.00 0.00 N ATOM 1262 CA ASP B 3 67.454 16.310 10.115 1.00 0.00 C ATOM 1263 C ASP B 3 66.625 15.027 10.029 1.00 0.00 C ATOM 1264 O ASP B 3 65.470 14.992 10.403 1.00 0.00 O ATOM 1265 CB ASP B 3 66.547 17.485 10.476 1.00 0.00 C ATOM 1266 CG ASP B 3 65.877 17.219 11.825 1.00 0.00 C ATOM 1267 OD1 ASP B 3 66.568 16.785 12.731 1.00 0.00 O ATOM 1268 OD2 ASP B 3 64.685 17.453 11.929 1.00 0.00 O ATOM 0 H ASP B 3 67.565 17.153 8.165 1.00 0.00 H new ATOM 0 HA ASP B 3 68.219 16.196 10.884 1.00 0.00 H new ATOM 0 HB2 ASP B 3 67.129 18.406 10.522 1.00 0.00 H new ATOM 0 HB3 ASP B 3 65.790 17.624 9.704 1.00 0.00 H new ATOM 1273 N ALA B 4 67.211 13.973 9.538 1.00 0.00 N ATOM 1274 CA ALA B 4 66.473 12.687 9.420 1.00 0.00 C ATOM 1275 C ALA B 4 67.439 11.612 8.931 1.00 0.00 C ATOM 1276 O ALA B 4 67.425 11.225 7.779 1.00 0.00 O ATOM 1277 CB ALA B 4 65.326 12.841 8.419 1.00 0.00 C ATOM 0 H ALA B 4 68.177 13.947 9.211 1.00 0.00 H new ATOM 0 HA ALA B 4 66.062 12.405 10.389 1.00 0.00 H new ATOM 0 HB1 ALA B 4 64.787 11.897 8.335 1.00 0.00 H new ATOM 0 HB2 ALA B 4 64.644 13.618 8.764 1.00 0.00 H new ATOM 0 HB3 ALA B 4 65.728 13.117 7.444 1.00 0.00 H new ATOM 1283 N ILE B 5 68.296 11.144 9.792 1.00 0.00 N ATOM 1284 CA ILE B 5 69.286 10.118 9.376 1.00 0.00 C ATOM 1285 C ILE B 5 68.788 8.724 9.755 1.00 0.00 C ATOM 1286 O ILE B 5 69.285 7.727 9.268 1.00 0.00 O ATOM 1287 CB ILE B 5 70.616 10.398 10.065 1.00 0.00 C ATOM 1288 CG1 ILE B 5 71.208 11.696 9.516 1.00 0.00 C ATOM 1289 CG2 ILE B 5 71.578 9.252 9.798 1.00 0.00 C ATOM 1290 CD1 ILE B 5 71.562 12.619 10.677 1.00 0.00 C ATOM 0 H ILE B 5 68.353 11.430 10.770 1.00 0.00 H new ATOM 0 HA ILE B 5 69.418 10.160 8.295 1.00 0.00 H new ATOM 0 HB ILE B 5 70.456 10.494 11.139 1.00 0.00 H new ATOM 0 HG12 ILE B 5 72.097 11.481 8.923 1.00 0.00 H new ATOM 0 HG13 ILE B 5 70.493 12.184 8.854 1.00 0.00 H new ATOM 0 HG21 ILE B 5 72.529 9.453 10.291 1.00 0.00 H new ATOM 0 HG22 ILE B 5 71.156 8.325 10.187 1.00 0.00 H new ATOM 0 HG23 ILE B 5 71.739 9.155 8.724 1.00 0.00 H new ATOM 0 HD11 ILE B 5 71.985 13.546 10.289 1.00 0.00 H new ATOM 0 HD12 ILE B 5 70.663 12.842 11.251 1.00 0.00 H new ATOM 0 HD13 ILE B 5 72.292 12.129 11.322 1.00 0.00 H new ATOM 1302 N ASN B 6 67.797 8.640 10.584 1.00 0.00 N ATOM 1303 CA ASN B 6 67.255 7.304 10.940 1.00 0.00 C ATOM 1304 C ASN B 6 66.162 6.983 9.940 1.00 0.00 C ATOM 1305 O ASN B 6 65.009 6.891 10.277 1.00 0.00 O ATOM 1306 CB ASN B 6 66.660 7.282 12.375 1.00 0.00 C ATOM 1307 CG ASN B 6 66.733 8.668 13.034 1.00 0.00 C ATOM 1308 OD1 ASN B 6 65.913 9.607 12.640 1.00 0.00 O flip ATOM 1309 ND2 ASN B 6 67.542 8.895 13.910 1.00 0.00 N flip ATOM 0 H ASN B 6 67.338 9.433 11.031 1.00 0.00 H new ATOM 0 HA ASN B 6 68.060 6.570 10.914 1.00 0.00 H new ATOM 0 HB2 ASN B 6 65.622 6.951 12.335 1.00 0.00 H new ATOM 0 HB3 ASN B 6 67.202 6.559 12.984 1.00 0.00 H new ATOM 0 HD21 ASN B 6 68.181 8.162 14.216 1.00 0.00 H new ATOM 0 HD22 ASN B 6 67.583 9.819 14.340 1.00 0.00 H new ATOM 1316 N ALA B 7 66.511 6.896 8.693 1.00 0.00 N ATOM 1317 CA ALA B 7 65.483 6.651 7.650 1.00 0.00 C ATOM 1318 C ALA B 7 65.619 5.241 7.069 1.00 0.00 C ATOM 1319 O ALA B 7 66.717 4.794 6.800 1.00 0.00 O ATOM 1320 CB ALA B 7 65.680 7.644 6.507 1.00 0.00 C ATOM 0 H ALA B 7 67.467 6.984 8.348 1.00 0.00 H new ATOM 0 HA ALA B 7 64.501 6.765 8.109 1.00 0.00 H new ATOM 0 HB1 ALA B 7 64.927 7.468 5.738 1.00 0.00 H new ATOM 0 HB2 ALA B 7 65.580 8.661 6.887 1.00 0.00 H new ATOM 0 HB3 ALA B 7 66.674 7.513 6.078 1.00 0.00 H new ATOM 1326 N PRO B 8 64.487 4.612 6.793 1.00 0.00 N ATOM 1327 CA PRO B 8 64.485 3.320 6.134 1.00 0.00 C ATOM 1328 C PRO B 8 64.958 3.537 4.711 1.00 0.00 C ATOM 1329 O PRO B 8 64.228 4.026 3.870 1.00 0.00 O ATOM 1330 CB PRO B 8 63.029 2.856 6.149 1.00 0.00 C ATOM 1331 CG PRO B 8 62.182 4.026 6.733 1.00 0.00 C ATOM 1332 CD PRO B 8 63.161 5.139 7.134 1.00 0.00 C ATOM 0 HA PRO B 8 65.130 2.583 6.613 1.00 0.00 H new ATOM 0 HB2 PRO B 8 62.695 2.603 5.143 1.00 0.00 H new ATOM 0 HB3 PRO B 8 62.917 1.958 6.757 1.00 0.00 H new ATOM 0 HG2 PRO B 8 61.468 4.390 5.995 1.00 0.00 H new ATOM 0 HG3 PRO B 8 61.606 3.691 7.596 1.00 0.00 H new ATOM 0 HD2 PRO B 8 62.952 6.063 6.595 1.00 0.00 H new ATOM 0 HD3 PRO B 8 63.087 5.367 8.197 1.00 0.00 H new ATOM 1340 N VAL B 9 66.187 3.261 4.451 1.00 0.00 N ATOM 1341 CA VAL B 9 66.734 3.538 3.107 1.00 0.00 C ATOM 1342 C VAL B 9 66.495 2.337 2.186 1.00 0.00 C ATOM 1343 O VAL B 9 67.154 1.321 2.278 1.00 0.00 O ATOM 1344 CB VAL B 9 68.223 3.800 3.259 1.00 0.00 C ATOM 1345 CG1 VAL B 9 68.876 2.574 3.869 1.00 0.00 C ATOM 1346 CG2 VAL B 9 68.837 4.100 1.900 1.00 0.00 C ATOM 0 H VAL B 9 66.846 2.852 5.114 1.00 0.00 H new ATOM 0 HA VAL B 9 66.242 4.404 2.664 1.00 0.00 H new ATOM 0 HB VAL B 9 68.383 4.660 3.909 1.00 0.00 H new ATOM 0 HG11 VAL B 9 69.946 2.750 3.983 1.00 0.00 H new ATOM 0 HG12 VAL B 9 68.435 2.375 4.846 1.00 0.00 H new ATOM 0 HG13 VAL B 9 68.717 1.715 3.217 1.00 0.00 H new ATOM 0 HG21 VAL B 9 69.905 4.287 2.016 1.00 0.00 H new ATOM 0 HG22 VAL B 9 68.688 3.248 1.237 1.00 0.00 H new ATOM 0 HG23 VAL B 9 68.359 4.981 1.471 1.00 0.00 H new ATOM 1356 N THR B 10 65.545 2.445 1.299 1.00 0.00 N ATOM 1357 CA THR B 10 65.257 1.312 0.382 1.00 0.00 C ATOM 1358 C THR B 10 66.441 1.094 -0.556 1.00 0.00 C ATOM 1359 O THR B 10 66.686 1.874 -1.454 1.00 0.00 O ATOM 1360 CB THR B 10 64.008 1.622 -0.441 1.00 0.00 C ATOM 1361 OG1 THR B 10 63.002 2.161 0.406 1.00 0.00 O ATOM 1362 CG2 THR B 10 63.496 0.334 -1.088 1.00 0.00 C ATOM 0 H THR B 10 64.957 3.269 1.171 1.00 0.00 H new ATOM 0 HA THR B 10 65.090 0.410 0.970 1.00 0.00 H new ATOM 0 HB THR B 10 64.253 2.348 -1.217 1.00 0.00 H new ATOM 0 HG1 THR B 10 62.202 2.361 -0.123 1.00 0.00 H new ATOM 0 HG21 THR B 10 62.605 0.552 -1.676 1.00 0.00 H new ATOM 0 HG22 THR B 10 64.268 -0.078 -1.738 1.00 0.00 H new ATOM 0 HG23 THR B 10 63.250 -0.390 -0.312 1.00 0.00 H new ATOM 1370 N CYS B 11 67.174 0.033 -0.362 1.00 0.00 N ATOM 1371 CA CYS B 11 68.338 -0.238 -1.253 1.00 0.00 C ATOM 1372 C CYS B 11 68.268 -1.674 -1.767 1.00 0.00 C ATOM 1373 O CYS B 11 67.318 -2.389 -1.521 1.00 0.00 O ATOM 1374 CB CYS B 11 69.640 -0.039 -0.482 1.00 0.00 C ATOM 1375 SG CYS B 11 69.595 1.552 0.367 1.00 0.00 S ATOM 0 H CYS B 11 67.018 -0.657 0.373 1.00 0.00 H new ATOM 0 HA CYS B 11 68.309 0.453 -2.096 1.00 0.00 H new ATOM 0 HB2 CYS B 11 69.775 -0.845 0.239 1.00 0.00 H new ATOM 0 HB3 CYS B 11 70.489 -0.076 -1.164 1.00 0.00 H new ATOM 1380 N CYS B 12 69.266 -2.098 -2.489 1.00 0.00 N ATOM 1381 CA CYS B 12 69.260 -3.490 -3.034 1.00 0.00 C ATOM 1382 C CYS B 12 70.540 -4.213 -2.596 1.00 0.00 C ATOM 1383 O CYS B 12 71.342 -3.685 -1.851 1.00 0.00 O ATOM 1384 CB CYS B 12 69.220 -3.453 -4.574 1.00 0.00 C ATOM 1385 SG CYS B 12 68.309 -1.994 -5.149 1.00 0.00 S ATOM 0 H CYS B 12 70.088 -1.543 -2.727 1.00 0.00 H new ATOM 0 HA CYS B 12 68.381 -4.013 -2.656 1.00 0.00 H new ATOM 0 HB2 CYS B 12 70.235 -3.435 -4.970 1.00 0.00 H new ATOM 0 HB3 CYS B 12 68.746 -4.358 -4.954 1.00 0.00 H new ATOM 1390 N TYR B 13 70.750 -5.406 -3.085 1.00 0.00 N ATOM 1391 CA TYR B 13 71.994 -6.156 -2.738 1.00 0.00 C ATOM 1392 C TYR B 13 72.529 -6.830 -4.002 1.00 0.00 C ATOM 1393 O TYR B 13 73.706 -6.779 -4.299 1.00 0.00 O ATOM 1394 CB TYR B 13 71.686 -7.232 -1.690 1.00 0.00 C ATOM 1395 CG TYR B 13 71.389 -6.588 -0.354 1.00 0.00 C ATOM 1396 CD1 TYR B 13 72.131 -5.462 0.058 1.00 0.00 C ATOM 1397 CD2 TYR B 13 70.369 -7.107 0.481 1.00 0.00 C ATOM 1398 CE1 TYR B 13 71.859 -4.854 1.299 1.00 0.00 C ATOM 1399 CE2 TYR B 13 70.100 -6.498 1.725 1.00 0.00 C ATOM 1400 CZ TYR B 13 70.843 -5.373 2.135 1.00 0.00 C ATOM 1401 OH TYR B 13 70.580 -4.780 3.349 1.00 0.00 O ATOM 0 H TYR B 13 70.112 -5.896 -3.712 1.00 0.00 H new ATOM 0 HA TYR B 13 72.733 -5.464 -2.333 1.00 0.00 H new ATOM 0 HB2 TYR B 13 70.833 -7.830 -2.012 1.00 0.00 H new ATOM 0 HB3 TYR B 13 72.534 -7.911 -1.595 1.00 0.00 H new ATOM 0 HD1 TYR B 13 72.908 -5.066 -0.578 1.00 0.00 H new ATOM 0 HD2 TYR B 13 69.798 -7.968 0.166 1.00 0.00 H new ATOM 0 HE1 TYR B 13 72.427 -3.991 1.613 1.00 0.00 H new ATOM 0 HE2 TYR B 13 69.324 -6.894 2.363 1.00 0.00 H new ATOM 0 HH TYR B 13 69.617 -4.617 3.432 1.00 0.00 H new ATOM 1411 N ASN B 14 71.662 -7.450 -4.753 1.00 0.00 N ATOM 1412 CA ASN B 14 72.096 -8.122 -6.008 1.00 0.00 C ATOM 1413 C ASN B 14 71.397 -7.458 -7.189 1.00 0.00 C ATOM 1414 O ASN B 14 70.740 -6.446 -7.040 1.00 0.00 O ATOM 1415 CB ASN B 14 71.710 -9.601 -5.950 1.00 0.00 C ATOM 1416 CG ASN B 14 72.381 -10.252 -4.743 1.00 0.00 C ATOM 1417 OD1 ASN B 14 71.694 -10.423 -3.650 1.00 0.00 O flip ATOM 1418 ND2 ASN B 14 73.541 -10.609 -4.796 1.00 0.00 N flip ATOM 0 H ASN B 14 70.665 -7.520 -4.549 1.00 0.00 H new ATOM 0 HA ASN B 14 73.177 -8.036 -6.123 1.00 0.00 H new ATOM 0 HB2 ASN B 14 70.627 -9.703 -5.877 1.00 0.00 H new ATOM 0 HB3 ASN B 14 72.017 -10.105 -6.867 1.00 0.00 H new ATOM 0 HD21 ASN B 14 74.077 -10.474 -5.653 1.00 0.00 H new ATOM 0 HD22 ASN B 14 73.978 -11.044 -3.983 1.00 0.00 H new ATOM 1425 N PHE B 15 71.526 -8.008 -8.364 1.00 0.00 N ATOM 1426 CA PHE B 15 70.855 -7.387 -9.538 1.00 0.00 C ATOM 1427 C PHE B 15 70.473 -8.455 -10.558 1.00 0.00 C ATOM 1428 O PHE B 15 71.316 -9.147 -11.092 1.00 0.00 O ATOM 1429 CB PHE B 15 71.798 -6.378 -10.200 1.00 0.00 C ATOM 1430 CG PHE B 15 72.171 -5.299 -9.213 1.00 0.00 C ATOM 1431 CD1 PHE B 15 73.240 -5.504 -8.312 1.00 0.00 C ATOM 1432 CD2 PHE B 15 71.446 -4.087 -9.182 1.00 0.00 C ATOM 1433 CE1 PHE B 15 73.584 -4.499 -7.382 1.00 0.00 C ATOM 1434 CE2 PHE B 15 71.789 -3.081 -8.252 1.00 0.00 C ATOM 1435 CZ PHE B 15 72.859 -3.288 -7.352 1.00 0.00 C ATOM 0 H PHE B 15 72.062 -8.853 -8.561 1.00 0.00 H new ATOM 0 HA PHE B 15 69.953 -6.880 -9.193 1.00 0.00 H new ATOM 0 HB2 PHE B 15 72.696 -6.885 -10.555 1.00 0.00 H new ATOM 0 HB3 PHE B 15 71.317 -5.935 -11.072 1.00 0.00 H new ATOM 0 HD1 PHE B 15 73.795 -6.430 -8.335 1.00 0.00 H new ATOM 0 HD2 PHE B 15 70.629 -3.930 -9.870 1.00 0.00 H new ATOM 0 HE1 PHE B 15 74.401 -4.657 -6.694 1.00 0.00 H new ATOM 0 HE2 PHE B 15 71.234 -2.155 -8.229 1.00 0.00 H new ATOM 0 HZ PHE B 15 73.122 -2.519 -6.641 1.00 0.00 H new ATOM 1445 N THR B 16 69.204 -8.564 -10.870 1.00 0.00 N ATOM 1446 CA THR B 16 68.772 -9.564 -11.909 1.00 0.00 C ATOM 1447 C THR B 16 69.638 -9.368 -13.155 1.00 0.00 C ATOM 1448 O THR B 16 69.400 -8.487 -13.948 1.00 0.00 O ATOM 1449 CB THR B 16 67.286 -9.351 -12.290 1.00 0.00 C ATOM 1450 OG1 THR B 16 67.074 -9.782 -13.628 1.00 0.00 O ATOM 1451 CG2 THR B 16 66.922 -7.872 -12.174 1.00 0.00 C ATOM 0 H THR B 16 68.452 -8.012 -10.457 1.00 0.00 H new ATOM 0 HA THR B 16 68.887 -10.571 -11.508 1.00 0.00 H new ATOM 0 HB THR B 16 66.659 -9.929 -11.611 1.00 0.00 H new ATOM 0 HG1 THR B 16 67.398 -9.095 -14.248 1.00 0.00 H new ATOM 0 HG21 THR B 16 65.875 -7.733 -12.444 1.00 0.00 H new ATOM 0 HG22 THR B 16 67.080 -7.538 -11.149 1.00 0.00 H new ATOM 0 HG23 THR B 16 67.551 -7.289 -12.847 1.00 0.00 H new ATOM 1459 N ASN B 17 70.661 -10.155 -13.318 1.00 0.00 N ATOM 1460 CA ASN B 17 71.542 -9.971 -14.502 1.00 0.00 C ATOM 1461 C ASN B 17 71.064 -10.853 -15.658 1.00 0.00 C ATOM 1462 O ASN B 17 71.696 -10.927 -16.693 1.00 0.00 O ATOM 1463 CB ASN B 17 72.979 -10.342 -14.133 1.00 0.00 C ATOM 1464 CG ASN B 17 73.041 -11.820 -13.740 1.00 0.00 C ATOM 1465 OD1 ASN B 17 72.054 -12.523 -13.818 1.00 0.00 O ATOM 1466 ND2 ASN B 17 74.170 -12.323 -13.320 1.00 0.00 N ATOM 0 H ASN B 17 70.925 -10.913 -12.688 1.00 0.00 H new ATOM 0 HA ASN B 17 71.503 -8.927 -14.814 1.00 0.00 H new ATOM 0 HB2 ASN B 17 73.643 -10.151 -14.976 1.00 0.00 H new ATOM 0 HB3 ASN B 17 73.326 -9.721 -13.307 1.00 0.00 H new ATOM 0 HD21 ASN B 17 74.223 -13.307 -13.057 1.00 0.00 H new ATOM 0 HD22 ASN B 17 74.999 -11.732 -13.255 1.00 0.00 H new ATOM 1473 N ARG B 18 69.944 -11.504 -15.506 1.00 0.00 N ATOM 1474 CA ARG B 18 69.430 -12.351 -16.612 1.00 0.00 C ATOM 1475 C ARG B 18 68.435 -11.535 -17.432 1.00 0.00 C ATOM 1476 O ARG B 18 67.592 -10.851 -16.892 1.00 0.00 O ATOM 1477 CB ARG B 18 68.732 -13.583 -16.038 1.00 0.00 C ATOM 1478 CG ARG B 18 69.749 -14.714 -15.871 1.00 0.00 C ATOM 1479 CD ARG B 18 69.388 -15.548 -14.641 1.00 0.00 C ATOM 1480 NE ARG B 18 69.401 -16.997 -15.001 1.00 0.00 N ATOM 1481 CZ ARG B 18 68.850 -17.888 -14.207 1.00 0.00 C ATOM 1482 NH1 ARG B 18 68.280 -17.521 -13.084 1.00 0.00 N ATOM 1483 NH2 ARG B 18 68.868 -19.150 -14.540 1.00 0.00 N ATOM 0 H ARG B 18 69.366 -11.485 -14.666 1.00 0.00 H new ATOM 0 HA ARG B 18 70.257 -12.675 -17.244 1.00 0.00 H new ATOM 0 HB2 ARG B 18 68.279 -13.342 -15.076 1.00 0.00 H new ATOM 0 HB3 ARG B 18 67.926 -13.899 -16.700 1.00 0.00 H new ATOM 0 HG2 ARG B 18 69.758 -15.344 -16.761 1.00 0.00 H new ATOM 0 HG3 ARG B 18 70.752 -14.302 -15.762 1.00 0.00 H new ATOM 0 HD2 ARG B 18 70.098 -15.356 -13.837 1.00 0.00 H new ATOM 0 HD3 ARG B 18 68.403 -15.263 -14.271 1.00 0.00 H new ATOM 0 HE ARG B 18 69.841 -17.298 -15.870 1.00 0.00 H new ATOM 0 HH11 ARG B 18 68.261 -16.536 -12.820 1.00 0.00 H new ATOM 0 HH12 ARG B 18 67.855 -18.221 -12.475 1.00 0.00 H new ATOM 0 HH21 ARG B 18 69.308 -19.441 -15.413 1.00 0.00 H new ATOM 0 HH22 ARG B 18 68.442 -19.845 -13.927 1.00 0.00 H new ATOM 1497 N LYS B 19 68.531 -11.589 -18.731 1.00 0.00 N ATOM 1498 CA LYS B 19 67.592 -10.803 -19.578 1.00 0.00 C ATOM 1499 C LYS B 19 66.154 -11.135 -19.183 1.00 0.00 C ATOM 1500 O LYS B 19 65.566 -12.080 -19.669 1.00 0.00 O ATOM 1501 CB LYS B 19 67.812 -11.151 -21.052 1.00 0.00 C ATOM 1502 CG LYS B 19 69.304 -11.063 -21.382 1.00 0.00 C ATOM 1503 CD LYS B 19 69.480 -10.811 -22.880 1.00 0.00 C ATOM 1504 CE LYS B 19 70.901 -10.311 -23.152 1.00 0.00 C ATOM 1505 NZ LYS B 19 71.243 -10.541 -24.584 1.00 0.00 N ATOM 0 H LYS B 19 69.218 -12.143 -19.242 1.00 0.00 H new ATOM 0 HA LYS B 19 67.775 -9.739 -19.429 1.00 0.00 H new ATOM 0 HB2 LYS B 19 67.442 -12.155 -21.258 1.00 0.00 H new ATOM 0 HB3 LYS B 19 67.248 -10.467 -21.686 1.00 0.00 H new ATOM 0 HG2 LYS B 19 69.767 -10.259 -20.810 1.00 0.00 H new ATOM 0 HG3 LYS B 19 69.806 -11.987 -21.096 1.00 0.00 H new ATOM 0 HD2 LYS B 19 69.293 -11.729 -23.438 1.00 0.00 H new ATOM 0 HD3 LYS B 19 68.753 -10.075 -23.223 1.00 0.00 H new ATOM 0 HE2 LYS B 19 70.976 -9.250 -22.915 1.00 0.00 H new ATOM 0 HE3 LYS B 19 71.611 -10.832 -22.509 1.00 0.00 H new ATOM 0 HZ1 LYS B 19 72.208 -10.201 -24.769 1.00 0.00 H new ATOM 0 HZ2 LYS B 19 71.187 -11.558 -24.795 1.00 0.00 H new ATOM 0 HZ3 LYS B 19 70.572 -10.025 -25.188 1.00 0.00 H new ATOM 1519 N ILE B 20 65.589 -10.363 -18.303 1.00 0.00 N ATOM 1520 CA ILE B 20 64.203 -10.619 -17.869 1.00 0.00 C ATOM 1521 C ILE B 20 63.246 -10.042 -18.905 1.00 0.00 C ATOM 1522 O ILE B 20 63.273 -8.867 -19.212 1.00 0.00 O ATOM 1523 CB ILE B 20 63.980 -9.978 -16.479 1.00 0.00 C ATOM 1524 CG1 ILE B 20 64.074 -11.069 -15.410 1.00 0.00 C ATOM 1525 CG2 ILE B 20 62.600 -9.295 -16.390 1.00 0.00 C ATOM 1526 CD1 ILE B 20 63.645 -10.496 -14.065 1.00 0.00 C ATOM 0 H ILE B 20 66.037 -9.559 -17.864 1.00 0.00 H new ATOM 0 HA ILE B 20 64.017 -11.690 -17.785 1.00 0.00 H new ATOM 0 HB ILE B 20 64.745 -9.218 -16.321 1.00 0.00 H new ATOM 0 HG12 ILE B 20 63.438 -11.912 -15.678 1.00 0.00 H new ATOM 0 HG13 ILE B 20 65.095 -11.446 -15.348 1.00 0.00 H new ATOM 0 HG21 ILE B 20 62.475 -8.855 -15.401 1.00 0.00 H new ATOM 0 HG22 ILE B 20 62.532 -8.513 -17.146 1.00 0.00 H new ATOM 0 HG23 ILE B 20 61.817 -10.034 -16.560 1.00 0.00 H new ATOM 0 HD11 ILE B 20 63.711 -11.271 -13.302 1.00 0.00 H new ATOM 0 HD12 ILE B 20 64.300 -9.667 -13.797 1.00 0.00 H new ATOM 0 HD13 ILE B 20 62.617 -10.140 -14.132 1.00 0.00 H new ATOM 1538 N SER B 21 62.407 -10.865 -19.435 1.00 0.00 N ATOM 1539 CA SER B 21 61.426 -10.400 -20.454 1.00 0.00 C ATOM 1540 C SER B 21 60.742 -9.116 -19.972 1.00 0.00 C ATOM 1541 O SER B 21 60.215 -9.054 -18.879 1.00 0.00 O ATOM 1542 CB SER B 21 60.374 -11.484 -20.653 1.00 0.00 C ATOM 1543 OG SER B 21 59.966 -11.505 -22.014 1.00 0.00 O ATOM 0 H SER B 21 62.351 -11.858 -19.208 1.00 0.00 H new ATOM 0 HA SER B 21 61.943 -10.199 -21.393 1.00 0.00 H new ATOM 0 HB2 SER B 21 60.779 -12.455 -20.369 1.00 0.00 H new ATOM 0 HB3 SER B 21 59.516 -11.295 -20.008 1.00 0.00 H new ATOM 0 HG SER B 21 59.291 -12.203 -22.142 1.00 0.00 H new ATOM 1549 N VAL B 22 60.737 -8.095 -20.784 1.00 0.00 N ATOM 1550 CA VAL B 22 60.078 -6.827 -20.379 1.00 0.00 C ATOM 1551 C VAL B 22 58.581 -7.076 -20.153 1.00 0.00 C ATOM 1552 O VAL B 22 57.886 -6.259 -19.584 1.00 0.00 O ATOM 1553 CB VAL B 22 60.261 -5.783 -21.482 1.00 0.00 C ATOM 1554 CG1 VAL B 22 59.632 -6.295 -22.778 1.00 0.00 C ATOM 1555 CG2 VAL B 22 59.578 -4.478 -21.064 1.00 0.00 C ATOM 0 H VAL B 22 61.162 -8.087 -21.711 1.00 0.00 H new ATOM 0 HA VAL B 22 60.528 -6.463 -19.455 1.00 0.00 H new ATOM 0 HB VAL B 22 61.324 -5.603 -21.641 1.00 0.00 H new ATOM 0 HG11 VAL B 22 59.762 -5.551 -23.564 1.00 0.00 H new ATOM 0 HG12 VAL B 22 60.116 -7.225 -23.075 1.00 0.00 H new ATOM 0 HG13 VAL B 22 58.568 -6.474 -22.620 1.00 0.00 H new ATOM 0 HG21 VAL B 22 59.707 -3.732 -21.848 1.00 0.00 H new ATOM 0 HG22 VAL B 22 58.515 -4.658 -20.906 1.00 0.00 H new ATOM 0 HG23 VAL B 22 60.025 -4.113 -20.139 1.00 0.00 H new ATOM 1565 N GLN B 23 58.082 -8.203 -20.593 1.00 0.00 N ATOM 1566 CA GLN B 23 56.659 -8.509 -20.408 1.00 0.00 C ATOM 1567 C GLN B 23 56.387 -8.654 -18.920 1.00 0.00 C ATOM 1568 O GLN B 23 55.356 -8.249 -18.419 1.00 0.00 O ATOM 1569 CB GLN B 23 56.340 -9.826 -21.159 1.00 0.00 C ATOM 1570 CG GLN B 23 55.779 -10.899 -20.207 1.00 0.00 C ATOM 1571 CD GLN B 23 55.251 -12.080 -21.024 1.00 0.00 C ATOM 1572 OE1 GLN B 23 54.066 -12.181 -21.274 1.00 0.00 O ATOM 1573 NE2 GLN B 23 56.088 -12.985 -21.453 1.00 0.00 N ATOM 0 H GLN B 23 58.618 -8.924 -21.077 1.00 0.00 H new ATOM 0 HA GLN B 23 56.028 -7.714 -20.805 1.00 0.00 H new ATOM 0 HB2 GLN B 23 55.618 -9.628 -21.951 1.00 0.00 H new ATOM 0 HB3 GLN B 23 57.244 -10.201 -21.638 1.00 0.00 H new ATOM 0 HG2 GLN B 23 56.557 -11.236 -19.522 1.00 0.00 H new ATOM 0 HG3 GLN B 23 54.979 -10.478 -19.598 1.00 0.00 H new ATOM 0 HE21 GLN B 23 57.083 -12.900 -21.243 1.00 0.00 H new ATOM 0 HE22 GLN B 23 55.748 -13.777 -21.998 1.00 0.00 H new ATOM 1582 N ARG B 24 57.297 -9.253 -18.218 1.00 0.00 N ATOM 1583 CA ARG B 24 57.090 -9.455 -16.776 1.00 0.00 C ATOM 1584 C ARG B 24 57.250 -8.137 -16.061 1.00 0.00 C ATOM 1585 O ARG B 24 56.649 -7.895 -15.038 1.00 0.00 O ATOM 1586 CB ARG B 24 58.119 -10.450 -16.225 1.00 0.00 C ATOM 1587 CG ARG B 24 58.272 -11.640 -17.175 1.00 0.00 C ATOM 1588 CD ARG B 24 57.495 -12.833 -16.628 1.00 0.00 C ATOM 1589 NE ARG B 24 56.063 -12.730 -17.040 1.00 0.00 N ATOM 1590 CZ ARG B 24 55.149 -13.491 -16.476 1.00 0.00 C ATOM 1591 NH1 ARG B 24 55.499 -14.350 -15.558 1.00 0.00 N ATOM 1592 NH2 ARG B 24 53.888 -13.393 -16.827 1.00 0.00 N ATOM 0 H ARG B 24 58.178 -9.611 -18.587 1.00 0.00 H new ATOM 0 HA ARG B 24 56.087 -9.851 -16.615 1.00 0.00 H new ATOM 0 HB2 ARG B 24 59.081 -9.954 -16.095 1.00 0.00 H new ATOM 0 HB3 ARG B 24 57.806 -10.800 -15.241 1.00 0.00 H new ATOM 0 HG2 ARG B 24 57.904 -11.377 -18.167 1.00 0.00 H new ATOM 0 HG3 ARG B 24 59.325 -11.898 -17.284 1.00 0.00 H new ATOM 0 HD2 ARG B 24 57.925 -13.762 -17.001 1.00 0.00 H new ATOM 0 HD3 ARG B 24 57.570 -12.861 -15.541 1.00 0.00 H new ATOM 0 HE ARG B 24 55.791 -12.065 -17.764 1.00 0.00 H new ATOM 0 HH11 ARG B 24 56.477 -14.430 -15.280 1.00 0.00 H new ATOM 0 HH12 ARG B 24 54.794 -14.942 -15.118 1.00 0.00 H new ATOM 0 HH21 ARG B 24 53.609 -12.722 -17.543 1.00 0.00 H new ATOM 0 HH22 ARG B 24 53.188 -13.987 -16.384 1.00 0.00 H new ATOM 1606 N LEU B 25 58.073 -7.289 -16.581 1.00 0.00 N ATOM 1607 CA LEU B 25 58.313 -5.988 -15.923 1.00 0.00 C ATOM 1608 C LEU B 25 57.032 -5.167 -15.897 1.00 0.00 C ATOM 1609 O LEU B 25 56.741 -4.413 -16.803 1.00 0.00 O ATOM 1610 CB LEU B 25 59.397 -5.228 -16.677 1.00 0.00 C ATOM 1611 CG LEU B 25 60.673 -6.091 -16.766 1.00 0.00 C ATOM 1612 CD1 LEU B 25 61.837 -5.234 -17.249 1.00 0.00 C ATOM 1613 CD2 LEU B 25 61.017 -6.670 -15.386 1.00 0.00 C ATOM 0 H LEU B 25 58.596 -7.441 -17.443 1.00 0.00 H new ATOM 0 HA LEU B 25 58.638 -6.163 -14.898 1.00 0.00 H new ATOM 0 HB2 LEU B 25 59.047 -4.975 -17.678 1.00 0.00 H new ATOM 0 HB3 LEU B 25 59.616 -4.289 -16.169 1.00 0.00 H new ATOM 0 HG LEU B 25 60.497 -6.907 -17.467 1.00 0.00 H new ATOM 0 HD11 LEU B 25 62.737 -5.845 -17.311 1.00 0.00 H new ATOM 0 HD12 LEU B 25 61.606 -4.827 -18.234 1.00 0.00 H new ATOM 0 HD13 LEU B 25 62.002 -4.416 -16.548 1.00 0.00 H new ATOM 0 HD21 LEU B 25 61.919 -7.277 -15.461 1.00 0.00 H new ATOM 0 HD22 LEU B 25 61.185 -5.856 -14.681 1.00 0.00 H new ATOM 0 HD23 LEU B 25 60.191 -7.289 -15.035 1.00 0.00 H new ATOM 1625 N ALA B 26 56.265 -5.308 -14.858 1.00 0.00 N ATOM 1626 CA ALA B 26 55.002 -4.544 -14.755 1.00 0.00 C ATOM 1627 C ALA B 26 55.300 -3.061 -14.504 1.00 0.00 C ATOM 1628 O ALA B 26 54.465 -2.205 -14.718 1.00 0.00 O ATOM 1629 CB ALA B 26 54.176 -5.086 -13.591 1.00 0.00 C ATOM 0 H ALA B 26 56.462 -5.925 -14.070 1.00 0.00 H new ATOM 0 HA ALA B 26 54.449 -4.648 -15.689 1.00 0.00 H new ATOM 0 HB1 ALA B 26 53.245 -4.525 -13.513 1.00 0.00 H new ATOM 0 HB2 ALA B 26 53.952 -6.139 -13.763 1.00 0.00 H new ATOM 0 HB3 ALA B 26 54.741 -4.982 -12.665 1.00 0.00 H new ATOM 1635 N SER B 27 56.475 -2.755 -14.035 1.00 0.00 N ATOM 1636 CA SER B 27 56.819 -1.328 -13.751 1.00 0.00 C ATOM 1637 C SER B 27 58.302 -1.224 -13.388 1.00 0.00 C ATOM 1638 O SER B 27 59.009 -2.210 -13.347 1.00 0.00 O ATOM 1639 CB SER B 27 55.972 -0.823 -12.582 1.00 0.00 C ATOM 1640 OG SER B 27 55.402 0.435 -12.920 1.00 0.00 O ATOM 0 H SER B 27 57.215 -3.428 -13.835 1.00 0.00 H new ATOM 0 HA SER B 27 56.617 -0.722 -14.635 1.00 0.00 H new ATOM 0 HB2 SER B 27 55.185 -1.541 -12.352 1.00 0.00 H new ATOM 0 HB3 SER B 27 56.587 -0.727 -11.687 1.00 0.00 H new ATOM 0 HG SER B 27 54.858 0.759 -12.172 1.00 0.00 H new ATOM 1646 N TYR B 28 58.787 -0.032 -13.145 1.00 0.00 N ATOM 1647 CA TYR B 28 60.231 0.123 -12.807 1.00 0.00 C ATOM 1648 C TYR B 28 60.420 1.384 -11.928 1.00 0.00 C ATOM 1649 O TYR B 28 59.993 2.465 -12.278 1.00 0.00 O ATOM 1650 CB TYR B 28 61.028 0.215 -14.140 1.00 0.00 C ATOM 1651 CG TYR B 28 61.826 1.494 -14.239 1.00 0.00 C ATOM 1652 CD1 TYR B 28 61.200 2.681 -14.673 1.00 0.00 C ATOM 1653 CD2 TYR B 28 63.186 1.507 -13.863 1.00 0.00 C ATOM 1654 CE1 TYR B 28 61.935 3.881 -14.739 1.00 0.00 C ATOM 1655 CE2 TYR B 28 63.922 2.706 -13.925 1.00 0.00 C ATOM 1656 CZ TYR B 28 63.298 3.896 -14.364 1.00 0.00 C ATOM 1657 OH TYR B 28 64.018 5.072 -14.423 1.00 0.00 O ATOM 0 H TYR B 28 58.248 0.834 -13.166 1.00 0.00 H new ATOM 0 HA TYR B 28 60.601 -0.729 -12.236 1.00 0.00 H new ATOM 0 HB2 TYR B 28 61.701 -0.639 -14.219 1.00 0.00 H new ATOM 0 HB3 TYR B 28 60.336 0.154 -14.980 1.00 0.00 H new ATOM 0 HD1 TYR B 28 60.157 2.670 -14.955 1.00 0.00 H new ATOM 0 HD2 TYR B 28 63.662 0.598 -13.528 1.00 0.00 H new ATOM 0 HE1 TYR B 28 61.457 4.789 -15.076 1.00 0.00 H new ATOM 0 HE2 TYR B 28 64.963 2.716 -13.637 1.00 0.00 H new ATOM 0 HH TYR B 28 63.418 5.831 -14.268 1.00 0.00 H new ATOM 1667 N ARG B 29 61.055 1.242 -10.787 1.00 0.00 N ATOM 1668 CA ARG B 29 61.264 2.424 -9.890 1.00 0.00 C ATOM 1669 C ARG B 29 62.760 2.597 -9.607 1.00 0.00 C ATOM 1670 O ARG B 29 63.249 2.220 -8.568 1.00 0.00 O ATOM 1671 CB ARG B 29 60.525 2.201 -8.575 1.00 0.00 C ATOM 1672 CG ARG B 29 59.978 3.535 -8.065 1.00 0.00 C ATOM 1673 CD ARG B 29 58.576 3.325 -7.492 1.00 0.00 C ATOM 1674 NE ARG B 29 57.666 4.396 -7.998 1.00 0.00 N ATOM 1675 CZ ARG B 29 56.498 4.602 -7.432 1.00 0.00 C ATOM 1676 NH1 ARG B 29 56.108 3.870 -6.417 1.00 0.00 N ATOM 1677 NH2 ARG B 29 55.716 5.546 -7.885 1.00 0.00 N ATOM 0 H ARG B 29 61.436 0.362 -10.440 1.00 0.00 H new ATOM 0 HA ARG B 29 60.880 3.320 -10.379 1.00 0.00 H new ATOM 0 HB2 ARG B 29 59.709 1.493 -8.720 1.00 0.00 H new ATOM 0 HB3 ARG B 29 61.198 1.766 -7.837 1.00 0.00 H new ATOM 0 HG2 ARG B 29 60.638 3.942 -7.299 1.00 0.00 H new ATOM 0 HG3 ARG B 29 59.946 4.261 -8.877 1.00 0.00 H new ATOM 0 HD2 ARG B 29 58.197 2.345 -7.780 1.00 0.00 H new ATOM 0 HD3 ARG B 29 58.610 3.346 -6.403 1.00 0.00 H new ATOM 0 HE ARG B 29 57.953 4.972 -8.789 1.00 0.00 H new ATOM 0 HH11 ARG B 29 56.713 3.131 -6.059 1.00 0.00 H new ATOM 0 HH12 ARG B 29 55.199 4.039 -5.986 1.00 0.00 H new ATOM 0 HH21 ARG B 29 56.013 6.119 -8.675 1.00 0.00 H new ATOM 0 HH22 ARG B 29 54.809 5.710 -7.449 1.00 0.00 H new ATOM 1691 N ARG B 30 63.480 3.152 -10.538 1.00 0.00 N ATOM 1692 CA ARG B 30 64.964 3.338 -10.365 1.00 0.00 C ATOM 1693 C ARG B 30 65.318 3.796 -8.938 1.00 0.00 C ATOM 1694 O ARG B 30 65.082 4.926 -8.562 1.00 0.00 O ATOM 1695 CB ARG B 30 65.454 4.390 -11.363 1.00 0.00 C ATOM 1696 CG ARG B 30 66.983 4.378 -11.407 1.00 0.00 C ATOM 1697 CD ARG B 30 67.454 4.559 -12.851 1.00 0.00 C ATOM 1698 NE ARG B 30 68.930 4.783 -12.869 1.00 0.00 N ATOM 1699 CZ ARG B 30 69.522 5.253 -13.945 1.00 0.00 C ATOM 1700 NH1 ARG B 30 68.828 5.528 -15.024 1.00 0.00 N ATOM 1701 NH2 ARG B 30 70.813 5.447 -13.941 1.00 0.00 N ATOM 0 H ARG B 30 63.109 3.492 -11.425 1.00 0.00 H new ATOM 0 HA ARG B 30 65.449 2.378 -10.543 1.00 0.00 H new ATOM 0 HB2 ARG B 30 65.049 4.183 -12.354 1.00 0.00 H new ATOM 0 HB3 ARG B 30 65.096 5.377 -11.072 1.00 0.00 H new ATOM 0 HG2 ARG B 30 67.382 5.176 -10.781 1.00 0.00 H new ATOM 0 HG3 ARG B 30 67.361 3.438 -11.005 1.00 0.00 H new ATOM 0 HD2 ARG B 30 67.202 3.677 -13.440 1.00 0.00 H new ATOM 0 HD3 ARG B 30 66.941 5.405 -13.309 1.00 0.00 H new ATOM 0 HE ARG B 30 69.484 4.570 -12.040 1.00 0.00 H new ATOM 0 HH11 ARG B 30 67.819 5.378 -15.034 1.00 0.00 H new ATOM 0 HH12 ARG B 30 69.297 5.892 -15.853 1.00 0.00 H new ATOM 0 HH21 ARG B 30 71.358 5.234 -13.106 1.00 0.00 H new ATOM 0 HH22 ARG B 30 71.277 5.811 -14.773 1.00 0.00 H new ATOM 1715 N ILE B 31 65.939 2.933 -8.163 1.00 0.00 N ATOM 1716 CA ILE B 31 66.371 3.333 -6.787 1.00 0.00 C ATOM 1717 C ILE B 31 67.605 4.236 -6.919 1.00 0.00 C ATOM 1718 O ILE B 31 68.296 4.206 -7.914 1.00 0.00 O ATOM 1719 CB ILE B 31 66.730 2.065 -5.956 1.00 0.00 C ATOM 1720 CG1 ILE B 31 65.474 1.560 -5.222 1.00 0.00 C ATOM 1721 CG2 ILE B 31 67.824 2.395 -4.917 1.00 0.00 C ATOM 1722 CD1 ILE B 31 65.853 0.417 -4.261 1.00 0.00 C ATOM 0 H ILE B 31 66.163 1.973 -8.425 1.00 0.00 H new ATOM 0 HA ILE B 31 65.567 3.864 -6.278 1.00 0.00 H new ATOM 0 HB ILE B 31 67.101 1.296 -6.633 1.00 0.00 H new ATOM 0 HG12 ILE B 31 65.014 2.377 -4.666 1.00 0.00 H new ATOM 0 HG13 ILE B 31 64.736 1.210 -5.944 1.00 0.00 H new ATOM 0 HG21 ILE B 31 68.064 1.499 -4.344 1.00 0.00 H new ATOM 0 HG22 ILE B 31 68.718 2.748 -5.430 1.00 0.00 H new ATOM 0 HG23 ILE B 31 67.463 3.171 -4.242 1.00 0.00 H new ATOM 0 HD11 ILE B 31 64.960 0.064 -3.745 1.00 0.00 H new ATOM 0 HD12 ILE B 31 66.293 -0.404 -4.827 1.00 0.00 H new ATOM 0 HD13 ILE B 31 66.575 0.781 -3.530 1.00 0.00 H new ATOM 1734 N THR B 32 67.897 5.013 -5.912 1.00 0.00 N ATOM 1735 CA THR B 32 69.101 5.895 -5.970 1.00 0.00 C ATOM 1736 C THR B 32 69.124 6.813 -4.752 1.00 0.00 C ATOM 1737 O THR B 32 69.503 7.965 -4.839 1.00 0.00 O ATOM 1738 CB THR B 32 69.069 6.741 -7.242 1.00 0.00 C ATOM 1739 OG1 THR B 32 67.748 6.769 -7.765 1.00 0.00 O ATOM 1740 CG2 THR B 32 70.022 6.144 -8.276 1.00 0.00 C ATOM 0 H THR B 32 67.355 5.076 -5.050 1.00 0.00 H new ATOM 0 HA THR B 32 69.996 5.272 -5.975 1.00 0.00 H new ATOM 0 HB THR B 32 69.382 7.758 -7.008 1.00 0.00 H new ATOM 0 HG1 THR B 32 67.730 7.313 -8.580 1.00 0.00 H new ATOM 0 HG21 THR B 32 69.999 6.748 -9.183 1.00 0.00 H new ATOM 0 HG22 THR B 32 71.035 6.132 -7.873 1.00 0.00 H new ATOM 0 HG23 THR B 32 69.713 5.125 -8.510 1.00 0.00 H new ATOM 1748 N SER B 33 68.737 6.315 -3.612 1.00 0.00 N ATOM 1749 CA SER B 33 68.756 7.162 -2.391 1.00 0.00 C ATOM 1750 C SER B 33 70.204 7.532 -2.064 1.00 0.00 C ATOM 1751 O SER B 33 71.123 6.790 -2.348 1.00 0.00 O ATOM 1752 CB SER B 33 68.147 6.389 -1.221 1.00 0.00 C ATOM 1753 OG SER B 33 68.444 7.061 -0.006 1.00 0.00 O ATOM 0 H SER B 33 68.409 5.359 -3.474 1.00 0.00 H new ATOM 0 HA SER B 33 68.174 8.068 -2.562 1.00 0.00 H new ATOM 0 HB2 SER B 33 67.068 6.305 -1.349 1.00 0.00 H new ATOM 0 HB3 SER B 33 68.545 5.374 -1.195 1.00 0.00 H new ATOM 0 HG SER B 33 67.726 6.900 0.641 1.00 0.00 H new ATOM 1759 N SER B 34 70.417 8.675 -1.474 1.00 0.00 N ATOM 1760 CA SER B 34 71.810 9.089 -1.136 1.00 0.00 C ATOM 1761 C SER B 34 72.384 8.160 -0.057 1.00 0.00 C ATOM 1762 O SER B 34 73.562 8.194 0.237 1.00 0.00 O ATOM 1763 CB SER B 34 71.800 10.527 -0.616 1.00 0.00 C ATOM 1764 OG SER B 34 71.196 10.558 0.671 1.00 0.00 O ATOM 0 H SER B 34 69.690 9.340 -1.211 1.00 0.00 H new ATOM 0 HA SER B 34 72.430 9.026 -2.030 1.00 0.00 H new ATOM 0 HB2 SER B 34 72.818 10.913 -0.562 1.00 0.00 H new ATOM 0 HB3 SER B 34 71.251 11.171 -1.303 1.00 0.00 H new ATOM 0 HG SER B 34 71.190 11.478 1.007 1.00 0.00 H new ATOM 1770 N LYS B 35 71.562 7.340 0.544 1.00 0.00 N ATOM 1771 CA LYS B 35 72.065 6.427 1.606 1.00 0.00 C ATOM 1772 C LYS B 35 72.285 5.015 1.038 1.00 0.00 C ATOM 1773 O LYS B 35 72.891 4.175 1.672 1.00 0.00 O ATOM 1774 CB LYS B 35 71.043 6.371 2.746 1.00 0.00 C ATOM 1775 CG LYS B 35 71.711 6.808 4.054 1.00 0.00 C ATOM 1776 CD LYS B 35 70.637 7.237 5.055 1.00 0.00 C ATOM 1777 CE LYS B 35 71.281 8.070 6.165 1.00 0.00 C ATOM 1778 NZ LYS B 35 72.356 7.276 6.824 1.00 0.00 N ATOM 0 H LYS B 35 70.565 7.265 0.344 1.00 0.00 H new ATOM 0 HA LYS B 35 73.017 6.804 1.980 1.00 0.00 H new ATOM 0 HB2 LYS B 35 70.197 7.021 2.522 1.00 0.00 H new ATOM 0 HB3 LYS B 35 70.650 5.359 2.847 1.00 0.00 H new ATOM 0 HG2 LYS B 35 72.301 5.989 4.465 1.00 0.00 H new ATOM 0 HG3 LYS B 35 72.399 7.633 3.866 1.00 0.00 H new ATOM 0 HD2 LYS B 35 69.865 7.818 4.550 1.00 0.00 H new ATOM 0 HD3 LYS B 35 70.149 6.360 5.480 1.00 0.00 H new ATOM 0 HE2 LYS B 35 71.695 8.989 5.750 1.00 0.00 H new ATOM 0 HE3 LYS B 35 70.529 8.362 6.898 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 72.227 7.305 7.855 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 72.309 6.290 6.497 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 73.284 7.678 6.580 1.00 0.00 H new ATOM 1792 N CYS B 36 71.802 4.742 -0.148 1.00 0.00 N ATOM 1793 CA CYS B 36 71.994 3.378 -0.728 1.00 0.00 C ATOM 1794 C CYS B 36 73.415 3.249 -1.298 1.00 0.00 C ATOM 1795 O CYS B 36 73.870 4.114 -2.019 1.00 0.00 O ATOM 1796 CB CYS B 36 70.969 3.135 -1.842 1.00 0.00 C ATOM 1797 SG CYS B 36 69.322 2.905 -1.116 1.00 0.00 S ATOM 0 H CYS B 36 71.287 5.398 -0.735 1.00 0.00 H new ATOM 0 HA CYS B 36 71.852 2.636 0.058 1.00 0.00 H new ATOM 0 HB2 CYS B 36 70.959 3.980 -2.531 1.00 0.00 H new ATOM 0 HB3 CYS B 36 71.248 2.255 -2.421 1.00 0.00 H new ATOM 1802 N PRO B 37 74.083 2.162 -0.941 1.00 0.00 N ATOM 1803 CA PRO B 37 75.447 1.911 -1.393 1.00 0.00 C ATOM 1804 C PRO B 37 75.490 1.710 -2.907 1.00 0.00 C ATOM 1805 O PRO B 37 76.535 1.791 -3.522 1.00 0.00 O ATOM 1806 CB PRO B 37 75.866 0.612 -0.687 1.00 0.00 C ATOM 1807 CG PRO B 37 74.643 0.103 0.130 1.00 0.00 C ATOM 1808 CD PRO B 37 73.520 1.126 -0.058 1.00 0.00 C ATOM 0 HA PRO B 37 76.106 2.748 -1.163 1.00 0.00 H new ATOM 0 HB2 PRO B 37 76.177 -0.136 -1.416 1.00 0.00 H new ATOM 0 HB3 PRO B 37 76.717 0.791 -0.030 1.00 0.00 H new ATOM 0 HG2 PRO B 37 74.330 -0.881 -0.218 1.00 0.00 H new ATOM 0 HG3 PRO B 37 74.899 0.002 1.185 1.00 0.00 H new ATOM 0 HD2 PRO B 37 72.639 0.665 -0.504 1.00 0.00 H new ATOM 0 HD3 PRO B 37 73.209 1.549 0.897 1.00 0.00 H new ATOM 1816 N LYS B 38 74.376 1.415 -3.509 1.00 0.00 N ATOM 1817 CA LYS B 38 74.376 1.172 -4.970 1.00 0.00 C ATOM 1818 C LYS B 38 73.022 1.549 -5.580 1.00 0.00 C ATOM 1819 O LYS B 38 71.978 1.254 -5.033 1.00 0.00 O ATOM 1820 CB LYS B 38 74.645 -0.312 -5.229 1.00 0.00 C ATOM 1821 CG LYS B 38 76.144 -0.536 -5.430 1.00 0.00 C ATOM 1822 CD LYS B 38 76.365 -1.489 -6.607 1.00 0.00 C ATOM 1823 CE LYS B 38 77.366 -0.872 -7.586 1.00 0.00 C ATOM 1824 NZ LYS B 38 78.636 -1.651 -7.553 1.00 0.00 N ATOM 0 H LYS B 38 73.468 1.332 -3.052 1.00 0.00 H new ATOM 0 HA LYS B 38 75.152 1.785 -5.429 1.00 0.00 H new ATOM 0 HB2 LYS B 38 74.288 -0.908 -4.389 1.00 0.00 H new ATOM 0 HB3 LYS B 38 74.097 -0.643 -6.111 1.00 0.00 H new ATOM 0 HG2 LYS B 38 76.642 0.415 -5.620 1.00 0.00 H new ATOM 0 HG3 LYS B 38 76.585 -0.952 -4.524 1.00 0.00 H new ATOM 0 HD2 LYS B 38 76.737 -2.448 -6.247 1.00 0.00 H new ATOM 0 HD3 LYS B 38 75.419 -1.684 -7.113 1.00 0.00 H new ATOM 0 HE2 LYS B 38 76.952 -0.873 -8.594 1.00 0.00 H new ATOM 0 HE3 LYS B 38 77.557 0.168 -7.320 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 79.317 -1.233 -8.218 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 79.032 -1.629 -6.592 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 78.446 -2.636 -7.826 1.00 0.00 H new ATOM 1838 N GLU B 39 73.037 2.158 -6.737 1.00 0.00 N ATOM 1839 CA GLU B 39 71.758 2.507 -7.417 1.00 0.00 C ATOM 1840 C GLU B 39 71.159 1.225 -7.998 1.00 0.00 C ATOM 1841 O GLU B 39 71.730 0.160 -7.876 1.00 0.00 O ATOM 1842 CB GLU B 39 72.037 3.498 -8.549 1.00 0.00 C ATOM 1843 CG GLU B 39 72.936 4.623 -8.034 1.00 0.00 C ATOM 1844 CD GLU B 39 73.086 5.692 -9.118 1.00 0.00 C ATOM 1845 OE1 GLU B 39 72.224 5.760 -9.979 1.00 0.00 O ATOM 1846 OE2 GLU B 39 74.060 6.425 -9.068 1.00 0.00 O ATOM 0 H GLU B 39 73.882 2.428 -7.240 1.00 0.00 H new ATOM 0 HA GLU B 39 71.065 2.961 -6.709 1.00 0.00 H new ATOM 0 HB2 GLU B 39 72.518 2.987 -9.383 1.00 0.00 H new ATOM 0 HB3 GLU B 39 71.100 3.910 -8.925 1.00 0.00 H new ATOM 0 HG2 GLU B 39 72.508 5.061 -7.133 1.00 0.00 H new ATOM 0 HG3 GLU B 39 73.914 4.226 -7.762 1.00 0.00 H new ATOM 1853 N ALA B 40 70.021 1.306 -8.632 1.00 0.00 N ATOM 1854 CA ALA B 40 69.421 0.070 -9.210 1.00 0.00 C ATOM 1855 C ALA B 40 68.103 0.395 -9.903 1.00 0.00 C ATOM 1856 O ALA B 40 67.669 1.528 -9.946 1.00 0.00 O ATOM 1857 CB ALA B 40 69.156 -0.931 -8.087 1.00 0.00 C ATOM 0 H ALA B 40 69.486 2.163 -8.774 1.00 0.00 H new ATOM 0 HA ALA B 40 70.114 -0.352 -9.938 1.00 0.00 H new ATOM 0 HB1 ALA B 40 68.717 -1.837 -8.504 1.00 0.00 H new ATOM 0 HB2 ALA B 40 70.094 -1.177 -7.590 1.00 0.00 H new ATOM 0 HB3 ALA B 40 68.467 -0.493 -7.364 1.00 0.00 H new ATOM 1863 N VAL B 41 67.448 -0.608 -10.411 1.00 0.00 N ATOM 1864 CA VAL B 41 66.133 -0.397 -11.064 1.00 0.00 C ATOM 1865 C VAL B 41 65.134 -1.318 -10.400 1.00 0.00 C ATOM 1866 O VAL B 41 65.332 -2.505 -10.343 1.00 0.00 O ATOM 1867 CB VAL B 41 66.229 -0.726 -12.571 1.00 0.00 C ATOM 1868 CG1 VAL B 41 64.960 -1.469 -13.043 1.00 0.00 C ATOM 1869 CG2 VAL B 41 66.358 0.571 -13.351 1.00 0.00 C ATOM 0 H VAL B 41 67.773 -1.575 -10.401 1.00 0.00 H new ATOM 0 HA VAL B 41 65.822 0.643 -10.961 1.00 0.00 H new ATOM 0 HB VAL B 41 67.097 -1.363 -12.741 1.00 0.00 H new ATOM 0 HG11 VAL B 41 65.044 -1.693 -14.106 1.00 0.00 H new ATOM 0 HG12 VAL B 41 64.853 -2.398 -12.484 1.00 0.00 H new ATOM 0 HG13 VAL B 41 64.086 -0.841 -12.873 1.00 0.00 H new ATOM 0 HG21 VAL B 41 66.426 0.350 -14.416 1.00 0.00 H new ATOM 0 HG22 VAL B 41 65.484 1.196 -13.166 1.00 0.00 H new ATOM 0 HG23 VAL B 41 67.256 1.100 -13.032 1.00 0.00 H new ATOM 1879 N ILE B 42 64.065 -0.804 -9.915 1.00 0.00 N ATOM 1880 CA ILE B 42 63.086 -1.691 -9.277 1.00 0.00 C ATOM 1881 C ILE B 42 62.128 -2.227 -10.325 1.00 0.00 C ATOM 1882 O ILE B 42 60.990 -1.821 -10.401 1.00 0.00 O ATOM 1883 CB ILE B 42 62.321 -0.938 -8.212 1.00 0.00 C ATOM 1884 CG1 ILE B 42 63.314 -0.162 -7.334 1.00 0.00 C ATOM 1885 CG2 ILE B 42 61.539 -1.942 -7.365 1.00 0.00 C ATOM 1886 CD1 ILE B 42 64.140 -1.135 -6.501 1.00 0.00 C ATOM 0 H ILE B 42 63.824 0.187 -9.931 1.00 0.00 H new ATOM 0 HA ILE B 42 63.609 -2.525 -8.808 1.00 0.00 H new ATOM 0 HB ILE B 42 61.626 -0.234 -8.669 1.00 0.00 H new ATOM 0 HG12 ILE B 42 63.970 0.443 -7.960 1.00 0.00 H new ATOM 0 HG13 ILE B 42 62.776 0.524 -6.680 1.00 0.00 H new ATOM 0 HG21 ILE B 42 60.983 -1.411 -6.593 1.00 0.00 H new ATOM 0 HG22 ILE B 42 60.844 -2.491 -8.001 1.00 0.00 H new ATOM 0 HG23 ILE B 42 62.232 -2.641 -6.897 1.00 0.00 H new ATOM 0 HD11 ILE B 42 64.842 -0.578 -5.881 1.00 0.00 H new ATOM 0 HD12 ILE B 42 63.478 -1.721 -5.863 1.00 0.00 H new ATOM 0 HD13 ILE B 42 64.691 -1.803 -7.163 1.00 0.00 H new ATOM 1898 N PHE B 43 62.583 -3.149 -11.127 1.00 0.00 N ATOM 1899 CA PHE B 43 61.709 -3.742 -12.169 1.00 0.00 C ATOM 1900 C PHE B 43 60.552 -4.484 -11.491 1.00 0.00 C ATOM 1901 O PHE B 43 60.609 -5.681 -11.295 1.00 0.00 O ATOM 1902 CB PHE B 43 62.519 -4.737 -13.002 1.00 0.00 C ATOM 1903 CG PHE B 43 63.261 -4.013 -14.100 1.00 0.00 C ATOM 1904 CD1 PHE B 43 62.600 -3.044 -14.891 1.00 0.00 C ATOM 1905 CD2 PHE B 43 64.618 -4.312 -14.344 1.00 0.00 C ATOM 1906 CE1 PHE B 43 63.303 -2.377 -15.923 1.00 0.00 C ATOM 1907 CE2 PHE B 43 65.315 -3.646 -15.375 1.00 0.00 C ATOM 1908 CZ PHE B 43 64.656 -2.680 -16.163 1.00 0.00 C ATOM 0 H PHE B 43 63.533 -3.519 -11.102 1.00 0.00 H new ATOM 0 HA PHE B 43 61.319 -2.954 -12.813 1.00 0.00 H new ATOM 0 HB2 PHE B 43 63.226 -5.267 -12.363 1.00 0.00 H new ATOM 0 HB3 PHE B 43 61.856 -5.486 -13.434 1.00 0.00 H new ATOM 0 HD1 PHE B 43 61.561 -2.814 -14.708 1.00 0.00 H new ATOM 0 HD2 PHE B 43 65.124 -5.051 -13.741 1.00 0.00 H new ATOM 0 HE1 PHE B 43 62.801 -1.635 -16.526 1.00 0.00 H new ATOM 0 HE2 PHE B 43 66.354 -3.876 -15.560 1.00 0.00 H new ATOM 0 HZ PHE B 43 65.191 -2.172 -16.952 1.00 0.00 H new ATOM 1918 N LYS B 44 59.499 -3.797 -11.140 1.00 0.00 N ATOM 1919 CA LYS B 44 58.356 -4.489 -10.490 1.00 0.00 C ATOM 1920 C LYS B 44 57.749 -5.451 -11.490 1.00 0.00 C ATOM 1921 O LYS B 44 57.007 -5.053 -12.358 1.00 0.00 O ATOM 1922 CB LYS B 44 57.298 -3.465 -10.069 1.00 0.00 C ATOM 1923 CG LYS B 44 57.119 -3.508 -8.549 1.00 0.00 C ATOM 1924 CD LYS B 44 55.637 -3.347 -8.205 1.00 0.00 C ATOM 1925 CE LYS B 44 55.501 -2.698 -6.826 1.00 0.00 C ATOM 1926 NZ LYS B 44 54.885 -1.349 -6.972 1.00 0.00 N ATOM 0 H LYS B 44 59.383 -2.793 -11.275 1.00 0.00 H new ATOM 0 HA LYS B 44 58.702 -5.025 -9.606 1.00 0.00 H new ATOM 0 HB2 LYS B 44 57.600 -2.465 -10.382 1.00 0.00 H new ATOM 0 HB3 LYS B 44 56.351 -3.681 -10.563 1.00 0.00 H new ATOM 0 HG2 LYS B 44 57.494 -4.452 -8.155 1.00 0.00 H new ATOM 0 HG3 LYS B 44 57.700 -2.714 -8.081 1.00 0.00 H new ATOM 0 HD2 LYS B 44 55.143 -2.733 -8.958 1.00 0.00 H new ATOM 0 HD3 LYS B 44 55.143 -4.319 -8.212 1.00 0.00 H new ATOM 0 HE2 LYS B 44 54.886 -3.322 -6.177 1.00 0.00 H new ATOM 0 HE3 LYS B 44 56.480 -2.614 -6.353 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 54.792 -0.907 -6.035 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 55.488 -0.756 -7.577 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 53.944 -1.442 -7.406 1.00 0.00 H new ATOM 1940 N THR B 45 58.077 -6.709 -11.400 1.00 0.00 N ATOM 1941 CA THR B 45 57.530 -7.690 -12.375 1.00 0.00 C ATOM 1942 C THR B 45 55.987 -7.687 -12.292 1.00 0.00 C ATOM 1943 O THR B 45 55.387 -6.716 -11.883 1.00 0.00 O ATOM 1944 CB THR B 45 58.089 -9.080 -12.061 1.00 0.00 C ATOM 1945 OG1 THR B 45 58.093 -9.285 -10.659 1.00 0.00 O ATOM 1946 CG2 THR B 45 59.516 -9.171 -12.599 1.00 0.00 C ATOM 0 H THR B 45 58.700 -7.100 -10.693 1.00 0.00 H new ATOM 0 HA THR B 45 57.824 -7.417 -13.388 1.00 0.00 H new ATOM 0 HB THR B 45 57.469 -9.844 -12.530 1.00 0.00 H new ATOM 0 HG1 THR B 45 58.934 -8.951 -10.282 1.00 0.00 H new ATOM 0 HG21 THR B 45 59.925 -10.158 -12.381 1.00 0.00 H new ATOM 0 HG22 THR B 45 59.509 -9.011 -13.677 1.00 0.00 H new ATOM 0 HG23 THR B 45 60.133 -8.409 -12.123 1.00 0.00 H new ATOM 1954 N ILE B 46 55.342 -8.762 -12.663 1.00 0.00 N ATOM 1955 CA ILE B 46 53.851 -8.787 -12.594 1.00 0.00 C ATOM 1956 C ILE B 46 53.432 -9.354 -11.276 1.00 0.00 C ATOM 1957 O ILE B 46 52.374 -9.048 -10.759 1.00 0.00 O ATOM 1958 CB ILE B 46 53.281 -9.672 -13.699 1.00 0.00 C ATOM 1959 CG1 ILE B 46 54.058 -11.015 -13.750 1.00 0.00 C ATOM 1960 CG2 ILE B 46 53.365 -8.939 -15.050 1.00 0.00 C ATOM 1961 CD1 ILE B 46 55.207 -10.944 -14.763 1.00 0.00 C ATOM 0 H ILE B 46 55.779 -9.617 -13.008 1.00 0.00 H new ATOM 0 HA ILE B 46 53.479 -7.770 -12.714 1.00 0.00 H new ATOM 0 HB ILE B 46 52.233 -9.887 -13.489 1.00 0.00 H new ATOM 0 HG12 ILE B 46 54.453 -11.249 -12.761 1.00 0.00 H new ATOM 0 HG13 ILE B 46 53.378 -11.823 -14.021 1.00 0.00 H new ATOM 0 HG21 ILE B 46 52.957 -9.575 -15.835 1.00 0.00 H new ATOM 0 HG22 ILE B 46 52.791 -8.014 -14.998 1.00 0.00 H new ATOM 0 HG23 ILE B 46 54.406 -8.708 -15.275 1.00 0.00 H new ATOM 0 HD11 ILE B 46 55.736 -11.897 -14.780 1.00 0.00 H new ATOM 0 HD12 ILE B 46 54.806 -10.734 -15.754 1.00 0.00 H new ATOM 0 HD13 ILE B 46 55.897 -10.151 -14.475 1.00 0.00 H new ATOM 1973 N VAL B 47 54.245 -10.173 -10.715 1.00 0.00 N ATOM 1974 CA VAL B 47 53.907 -10.759 -9.427 1.00 0.00 C ATOM 1975 C VAL B 47 54.414 -9.838 -8.316 1.00 0.00 C ATOM 1976 O VAL B 47 54.495 -10.220 -7.165 1.00 0.00 O ATOM 1977 CB VAL B 47 54.547 -12.134 -9.339 1.00 0.00 C ATOM 1978 CG1 VAL B 47 56.067 -12.007 -9.186 1.00 0.00 C ATOM 1979 CG2 VAL B 47 53.968 -12.870 -8.156 1.00 0.00 C ATOM 0 H VAL B 47 55.142 -10.463 -11.104 1.00 0.00 H new ATOM 0 HA VAL B 47 52.828 -10.868 -9.316 1.00 0.00 H new ATOM 0 HB VAL B 47 54.340 -12.688 -10.254 1.00 0.00 H new ATOM 0 HG11 VAL B 47 56.511 -13.001 -9.124 1.00 0.00 H new ATOM 0 HG12 VAL B 47 56.477 -11.480 -10.047 1.00 0.00 H new ATOM 0 HG13 VAL B 47 56.296 -11.450 -8.277 1.00 0.00 H new ATOM 0 HG21 VAL B 47 54.422 -13.859 -8.085 1.00 0.00 H new ATOM 0 HG22 VAL B 47 54.173 -12.310 -7.243 1.00 0.00 H new ATOM 0 HG23 VAL B 47 52.891 -12.974 -8.284 1.00 0.00 H new ATOM 1989 N ALA B 48 54.733 -8.608 -8.656 1.00 0.00 N ATOM 1990 CA ALA B 48 55.202 -7.645 -7.637 1.00 0.00 C ATOM 1991 C ALA B 48 56.598 -8.036 -7.158 1.00 0.00 C ATOM 1992 O ALA B 48 57.029 -7.648 -6.091 1.00 0.00 O ATOM 1993 CB ALA B 48 54.233 -7.647 -6.468 1.00 0.00 C ATOM 0 H ALA B 48 54.684 -8.240 -9.606 1.00 0.00 H new ATOM 0 HA ALA B 48 55.247 -6.646 -8.071 1.00 0.00 H new ATOM 0 HB1 ALA B 48 54.573 -6.939 -5.712 1.00 0.00 H new ATOM 0 HB2 ALA B 48 53.242 -7.358 -6.817 1.00 0.00 H new ATOM 0 HB3 ALA B 48 54.188 -8.646 -6.035 1.00 0.00 H new ATOM 1999 N LYS B 49 57.317 -8.781 -7.947 1.00 0.00 N ATOM 2000 CA LYS B 49 58.693 -9.171 -7.546 1.00 0.00 C ATOM 2001 C LYS B 49 59.651 -8.032 -7.884 1.00 0.00 C ATOM 2002 O LYS B 49 60.352 -8.070 -8.875 1.00 0.00 O ATOM 2003 CB LYS B 49 59.108 -10.430 -8.298 1.00 0.00 C ATOM 2004 CG LYS B 49 59.441 -11.539 -7.298 1.00 0.00 C ATOM 2005 CD LYS B 49 59.203 -12.903 -7.948 1.00 0.00 C ATOM 2006 CE LYS B 49 60.427 -13.293 -8.780 1.00 0.00 C ATOM 2007 NZ LYS B 49 60.600 -14.772 -8.747 1.00 0.00 N ATOM 0 H LYS B 49 57.010 -9.137 -8.853 1.00 0.00 H new ATOM 0 HA LYS B 49 58.722 -9.370 -6.475 1.00 0.00 H new ATOM 0 HB2 LYS B 49 58.304 -10.752 -8.959 1.00 0.00 H new ATOM 0 HB3 LYS B 49 59.974 -10.221 -8.927 1.00 0.00 H new ATOM 0 HG2 LYS B 49 60.479 -11.454 -6.977 1.00 0.00 H new ATOM 0 HG3 LYS B 49 58.822 -11.437 -6.406 1.00 0.00 H new ATOM 0 HD2 LYS B 49 59.016 -13.655 -7.182 1.00 0.00 H new ATOM 0 HD3 LYS B 49 58.316 -12.866 -8.581 1.00 0.00 H new ATOM 0 HE2 LYS B 49 60.304 -12.954 -9.808 1.00 0.00 H new ATOM 0 HE3 LYS B 49 61.318 -12.803 -8.387 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 61.564 -15.002 -8.433 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 59.912 -15.187 -8.086 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 60.444 -15.161 -9.699 1.00 0.00 H new ATOM 2021 N GLU B 50 59.681 -7.011 -7.071 1.00 0.00 N ATOM 2022 CA GLU B 50 60.590 -5.862 -7.348 1.00 0.00 C ATOM 2023 C GLU B 50 62.011 -6.382 -7.557 1.00 0.00 C ATOM 2024 O GLU B 50 62.616 -6.933 -6.660 1.00 0.00 O ATOM 2025 CB GLU B 50 60.567 -4.898 -6.160 1.00 0.00 C ATOM 2026 CG GLU B 50 59.203 -4.209 -6.087 1.00 0.00 C ATOM 2027 CD GLU B 50 59.184 -3.233 -4.908 1.00 0.00 C ATOM 2028 OE1 GLU B 50 59.224 -3.697 -3.780 1.00 0.00 O ATOM 2029 OE2 GLU B 50 59.132 -2.039 -5.154 1.00 0.00 O ATOM 0 H GLU B 50 59.115 -6.923 -6.227 1.00 0.00 H new ATOM 0 HA GLU B 50 60.258 -5.339 -8.245 1.00 0.00 H new ATOM 0 HB2 GLU B 50 60.762 -5.440 -5.235 1.00 0.00 H new ATOM 0 HB3 GLU B 50 61.357 -4.154 -6.266 1.00 0.00 H new ATOM 0 HG2 GLU B 50 59.003 -3.676 -7.017 1.00 0.00 H new ATOM 0 HG3 GLU B 50 58.414 -4.952 -5.970 1.00 0.00 H new ATOM 2036 N ILE B 51 62.543 -6.231 -8.738 1.00 0.00 N ATOM 2037 CA ILE B 51 63.926 -6.742 -8.992 1.00 0.00 C ATOM 2038 C ILE B 51 64.888 -5.576 -9.196 1.00 0.00 C ATOM 2039 O ILE B 51 64.819 -4.868 -10.174 1.00 0.00 O ATOM 2040 CB ILE B 51 63.963 -7.625 -10.237 1.00 0.00 C ATOM 2041 CG1 ILE B 51 62.572 -8.153 -10.569 1.00 0.00 C ATOM 2042 CG2 ILE B 51 64.889 -8.807 -9.978 1.00 0.00 C ATOM 2043 CD1 ILE B 51 62.662 -8.985 -11.838 1.00 0.00 C ATOM 0 H ILE B 51 62.089 -5.781 -9.533 1.00 0.00 H new ATOM 0 HA ILE B 51 64.226 -7.329 -8.124 1.00 0.00 H new ATOM 0 HB ILE B 51 64.323 -7.030 -11.077 1.00 0.00 H new ATOM 0 HG12 ILE B 51 62.190 -8.757 -9.746 1.00 0.00 H new ATOM 0 HG13 ILE B 51 61.876 -7.326 -10.707 1.00 0.00 H new ATOM 0 HG21 ILE B 51 64.922 -9.444 -10.862 1.00 0.00 H new ATOM 0 HG22 ILE B 51 65.892 -8.442 -9.756 1.00 0.00 H new ATOM 0 HG23 ILE B 51 64.517 -9.382 -9.130 1.00 0.00 H new ATOM 0 HD11 ILE B 51 61.675 -9.371 -12.091 1.00 0.00 H new ATOM 0 HD12 ILE B 51 63.029 -8.364 -12.655 1.00 0.00 H new ATOM 0 HD13 ILE B 51 63.348 -9.817 -11.679 1.00 0.00 H new ATOM 2055 N CYS B 52 65.797 -5.394 -8.293 1.00 0.00 N ATOM 2056 CA CYS B 52 66.787 -4.295 -8.430 1.00 0.00 C ATOM 2057 C CYS B 52 67.797 -4.645 -9.515 1.00 0.00 C ATOM 2058 O CYS B 52 68.852 -5.165 -9.247 1.00 0.00 O ATOM 2059 CB CYS B 52 67.514 -4.125 -7.124 1.00 0.00 C ATOM 2060 SG CYS B 52 66.772 -2.761 -6.198 1.00 0.00 S ATOM 0 H CYS B 52 65.901 -5.965 -7.454 1.00 0.00 H new ATOM 0 HA CYS B 52 66.270 -3.373 -8.697 1.00 0.00 H new ATOM 0 HB2 CYS B 52 67.461 -5.046 -6.543 1.00 0.00 H new ATOM 0 HB3 CYS B 52 68.570 -3.924 -7.306 1.00 0.00 H new ATOM 2065 N ALA B 53 67.477 -4.362 -10.728 1.00 0.00 N ATOM 2066 CA ALA B 53 68.402 -4.680 -11.847 1.00 0.00 C ATOM 2067 C ALA B 53 69.385 -3.523 -12.050 1.00 0.00 C ATOM 2068 O ALA B 53 69.052 -2.371 -11.865 1.00 0.00 O ATOM 2069 CB ALA B 53 67.581 -4.882 -13.118 1.00 0.00 C ATOM 0 H ALA B 53 66.602 -3.917 -11.006 1.00 0.00 H new ATOM 0 HA ALA B 53 68.963 -5.586 -11.617 1.00 0.00 H new ATOM 0 HB1 ALA B 53 68.247 -5.116 -13.948 1.00 0.00 H new ATOM 0 HB2 ALA B 53 66.881 -5.704 -12.972 1.00 0.00 H new ATOM 0 HB3 ALA B 53 67.028 -3.970 -13.343 1.00 0.00 H new ATOM 2075 N ASP B 54 70.602 -3.826 -12.416 1.00 0.00 N ATOM 2076 CA ASP B 54 71.615 -2.747 -12.610 1.00 0.00 C ATOM 2077 C ASP B 54 71.301 -1.959 -13.903 1.00 0.00 C ATOM 2078 O ASP B 54 71.264 -2.534 -14.973 1.00 0.00 O ATOM 2079 CB ASP B 54 73.005 -3.377 -12.729 1.00 0.00 C ATOM 2080 CG ASP B 54 74.053 -2.273 -12.885 1.00 0.00 C ATOM 2081 OD1 ASP B 54 73.927 -1.264 -12.210 1.00 0.00 O ATOM 2082 OD2 ASP B 54 74.964 -2.456 -13.674 1.00 0.00 O ATOM 0 H ASP B 54 70.939 -4.773 -12.589 1.00 0.00 H new ATOM 0 HA ASP B 54 71.586 -2.068 -11.758 1.00 0.00 H new ATOM 0 HB2 ASP B 54 73.221 -3.976 -11.845 1.00 0.00 H new ATOM 0 HB3 ASP B 54 73.039 -4.050 -13.586 1.00 0.00 H new ATOM 2087 N PRO B 55 71.094 -0.653 -13.770 1.00 0.00 N ATOM 2088 CA PRO B 55 70.802 0.201 -14.925 1.00 0.00 C ATOM 2089 C PRO B 55 71.993 0.216 -15.892 1.00 0.00 C ATOM 2090 O PRO B 55 71.884 0.662 -17.017 1.00 0.00 O ATOM 2091 CB PRO B 55 70.574 1.606 -14.339 1.00 0.00 C ATOM 2092 CG PRO B 55 70.794 1.508 -12.798 1.00 0.00 C ATOM 2093 CD PRO B 55 71.129 0.041 -12.474 1.00 0.00 C ATOM 0 HA PRO B 55 69.938 -0.154 -15.487 1.00 0.00 H new ATOM 0 HB2 PRO B 55 71.266 2.323 -14.781 1.00 0.00 H new ATOM 0 HB3 PRO B 55 69.566 1.956 -14.562 1.00 0.00 H new ATOM 0 HG2 PRO B 55 71.604 2.165 -12.483 1.00 0.00 H new ATOM 0 HG3 PRO B 55 69.900 1.825 -12.262 1.00 0.00 H new ATOM 0 HD2 PRO B 55 72.110 -0.046 -12.006 1.00 0.00 H new ATOM 0 HD3 PRO B 55 70.405 -0.385 -11.779 1.00 0.00 H new ATOM 2101 N LYS B 56 73.134 -0.259 -15.460 1.00 0.00 N ATOM 2102 CA LYS B 56 74.323 -0.262 -16.346 1.00 0.00 C ATOM 2103 C LYS B 56 74.342 -1.541 -17.195 1.00 0.00 C ATOM 2104 O LYS B 56 75.346 -1.885 -17.786 1.00 0.00 O ATOM 2105 CB LYS B 56 75.592 -0.199 -15.493 1.00 0.00 C ATOM 2106 CG LYS B 56 76.198 1.203 -15.583 1.00 0.00 C ATOM 2107 CD LYS B 56 76.297 1.806 -14.180 1.00 0.00 C ATOM 2108 CE LYS B 56 77.065 3.127 -14.247 1.00 0.00 C ATOM 2109 NZ LYS B 56 77.946 3.250 -13.052 1.00 0.00 N ATOM 0 H LYS B 56 73.287 -0.645 -14.528 1.00 0.00 H new ATOM 0 HA LYS B 56 74.279 0.604 -17.006 1.00 0.00 H new ATOM 0 HB2 LYS B 56 75.358 -0.440 -14.456 1.00 0.00 H new ATOM 0 HB3 LYS B 56 76.312 -0.941 -15.838 1.00 0.00 H new ATOM 0 HG2 LYS B 56 77.186 1.155 -16.041 1.00 0.00 H new ATOM 0 HG3 LYS B 56 75.582 1.837 -16.221 1.00 0.00 H new ATOM 0 HD2 LYS B 56 75.300 1.973 -13.773 1.00 0.00 H new ATOM 0 HD3 LYS B 56 76.803 1.112 -13.509 1.00 0.00 H new ATOM 0 HE2 LYS B 56 77.662 3.167 -15.158 1.00 0.00 H new ATOM 0 HE3 LYS B 56 76.368 3.964 -14.286 1.00 0.00 H new ATOM 0 HZ1 LYS B 56 78.469 4.148 -13.097 1.00 0.00 H new ATOM 0 HZ2 LYS B 56 77.366 3.230 -12.189 1.00 0.00 H new ATOM 0 HZ3 LYS B 56 78.620 2.458 -13.034 1.00 0.00 H new ATOM 2123 N GLN B 57 73.243 -2.247 -17.262 1.00 0.00 N ATOM 2124 CA GLN B 57 73.212 -3.493 -18.072 1.00 0.00 C ATOM 2125 C GLN B 57 72.798 -3.153 -19.505 1.00 0.00 C ATOM 2126 O GLN B 57 72.402 -2.042 -19.800 1.00 0.00 O ATOM 2127 CB GLN B 57 72.202 -4.466 -17.463 1.00 0.00 C ATOM 2128 CG GLN B 57 72.947 -5.606 -16.764 1.00 0.00 C ATOM 2129 CD GLN B 57 73.043 -6.808 -17.705 1.00 0.00 C ATOM 2130 OE1 GLN B 57 73.514 -6.687 -18.818 1.00 0.00 O ATOM 2131 NE2 GLN B 57 72.615 -7.972 -17.302 1.00 0.00 N ATOM 0 H GLN B 57 72.369 -2.012 -16.791 1.00 0.00 H new ATOM 0 HA GLN B 57 74.200 -3.953 -18.079 1.00 0.00 H new ATOM 0 HB2 GLN B 57 71.563 -3.944 -16.750 1.00 0.00 H new ATOM 0 HB3 GLN B 57 71.552 -4.866 -18.241 1.00 0.00 H new ATOM 0 HG2 GLN B 57 73.945 -5.278 -16.474 1.00 0.00 H new ATOM 0 HG3 GLN B 57 72.426 -5.888 -15.849 1.00 0.00 H new ATOM 0 HE21 GLN B 57 72.219 -8.074 -16.367 1.00 0.00 H new ATOM 0 HE22 GLN B 57 72.676 -8.780 -17.921 1.00 0.00 H new ATOM 2140 N LYS B 58 72.895 -4.095 -20.402 1.00 0.00 N ATOM 2141 CA LYS B 58 72.518 -3.818 -21.817 1.00 0.00 C ATOM 2142 C LYS B 58 71.072 -4.244 -22.063 1.00 0.00 C ATOM 2143 O LYS B 58 70.442 -3.809 -23.008 1.00 0.00 O ATOM 2144 CB LYS B 58 73.444 -4.597 -22.754 1.00 0.00 C ATOM 2145 CG LYS B 58 73.072 -4.296 -24.208 1.00 0.00 C ATOM 2146 CD LYS B 58 71.960 -5.245 -24.660 1.00 0.00 C ATOM 2147 CE LYS B 58 72.485 -6.158 -25.768 1.00 0.00 C ATOM 2148 NZ LYS B 58 72.927 -5.329 -26.927 1.00 0.00 N ATOM 0 H LYS B 58 73.219 -5.044 -20.217 1.00 0.00 H new ATOM 0 HA LYS B 58 72.615 -2.750 -22.010 1.00 0.00 H new ATOM 0 HB2 LYS B 58 74.482 -4.321 -22.569 1.00 0.00 H new ATOM 0 HB3 LYS B 58 73.359 -5.666 -22.560 1.00 0.00 H new ATOM 0 HG2 LYS B 58 72.742 -3.261 -24.303 1.00 0.00 H new ATOM 0 HG3 LYS B 58 73.946 -4.412 -24.849 1.00 0.00 H new ATOM 0 HD2 LYS B 58 71.612 -5.842 -23.817 1.00 0.00 H new ATOM 0 HD3 LYS B 58 71.104 -4.674 -25.020 1.00 0.00 H new ATOM 0 HE2 LYS B 58 73.317 -6.757 -25.397 1.00 0.00 H new ATOM 0 HE3 LYS B 58 71.706 -6.854 -26.081 1.00 0.00 H new ATOM 0 HZ1 LYS B 58 72.721 -5.833 -27.813 1.00 0.00 H new ATOM 0 HZ2 LYS B 58 72.418 -4.422 -26.919 1.00 0.00 H new ATOM 0 HZ3 LYS B 58 73.950 -5.153 -26.858 1.00 0.00 H new ATOM 2162 N TRP B 59 70.526 -5.074 -21.217 1.00 0.00 N ATOM 2163 CA TRP B 59 69.120 -5.499 -21.415 1.00 0.00 C ATOM 2164 C TRP B 59 68.218 -4.612 -20.563 1.00 0.00 C ATOM 2165 O TRP B 59 67.069 -4.396 -20.876 1.00 0.00 O ATOM 2166 CB TRP B 59 68.961 -6.979 -21.019 1.00 0.00 C ATOM 2167 CG TRP B 59 69.012 -7.128 -19.530 1.00 0.00 C ATOM 2168 CD1 TRP B 59 70.144 -7.231 -18.791 1.00 0.00 C ATOM 2169 CD2 TRP B 59 67.904 -7.196 -18.595 1.00 0.00 C ATOM 2170 NE1 TRP B 59 69.796 -7.359 -17.455 1.00 0.00 N ATOM 2171 CE2 TRP B 59 68.427 -7.342 -17.280 1.00 0.00 C ATOM 2172 CE3 TRP B 59 66.494 -7.145 -18.754 1.00 0.00 C ATOM 2173 CZ2 TRP B 59 67.584 -7.436 -16.161 1.00 0.00 C ATOM 2174 CZ3 TRP B 59 65.644 -7.239 -17.624 1.00 0.00 C ATOM 2175 CH2 TRP B 59 66.198 -7.384 -16.331 1.00 0.00 C ATOM 0 H TRP B 59 70.993 -5.472 -20.402 1.00 0.00 H new ATOM 0 HA TRP B 59 68.839 -5.397 -22.463 1.00 0.00 H new ATOM 0 HB2 TRP B 59 68.014 -7.364 -21.397 1.00 0.00 H new ATOM 0 HB3 TRP B 59 69.752 -7.572 -21.478 1.00 0.00 H new ATOM 0 HD1 TRP B 59 71.152 -7.216 -19.179 1.00 0.00 H new ATOM 0 HE1 TRP B 59 70.469 -7.454 -16.695 1.00 0.00 H new ATOM 0 HE3 TRP B 59 66.068 -7.034 -19.740 1.00 0.00 H new ATOM 0 HZ2 TRP B 59 68.005 -7.548 -15.173 1.00 0.00 H new ATOM 0 HZ3 TRP B 59 64.572 -7.200 -17.750 1.00 0.00 H new ATOM 0 HH2 TRP B 59 65.548 -7.455 -15.472 1.00 0.00 H new ATOM 2186 N VAL B 60 68.749 -4.069 -19.503 1.00 0.00 N ATOM 2187 CA VAL B 60 67.944 -3.163 -18.655 1.00 0.00 C ATOM 2188 C VAL B 60 67.877 -1.785 -19.326 1.00 0.00 C ATOM 2189 O VAL B 60 67.079 -0.950 -18.969 1.00 0.00 O ATOM 2190 CB VAL B 60 68.594 -3.050 -17.276 1.00 0.00 C ATOM 2191 CG1 VAL B 60 67.867 -1.992 -16.448 1.00 0.00 C ATOM 2192 CG2 VAL B 60 68.496 -4.398 -16.567 1.00 0.00 C ATOM 0 H VAL B 60 69.709 -4.217 -19.191 1.00 0.00 H new ATOM 0 HA VAL B 60 66.934 -3.555 -18.537 1.00 0.00 H new ATOM 0 HB VAL B 60 69.640 -2.763 -17.389 1.00 0.00 H new ATOM 0 HG11 VAL B 60 68.333 -1.915 -15.466 1.00 0.00 H new ATOM 0 HG12 VAL B 60 67.927 -1.029 -16.955 1.00 0.00 H new ATOM 0 HG13 VAL B 60 66.821 -2.276 -16.332 1.00 0.00 H new ATOM 0 HG21 VAL B 60 68.958 -4.326 -15.582 1.00 0.00 H new ATOM 0 HG22 VAL B 60 67.448 -4.676 -16.457 1.00 0.00 H new ATOM 0 HG23 VAL B 60 69.013 -5.157 -17.155 1.00 0.00 H new ATOM 2202 N GLN B 61 68.688 -1.552 -20.323 1.00 0.00 N ATOM 2203 CA GLN B 61 68.627 -0.250 -21.033 1.00 0.00 C ATOM 2204 C GLN B 61 67.441 -0.286 -21.993 1.00 0.00 C ATOM 2205 O GLN B 61 66.849 0.728 -22.307 1.00 0.00 O ATOM 2206 CB GLN B 61 69.921 -0.029 -21.819 1.00 0.00 C ATOM 2207 CG GLN B 61 70.847 0.900 -21.029 1.00 0.00 C ATOM 2208 CD GLN B 61 70.881 2.276 -21.696 1.00 0.00 C ATOM 2209 OE1 GLN B 61 69.982 2.629 -22.434 1.00 0.00 O ATOM 2210 NE2 GLN B 61 71.887 3.075 -21.465 1.00 0.00 N ATOM 0 H GLN B 61 69.387 -2.207 -20.673 1.00 0.00 H new ATOM 0 HA GLN B 61 68.509 0.564 -20.318 1.00 0.00 H new ATOM 0 HB2 GLN B 61 70.415 -0.983 -22.002 1.00 0.00 H new ATOM 0 HB3 GLN B 61 69.697 0.406 -22.793 1.00 0.00 H new ATOM 0 HG2 GLN B 61 70.497 0.991 -20.001 1.00 0.00 H new ATOM 0 HG3 GLN B 61 71.852 0.480 -20.987 1.00 0.00 H new ATOM 0 HE21 GLN B 61 72.642 2.779 -20.846 1.00 0.00 H new ATOM 0 HE22 GLN B 61 71.919 3.995 -21.904 1.00 0.00 H new ATOM 2219 N ASP B 62 67.081 -1.457 -22.449 1.00 0.00 N ATOM 2220 CA ASP B 62 65.927 -1.575 -23.371 1.00 0.00 C ATOM 2221 C ASP B 62 64.641 -1.745 -22.555 1.00 0.00 C ATOM 2222 O ASP B 62 63.612 -1.181 -22.874 1.00 0.00 O ATOM 2223 CB ASP B 62 66.121 -2.792 -24.280 1.00 0.00 C ATOM 2224 CG ASP B 62 65.304 -2.608 -25.560 1.00 0.00 C ATOM 2225 OD1 ASP B 62 64.163 -2.191 -25.457 1.00 0.00 O ATOM 2226 OD2 ASP B 62 65.835 -2.888 -26.622 1.00 0.00 O ATOM 0 H ASP B 62 67.542 -2.337 -22.218 1.00 0.00 H new ATOM 0 HA ASP B 62 65.855 -0.675 -23.982 1.00 0.00 H new ATOM 0 HB2 ASP B 62 67.177 -2.913 -24.524 1.00 0.00 H new ATOM 0 HB3 ASP B 62 65.808 -3.699 -23.763 1.00 0.00 H new ATOM 2231 N SER B 63 64.697 -2.511 -21.498 1.00 0.00 N ATOM 2232 CA SER B 63 63.490 -2.715 -20.652 1.00 0.00 C ATOM 2233 C SER B 63 63.218 -1.445 -19.854 1.00 0.00 C ATOM 2234 O SER B 63 62.141 -0.893 -19.893 1.00 0.00 O ATOM 2235 CB SER B 63 63.752 -3.859 -19.683 1.00 0.00 C ATOM 2236 OG SER B 63 64.590 -4.824 -20.305 1.00 0.00 O ATOM 0 H SER B 63 65.532 -3.006 -21.185 1.00 0.00 H new ATOM 0 HA SER B 63 62.632 -2.948 -21.283 1.00 0.00 H new ATOM 0 HB2 SER B 63 64.225 -3.481 -18.777 1.00 0.00 H new ATOM 0 HB3 SER B 63 62.810 -4.319 -19.383 1.00 0.00 H new ATOM 0 HG SER B 63 65.527 -4.630 -20.092 1.00 0.00 H new ATOM 2242 N MET B 64 64.193 -0.986 -19.123 1.00 0.00 N ATOM 2243 CA MET B 64 64.015 0.252 -18.310 1.00 0.00 C ATOM 2244 C MET B 64 63.423 1.357 -19.184 1.00 0.00 C ATOM 2245 O MET B 64 62.761 2.248 -18.701 1.00 0.00 O ATOM 2246 CB MET B 64 65.373 0.700 -17.771 1.00 0.00 C ATOM 2247 CG MET B 64 65.201 1.953 -16.912 1.00 0.00 C ATOM 2248 SD MET B 64 66.468 3.173 -17.355 1.00 0.00 S ATOM 2249 CE MET B 64 67.889 2.048 -17.362 1.00 0.00 C ATOM 0 H MET B 64 65.114 -1.418 -19.052 1.00 0.00 H new ATOM 0 HA MET B 64 63.340 0.049 -17.479 1.00 0.00 H new ATOM 0 HB2 MET B 64 65.821 -0.099 -17.180 1.00 0.00 H new ATOM 0 HB3 MET B 64 66.053 0.905 -18.598 1.00 0.00 H new ATOM 0 HG2 MET B 64 64.207 2.375 -17.062 1.00 0.00 H new ATOM 0 HG3 MET B 64 65.283 1.696 -15.856 1.00 0.00 H new ATOM 0 HE1 MET B 64 68.789 2.597 -17.084 1.00 0.00 H new ATOM 0 HE2 MET B 64 67.719 1.243 -16.647 1.00 0.00 H new ATOM 0 HE3 MET B 64 68.015 1.627 -18.359 1.00 0.00 H new ATOM 2259 N ASP B 65 63.646 1.294 -20.471 1.00 0.00 N ATOM 2260 CA ASP B 65 63.087 2.322 -21.377 1.00 0.00 C ATOM 2261 C ASP B 65 61.653 1.949 -21.710 1.00 0.00 C ATOM 2262 O ASP B 65 60.777 2.787 -21.770 1.00 0.00 O ATOM 2263 CB ASP B 65 63.918 2.380 -22.662 1.00 0.00 C ATOM 2264 CG ASP B 65 64.782 3.642 -22.655 1.00 0.00 C ATOM 2265 OD1 ASP B 65 64.315 4.653 -22.160 1.00 0.00 O ATOM 2266 OD2 ASP B 65 65.896 3.575 -23.147 1.00 0.00 O ATOM 0 H ASP B 65 64.196 0.567 -20.929 1.00 0.00 H new ATOM 0 HA ASP B 65 63.113 3.299 -20.894 1.00 0.00 H new ATOM 0 HB2 ASP B 65 64.549 1.495 -22.740 1.00 0.00 H new ATOM 0 HB3 ASP B 65 63.262 2.381 -23.532 1.00 0.00 H new ATOM 2271 N HIS B 66 61.406 0.690 -21.907 1.00 0.00 N ATOM 2272 CA HIS B 66 60.027 0.241 -22.215 1.00 0.00 C ATOM 2273 C HIS B 66 59.105 0.677 -21.080 1.00 0.00 C ATOM 2274 O HIS B 66 57.935 0.941 -21.278 1.00 0.00 O ATOM 2275 CB HIS B 66 60.000 -1.284 -22.342 1.00 0.00 C ATOM 2276 CG HIS B 66 58.624 -1.727 -22.757 1.00 0.00 C ATOM 2277 ND1 HIS B 66 57.614 -2.350 -22.068 1.00 0.00 N flip ATOM 2278 CD2 HIS B 66 58.145 -1.543 -24.045 1.00 0.00 C flip ATOM 2279 CE1 HIS B 66 56.525 -2.550 -22.910 1.00 0.00 C flip ATOM 2280 NE2 HIS B 66 56.897 -2.045 -24.090 1.00 0.00 N flip ATOM 0 H HIS B 66 62.105 -0.052 -21.868 1.00 0.00 H new ATOM 0 HA HIS B 66 59.694 0.682 -23.154 1.00 0.00 H new ATOM 0 HB2 HIS B 66 60.736 -1.612 -23.076 1.00 0.00 H new ATOM 0 HB3 HIS B 66 60.271 -1.744 -21.392 1.00 0.00 H new ATOM 0 HD2 HIS B 66 58.677 -1.081 -24.864 1.00 0.00 H new ATOM 0 HE1 HIS B 66 55.581 -3.014 -22.663 1.00 0.00 H new ATOM 0 HE2 HIS B 66 56.308 -2.041 -24.922 1.00 0.00 H new ATOM 2288 N LEU B 67 59.635 0.775 -19.892 1.00 0.00 N ATOM 2289 CA LEU B 67 58.810 1.217 -18.739 1.00 0.00 C ATOM 2290 C LEU B 67 58.949 2.724 -18.599 1.00 0.00 C ATOM 2291 O LEU B 67 58.039 3.408 -18.174 1.00 0.00 O ATOM 2292 CB LEU B 67 59.297 0.526 -17.454 1.00 0.00 C ATOM 2293 CG LEU B 67 59.637 -0.942 -17.749 1.00 0.00 C ATOM 2294 CD1 LEU B 67 60.391 -1.543 -16.573 1.00 0.00 C ATOM 2295 CD2 LEU B 67 58.357 -1.726 -17.961 1.00 0.00 C ATOM 0 H LEU B 67 60.609 0.566 -19.672 1.00 0.00 H new ATOM 0 HA LEU B 67 57.766 0.952 -18.903 1.00 0.00 H new ATOM 0 HB2 LEU B 67 60.175 1.041 -17.064 1.00 0.00 H new ATOM 0 HB3 LEU B 67 58.526 0.583 -16.685 1.00 0.00 H new ATOM 0 HG LEU B 67 60.256 -0.989 -18.645 1.00 0.00 H new ATOM 0 HD11 LEU B 67 60.630 -2.585 -16.788 1.00 0.00 H new ATOM 0 HD12 LEU B 67 61.313 -0.986 -16.409 1.00 0.00 H new ATOM 0 HD13 LEU B 67 59.771 -1.490 -15.678 1.00 0.00 H new ATOM 0 HD21 LEU B 67 58.599 -2.768 -18.170 1.00 0.00 H new ATOM 0 HD22 LEU B 67 57.743 -1.670 -17.062 1.00 0.00 H new ATOM 0 HD23 LEU B 67 57.808 -1.305 -18.803 1.00 0.00 H new ATOM 2307 N ASP B 68 60.069 3.253 -18.998 1.00 0.00 N ATOM 2308 CA ASP B 68 60.256 4.715 -18.942 1.00 0.00 C ATOM 2309 C ASP B 68 59.297 5.376 -19.932 1.00 0.00 C ATOM 2310 O ASP B 68 59.081 6.571 -19.898 1.00 0.00 O ATOM 2311 CB ASP B 68 61.702 5.059 -19.309 1.00 0.00 C ATOM 2312 CG ASP B 68 62.352 5.829 -18.159 1.00 0.00 C ATOM 2313 OD1 ASP B 68 61.638 6.541 -17.470 1.00 0.00 O ATOM 2314 OD2 ASP B 68 63.552 5.695 -17.985 1.00 0.00 O ATOM 0 H ASP B 68 60.864 2.727 -19.362 1.00 0.00 H new ATOM 0 HA ASP B 68 60.049 5.078 -17.935 1.00 0.00 H new ATOM 0 HB2 ASP B 68 62.263 4.147 -19.513 1.00 0.00 H new ATOM 0 HB3 ASP B 68 61.724 5.657 -20.220 1.00 0.00 H new ATOM 2319 N LYS B 69 58.702 4.601 -20.809 1.00 0.00 N ATOM 2320 CA LYS B 69 57.751 5.179 -21.772 1.00 0.00 C ATOM 2321 C LYS B 69 56.543 4.260 -21.907 1.00 0.00 C ATOM 2322 O LYS B 69 56.010 4.065 -22.982 1.00 0.00 O ATOM 2323 CB LYS B 69 58.432 5.358 -23.135 1.00 0.00 C ATOM 2324 CG LYS B 69 58.772 3.985 -23.728 1.00 0.00 C ATOM 2325 CD LYS B 69 59.979 4.114 -24.658 1.00 0.00 C ATOM 2326 CE LYS B 69 59.748 3.269 -25.912 1.00 0.00 C ATOM 2327 NZ LYS B 69 61.058 2.792 -26.438 1.00 0.00 N ATOM 0 H LYS B 69 58.844 3.594 -20.888 1.00 0.00 H new ATOM 0 HA LYS B 69 57.421 6.154 -21.414 1.00 0.00 H new ATOM 0 HB2 LYS B 69 57.775 5.904 -23.812 1.00 0.00 H new ATOM 0 HB3 LYS B 69 59.339 5.951 -23.024 1.00 0.00 H new ATOM 0 HG2 LYS B 69 58.990 3.276 -22.929 1.00 0.00 H new ATOM 0 HG3 LYS B 69 57.916 3.593 -24.278 1.00 0.00 H new ATOM 0 HD2 LYS B 69 60.130 5.158 -24.933 1.00 0.00 H new ATOM 0 HD3 LYS B 69 60.883 3.785 -24.146 1.00 0.00 H new ATOM 0 HE2 LYS B 69 59.107 2.419 -25.678 1.00 0.00 H new ATOM 0 HE3 LYS B 69 59.232 3.858 -26.670 1.00 0.00 H new ATOM 0 HZ1 LYS B 69 60.901 2.217 -27.291 1.00 0.00 H new ATOM 0 HZ2 LYS B 69 61.655 3.610 -26.676 1.00 0.00 H new ATOM 0 HZ3 LYS B 69 61.533 2.216 -25.715 1.00 0.00 H new ATOM 2341 N GLN B 70 56.108 3.697 -20.822 1.00 0.00 N ATOM 2342 CA GLN B 70 54.940 2.798 -20.867 1.00 0.00 C ATOM 2343 C GLN B 70 53.654 3.612 -20.707 1.00 0.00 C ATOM 2344 O GLN B 70 52.574 3.155 -21.023 1.00 0.00 O ATOM 2345 CB GLN B 70 55.040 1.771 -19.737 1.00 0.00 C ATOM 2346 CG GLN B 70 55.407 0.404 -20.320 1.00 0.00 C ATOM 2347 CD GLN B 70 54.371 -0.632 -19.880 1.00 0.00 C ATOM 2348 OE1 GLN B 70 54.719 -1.730 -19.494 1.00 0.00 O ATOM 2349 NE2 GLN B 70 53.103 -0.328 -19.922 1.00 0.00 N ATOM 0 H GLN B 70 56.519 3.825 -19.897 1.00 0.00 H new ATOM 0 HA GLN B 70 54.921 2.281 -21.827 1.00 0.00 H new ATOM 0 HB2 GLN B 70 55.793 2.083 -19.013 1.00 0.00 H new ATOM 0 HB3 GLN B 70 54.091 1.708 -19.204 1.00 0.00 H new ATOM 0 HG2 GLN B 70 55.443 0.458 -21.408 1.00 0.00 H new ATOM 0 HG3 GLN B 70 56.400 0.107 -19.982 1.00 0.00 H new ATOM 0 HE21 GLN B 70 52.810 0.594 -20.246 1.00 0.00 H new ATOM 0 HE22 GLN B 70 52.405 -1.012 -19.631 1.00 0.00 H new ATOM 2358 N THR B 71 53.762 4.813 -20.215 1.00 0.00 N ATOM 2359 CA THR B 71 52.559 5.654 -20.030 1.00 0.00 C ATOM 2360 C THR B 71 52.627 6.859 -20.971 1.00 0.00 C ATOM 2361 O THR B 71 52.278 7.964 -20.606 1.00 0.00 O ATOM 2362 CB THR B 71 52.497 6.142 -18.582 1.00 0.00 C ATOM 2363 OG1 THR B 71 51.377 7.002 -18.420 1.00 0.00 O ATOM 2364 CG2 THR B 71 53.779 6.903 -18.248 1.00 0.00 C ATOM 0 H THR B 71 54.641 5.247 -19.932 1.00 0.00 H new ATOM 0 HA THR B 71 51.668 5.068 -20.256 1.00 0.00 H new ATOM 0 HB THR B 71 52.397 5.288 -17.913 1.00 0.00 H new ATOM 0 HG1 THR B 71 51.477 7.783 -19.004 1.00 0.00 H new ATOM 0 HG21 THR B 71 53.737 7.252 -17.216 1.00 0.00 H new ATOM 0 HG22 THR B 71 54.637 6.243 -18.373 1.00 0.00 H new ATOM 0 HG23 THR B 71 53.879 7.758 -18.916 1.00 0.00 H new ATOM 2372 N GLN B 72 53.081 6.656 -22.176 1.00 0.00 N ATOM 2373 CA GLN B 72 53.179 7.784 -23.132 1.00 0.00 C ATOM 2374 C GLN B 72 51.865 7.919 -23.903 1.00 0.00 C ATOM 2375 O GLN B 72 51.586 7.162 -24.811 1.00 0.00 O ATOM 2376 CB GLN B 72 54.324 7.522 -24.114 1.00 0.00 C ATOM 2377 CG GLN B 72 55.626 8.082 -23.539 1.00 0.00 C ATOM 2378 CD GLN B 72 56.154 9.188 -24.454 1.00 0.00 C ATOM 2379 OE1 GLN B 72 55.916 9.172 -25.646 1.00 0.00 O ATOM 2380 NE2 GLN B 72 56.867 10.154 -23.945 1.00 0.00 N ATOM 0 H GLN B 72 53.388 5.753 -22.537 1.00 0.00 H new ATOM 0 HA GLN B 72 53.373 8.707 -22.585 1.00 0.00 H new ATOM 0 HB2 GLN B 72 54.424 6.452 -24.295 1.00 0.00 H new ATOM 0 HB3 GLN B 72 54.108 7.989 -25.075 1.00 0.00 H new ATOM 0 HG2 GLN B 72 55.454 8.476 -22.537 1.00 0.00 H new ATOM 0 HG3 GLN B 72 56.366 7.288 -23.447 1.00 0.00 H new ATOM 0 HE21 GLN B 72 57.067 10.168 -22.945 1.00 0.00 H new ATOM 0 HE22 GLN B 72 57.225 10.896 -24.547 1.00 0.00 H new ATOM 2389 N THR B 73 51.056 8.878 -23.548 1.00 0.00 N ATOM 2390 CA THR B 73 49.760 9.064 -24.259 1.00 0.00 C ATOM 2391 C THR B 73 49.781 10.401 -25.021 1.00 0.00 C ATOM 2392 O THR B 73 49.370 11.414 -24.492 1.00 0.00 O ATOM 2393 CB THR B 73 48.619 9.077 -23.239 1.00 0.00 C ATOM 2394 OG1 THR B 73 48.584 7.833 -22.554 1.00 0.00 O ATOM 2395 CG2 THR B 73 47.292 9.299 -23.963 1.00 0.00 C ATOM 0 H THR B 73 51.237 9.542 -22.795 1.00 0.00 H new ATOM 0 HA THR B 73 49.610 8.246 -24.964 1.00 0.00 H new ATOM 0 HB THR B 73 48.780 9.882 -22.522 1.00 0.00 H new ATOM 0 HG1 THR B 73 47.855 7.841 -21.899 1.00 0.00 H new ATOM 0 HG21 THR B 73 46.479 9.308 -23.237 1.00 0.00 H new ATOM 0 HG22 THR B 73 47.320 10.253 -24.489 1.00 0.00 H new ATOM 0 HG23 THR B 73 47.129 8.494 -24.680 1.00 0.00 H new ATOM 2403 N PRO B 74 50.266 10.364 -26.251 1.00 0.00 N ATOM 2404 CA PRO B 74 50.343 11.567 -27.083 1.00 0.00 C ATOM 2405 C PRO B 74 48.946 12.158 -27.292 1.00 0.00 C ATOM 2406 O PRO B 74 48.170 11.675 -28.093 1.00 0.00 O ATOM 2407 CB PRO B 74 50.934 11.090 -28.422 1.00 0.00 C ATOM 2408 CG PRO B 74 51.198 9.556 -28.295 1.00 0.00 C ATOM 2409 CD PRO B 74 50.759 9.131 -26.883 1.00 0.00 C ATOM 0 HA PRO B 74 50.951 12.347 -26.624 1.00 0.00 H new ATOM 0 HB2 PRO B 74 50.244 11.294 -29.241 1.00 0.00 H new ATOM 0 HB3 PRO B 74 51.859 11.622 -28.645 1.00 0.00 H new ATOM 0 HG2 PRO B 74 50.640 9.006 -29.053 1.00 0.00 H new ATOM 0 HG3 PRO B 74 52.253 9.333 -28.452 1.00 0.00 H new ATOM 0 HD2 PRO B 74 49.980 8.370 -26.924 1.00 0.00 H new ATOM 0 HD3 PRO B 74 51.591 8.705 -26.322 1.00 0.00 H new ATOM 2417 N LYS B 75 48.620 13.200 -26.577 1.00 0.00 N ATOM 2418 CA LYS B 75 47.275 13.822 -26.735 1.00 0.00 C ATOM 2419 C LYS B 75 47.114 14.334 -28.167 1.00 0.00 C ATOM 2420 O LYS B 75 47.671 15.346 -28.541 1.00 0.00 O ATOM 2421 CB LYS B 75 47.136 14.991 -25.756 1.00 0.00 C ATOM 2422 CG LYS B 75 46.511 14.492 -24.453 1.00 0.00 C ATOM 2423 CD LYS B 75 46.685 15.554 -23.365 1.00 0.00 C ATOM 2424 CE LYS B 75 47.925 15.230 -22.529 1.00 0.00 C ATOM 2425 NZ LYS B 75 49.083 16.023 -23.029 1.00 0.00 N ATOM 0 H LYS B 75 49.227 13.647 -25.890 1.00 0.00 H new ATOM 0 HA LYS B 75 46.505 13.080 -26.527 1.00 0.00 H new ATOM 0 HB2 LYS B 75 48.113 15.432 -25.558 1.00 0.00 H new ATOM 0 HB3 LYS B 75 46.516 15.774 -26.193 1.00 0.00 H new ATOM 0 HG2 LYS B 75 45.452 14.279 -24.603 1.00 0.00 H new ATOM 0 HG3 LYS B 75 46.983 13.559 -24.145 1.00 0.00 H new ATOM 0 HD2 LYS B 75 46.786 16.540 -23.818 1.00 0.00 H new ATOM 0 HD3 LYS B 75 45.801 15.585 -22.727 1.00 0.00 H new ATOM 0 HE2 LYS B 75 47.739 15.460 -21.480 1.00 0.00 H new ATOM 0 HE3 LYS B 75 48.148 14.165 -22.588 1.00 0.00 H new ATOM 0 HZ1 LYS B 75 49.820 16.061 -22.296 1.00 0.00 H new ATOM 0 HZ2 LYS B 75 49.468 15.574 -23.885 1.00 0.00 H new ATOM 0 HZ3 LYS B 75 48.770 16.989 -23.256 1.00 0.00 H new ATOM 2439 N THR B 76 46.357 13.641 -28.973 1.00 0.00 N ATOM 2440 CA THR B 76 46.161 14.089 -30.381 1.00 0.00 C ATOM 2441 C THR B 76 44.798 14.772 -30.514 1.00 0.00 C ATOM 2442 O THR B 76 43.839 14.248 -29.971 1.00 0.00 O ATOM 2443 CB THR B 76 46.219 12.878 -31.314 1.00 0.00 C ATOM 2444 OG1 THR B 76 47.165 11.942 -30.817 1.00 0.00 O ATOM 2445 CG2 THR B 76 46.634 13.330 -32.714 1.00 0.00 C ATOM 2446 OXT THR B 76 44.737 15.808 -31.156 1.00 0.00 O ATOM 0 H THR B 76 45.866 12.784 -28.718 1.00 0.00 H new ATOM 0 HA THR B 76 46.948 14.793 -30.651 1.00 0.00 H new ATOM 0 HB THR B 76 45.236 12.410 -31.362 1.00 0.00 H new ATOM 0 HG1 THR B 76 47.201 11.165 -31.414 1.00 0.00 H new ATOM 0 HG21 THR B 76 46.675 12.466 -33.378 1.00 0.00 H new ATOM 0 HG22 THR B 76 45.907 14.047 -33.095 1.00 0.00 H new ATOM 0 HG23 THR B 76 47.617 13.800 -32.668 1.00 0.00 H new TER 2454 THR B 76