USER MOD reduce.3.24.130724 H: found=0, std=0, add=1240, rem=0, adj=42 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+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: B 14 ASN :FLIP amide:sc= -1.53 F(o=-2.6!,f=-1.5) USER MOD Set 2.1: A 14 ASN :FLIP amide:sc= -1.52 F(o=-2.5!,f=-1.5) USER MOD Set 2.2: B 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.1: A 10 THR OG1 : rot 180:sc= -0.361 USER MOD Set 3.2: B 10 THR OG1 : rot 180:sc= -0.36 USER MOD Single : A 1 GLN : amide:sc= -0.379 K(o=-0.38,f=-1.9!) USER MOD Single : A 1 GLN N :NH3+ -104:sc= -0.0202 (180deg=-0.536) USER MOD Single : A 6 ASN :FLIP amide:sc= -4.48! C(o=-5.1!,f=-4.5!) USER MOD Single : A 13 TYR OH : rot 138:sc= -1.43! USER MOD Single : A 16 THR OG1 : rot -107:sc= 0.694 USER MOD Single : A 17 ASN : amide:sc= -0.644 K(o=-0.64,f=-2) USER MOD Single : A 19 LYS NZ :NH3+ 156:sc= -0.0224 (180deg=-0.35) USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 23 GLN : amide:sc= -0.0272 X(o=-0.027,f=0) USER MOD Single : A 27 SER OG : rot 53:sc= 0.165 USER MOD Single : A 28 TYR OH : rot -49:sc= 0.139 USER MOD Single : A 32 THR OG1 : rot 180:sc= -0.889 USER MOD Single : A 33 SER OG : rot 150:sc= 0 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 -87:sc= -0.813 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 GLN :FLIP amide:sc= -1.18 F(o=-3.6!,f=-1.2) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 GLN : amide:sc= 0 K(o=0,f=-0.79) USER MOD Single : A 63 SER OG : rot 71:sc= 0.0349 USER MOD Single : A 64 MET CE :methyl -169:sc= -0.213 (180deg=-0.313) USER MOD Single : A 66 HIS :FLIP no HD1:sc= -1.42 F(o=-3,f=-1.4) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 GLN : amide:sc= -2.42! C(o=-2.4!,f=-2.1!) USER MOD Single : A 71 THR OG1 : rot 68:sc= 0.984 USER MOD Single : A 72 GLN : amide:sc= 0 X(o=0,f=0.00083) USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0.0522 USER MOD Single : B 1 GLN : amide:sc= -0.305 K(o=-0.3,f=-2!) USER MOD Single : B 1 GLN N :NH3+ -106:sc= -0.0116 (180deg=-0.583) USER MOD Single : B 6 ASN :FLIP amide:sc= -4.43! C(o=-5.1!,f=-4.4!) USER MOD Single : B 13 TYR OH : rot 130:sc= -1.43! USER MOD Single : B 16 THR OG1 : rot -112:sc= 0.702 USER MOD Single : B 17 ASN : amide:sc= -0.652 K(o=-0.65,f=-1.9) USER MOD Single : B 19 LYS NZ :NH3+ 157:sc= -0.0457 (180deg=-0.344) USER MOD Single : B 21 SER OG : rot 180:sc= 0 USER MOD Single : B 23 GLN : amide:sc= -0.0449 X(o=-0.045,f=0) USER MOD Single : B 27 SER OG : rot 53:sc= 0.162 USER MOD Single : B 28 TYR OH : rot -50:sc= 0.148 USER MOD Single : B 32 THR OG1 : rot 180:sc= -0.967 USER MOD Single : B 33 SER OG : rot 150:sc= 0 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 -87:sc= -0.875 USER MOD Single : B 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 57 GLN :FLIP amide:sc= -1.03 F(o=-3.4!,f=-1) USER MOD Single : B 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 61 GLN : amide:sc= 0 K(o=0,f=-0.76) USER MOD Single : B 63 SER OG : rot 71:sc= -0.0388 USER MOD Single : B 64 MET CE :methyl -171:sc= -0.2 (180deg=-0.306) USER MOD Single : B 66 HIS :FLIP no HD1:sc= -1.38 F(o=-2.9,f=-1.4) USER MOD Single : B 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 70 GLN : amide:sc= -2.41! C(o=-2.4!,f=-2.2!) USER MOD Single : B 71 THR OG1 : rot 68:sc= 0.85 USER MOD Single : B 72 GLN : amide:sc= 0 X(o=0,f=0.00064) USER MOD Single : B 73 THR OG1 : rot 180:sc= 0 USER MOD Single : B 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 76 THR OG1 : rot 180:sc= 0.0305 USER MOD ----------------------------------------------------------------- ATOM 1 N GLN A 1 68.930 -21.508 -6.599 1.00 0.00 N ATOM 2 CA GLN A 1 67.641 -20.898 -7.034 1.00 0.00 C ATOM 3 C GLN A 1 67.369 -19.631 -6.207 1.00 0.00 C ATOM 4 O GLN A 1 66.638 -19.676 -5.239 1.00 0.00 O ATOM 5 CB GLN A 1 66.505 -21.901 -6.821 1.00 0.00 C ATOM 6 CG GLN A 1 66.233 -22.649 -8.127 1.00 0.00 C ATOM 7 CD GLN A 1 64.741 -22.568 -8.461 1.00 0.00 C ATOM 8 OE1 GLN A 1 63.922 -22.362 -7.588 1.00 0.00 O ATOM 9 NE2 GLN A 1 64.352 -22.721 -9.697 1.00 0.00 N ATOM 0 H1 GLN A 1 69.667 -21.302 -7.303 1.00 0.00 H new ATOM 0 H2 GLN A 1 69.209 -21.111 -5.679 1.00 0.00 H new ATOM 0 H3 GLN A 1 68.814 -22.538 -6.511 1.00 0.00 H new ATOM 0 HA GLN A 1 67.701 -20.636 -8.090 1.00 0.00 H new ATOM 0 HB2 GLN A 1 66.771 -22.607 -6.034 1.00 0.00 H new ATOM 0 HB3 GLN A 1 65.604 -21.382 -6.492 1.00 0.00 H new ATOM 0 HG2 GLN A 1 66.822 -22.216 -8.936 1.00 0.00 H new ATOM 0 HG3 GLN A 1 66.539 -23.691 -8.032 1.00 0.00 H new ATOM 0 HE21 GLN A 1 65.040 -22.894 -10.430 1.00 0.00 H new ATOM 0 HE22 GLN A 1 63.360 -22.668 -9.930 1.00 0.00 H new ATOM 20 N PRO A 2 67.971 -18.529 -6.619 1.00 0.00 N ATOM 21 CA PRO A 2 67.799 -17.251 -5.925 1.00 0.00 C ATOM 22 C PRO A 2 66.326 -16.832 -5.944 1.00 0.00 C ATOM 23 O PRO A 2 65.882 -16.127 -6.827 1.00 0.00 O ATOM 24 CB PRO A 2 68.655 -16.248 -6.718 1.00 0.00 C ATOM 25 CG PRO A 2 69.320 -17.030 -7.895 1.00 0.00 C ATOM 26 CD PRO A 2 68.852 -18.493 -7.794 1.00 0.00 C ATOM 0 HA PRO A 2 68.100 -17.306 -4.879 1.00 0.00 H new ATOM 0 HB2 PRO A 2 68.038 -15.434 -7.098 1.00 0.00 H new ATOM 0 HB3 PRO A 2 69.414 -15.800 -6.077 1.00 0.00 H new ATOM 0 HG2 PRO A 2 69.032 -16.600 -8.854 1.00 0.00 H new ATOM 0 HG3 PRO A 2 70.406 -16.969 -7.832 1.00 0.00 H new ATOM 0 HD2 PRO A 2 68.321 -18.801 -8.695 1.00 0.00 H new ATOM 0 HD3 PRO A 2 69.697 -19.171 -7.675 1.00 0.00 H new ATOM 34 N ASP A 3 65.564 -17.268 -4.977 1.00 0.00 N ATOM 35 CA ASP A 3 64.125 -16.905 -4.940 1.00 0.00 C ATOM 36 C ASP A 3 63.977 -15.398 -4.711 1.00 0.00 C ATOM 37 O ASP A 3 63.889 -14.939 -3.589 1.00 0.00 O ATOM 38 CB ASP A 3 63.436 -17.664 -3.804 1.00 0.00 C ATOM 39 CG ASP A 3 63.554 -19.169 -4.050 1.00 0.00 C ATOM 40 OD1 ASP A 3 63.684 -19.552 -5.200 1.00 0.00 O ATOM 41 OD2 ASP A 3 63.514 -19.912 -3.083 1.00 0.00 O ATOM 0 H ASP A 3 65.881 -17.862 -4.210 1.00 0.00 H new ATOM 0 HA ASP A 3 63.662 -17.172 -5.890 1.00 0.00 H new ATOM 0 HB2 ASP A 3 63.893 -17.404 -2.849 1.00 0.00 H new ATOM 0 HB3 ASP A 3 62.386 -17.376 -3.744 1.00 0.00 H new ATOM 46 N ALA A 4 63.943 -14.627 -5.763 1.00 0.00 N ATOM 47 CA ALA A 4 63.795 -13.152 -5.604 1.00 0.00 C ATOM 48 C ALA A 4 65.001 -12.598 -4.847 1.00 0.00 C ATOM 49 O ALA A 4 64.865 -11.868 -3.886 1.00 0.00 O ATOM 50 CB ALA A 4 62.516 -12.848 -4.821 1.00 0.00 C ATOM 0 H ALA A 4 64.011 -14.955 -6.727 1.00 0.00 H new ATOM 0 HA ALA A 4 63.737 -12.685 -6.587 1.00 0.00 H new ATOM 0 HB1 ALA A 4 62.408 -11.770 -4.705 1.00 0.00 H new ATOM 0 HB2 ALA A 4 61.656 -13.243 -5.362 1.00 0.00 H new ATOM 0 HB3 ALA A 4 62.572 -13.315 -3.838 1.00 0.00 H new ATOM 56 N ILE A 5 66.181 -12.942 -5.274 1.00 0.00 N ATOM 57 CA ILE A 5 67.397 -12.441 -4.588 1.00 0.00 C ATOM 58 C ILE A 5 67.620 -10.978 -4.958 1.00 0.00 C ATOM 59 O ILE A 5 68.062 -10.183 -4.155 1.00 0.00 O ATOM 60 CB ILE A 5 68.604 -13.291 -5.025 1.00 0.00 C ATOM 61 CG1 ILE A 5 69.389 -13.724 -3.791 1.00 0.00 C ATOM 62 CG2 ILE A 5 69.519 -12.485 -5.959 1.00 0.00 C ATOM 63 CD1 ILE A 5 68.478 -14.536 -2.868 1.00 0.00 C ATOM 0 H ILE A 5 66.355 -13.552 -6.073 1.00 0.00 H new ATOM 0 HA ILE A 5 67.276 -12.517 -3.507 1.00 0.00 H new ATOM 0 HB ILE A 5 68.243 -14.168 -5.561 1.00 0.00 H new ATOM 0 HG12 ILE A 5 70.252 -14.321 -4.086 1.00 0.00 H new ATOM 0 HG13 ILE A 5 69.772 -12.850 -3.265 1.00 0.00 H new ATOM 0 HG21 ILE A 5 70.367 -13.101 -6.258 1.00 0.00 H new ATOM 0 HG22 ILE A 5 68.960 -12.183 -6.844 1.00 0.00 H new ATOM 0 HG23 ILE A 5 69.881 -11.598 -5.438 1.00 0.00 H new ATOM 0 HD11 ILE A 5 69.038 -14.846 -1.986 1.00 0.00 H new ATOM 0 HD12 ILE A 5 67.630 -13.923 -2.563 1.00 0.00 H new ATOM 0 HD13 ILE A 5 68.117 -15.418 -3.397 1.00 0.00 H new ATOM 75 N ASN A 6 67.332 -10.632 -6.173 1.00 0.00 N ATOM 76 CA ASN A 6 67.531 -9.223 -6.610 1.00 0.00 C ATOM 77 C ASN A 6 66.291 -8.436 -6.238 1.00 0.00 C ATOM 78 O ASN A 6 65.596 -7.929 -7.075 1.00 0.00 O ATOM 79 CB ASN A 6 67.764 -9.112 -8.146 1.00 0.00 C ATOM 80 CG ASN A 6 67.708 -10.487 -8.833 1.00 0.00 C ATOM 81 OD1 ASN A 6 66.556 -11.088 -8.972 1.00 0.00 O flip ATOM 82 ND2 ASN A 6 68.722 -11.014 -9.245 1.00 0.00 N flip ATOM 0 H ASN A 6 66.966 -11.262 -6.887 1.00 0.00 H new ATOM 0 HA ASN A 6 68.419 -8.829 -6.115 1.00 0.00 H new ATOM 0 HB2 ASN A 6 67.010 -8.457 -8.582 1.00 0.00 H new ATOM 0 HB3 ASN A 6 68.734 -8.651 -8.334 1.00 0.00 H new ATOM 0 HD21 ASN A 6 69.621 -10.545 -9.136 1.00 0.00 H new ATOM 0 HD22 ASN A 6 68.674 -11.926 -9.700 1.00 0.00 H new ATOM 89 N ALA A 7 65.987 -8.377 -4.987 1.00 0.00 N ATOM 90 CA ALA A 7 64.768 -7.649 -4.545 1.00 0.00 C ATOM 91 C ALA A 7 65.155 -6.352 -3.830 1.00 0.00 C ATOM 92 O ALA A 7 65.992 -6.372 -2.948 1.00 0.00 O ATOM 93 CB ALA A 7 63.991 -8.514 -3.556 1.00 0.00 C ATOM 0 H ALA A 7 66.531 -8.804 -4.237 1.00 0.00 H new ATOM 0 HA ALA A 7 64.163 -7.425 -5.423 1.00 0.00 H new ATOM 0 HB1 ALA A 7 63.097 -7.982 -3.231 1.00 0.00 H new ATOM 0 HB2 ALA A 7 63.702 -9.448 -4.038 1.00 0.00 H new ATOM 0 HB3 ALA A 7 64.618 -8.731 -2.691 1.00 0.00 H new ATOM 99 N PRO A 8 64.477 -5.265 -4.162 1.00 0.00 N ATOM 100 CA PRO A 8 64.701 -4.011 -3.471 1.00 0.00 C ATOM 101 C PRO A 8 64.294 -4.207 -2.028 1.00 0.00 C ATOM 102 O PRO A 8 63.124 -4.229 -1.697 1.00 0.00 O ATOM 103 CB PRO A 8 63.794 -2.994 -4.156 1.00 0.00 C ATOM 104 CG PRO A 8 63.048 -3.745 -5.300 1.00 0.00 C ATOM 105 CD PRO A 8 63.475 -5.220 -5.230 1.00 0.00 C ATOM 0 HA PRO A 8 65.738 -3.677 -3.500 1.00 0.00 H new ATOM 0 HB2 PRO A 8 63.084 -2.571 -3.446 1.00 0.00 H new ATOM 0 HB3 PRO A 8 64.378 -2.165 -4.556 1.00 0.00 H new ATOM 0 HG2 PRO A 8 61.969 -3.651 -5.182 1.00 0.00 H new ATOM 0 HG3 PRO A 8 63.301 -3.317 -6.270 1.00 0.00 H new ATOM 0 HD2 PRO A 8 62.627 -5.868 -5.006 1.00 0.00 H new ATOM 0 HD3 PRO A 8 63.892 -5.557 -6.179 1.00 0.00 H new ATOM 113 N VAL A 9 65.234 -4.430 -1.187 1.00 0.00 N ATOM 114 CA VAL A 9 64.914 -4.721 0.221 1.00 0.00 C ATOM 115 C VAL A 9 64.806 -3.411 1.006 1.00 0.00 C ATOM 116 O VAL A 9 65.778 -2.710 1.206 1.00 0.00 O ATOM 117 CB VAL A 9 66.038 -5.571 0.779 1.00 0.00 C ATOM 118 CG1 VAL A 9 67.334 -4.797 0.649 1.00 0.00 C ATOM 119 CG2 VAL A 9 65.768 -5.905 2.238 1.00 0.00 C ATOM 0 H VAL A 9 66.229 -4.424 -1.413 1.00 0.00 H new ATOM 0 HA VAL A 9 63.963 -5.248 0.301 1.00 0.00 H new ATOM 0 HB VAL A 9 66.108 -6.507 0.224 1.00 0.00 H new ATOM 0 HG11 VAL A 9 68.155 -5.394 1.046 1.00 0.00 H new ATOM 0 HG12 VAL A 9 67.521 -4.575 -0.402 1.00 0.00 H new ATOM 0 HG13 VAL A 9 67.259 -3.865 1.209 1.00 0.00 H new ATOM 0 HG21 VAL A 9 66.582 -6.516 2.628 1.00 0.00 H new ATOM 0 HG22 VAL A 9 65.697 -4.983 2.815 1.00 0.00 H new ATOM 0 HG23 VAL A 9 64.831 -6.456 2.318 1.00 0.00 H new ATOM 129 N THR A 10 63.632 -3.070 1.445 1.00 0.00 N ATOM 130 CA THR A 10 63.473 -1.806 2.204 1.00 0.00 C ATOM 131 C THR A 10 64.039 -1.977 3.609 1.00 0.00 C ATOM 132 O THR A 10 63.455 -2.631 4.449 1.00 0.00 O ATOM 133 CB THR A 10 61.997 -1.438 2.294 1.00 0.00 C ATOM 134 OG1 THR A 10 61.421 -1.464 0.994 1.00 0.00 O ATOM 135 CG2 THR A 10 61.869 -0.037 2.883 1.00 0.00 C ATOM 0 H THR A 10 62.777 -3.611 1.311 1.00 0.00 H new ATOM 0 HA THR A 10 64.012 -1.011 1.688 1.00 0.00 H new ATOM 0 HB THR A 10 61.476 -2.153 2.931 1.00 0.00 H new ATOM 0 HG1 THR A 10 60.471 -1.229 1.052 1.00 0.00 H new ATOM 0 HG21 THR A 10 60.815 0.234 2.951 1.00 0.00 H new ATOM 0 HG22 THR A 10 62.313 -0.019 3.878 1.00 0.00 H new ATOM 0 HG23 THR A 10 62.387 0.676 2.241 1.00 0.00 H new ATOM 143 N CYS A 11 65.167 -1.382 3.878 1.00 0.00 N ATOM 144 CA CYS A 11 65.762 -1.501 5.242 1.00 0.00 C ATOM 145 C CYS A 11 66.057 -0.107 5.796 1.00 0.00 C ATOM 146 O CYS A 11 65.492 0.878 5.363 1.00 0.00 O ATOM 147 CB CYS A 11 67.064 -2.305 5.183 1.00 0.00 C ATOM 148 SG CYS A 11 66.813 -3.798 4.202 1.00 0.00 S ATOM 0 H CYS A 11 65.703 -0.820 3.216 1.00 0.00 H new ATOM 0 HA CYS A 11 65.053 -2.014 5.891 1.00 0.00 H new ATOM 0 HB2 CYS A 11 67.857 -1.699 4.745 1.00 0.00 H new ATOM 0 HB3 CYS A 11 67.385 -2.570 6.190 1.00 0.00 H new ATOM 153 N CYS A 12 66.941 -0.017 6.749 1.00 0.00 N ATOM 154 CA CYS A 12 67.281 1.312 7.334 1.00 0.00 C ATOM 155 C CYS A 12 68.798 1.389 7.544 1.00 0.00 C ATOM 156 O CYS A 12 69.527 0.478 7.210 1.00 0.00 O ATOM 157 CB CYS A 12 66.592 1.474 8.695 1.00 0.00 C ATOM 158 SG CYS A 12 64.910 0.820 8.620 1.00 0.00 S ATOM 0 H CYS A 12 67.445 -0.808 7.150 1.00 0.00 H new ATOM 0 HA CYS A 12 66.947 2.099 6.658 1.00 0.00 H new ATOM 0 HB2 CYS A 12 67.160 0.950 9.464 1.00 0.00 H new ATOM 0 HB3 CYS A 12 66.569 2.527 8.977 1.00 0.00 H new ATOM 163 N TYR A 13 69.267 2.449 8.141 1.00 0.00 N ATOM 164 CA TYR A 13 70.730 2.564 8.427 1.00 0.00 C ATOM 165 C TYR A 13 70.911 3.132 9.836 1.00 0.00 C ATOM 166 O TYR A 13 71.735 2.674 10.602 1.00 0.00 O ATOM 167 CB TYR A 13 71.397 3.503 7.412 1.00 0.00 C ATOM 168 CG TYR A 13 71.368 2.878 6.037 1.00 0.00 C ATOM 169 CD1 TYR A 13 71.614 1.497 5.889 1.00 0.00 C ATOM 170 CD2 TYR A 13 71.105 3.674 4.896 1.00 0.00 C ATOM 171 CE1 TYR A 13 71.599 0.911 4.607 1.00 0.00 C ATOM 172 CE2 TYR A 13 71.093 3.087 3.615 1.00 0.00 C ATOM 173 CZ TYR A 13 71.341 1.708 3.468 1.00 0.00 C ATOM 174 OH TYR A 13 71.339 1.138 2.213 1.00 0.00 O ATOM 0 H TYR A 13 68.703 3.243 8.445 1.00 0.00 H new ATOM 0 HA TYR A 13 71.192 1.580 8.353 1.00 0.00 H new ATOM 0 HB2 TYR A 13 70.879 4.462 7.396 1.00 0.00 H new ATOM 0 HB3 TYR A 13 72.427 3.701 7.709 1.00 0.00 H new ATOM 0 HD1 TYR A 13 71.814 0.888 6.758 1.00 0.00 H new ATOM 0 HD2 TYR A 13 70.914 4.731 5.007 1.00 0.00 H new ATOM 0 HE1 TYR A 13 71.785 -0.147 4.495 1.00 0.00 H new ATOM 0 HE2 TYR A 13 70.893 3.695 2.745 1.00 0.00 H new ATOM 0 HH TYR A 13 70.591 1.498 1.691 1.00 0.00 H new ATOM 184 N ASN A 14 70.127 4.117 10.186 1.00 0.00 N ATOM 185 CA ASN A 14 70.227 4.707 11.546 1.00 0.00 C ATOM 186 C ASN A 14 68.934 4.425 12.300 1.00 0.00 C ATOM 187 O ASN A 14 68.100 3.662 11.855 1.00 0.00 O ATOM 188 CB ASN A 14 70.431 6.218 11.437 1.00 0.00 C ATOM 189 CG ASN A 14 71.742 6.507 10.704 1.00 0.00 C ATOM 190 OD1 ASN A 14 71.722 7.238 9.624 1.00 0.00 O flip ATOM 191 ND2 ASN A 14 72.794 6.063 11.118 1.00 0.00 N flip ATOM 0 H ASN A 14 69.420 4.538 9.583 1.00 0.00 H new ATOM 0 HA ASN A 14 71.072 4.268 12.077 1.00 0.00 H new ATOM 0 HB2 ASN A 14 69.596 6.670 10.902 1.00 0.00 H new ATOM 0 HB3 ASN A 14 70.452 6.665 12.431 1.00 0.00 H new ATOM 0 HD21 ASN A 14 72.809 5.491 11.963 1.00 0.00 H new ATOM 0 HD22 ASN A 14 73.662 6.262 10.621 1.00 0.00 H new ATOM 198 N PHE A 15 68.752 5.031 13.436 1.00 0.00 N ATOM 199 CA PHE A 15 67.503 4.789 14.206 1.00 0.00 C ATOM 200 C PHE A 15 67.199 5.992 15.099 1.00 0.00 C ATOM 201 O PHE A 15 67.958 6.317 15.990 1.00 0.00 O ATOM 202 CB PHE A 15 67.676 3.547 15.085 1.00 0.00 C ATOM 203 CG PHE A 15 67.941 2.336 14.222 1.00 0.00 C ATOM 204 CD1 PHE A 15 69.266 2.000 13.863 1.00 0.00 C ATOM 205 CD2 PHE A 15 66.864 1.546 13.762 1.00 0.00 C ATOM 206 CE1 PHE A 15 69.512 0.875 13.046 1.00 0.00 C ATOM 207 CE2 PHE A 15 67.111 0.422 12.944 1.00 0.00 C ATOM 208 CZ PHE A 15 68.436 0.086 12.586 1.00 0.00 C ATOM 0 H PHE A 15 69.411 5.681 13.864 1.00 0.00 H new ATOM 0 HA PHE A 15 66.680 4.638 13.507 1.00 0.00 H new ATOM 0 HB2 PHE A 15 68.502 3.696 15.781 1.00 0.00 H new ATOM 0 HB3 PHE A 15 66.779 3.388 15.684 1.00 0.00 H new ATOM 0 HD1 PHE A 15 70.090 2.604 14.213 1.00 0.00 H new ATOM 0 HD2 PHE A 15 65.851 1.802 14.036 1.00 0.00 H new ATOM 0 HE1 PHE A 15 70.525 0.618 12.773 1.00 0.00 H new ATOM 0 HE2 PHE A 15 66.287 -0.181 12.592 1.00 0.00 H new ATOM 0 HZ PHE A 15 68.625 -0.774 11.961 1.00 0.00 H new ATOM 218 N THR A 16 66.072 6.641 14.892 1.00 0.00 N ATOM 219 CA THR A 16 65.707 7.809 15.776 1.00 0.00 C ATOM 220 C THR A 16 65.881 7.379 17.237 1.00 0.00 C ATOM 221 O THR A 16 65.085 6.640 17.770 1.00 0.00 O ATOM 222 CB THR A 16 64.234 8.249 15.540 1.00 0.00 C ATOM 223 OG1 THR A 16 63.671 8.698 16.767 1.00 0.00 O ATOM 224 CG2 THR A 16 63.403 7.080 15.005 1.00 0.00 C ATOM 0 H THR A 16 65.396 6.419 14.161 1.00 0.00 H new ATOM 0 HA THR A 16 66.355 8.653 15.540 1.00 0.00 H new ATOM 0 HB THR A 16 64.225 9.055 14.807 1.00 0.00 H new ATOM 0 HG1 THR A 16 63.036 8.030 17.099 1.00 0.00 H new ATOM 0 HG21 THR A 16 62.375 7.407 14.846 1.00 0.00 H new ATOM 0 HG22 THR A 16 63.825 6.736 14.061 1.00 0.00 H new ATOM 0 HG23 THR A 16 63.416 6.264 15.727 1.00 0.00 H new ATOM 232 N ASN A 17 66.934 7.800 17.875 1.00 0.00 N ATOM 233 CA ASN A 17 67.154 7.373 19.283 1.00 0.00 C ATOM 234 C ASN A 17 66.585 8.415 20.246 1.00 0.00 C ATOM 235 O ASN A 17 66.782 8.336 21.443 1.00 0.00 O ATOM 236 CB ASN A 17 68.655 7.206 19.537 1.00 0.00 C ATOM 237 CG ASN A 17 68.878 6.651 20.945 1.00 0.00 C ATOM 238 OD1 ASN A 17 68.062 5.910 21.454 1.00 0.00 O ATOM 239 ND2 ASN A 17 69.958 6.981 21.599 1.00 0.00 N ATOM 0 H ASN A 17 67.648 8.417 17.487 1.00 0.00 H new ATOM 0 HA ASN A 17 66.646 6.423 19.449 1.00 0.00 H new ATOM 0 HB2 ASN A 17 69.087 6.532 18.797 1.00 0.00 H new ATOM 0 HB3 ASN A 17 69.161 8.165 19.429 1.00 0.00 H new ATOM 0 HD21 ASN A 17 70.117 6.616 22.538 1.00 0.00 H new ATOM 0 HD22 ASN A 17 70.643 7.604 21.171 1.00 0.00 H new ATOM 246 N ARG A 18 65.859 9.373 19.746 1.00 0.00 N ATOM 247 CA ARG A 18 65.261 10.390 20.646 1.00 0.00 C ATOM 248 C ARG A 18 63.871 9.917 21.062 1.00 0.00 C ATOM 249 O ARG A 18 63.340 8.975 20.509 1.00 0.00 O ATOM 250 CB ARG A 18 65.150 11.726 19.910 1.00 0.00 C ATOM 251 CG ARG A 18 66.268 12.661 20.376 1.00 0.00 C ATOM 252 CD ARG A 18 66.503 13.742 19.320 1.00 0.00 C ATOM 253 NE ARG A 18 67.949 13.768 18.947 1.00 0.00 N ATOM 254 CZ ARG A 18 68.452 14.790 18.290 1.00 0.00 C ATOM 255 NH1 ARG A 18 67.680 15.788 17.961 1.00 0.00 N ATOM 256 NH2 ARG A 18 69.722 14.816 17.964 1.00 0.00 N ATOM 0 H ARG A 18 65.655 9.494 18.754 1.00 0.00 H new ATOM 0 HA ARG A 18 65.889 10.522 21.527 1.00 0.00 H new ATOM 0 HB2 ARG A 18 65.219 11.567 18.834 1.00 0.00 H new ATOM 0 HB3 ARG A 18 64.178 12.180 20.103 1.00 0.00 H new ATOM 0 HG2 ARG A 18 66.000 13.120 21.328 1.00 0.00 H new ATOM 0 HG3 ARG A 18 67.184 12.095 20.542 1.00 0.00 H new ATOM 0 HD2 ARG A 18 65.893 13.543 18.439 1.00 0.00 H new ATOM 0 HD3 ARG A 18 66.199 14.715 19.706 1.00 0.00 H new ATOM 0 HE ARG A 18 68.552 12.986 19.204 1.00 0.00 H new ATOM 0 HH11 ARG A 18 66.692 15.773 18.213 1.00 0.00 H new ATOM 0 HH12 ARG A 18 68.064 16.584 17.451 1.00 0.00 H new ATOM 0 HH21 ARG A 18 70.330 14.038 18.220 1.00 0.00 H new ATOM 0 HH22 ARG A 18 70.101 15.614 17.454 1.00 0.00 H new ATOM 270 N LYS A 19 63.273 10.557 22.024 1.00 0.00 N ATOM 271 CA LYS A 19 61.911 10.136 22.452 1.00 0.00 C ATOM 272 C LYS A 19 60.879 10.865 21.597 1.00 0.00 C ATOM 273 O LYS A 19 60.081 11.639 22.088 1.00 0.00 O ATOM 274 CB LYS A 19 61.695 10.483 23.931 1.00 0.00 C ATOM 275 CG LYS A 19 62.948 10.124 24.738 1.00 0.00 C ATOM 276 CD LYS A 19 63.014 8.608 24.927 1.00 0.00 C ATOM 277 CE LYS A 19 63.887 8.283 26.141 1.00 0.00 C ATOM 278 NZ LYS A 19 63.146 8.620 27.389 1.00 0.00 N ATOM 0 H LYS A 19 63.665 11.350 22.531 1.00 0.00 H new ATOM 0 HA LYS A 19 61.804 9.059 22.325 1.00 0.00 H new ATOM 0 HB2 LYS A 19 61.476 11.546 24.036 1.00 0.00 H new ATOM 0 HB3 LYS A 19 60.833 9.940 24.319 1.00 0.00 H new ATOM 0 HG2 LYS A 19 63.840 10.476 24.221 1.00 0.00 H new ATOM 0 HG3 LYS A 19 62.924 10.622 25.707 1.00 0.00 H new ATOM 0 HD2 LYS A 19 62.011 8.204 25.068 1.00 0.00 H new ATOM 0 HD3 LYS A 19 63.424 8.137 24.034 1.00 0.00 H new ATOM 0 HE2 LYS A 19 64.154 7.226 26.138 1.00 0.00 H new ATOM 0 HE3 LYS A 19 64.818 8.847 26.094 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 63.521 8.056 28.178 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 63.263 9.632 27.600 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 62.136 8.407 27.261 1.00 0.00 H new ATOM 292 N ILE A 20 60.900 10.631 20.312 1.00 0.00 N ATOM 293 CA ILE A 20 59.944 11.305 19.405 1.00 0.00 C ATOM 294 C ILE A 20 58.532 11.172 19.961 1.00 0.00 C ATOM 295 O ILE A 20 58.045 10.091 20.226 1.00 0.00 O ATOM 296 CB ILE A 20 60.043 10.666 18.005 1.00 0.00 C ATOM 297 CG1 ILE A 20 61.131 11.391 17.209 1.00 0.00 C ATOM 298 CG2 ILE A 20 58.703 10.772 17.251 1.00 0.00 C ATOM 299 CD1 ILE A 20 61.076 10.944 15.754 1.00 0.00 C ATOM 0 H ILE A 20 61.549 9.993 19.853 1.00 0.00 H new ATOM 0 HA ILE A 20 60.184 12.365 19.328 1.00 0.00 H new ATOM 0 HB ILE A 20 60.289 9.610 18.117 1.00 0.00 H new ATOM 0 HG12 ILE A 20 60.988 12.470 17.275 1.00 0.00 H new ATOM 0 HG13 ILE A 20 62.112 11.173 17.631 1.00 0.00 H new ATOM 0 HG21 ILE A 20 58.802 10.313 16.267 1.00 0.00 H new ATOM 0 HG22 ILE A 20 57.926 10.256 17.815 1.00 0.00 H new ATOM 0 HG23 ILE A 20 58.432 11.822 17.137 1.00 0.00 H new ATOM 0 HD11 ILE A 20 61.850 11.459 15.186 1.00 0.00 H new ATOM 0 HD12 ILE A 20 61.240 9.868 15.698 1.00 0.00 H new ATOM 0 HD13 ILE A 20 60.098 11.184 15.336 1.00 0.00 H new ATOM 311 N SER A 21 57.882 12.270 20.123 1.00 0.00 N ATOM 312 CA SER A 21 56.490 12.265 20.645 1.00 0.00 C ATOM 313 C SER A 21 55.655 11.217 19.902 1.00 0.00 C ATOM 314 O SER A 21 55.581 11.216 18.689 1.00 0.00 O ATOM 315 CB SER A 21 55.880 13.642 20.417 1.00 0.00 C ATOM 316 OG SER A 21 54.971 13.939 21.470 1.00 0.00 O ATOM 0 H SER A 21 58.256 13.196 19.914 1.00 0.00 H new ATOM 0 HA SER A 21 56.500 12.024 21.708 1.00 0.00 H new ATOM 0 HB2 SER A 21 56.665 14.397 20.376 1.00 0.00 H new ATOM 0 HB3 SER A 21 55.363 13.668 19.458 1.00 0.00 H new ATOM 0 HG SER A 21 54.580 14.826 21.324 1.00 0.00 H new ATOM 322 N VAL A 22 55.015 10.334 20.620 1.00 0.00 N ATOM 323 CA VAL A 22 54.178 9.304 19.953 1.00 0.00 C ATOM 324 C VAL A 22 53.142 9.995 19.059 1.00 0.00 C ATOM 325 O VAL A 22 52.601 9.403 18.146 1.00 0.00 O ATOM 326 CB VAL A 22 53.462 8.462 21.010 1.00 0.00 C ATOM 327 CG1 VAL A 22 52.570 9.364 21.865 1.00 0.00 C ATOM 328 CG2 VAL A 22 52.601 7.402 20.320 1.00 0.00 C ATOM 0 H VAL A 22 55.037 10.284 21.639 1.00 0.00 H new ATOM 0 HA VAL A 22 54.811 8.657 19.346 1.00 0.00 H new ATOM 0 HB VAL A 22 54.201 7.974 21.646 1.00 0.00 H new ATOM 0 HG11 VAL A 22 52.060 8.763 22.618 1.00 0.00 H new ATOM 0 HG12 VAL A 22 53.182 10.120 22.357 1.00 0.00 H new ATOM 0 HG13 VAL A 22 51.831 9.853 21.230 1.00 0.00 H new ATOM 0 HG21 VAL A 22 52.090 6.801 21.073 1.00 0.00 H new ATOM 0 HG22 VAL A 22 51.863 7.890 19.684 1.00 0.00 H new ATOM 0 HG23 VAL A 22 53.235 6.758 19.711 1.00 0.00 H new ATOM 338 N GLN A 23 52.870 11.249 19.312 1.00 0.00 N ATOM 339 CA GLN A 23 51.896 11.981 18.490 1.00 0.00 C ATOM 340 C GLN A 23 52.478 12.162 17.098 1.00 0.00 C ATOM 341 O GLN A 23 51.814 11.968 16.099 1.00 0.00 O ATOM 342 CB GLN A 23 51.619 13.350 19.157 1.00 0.00 C ATOM 343 CG GLN A 23 52.017 14.518 18.232 1.00 0.00 C ATOM 344 CD GLN A 23 51.566 15.840 18.853 1.00 0.00 C ATOM 345 OE1 GLN A 23 52.372 16.716 19.098 1.00 0.00 O ATOM 346 NE2 GLN A 23 50.302 16.024 19.121 1.00 0.00 N ATOM 0 H GLN A 23 53.293 11.792 20.065 1.00 0.00 H new ATOM 0 HA GLN A 23 50.957 11.433 18.410 1.00 0.00 H new ATOM 0 HB2 GLN A 23 50.561 13.427 19.408 1.00 0.00 H new ATOM 0 HB3 GLN A 23 52.174 13.419 20.093 1.00 0.00 H new ATOM 0 HG2 GLN A 23 53.097 14.525 18.082 1.00 0.00 H new ATOM 0 HG3 GLN A 23 51.559 14.391 17.251 1.00 0.00 H new ATOM 0 HE21 GLN A 23 49.625 15.289 18.916 1.00 0.00 H new ATOM 0 HE22 GLN A 23 49.991 16.903 19.536 1.00 0.00 H new ATOM 355 N ARG A 24 53.716 12.553 17.030 1.00 0.00 N ATOM 356 CA ARG A 24 54.348 12.770 15.717 1.00 0.00 C ATOM 357 C ARG A 24 54.240 11.508 14.895 1.00 0.00 C ATOM 358 O ARG A 24 54.144 11.543 13.688 1.00 0.00 O ATOM 359 CB ARG A 24 55.825 13.114 15.906 1.00 0.00 C ATOM 360 CG ARG A 24 55.958 14.348 16.788 1.00 0.00 C ATOM 361 CD ARG A 24 55.823 15.601 15.930 1.00 0.00 C ATOM 362 NE ARG A 24 56.656 16.695 16.511 1.00 0.00 N ATOM 363 CZ ARG A 24 56.482 17.941 16.131 1.00 0.00 C ATOM 364 NH1 ARG A 24 55.572 18.247 15.237 1.00 0.00 N ATOM 365 NH2 ARG A 24 57.222 18.884 16.647 1.00 0.00 N ATOM 0 H ARG A 24 54.316 12.731 17.836 1.00 0.00 H new ATOM 0 HA ARG A 24 53.843 13.591 15.207 1.00 0.00 H new ATOM 0 HB2 ARG A 24 56.349 12.273 16.360 1.00 0.00 H new ATOM 0 HB3 ARG A 24 56.292 13.295 14.938 1.00 0.00 H new ATOM 0 HG2 ARG A 24 55.191 14.340 17.562 1.00 0.00 H new ATOM 0 HG3 ARG A 24 56.923 14.344 17.295 1.00 0.00 H new ATOM 0 HD2 ARG A 24 56.141 15.391 14.909 1.00 0.00 H new ATOM 0 HD3 ARG A 24 54.779 15.911 15.882 1.00 0.00 H new ATOM 0 HE ARG A 24 57.366 16.474 17.209 1.00 0.00 H new ATOM 0 HH11 ARG A 24 54.991 17.514 14.829 1.00 0.00 H new ATOM 0 HH12 ARG A 24 55.446 19.217 14.949 1.00 0.00 H new ATOM 0 HH21 ARG A 24 57.932 18.653 17.342 1.00 0.00 H new ATOM 0 HH22 ARG A 24 57.091 19.853 16.355 1.00 0.00 H new ATOM 379 N LEU A 25 54.283 10.394 15.542 1.00 0.00 N ATOM 380 CA LEU A 25 54.225 9.110 14.818 1.00 0.00 C ATOM 381 C LEU A 25 52.846 8.895 14.218 1.00 0.00 C ATOM 382 O LEU A 25 51.956 8.361 14.850 1.00 0.00 O ATOM 383 CB LEU A 25 54.547 7.979 15.779 1.00 0.00 C ATOM 384 CG LEU A 25 55.883 8.274 16.480 1.00 0.00 C ATOM 385 CD1 LEU A 25 56.301 7.070 17.311 1.00 0.00 C ATOM 386 CD2 LEU A 25 56.966 8.564 15.436 1.00 0.00 C ATOM 0 H LEU A 25 54.357 10.315 16.556 1.00 0.00 H new ATOM 0 HA LEU A 25 54.954 9.128 14.008 1.00 0.00 H new ATOM 0 HB2 LEU A 25 53.751 7.875 16.517 1.00 0.00 H new ATOM 0 HB3 LEU A 25 54.607 7.034 15.240 1.00 0.00 H new ATOM 0 HG LEU A 25 55.760 9.143 17.127 1.00 0.00 H new ATOM 0 HD11 LEU A 25 57.248 7.281 17.807 1.00 0.00 H new ATOM 0 HD12 LEU A 25 55.537 6.862 18.061 1.00 0.00 H new ATOM 0 HD13 LEU A 25 56.417 6.202 16.662 1.00 0.00 H new ATOM 0 HD21 LEU A 25 57.910 8.772 15.939 1.00 0.00 H new ATOM 0 HD22 LEU A 25 57.085 7.698 14.785 1.00 0.00 H new ATOM 0 HD23 LEU A 25 56.674 9.429 14.840 1.00 0.00 H new ATOM 398 N ALA A 26 52.667 9.298 13.001 1.00 0.00 N ATOM 399 CA ALA A 26 51.354 9.114 12.344 1.00 0.00 C ATOM 400 C ALA A 26 51.114 7.626 12.059 1.00 0.00 C ATOM 401 O ALA A 26 50.000 7.201 11.827 1.00 0.00 O ATOM 402 CB ALA A 26 51.336 9.879 11.026 1.00 0.00 C ATOM 0 H ALA A 26 53.379 9.751 12.428 1.00 0.00 H new ATOM 0 HA ALA A 26 50.571 9.488 13.004 1.00 0.00 H new ATOM 0 HB1 ALA A 26 50.369 9.745 10.540 1.00 0.00 H new ATOM 0 HB2 ALA A 26 51.501 10.939 11.218 1.00 0.00 H new ATOM 0 HB3 ALA A 26 52.125 9.501 10.375 1.00 0.00 H new ATOM 408 N SER A 27 52.150 6.838 12.058 1.00 0.00 N ATOM 409 CA SER A 27 51.984 5.382 11.767 1.00 0.00 C ATOM 410 C SER A 27 53.285 4.645 12.095 1.00 0.00 C ATOM 411 O SER A 27 54.274 5.249 12.460 1.00 0.00 O ATOM 412 CB SER A 27 51.649 5.192 10.288 1.00 0.00 C ATOM 413 OG SER A 27 50.296 4.772 10.161 1.00 0.00 O ATOM 0 H SER A 27 53.107 7.136 12.246 1.00 0.00 H new ATOM 0 HA SER A 27 51.175 4.980 12.376 1.00 0.00 H new ATOM 0 HB2 SER A 27 51.804 6.125 9.746 1.00 0.00 H new ATOM 0 HB3 SER A 27 52.315 4.451 9.845 1.00 0.00 H new ATOM 0 HG SER A 27 49.714 5.393 10.647 1.00 0.00 H new ATOM 419 N TYR A 28 53.292 3.341 11.982 1.00 0.00 N ATOM 420 CA TYR A 28 54.530 2.578 12.309 1.00 0.00 C ATOM 421 C TYR A 28 54.563 1.271 11.479 1.00 0.00 C ATOM 422 O TYR A 28 53.594 0.541 11.418 1.00 0.00 O ATOM 423 CB TYR A 28 54.532 2.293 13.837 1.00 0.00 C ATOM 424 CG TYR A 28 54.621 0.816 14.140 1.00 0.00 C ATOM 425 CD1 TYR A 28 53.472 0.006 14.031 1.00 0.00 C ATOM 426 CD2 TYR A 28 55.859 0.245 14.503 1.00 0.00 C ATOM 427 CE1 TYR A 28 53.557 -1.376 14.287 1.00 0.00 C ATOM 428 CE2 TYR A 28 55.948 -1.139 14.759 1.00 0.00 C ATOM 429 CZ TYR A 28 54.796 -1.952 14.651 1.00 0.00 C ATOM 430 OH TYR A 28 54.882 -3.306 14.903 1.00 0.00 O ATOM 0 H TYR A 28 52.498 2.776 11.679 1.00 0.00 H new ATOM 0 HA TYR A 28 55.424 3.148 12.057 1.00 0.00 H new ATOM 0 HB2 TYR A 28 55.373 2.809 14.300 1.00 0.00 H new ATOM 0 HB3 TYR A 28 53.624 2.700 14.282 1.00 0.00 H new ATOM 0 HD1 TYR A 28 52.526 0.446 13.751 1.00 0.00 H new ATOM 0 HD2 TYR A 28 56.738 0.867 14.585 1.00 0.00 H new ATOM 0 HE1 TYR A 28 52.676 -1.996 14.205 1.00 0.00 H new ATOM 0 HE2 TYR A 28 56.895 -1.577 15.037 1.00 0.00 H new ATOM 0 HH TYR A 28 54.168 -3.570 15.520 1.00 0.00 H new ATOM 440 N ARG A 29 55.674 0.980 10.843 1.00 0.00 N ATOM 441 CA ARG A 29 55.762 -0.270 10.023 1.00 0.00 C ATOM 442 C ARG A 29 57.028 -1.050 10.404 1.00 0.00 C ATOM 443 O ARG A 29 58.053 -0.940 9.769 1.00 0.00 O ATOM 444 CB ARG A 29 55.817 0.094 8.540 1.00 0.00 C ATOM 445 CG ARG A 29 54.665 -0.592 7.804 1.00 0.00 C ATOM 446 CD ARG A 29 55.169 -1.143 6.468 1.00 0.00 C ATOM 447 NE ARG A 29 54.311 -2.290 6.047 1.00 0.00 N ATOM 448 CZ ARG A 29 54.708 -3.108 5.097 1.00 0.00 C ATOM 449 NH1 ARG A 29 55.864 -2.930 4.503 1.00 0.00 N ATOM 450 NH2 ARG A 29 53.945 -4.105 4.742 1.00 0.00 N ATOM 0 H ARG A 29 56.519 1.551 10.856 1.00 0.00 H new ATOM 0 HA ARG A 29 54.885 -0.888 10.214 1.00 0.00 H new ATOM 0 HB2 ARG A 29 55.749 1.175 8.417 1.00 0.00 H new ATOM 0 HB3 ARG A 29 56.771 -0.216 8.114 1.00 0.00 H new ATOM 0 HG2 ARG A 29 54.260 -1.400 8.413 1.00 0.00 H new ATOM 0 HG3 ARG A 29 53.854 0.117 7.635 1.00 0.00 H new ATOM 0 HD2 ARG A 29 55.148 -0.361 5.709 1.00 0.00 H new ATOM 0 HD3 ARG A 29 56.206 -1.466 6.564 1.00 0.00 H new ATOM 0 HE ARG A 29 53.410 -2.440 6.500 1.00 0.00 H new ATOM 0 HH11 ARG A 29 56.464 -2.152 4.777 1.00 0.00 H new ATOM 0 HH12 ARG A 29 56.163 -3.570 3.767 1.00 0.00 H new ATOM 0 HH21 ARG A 29 53.045 -4.247 5.201 1.00 0.00 H new ATOM 0 HH22 ARG A 29 54.248 -4.742 4.006 1.00 0.00 H new ATOM 464 N ARG A 30 56.957 -1.832 11.445 1.00 0.00 N ATOM 465 CA ARG A 30 58.154 -2.617 11.895 1.00 0.00 C ATOM 466 C ARG A 30 58.838 -3.310 10.705 1.00 0.00 C ATOM 467 O ARG A 30 58.352 -4.296 10.188 1.00 0.00 O ATOM 468 CB ARG A 30 57.707 -3.678 12.903 1.00 0.00 C ATOM 469 CG ARG A 30 58.937 -4.336 13.532 1.00 0.00 C ATOM 470 CD ARG A 30 59.074 -3.881 14.986 1.00 0.00 C ATOM 471 NE ARG A 30 58.918 -5.061 15.900 1.00 0.00 N ATOM 472 CZ ARG A 30 59.601 -6.166 15.699 1.00 0.00 C ATOM 473 NH1 ARG A 30 60.610 -6.186 14.863 1.00 0.00 N ATOM 474 NH2 ARG A 30 59.319 -7.235 16.395 1.00 0.00 N ATOM 0 H ARG A 30 56.119 -1.966 12.010 1.00 0.00 H new ATOM 0 HA ARG A 30 58.866 -1.931 12.353 1.00 0.00 H new ATOM 0 HB2 ARG A 30 57.090 -3.222 13.677 1.00 0.00 H new ATOM 0 HB3 ARG A 30 57.093 -4.430 12.407 1.00 0.00 H new ATOM 0 HG2 ARG A 30 58.845 -5.421 13.487 1.00 0.00 H new ATOM 0 HG3 ARG A 30 59.832 -4.069 12.971 1.00 0.00 H new ATOM 0 HD2 ARG A 30 60.047 -3.414 15.141 1.00 0.00 H new ATOM 0 HD3 ARG A 30 58.319 -3.129 15.215 1.00 0.00 H new ATOM 0 HE ARG A 30 58.273 -5.005 16.688 1.00 0.00 H new ATOM 0 HH11 ARG A 30 60.873 -5.338 14.360 1.00 0.00 H new ATOM 0 HH12 ARG A 30 61.133 -7.049 14.715 1.00 0.00 H new ATOM 0 HH21 ARG A 30 58.573 -7.209 17.090 1.00 0.00 H new ATOM 0 HH22 ARG A 30 59.845 -8.096 16.244 1.00 0.00 H new ATOM 488 N ILE A 31 59.990 -2.825 10.298 1.00 0.00 N ATOM 489 CA ILE A 31 60.727 -3.493 9.182 1.00 0.00 C ATOM 490 C ILE A 31 61.255 -4.839 9.688 1.00 0.00 C ATOM 491 O ILE A 31 61.373 -5.061 10.873 1.00 0.00 O ATOM 492 CB ILE A 31 61.919 -2.604 8.725 1.00 0.00 C ATOM 493 CG1 ILE A 31 61.408 -1.507 7.778 1.00 0.00 C ATOM 494 CG2 ILE A 31 62.971 -3.465 7.989 1.00 0.00 C ATOM 495 CD1 ILE A 31 62.596 -0.698 7.230 1.00 0.00 C ATOM 0 H ILE A 31 60.447 -2.001 10.689 1.00 0.00 H new ATOM 0 HA ILE A 31 60.058 -3.644 8.335 1.00 0.00 H new ATOM 0 HB ILE A 31 62.378 -2.149 9.602 1.00 0.00 H new ATOM 0 HG12 ILE A 31 60.850 -1.955 6.955 1.00 0.00 H new ATOM 0 HG13 ILE A 31 60.720 -0.848 8.308 1.00 0.00 H new ATOM 0 HG21 ILE A 31 63.801 -2.834 7.673 1.00 0.00 H new ATOM 0 HG22 ILE A 31 63.340 -4.241 8.660 1.00 0.00 H new ATOM 0 HG23 ILE A 31 62.514 -3.928 7.114 1.00 0.00 H new ATOM 0 HD11 ILE A 31 62.229 0.079 6.559 1.00 0.00 H new ATOM 0 HD12 ILE A 31 63.135 -0.237 8.058 1.00 0.00 H new ATOM 0 HD13 ILE A 31 63.267 -1.361 6.684 1.00 0.00 H new ATOM 507 N THR A 32 61.602 -5.722 8.792 1.00 0.00 N ATOM 508 CA THR A 32 62.156 -7.042 9.208 1.00 0.00 C ATOM 509 C THR A 32 62.310 -7.937 7.980 1.00 0.00 C ATOM 510 O THR A 32 62.073 -9.128 8.034 1.00 0.00 O ATOM 511 CB THR A 32 61.216 -7.712 10.210 1.00 0.00 C ATOM 512 OG1 THR A 32 59.926 -7.123 10.120 1.00 0.00 O ATOM 513 CG2 THR A 32 61.768 -7.536 11.624 1.00 0.00 C ATOM 0 H THR A 32 61.525 -5.585 7.784 1.00 0.00 H new ATOM 0 HA THR A 32 63.128 -6.890 9.677 1.00 0.00 H new ATOM 0 HB THR A 32 61.141 -8.775 9.983 1.00 0.00 H new ATOM 0 HG1 THR A 32 59.324 -7.554 10.762 1.00 0.00 H new ATOM 0 HG21 THR A 32 61.098 -8.014 12.338 1.00 0.00 H new ATOM 0 HG22 THR A 32 62.755 -7.995 11.689 1.00 0.00 H new ATOM 0 HG23 THR A 32 61.846 -6.474 11.854 1.00 0.00 H new ATOM 521 N SER A 33 62.711 -7.375 6.873 1.00 0.00 N ATOM 522 CA SER A 33 62.885 -8.197 5.646 1.00 0.00 C ATOM 523 C SER A 33 63.987 -9.231 5.886 1.00 0.00 C ATOM 524 O SER A 33 64.930 -8.989 6.614 1.00 0.00 O ATOM 525 CB SER A 33 63.273 -7.291 4.475 1.00 0.00 C ATOM 526 OG SER A 33 62.955 -7.940 3.251 1.00 0.00 O ATOM 0 H SER A 33 62.925 -6.383 6.767 1.00 0.00 H new ATOM 0 HA SER A 33 61.952 -8.708 5.410 1.00 0.00 H new ATOM 0 HB2 SER A 33 62.743 -6.341 4.544 1.00 0.00 H new ATOM 0 HB3 SER A 33 64.339 -7.065 4.513 1.00 0.00 H new ATOM 0 HG SER A 33 62.737 -7.268 2.571 1.00 0.00 H new ATOM 532 N SER A 34 63.872 -10.383 5.287 1.00 0.00 N ATOM 533 CA SER A 34 64.910 -11.435 5.490 1.00 0.00 C ATOM 534 C SER A 34 66.253 -10.960 4.921 1.00 0.00 C ATOM 535 O SER A 34 67.284 -11.551 5.172 1.00 0.00 O ATOM 536 CB SER A 34 64.481 -12.716 4.772 1.00 0.00 C ATOM 537 OG SER A 34 64.252 -13.739 5.732 1.00 0.00 O ATOM 0 H SER A 34 63.106 -10.643 4.666 1.00 0.00 H new ATOM 0 HA SER A 34 65.020 -11.629 6.557 1.00 0.00 H new ATOM 0 HB2 SER A 34 63.575 -12.536 4.193 1.00 0.00 H new ATOM 0 HB3 SER A 34 65.253 -13.028 4.068 1.00 0.00 H new ATOM 0 HG SER A 34 63.975 -14.561 5.275 1.00 0.00 H new ATOM 543 N LYS A 35 66.252 -9.905 4.149 1.00 0.00 N ATOM 544 CA LYS A 35 67.530 -9.413 3.561 1.00 0.00 C ATOM 545 C LYS A 35 68.028 -8.182 4.340 1.00 0.00 C ATOM 546 O LYS A 35 69.163 -7.772 4.200 1.00 0.00 O ATOM 547 CB LYS A 35 67.301 -9.038 2.091 1.00 0.00 C ATOM 548 CG LYS A 35 68.204 -9.894 1.186 1.00 0.00 C ATOM 549 CD LYS A 35 69.659 -9.805 1.661 1.00 0.00 C ATOM 550 CE LYS A 35 70.594 -9.849 0.452 1.00 0.00 C ATOM 551 NZ LYS A 35 71.014 -11.257 0.199 1.00 0.00 N ATOM 0 H LYS A 35 65.423 -9.365 3.901 1.00 0.00 H new ATOM 0 HA LYS A 35 68.282 -10.199 3.624 1.00 0.00 H new ATOM 0 HB2 LYS A 35 66.255 -9.192 1.826 1.00 0.00 H new ATOM 0 HB3 LYS A 35 67.516 -7.980 1.939 1.00 0.00 H new ATOM 0 HG2 LYS A 35 67.870 -10.932 1.203 1.00 0.00 H new ATOM 0 HG3 LYS A 35 68.128 -9.551 0.154 1.00 0.00 H new ATOM 0 HD2 LYS A 35 69.814 -8.883 2.221 1.00 0.00 H new ATOM 0 HD3 LYS A 35 69.883 -10.630 2.337 1.00 0.00 H new ATOM 0 HE2 LYS A 35 70.090 -9.445 -0.426 1.00 0.00 H new ATOM 0 HE3 LYS A 35 71.469 -9.224 0.632 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 71.650 -11.287 -0.623 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 71.511 -11.627 1.035 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 70.175 -11.841 0.009 1.00 0.00 H new ATOM 565 N CYS A 36 67.193 -7.590 5.159 1.00 0.00 N ATOM 566 CA CYS A 36 67.637 -6.388 5.933 1.00 0.00 C ATOM 567 C CYS A 36 68.608 -6.817 7.047 1.00 0.00 C ATOM 568 O CYS A 36 68.309 -7.712 7.812 1.00 0.00 O ATOM 569 CB CYS A 36 66.421 -5.690 6.554 1.00 0.00 C ATOM 570 SG CYS A 36 65.455 -4.869 5.256 1.00 0.00 S ATOM 0 H CYS A 36 66.230 -7.884 5.325 1.00 0.00 H new ATOM 0 HA CYS A 36 68.143 -5.697 5.258 1.00 0.00 H new ATOM 0 HB2 CYS A 36 65.800 -6.418 7.077 1.00 0.00 H new ATOM 0 HB3 CYS A 36 66.748 -4.959 7.294 1.00 0.00 H new ATOM 575 N PRO A 37 69.758 -6.160 7.097 1.00 0.00 N ATOM 576 CA PRO A 37 70.776 -6.463 8.097 1.00 0.00 C ATOM 577 C PRO A 37 70.264 -6.169 9.503 1.00 0.00 C ATOM 578 O PRO A 37 70.799 -6.650 10.482 1.00 0.00 O ATOM 579 CB PRO A 37 71.946 -5.525 7.768 1.00 0.00 C ATOM 580 CG PRO A 37 71.502 -4.616 6.585 1.00 0.00 C ATOM 581 CD PRO A 37 70.108 -5.085 6.157 1.00 0.00 C ATOM 0 HA PRO A 37 71.059 -7.516 8.074 1.00 0.00 H new ATOM 0 HB2 PRO A 37 72.209 -4.922 8.637 1.00 0.00 H new ATOM 0 HB3 PRO A 37 72.833 -6.099 7.498 1.00 0.00 H new ATOM 0 HG2 PRO A 37 71.480 -3.570 6.890 1.00 0.00 H new ATOM 0 HG3 PRO A 37 72.205 -4.691 5.756 1.00 0.00 H new ATOM 0 HD2 PRO A 37 69.386 -4.270 6.205 1.00 0.00 H new ATOM 0 HD3 PRO A 37 70.113 -5.447 5.129 1.00 0.00 H new ATOM 589 N LYS A 38 69.259 -5.354 9.618 1.00 0.00 N ATOM 590 CA LYS A 38 68.752 -5.001 10.963 1.00 0.00 C ATOM 591 C LYS A 38 67.257 -4.679 10.908 1.00 0.00 C ATOM 592 O LYS A 38 66.804 -3.923 10.071 1.00 0.00 O ATOM 593 CB LYS A 38 69.512 -3.775 11.474 1.00 0.00 C ATOM 594 CG LYS A 38 70.925 -4.185 11.895 1.00 0.00 C ATOM 595 CD LYS A 38 71.380 -3.320 13.071 1.00 0.00 C ATOM 596 CE LYS A 38 72.851 -2.941 12.889 1.00 0.00 C ATOM 597 NZ LYS A 38 73.713 -3.974 13.532 1.00 0.00 N ATOM 0 H LYS A 38 68.768 -4.918 8.838 1.00 0.00 H new ATOM 0 HA LYS A 38 68.903 -5.848 11.632 1.00 0.00 H new ATOM 0 HB2 LYS A 38 69.560 -3.014 10.695 1.00 0.00 H new ATOM 0 HB3 LYS A 38 68.984 -3.333 12.319 1.00 0.00 H new ATOM 0 HG2 LYS A 38 70.940 -5.238 12.177 1.00 0.00 H new ATOM 0 HG3 LYS A 38 71.613 -4.069 11.058 1.00 0.00 H new ATOM 0 HD2 LYS A 38 70.767 -2.421 13.133 1.00 0.00 H new ATOM 0 HD3 LYS A 38 71.247 -3.862 14.007 1.00 0.00 H new ATOM 0 HE2 LYS A 38 73.089 -2.862 11.828 1.00 0.00 H new ATOM 0 HE3 LYS A 38 73.044 -1.964 13.332 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 74.713 -3.717 13.409 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 73.492 -4.028 14.547 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 73.536 -4.898 13.089 1.00 0.00 H new ATOM 611 N GLU A 39 66.494 -5.209 11.829 1.00 0.00 N ATOM 612 CA GLU A 39 65.039 -4.891 11.866 1.00 0.00 C ATOM 613 C GLU A 39 64.881 -3.409 12.214 1.00 0.00 C ATOM 614 O GLU A 39 65.854 -2.700 12.376 1.00 0.00 O ATOM 615 CB GLU A 39 64.356 -5.743 12.940 1.00 0.00 C ATOM 616 CG GLU A 39 64.829 -7.193 12.821 1.00 0.00 C ATOM 617 CD GLU A 39 63.880 -8.105 13.601 1.00 0.00 C ATOM 618 OE1 GLU A 39 63.259 -7.622 14.533 1.00 0.00 O ATOM 619 OE2 GLU A 39 63.791 -9.271 13.252 1.00 0.00 O ATOM 0 H GLU A 39 66.817 -5.848 12.556 1.00 0.00 H new ATOM 0 HA GLU A 39 64.582 -5.103 10.900 1.00 0.00 H new ATOM 0 HB2 GLU A 39 64.590 -5.354 13.931 1.00 0.00 H new ATOM 0 HB3 GLU A 39 63.273 -5.692 12.825 1.00 0.00 H new ATOM 0 HG2 GLU A 39 64.859 -7.492 11.773 1.00 0.00 H new ATOM 0 HG3 GLU A 39 65.843 -7.289 13.209 1.00 0.00 H new ATOM 626 N ALA A 40 63.674 -2.929 12.339 1.00 0.00 N ATOM 627 CA ALA A 40 63.492 -1.489 12.685 1.00 0.00 C ATOM 628 C ALA A 40 62.004 -1.154 12.771 1.00 0.00 C ATOM 629 O ALA A 40 61.155 -2.022 12.762 1.00 0.00 O ATOM 630 CB ALA A 40 64.136 -0.622 11.600 1.00 0.00 C ATOM 0 H ALA A 40 62.814 -3.464 12.218 1.00 0.00 H new ATOM 0 HA ALA A 40 63.962 -1.293 13.649 1.00 0.00 H new ATOM 0 HB1 ALA A 40 64.005 0.431 11.850 1.00 0.00 H new ATOM 0 HB2 ALA A 40 65.200 -0.850 11.536 1.00 0.00 H new ATOM 0 HB3 ALA A 40 63.662 -0.829 10.640 1.00 0.00 H new ATOM 636 N VAL A 41 61.688 0.110 12.831 1.00 0.00 N ATOM 637 CA VAL A 41 60.261 0.530 12.886 1.00 0.00 C ATOM 638 C VAL A 41 60.073 1.723 11.971 1.00 0.00 C ATOM 639 O VAL A 41 60.672 2.758 12.166 1.00 0.00 O ATOM 640 CB VAL A 41 59.875 0.920 14.330 1.00 0.00 C ATOM 641 CG1 VAL A 41 58.919 2.130 14.323 1.00 0.00 C ATOM 642 CG2 VAL A 41 59.172 -0.253 14.989 1.00 0.00 C ATOM 0 H VAL A 41 62.363 0.875 12.844 1.00 0.00 H new ATOM 0 HA VAL A 41 59.624 -0.295 12.566 1.00 0.00 H new ATOM 0 HB VAL A 41 60.780 1.181 14.879 1.00 0.00 H new ATOM 0 HG11 VAL A 41 58.657 2.392 15.348 1.00 0.00 H new ATOM 0 HG12 VAL A 41 59.409 2.978 13.846 1.00 0.00 H new ATOM 0 HG13 VAL A 41 58.014 1.876 13.771 1.00 0.00 H new ATOM 0 HG21 VAL A 41 58.896 0.014 16.009 1.00 0.00 H new ATOM 0 HG22 VAL A 41 58.274 -0.503 14.424 1.00 0.00 H new ATOM 0 HG23 VAL A 41 59.840 -1.114 15.008 1.00 0.00 H new ATOM 652 N ILE A 42 59.220 1.615 11.011 1.00 0.00 N ATOM 653 CA ILE A 42 58.987 2.770 10.135 1.00 0.00 C ATOM 654 C ILE A 42 58.025 3.725 10.822 1.00 0.00 C ATOM 655 O ILE A 42 56.843 3.710 10.567 1.00 0.00 O ATOM 656 CB ILE A 42 58.379 2.324 8.815 1.00 0.00 C ATOM 657 CG1 ILE A 42 59.138 1.085 8.262 1.00 0.00 C ATOM 658 CG2 ILE A 42 58.448 3.488 7.834 1.00 0.00 C ATOM 659 CD1 ILE A 42 60.357 1.500 7.423 1.00 0.00 C ATOM 0 H ILE A 42 58.676 0.779 10.796 1.00 0.00 H new ATOM 0 HA ILE A 42 59.940 3.262 9.938 1.00 0.00 H new ATOM 0 HB ILE A 42 57.339 2.034 8.961 1.00 0.00 H new ATOM 0 HG12 ILE A 42 59.463 0.456 9.091 1.00 0.00 H new ATOM 0 HG13 ILE A 42 58.462 0.485 7.652 1.00 0.00 H new ATOM 0 HG21 ILE A 42 58.016 3.186 6.880 1.00 0.00 H new ATOM 0 HG22 ILE A 42 57.889 4.334 8.234 1.00 0.00 H new ATOM 0 HG23 ILE A 42 59.488 3.777 7.685 1.00 0.00 H new ATOM 0 HD11 ILE A 42 60.864 0.609 7.052 1.00 0.00 H new ATOM 0 HD12 ILE A 42 60.029 2.108 6.580 1.00 0.00 H new ATOM 0 HD13 ILE A 42 61.044 2.078 8.041 1.00 0.00 H new ATOM 671 N PHE A 43 58.520 4.553 11.695 1.00 0.00 N ATOM 672 CA PHE A 43 57.630 5.509 12.401 1.00 0.00 C ATOM 673 C PHE A 43 57.203 6.616 11.434 1.00 0.00 C ATOM 674 O PHE A 43 57.758 7.696 11.437 1.00 0.00 O ATOM 675 CB PHE A 43 58.384 6.137 13.576 1.00 0.00 C ATOM 676 CG PHE A 43 58.243 5.269 14.808 1.00 0.00 C ATOM 677 CD1 PHE A 43 56.984 4.724 15.159 1.00 0.00 C ATOM 678 CD2 PHE A 43 59.371 5.008 15.611 1.00 0.00 C ATOM 679 CE1 PHE A 43 56.864 3.919 16.315 1.00 0.00 C ATOM 680 CE2 PHE A 43 59.248 4.203 16.765 1.00 0.00 C ATOM 681 CZ PHE A 43 57.994 3.660 17.116 1.00 0.00 C ATOM 0 H PHE A 43 59.506 4.608 11.950 1.00 0.00 H new ATOM 0 HA PHE A 43 56.751 4.980 12.768 1.00 0.00 H new ATOM 0 HB2 PHE A 43 59.438 6.253 13.322 1.00 0.00 H new ATOM 0 HB3 PHE A 43 57.993 7.134 13.778 1.00 0.00 H new ATOM 0 HD1 PHE A 43 56.118 4.923 14.545 1.00 0.00 H new ATOM 0 HD2 PHE A 43 60.331 5.424 15.344 1.00 0.00 H new ATOM 0 HE1 PHE A 43 55.905 3.502 16.585 1.00 0.00 H new ATOM 0 HE2 PHE A 43 60.114 4.003 17.379 1.00 0.00 H new ATOM 0 HZ PHE A 43 57.900 3.045 17.999 1.00 0.00 H new ATOM 691 N LYS A 44 56.218 6.369 10.614 1.00 0.00 N ATOM 692 CA LYS A 44 55.769 7.425 9.669 1.00 0.00 C ATOM 693 C LYS A 44 55.271 8.605 10.478 1.00 0.00 C ATOM 694 O LYS A 44 54.166 8.598 10.971 1.00 0.00 O ATOM 695 CB LYS A 44 54.630 6.894 8.795 1.00 0.00 C ATOM 696 CG LYS A 44 55.059 6.918 7.327 1.00 0.00 C ATOM 697 CD LYS A 44 53.960 7.568 6.484 1.00 0.00 C ATOM 698 CE LYS A 44 52.739 6.647 6.438 1.00 0.00 C ATOM 699 NZ LYS A 44 52.809 5.791 5.220 1.00 0.00 N ATOM 0 H LYS A 44 55.709 5.487 10.559 1.00 0.00 H new ATOM 0 HA LYS A 44 56.597 7.724 9.026 1.00 0.00 H new ATOM 0 HB2 LYS A 44 54.372 5.878 9.093 1.00 0.00 H new ATOM 0 HB3 LYS A 44 53.737 7.503 8.934 1.00 0.00 H new ATOM 0 HG2 LYS A 44 55.991 7.473 7.219 1.00 0.00 H new ATOM 0 HG3 LYS A 44 55.249 5.904 6.976 1.00 0.00 H new ATOM 0 HD2 LYS A 44 53.685 8.533 6.908 1.00 0.00 H new ATOM 0 HD3 LYS A 44 54.325 7.756 5.474 1.00 0.00 H new ATOM 0 HE2 LYS A 44 52.706 6.024 7.332 1.00 0.00 H new ATOM 0 HE3 LYS A 44 51.824 7.239 6.428 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 51.979 5.165 5.188 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 52.821 6.394 4.372 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 53.676 5.217 5.249 1.00 0.00 H new ATOM 713 N THR A 45 56.083 9.607 10.645 1.00 0.00 N ATOM 714 CA THR A 45 55.658 10.777 11.456 1.00 0.00 C ATOM 715 C THR A 45 54.400 11.411 10.827 1.00 0.00 C ATOM 716 O THR A 45 53.665 10.763 10.112 1.00 0.00 O ATOM 717 CB THR A 45 56.805 11.789 11.514 1.00 0.00 C ATOM 718 OG1 THR A 45 57.432 11.869 10.245 1.00 0.00 O ATOM 719 CG2 THR A 45 57.819 11.327 12.559 1.00 0.00 C ATOM 0 H THR A 45 57.023 9.667 10.255 1.00 0.00 H new ATOM 0 HA THR A 45 55.414 10.462 12.471 1.00 0.00 H new ATOM 0 HB THR A 45 56.419 12.772 11.784 1.00 0.00 H new ATOM 0 HG1 THR A 45 58.131 11.185 10.182 1.00 0.00 H new ATOM 0 HG21 THR A 45 58.641 12.041 12.609 1.00 0.00 H new ATOM 0 HG22 THR A 45 57.334 11.263 13.533 1.00 0.00 H new ATOM 0 HG23 THR A 45 58.206 10.347 12.282 1.00 0.00 H new ATOM 727 N ILE A 46 54.146 12.667 11.083 1.00 0.00 N ATOM 728 CA ILE A 46 52.935 13.313 10.498 1.00 0.00 C ATOM 729 C ILE A 46 53.290 13.918 9.178 1.00 0.00 C ATOM 730 O ILE A 46 52.465 14.048 8.294 1.00 0.00 O ATOM 731 CB ILE A 46 52.426 14.423 11.416 1.00 0.00 C ATOM 732 CG1 ILE A 46 53.617 15.303 11.887 1.00 0.00 C ATOM 733 CG2 ILE A 46 51.688 13.811 12.620 1.00 0.00 C ATOM 734 CD1 ILE A 46 54.176 14.798 13.227 1.00 0.00 C ATOM 0 H ILE A 46 54.722 13.271 11.669 1.00 0.00 H new ATOM 0 HA ILE A 46 52.159 12.556 10.379 1.00 0.00 H new ATOM 0 HB ILE A 46 51.725 15.053 10.869 1.00 0.00 H new ATOM 0 HG12 ILE A 46 54.404 15.291 11.133 1.00 0.00 H new ATOM 0 HG13 ILE A 46 53.291 16.338 11.991 1.00 0.00 H new ATOM 0 HG21 ILE A 46 51.328 14.609 13.270 1.00 0.00 H new ATOM 0 HG22 ILE A 46 50.842 13.221 12.267 1.00 0.00 H new ATOM 0 HG23 ILE A 46 52.370 13.169 13.177 1.00 0.00 H new ATOM 0 HD11 ILE A 46 55.009 15.430 13.535 1.00 0.00 H new ATOM 0 HD12 ILE A 46 53.393 14.834 13.985 1.00 0.00 H new ATOM 0 HD13 ILE A 46 54.523 13.771 13.113 1.00 0.00 H new ATOM 746 N VAL A 47 54.510 14.285 9.022 1.00 0.00 N ATOM 747 CA VAL A 47 54.931 14.873 7.759 1.00 0.00 C ATOM 748 C VAL A 47 55.377 13.754 6.815 1.00 0.00 C ATOM 749 O VAL A 47 56.024 13.989 5.814 1.00 0.00 O ATOM 750 CB VAL A 47 56.068 15.844 8.033 1.00 0.00 C ATOM 751 CG1 VAL A 47 57.354 15.082 8.364 1.00 0.00 C ATOM 752 CG2 VAL A 47 56.278 16.710 6.815 1.00 0.00 C ATOM 0 H VAL A 47 55.241 14.200 9.729 1.00 0.00 H new ATOM 0 HA VAL A 47 54.111 15.415 7.288 1.00 0.00 H new ATOM 0 HB VAL A 47 55.811 16.468 8.889 1.00 0.00 H new ATOM 0 HG11 VAL A 47 58.158 15.792 8.557 1.00 0.00 H new ATOM 0 HG12 VAL A 47 57.194 14.465 9.248 1.00 0.00 H new ATOM 0 HG13 VAL A 47 57.627 14.446 7.522 1.00 0.00 H new ATOM 0 HG21 VAL A 47 57.092 17.410 7.002 1.00 0.00 H new ATOM 0 HG22 VAL A 47 56.529 16.081 5.961 1.00 0.00 H new ATOM 0 HG23 VAL A 47 55.364 17.265 6.601 1.00 0.00 H new ATOM 762 N ALA A 48 55.008 12.528 7.123 1.00 0.00 N ATOM 763 CA ALA A 48 55.375 11.392 6.251 1.00 0.00 C ATOM 764 C ALA A 48 56.874 11.113 6.362 1.00 0.00 C ATOM 765 O ALA A 48 57.454 10.450 5.525 1.00 0.00 O ATOM 766 CB ALA A 48 55.013 11.730 4.815 1.00 0.00 C ATOM 0 H ALA A 48 54.465 12.278 7.949 1.00 0.00 H new ATOM 0 HA ALA A 48 54.830 10.501 6.563 1.00 0.00 H new ATOM 0 HB1 ALA A 48 55.281 10.896 4.166 1.00 0.00 H new ATOM 0 HB2 ALA A 48 53.941 11.915 4.744 1.00 0.00 H new ATOM 0 HB3 ALA A 48 55.557 12.622 4.503 1.00 0.00 H new ATOM 772 N LYS A 49 57.503 11.593 7.399 1.00 0.00 N ATOM 773 CA LYS A 49 58.955 11.330 7.571 1.00 0.00 C ATOM 774 C LYS A 49 59.138 9.945 8.186 1.00 0.00 C ATOM 775 O LYS A 49 59.323 9.803 9.379 1.00 0.00 O ATOM 776 CB LYS A 49 59.566 12.384 8.487 1.00 0.00 C ATOM 777 CG LYS A 49 60.677 13.127 7.743 1.00 0.00 C ATOM 778 CD LYS A 49 60.873 14.510 8.368 1.00 0.00 C ATOM 779 CE LYS A 49 61.362 14.354 9.809 1.00 0.00 C ATOM 780 NZ LYS A 49 62.158 15.553 10.196 1.00 0.00 N ATOM 0 H LYS A 49 57.073 12.155 8.133 1.00 0.00 H new ATOM 0 HA LYS A 49 59.453 11.372 6.602 1.00 0.00 H new ATOM 0 HB2 LYS A 49 58.799 13.087 8.812 1.00 0.00 H new ATOM 0 HB3 LYS A 49 59.967 11.913 9.384 1.00 0.00 H new ATOM 0 HG2 LYS A 49 61.606 12.559 7.793 1.00 0.00 H new ATOM 0 HG3 LYS A 49 60.420 13.226 6.688 1.00 0.00 H new ATOM 0 HD2 LYS A 49 61.595 15.084 7.788 1.00 0.00 H new ATOM 0 HD3 LYS A 49 59.935 15.066 8.349 1.00 0.00 H new ATOM 0 HE2 LYS A 49 60.513 14.236 10.482 1.00 0.00 H new ATOM 0 HE3 LYS A 49 61.971 13.455 9.902 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 62.491 15.447 11.176 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 62.976 15.646 9.561 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 61.563 16.403 10.122 1.00 0.00 H new ATOM 794 N GLU A 50 59.086 8.920 7.382 1.00 0.00 N ATOM 795 CA GLU A 50 59.252 7.542 7.917 1.00 0.00 C ATOM 796 C GLU A 50 60.560 7.462 8.696 1.00 0.00 C ATOM 797 O GLU A 50 61.630 7.609 8.138 1.00 0.00 O ATOM 798 CB GLU A 50 59.285 6.549 6.757 1.00 0.00 C ATOM 799 CG GLU A 50 57.875 6.376 6.192 1.00 0.00 C ATOM 800 CD GLU A 50 57.937 5.544 4.910 1.00 0.00 C ATOM 801 OE1 GLU A 50 58.874 5.730 4.151 1.00 0.00 O ATOM 802 OE2 GLU A 50 57.047 4.734 4.708 1.00 0.00 O ATOM 0 H GLU A 50 58.935 8.978 6.375 1.00 0.00 H new ATOM 0 HA GLU A 50 58.419 7.299 8.577 1.00 0.00 H new ATOM 0 HB2 GLU A 50 59.959 6.906 5.978 1.00 0.00 H new ATOM 0 HB3 GLU A 50 59.672 5.589 7.098 1.00 0.00 H new ATOM 0 HG2 GLU A 50 57.235 5.885 6.926 1.00 0.00 H new ATOM 0 HG3 GLU A 50 57.433 7.350 5.985 1.00 0.00 H new ATOM 809 N ILE A 51 60.492 7.257 9.983 1.00 0.00 N ATOM 810 CA ILE A 51 61.753 7.202 10.777 1.00 0.00 C ATOM 811 C ILE A 51 62.018 5.797 11.274 1.00 0.00 C ATOM 812 O ILE A 51 61.432 5.350 12.239 1.00 0.00 O ATOM 813 CB ILE A 51 61.683 8.113 11.996 1.00 0.00 C ATOM 814 CG1 ILE A 51 60.621 9.181 11.822 1.00 0.00 C ATOM 815 CG2 ILE A 51 63.033 8.784 12.192 1.00 0.00 C ATOM 816 CD1 ILE A 51 60.522 9.960 13.119 1.00 0.00 C ATOM 0 H ILE A 51 59.631 7.127 10.514 1.00 0.00 H new ATOM 0 HA ILE A 51 62.552 7.529 10.112 1.00 0.00 H new ATOM 0 HB ILE A 51 61.425 7.508 12.865 1.00 0.00 H new ATOM 0 HG12 ILE A 51 60.880 9.845 10.998 1.00 0.00 H new ATOM 0 HG13 ILE A 51 59.661 8.727 11.576 1.00 0.00 H new ATOM 0 HG21 ILE A 51 62.991 9.438 13.063 1.00 0.00 H new ATOM 0 HG22 ILE A 51 63.798 8.023 12.346 1.00 0.00 H new ATOM 0 HG23 ILE A 51 63.279 9.372 11.308 1.00 0.00 H new ATOM 0 HD11 ILE A 51 59.763 10.736 13.020 1.00 0.00 H new ATOM 0 HD12 ILE A 51 60.247 9.285 13.929 1.00 0.00 H new ATOM 0 HD13 ILE A 51 61.485 10.420 13.342 1.00 0.00 H new ATOM 828 N CYS A 52 62.959 5.131 10.695 1.00 0.00 N ATOM 829 CA CYS A 52 63.329 3.798 11.203 1.00 0.00 C ATOM 830 C CYS A 52 63.799 3.963 12.636 1.00 0.00 C ATOM 831 O CYS A 52 64.666 4.759 12.921 1.00 0.00 O ATOM 832 CB CYS A 52 64.451 3.229 10.362 1.00 0.00 C ATOM 833 SG CYS A 52 63.747 2.435 8.903 1.00 0.00 S ATOM 0 H CYS A 52 63.491 5.454 9.887 1.00 0.00 H new ATOM 0 HA CYS A 52 62.477 3.120 11.156 1.00 0.00 H new ATOM 0 HB2 CYS A 52 65.138 4.021 10.065 1.00 0.00 H new ATOM 0 HB3 CYS A 52 65.028 2.508 10.942 1.00 0.00 H new ATOM 838 N ALA A 53 63.215 3.258 13.540 1.00 0.00 N ATOM 839 CA ALA A 53 63.610 3.410 14.960 1.00 0.00 C ATOM 840 C ALA A 53 63.941 2.036 15.542 1.00 0.00 C ATOM 841 O ALA A 53 63.375 1.034 15.155 1.00 0.00 O ATOM 842 CB ALA A 53 62.460 4.055 15.735 1.00 0.00 C ATOM 0 H ALA A 53 62.476 2.577 13.363 1.00 0.00 H new ATOM 0 HA ALA A 53 64.491 4.047 15.038 1.00 0.00 H new ATOM 0 HB1 ALA A 53 62.745 4.169 16.781 1.00 0.00 H new ATOM 0 HB2 ALA A 53 62.239 5.034 15.310 1.00 0.00 H new ATOM 0 HB3 ALA A 53 61.575 3.422 15.667 1.00 0.00 H new ATOM 848 N ASP A 54 64.874 1.977 16.452 1.00 0.00 N ATOM 849 CA ASP A 54 65.265 0.665 17.036 1.00 0.00 C ATOM 850 C ASP A 54 64.180 0.190 18.026 1.00 0.00 C ATOM 851 O ASP A 54 63.955 0.828 19.034 1.00 0.00 O ATOM 852 CB ASP A 54 66.594 0.819 17.778 1.00 0.00 C ATOM 853 CG ASP A 54 67.094 -0.558 18.229 1.00 0.00 C ATOM 854 OD1 ASP A 54 66.546 -1.545 17.766 1.00 0.00 O ATOM 855 OD2 ASP A 54 68.015 -0.601 19.030 1.00 0.00 O ATOM 0 H ASP A 54 65.383 2.783 16.816 1.00 0.00 H new ATOM 0 HA ASP A 54 65.370 -0.069 16.237 1.00 0.00 H new ATOM 0 HB2 ASP A 54 67.332 1.290 17.129 1.00 0.00 H new ATOM 0 HB3 ASP A 54 66.466 1.471 18.642 1.00 0.00 H new ATOM 860 N PRO A 55 63.539 -0.932 17.713 1.00 0.00 N ATOM 861 CA PRO A 55 62.498 -1.488 18.583 1.00 0.00 C ATOM 862 C PRO A 55 63.099 -1.890 19.938 1.00 0.00 C ATOM 863 O PRO A 55 62.387 -2.148 20.889 1.00 0.00 O ATOM 864 CB PRO A 55 61.977 -2.730 17.841 1.00 0.00 C ATOM 865 CG PRO A 55 62.807 -2.871 16.526 1.00 0.00 C ATOM 866 CD PRO A 55 63.803 -1.699 16.486 1.00 0.00 C ATOM 0 HA PRO A 55 61.704 -0.769 18.785 1.00 0.00 H new ATOM 0 HB2 PRO A 55 62.085 -3.620 18.460 1.00 0.00 H new ATOM 0 HB3 PRO A 55 60.916 -2.625 17.616 1.00 0.00 H new ATOM 0 HG2 PRO A 55 63.335 -3.825 16.505 1.00 0.00 H new ATOM 0 HG3 PRO A 55 62.153 -2.849 15.654 1.00 0.00 H new ATOM 0 HD2 PRO A 55 64.832 -2.057 16.458 1.00 0.00 H new ATOM 0 HD3 PRO A 55 63.655 -1.085 15.597 1.00 0.00 H new ATOM 874 N LYS A 56 64.404 -1.954 20.030 1.00 0.00 N ATOM 875 CA LYS A 56 65.043 -2.347 21.311 1.00 0.00 C ATOM 876 C LYS A 56 65.110 -1.143 22.264 1.00 0.00 C ATOM 877 O LYS A 56 65.699 -1.216 23.324 1.00 0.00 O ATOM 878 CB LYS A 56 66.459 -2.855 21.035 1.00 0.00 C ATOM 879 CG LYS A 56 66.391 -4.107 20.159 1.00 0.00 C ATOM 880 CD LYS A 56 66.502 -5.353 21.042 1.00 0.00 C ATOM 881 CE LYS A 56 67.569 -6.289 20.472 1.00 0.00 C ATOM 882 NZ LYS A 56 67.625 -7.535 21.286 1.00 0.00 N ATOM 0 H LYS A 56 65.051 -1.749 19.268 1.00 0.00 H new ATOM 0 HA LYS A 56 64.450 -3.134 21.777 1.00 0.00 H new ATOM 0 HB2 LYS A 56 67.044 -2.081 20.537 1.00 0.00 H new ATOM 0 HB3 LYS A 56 66.965 -3.082 21.974 1.00 0.00 H new ATOM 0 HG2 LYS A 56 65.454 -4.124 19.603 1.00 0.00 H new ATOM 0 HG3 LYS A 56 67.197 -4.095 19.425 1.00 0.00 H new ATOM 0 HD2 LYS A 56 66.761 -5.067 22.062 1.00 0.00 H new ATOM 0 HD3 LYS A 56 65.541 -5.865 21.089 1.00 0.00 H new ATOM 0 HE2 LYS A 56 67.339 -6.530 19.434 1.00 0.00 H new ATOM 0 HE3 LYS A 56 68.541 -5.795 20.477 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 68.351 -8.171 20.898 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 67.864 -7.297 22.270 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 66.700 -8.009 21.260 1.00 0.00 H new ATOM 896 N GLN A 57 64.516 -0.035 21.898 1.00 0.00 N ATOM 897 CA GLN A 57 64.555 1.156 22.788 1.00 0.00 C ATOM 898 C GLN A 57 63.367 1.110 23.749 1.00 0.00 C ATOM 899 O GLN A 57 62.415 0.384 23.540 1.00 0.00 O ATOM 900 CB GLN A 57 64.474 2.425 21.936 1.00 0.00 C ATOM 901 CG GLN A 57 65.772 3.225 22.078 1.00 0.00 C ATOM 902 CD GLN A 57 66.974 2.337 21.734 1.00 0.00 C ATOM 903 OE1 GLN A 57 66.825 1.344 20.898 1.00 0.00 O flip ATOM 904 NE2 GLN A 57 68.062 2.549 22.234 1.00 0.00 N flip ATOM 0 H GLN A 57 64.008 0.092 21.023 1.00 0.00 H new ATOM 0 HA GLN A 57 65.484 1.158 23.359 1.00 0.00 H new ATOM 0 HB2 GLN A 57 64.309 2.163 20.891 1.00 0.00 H new ATOM 0 HB3 GLN A 57 63.625 3.032 22.250 1.00 0.00 H new ATOM 0 HG2 GLN A 57 65.749 4.092 21.418 1.00 0.00 H new ATOM 0 HG3 GLN A 57 65.867 3.602 23.096 1.00 0.00 H new ATOM 0 HE21 GLN A 57 68.181 3.324 22.887 1.00 0.00 H new ATOM 0 HE22 GLN A 57 68.856 1.952 22.000 1.00 0.00 H new ATOM 913 N LYS A 58 63.418 1.871 24.805 1.00 0.00 N ATOM 914 CA LYS A 58 62.294 1.863 25.781 1.00 0.00 C ATOM 915 C LYS A 58 61.279 2.951 25.415 1.00 0.00 C ATOM 916 O LYS A 58 60.184 2.986 25.940 1.00 0.00 O ATOM 917 CB LYS A 58 62.842 2.120 27.193 1.00 0.00 C ATOM 918 CG LYS A 58 61.683 2.359 28.182 1.00 0.00 C ATOM 919 CD LYS A 58 60.639 1.242 28.051 1.00 0.00 C ATOM 920 CE LYS A 58 60.303 0.692 29.438 1.00 0.00 C ATOM 921 NZ LYS A 58 60.224 -0.796 29.377 1.00 0.00 N ATOM 0 H LYS A 58 64.189 2.498 25.035 1.00 0.00 H new ATOM 0 HA LYS A 58 61.800 0.892 25.754 1.00 0.00 H new ATOM 0 HB2 LYS A 58 63.438 1.268 27.520 1.00 0.00 H new ATOM 0 HB3 LYS A 58 63.504 2.986 27.182 1.00 0.00 H new ATOM 0 HG2 LYS A 58 62.066 2.392 29.202 1.00 0.00 H new ATOM 0 HG3 LYS A 58 61.220 3.326 27.984 1.00 0.00 H new ATOM 0 HD2 LYS A 58 59.738 1.626 27.572 1.00 0.00 H new ATOM 0 HD3 LYS A 58 61.022 0.444 27.415 1.00 0.00 H new ATOM 0 HE2 LYS A 58 61.064 0.997 30.156 1.00 0.00 H new ATOM 0 HE3 LYS A 58 59.355 1.103 29.784 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 59.996 -1.170 30.320 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 59.483 -1.077 28.704 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 61.139 -1.180 29.064 1.00 0.00 H new ATOM 935 N TRP A 59 61.620 3.830 24.515 1.00 0.00 N ATOM 936 CA TRP A 59 60.656 4.888 24.129 1.00 0.00 C ATOM 937 C TRP A 59 59.891 4.421 22.901 1.00 0.00 C ATOM 938 O TRP A 59 58.715 4.678 22.754 1.00 0.00 O ATOM 939 CB TRP A 59 61.409 6.204 23.844 1.00 0.00 C ATOM 940 CG TRP A 59 62.056 6.161 22.490 1.00 0.00 C ATOM 941 CD1 TRP A 59 63.277 5.638 22.222 1.00 0.00 C ATOM 942 CD2 TRP A 59 61.538 6.662 21.230 1.00 0.00 C ATOM 943 NE1 TRP A 59 63.543 5.789 20.868 1.00 0.00 N ATOM 944 CE2 TRP A 59 62.502 6.415 20.212 1.00 0.00 C ATOM 945 CE3 TRP A 59 60.328 7.307 20.865 1.00 0.00 C ATOM 946 CZ2 TRP A 59 62.275 6.796 18.876 1.00 0.00 C ATOM 947 CZ3 TRP A 59 60.101 7.691 19.521 1.00 0.00 C ATOM 948 CH2 TRP A 59 61.081 7.432 18.533 1.00 0.00 C ATOM 0 H TRP A 59 62.519 3.859 24.035 1.00 0.00 H new ATOM 0 HA TRP A 59 59.952 5.074 24.940 1.00 0.00 H new ATOM 0 HB2 TRP A 59 60.716 7.044 23.895 1.00 0.00 H new ATOM 0 HB3 TRP A 59 62.167 6.369 24.610 1.00 0.00 H new ATOM 0 HD1 TRP A 59 63.936 5.179 22.944 1.00 0.00 H new ATOM 0 HE1 TRP A 59 64.401 5.476 20.414 1.00 0.00 H new ATOM 0 HE3 TRP A 59 59.577 7.506 21.615 1.00 0.00 H new ATOM 0 HZ2 TRP A 59 63.021 6.597 18.121 1.00 0.00 H new ATOM 0 HZ3 TRP A 59 59.178 8.182 19.249 1.00 0.00 H new ATOM 0 HH2 TRP A 59 60.904 7.728 17.509 1.00 0.00 H new ATOM 959 N VAL A 60 60.539 3.693 22.040 1.00 0.00 N ATOM 960 CA VAL A 60 59.837 3.160 20.857 1.00 0.00 C ATOM 961 C VAL A 60 58.860 2.084 21.330 1.00 0.00 C ATOM 962 O VAL A 60 57.720 2.061 20.942 1.00 0.00 O ATOM 963 CB VAL A 60 60.858 2.560 19.883 1.00 0.00 C ATOM 964 CG1 VAL A 60 60.137 1.763 18.796 1.00 0.00 C ATOM 965 CG2 VAL A 60 61.655 3.692 19.233 1.00 0.00 C ATOM 0 H VAL A 60 61.526 3.447 22.109 1.00 0.00 H new ATOM 0 HA VAL A 60 59.294 3.953 20.343 1.00 0.00 H new ATOM 0 HB VAL A 60 61.529 1.896 20.428 1.00 0.00 H new ATOM 0 HG11 VAL A 60 60.870 1.340 18.108 1.00 0.00 H new ATOM 0 HG12 VAL A 60 59.563 0.958 19.255 1.00 0.00 H new ATOM 0 HG13 VAL A 60 59.463 2.422 18.248 1.00 0.00 H new ATOM 0 HG21 VAL A 60 62.383 3.272 18.539 1.00 0.00 H new ATOM 0 HG22 VAL A 60 60.976 4.351 18.692 1.00 0.00 H new ATOM 0 HG23 VAL A 60 62.175 4.261 20.004 1.00 0.00 H new ATOM 975 N GLN A 61 59.294 1.208 22.193 1.00 0.00 N ATOM 976 CA GLN A 61 58.372 0.153 22.703 1.00 0.00 C ATOM 977 C GLN A 61 57.076 0.809 23.192 1.00 0.00 C ATOM 978 O GLN A 61 56.019 0.208 23.171 1.00 0.00 O ATOM 979 CB GLN A 61 59.038 -0.593 23.861 1.00 0.00 C ATOM 980 CG GLN A 61 59.922 -1.711 23.306 1.00 0.00 C ATOM 981 CD GLN A 61 60.728 -2.338 24.446 1.00 0.00 C ATOM 982 OE1 GLN A 61 60.300 -2.330 25.583 1.00 0.00 O ATOM 983 NE2 GLN A 61 61.885 -2.884 24.187 1.00 0.00 N ATOM 0 H GLN A 61 60.243 1.176 22.566 1.00 0.00 H new ATOM 0 HA GLN A 61 58.145 -0.553 21.904 1.00 0.00 H new ATOM 0 HB2 GLN A 61 59.636 0.097 24.456 1.00 0.00 H new ATOM 0 HB3 GLN A 61 58.279 -1.010 24.524 1.00 0.00 H new ATOM 0 HG2 GLN A 61 59.307 -2.469 22.822 1.00 0.00 H new ATOM 0 HG3 GLN A 61 60.595 -1.314 22.546 1.00 0.00 H new ATOM 0 HE21 GLN A 61 62.244 -2.890 23.232 1.00 0.00 H new ATOM 0 HE22 GLN A 61 62.430 -3.304 24.939 1.00 0.00 H new ATOM 992 N ASP A 62 57.147 2.044 23.616 1.00 0.00 N ATOM 993 CA ASP A 62 55.925 2.737 24.081 1.00 0.00 C ATOM 994 C ASP A 62 55.204 3.358 22.880 1.00 0.00 C ATOM 995 O ASP A 62 53.991 3.401 22.824 1.00 0.00 O ATOM 996 CB ASP A 62 56.308 3.838 25.072 1.00 0.00 C ATOM 997 CG ASP A 62 56.124 3.326 26.502 1.00 0.00 C ATOM 998 OD1 ASP A 62 55.064 2.795 26.788 1.00 0.00 O ATOM 999 OD2 ASP A 62 57.048 3.473 27.286 1.00 0.00 O ATOM 0 H ASP A 62 58.003 2.597 23.658 1.00 0.00 H new ATOM 0 HA ASP A 62 55.265 2.022 24.572 1.00 0.00 H new ATOM 0 HB2 ASP A 62 57.343 4.140 24.913 1.00 0.00 H new ATOM 0 HB3 ASP A 62 55.689 4.720 24.908 1.00 0.00 H new ATOM 1004 N SER A 63 55.945 3.837 21.916 1.00 0.00 N ATOM 1005 CA SER A 63 55.314 4.455 20.721 1.00 0.00 C ATOM 1006 C SER A 63 54.799 3.361 19.788 1.00 0.00 C ATOM 1007 O SER A 63 53.624 3.240 19.561 1.00 0.00 O ATOM 1008 CB SER A 63 56.349 5.283 19.985 1.00 0.00 C ATOM 1009 OG SER A 63 57.325 5.749 20.908 1.00 0.00 O ATOM 0 H SER A 63 56.965 3.825 21.908 1.00 0.00 H new ATOM 0 HA SER A 63 54.484 5.087 21.036 1.00 0.00 H new ATOM 0 HB2 SER A 63 56.824 4.684 19.208 1.00 0.00 H new ATOM 0 HB3 SER A 63 55.870 6.127 19.489 1.00 0.00 H new ATOM 0 HG SER A 63 57.882 4.998 21.203 1.00 0.00 H new ATOM 1015 N MET A 64 55.685 2.574 19.230 1.00 0.00 N ATOM 1016 CA MET A 64 55.257 1.486 18.297 1.00 0.00 C ATOM 1017 C MET A 64 54.077 0.710 18.895 1.00 0.00 C ATOM 1018 O MET A 64 53.286 0.137 18.181 1.00 0.00 O ATOM 1019 CB MET A 64 56.426 0.529 18.056 1.00 0.00 C ATOM 1020 CG MET A 64 56.946 0.008 19.397 1.00 0.00 C ATOM 1021 SD MET A 64 57.050 -1.797 19.347 1.00 0.00 S ATOM 1022 CE MET A 64 58.854 -1.912 19.293 1.00 0.00 C ATOM 0 H MET A 64 56.692 2.639 19.381 1.00 0.00 H new ATOM 0 HA MET A 64 54.947 1.932 17.352 1.00 0.00 H new ATOM 0 HB2 MET A 64 56.105 -0.304 17.431 1.00 0.00 H new ATOM 0 HB3 MET A 64 57.224 1.041 17.519 1.00 0.00 H new ATOM 0 HG2 MET A 64 57.927 0.433 19.608 1.00 0.00 H new ATOM 0 HG3 MET A 64 56.282 0.322 20.203 1.00 0.00 H new ATOM 0 HE1 MET A 64 59.147 -2.936 19.062 1.00 0.00 H new ATOM 0 HE2 MET A 64 59.238 -1.242 18.524 1.00 0.00 H new ATOM 0 HE3 MET A 64 59.266 -1.627 20.261 1.00 0.00 H new ATOM 1032 N ASP A 65 53.943 0.704 20.199 1.00 0.00 N ATOM 1033 CA ASP A 65 52.807 -0.009 20.826 1.00 0.00 C ATOM 1034 C ASP A 65 51.577 0.870 20.725 1.00 0.00 C ATOM 1035 O ASP A 65 50.501 0.422 20.384 1.00 0.00 O ATOM 1036 CB ASP A 65 53.121 -0.292 22.296 1.00 0.00 C ATOM 1037 CG ASP A 65 53.589 -1.740 22.449 1.00 0.00 C ATOM 1038 OD1 ASP A 65 54.275 -2.217 21.559 1.00 0.00 O ATOM 1039 OD2 ASP A 65 53.254 -2.347 23.451 1.00 0.00 O ATOM 0 H ASP A 65 54.577 1.166 20.851 1.00 0.00 H new ATOM 0 HA ASP A 65 52.633 -0.957 20.317 1.00 0.00 H new ATOM 0 HB2 ASP A 65 53.893 0.390 22.652 1.00 0.00 H new ATOM 0 HB3 ASP A 65 52.236 -0.118 22.908 1.00 0.00 H new ATOM 1044 N HIS A 66 51.737 2.130 20.989 1.00 0.00 N ATOM 1045 CA HIS A 66 50.592 3.064 20.879 1.00 0.00 C ATOM 1046 C HIS A 66 50.017 2.968 19.468 1.00 0.00 C ATOM 1047 O HIS A 66 48.821 2.956 19.269 1.00 0.00 O ATOM 1048 CB HIS A 66 51.071 4.494 21.145 1.00 0.00 C ATOM 1049 CG HIS A 66 49.919 5.450 20.987 1.00 0.00 C ATOM 1050 ND1 HIS A 66 49.675 6.446 20.077 1.00 0.00 N flip ATOM 1051 CD2 HIS A 66 48.830 5.443 21.844 1.00 0.00 C flip ATOM 1052 CE1 HIS A 66 48.455 7.051 20.359 1.00 0.00 C flip ATOM 1053 NE2 HIS A 66 47.986 6.410 21.433 1.00 0.00 N flip ATOM 0 H HIS A 66 52.617 2.556 21.278 1.00 0.00 H new ATOM 0 HA HIS A 66 49.826 2.804 21.610 1.00 0.00 H new ATOM 0 HB2 HIS A 66 51.483 4.569 22.151 1.00 0.00 H new ATOM 0 HB3 HIS A 66 51.871 4.755 20.452 1.00 0.00 H new ATOM 0 HD2 HIS A 66 48.684 4.784 22.687 1.00 0.00 H new ATOM 0 HE1 HIS A 66 47.987 7.864 19.824 1.00 0.00 H new ATOM 0 HE2 HIS A 66 47.098 6.626 21.886 1.00 0.00 H new ATOM 1061 N LEU A 67 50.871 2.855 18.490 1.00 0.00 N ATOM 1062 CA LEU A 67 50.398 2.717 17.091 1.00 0.00 C ATOM 1063 C LEU A 67 49.912 1.298 16.897 1.00 0.00 C ATOM 1064 O LEU A 67 48.984 1.039 16.155 1.00 0.00 O ATOM 1065 CB LEU A 67 51.555 3.016 16.125 1.00 0.00 C ATOM 1066 CG LEU A 67 52.312 4.271 16.593 1.00 0.00 C ATOM 1067 CD1 LEU A 67 53.658 4.359 15.886 1.00 0.00 C ATOM 1068 CD2 LEU A 67 51.495 5.503 16.257 1.00 0.00 C ATOM 0 H LEU A 67 51.885 2.853 18.604 1.00 0.00 H new ATOM 0 HA LEU A 67 49.589 3.419 16.890 1.00 0.00 H new ATOM 0 HB2 LEU A 67 52.235 2.165 16.082 1.00 0.00 H new ATOM 0 HB3 LEU A 67 51.170 3.167 15.117 1.00 0.00 H new ATOM 0 HG LEU A 67 52.472 4.211 17.670 1.00 0.00 H new ATOM 0 HD11 LEU A 67 54.188 5.250 16.222 1.00 0.00 H new ATOM 0 HD12 LEU A 67 54.250 3.474 16.120 1.00 0.00 H new ATOM 0 HD13 LEU A 67 53.500 4.416 14.809 1.00 0.00 H new ATOM 0 HD21 LEU A 67 52.028 6.394 16.587 1.00 0.00 H new ATOM 0 HD22 LEU A 67 51.338 5.553 15.180 1.00 0.00 H new ATOM 0 HD23 LEU A 67 50.531 5.449 16.762 1.00 0.00 H new ATOM 1080 N ASP A 68 50.488 0.379 17.609 1.00 0.00 N ATOM 1081 CA ASP A 68 50.024 -1.012 17.531 1.00 0.00 C ATOM 1082 C ASP A 68 48.633 -1.095 18.163 1.00 0.00 C ATOM 1083 O ASP A 68 47.947 -2.091 18.045 1.00 0.00 O ATOM 1084 CB ASP A 68 50.997 -1.918 18.290 1.00 0.00 C ATOM 1085 CG ASP A 68 51.543 -2.989 17.342 1.00 0.00 C ATOM 1086 OD1 ASP A 68 52.518 -2.712 16.665 1.00 0.00 O ATOM 1087 OD2 ASP A 68 50.975 -4.069 17.311 1.00 0.00 O ATOM 0 H ASP A 68 51.268 0.541 18.246 1.00 0.00 H new ATOM 0 HA ASP A 68 49.978 -1.337 16.492 1.00 0.00 H new ATOM 0 HB2 ASP A 68 51.817 -1.327 18.699 1.00 0.00 H new ATOM 0 HB3 ASP A 68 50.491 -2.388 19.133 1.00 0.00 H new ATOM 1092 N LYS A 69 48.201 -0.042 18.829 1.00 0.00 N ATOM 1093 CA LYS A 69 46.868 -0.063 19.446 1.00 0.00 C ATOM 1094 C LYS A 69 46.110 1.218 19.106 1.00 0.00 C ATOM 1095 O LYS A 69 45.301 1.698 19.876 1.00 0.00 O ATOM 1096 CB LYS A 69 46.997 -0.206 20.965 1.00 0.00 C ATOM 1097 CG LYS A 69 47.697 1.030 21.539 1.00 0.00 C ATOM 1098 CD LYS A 69 48.132 0.748 22.978 1.00 0.00 C ATOM 1099 CE LYS A 69 48.091 2.047 23.786 1.00 0.00 C ATOM 1100 NZ LYS A 69 47.185 1.876 24.957 1.00 0.00 N ATOM 0 H LYS A 69 48.728 0.821 18.961 1.00 0.00 H new ATOM 0 HA LYS A 69 46.313 -0.915 19.054 1.00 0.00 H new ATOM 0 HB2 LYS A 69 46.011 -0.320 21.415 1.00 0.00 H new ATOM 0 HB3 LYS A 69 47.564 -1.104 21.209 1.00 0.00 H new ATOM 0 HG2 LYS A 69 48.564 1.286 20.929 1.00 0.00 H new ATOM 0 HG3 LYS A 69 47.024 1.887 21.513 1.00 0.00 H new ATOM 0 HD2 LYS A 69 47.474 0.005 23.429 1.00 0.00 H new ATOM 0 HD3 LYS A 69 49.139 0.331 22.990 1.00 0.00 H new ATOM 0 HE2 LYS A 69 49.094 2.309 24.124 1.00 0.00 H new ATOM 0 HE3 LYS A 69 47.741 2.867 23.159 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 47.157 2.759 25.506 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 46.227 1.645 24.624 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 47.538 1.105 25.559 1.00 0.00 H new ATOM 1114 N GLN A 70 46.331 1.747 17.944 1.00 0.00 N ATOM 1115 CA GLN A 70 45.592 2.965 17.526 1.00 0.00 C ATOM 1116 C GLN A 70 45.868 3.256 16.041 1.00 0.00 C ATOM 1117 O GLN A 70 45.849 4.389 15.608 1.00 0.00 O ATOM 1118 CB GLN A 70 46.011 4.168 18.403 1.00 0.00 C ATOM 1119 CG GLN A 70 47.358 4.736 17.933 1.00 0.00 C ATOM 1120 CD GLN A 70 47.128 6.073 17.227 1.00 0.00 C ATOM 1121 OE1 GLN A 70 47.664 6.312 16.163 1.00 0.00 O ATOM 1122 NE2 GLN A 70 46.349 6.963 17.778 1.00 0.00 N ATOM 0 H GLN A 70 46.996 1.388 17.259 1.00 0.00 H new ATOM 0 HA GLN A 70 44.523 2.800 17.658 1.00 0.00 H new ATOM 0 HB2 GLN A 70 45.247 4.944 18.355 1.00 0.00 H new ATOM 0 HB3 GLN A 70 46.085 3.857 19.445 1.00 0.00 H new ATOM 0 HG2 GLN A 70 48.025 4.872 18.785 1.00 0.00 H new ATOM 0 HG3 GLN A 70 47.845 4.034 17.256 1.00 0.00 H new ATOM 0 HE21 GLN A 70 45.899 6.763 18.671 1.00 0.00 H new ATOM 0 HE22 GLN A 70 46.190 7.858 17.316 1.00 0.00 H new ATOM 1131 N THR A 71 46.115 2.237 15.262 1.00 0.00 N ATOM 1132 CA THR A 71 46.382 2.450 13.823 1.00 0.00 C ATOM 1133 C THR A 71 45.287 1.776 12.995 1.00 0.00 C ATOM 1134 O THR A 71 45.009 2.165 11.878 1.00 0.00 O ATOM 1135 CB THR A 71 47.743 1.851 13.461 1.00 0.00 C ATOM 1136 OG1 THR A 71 48.762 2.513 14.197 1.00 0.00 O ATOM 1137 CG2 THR A 71 47.998 2.027 11.964 1.00 0.00 C ATOM 0 H THR A 71 46.142 1.264 15.568 1.00 0.00 H new ATOM 0 HA THR A 71 46.390 3.519 13.609 1.00 0.00 H new ATOM 0 HB THR A 71 47.749 0.789 13.706 1.00 0.00 H new ATOM 0 HG1 THR A 71 48.670 2.298 15.149 1.00 0.00 H new ATOM 0 HG21 THR A 71 48.968 1.600 11.707 1.00 0.00 H new ATOM 0 HG22 THR A 71 47.217 1.518 11.400 1.00 0.00 H new ATOM 0 HG23 THR A 71 47.992 3.088 11.716 1.00 0.00 H new ATOM 1145 N GLN A 72 44.665 0.773 13.536 1.00 0.00 N ATOM 1146 CA GLN A 72 43.590 0.075 12.796 1.00 0.00 C ATOM 1147 C GLN A 72 42.579 -0.502 13.790 1.00 0.00 C ATOM 1148 O GLN A 72 42.396 -1.700 13.879 1.00 0.00 O ATOM 1149 CB GLN A 72 44.193 -1.059 11.964 1.00 0.00 C ATOM 1150 CG GLN A 72 44.963 -2.011 12.881 1.00 0.00 C ATOM 1151 CD GLN A 72 44.626 -3.457 12.514 1.00 0.00 C ATOM 1152 OE1 GLN A 72 43.941 -4.139 13.250 1.00 0.00 O ATOM 1153 NE2 GLN A 72 45.082 -3.957 11.398 1.00 0.00 N ATOM 0 H GLN A 72 44.858 0.405 14.467 1.00 0.00 H new ATOM 0 HA GLN A 72 43.088 0.781 12.135 1.00 0.00 H new ATOM 0 HB2 GLN A 72 43.404 -1.600 11.441 1.00 0.00 H new ATOM 0 HB3 GLN A 72 44.859 -0.652 11.203 1.00 0.00 H new ATOM 0 HG2 GLN A 72 46.035 -1.840 12.783 1.00 0.00 H new ATOM 0 HG3 GLN A 72 44.704 -1.819 13.922 1.00 0.00 H new ATOM 0 HE21 GLN A 72 45.657 -3.384 10.780 1.00 0.00 H new ATOM 0 HE22 GLN A 72 44.863 -4.920 11.144 1.00 0.00 H new ATOM 1162 N THR A 73 41.925 0.341 14.542 1.00 0.00 N ATOM 1163 CA THR A 73 40.930 -0.160 15.532 1.00 0.00 C ATOM 1164 C THR A 73 39.520 0.302 15.122 1.00 0.00 C ATOM 1165 O THR A 73 39.061 1.336 15.566 1.00 0.00 O ATOM 1166 CB THR A 73 41.269 0.400 16.916 1.00 0.00 C ATOM 1167 OG1 THR A 73 42.558 -0.051 17.306 1.00 0.00 O ATOM 1168 CG2 THR A 73 40.231 -0.083 17.929 1.00 0.00 C ATOM 0 H THR A 73 42.037 1.354 14.514 1.00 0.00 H new ATOM 0 HA THR A 73 40.959 -1.249 15.561 1.00 0.00 H new ATOM 0 HB THR A 73 41.261 1.489 16.880 1.00 0.00 H new ATOM 0 HG1 THR A 73 42.776 0.309 18.191 1.00 0.00 H new ATOM 0 HG21 THR A 73 40.472 0.315 18.915 1.00 0.00 H new ATOM 0 HG22 THR A 73 39.242 0.263 17.629 1.00 0.00 H new ATOM 0 HG23 THR A 73 40.238 -1.172 17.966 1.00 0.00 H new ATOM 1176 N PRO A 74 38.870 -0.486 14.283 1.00 0.00 N ATOM 1177 CA PRO A 74 37.520 -0.164 13.814 1.00 0.00 C ATOM 1178 C PRO A 74 36.553 -0.089 15.000 1.00 0.00 C ATOM 1179 O PRO A 74 36.887 -0.453 16.110 1.00 0.00 O ATOM 1180 CB PRO A 74 37.134 -1.323 12.878 1.00 0.00 C ATOM 1181 CG PRO A 74 38.342 -2.313 12.841 1.00 0.00 C ATOM 1182 CD PRO A 74 39.437 -1.734 13.753 1.00 0.00 C ATOM 0 HA PRO A 74 37.479 0.800 13.307 1.00 0.00 H new ATOM 0 HB2 PRO A 74 36.236 -1.825 13.239 1.00 0.00 H new ATOM 0 HB3 PRO A 74 36.911 -0.951 11.878 1.00 0.00 H new ATOM 0 HG2 PRO A 74 38.039 -3.302 13.185 1.00 0.00 H new ATOM 0 HG3 PRO A 74 38.712 -2.429 11.822 1.00 0.00 H new ATOM 0 HD2 PRO A 74 39.688 -2.426 14.557 1.00 0.00 H new ATOM 0 HD3 PRO A 74 40.355 -1.545 13.197 1.00 0.00 H new ATOM 1190 N LYS A 75 35.357 0.382 14.773 1.00 0.00 N ATOM 1191 CA LYS A 75 34.371 0.480 15.886 1.00 0.00 C ATOM 1192 C LYS A 75 32.984 0.782 15.315 1.00 0.00 C ATOM 1193 O LYS A 75 32.835 1.074 14.145 1.00 0.00 O ATOM 1194 CB LYS A 75 34.787 1.603 16.838 1.00 0.00 C ATOM 1195 CG LYS A 75 34.942 2.906 16.051 1.00 0.00 C ATOM 1196 CD LYS A 75 34.813 4.097 17.004 1.00 0.00 C ATOM 1197 CE LYS A 75 35.703 5.240 16.515 1.00 0.00 C ATOM 1198 NZ LYS A 75 35.875 6.239 17.607 1.00 0.00 N ATOM 0 H LYS A 75 35.020 0.703 13.865 1.00 0.00 H new ATOM 0 HA LYS A 75 34.341 -0.465 16.429 1.00 0.00 H new ATOM 0 HB2 LYS A 75 34.040 1.726 17.622 1.00 0.00 H new ATOM 0 HB3 LYS A 75 35.726 1.349 17.330 1.00 0.00 H new ATOM 0 HG2 LYS A 75 35.911 2.929 15.552 1.00 0.00 H new ATOM 0 HG3 LYS A 75 34.181 2.966 15.272 1.00 0.00 H new ATOM 0 HD2 LYS A 75 33.775 4.426 17.054 1.00 0.00 H new ATOM 0 HD3 LYS A 75 35.103 3.802 18.013 1.00 0.00 H new ATOM 0 HE2 LYS A 75 36.674 4.852 16.206 1.00 0.00 H new ATOM 0 HE3 LYS A 75 35.256 5.714 15.641 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 36.480 7.016 17.274 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 34.946 6.617 17.881 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 36.319 5.782 18.429 1.00 0.00 H new ATOM 1212 N THR A 76 31.968 0.716 16.131 1.00 0.00 N ATOM 1213 CA THR A 76 30.593 1.000 15.633 1.00 0.00 C ATOM 1214 C THR A 76 30.210 2.438 15.988 1.00 0.00 C ATOM 1215 O THR A 76 29.912 2.683 17.145 1.00 0.00 O ATOM 1216 CB THR A 76 29.603 0.033 16.287 1.00 0.00 C ATOM 1217 OG1 THR A 76 30.082 -0.336 17.574 1.00 0.00 O ATOM 1218 CG2 THR A 76 29.460 -1.218 15.418 1.00 0.00 C ATOM 1219 OXT THR A 76 30.221 3.271 15.096 1.00 0.00 O ATOM 0 H THR A 76 32.031 0.478 17.121 1.00 0.00 H new ATOM 0 HA THR A 76 30.565 0.872 14.551 1.00 0.00 H new ATOM 0 HB THR A 76 28.632 0.519 16.385 1.00 0.00 H new ATOM 0 HG1 THR A 76 29.448 -0.954 17.994 1.00 0.00 H new ATOM 0 HG21 THR A 76 28.755 -1.906 15.884 1.00 0.00 H new ATOM 0 HG22 THR A 76 29.093 -0.936 14.431 1.00 0.00 H new ATOM 0 HG23 THR A 76 30.430 -1.705 15.318 1.00 0.00 H new TER 1227 THR A 76 ATOM 1228 N GLN B 1 72.952 18.074 12.444 1.00 0.00 N ATOM 1229 CA GLN B 1 71.485 18.078 12.187 1.00 0.00 C ATOM 1230 C GLN B 1 71.133 16.949 11.203 1.00 0.00 C ATOM 1231 O GLN B 1 71.006 17.186 10.019 1.00 0.00 O ATOM 1232 CB GLN B 1 71.075 19.424 11.586 1.00 0.00 C ATOM 1233 CG GLN B 1 70.567 20.346 12.696 1.00 0.00 C ATOM 1234 CD GLN B 1 69.195 20.901 12.311 1.00 0.00 C ATOM 1235 OE1 GLN B 1 68.853 20.954 11.145 1.00 0.00 O ATOM 1236 NE2 GLN B 1 68.388 21.321 13.246 1.00 0.00 N ATOM 0 H1 GLN B 1 73.137 17.693 13.394 1.00 0.00 H new ATOM 0 H2 GLN B 1 73.427 17.480 11.734 1.00 0.00 H new ATOM 0 H3 GLN B 1 73.318 19.046 12.383 1.00 0.00 H new ATOM 0 HA GLN B 1 70.952 17.922 13.125 1.00 0.00 H new ATOM 0 HB2 GLN B 1 71.925 19.882 11.079 1.00 0.00 H new ATOM 0 HB3 GLN B 1 70.298 19.278 10.836 1.00 0.00 H new ATOM 0 HG2 GLN B 1 70.499 19.798 13.636 1.00 0.00 H new ATOM 0 HG3 GLN B 1 71.270 21.164 12.854 1.00 0.00 H new ATOM 0 HE21 GLN B 1 68.674 21.277 14.224 1.00 0.00 H new ATOM 0 HE22 GLN B 1 67.471 21.693 12.999 1.00 0.00 H new ATOM 1247 N PRO B 2 70.987 15.746 11.729 1.00 0.00 N ATOM 1248 CA PRO B 2 70.653 14.581 10.909 1.00 0.00 C ATOM 1249 C PRO B 2 69.302 14.789 10.217 1.00 0.00 C ATOM 1250 O PRO B 2 68.267 14.413 10.731 1.00 0.00 O ATOM 1251 CB PRO B 2 70.577 13.404 11.897 1.00 0.00 C ATOM 1252 CG PRO B 2 70.889 13.969 13.319 1.00 0.00 C ATOM 1253 CD PRO B 2 71.145 15.478 13.166 1.00 0.00 C ATOM 0 HA PRO B 2 71.388 14.406 10.124 1.00 0.00 H new ATOM 0 HB2 PRO B 2 69.588 12.947 11.874 1.00 0.00 H new ATOM 0 HB3 PRO B 2 71.293 12.628 11.626 1.00 0.00 H new ATOM 0 HG2 PRO B 2 70.054 13.788 13.996 1.00 0.00 H new ATOM 0 HG3 PRO B 2 71.760 13.473 13.747 1.00 0.00 H new ATOM 0 HD2 PRO B 2 70.438 16.060 13.756 1.00 0.00 H new ATOM 0 HD3 PRO B 2 72.144 15.746 13.510 1.00 0.00 H new ATOM 1261 N ASP B 3 69.304 15.395 9.060 1.00 0.00 N ATOM 1262 CA ASP B 3 68.027 15.636 8.342 1.00 0.00 C ATOM 1263 C ASP B 3 67.410 14.299 7.920 1.00 0.00 C ATOM 1264 O ASP B 3 67.662 13.802 6.840 1.00 0.00 O ATOM 1265 CB ASP B 3 68.295 16.487 7.100 1.00 0.00 C ATOM 1266 CG ASP B 3 68.878 17.837 7.522 1.00 0.00 C ATOM 1267 OD1 ASP B 3 68.615 18.251 8.639 1.00 0.00 O ATOM 1268 OD2 ASP B 3 69.578 18.434 6.721 1.00 0.00 O ATOM 0 H ASP B 3 70.140 15.733 8.583 1.00 0.00 H new ATOM 0 HA ASP B 3 67.335 16.159 9.002 1.00 0.00 H new ATOM 0 HB2 ASP B 3 68.988 15.971 6.436 1.00 0.00 H new ATOM 0 HB3 ASP B 3 67.371 16.637 6.542 1.00 0.00 H new ATOM 1273 N ALA B 4 66.600 13.715 8.761 1.00 0.00 N ATOM 1274 CA ALA B 4 65.965 12.414 8.405 1.00 0.00 C ATOM 1275 C ALA B 4 67.047 11.352 8.223 1.00 0.00 C ATOM 1276 O ALA B 4 67.079 10.645 7.236 1.00 0.00 O ATOM 1277 CB ALA B 4 65.175 12.570 7.103 1.00 0.00 C ATOM 0 H ALA B 4 66.351 14.083 9.679 1.00 0.00 H new ATOM 0 HA ALA B 4 65.289 12.109 9.204 1.00 0.00 H new ATOM 0 HB1 ALA B 4 64.711 11.619 6.843 1.00 0.00 H new ATOM 0 HB2 ALA B 4 64.402 13.327 7.235 1.00 0.00 H new ATOM 0 HB3 ALA B 4 65.849 12.876 6.303 1.00 0.00 H new ATOM 1283 N ILE B 5 67.933 11.235 9.169 1.00 0.00 N ATOM 1284 CA ILE B 5 69.011 10.225 9.058 1.00 0.00 C ATOM 1285 C ILE B 5 68.438 8.840 9.341 1.00 0.00 C ATOM 1286 O ILE B 5 68.835 7.859 8.749 1.00 0.00 O ATOM 1287 CB ILE B 5 70.117 10.561 10.076 1.00 0.00 C ATOM 1288 CG1 ILE B 5 71.473 10.518 9.379 1.00 0.00 C ATOM 1289 CG2 ILE B 5 70.104 9.555 11.236 1.00 0.00 C ATOM 1290 CD1 ILE B 5 71.488 11.528 8.231 1.00 0.00 C ATOM 0 H ILE B 5 67.955 11.800 10.018 1.00 0.00 H new ATOM 0 HA ILE B 5 69.432 10.234 8.052 1.00 0.00 H new ATOM 0 HB ILE B 5 69.937 11.558 10.477 1.00 0.00 H new ATOM 0 HG12 ILE B 5 72.267 10.747 10.090 1.00 0.00 H new ATOM 0 HG13 ILE B 5 71.666 9.515 8.998 1.00 0.00 H new ATOM 0 HG21 ILE B 5 70.892 9.808 11.946 1.00 0.00 H new ATOM 0 HG22 ILE B 5 69.138 9.592 11.739 1.00 0.00 H new ATOM 0 HG23 ILE B 5 70.273 8.550 10.848 1.00 0.00 H new ATOM 0 HD11 ILE B 5 72.457 11.498 7.732 1.00 0.00 H new ATOM 0 HD12 ILE B 5 70.704 11.278 7.516 1.00 0.00 H new ATOM 0 HD13 ILE B 5 71.314 12.529 8.625 1.00 0.00 H new ATOM 1302 N ASN B 6 67.523 8.762 10.253 1.00 0.00 N ATOM 1303 CA ASN B 6 66.920 7.443 10.589 1.00 0.00 C ATOM 1304 C ASN B 6 65.784 7.184 9.621 1.00 0.00 C ATOM 1305 O ASN B 6 64.649 7.084 9.999 1.00 0.00 O ATOM 1306 CB ASN B 6 66.369 7.402 12.046 1.00 0.00 C ATOM 1307 CG ASN B 6 66.563 8.746 12.767 1.00 0.00 C ATOM 1308 OD1 ASN B 6 65.822 9.768 12.430 1.00 0.00 O flip ATOM 1309 ND2 ASN B 6 67.397 8.863 13.643 1.00 0.00 N flip ATOM 0 H ASN B 6 67.162 9.554 10.785 1.00 0.00 H new ATOM 0 HA ASN B 6 67.694 6.680 10.511 1.00 0.00 H new ATOM 0 HB2 ASN B 6 65.309 7.149 12.027 1.00 0.00 H new ATOM 0 HB3 ASN B 6 66.875 6.614 12.604 1.00 0.00 H new ATOM 0 HD21 ASN B 6 67.976 8.065 13.906 1.00 0.00 H new ATOM 0 HD22 ASN B 6 67.518 9.759 14.115 1.00 0.00 H new ATOM 1316 N ALA B 7 66.083 7.126 8.368 1.00 0.00 N ATOM 1317 CA ALA B 7 65.018 6.906 7.354 1.00 0.00 C ATOM 1318 C ALA B 7 65.132 5.498 6.764 1.00 0.00 C ATOM 1319 O ALA B 7 66.204 5.092 6.361 1.00 0.00 O ATOM 1320 CB ALA B 7 65.190 7.905 6.212 1.00 0.00 C ATOM 0 H ALA B 7 67.026 7.222 7.991 1.00 0.00 H new ATOM 0 HA ALA B 7 64.049 7.032 7.838 1.00 0.00 H new ATOM 0 HB1 ALA B 7 64.410 7.745 5.468 1.00 0.00 H new ATOM 0 HB2 ALA B 7 65.116 8.920 6.602 1.00 0.00 H new ATOM 0 HB3 ALA B 7 66.167 7.764 5.750 1.00 0.00 H new ATOM 1326 N PRO B 8 64.006 4.811 6.642 1.00 0.00 N ATOM 1327 CA PRO B 8 63.995 3.510 6.006 1.00 0.00 C ATOM 1328 C PRO B 8 64.399 3.707 4.562 1.00 0.00 C ATOM 1329 O PRO B 8 63.625 4.160 3.742 1.00 0.00 O ATOM 1330 CB PRO B 8 62.556 3.015 6.102 1.00 0.00 C ATOM 1331 CG PRO B 8 61.745 4.112 6.854 1.00 0.00 C ATOM 1332 CD PRO B 8 62.707 5.279 7.132 1.00 0.00 C ATOM 0 HA PRO B 8 64.676 2.794 6.466 1.00 0.00 H new ATOM 0 HB2 PRO B 8 62.141 2.842 5.109 1.00 0.00 H new ATOM 0 HB3 PRO B 8 62.510 2.067 6.637 1.00 0.00 H new ATOM 0 HG2 PRO B 8 60.899 4.446 6.252 1.00 0.00 H new ATOM 0 HG3 PRO B 8 61.338 3.719 7.786 1.00 0.00 H new ATOM 0 HD2 PRO B 8 62.391 6.185 6.615 1.00 0.00 H new ATOM 0 HD3 PRO B 8 62.746 5.516 8.195 1.00 0.00 H new ATOM 1340 N VAL B 9 65.619 3.450 4.263 1.00 0.00 N ATOM 1341 CA VAL B 9 66.115 3.701 2.898 1.00 0.00 C ATOM 1342 C VAL B 9 65.859 2.473 2.023 1.00 0.00 C ATOM 1343 O VAL B 9 66.445 1.425 2.214 1.00 0.00 O ATOM 1344 CB VAL B 9 67.603 3.970 2.996 1.00 0.00 C ATOM 1345 CG1 VAL B 9 68.268 2.760 3.619 1.00 0.00 C ATOM 1346 CG2 VAL B 9 68.179 4.236 1.616 1.00 0.00 C ATOM 0 H VAL B 9 66.309 3.071 4.912 1.00 0.00 H new ATOM 0 HA VAL B 9 65.603 4.553 2.450 1.00 0.00 H new ATOM 0 HB VAL B 9 67.783 4.850 3.613 1.00 0.00 H new ATOM 0 HG11 VAL B 9 69.341 2.935 3.698 1.00 0.00 H new ATOM 0 HG12 VAL B 9 67.854 2.589 4.613 1.00 0.00 H new ATOM 0 HG13 VAL B 9 68.088 1.884 2.995 1.00 0.00 H new ATOM 0 HG21 VAL B 9 69.249 4.428 1.699 1.00 0.00 H new ATOM 0 HG22 VAL B 9 68.015 3.367 0.979 1.00 0.00 H new ATOM 0 HG23 VAL B 9 67.687 5.105 1.178 1.00 0.00 H new ATOM 1356 N THR B 10 64.984 2.586 1.069 1.00 0.00 N ATOM 1357 CA THR B 10 64.694 1.421 0.198 1.00 0.00 C ATOM 1358 C THR B 10 65.849 1.210 -0.776 1.00 0.00 C ATOM 1359 O THR B 10 66.025 1.957 -1.718 1.00 0.00 O ATOM 1360 CB THR B 10 63.410 1.668 -0.584 1.00 0.00 C ATOM 1361 OG1 THR B 10 62.376 2.052 0.311 1.00 0.00 O ATOM 1362 CG2 THR B 10 63.014 0.384 -1.306 1.00 0.00 C ATOM 0 H THR B 10 64.458 3.433 0.855 1.00 0.00 H new ATOM 0 HA THR B 10 64.573 0.533 0.818 1.00 0.00 H new ATOM 0 HB THR B 10 63.567 2.464 -1.311 1.00 0.00 H new ATOM 0 HG1 THR B 10 61.551 2.213 -0.192 1.00 0.00 H new ATOM 0 HG21 THR B 10 62.096 0.551 -1.869 1.00 0.00 H new ATOM 0 HG22 THR B 10 63.810 0.091 -1.990 1.00 0.00 H new ATOM 0 HG23 THR B 10 62.853 -0.409 -0.576 1.00 0.00 H new ATOM 1370 N CYS B 11 66.632 0.191 -0.565 1.00 0.00 N ATOM 1371 CA CYS B 11 67.770 -0.075 -1.494 1.00 0.00 C ATOM 1372 C CYS B 11 67.697 -1.519 -1.991 1.00 0.00 C ATOM 1373 O CYS B 11 66.658 -2.146 -1.962 1.00 0.00 O ATOM 1374 CB CYS B 11 69.103 0.142 -0.774 1.00 0.00 C ATOM 1375 SG CYS B 11 69.057 1.702 0.132 1.00 0.00 S ATOM 0 H CYS B 11 66.536 -0.469 0.207 1.00 0.00 H new ATOM 0 HA CYS B 11 67.703 0.612 -2.338 1.00 0.00 H new ATOM 0 HB2 CYS B 11 69.295 -0.683 -0.088 1.00 0.00 H new ATOM 0 HB3 CYS B 11 69.920 0.153 -1.496 1.00 0.00 H new ATOM 1380 N CYS B 12 68.798 -2.050 -2.447 1.00 0.00 N ATOM 1381 CA CYS B 12 68.802 -3.455 -2.946 1.00 0.00 C ATOM 1382 C CYS B 12 70.075 -4.154 -2.455 1.00 0.00 C ATOM 1383 O CYS B 12 70.870 -3.581 -1.738 1.00 0.00 O ATOM 1384 CB CYS B 12 68.801 -3.464 -4.480 1.00 0.00 C ATOM 1385 SG CYS B 12 67.686 -2.188 -5.106 1.00 0.00 S ATOM 0 H CYS B 12 69.697 -1.571 -2.496 1.00 0.00 H new ATOM 0 HA CYS B 12 67.915 -3.970 -2.576 1.00 0.00 H new ATOM 0 HB2 CYS B 12 69.810 -3.291 -4.853 1.00 0.00 H new ATOM 0 HB3 CYS B 12 68.489 -4.442 -4.846 1.00 0.00 H new ATOM 1390 N TYR B 13 70.296 -5.366 -2.879 1.00 0.00 N ATOM 1391 CA TYR B 13 71.546 -6.085 -2.484 1.00 0.00 C ATOM 1392 C TYR B 13 72.098 -6.816 -3.708 1.00 0.00 C ATOM 1393 O TYR B 13 73.284 -6.806 -3.971 1.00 0.00 O ATOM 1394 CB TYR B 13 71.244 -7.105 -1.378 1.00 0.00 C ATOM 1395 CG TYR B 13 70.851 -6.386 -0.107 1.00 0.00 C ATOM 1396 CD1 TYR B 13 71.534 -5.212 0.273 1.00 0.00 C ATOM 1397 CD2 TYR B 13 69.809 -6.892 0.706 1.00 0.00 C ATOM 1398 CE1 TYR B 13 71.178 -4.544 1.462 1.00 0.00 C ATOM 1399 CE2 TYR B 13 69.456 -6.222 1.896 1.00 0.00 C ATOM 1400 CZ TYR B 13 70.140 -5.050 2.275 1.00 0.00 C ATOM 1401 OH TYR B 13 69.801 -4.406 3.445 1.00 0.00 O ATOM 0 H TYR B 13 69.666 -5.894 -3.483 1.00 0.00 H new ATOM 0 HA TYR B 13 72.275 -5.366 -2.110 1.00 0.00 H new ATOM 0 HB2 TYR B 13 70.440 -7.769 -1.694 1.00 0.00 H new ATOM 0 HB3 TYR B 13 72.120 -7.728 -1.197 1.00 0.00 H new ATOM 0 HD1 TYR B 13 72.329 -4.825 -0.347 1.00 0.00 H new ATOM 0 HD2 TYR B 13 69.285 -7.790 0.416 1.00 0.00 H new ATOM 0 HE1 TYR B 13 71.700 -3.644 1.752 1.00 0.00 H new ATOM 0 HE2 TYR B 13 68.661 -6.608 2.517 1.00 0.00 H new ATOM 0 HH TYR B 13 68.831 -4.268 3.473 1.00 0.00 H new ATOM 1411 N ASN B 14 71.237 -7.435 -4.471 1.00 0.00 N ATOM 1412 CA ASN B 14 71.695 -8.150 -5.692 1.00 0.00 C ATOM 1413 C ASN B 14 71.116 -7.451 -6.917 1.00 0.00 C ATOM 1414 O ASN B 14 70.555 -6.377 -6.821 1.00 0.00 O ATOM 1415 CB ASN B 14 71.204 -9.597 -5.654 1.00 0.00 C ATOM 1416 CG ASN B 14 71.803 -10.310 -4.442 1.00 0.00 C ATOM 1417 OD1 ASN B 14 71.008 -10.860 -3.566 1.00 0.00 O flip ATOM 1418 ND2 ASN B 14 73.007 -10.369 -4.290 1.00 0.00 N flip ATOM 0 H ASN B 14 70.233 -7.475 -4.298 1.00 0.00 H new ATOM 0 HA ASN B 14 72.784 -8.142 -5.738 1.00 0.00 H new ATOM 0 HB2 ASN B 14 70.116 -9.621 -5.601 1.00 0.00 H new ATOM 0 HB3 ASN B 14 71.490 -10.113 -6.570 1.00 0.00 H new ATOM 0 HD21 ASN B 14 73.629 -9.939 -4.975 1.00 0.00 H new ATOM 0 HD22 ASN B 14 73.396 -10.848 -3.478 1.00 0.00 H new ATOM 1425 N PHE B 15 71.241 -8.044 -8.066 1.00 0.00 N ATOM 1426 CA PHE B 15 70.689 -7.402 -9.287 1.00 0.00 C ATOM 1427 C PHE B 15 70.368 -8.466 -10.338 1.00 0.00 C ATOM 1428 O PHE B 15 71.246 -9.155 -10.818 1.00 0.00 O ATOM 1429 CB PHE B 15 71.721 -6.428 -9.865 1.00 0.00 C ATOM 1430 CG PHE B 15 72.026 -5.344 -8.858 1.00 0.00 C ATOM 1431 CD1 PHE B 15 73.055 -5.531 -7.907 1.00 0.00 C ATOM 1432 CD2 PHE B 15 71.274 -4.148 -8.858 1.00 0.00 C ATOM 1433 CE1 PHE B 15 73.333 -4.521 -6.959 1.00 0.00 C ATOM 1434 CE2 PHE B 15 71.552 -3.139 -7.908 1.00 0.00 C ATOM 1435 CZ PHE B 15 72.581 -3.326 -6.959 1.00 0.00 C ATOM 0 H PHE B 15 71.700 -8.943 -8.214 1.00 0.00 H new ATOM 0 HA PHE B 15 69.778 -6.865 -9.022 1.00 0.00 H new ATOM 0 HB2 PHE B 15 72.634 -6.964 -10.123 1.00 0.00 H new ATOM 0 HB3 PHE B 15 71.340 -5.985 -10.785 1.00 0.00 H new ATOM 0 HD1 PHE B 15 73.629 -6.446 -7.905 1.00 0.00 H new ATOM 0 HD2 PHE B 15 70.487 -4.005 -9.584 1.00 0.00 H new ATOM 0 HE1 PHE B 15 74.121 -4.663 -6.234 1.00 0.00 H new ATOM 0 HE2 PHE B 15 70.977 -2.225 -7.908 1.00 0.00 H new ATOM 0 HZ PHE B 15 72.793 -2.555 -6.233 1.00 0.00 H new ATOM 1445 N THR B 16 69.117 -8.586 -10.728 1.00 0.00 N ATOM 1446 CA THR B 16 68.758 -9.592 -11.793 1.00 0.00 C ATOM 1447 C THR B 16 69.727 -9.417 -12.967 1.00 0.00 C ATOM 1448 O THR B 16 69.628 -8.478 -13.725 1.00 0.00 O ATOM 1449 CB THR B 16 67.299 -9.380 -12.294 1.00 0.00 C ATOM 1450 OG1 THR B 16 67.224 -9.688 -13.681 1.00 0.00 O ATOM 1451 CG2 THR B 16 66.862 -7.930 -12.077 1.00 0.00 C ATOM 0 H THR B 16 68.336 -8.040 -10.363 1.00 0.00 H new ATOM 0 HA THR B 16 68.831 -10.596 -11.375 1.00 0.00 H new ATOM 0 HB THR B 16 66.638 -10.037 -11.729 1.00 0.00 H new ATOM 0 HG1 THR B 16 67.055 -8.868 -14.190 1.00 0.00 H new ATOM 0 HG21 THR B 16 65.840 -7.801 -12.433 1.00 0.00 H new ATOM 0 HG22 THR B 16 66.909 -7.691 -11.015 1.00 0.00 H new ATOM 0 HG23 THR B 16 67.525 -7.264 -12.629 1.00 0.00 H new ATOM 1459 N ASN B 17 70.686 -10.286 -13.100 1.00 0.00 N ATOM 1460 CA ASN B 17 71.669 -10.126 -14.207 1.00 0.00 C ATOM 1461 C ASN B 17 71.233 -10.945 -15.422 1.00 0.00 C ATOM 1462 O ASN B 17 71.961 -11.073 -16.386 1.00 0.00 O ATOM 1463 CB ASN B 17 73.048 -10.599 -13.738 1.00 0.00 C ATOM 1464 CG ASN B 17 74.082 -10.324 -14.830 1.00 0.00 C ATOM 1465 OD1 ASN B 17 73.958 -9.374 -15.575 1.00 0.00 O ATOM 1466 ND2 ASN B 17 75.108 -11.122 -14.956 1.00 0.00 N ATOM 0 H ASN B 17 70.833 -11.095 -12.496 1.00 0.00 H new ATOM 0 HA ASN B 17 71.719 -9.074 -14.489 1.00 0.00 H new ATOM 0 HB2 ASN B 17 73.328 -10.083 -12.820 1.00 0.00 H new ATOM 0 HB3 ASN B 17 73.020 -11.664 -13.509 1.00 0.00 H new ATOM 0 HD21 ASN B 17 75.805 -10.947 -15.680 1.00 0.00 H new ATOM 0 HD22 ASN B 17 75.213 -11.921 -14.330 1.00 0.00 H new ATOM 1473 N ARG B 18 70.046 -11.477 -15.402 1.00 0.00 N ATOM 1474 CA ARG B 18 69.568 -12.255 -16.573 1.00 0.00 C ATOM 1475 C ARG B 18 68.835 -11.310 -17.520 1.00 0.00 C ATOM 1476 O ARG B 18 68.539 -10.184 -17.176 1.00 0.00 O ATOM 1477 CB ARG B 18 68.612 -13.354 -16.103 1.00 0.00 C ATOM 1478 CG ARG B 18 69.342 -14.699 -16.107 1.00 0.00 C ATOM 1479 CD ARG B 18 68.619 -15.672 -15.172 1.00 0.00 C ATOM 1480 NE ARG B 18 69.595 -16.236 -14.192 1.00 0.00 N ATOM 1481 CZ ARG B 18 69.291 -17.302 -13.485 1.00 0.00 C ATOM 1482 NH1 ARG B 18 68.127 -17.871 -13.639 1.00 0.00 N ATOM 1483 NH2 ARG B 18 70.146 -17.800 -12.624 1.00 0.00 N ATOM 0 H ARG B 18 69.387 -11.407 -14.626 1.00 0.00 H new ATOM 0 HA ARG B 18 70.413 -12.714 -17.086 1.00 0.00 H new ATOM 0 HB2 ARG B 18 68.246 -13.129 -15.101 1.00 0.00 H new ATOM 0 HB3 ARG B 18 67.741 -13.398 -16.757 1.00 0.00 H new ATOM 0 HG2 ARG B 18 69.374 -15.105 -17.118 1.00 0.00 H new ATOM 0 HG3 ARG B 18 70.374 -14.566 -15.784 1.00 0.00 H new ATOM 0 HD2 ARG B 18 67.814 -15.158 -14.646 1.00 0.00 H new ATOM 0 HD3 ARG B 18 68.161 -16.475 -15.749 1.00 0.00 H new ATOM 0 HE ARG B 18 70.505 -15.791 -14.070 1.00 0.00 H new ATOM 0 HH11 ARG B 18 67.457 -17.489 -14.306 1.00 0.00 H new ATOM 0 HH12 ARG B 18 67.887 -18.698 -13.092 1.00 0.00 H new ATOM 0 HH21 ARG B 18 71.057 -17.360 -12.498 1.00 0.00 H new ATOM 0 HH22 ARG B 18 69.899 -18.627 -12.081 1.00 0.00 H new ATOM 1497 N LYS B 19 68.536 -11.751 -18.708 1.00 0.00 N ATOM 1498 CA LYS B 19 67.812 -10.866 -19.660 1.00 0.00 C ATOM 1499 C LYS B 19 66.310 -11.031 -19.441 1.00 0.00 C ATOM 1500 O LYS B 19 65.586 -11.466 -20.314 1.00 0.00 O ATOM 1501 CB LYS B 19 68.168 -11.244 -21.102 1.00 0.00 C ATOM 1502 CG LYS B 19 69.674 -11.498 -21.218 1.00 0.00 C ATOM 1503 CD LYS B 19 70.419 -10.162 -21.203 1.00 0.00 C ATOM 1504 CE LYS B 19 71.792 -10.337 -21.854 1.00 0.00 C ATOM 1505 NZ LYS B 19 71.630 -10.474 -23.329 1.00 0.00 N ATOM 0 H LYS B 19 68.760 -12.682 -19.060 1.00 0.00 H new ATOM 0 HA LYS B 19 68.101 -9.829 -19.488 1.00 0.00 H new ATOM 0 HB2 LYS B 19 67.616 -12.135 -21.400 1.00 0.00 H new ATOM 0 HB3 LYS B 19 67.872 -10.444 -21.780 1.00 0.00 H new ATOM 0 HG2 LYS B 19 70.013 -12.125 -20.393 1.00 0.00 H new ATOM 0 HG3 LYS B 19 69.893 -12.038 -22.139 1.00 0.00 H new ATOM 0 HD2 LYS B 19 69.844 -9.407 -21.739 1.00 0.00 H new ATOM 0 HD3 LYS B 19 70.533 -9.808 -20.178 1.00 0.00 H new ATOM 0 HE2 LYS B 19 72.426 -9.481 -21.625 1.00 0.00 H new ATOM 0 HE3 LYS B 19 72.289 -11.219 -21.449 1.00 0.00 H new ATOM 0 HZ1 LYS B 19 72.517 -10.206 -23.802 1.00 0.00 H new ATOM 0 HZ2 LYS B 19 71.397 -11.460 -23.563 1.00 0.00 H new ATOM 0 HZ3 LYS B 19 70.863 -9.851 -23.653 1.00 0.00 H new ATOM 1519 N ILE B 20 65.841 -10.697 -18.268 1.00 0.00 N ATOM 1520 CA ILE B 20 64.400 -10.838 -17.963 1.00 0.00 C ATOM 1521 C ILE B 20 63.577 -10.208 -19.080 1.00 0.00 C ATOM 1522 O ILE B 20 63.740 -9.055 -19.426 1.00 0.00 O ATOM 1523 CB ILE B 20 64.102 -10.155 -16.611 1.00 0.00 C ATOM 1524 CG1 ILE B 20 64.320 -11.171 -15.488 1.00 0.00 C ATOM 1525 CG2 ILE B 20 62.650 -9.640 -16.560 1.00 0.00 C ATOM 1526 CD1 ILE B 20 63.799 -10.595 -14.178 1.00 0.00 C ATOM 0 H ILE B 20 66.407 -10.329 -17.504 1.00 0.00 H new ATOM 0 HA ILE B 20 64.133 -11.892 -17.893 1.00 0.00 H new ATOM 0 HB ILE B 20 64.771 -9.303 -16.491 1.00 0.00 H new ATOM 0 HG12 ILE B 20 63.803 -12.102 -15.720 1.00 0.00 H new ATOM 0 HG13 ILE B 20 65.380 -11.408 -15.398 1.00 0.00 H new ATOM 0 HG21 ILE B 20 62.467 -9.163 -15.597 1.00 0.00 H new ATOM 0 HG22 ILE B 20 62.493 -8.916 -17.359 1.00 0.00 H new ATOM 0 HG23 ILE B 20 61.963 -10.476 -16.688 1.00 0.00 H new ATOM 0 HD11 ILE B 20 63.953 -11.317 -13.376 1.00 0.00 H new ATOM 0 HD12 ILE B 20 64.336 -9.675 -13.946 1.00 0.00 H new ATOM 0 HD13 ILE B 20 62.735 -10.380 -14.273 1.00 0.00 H new ATOM 1538 N SER B 21 62.692 -10.965 -19.627 1.00 0.00 N ATOM 1539 CA SER B 21 61.820 -10.456 -20.718 1.00 0.00 C ATOM 1540 C SER B 21 61.237 -9.094 -20.331 1.00 0.00 C ATOM 1541 O SER B 21 60.631 -8.941 -19.288 1.00 0.00 O ATOM 1542 CB SER B 21 60.679 -11.445 -20.930 1.00 0.00 C ATOM 1543 OG SER B 21 60.311 -11.458 -22.302 1.00 0.00 O ATOM 0 H SER B 21 62.525 -11.937 -19.365 1.00 0.00 H new ATOM 0 HA SER B 21 62.405 -10.347 -21.631 1.00 0.00 H new ATOM 0 HB2 SER B 21 60.985 -12.443 -20.615 1.00 0.00 H new ATOM 0 HB3 SER B 21 59.823 -11.166 -20.316 1.00 0.00 H new ATOM 0 HG SER B 21 59.579 -12.095 -22.438 1.00 0.00 H new ATOM 1549 N VAL B 22 61.404 -8.104 -21.167 1.00 0.00 N ATOM 1550 CA VAL B 22 60.846 -6.764 -20.849 1.00 0.00 C ATOM 1551 C VAL B 22 59.340 -6.889 -20.594 1.00 0.00 C ATOM 1552 O VAL B 22 58.733 -6.043 -19.970 1.00 0.00 O ATOM 1553 CB VAL B 22 61.089 -5.818 -22.027 1.00 0.00 C ATOM 1554 CG1 VAL B 22 60.402 -6.369 -23.277 1.00 0.00 C ATOM 1555 CG2 VAL B 22 60.515 -4.438 -21.695 1.00 0.00 C ATOM 0 H VAL B 22 61.903 -8.168 -22.055 1.00 0.00 H new ATOM 0 HA VAL B 22 61.334 -6.367 -19.959 1.00 0.00 H new ATOM 0 HB VAL B 22 62.160 -5.734 -22.211 1.00 0.00 H new ATOM 0 HG11 VAL B 22 60.576 -5.694 -24.115 1.00 0.00 H new ATOM 0 HG12 VAL B 22 60.809 -7.352 -23.512 1.00 0.00 H new ATOM 0 HG13 VAL B 22 59.331 -6.454 -23.096 1.00 0.00 H new ATOM 0 HG21 VAL B 22 60.687 -3.762 -22.532 1.00 0.00 H new ATOM 0 HG22 VAL B 22 59.444 -4.524 -21.511 1.00 0.00 H new ATOM 0 HG23 VAL B 22 61.005 -4.045 -20.805 1.00 0.00 H new ATOM 1565 N GLN B 23 58.736 -7.949 -21.067 1.00 0.00 N ATOM 1566 CA GLN B 23 57.296 -8.144 -20.852 1.00 0.00 C ATOM 1567 C GLN B 23 57.059 -8.402 -19.373 1.00 0.00 C ATOM 1568 O GLN B 23 56.157 -7.859 -18.767 1.00 0.00 O ATOM 1569 CB GLN B 23 56.829 -9.349 -21.705 1.00 0.00 C ATOM 1570 CG GLN B 23 56.261 -10.478 -20.822 1.00 0.00 C ATOM 1571 CD GLN B 23 55.653 -11.565 -21.710 1.00 0.00 C ATOM 1572 OE1 GLN B 23 56.056 -12.710 -21.651 1.00 0.00 O ATOM 1573 NE2 GLN B 23 54.691 -11.254 -22.536 1.00 0.00 N ATOM 0 H GLN B 23 59.196 -8.689 -21.597 1.00 0.00 H new ATOM 0 HA GLN B 23 56.730 -7.262 -21.151 1.00 0.00 H new ATOM 0 HB2 GLN B 23 56.068 -9.022 -22.414 1.00 0.00 H new ATOM 0 HB3 GLN B 23 57.667 -9.729 -22.290 1.00 0.00 H new ATOM 0 HG2 GLN B 23 57.051 -10.901 -20.201 1.00 0.00 H new ATOM 0 HG3 GLN B 23 55.504 -10.080 -20.147 1.00 0.00 H new ATOM 0 HE21 GLN B 23 54.352 -10.293 -22.586 1.00 0.00 H new ATOM 0 HE22 GLN B 23 54.278 -11.972 -23.131 1.00 0.00 H new ATOM 1582 N ARG B 24 57.859 -9.246 -18.793 1.00 0.00 N ATOM 1583 CA ARG B 24 57.686 -9.566 -17.365 1.00 0.00 C ATOM 1584 C ARG B 24 57.734 -8.290 -16.558 1.00 0.00 C ATOM 1585 O ARG B 24 57.097 -8.162 -15.535 1.00 0.00 O ATOM 1586 CB ARG B 24 58.810 -10.488 -16.901 1.00 0.00 C ATOM 1587 CG ARG B 24 58.821 -11.754 -17.747 1.00 0.00 C ATOM 1588 CD ARG B 24 57.826 -12.755 -17.172 1.00 0.00 C ATOM 1589 NE ARG B 24 58.315 -14.143 -17.422 1.00 0.00 N ATOM 1590 CZ ARG B 24 57.506 -15.172 -17.287 1.00 0.00 C ATOM 1591 NH1 ARG B 24 56.255 -14.996 -16.937 1.00 0.00 N ATOM 1592 NH2 ARG B 24 57.953 -16.379 -17.507 1.00 0.00 N ATOM 0 H ARG B 24 58.630 -9.729 -19.255 1.00 0.00 H new ATOM 0 HA ARG B 24 56.726 -10.062 -17.223 1.00 0.00 H new ATOM 0 HB2 ARG B 24 59.769 -9.977 -16.983 1.00 0.00 H new ATOM 0 HB3 ARG B 24 58.673 -10.743 -15.850 1.00 0.00 H new ATOM 0 HG2 ARG B 24 58.561 -11.518 -18.779 1.00 0.00 H new ATOM 0 HG3 ARG B 24 59.821 -12.186 -17.762 1.00 0.00 H new ATOM 0 HD2 ARG B 24 57.704 -12.588 -16.102 1.00 0.00 H new ATOM 0 HD3 ARG B 24 56.847 -12.615 -17.630 1.00 0.00 H new ATOM 0 HE ARG B 24 59.285 -14.295 -17.700 1.00 0.00 H new ATOM 0 HH11 ARG B 24 55.901 -14.055 -16.767 1.00 0.00 H new ATOM 0 HH12 ARG B 24 55.636 -15.800 -16.835 1.00 0.00 H new ATOM 0 HH21 ARG B 24 58.925 -16.521 -17.782 1.00 0.00 H new ATOM 0 HH22 ARG B 24 57.330 -17.180 -17.404 1.00 0.00 H new ATOM 1606 N LEU B 25 58.503 -7.358 -17.001 1.00 0.00 N ATOM 1607 CA LEU B 25 58.645 -6.092 -16.255 1.00 0.00 C ATOM 1608 C LEU B 25 57.360 -5.285 -16.325 1.00 0.00 C ATOM 1609 O LEU B 25 57.148 -4.505 -17.232 1.00 0.00 O ATOM 1610 CB LEU B 25 59.787 -5.287 -16.850 1.00 0.00 C ATOM 1611 CG LEU B 25 61.051 -6.160 -16.897 1.00 0.00 C ATOM 1612 CD1 LEU B 25 62.242 -5.313 -17.325 1.00 0.00 C ATOM 1613 CD2 LEU B 25 61.329 -6.752 -15.513 1.00 0.00 C ATOM 0 H LEU B 25 59.049 -7.416 -17.861 1.00 0.00 H new ATOM 0 HA LEU B 25 58.856 -6.318 -15.210 1.00 0.00 H new ATOM 0 HB2 LEU B 25 59.526 -4.950 -17.853 1.00 0.00 H new ATOM 0 HB3 LEU B 25 59.969 -4.395 -16.251 1.00 0.00 H new ATOM 0 HG LEU B 25 60.896 -6.967 -17.613 1.00 0.00 H new ATOM 0 HD11 LEU B 25 63.137 -5.934 -17.358 1.00 0.00 H new ATOM 0 HD12 LEU B 25 62.054 -4.895 -18.314 1.00 0.00 H new ATOM 0 HD13 LEU B 25 62.388 -4.503 -16.610 1.00 0.00 H new ATOM 0 HD21 LEU B 25 62.226 -7.369 -15.555 1.00 0.00 H new ATOM 0 HD22 LEU B 25 61.477 -5.945 -14.795 1.00 0.00 H new ATOM 0 HD23 LEU B 25 60.482 -7.364 -15.202 1.00 0.00 H new ATOM 1625 N ALA B 26 56.506 -5.457 -15.367 1.00 0.00 N ATOM 1626 CA ALA B 26 55.236 -4.698 -15.359 1.00 0.00 C ATOM 1627 C ALA B 26 55.511 -3.218 -15.065 1.00 0.00 C ATOM 1628 O ALA B 26 54.687 -2.363 -15.319 1.00 0.00 O ATOM 1629 CB ALA B 26 54.320 -5.256 -14.274 1.00 0.00 C ATOM 0 H ALA B 26 56.634 -6.096 -14.582 1.00 0.00 H new ATOM 0 HA ALA B 26 54.760 -4.792 -16.335 1.00 0.00 H new ATOM 0 HB1 ALA B 26 53.384 -4.698 -14.266 1.00 0.00 H new ATOM 0 HB2 ALA B 26 54.115 -6.307 -14.476 1.00 0.00 H new ATOM 0 HB3 ALA B 26 54.807 -5.162 -13.303 1.00 0.00 H new ATOM 1635 N SER B 27 56.652 -2.915 -14.517 1.00 0.00 N ATOM 1636 CA SER B 27 56.971 -1.492 -14.189 1.00 0.00 C ATOM 1637 C SER B 27 58.451 -1.374 -13.817 1.00 0.00 C ATOM 1638 O SER B 27 59.163 -2.357 -13.756 1.00 0.00 O ATOM 1639 CB SER B 27 56.111 -1.037 -13.008 1.00 0.00 C ATOM 1640 OG SER B 27 55.142 -0.101 -13.464 1.00 0.00 O ATOM 0 H SER B 27 57.381 -3.588 -14.280 1.00 0.00 H new ATOM 0 HA SER B 27 56.763 -0.863 -15.055 1.00 0.00 H new ATOM 0 HB2 SER B 27 55.618 -1.895 -12.551 1.00 0.00 H new ATOM 0 HB3 SER B 27 56.738 -0.584 -12.240 1.00 0.00 H new ATOM 0 HG SER B 27 54.649 -0.483 -14.220 1.00 0.00 H new ATOM 1646 N TYR B 28 58.927 -0.178 -13.584 1.00 0.00 N ATOM 1647 CA TYR B 28 60.367 -0.010 -13.238 1.00 0.00 C ATOM 1648 C TYR B 28 60.542 1.250 -12.356 1.00 0.00 C ATOM 1649 O TYR B 28 60.033 2.309 -12.666 1.00 0.00 O ATOM 1650 CB TYR B 28 61.172 0.095 -14.563 1.00 0.00 C ATOM 1651 CG TYR B 28 61.970 1.375 -14.644 1.00 0.00 C ATOM 1652 CD1 TYR B 28 61.326 2.583 -14.984 1.00 0.00 C ATOM 1653 CD2 TYR B 28 63.349 1.366 -14.351 1.00 0.00 C ATOM 1654 CE1 TYR B 28 62.061 3.783 -15.036 1.00 0.00 C ATOM 1655 CE2 TYR B 28 64.088 2.565 -14.399 1.00 0.00 C ATOM 1656 CZ TYR B 28 63.446 3.776 -14.742 1.00 0.00 C ATOM 1657 OH TYR B 28 64.168 4.951 -14.793 1.00 0.00 O ATOM 0 H TYR B 28 58.383 0.684 -13.618 1.00 0.00 H new ATOM 0 HA TYR B 28 60.738 -0.861 -12.668 1.00 0.00 H new ATOM 0 HB2 TYR B 28 61.846 -0.758 -14.645 1.00 0.00 H new ATOM 0 HB3 TYR B 28 60.486 0.042 -15.408 1.00 0.00 H new ATOM 0 HD1 TYR B 28 60.269 2.588 -15.205 1.00 0.00 H new ATOM 0 HD2 TYR B 28 63.839 0.440 -14.090 1.00 0.00 H new ATOM 0 HE1 TYR B 28 61.569 4.707 -15.300 1.00 0.00 H new ATOM 0 HE2 TYR B 28 65.144 2.558 -14.174 1.00 0.00 H new ATOM 0 HH TYR B 28 63.994 5.405 -15.644 1.00 0.00 H new ATOM 1667 N ARG B 29 61.257 1.135 -11.261 1.00 0.00 N ATOM 1668 CA ARG B 29 61.457 2.322 -10.370 1.00 0.00 C ATOM 1669 C ARG B 29 62.951 2.487 -10.058 1.00 0.00 C ATOM 1670 O ARG B 29 63.438 2.042 -9.043 1.00 0.00 O ATOM 1671 CB ARG B 29 60.686 2.117 -9.067 1.00 0.00 C ATOM 1672 CG ARG B 29 59.708 3.276 -8.864 1.00 0.00 C ATOM 1673 CD ARG B 29 59.728 3.710 -7.398 1.00 0.00 C ATOM 1674 NE ARG B 29 59.313 5.141 -7.297 1.00 0.00 N ATOM 1675 CZ ARG B 29 59.528 5.822 -6.192 1.00 0.00 C ATOM 1676 NH1 ARG B 29 60.111 5.258 -5.162 1.00 0.00 N ATOM 1677 NH2 ARG B 29 59.158 7.072 -6.122 1.00 0.00 N ATOM 0 H ARG B 29 61.708 0.276 -10.948 1.00 0.00 H new ATOM 0 HA ARG B 29 61.091 3.217 -10.874 1.00 0.00 H new ATOM 0 HB2 ARG B 29 60.144 1.172 -9.098 1.00 0.00 H new ATOM 0 HB3 ARG B 29 61.379 2.061 -8.227 1.00 0.00 H new ATOM 0 HG2 ARG B 29 59.982 4.113 -9.506 1.00 0.00 H new ATOM 0 HG3 ARG B 29 58.702 2.971 -9.150 1.00 0.00 H new ATOM 0 HD2 ARG B 29 59.055 3.083 -6.813 1.00 0.00 H new ATOM 0 HD3 ARG B 29 60.727 3.580 -6.983 1.00 0.00 H new ATOM 0 HE ARG B 29 58.860 5.594 -8.091 1.00 0.00 H new ATOM 0 HH11 ARG B 29 60.403 4.282 -5.212 1.00 0.00 H new ATOM 0 HH12 ARG B 29 60.273 5.795 -4.310 1.00 0.00 H new ATOM 0 HH21 ARG B 29 58.705 7.515 -6.921 1.00 0.00 H new ATOM 0 HH22 ARG B 29 59.322 7.605 -5.268 1.00 0.00 H new ATOM 1691 N ARG B 30 63.677 3.124 -10.933 1.00 0.00 N ATOM 1692 CA ARG B 30 65.148 3.315 -10.714 1.00 0.00 C ATOM 1693 C ARG B 30 65.434 3.793 -9.281 1.00 0.00 C ATOM 1694 O ARG B 30 65.208 4.938 -8.943 1.00 0.00 O ATOM 1695 CB ARG B 30 65.670 4.359 -11.704 1.00 0.00 C ATOM 1696 CG ARG B 30 67.199 4.405 -11.640 1.00 0.00 C ATOM 1697 CD ARG B 30 67.782 3.789 -12.913 1.00 0.00 C ATOM 1698 NE ARG B 30 68.543 4.835 -13.675 1.00 0.00 N ATOM 1699 CZ ARG B 30 69.438 5.589 -13.078 1.00 0.00 C ATOM 1700 NH1 ARG B 30 69.874 5.287 -11.880 1.00 0.00 N ATOM 1701 NH2 ARG B 30 69.955 6.605 -13.716 1.00 0.00 N ATOM 0 H ARG B 30 63.317 3.526 -11.799 1.00 0.00 H new ATOM 0 HA ARG B 30 65.649 2.359 -10.868 1.00 0.00 H new ATOM 0 HB2 ARG B 30 65.345 4.112 -12.715 1.00 0.00 H new ATOM 0 HB3 ARG B 30 65.256 5.339 -11.467 1.00 0.00 H new ATOM 0 HG2 ARG B 30 67.538 5.435 -11.534 1.00 0.00 H new ATOM 0 HG3 ARG B 30 67.553 3.861 -10.765 1.00 0.00 H new ATOM 0 HD2 ARG B 30 68.441 2.959 -12.659 1.00 0.00 H new ATOM 0 HD3 ARG B 30 66.982 3.383 -13.532 1.00 0.00 H new ATOM 0 HE ARG B 30 68.363 4.962 -14.671 1.00 0.00 H new ATOM 0 HH11 ARG B 30 69.518 4.459 -11.401 1.00 0.00 H new ATOM 0 HH12 ARG B 30 70.569 5.880 -11.426 1.00 0.00 H new ATOM 0 HH21 ARG B 30 69.663 6.809 -14.672 1.00 0.00 H new ATOM 0 HH22 ARG B 30 70.650 7.194 -13.258 1.00 0.00 H new ATOM 1715 N ILE B 31 65.976 2.932 -8.449 1.00 0.00 N ATOM 1716 CA ILE B 31 66.327 3.356 -7.060 1.00 0.00 C ATOM 1717 C ILE B 31 67.515 4.322 -7.135 1.00 0.00 C ATOM 1718 O ILE B 31 68.232 4.357 -8.110 1.00 0.00 O ATOM 1719 CB ILE B 31 66.717 2.116 -6.207 1.00 0.00 C ATOM 1720 CG1 ILE B 31 65.443 1.417 -5.706 1.00 0.00 C ATOM 1721 CG2 ILE B 31 67.568 2.554 -4.992 1.00 0.00 C ATOM 1722 CD1 ILE B 31 65.820 0.259 -4.766 1.00 0.00 C ATOM 0 H ILE B 31 66.188 1.960 -8.673 1.00 0.00 H new ATOM 0 HA ILE B 31 65.471 3.844 -6.595 1.00 0.00 H new ATOM 0 HB ILE B 31 67.297 1.430 -6.824 1.00 0.00 H new ATOM 0 HG12 ILE B 31 64.808 2.131 -5.182 1.00 0.00 H new ATOM 0 HG13 ILE B 31 64.868 1.039 -6.551 1.00 0.00 H new ATOM 0 HG21 ILE B 31 67.836 1.678 -4.401 1.00 0.00 H new ATOM 0 HG22 ILE B 31 68.475 3.047 -5.342 1.00 0.00 H new ATOM 0 HG23 ILE B 31 66.994 3.246 -4.376 1.00 0.00 H new ATOM 0 HD11 ILE B 31 64.914 -0.233 -4.414 1.00 0.00 H new ATOM 0 HD12 ILE B 31 66.438 -0.460 -5.304 1.00 0.00 H new ATOM 0 HD13 ILE B 31 66.376 0.649 -3.913 1.00 0.00 H new ATOM 1734 N THR B 32 67.740 5.077 -6.094 1.00 0.00 N ATOM 1735 CA THR B 32 68.898 6.017 -6.082 1.00 0.00 C ATOM 1736 C THR B 32 68.825 6.894 -4.834 1.00 0.00 C ATOM 1737 O THR B 32 69.135 8.068 -4.868 1.00 0.00 O ATOM 1738 CB THR B 32 68.868 6.901 -7.327 1.00 0.00 C ATOM 1739 OG1 THR B 32 67.563 6.890 -7.889 1.00 0.00 O ATOM 1740 CG2 THR B 32 69.876 6.379 -8.350 1.00 0.00 C ATOM 0 H THR B 32 67.170 5.083 -5.248 1.00 0.00 H new ATOM 0 HA THR B 32 69.825 5.443 -6.075 1.00 0.00 H new ATOM 0 HB THR B 32 69.131 7.922 -7.052 1.00 0.00 H new ATOM 0 HG1 THR B 32 67.546 7.459 -8.687 1.00 0.00 H new ATOM 0 HG21 THR B 32 69.854 7.011 -9.238 1.00 0.00 H new ATOM 0 HG22 THR B 32 70.876 6.397 -7.917 1.00 0.00 H new ATOM 0 HG23 THR B 32 69.618 5.356 -8.626 1.00 0.00 H new ATOM 1748 N SER B 33 68.421 6.332 -3.727 1.00 0.00 N ATOM 1749 CA SER B 33 68.335 7.134 -2.479 1.00 0.00 C ATOM 1750 C SER B 33 69.735 7.612 -2.090 1.00 0.00 C ATOM 1751 O SER B 33 70.719 6.943 -2.334 1.00 0.00 O ATOM 1752 CB SER B 33 67.753 6.271 -1.356 1.00 0.00 C ATOM 1753 OG SER B 33 67.205 7.114 -0.349 1.00 0.00 O ATOM 0 H SER B 33 68.148 5.354 -3.636 1.00 0.00 H new ATOM 0 HA SER B 33 67.688 7.996 -2.640 1.00 0.00 H new ATOM 0 HB2 SER B 33 66.982 5.610 -1.752 1.00 0.00 H new ATOM 0 HB3 SER B 33 68.530 5.635 -0.931 1.00 0.00 H new ATOM 0 HG SER B 33 66.456 6.657 0.088 1.00 0.00 H new ATOM 1759 N SER B 34 69.834 8.768 -1.496 1.00 0.00 N ATOM 1760 CA SER B 34 71.173 9.291 -1.101 1.00 0.00 C ATOM 1761 C SER B 34 71.799 8.378 -0.038 1.00 0.00 C ATOM 1762 O SER B 34 72.971 8.479 0.264 1.00 0.00 O ATOM 1763 CB SER B 34 71.019 10.701 -0.530 1.00 0.00 C ATOM 1764 OG SER B 34 71.680 11.630 -1.382 1.00 0.00 O ATOM 0 H SER B 34 69.046 9.374 -1.267 1.00 0.00 H new ATOM 0 HA SER B 34 71.820 9.317 -1.978 1.00 0.00 H new ATOM 0 HB2 SER B 34 69.963 10.957 -0.444 1.00 0.00 H new ATOM 0 HB3 SER B 34 71.441 10.747 0.474 1.00 0.00 H new ATOM 0 HG SER B 34 71.581 12.535 -1.019 1.00 0.00 H new ATOM 1770 N LYS B 35 71.027 7.495 0.541 1.00 0.00 N ATOM 1771 CA LYS B 35 71.586 6.595 1.588 1.00 0.00 C ATOM 1772 C LYS B 35 71.841 5.197 1.000 1.00 0.00 C ATOM 1773 O LYS B 35 72.520 4.382 1.595 1.00 0.00 O ATOM 1774 CB LYS B 35 70.589 6.494 2.752 1.00 0.00 C ATOM 1775 CG LYS B 35 71.243 7.002 4.047 1.00 0.00 C ATOM 1776 CD LYS B 35 72.583 6.293 4.273 1.00 0.00 C ATOM 1777 CE LYS B 35 72.801 6.079 5.772 1.00 0.00 C ATOM 1778 NZ LYS B 35 73.585 7.219 6.327 1.00 0.00 N ATOM 0 H LYS B 35 70.037 7.360 0.334 1.00 0.00 H new ATOM 0 HA LYS B 35 72.531 7.003 1.948 1.00 0.00 H new ATOM 0 HB2 LYS B 35 69.697 7.080 2.530 1.00 0.00 H new ATOM 0 HB3 LYS B 35 70.267 5.460 2.878 1.00 0.00 H new ATOM 0 HG2 LYS B 35 71.398 8.079 3.987 1.00 0.00 H new ATOM 0 HG3 LYS B 35 70.580 6.822 4.893 1.00 0.00 H new ATOM 0 HD2 LYS B 35 72.592 5.335 3.753 1.00 0.00 H new ATOM 0 HD3 LYS B 35 73.396 6.888 3.858 1.00 0.00 H new ATOM 0 HE2 LYS B 35 71.841 6.001 6.283 1.00 0.00 H new ATOM 0 HE3 LYS B 35 73.330 5.142 5.943 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 73.734 7.074 7.346 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 74.506 7.273 5.847 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 73.063 8.106 6.176 1.00 0.00 H new ATOM 1792 N CYS B 36 71.308 4.908 -0.163 1.00 0.00 N ATOM 1793 CA CYS B 36 71.532 3.558 -0.769 1.00 0.00 C ATOM 1794 C CYS B 36 72.980 3.449 -1.276 1.00 0.00 C ATOM 1795 O CYS B 36 73.444 4.307 -2.000 1.00 0.00 O ATOM 1796 CB CYS B 36 70.563 3.346 -1.939 1.00 0.00 C ATOM 1797 SG CYS B 36 68.877 3.114 -1.307 1.00 0.00 S ATOM 0 H CYS B 36 70.732 5.543 -0.715 1.00 0.00 H new ATOM 0 HA CYS B 36 71.356 2.794 -0.011 1.00 0.00 H new ATOM 0 HB2 CYS B 36 70.595 4.205 -2.610 1.00 0.00 H new ATOM 0 HB3 CYS B 36 70.866 2.476 -2.521 1.00 0.00 H new ATOM 1802 N PRO B 37 73.658 2.386 -0.868 1.00 0.00 N ATOM 1803 CA PRO B 37 75.043 2.154 -1.264 1.00 0.00 C ATOM 1804 C PRO B 37 75.150 1.950 -2.772 1.00 0.00 C ATOM 1805 O PRO B 37 76.211 2.077 -3.351 1.00 0.00 O ATOM 1806 CB PRO B 37 75.453 0.864 -0.539 1.00 0.00 C ATOM 1807 CG PRO B 37 74.201 0.333 0.219 1.00 0.00 C ATOM 1808 CD PRO B 37 73.083 1.360 0.015 1.00 0.00 C ATOM 0 HA PRO B 37 75.680 3.001 -1.009 1.00 0.00 H new ATOM 0 HB2 PRO B 37 75.813 0.122 -1.252 1.00 0.00 H new ATOM 0 HB3 PRO B 37 76.269 1.059 0.157 1.00 0.00 H new ATOM 0 HG2 PRO B 37 73.903 -0.643 -0.165 1.00 0.00 H new ATOM 0 HG3 PRO B 37 74.418 0.205 1.279 1.00 0.00 H new ATOM 0 HD2 PRO B 37 72.204 0.900 -0.436 1.00 0.00 H new ATOM 0 HD3 PRO B 37 72.766 1.791 0.965 1.00 0.00 H new ATOM 1816 N LYS B 38 74.075 1.599 -3.409 1.00 0.00 N ATOM 1817 CA LYS B 38 74.137 1.345 -4.866 1.00 0.00 C ATOM 1818 C LYS B 38 72.790 1.653 -5.525 1.00 0.00 C ATOM 1819 O LYS B 38 71.749 1.230 -5.063 1.00 0.00 O ATOM 1820 CB LYS B 38 74.482 -0.129 -5.099 1.00 0.00 C ATOM 1821 CG LYS B 38 75.964 -0.361 -4.794 1.00 0.00 C ATOM 1822 CD LYS B 38 76.512 -1.450 -5.719 1.00 0.00 C ATOM 1823 CE LYS B 38 77.452 -2.364 -4.931 1.00 0.00 C ATOM 1824 NZ LYS B 38 78.842 -1.833 -5.008 1.00 0.00 N ATOM 0 H LYS B 38 73.156 1.477 -2.983 1.00 0.00 H new ATOM 0 HA LYS B 38 74.898 1.990 -5.305 1.00 0.00 H new ATOM 0 HB2 LYS B 38 73.865 -0.763 -4.462 1.00 0.00 H new ATOM 0 HB3 LYS B 38 74.264 -0.406 -6.131 1.00 0.00 H new ATOM 0 HG2 LYS B 38 76.524 0.564 -4.933 1.00 0.00 H new ATOM 0 HG3 LYS B 38 76.090 -0.657 -3.752 1.00 0.00 H new ATOM 0 HD2 LYS B 38 75.691 -2.031 -6.140 1.00 0.00 H new ATOM 0 HD3 LYS B 38 77.044 -0.997 -6.555 1.00 0.00 H new ATOM 0 HE2 LYS B 38 77.131 -2.423 -3.891 1.00 0.00 H new ATOM 0 HE3 LYS B 38 77.415 -3.376 -5.334 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 79.481 -2.454 -4.472 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 79.146 -1.798 -6.002 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 78.871 -0.875 -4.603 1.00 0.00 H new ATOM 1838 N GLU B 39 72.809 2.349 -6.633 1.00 0.00 N ATOM 1839 CA GLU B 39 71.537 2.637 -7.354 1.00 0.00 C ATOM 1840 C GLU B 39 70.975 1.316 -7.883 1.00 0.00 C ATOM 1841 O GLU B 39 71.542 0.264 -7.658 1.00 0.00 O ATOM 1842 CB GLU B 39 71.818 3.578 -8.529 1.00 0.00 C ATOM 1843 CG GLU B 39 72.722 4.723 -8.064 1.00 0.00 C ATOM 1844 CD GLU B 39 72.681 5.855 -9.092 1.00 0.00 C ATOM 1845 OE1 GLU B 39 72.413 5.569 -10.247 1.00 0.00 O ATOM 1846 OE2 GLU B 39 72.918 6.988 -8.707 1.00 0.00 O ATOM 0 H GLU B 39 73.650 2.729 -7.067 1.00 0.00 H new ATOM 0 HA GLU B 39 70.821 3.110 -6.681 1.00 0.00 H new ATOM 0 HB2 GLU B 39 72.296 3.030 -9.341 1.00 0.00 H new ATOM 0 HB3 GLU B 39 70.882 3.976 -8.921 1.00 0.00 H new ATOM 0 HG2 GLU B 39 72.393 5.089 -7.091 1.00 0.00 H new ATOM 0 HG3 GLU B 39 73.745 4.366 -7.941 1.00 0.00 H new ATOM 1853 N ALA B 40 69.878 1.348 -8.586 1.00 0.00 N ATOM 1854 CA ALA B 40 69.312 0.075 -9.119 1.00 0.00 C ATOM 1855 C ALA B 40 68.030 0.356 -9.901 1.00 0.00 C ATOM 1856 O ALA B 40 67.696 1.487 -10.188 1.00 0.00 O ATOM 1857 CB ALA B 40 68.991 -0.864 -7.954 1.00 0.00 C ATOM 0 H ALA B 40 69.352 2.192 -8.814 1.00 0.00 H new ATOM 0 HA ALA B 40 70.043 -0.388 -9.782 1.00 0.00 H new ATOM 0 HB1 ALA B 40 68.577 -1.795 -8.341 1.00 0.00 H new ATOM 0 HB2 ALA B 40 69.903 -1.076 -7.396 1.00 0.00 H new ATOM 0 HB3 ALA B 40 68.264 -0.390 -7.294 1.00 0.00 H new ATOM 1863 N VAL B 41 67.300 -0.676 -10.224 1.00 0.00 N ATOM 1864 CA VAL B 41 66.019 -0.494 -10.958 1.00 0.00 C ATOM 1865 C VAL B 41 64.979 -1.413 -10.351 1.00 0.00 C ATOM 1866 O VAL B 41 65.130 -2.616 -10.357 1.00 0.00 O ATOM 1867 CB VAL B 41 66.207 -0.839 -12.452 1.00 0.00 C ATOM 1868 CG1 VAL B 41 64.956 -1.559 -12.999 1.00 0.00 C ATOM 1869 CG2 VAL B 41 66.412 0.444 -13.235 1.00 0.00 C ATOM 0 H VAL B 41 67.539 -1.644 -10.009 1.00 0.00 H new ATOM 0 HA VAL B 41 65.696 0.544 -10.878 1.00 0.00 H new ATOM 0 HB VAL B 41 67.072 -1.493 -12.557 1.00 0.00 H new ATOM 0 HG11 VAL B 41 65.104 -1.795 -14.053 1.00 0.00 H new ATOM 0 HG12 VAL B 41 64.793 -2.480 -12.440 1.00 0.00 H new ATOM 0 HG13 VAL B 41 64.087 -0.910 -12.891 1.00 0.00 H new ATOM 0 HG21 VAL B 41 66.545 0.208 -14.291 1.00 0.00 H new ATOM 0 HG22 VAL B 41 65.540 1.087 -13.114 1.00 0.00 H new ATOM 0 HG23 VAL B 41 67.298 0.959 -12.863 1.00 0.00 H new ATOM 1879 N ILE B 42 63.908 -0.878 -9.874 1.00 0.00 N ATOM 1880 CA ILE B 42 62.866 -1.750 -9.319 1.00 0.00 C ATOM 1881 C ILE B 42 62.026 -2.303 -10.457 1.00 0.00 C ATOM 1882 O ILE B 42 60.973 -1.791 -10.763 1.00 0.00 O ATOM 1883 CB ILE B 42 61.962 -0.967 -8.378 1.00 0.00 C ATOM 1884 CG1 ILE B 42 62.814 -0.086 -7.420 1.00 0.00 C ATOM 1885 CG2 ILE B 42 61.109 -1.957 -7.594 1.00 0.00 C ATOM 1886 CD1 ILE B 42 63.242 -0.868 -6.168 1.00 0.00 C ATOM 0 H ILE B 42 63.710 0.122 -9.845 1.00 0.00 H new ATOM 0 HA ILE B 42 63.341 -2.560 -8.765 1.00 0.00 H new ATOM 0 HB ILE B 42 61.314 -0.301 -8.948 1.00 0.00 H new ATOM 0 HG12 ILE B 42 63.698 0.274 -7.945 1.00 0.00 H new ATOM 0 HG13 ILE B 42 62.240 0.792 -7.124 1.00 0.00 H new ATOM 0 HG21 ILE B 42 60.454 -1.413 -6.913 1.00 0.00 H new ATOM 0 HG22 ILE B 42 60.506 -2.545 -8.286 1.00 0.00 H new ATOM 0 HG23 ILE B 42 61.756 -2.621 -7.021 1.00 0.00 H new ATOM 0 HD11 ILE B 42 63.836 -0.222 -5.521 1.00 0.00 H new ATOM 0 HD12 ILE B 42 62.356 -1.206 -5.630 1.00 0.00 H new ATOM 0 HD13 ILE B 42 63.838 -1.731 -6.464 1.00 0.00 H new ATOM 1898 N PHE B 43 62.484 -3.344 -11.091 1.00 0.00 N ATOM 1899 CA PHE B 43 61.710 -3.929 -12.215 1.00 0.00 C ATOM 1900 C PHE B 43 60.490 -4.670 -11.661 1.00 0.00 C ATOM 1901 O PHE B 43 60.503 -5.876 -11.522 1.00 0.00 O ATOM 1902 CB PHE B 43 62.591 -4.920 -12.980 1.00 0.00 C ATOM 1903 CG PHE B 43 63.381 -4.197 -14.048 1.00 0.00 C ATOM 1904 CD1 PHE B 43 62.753 -3.233 -14.873 1.00 0.00 C ATOM 1905 CD2 PHE B 43 64.748 -4.491 -14.226 1.00 0.00 C ATOM 1906 CE1 PHE B 43 63.500 -2.567 -15.872 1.00 0.00 C ATOM 1907 CE2 PHE B 43 65.493 -3.825 -15.223 1.00 0.00 C ATOM 1908 CZ PHE B 43 64.868 -2.863 -16.045 1.00 0.00 C ATOM 0 H PHE B 43 63.363 -3.815 -10.878 1.00 0.00 H new ATOM 0 HA PHE B 43 61.386 -3.132 -12.884 1.00 0.00 H new ATOM 0 HB2 PHE B 43 63.271 -5.421 -12.291 1.00 0.00 H new ATOM 0 HB3 PHE B 43 61.972 -5.693 -13.435 1.00 0.00 H new ATOM 0 HD1 PHE B 43 61.705 -3.007 -14.740 1.00 0.00 H new ATOM 0 HD2 PHE B 43 65.227 -5.228 -13.598 1.00 0.00 H new ATOM 0 HE1 PHE B 43 63.023 -1.831 -16.503 1.00 0.00 H new ATOM 0 HE2 PHE B 43 66.540 -4.051 -15.357 1.00 0.00 H new ATOM 0 HZ PHE B 43 65.438 -2.353 -16.807 1.00 0.00 H new ATOM 1918 N LYS B 44 59.433 -3.969 -11.354 1.00 0.00 N ATOM 1919 CA LYS B 44 58.227 -4.657 -10.825 1.00 0.00 C ATOM 1920 C LYS B 44 57.721 -5.614 -11.886 1.00 0.00 C ATOM 1921 O LYS B 44 57.066 -5.215 -12.819 1.00 0.00 O ATOM 1922 CB LYS B 44 57.136 -3.630 -10.509 1.00 0.00 C ATOM 1923 CG LYS B 44 56.806 -3.676 -9.017 1.00 0.00 C ATOM 1924 CD LYS B 44 55.288 -3.744 -8.831 1.00 0.00 C ATOM 1925 CE LYS B 44 54.662 -2.412 -9.248 1.00 0.00 C ATOM 1926 NZ LYS B 44 54.511 -1.538 -8.051 1.00 0.00 N ATOM 0 H LYS B 44 59.354 -2.956 -11.447 1.00 0.00 H new ATOM 0 HA LYS B 44 58.479 -5.197 -9.912 1.00 0.00 H new ATOM 0 HB2 LYS B 44 57.471 -2.631 -10.787 1.00 0.00 H new ATOM 0 HB3 LYS B 44 56.242 -3.841 -11.096 1.00 0.00 H new ATOM 0 HG2 LYS B 44 57.279 -4.543 -8.556 1.00 0.00 H new ATOM 0 HG3 LYS B 44 57.205 -2.793 -8.518 1.00 0.00 H new ATOM 0 HD2 LYS B 44 54.874 -4.556 -9.429 1.00 0.00 H new ATOM 0 HD3 LYS B 44 55.048 -3.961 -7.790 1.00 0.00 H new ATOM 0 HE2 LYS B 44 55.288 -1.921 -9.993 1.00 0.00 H new ATOM 0 HE3 LYS B 44 53.690 -2.584 -9.711 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 54.085 -0.632 -8.334 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 53.897 -2.006 -7.354 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 55.445 -1.364 -7.628 1.00 0.00 H new ATOM 1940 N THR B 45 58.045 -6.869 -11.768 1.00 0.00 N ATOM 1941 CA THR B 45 57.604 -7.846 -12.795 1.00 0.00 C ATOM 1942 C THR B 45 56.063 -7.857 -12.869 1.00 0.00 C ATOM 1943 O THR B 45 55.413 -6.901 -12.501 1.00 0.00 O ATOM 1944 CB THR B 45 58.140 -9.232 -12.432 1.00 0.00 C ATOM 1945 OG1 THR B 45 58.035 -9.429 -11.030 1.00 0.00 O ATOM 1946 CG2 THR B 45 59.607 -9.321 -12.855 1.00 0.00 C ATOM 0 H THR B 45 58.596 -7.260 -11.004 1.00 0.00 H new ATOM 0 HA THR B 45 57.994 -7.563 -13.773 1.00 0.00 H new ATOM 0 HB THR B 45 57.561 -10.000 -12.945 1.00 0.00 H new ATOM 0 HG1 THR B 45 58.838 -9.080 -10.590 1.00 0.00 H new ATOM 0 HG21 THR B 45 60.000 -10.305 -12.601 1.00 0.00 H new ATOM 0 HG22 THR B 45 59.685 -9.166 -13.931 1.00 0.00 H new ATOM 0 HG23 THR B 45 60.183 -8.555 -12.335 1.00 0.00 H new ATOM 1954 N ILE B 46 55.474 -8.926 -13.337 1.00 0.00 N ATOM 1955 CA ILE B 46 53.985 -8.971 -13.429 1.00 0.00 C ATOM 1956 C ILE B 46 53.431 -9.532 -12.159 1.00 0.00 C ATOM 1957 O ILE B 46 52.323 -9.231 -11.760 1.00 0.00 O ATOM 1958 CB ILE B 46 53.548 -9.872 -14.585 1.00 0.00 C ATOM 1959 CG1 ILE B 46 54.361 -11.197 -14.555 1.00 0.00 C ATOM 1960 CG2 ILE B 46 53.749 -9.140 -15.924 1.00 0.00 C ATOM 1961 CD1 ILE B 46 55.612 -11.095 -15.438 1.00 0.00 C ATOM 0 H ILE B 46 55.956 -9.765 -13.658 1.00 0.00 H new ATOM 0 HA ILE B 46 53.615 -7.959 -13.597 1.00 0.00 H new ATOM 0 HB ILE B 46 52.490 -10.111 -14.478 1.00 0.00 H new ATOM 0 HG12 ILE B 46 54.653 -11.426 -13.530 1.00 0.00 H new ATOM 0 HG13 ILE B 46 53.735 -12.020 -14.899 1.00 0.00 H new ATOM 0 HG21 ILE B 46 53.436 -9.787 -16.743 1.00 0.00 H new ATOM 0 HG22 ILE B 46 53.152 -8.228 -15.933 1.00 0.00 H new ATOM 0 HG23 ILE B 46 54.802 -8.885 -16.045 1.00 0.00 H new ATOM 0 HD11 ILE B 46 56.162 -12.035 -15.399 1.00 0.00 H new ATOM 0 HD12 ILE B 46 55.316 -10.890 -16.467 1.00 0.00 H new ATOM 0 HD13 ILE B 46 56.248 -10.287 -15.076 1.00 0.00 H new ATOM 1973 N VAL B 47 54.186 -10.338 -11.507 1.00 0.00 N ATOM 1974 CA VAL B 47 53.718 -10.916 -10.256 1.00 0.00 C ATOM 1975 C VAL B 47 54.095 -9.979 -9.106 1.00 0.00 C ATOM 1976 O VAL B 47 54.065 -10.352 -7.949 1.00 0.00 O ATOM 1977 CB VAL B 47 54.360 -12.283 -10.084 1.00 0.00 C ATOM 1978 CG1 VAL B 47 55.840 -12.136 -9.721 1.00 0.00 C ATOM 1979 CG2 VAL B 47 53.632 -13.034 -8.996 1.00 0.00 C ATOM 0 H VAL B 47 55.122 -10.623 -11.795 1.00 0.00 H new ATOM 0 HA VAL B 47 52.635 -11.036 -10.261 1.00 0.00 H new ATOM 0 HB VAL B 47 54.291 -12.835 -11.021 1.00 0.00 H new ATOM 0 HG11 VAL B 47 56.285 -13.124 -9.601 1.00 0.00 H new ATOM 0 HG12 VAL B 47 56.358 -11.598 -10.515 1.00 0.00 H new ATOM 0 HG13 VAL B 47 55.932 -11.581 -8.787 1.00 0.00 H new ATOM 0 HG21 VAL B 47 54.086 -14.016 -8.866 1.00 0.00 H new ATOM 0 HG22 VAL B 47 53.699 -12.476 -8.062 1.00 0.00 H new ATOM 0 HG23 VAL B 47 52.585 -13.152 -9.274 1.00 0.00 H new ATOM 1989 N ALA B 48 54.431 -8.746 -9.422 1.00 0.00 N ATOM 1990 CA ALA B 48 54.784 -7.771 -8.370 1.00 0.00 C ATOM 1991 C ALA B 48 56.140 -8.127 -7.763 1.00 0.00 C ATOM 1992 O ALA B 48 56.492 -7.669 -6.693 1.00 0.00 O ATOM 1993 CB ALA B 48 53.711 -7.790 -7.293 1.00 0.00 C ATOM 0 H ALA B 48 54.472 -8.384 -10.375 1.00 0.00 H new ATOM 0 HA ALA B 48 54.847 -6.773 -8.804 1.00 0.00 H new ATOM 0 HB1 ALA B 48 53.966 -7.072 -6.513 1.00 0.00 H new ATOM 0 HB2 ALA B 48 52.750 -7.523 -7.732 1.00 0.00 H new ATOM 0 HB3 ALA B 48 53.647 -8.788 -6.860 1.00 0.00 H new ATOM 1999 N LYS B 49 56.919 -8.920 -8.447 1.00 0.00 N ATOM 2000 CA LYS B 49 58.260 -9.278 -7.917 1.00 0.00 C ATOM 2001 C LYS B 49 59.238 -8.152 -8.242 1.00 0.00 C ATOM 2002 O LYS B 49 59.980 -8.215 -9.203 1.00 0.00 O ATOM 2003 CB LYS B 49 58.739 -10.574 -8.561 1.00 0.00 C ATOM 2004 CG LYS B 49 58.993 -11.621 -7.474 1.00 0.00 C ATOM 2005 CD LYS B 49 58.878 -13.022 -8.078 1.00 0.00 C ATOM 2006 CE LYS B 49 59.980 -13.219 -9.120 1.00 0.00 C ATOM 2007 NZ LYS B 49 60.312 -14.668 -9.225 1.00 0.00 N ATOM 0 H LYS B 49 56.683 -9.334 -9.349 1.00 0.00 H new ATOM 0 HA LYS B 49 58.203 -9.418 -6.838 1.00 0.00 H new ATOM 0 HB2 LYS B 49 57.992 -10.940 -9.266 1.00 0.00 H new ATOM 0 HB3 LYS B 49 59.652 -10.395 -9.129 1.00 0.00 H new ATOM 0 HG2 LYS B 49 59.984 -11.480 -7.043 1.00 0.00 H new ATOM 0 HG3 LYS B 49 58.273 -11.502 -6.664 1.00 0.00 H new ATOM 0 HD2 LYS B 49 58.964 -13.776 -7.295 1.00 0.00 H new ATOM 0 HD3 LYS B 49 57.899 -13.152 -8.539 1.00 0.00 H new ATOM 0 HE2 LYS B 49 59.652 -12.839 -10.088 1.00 0.00 H new ATOM 0 HE3 LYS B 49 60.867 -12.651 -8.839 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 61.061 -14.802 -9.934 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 60.642 -15.016 -8.302 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 59.465 -15.198 -9.513 1.00 0.00 H new ATOM 2021 N GLU B 50 59.242 -7.115 -7.449 1.00 0.00 N ATOM 2022 CA GLU B 50 60.167 -5.979 -7.712 1.00 0.00 C ATOM 2023 C GLU B 50 61.594 -6.508 -7.804 1.00 0.00 C ATOM 2024 O GLU B 50 62.138 -7.014 -6.842 1.00 0.00 O ATOM 2025 CB GLU B 50 60.068 -4.972 -6.568 1.00 0.00 C ATOM 2026 CG GLU B 50 58.756 -4.193 -6.686 1.00 0.00 C ATOM 2027 CD GLU B 50 58.560 -3.332 -5.436 1.00 0.00 C ATOM 2028 OE1 GLU B 50 58.891 -3.800 -4.360 1.00 0.00 O ATOM 2029 OE2 GLU B 50 58.083 -2.218 -5.578 1.00 0.00 O ATOM 0 H GLU B 50 58.644 -7.007 -6.630 1.00 0.00 H new ATOM 0 HA GLU B 50 59.897 -5.491 -8.649 1.00 0.00 H new ATOM 0 HB2 GLU B 50 60.111 -5.489 -5.609 1.00 0.00 H new ATOM 0 HB3 GLU B 50 60.915 -4.286 -6.599 1.00 0.00 H new ATOM 0 HG2 GLU B 50 58.773 -3.563 -7.575 1.00 0.00 H new ATOM 0 HG3 GLU B 50 57.920 -4.883 -6.800 1.00 0.00 H new ATOM 2036 N ILE B 51 62.204 -6.423 -8.955 1.00 0.00 N ATOM 2037 CA ILE B 51 63.590 -6.958 -9.084 1.00 0.00 C ATOM 2038 C ILE B 51 64.588 -5.833 -9.265 1.00 0.00 C ATOM 2039 O ILE B 51 64.733 -5.288 -10.340 1.00 0.00 O ATOM 2040 CB ILE B 51 63.719 -7.881 -10.289 1.00 0.00 C ATOM 2041 CG1 ILE B 51 62.366 -8.412 -10.721 1.00 0.00 C ATOM 2042 CG2 ILE B 51 64.617 -9.053 -9.920 1.00 0.00 C ATOM 2043 CD1 ILE B 51 62.562 -9.213 -11.992 1.00 0.00 C ATOM 0 H ILE B 51 61.810 -6.012 -9.801 1.00 0.00 H new ATOM 0 HA ILE B 51 63.797 -7.510 -8.167 1.00 0.00 H new ATOM 0 HB ILE B 51 64.146 -7.313 -11.115 1.00 0.00 H new ATOM 0 HG12 ILE B 51 61.935 -9.037 -9.939 1.00 0.00 H new ATOM 0 HG13 ILE B 51 61.671 -7.590 -10.892 1.00 0.00 H new ATOM 0 HG21 ILE B 51 64.715 -9.720 -10.777 1.00 0.00 H new ATOM 0 HG22 ILE B 51 65.601 -8.681 -9.634 1.00 0.00 H new ATOM 0 HG23 ILE B 51 64.178 -9.598 -9.084 1.00 0.00 H new ATOM 0 HD11 ILE B 51 61.602 -9.607 -12.325 1.00 0.00 H new ATOM 0 HD12 ILE B 51 62.979 -8.570 -12.767 1.00 0.00 H new ATOM 0 HD13 ILE B 51 63.247 -10.039 -11.800 1.00 0.00 H new ATOM 2055 N CYS B 52 65.343 -5.544 -8.259 1.00 0.00 N ATOM 2056 CA CYS B 52 66.400 -4.530 -8.409 1.00 0.00 C ATOM 2057 C CYS B 52 67.356 -5.011 -9.484 1.00 0.00 C ATOM 2058 O CYS B 52 67.859 -6.111 -9.426 1.00 0.00 O ATOM 2059 CB CYS B 52 67.143 -4.375 -7.100 1.00 0.00 C ATOM 2060 SG CYS B 52 66.241 -3.224 -6.045 1.00 0.00 S ATOM 0 H CYS B 52 65.273 -5.969 -7.334 1.00 0.00 H new ATOM 0 HA CYS B 52 65.970 -3.567 -8.684 1.00 0.00 H new ATOM 0 HB2 CYS B 52 67.240 -5.342 -6.606 1.00 0.00 H new ATOM 0 HB3 CYS B 52 68.153 -4.007 -7.282 1.00 0.00 H new ATOM 2065 N ALA B 53 67.579 -4.226 -10.479 1.00 0.00 N ATOM 2066 CA ALA B 53 68.474 -4.665 -11.575 1.00 0.00 C ATOM 2067 C ALA B 53 69.551 -3.604 -11.804 1.00 0.00 C ATOM 2068 O ALA B 53 69.325 -2.425 -11.615 1.00 0.00 O ATOM 2069 CB ALA B 53 67.648 -4.870 -12.846 1.00 0.00 C ATOM 0 H ALA B 53 67.181 -3.293 -10.588 1.00 0.00 H new ATOM 0 HA ALA B 53 68.957 -5.606 -11.310 1.00 0.00 H new ATOM 0 HB1 ALA B 53 68.301 -5.193 -13.656 1.00 0.00 H new ATOM 0 HB2 ALA B 53 66.888 -5.631 -12.667 1.00 0.00 H new ATOM 0 HB3 ALA B 53 67.165 -3.932 -13.121 1.00 0.00 H new ATOM 2075 N ASP B 54 70.730 -4.014 -12.183 1.00 0.00 N ATOM 2076 CA ASP B 54 71.830 -3.033 -12.394 1.00 0.00 C ATOM 2077 C ASP B 54 71.600 -2.266 -13.713 1.00 0.00 C ATOM 2078 O ASP B 54 71.621 -2.859 -14.772 1.00 0.00 O ATOM 2079 CB ASP B 54 73.164 -3.779 -12.467 1.00 0.00 C ATOM 2080 CG ASP B 54 74.316 -2.771 -12.504 1.00 0.00 C ATOM 2081 OD1 ASP B 54 74.067 -1.607 -12.244 1.00 0.00 O ATOM 2082 OD2 ASP B 54 75.428 -3.181 -12.796 1.00 0.00 O ATOM 0 H ASP B 54 70.979 -4.988 -12.356 1.00 0.00 H new ATOM 0 HA ASP B 54 71.847 -2.325 -11.565 1.00 0.00 H new ATOM 0 HB2 ASP B 54 73.271 -4.437 -11.605 1.00 0.00 H new ATOM 0 HB3 ASP B 54 73.191 -4.410 -13.355 1.00 0.00 H new ATOM 2087 N PRO B 55 71.397 -0.957 -13.613 1.00 0.00 N ATOM 2088 CA PRO B 55 71.181 -0.122 -14.797 1.00 0.00 C ATOM 2089 C PRO B 55 72.432 -0.131 -15.688 1.00 0.00 C ATOM 2090 O PRO B 55 72.397 0.293 -16.827 1.00 0.00 O ATOM 2091 CB PRO B 55 70.927 1.293 -14.250 1.00 0.00 C ATOM 2092 CG PRO B 55 71.052 1.221 -12.695 1.00 0.00 C ATOM 2093 CD PRO B 55 71.361 -0.240 -12.329 1.00 0.00 C ATOM 0 HA PRO B 55 70.351 -0.481 -15.405 1.00 0.00 H new ATOM 0 HB2 PRO B 55 71.649 1.999 -14.661 1.00 0.00 H new ATOM 0 HB3 PRO B 55 69.937 1.645 -14.540 1.00 0.00 H new ATOM 0 HG2 PRO B 55 71.844 1.881 -12.342 1.00 0.00 H new ATOM 0 HG3 PRO B 55 70.128 1.549 -12.219 1.00 0.00 H new ATOM 0 HD2 PRO B 55 72.313 -0.322 -11.805 1.00 0.00 H new ATOM 0 HD3 PRO B 55 70.597 -0.651 -11.669 1.00 0.00 H new ATOM 2101 N LYS B 56 73.541 -0.604 -15.174 1.00 0.00 N ATOM 2102 CA LYS B 56 74.786 -0.630 -15.982 1.00 0.00 C ATOM 2103 C LYS B 56 74.788 -1.850 -16.917 1.00 0.00 C ATOM 2104 O LYS B 56 75.765 -2.125 -17.585 1.00 0.00 O ATOM 2105 CB LYS B 56 75.994 -0.706 -15.047 1.00 0.00 C ATOM 2106 CG LYS B 56 76.046 0.551 -14.176 1.00 0.00 C ATOM 2107 CD LYS B 56 77.030 1.553 -14.783 1.00 0.00 C ATOM 2108 CE LYS B 56 77.999 2.035 -13.702 1.00 0.00 C ATOM 2109 NZ LYS B 56 78.909 3.067 -14.275 1.00 0.00 N ATOM 0 H LYS B 56 73.632 -0.973 -14.227 1.00 0.00 H new ATOM 0 HA LYS B 56 74.838 0.278 -16.583 1.00 0.00 H new ATOM 0 HB2 LYS B 56 75.925 -1.594 -14.419 1.00 0.00 H new ATOM 0 HB3 LYS B 56 76.912 -0.797 -15.628 1.00 0.00 H new ATOM 0 HG2 LYS B 56 75.054 0.997 -14.104 1.00 0.00 H new ATOM 0 HG3 LYS B 56 76.353 0.292 -13.163 1.00 0.00 H new ATOM 0 HD2 LYS B 56 77.582 1.088 -15.600 1.00 0.00 H new ATOM 0 HD3 LYS B 56 76.489 2.400 -15.205 1.00 0.00 H new ATOM 0 HE2 LYS B 56 77.445 2.451 -12.861 1.00 0.00 H new ATOM 0 HE3 LYS B 56 78.579 1.196 -13.318 1.00 0.00 H new ATOM 0 HZ1 LYS B 56 79.568 3.395 -13.540 1.00 0.00 H new ATOM 0 HZ2 LYS B 56 79.447 2.656 -15.064 1.00 0.00 H new ATOM 0 HZ3 LYS B 56 78.348 3.871 -14.621 1.00 0.00 H new ATOM 2123 N GLN B 57 73.706 -2.584 -16.974 1.00 0.00 N ATOM 2124 CA GLN B 57 73.662 -3.773 -17.863 1.00 0.00 C ATOM 2125 C GLN B 57 73.167 -3.353 -19.247 1.00 0.00 C ATOM 2126 O GLN B 57 72.604 -2.291 -19.418 1.00 0.00 O ATOM 2127 CB GLN B 57 72.706 -4.812 -17.272 1.00 0.00 C ATOM 2128 CG GLN B 57 73.485 -6.074 -16.892 1.00 0.00 C ATOM 2129 CD GLN B 57 74.645 -5.712 -15.956 1.00 0.00 C ATOM 2130 OE1 GLN B 57 74.545 -4.664 -15.182 1.00 0.00 O flip ATOM 2131 NE2 GLN B 57 75.653 -6.390 -15.929 1.00 0.00 N flip ATOM 0 H GLN B 57 72.854 -2.408 -16.442 1.00 0.00 H new ATOM 0 HA GLN B 57 74.660 -4.204 -17.949 1.00 0.00 H new ATOM 0 HB2 GLN B 57 72.207 -4.403 -16.394 1.00 0.00 H new ATOM 0 HB3 GLN B 57 71.928 -5.057 -17.995 1.00 0.00 H new ATOM 0 HG2 GLN B 57 72.822 -6.788 -16.403 1.00 0.00 H new ATOM 0 HG3 GLN B 57 73.869 -6.559 -17.790 1.00 0.00 H new ATOM 0 HE21 GLN B 57 75.733 -7.209 -16.532 1.00 0.00 H new ATOM 0 HE22 GLN B 57 76.419 -6.141 -15.303 1.00 0.00 H new ATOM 2140 N LYS B 58 73.379 -4.174 -20.237 1.00 0.00 N ATOM 2141 CA LYS B 58 72.926 -3.814 -21.609 1.00 0.00 C ATOM 2142 C LYS B 58 71.516 -4.364 -21.852 1.00 0.00 C ATOM 2143 O LYS B 58 70.866 -4.010 -22.815 1.00 0.00 O ATOM 2144 CB LYS B 58 73.899 -4.409 -22.639 1.00 0.00 C ATOM 2145 CG LYS B 58 73.324 -4.264 -24.063 1.00 0.00 C ATOM 2146 CD LYS B 58 72.879 -2.815 -24.306 1.00 0.00 C ATOM 2147 CE LYS B 58 73.457 -2.319 -25.632 1.00 0.00 C ATOM 2148 NZ LYS B 58 73.960 -0.927 -25.465 1.00 0.00 N ATOM 0 H LYS B 58 73.846 -5.077 -20.156 1.00 0.00 H new ATOM 0 HA LYS B 58 72.907 -2.729 -21.711 1.00 0.00 H new ATOM 0 HB2 LYS B 58 74.862 -3.903 -22.575 1.00 0.00 H new ATOM 0 HB3 LYS B 58 74.077 -5.461 -22.416 1.00 0.00 H new ATOM 0 HG2 LYS B 58 74.076 -4.550 -24.798 1.00 0.00 H new ATOM 0 HG3 LYS B 58 72.478 -4.939 -24.193 1.00 0.00 H new ATOM 0 HD2 LYS B 58 71.791 -2.756 -24.327 1.00 0.00 H new ATOM 0 HD3 LYS B 58 73.217 -2.178 -23.489 1.00 0.00 H new ATOM 0 HE2 LYS B 58 74.267 -2.973 -25.955 1.00 0.00 H new ATOM 0 HE3 LYS B 58 72.693 -2.350 -26.408 1.00 0.00 H new ATOM 0 HZ1 LYS B 58 74.353 -0.589 -26.367 1.00 0.00 H new ATOM 0 HZ2 LYS B 58 73.177 -0.307 -25.175 1.00 0.00 H new ATOM 0 HZ3 LYS B 58 74.702 -0.911 -24.736 1.00 0.00 H new ATOM 2162 N TRP B 59 71.030 -5.211 -20.988 1.00 0.00 N ATOM 2163 CA TRP B 59 69.665 -5.750 -21.186 1.00 0.00 C ATOM 2164 C TRP B 59 68.687 -4.895 -20.396 1.00 0.00 C ATOM 2165 O TRP B 59 67.580 -4.645 -20.823 1.00 0.00 O ATOM 2166 CB TRP B 59 69.611 -7.222 -20.726 1.00 0.00 C ATOM 2167 CG TRP B 59 69.533 -7.306 -19.230 1.00 0.00 C ATOM 2168 CD1 TRP B 59 70.597 -7.289 -18.388 1.00 0.00 C ATOM 2169 CD2 TRP B 59 68.351 -7.428 -18.395 1.00 0.00 C ATOM 2170 NE1 TRP B 59 70.136 -7.397 -17.083 1.00 0.00 N ATOM 2171 CE2 TRP B 59 68.759 -7.487 -17.033 1.00 0.00 C ATOM 2172 CE3 TRP B 59 66.964 -7.497 -18.683 1.00 0.00 C ATOM 2173 CZ2 TRP B 59 67.823 -7.609 -15.989 1.00 0.00 C ATOM 2174 CZ3 TRP B 59 66.022 -7.620 -17.632 1.00 0.00 C ATOM 2175 CH2 TRP B 59 66.461 -7.676 -16.287 1.00 0.00 C ATOM 0 H TRP B 59 71.519 -5.549 -20.159 1.00 0.00 H new ATOM 0 HA TRP B 59 69.395 -5.719 -22.242 1.00 0.00 H new ATOM 0 HB2 TRP B 59 68.746 -7.715 -21.169 1.00 0.00 H new ATOM 0 HB3 TRP B 59 70.496 -7.752 -21.080 1.00 0.00 H new ATOM 0 HD1 TRP B 59 71.632 -7.205 -18.684 1.00 0.00 H new ATOM 0 HE1 TRP B 59 70.741 -7.408 -16.262 1.00 0.00 H new ATOM 0 HE3 TRP B 59 66.625 -7.456 -19.707 1.00 0.00 H new ATOM 0 HZ2 TRP B 59 68.157 -7.651 -14.963 1.00 0.00 H new ATOM 0 HZ3 TRP B 59 64.967 -7.671 -17.857 1.00 0.00 H new ATOM 0 HH2 TRP B 59 65.740 -7.771 -15.489 1.00 0.00 H new ATOM 2186 N VAL B 60 69.106 -4.405 -19.267 1.00 0.00 N ATOM 2187 CA VAL B 60 68.226 -3.521 -18.482 1.00 0.00 C ATOM 2188 C VAL B 60 68.090 -2.197 -19.234 1.00 0.00 C ATOM 2189 O VAL B 60 67.015 -1.681 -19.402 1.00 0.00 O ATOM 2190 CB VAL B 60 68.841 -3.285 -17.096 1.00 0.00 C ATOM 2191 CG1 VAL B 60 68.094 -2.160 -16.378 1.00 0.00 C ATOM 2192 CG2 VAL B 60 68.731 -4.568 -16.275 1.00 0.00 C ATOM 0 H VAL B 60 70.023 -4.582 -18.858 1.00 0.00 H new ATOM 0 HA VAL B 60 67.244 -3.975 -18.351 1.00 0.00 H new ATOM 0 HB VAL B 60 69.888 -3.004 -17.209 1.00 0.00 H new ATOM 0 HG11 VAL B 60 68.537 -1.999 -15.395 1.00 0.00 H new ATOM 0 HG12 VAL B 60 68.167 -1.243 -16.963 1.00 0.00 H new ATOM 0 HG13 VAL B 60 67.046 -2.435 -16.263 1.00 0.00 H new ATOM 0 HG21 VAL B 60 69.166 -4.407 -15.289 1.00 0.00 H new ATOM 0 HG22 VAL B 60 67.682 -4.843 -16.168 1.00 0.00 H new ATOM 0 HG23 VAL B 60 69.267 -5.371 -16.781 1.00 0.00 H new ATOM 2202 N GLN B 61 69.176 -1.659 -19.716 1.00 0.00 N ATOM 2203 CA GLN B 61 69.092 -0.380 -20.478 1.00 0.00 C ATOM 2204 C GLN B 61 68.017 -0.508 -21.561 1.00 0.00 C ATOM 2205 O GLN B 61 67.404 0.463 -21.961 1.00 0.00 O ATOM 2206 CB GLN B 61 70.444 -0.082 -21.130 1.00 0.00 C ATOM 2207 CG GLN B 61 71.347 0.638 -20.126 1.00 0.00 C ATOM 2208 CD GLN B 61 72.754 0.772 -20.709 1.00 0.00 C ATOM 2209 OE1 GLN B 61 72.924 0.823 -21.912 1.00 0.00 O ATOM 2210 NE2 GLN B 61 73.779 0.834 -19.904 1.00 0.00 N ATOM 0 H GLN B 61 70.114 -2.047 -19.616 1.00 0.00 H new ATOM 0 HA GLN B 61 68.833 0.433 -19.800 1.00 0.00 H new ATOM 0 HB2 GLN B 61 70.914 -1.009 -21.458 1.00 0.00 H new ATOM 0 HB3 GLN B 61 70.304 0.536 -22.017 1.00 0.00 H new ATOM 0 HG2 GLN B 61 70.941 1.624 -19.898 1.00 0.00 H new ATOM 0 HG3 GLN B 61 71.382 0.083 -19.189 1.00 0.00 H new ATOM 0 HE21 GLN B 61 73.638 0.791 -18.895 1.00 0.00 H new ATOM 0 HE22 GLN B 61 74.721 0.925 -20.284 1.00 0.00 H new ATOM 2219 N ASP B 62 67.771 -1.705 -22.029 1.00 0.00 N ATOM 2220 CA ASP B 62 66.729 -1.895 -23.063 1.00 0.00 C ATOM 2221 C ASP B 62 65.363 -2.051 -22.385 1.00 0.00 C ATOM 2222 O ASP B 62 64.354 -1.600 -22.888 1.00 0.00 O ATOM 2223 CB ASP B 62 67.041 -3.150 -23.881 1.00 0.00 C ATOM 2224 CG ASP B 62 67.745 -2.754 -25.179 1.00 0.00 C ATOM 2225 OD1 ASP B 62 67.240 -1.874 -25.859 1.00 0.00 O ATOM 2226 OD2 ASP B 62 68.776 -3.335 -25.473 1.00 0.00 O ATOM 0 H ASP B 62 68.251 -2.555 -21.735 1.00 0.00 H new ATOM 0 HA ASP B 62 66.711 -1.029 -23.725 1.00 0.00 H new ATOM 0 HB2 ASP B 62 67.673 -3.825 -23.304 1.00 0.00 H new ATOM 0 HB3 ASP B 62 66.120 -3.689 -24.105 1.00 0.00 H new ATOM 2231 N SER B 63 65.328 -2.687 -21.245 1.00 0.00 N ATOM 2232 CA SER B 63 64.037 -2.879 -20.532 1.00 0.00 C ATOM 2233 C SER B 63 63.643 -1.582 -19.828 1.00 0.00 C ATOM 2234 O SER B 63 62.652 -0.978 -20.144 1.00 0.00 O ATOM 2235 CB SER B 63 64.202 -3.972 -19.496 1.00 0.00 C ATOM 2236 OG SER B 63 65.210 -4.880 -19.920 1.00 0.00 O ATOM 0 H SER B 63 66.143 -3.083 -20.777 1.00 0.00 H new ATOM 0 HA SER B 63 63.263 -3.155 -21.248 1.00 0.00 H new ATOM 0 HB2 SER B 63 64.471 -3.537 -18.533 1.00 0.00 H new ATOM 0 HB3 SER B 63 63.259 -4.499 -19.355 1.00 0.00 H new ATOM 0 HG SER B 63 66.087 -4.448 -19.855 1.00 0.00 H new ATOM 2242 N MET B 64 64.413 -1.164 -18.853 1.00 0.00 N ATOM 2243 CA MET B 64 64.086 0.092 -18.110 1.00 0.00 C ATOM 2244 C MET B 64 63.724 1.212 -19.095 1.00 0.00 C ATOM 2245 O MET B 64 63.000 2.122 -18.761 1.00 0.00 O ATOM 2246 CB MET B 64 65.293 0.522 -17.272 1.00 0.00 C ATOM 2247 CG MET B 64 66.521 0.654 -18.175 1.00 0.00 C ATOM 2248 SD MET B 64 67.303 2.262 -17.904 1.00 0.00 S ATOM 2249 CE MET B 64 68.763 1.650 -17.029 1.00 0.00 C ATOM 0 H MET B 64 65.258 -1.642 -18.539 1.00 0.00 H new ATOM 0 HA MET B 64 63.234 -0.097 -17.457 1.00 0.00 H new ATOM 0 HB2 MET B 64 65.087 1.472 -16.779 1.00 0.00 H new ATOM 0 HB3 MET B 64 65.483 -0.210 -16.487 1.00 0.00 H new ATOM 0 HG2 MET B 64 67.229 -0.147 -17.962 1.00 0.00 H new ATOM 0 HG3 MET B 64 66.229 0.552 -19.220 1.00 0.00 H new ATOM 0 HE1 MET B 64 69.321 2.492 -16.619 1.00 0.00 H new ATOM 0 HE2 MET B 64 68.452 0.992 -16.218 1.00 0.00 H new ATOM 0 HE3 MET B 64 69.397 1.097 -17.722 1.00 0.00 H new ATOM 2259 N ASP B 65 64.209 1.140 -20.311 1.00 0.00 N ATOM 2260 CA ASP B 65 63.870 2.181 -21.307 1.00 0.00 C ATOM 2261 C ASP B 65 62.492 1.882 -21.861 1.00 0.00 C ATOM 2262 O ASP B 65 61.659 2.754 -22.000 1.00 0.00 O ATOM 2263 CB ASP B 65 64.898 2.165 -22.441 1.00 0.00 C ATOM 2264 CG ASP B 65 65.919 3.282 -22.220 1.00 0.00 C ATOM 2265 OD1 ASP B 65 66.255 3.532 -21.074 1.00 0.00 O ATOM 2266 OD2 ASP B 65 66.347 3.869 -23.200 1.00 0.00 O ATOM 0 H ASP B 65 64.825 0.401 -20.649 1.00 0.00 H new ATOM 0 HA ASP B 65 63.880 3.165 -20.839 1.00 0.00 H new ATOM 0 HB2 ASP B 65 65.402 1.199 -22.476 1.00 0.00 H new ATOM 0 HB3 ASP B 65 64.399 2.299 -23.401 1.00 0.00 H new ATOM 2271 N HIS B 66 62.235 0.643 -22.151 1.00 0.00 N ATOM 2272 CA HIS B 66 60.898 0.261 -22.663 1.00 0.00 C ATOM 2273 C HIS B 66 59.841 0.721 -21.662 1.00 0.00 C ATOM 2274 O HIS B 66 58.802 1.230 -22.025 1.00 0.00 O ATOM 2275 CB HIS B 66 60.829 -1.260 -22.827 1.00 0.00 C ATOM 2276 CG HIS B 66 59.456 -1.654 -23.303 1.00 0.00 C ATOM 2277 ND1 HIS B 66 58.453 -2.374 -22.705 1.00 0.00 N flip ATOM 2278 CD2 HIS B 66 58.976 -1.298 -24.553 1.00 0.00 C flip ATOM 2279 CE1 HIS B 66 57.364 -2.464 -23.566 1.00 0.00 C flip ATOM 2280 NE2 HIS B 66 57.731 -1.801 -24.666 1.00 0.00 N flip ATOM 0 H HIS B 66 62.898 -0.126 -22.055 1.00 0.00 H new ATOM 0 HA HIS B 66 60.720 0.731 -23.630 1.00 0.00 H new ATOM 0 HB2 HIS B 66 61.582 -1.594 -23.541 1.00 0.00 H new ATOM 0 HB3 HIS B 66 61.050 -1.749 -21.878 1.00 0.00 H new ATOM 0 HD2 HIS B 66 59.503 -0.723 -25.300 1.00 0.00 H new ATOM 0 HE1 HIS B 66 56.424 -2.963 -23.384 1.00 0.00 H new ATOM 0 HE2 HIS B 66 57.141 -1.689 -25.491 1.00 0.00 H new ATOM 2288 N LEU B 67 60.126 0.580 -20.399 1.00 0.00 N ATOM 2289 CA LEU B 67 59.173 1.034 -19.358 1.00 0.00 C ATOM 2290 C LEU B 67 59.264 2.542 -19.261 1.00 0.00 C ATOM 2291 O LEU B 67 58.293 3.223 -18.997 1.00 0.00 O ATOM 2292 CB LEU B 67 59.541 0.396 -18.008 1.00 0.00 C ATOM 2293 CG LEU B 67 59.853 -1.096 -18.208 1.00 0.00 C ATOM 2294 CD1 LEU B 67 60.573 -1.643 -16.982 1.00 0.00 C ATOM 2295 CD2 LEU B 67 58.559 -1.859 -18.402 1.00 0.00 C ATOM 0 H LEU B 67 60.987 0.165 -20.043 1.00 0.00 H new ATOM 0 HA LEU B 67 58.157 0.737 -19.617 1.00 0.00 H new ATOM 0 HB2 LEU B 67 60.405 0.904 -17.578 1.00 0.00 H new ATOM 0 HB3 LEU B 67 58.718 0.514 -17.303 1.00 0.00 H new ATOM 0 HG LEU B 67 60.489 -1.213 -19.086 1.00 0.00 H new ATOM 0 HD11 LEU B 67 60.791 -2.701 -17.130 1.00 0.00 H new ATOM 0 HD12 LEU B 67 61.505 -1.097 -16.834 1.00 0.00 H new ATOM 0 HD13 LEU B 67 59.939 -1.523 -16.104 1.00 0.00 H new ATOM 0 HD21 LEU B 67 58.778 -2.917 -18.544 1.00 0.00 H new ATOM 0 HD22 LEU B 67 57.928 -1.734 -17.522 1.00 0.00 H new ATOM 0 HD23 LEU B 67 58.039 -1.475 -19.280 1.00 0.00 H new ATOM 2307 N ASP B 68 60.414 3.077 -19.541 1.00 0.00 N ATOM 2308 CA ASP B 68 60.564 4.537 -19.542 1.00 0.00 C ATOM 2309 C ASP B 68 59.772 5.107 -20.721 1.00 0.00 C ATOM 2310 O ASP B 68 59.570 6.300 -20.826 1.00 0.00 O ATOM 2311 CB ASP B 68 62.046 4.899 -19.685 1.00 0.00 C ATOM 2312 CG ASP B 68 62.481 5.750 -18.491 1.00 0.00 C ATOM 2313 OD1 ASP B 68 62.841 5.174 -17.478 1.00 0.00 O ATOM 2314 OD2 ASP B 68 62.445 6.964 -18.608 1.00 0.00 O ATOM 0 H ASP B 68 61.259 2.554 -19.770 1.00 0.00 H new ATOM 0 HA ASP B 68 60.188 4.955 -18.608 1.00 0.00 H new ATOM 0 HB2 ASP B 68 62.649 3.993 -19.738 1.00 0.00 H new ATOM 0 HB3 ASP B 68 62.210 5.446 -20.614 1.00 0.00 H new ATOM 2319 N LYS B 69 59.308 4.252 -21.613 1.00 0.00 N ATOM 2320 CA LYS B 69 58.530 4.744 -22.760 1.00 0.00 C ATOM 2321 C LYS B 69 57.260 3.914 -22.929 1.00 0.00 C ATOM 2322 O LYS B 69 56.771 3.721 -24.025 1.00 0.00 O ATOM 2323 CB LYS B 69 59.377 4.669 -24.033 1.00 0.00 C ATOM 2324 CG LYS B 69 59.700 3.206 -24.351 1.00 0.00 C ATOM 2325 CD LYS B 69 60.808 3.144 -25.403 1.00 0.00 C ATOM 2326 CE LYS B 69 60.622 1.896 -26.267 1.00 0.00 C ATOM 2327 NZ LYS B 69 60.495 2.297 -27.697 1.00 0.00 N ATOM 0 H LYS B 69 59.444 3.242 -21.580 1.00 0.00 H new ATOM 0 HA LYS B 69 58.250 5.782 -22.578 1.00 0.00 H new ATOM 0 HB2 LYS B 69 58.840 5.123 -24.866 1.00 0.00 H new ATOM 0 HB3 LYS B 69 60.299 5.235 -23.902 1.00 0.00 H new ATOM 0 HG2 LYS B 69 60.015 2.687 -23.446 1.00 0.00 H new ATOM 0 HG3 LYS B 69 58.808 2.697 -24.717 1.00 0.00 H new ATOM 0 HD2 LYS B 69 60.783 4.038 -26.026 1.00 0.00 H new ATOM 0 HD3 LYS B 69 61.784 3.121 -24.918 1.00 0.00 H new ATOM 0 HE2 LYS B 69 61.470 1.223 -26.141 1.00 0.00 H new ATOM 0 HE3 LYS B 69 59.733 1.351 -25.951 1.00 0.00 H new ATOM 0 HZ1 LYS B 69 60.368 1.449 -28.285 1.00 0.00 H new ATOM 0 HZ2 LYS B 69 59.672 2.923 -27.810 1.00 0.00 H new ATOM 0 HZ3 LYS B 69 61.356 2.799 -27.994 1.00 0.00 H new ATOM 2341 N GLN B 70 56.701 3.459 -21.851 1.00 0.00 N ATOM 2342 CA GLN B 70 55.436 2.687 -21.936 1.00 0.00 C ATOM 2343 C GLN B 70 54.869 2.461 -20.525 1.00 0.00 C ATOM 2344 O GLN B 70 54.206 1.478 -20.262 1.00 0.00 O ATOM 2345 CB GLN B 70 55.685 1.336 -22.646 1.00 0.00 C ATOM 2346 CG GLN B 70 56.320 0.327 -21.678 1.00 0.00 C ATOM 2347 CD GLN B 70 55.284 -0.729 -21.290 1.00 0.00 C ATOM 2348 OE1 GLN B 70 55.136 -1.054 -20.128 1.00 0.00 O ATOM 2349 NE2 GLN B 70 54.555 -1.284 -22.219 1.00 0.00 N ATOM 0 H GLN B 70 57.067 3.588 -20.908 1.00 0.00 H new ATOM 0 HA GLN B 70 54.708 3.252 -22.519 1.00 0.00 H new ATOM 0 HB2 GLN B 70 54.744 0.940 -23.027 1.00 0.00 H new ATOM 0 HB3 GLN B 70 56.339 1.485 -23.505 1.00 0.00 H new ATOM 0 HG2 GLN B 70 57.182 -0.149 -22.146 1.00 0.00 H new ATOM 0 HG3 GLN B 70 56.683 0.840 -20.787 1.00 0.00 H new ATOM 0 HE21 GLN B 70 54.678 -1.012 -23.194 1.00 0.00 H new ATOM 0 HE22 GLN B 70 53.862 -1.990 -21.970 1.00 0.00 H new ATOM 2358 N THR B 71 55.123 3.369 -19.621 1.00 0.00 N ATOM 2359 CA THR B 71 54.600 3.212 -18.245 1.00 0.00 C ATOM 2360 C THR B 71 53.623 4.346 -17.936 1.00 0.00 C ATOM 2361 O THR B 71 52.741 4.215 -17.112 1.00 0.00 O ATOM 2362 CB THR B 71 55.763 3.250 -17.249 1.00 0.00 C ATOM 2363 OG1 THR B 71 56.643 2.164 -17.509 1.00 0.00 O ATOM 2364 CG2 THR B 71 55.221 3.137 -15.824 1.00 0.00 C ATOM 0 H THR B 71 55.672 4.213 -19.783 1.00 0.00 H new ATOM 0 HA THR B 71 54.082 2.257 -18.161 1.00 0.00 H new ATOM 0 HB THR B 71 56.303 4.191 -17.357 1.00 0.00 H new ATOM 0 HG1 THR B 71 57.086 2.301 -18.373 1.00 0.00 H new ATOM 0 HG21 THR B 71 56.050 3.164 -15.116 1.00 0.00 H new ATOM 0 HG22 THR B 71 54.546 3.969 -15.624 1.00 0.00 H new ATOM 0 HG23 THR B 71 54.680 2.197 -15.714 1.00 0.00 H new ATOM 2372 N GLN B 72 53.772 5.454 -18.597 1.00 0.00 N ATOM 2373 CA GLN B 72 52.860 6.596 -18.356 1.00 0.00 C ATOM 2374 C GLN B 72 52.732 7.426 -19.636 1.00 0.00 C ATOM 2375 O GLN B 72 53.105 8.581 -19.676 1.00 0.00 O ATOM 2376 CB GLN B 72 53.418 7.470 -17.232 1.00 0.00 C ATOM 2377 CG GLN B 72 54.828 7.938 -17.603 1.00 0.00 C ATOM 2378 CD GLN B 72 54.971 9.427 -17.283 1.00 0.00 C ATOM 2379 OE1 GLN B 72 55.029 10.249 -18.177 1.00 0.00 O ATOM 2380 NE2 GLN B 72 55.031 9.812 -16.039 1.00 0.00 N ATOM 0 H GLN B 72 54.493 5.618 -19.300 1.00 0.00 H new ATOM 0 HA GLN B 72 51.878 6.221 -18.067 1.00 0.00 H new ATOM 0 HB2 GLN B 72 52.769 8.330 -17.069 1.00 0.00 H new ATOM 0 HB3 GLN B 72 53.443 6.908 -16.298 1.00 0.00 H new ATOM 0 HG2 GLN B 72 55.571 7.363 -17.050 1.00 0.00 H new ATOM 0 HG3 GLN B 72 55.014 7.763 -18.663 1.00 0.00 H new ATOM 0 HE21 GLN B 72 54.982 9.123 -15.289 1.00 0.00 H new ATOM 0 HE22 GLN B 72 55.127 10.803 -15.816 1.00 0.00 H new ATOM 2389 N THR B 73 52.212 6.844 -20.682 1.00 0.00 N ATOM 2390 CA THR B 73 52.066 7.598 -21.958 1.00 0.00 C ATOM 2391 C THR B 73 50.572 7.782 -22.278 1.00 0.00 C ATOM 2392 O THR B 73 49.992 6.979 -22.982 1.00 0.00 O ATOM 2393 CB THR B 73 52.736 6.815 -23.090 1.00 0.00 C ATOM 2394 OG1 THR B 73 54.122 6.670 -22.807 1.00 0.00 O ATOM 2395 CG2 THR B 73 52.559 7.567 -24.408 1.00 0.00 C ATOM 0 H THR B 73 51.882 5.879 -20.708 1.00 0.00 H new ATOM 0 HA THR B 73 52.539 8.575 -21.859 1.00 0.00 H new ATOM 0 HB THR B 73 52.276 5.830 -23.173 1.00 0.00 H new ATOM 0 HG1 THR B 73 54.553 6.167 -23.530 1.00 0.00 H new ATOM 0 HG21 THR B 73 53.037 7.008 -25.213 1.00 0.00 H new ATOM 0 HG22 THR B 73 51.496 7.678 -24.624 1.00 0.00 H new ATOM 0 HG23 THR B 73 53.018 8.553 -24.329 1.00 0.00 H new ATOM 2403 N PRO B 74 49.989 8.844 -21.747 1.00 0.00 N ATOM 2404 CA PRO B 74 48.572 9.138 -21.974 1.00 0.00 C ATOM 2405 C PRO B 74 48.305 9.337 -23.469 1.00 0.00 C ATOM 2406 O PRO B 74 49.218 9.424 -24.267 1.00 0.00 O ATOM 2407 CB PRO B 74 48.305 10.442 -21.202 1.00 0.00 C ATOM 2408 CG PRO B 74 49.647 10.865 -20.524 1.00 0.00 C ATOM 2409 CD PRO B 74 50.702 9.808 -20.898 1.00 0.00 C ATOM 0 HA PRO B 74 47.925 8.327 -21.640 1.00 0.00 H new ATOM 0 HB2 PRO B 74 47.953 11.222 -21.877 1.00 0.00 H new ATOM 0 HB3 PRO B 74 47.527 10.293 -20.453 1.00 0.00 H new ATOM 0 HG2 PRO B 74 49.955 11.853 -20.865 1.00 0.00 H new ATOM 0 HG3 PRO B 74 49.529 10.924 -19.442 1.00 0.00 H new ATOM 0 HD2 PRO B 74 51.540 10.258 -21.430 1.00 0.00 H new ATOM 0 HD3 PRO B 74 51.110 9.326 -20.010 1.00 0.00 H new ATOM 2417 N LYS B 75 47.061 9.409 -23.855 1.00 0.00 N ATOM 2418 CA LYS B 75 46.737 9.602 -25.297 1.00 0.00 C ATOM 2419 C LYS B 75 45.252 9.939 -25.446 1.00 0.00 C ATOM 2420 O LYS B 75 44.488 9.850 -24.505 1.00 0.00 O ATOM 2421 CB LYS B 75 47.048 8.317 -26.065 1.00 0.00 C ATOM 2422 CG LYS B 75 46.296 7.147 -25.429 1.00 0.00 C ATOM 2423 CD LYS B 75 46.148 6.018 -26.452 1.00 0.00 C ATOM 2424 CE LYS B 75 46.180 4.669 -25.730 1.00 0.00 C ATOM 2425 NZ LYS B 75 46.412 3.581 -26.723 1.00 0.00 N ATOM 0 H LYS B 75 46.254 9.343 -23.234 1.00 0.00 H new ATOM 0 HA LYS B 75 47.336 10.419 -25.698 1.00 0.00 H new ATOM 0 HB2 LYS B 75 46.756 8.426 -27.110 1.00 0.00 H new ATOM 0 HB3 LYS B 75 48.121 8.124 -26.052 1.00 0.00 H new ATOM 0 HG2 LYS B 75 46.835 6.789 -24.552 1.00 0.00 H new ATOM 0 HG3 LYS B 75 45.314 7.474 -25.088 1.00 0.00 H new ATOM 0 HD2 LYS B 75 45.211 6.128 -26.998 1.00 0.00 H new ATOM 0 HD3 LYS B 75 46.953 6.069 -27.185 1.00 0.00 H new ATOM 0 HE2 LYS B 75 46.970 4.665 -24.979 1.00 0.00 H new ATOM 0 HE3 LYS B 75 45.239 4.503 -25.205 1.00 0.00 H new ATOM 0 HZ1 LYS B 75 46.434 2.663 -26.234 1.00 0.00 H new ATOM 0 HZ2 LYS B 75 45.644 3.581 -27.424 1.00 0.00 H new ATOM 0 HZ3 LYS B 75 47.320 3.738 -27.205 1.00 0.00 H new ATOM 2439 N THR B 76 44.836 10.324 -26.622 1.00 0.00 N ATOM 2440 CA THR B 76 43.401 10.664 -26.829 1.00 0.00 C ATOM 2441 C THR B 76 42.680 9.472 -27.461 1.00 0.00 C ATOM 2442 O THR B 76 42.867 9.251 -28.647 1.00 0.00 O ATOM 2443 CB THR B 76 43.294 11.875 -27.759 1.00 0.00 C ATOM 2444 OG1 THR B 76 44.403 11.890 -28.646 1.00 0.00 O ATOM 2445 CG2 THR B 76 43.286 13.159 -26.927 1.00 0.00 C ATOM 2446 OXT THR B 76 41.954 8.798 -26.748 1.00 0.00 O ATOM 0 H THR B 76 45.428 10.417 -27.447 1.00 0.00 H new ATOM 0 HA THR B 76 42.941 10.900 -25.869 1.00 0.00 H new ATOM 0 HB THR B 76 42.370 11.811 -28.334 1.00 0.00 H new ATOM 0 HG1 THR B 76 44.334 12.664 -29.243 1.00 0.00 H new ATOM 0 HG21 THR B 76 43.210 14.021 -27.589 1.00 0.00 H new ATOM 0 HG22 THR B 76 42.434 13.147 -26.248 1.00 0.00 H new ATOM 0 HG23 THR B 76 44.209 13.225 -26.351 1.00 0.00 H new TER 2454 THR B 76