USER MOD reduce.3.24.130724 H: found=0, std=0, add=1240, rem=0, adj=38 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: B 61 GLN : amide:sc= -0.268 K(o=-10,f=-15) USER MOD Set 1.2: B 64 MET CE :methyl -109:sc= -9.83! (180deg=-11.6!) USER MOD Set 2.1: A 61 GLN : amide:sc= -0.139 K(o=-10,f=-15) USER MOD Set 2.2: A 64 MET CE :methyl -105:sc= -10! (180deg=-11.6!) USER MOD Single : A 1 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 1 GLN N :NH3+ -129:sc= -2.75! (180deg=-6.18!) USER MOD Single : A 6 ASN : amide:sc= -4.93 K(o=-4.9,f=-3.9!) USER MOD Single : A 10 THR OG1 : rot 180:sc= 0.0376 USER MOD Single : A 13 TYR OH : rot 130:sc= -1.76! USER MOD Single : A 14 ASN : amide:sc= -5.33! C(o=-5.3!,f=-3.6!) USER MOD Single : A 16 THR OG1 : rot -78:sc= -0.784 USER MOD Single : A 17 ASN : amide:sc= -1.24 K(o=-1.2,f=-4.1!) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 23 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 27 SER OG : rot 180:sc= -1.34 USER MOD Single : A 28 TYR OH : rot 30:sc= -0.0857 USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 33 SER OG : rot 170:sc= -0.129 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ 160:sc= 0 (180deg=-0.447) USER MOD Single : A 38 LYS NZ :NH3+ 158:sc= -0.0346 (180deg=-0.532) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 THR OG1 : rot -90:sc= -0.82 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 : amide:sc= -0.74 K(o=-0.74,f=-3!) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 SER OG : rot -180:sc= 0.28 USER MOD Single : A 66 HIS : no HE2:sc= -37.1! C(o=-37!,f=-38!) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 GLN : amide:sc= -2.16! C(o=-2.2!,f=-2.3!) USER MOD Single : A 71 THR OG1 : rot -45:sc= 1.13 USER MOD Single : A 72 GLN : amide:sc= -0.0618 K(o=-0.062,f=-0.58) 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 -11:sc= 1.06 USER MOD Single : B 1 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 1 GLN N :NH3+ -135:sc= -3.02! (180deg=-6.42!) USER MOD Single : B 6 ASN : amide:sc= -4.93 K(o=-4.9,f=-3.9!) USER MOD Single : B 10 THR OG1 : rot 180:sc= 0.0442 USER MOD Single : B 13 TYR OH : rot 150:sc= -1.84! USER MOD Single : B 14 ASN : amide:sc= -5.43! C(o=-5.4!,f=-3.7!) USER MOD Single : B 16 THR OG1 : rot -76:sc= -0.707 USER MOD Single : B 17 ASN : amide:sc= -1.2 K(o=-1.2,f=-4!) USER MOD Single : B 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 21 SER OG : rot 180:sc= 0 USER MOD Single : B 23 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 27 SER OG : rot 180:sc= -1.34 USER MOD Single : B 28 TYR OH : rot 30:sc= -0.0897 USER MOD Single : B 32 THR OG1 : rot 180:sc= 0 USER MOD Single : B 33 SER OG : rot 170:sc= -0.083 USER MOD Single : B 34 SER OG : rot 180:sc= 0 USER MOD Single : B 35 LYS NZ :NH3+ 160:sc=-0.00134 (180deg=-0.434) USER MOD Single : B 38 LYS NZ :NH3+ 158:sc= -0.0655 (180deg=-0.534) USER MOD Single : B 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 45 THR OG1 : rot -89:sc= -0.765 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 : amide:sc= -0.867 K(o=-0.87,f=-3.1!) USER MOD Single : B 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 63 SER OG : rot 178:sc= 0.339 USER MOD Single : B 66 HIS : no HE2:sc= -37.6! C(o=-38!,f=-39!) USER MOD Single : B 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 70 GLN : amide:sc= -2.1! C(o=-2.1!,f=-2.3!) USER MOD Single : B 71 THR OG1 : rot -51:sc= 1.2 USER MOD Single : B 72 GLN : amide:sc= -0.0666 K(o=-0.067,f=-0.69) 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 -5:sc= 1.07 USER MOD ----------------------------------------------------------------- ATOM 1 N GLN A 1 66.221 -22.484 -4.297 1.00 0.00 N ATOM 2 CA GLN A 1 64.758 -22.312 -4.057 1.00 0.00 C ATOM 3 C GLN A 1 64.372 -20.825 -4.200 1.00 0.00 C ATOM 4 O GLN A 1 63.507 -20.495 -4.987 1.00 0.00 O ATOM 5 CB GLN A 1 64.402 -22.806 -2.651 1.00 0.00 C ATOM 6 CG GLN A 1 63.356 -23.917 -2.747 1.00 0.00 C ATOM 7 CD GLN A 1 64.011 -25.264 -2.434 1.00 0.00 C ATOM 8 OE1 GLN A 1 64.604 -25.880 -3.297 1.00 0.00 O ATOM 9 NE2 GLN A 1 63.930 -25.749 -1.226 1.00 0.00 N ATOM 0 H1 GLN A 1 66.372 -23.237 -4.998 1.00 0.00 H new ATOM 0 H2 GLN A 1 66.621 -21.593 -4.654 1.00 0.00 H new ATOM 0 H3 GLN A 1 66.691 -22.742 -3.406 1.00 0.00 H new ATOM 0 HA GLN A 1 64.206 -22.896 -4.794 1.00 0.00 H new ATOM 0 HB2 GLN A 1 65.295 -23.176 -2.148 1.00 0.00 H new ATOM 0 HB3 GLN A 1 64.017 -21.981 -2.051 1.00 0.00 H new ATOM 0 HG2 GLN A 1 62.542 -23.726 -2.048 1.00 0.00 H new ATOM 0 HG3 GLN A 1 62.921 -23.936 -3.746 1.00 0.00 H new ATOM 0 HE21 GLN A 1 63.432 -25.232 -0.501 1.00 0.00 H new ATOM 0 HE22 GLN A 1 64.364 -26.645 -1.006 1.00 0.00 H new ATOM 20 N PRO A 2 65.023 -19.962 -3.430 1.00 0.00 N ATOM 21 CA PRO A 2 64.735 -18.526 -3.481 1.00 0.00 C ATOM 22 C PRO A 2 65.036 -17.972 -4.876 1.00 0.00 C ATOM 23 O PRO A 2 66.143 -17.565 -5.168 1.00 0.00 O ATOM 24 CB PRO A 2 65.673 -17.891 -2.439 1.00 0.00 C ATOM 25 CG PRO A 2 66.512 -19.043 -1.804 1.00 0.00 C ATOM 26 CD PRO A 2 66.070 -20.356 -2.474 1.00 0.00 C ATOM 0 HA PRO A 2 63.687 -18.311 -3.273 1.00 0.00 H new ATOM 0 HB2 PRO A 2 66.325 -17.154 -2.908 1.00 0.00 H new ATOM 0 HB3 PRO A 2 65.099 -17.367 -1.674 1.00 0.00 H new ATOM 0 HG2 PRO A 2 67.577 -18.873 -1.959 1.00 0.00 H new ATOM 0 HG3 PRO A 2 66.350 -19.088 -0.727 1.00 0.00 H new ATOM 0 HD2 PRO A 2 66.904 -20.841 -2.980 1.00 0.00 H new ATOM 0 HD3 PRO A 2 65.687 -21.065 -1.739 1.00 0.00 H new ATOM 34 N ASP A 3 64.058 -17.952 -5.742 1.00 0.00 N ATOM 35 CA ASP A 3 64.286 -17.425 -7.108 1.00 0.00 C ATOM 36 C ASP A 3 64.030 -15.917 -7.125 1.00 0.00 C ATOM 37 O ASP A 3 63.321 -15.405 -7.967 1.00 0.00 O ATOM 38 CB ASP A 3 63.339 -18.115 -8.089 1.00 0.00 C ATOM 39 CG ASP A 3 63.788 -19.561 -8.302 1.00 0.00 C ATOM 40 OD1 ASP A 3 64.118 -20.209 -7.321 1.00 0.00 O ATOM 41 OD2 ASP A 3 63.794 -19.998 -9.440 1.00 0.00 O ATOM 0 H ASP A 3 63.110 -18.280 -5.556 1.00 0.00 H new ATOM 0 HA ASP A 3 65.317 -17.621 -7.403 1.00 0.00 H new ATOM 0 HB2 ASP A 3 62.320 -18.093 -7.703 1.00 0.00 H new ATOM 0 HB3 ASP A 3 63.332 -17.582 -9.040 1.00 0.00 H new ATOM 46 N ALA A 4 64.607 -15.205 -6.200 1.00 0.00 N ATOM 47 CA ALA A 4 64.408 -13.730 -6.153 1.00 0.00 C ATOM 48 C ALA A 4 65.409 -13.126 -5.173 1.00 0.00 C ATOM 49 O ALA A 4 65.048 -12.644 -4.119 1.00 0.00 O ATOM 50 CB ALA A 4 62.985 -13.416 -5.689 1.00 0.00 C ATOM 0 H ALA A 4 65.211 -15.583 -5.470 1.00 0.00 H new ATOM 0 HA ALA A 4 64.561 -13.307 -7.146 1.00 0.00 H new ATOM 0 HB1 ALA A 4 62.843 -12.336 -5.656 1.00 0.00 H new ATOM 0 HB2 ALA A 4 62.270 -13.855 -6.385 1.00 0.00 H new ATOM 0 HB3 ALA A 4 62.826 -13.833 -4.695 1.00 0.00 H new ATOM 56 N ILE A 5 66.666 -13.162 -5.508 1.00 0.00 N ATOM 57 CA ILE A 5 67.694 -12.606 -4.593 1.00 0.00 C ATOM 58 C ILE A 5 68.029 -11.171 -4.998 1.00 0.00 C ATOM 59 O ILE A 5 68.615 -10.425 -4.238 1.00 0.00 O ATOM 60 CB ILE A 5 68.951 -13.466 -4.663 1.00 0.00 C ATOM 61 CG1 ILE A 5 68.658 -14.843 -4.072 1.00 0.00 C ATOM 62 CG2 ILE A 5 70.065 -12.799 -3.866 1.00 0.00 C ATOM 63 CD1 ILE A 5 69.165 -15.921 -5.026 1.00 0.00 C ATOM 0 H ILE A 5 67.026 -13.554 -6.378 1.00 0.00 H new ATOM 0 HA ILE A 5 67.308 -12.606 -3.574 1.00 0.00 H new ATOM 0 HB ILE A 5 69.261 -13.575 -5.702 1.00 0.00 H new ATOM 0 HG12 ILE A 5 69.142 -14.945 -3.100 1.00 0.00 H new ATOM 0 HG13 ILE A 5 67.587 -14.961 -3.909 1.00 0.00 H new ATOM 0 HG21 ILE A 5 70.965 -13.412 -3.915 1.00 0.00 H new ATOM 0 HG22 ILE A 5 70.274 -11.815 -4.286 1.00 0.00 H new ATOM 0 HG23 ILE A 5 69.755 -12.692 -2.827 1.00 0.00 H new ATOM 0 HD11 ILE A 5 68.957 -16.905 -4.606 1.00 0.00 H new ATOM 0 HD12 ILE A 5 68.661 -15.822 -5.987 1.00 0.00 H new ATOM 0 HD13 ILE A 5 70.240 -15.806 -5.167 1.00 0.00 H new ATOM 75 N ASN A 6 67.638 -10.767 -6.166 1.00 0.00 N ATOM 76 CA ASN A 6 67.907 -9.366 -6.582 1.00 0.00 C ATOM 77 C ASN A 6 66.731 -8.523 -6.128 1.00 0.00 C ATOM 78 O ASN A 6 66.011 -7.968 -6.920 1.00 0.00 O ATOM 79 CB ASN A 6 68.068 -9.234 -8.122 1.00 0.00 C ATOM 80 CG ASN A 6 67.876 -10.584 -8.831 1.00 0.00 C ATOM 81 OD1 ASN A 6 68.826 -11.177 -9.301 1.00 0.00 O ATOM 82 ND2 ASN A 6 66.677 -11.094 -8.923 1.00 0.00 N ATOM 0 H ASN A 6 67.146 -11.341 -6.850 1.00 0.00 H new ATOM 0 HA ASN A 6 68.842 -9.035 -6.131 1.00 0.00 H new ATOM 0 HB2 ASN A 6 67.342 -8.516 -8.504 1.00 0.00 H new ATOM 0 HB3 ASN A 6 69.058 -8.840 -8.352 1.00 0.00 H new ATOM 0 HD21 ASN A 6 66.538 -11.990 -9.390 1.00 0.00 H new ATOM 0 HD22 ASN A 6 65.879 -10.596 -8.528 1.00 0.00 H new ATOM 89 N ALA A 7 66.494 -8.481 -4.854 1.00 0.00 N ATOM 90 CA ALA A 7 65.329 -7.720 -4.343 1.00 0.00 C ATOM 91 C ALA A 7 65.787 -6.444 -3.631 1.00 0.00 C ATOM 92 O ALA A 7 66.727 -6.479 -2.863 1.00 0.00 O ATOM 93 CB ALA A 7 64.576 -8.570 -3.324 1.00 0.00 C ATOM 0 H ALA A 7 67.059 -8.942 -4.141 1.00 0.00 H new ATOM 0 HA ALA A 7 64.693 -7.465 -5.191 1.00 0.00 H new ATOM 0 HB1 ALA A 7 63.719 -8.012 -2.947 1.00 0.00 H new ATOM 0 HB2 ALA A 7 64.231 -9.488 -3.800 1.00 0.00 H new ATOM 0 HB3 ALA A 7 65.240 -8.818 -2.496 1.00 0.00 H new ATOM 99 N PRO A 8 65.043 -5.368 -3.826 1.00 0.00 N ATOM 100 CA PRO A 8 65.309 -4.137 -3.114 1.00 0.00 C ATOM 101 C PRO A 8 64.972 -4.380 -1.658 1.00 0.00 C ATOM 102 O PRO A 8 63.817 -4.445 -1.282 1.00 0.00 O ATOM 103 CB PRO A 8 64.361 -3.101 -3.717 1.00 0.00 C ATOM 104 CG PRO A 8 63.442 -3.857 -4.727 1.00 0.00 C ATOM 105 CD PRO A 8 63.919 -5.317 -4.766 1.00 0.00 C ATOM 0 HA PRO A 8 66.343 -3.801 -3.189 1.00 0.00 H new ATOM 0 HB2 PRO A 8 63.767 -2.623 -2.938 1.00 0.00 H new ATOM 0 HB3 PRO A 8 64.921 -2.313 -4.220 1.00 0.00 H new ATOM 0 HG2 PRO A 8 62.399 -3.801 -4.415 1.00 0.00 H new ATOM 0 HG3 PRO A 8 63.504 -3.405 -5.717 1.00 0.00 H new ATOM 0 HD2 PRO A 8 63.124 -6.001 -4.470 1.00 0.00 H new ATOM 0 HD3 PRO A 8 64.230 -5.605 -5.770 1.00 0.00 H new ATOM 113 N VAL A 9 65.950 -4.602 -0.852 1.00 0.00 N ATOM 114 CA VAL A 9 65.676 -4.942 0.552 1.00 0.00 C ATOM 115 C VAL A 9 65.534 -3.656 1.380 1.00 0.00 C ATOM 116 O VAL A 9 66.501 -3.065 1.815 1.00 0.00 O ATOM 117 CB VAL A 9 66.843 -5.769 1.056 1.00 0.00 C ATOM 118 CG1 VAL A 9 68.105 -4.946 0.934 1.00 0.00 C ATOM 119 CG2 VAL A 9 66.613 -6.169 2.502 1.00 0.00 C ATOM 0 H VAL A 9 66.937 -4.563 -1.107 1.00 0.00 H new ATOM 0 HA VAL A 9 64.747 -5.505 0.642 1.00 0.00 H new ATOM 0 HB VAL A 9 66.938 -6.678 0.462 1.00 0.00 H new ATOM 0 HG11 VAL A 9 68.954 -5.527 1.293 1.00 0.00 H new ATOM 0 HG12 VAL A 9 68.264 -4.677 -0.110 1.00 0.00 H new ATOM 0 HG13 VAL A 9 68.007 -4.039 1.531 1.00 0.00 H new ATOM 0 HG21 VAL A 9 67.457 -6.762 2.854 1.00 0.00 H new ATOM 0 HG22 VAL A 9 66.518 -5.274 3.116 1.00 0.00 H new ATOM 0 HG23 VAL A 9 65.699 -6.758 2.575 1.00 0.00 H new ATOM 129 N THR A 10 64.327 -3.215 1.593 1.00 0.00 N ATOM 130 CA THR A 10 64.121 -1.970 2.378 1.00 0.00 C ATOM 131 C THR A 10 64.701 -2.146 3.781 1.00 0.00 C ATOM 132 O THR A 10 64.186 -2.896 4.586 1.00 0.00 O ATOM 133 CB THR A 10 62.625 -1.671 2.480 1.00 0.00 C ATOM 134 OG1 THR A 10 61.974 -2.110 1.295 1.00 0.00 O ATOM 135 CG2 THR A 10 62.415 -0.166 2.650 1.00 0.00 C ATOM 0 H THR A 10 63.475 -3.664 1.257 1.00 0.00 H new ATOM 0 HA THR A 10 64.624 -1.142 1.879 1.00 0.00 H new ATOM 0 HB THR A 10 62.207 -2.194 3.340 1.00 0.00 H new ATOM 0 HG1 THR A 10 61.015 -1.921 1.359 1.00 0.00 H new ATOM 0 HG21 THR A 10 61.348 0.047 2.723 1.00 0.00 H new ATOM 0 HG22 THR A 10 62.915 0.171 3.558 1.00 0.00 H new ATOM 0 HG23 THR A 10 62.832 0.359 1.790 1.00 0.00 H new ATOM 143 N CYS A 11 65.767 -1.454 4.085 1.00 0.00 N ATOM 144 CA CYS A 11 66.368 -1.575 5.443 1.00 0.00 C ATOM 145 C CYS A 11 66.668 -0.180 5.991 1.00 0.00 C ATOM 146 O CYS A 11 66.159 0.811 5.505 1.00 0.00 O ATOM 147 CB CYS A 11 67.668 -2.379 5.374 1.00 0.00 C ATOM 148 SG CYS A 11 67.407 -3.868 4.384 1.00 0.00 S ATOM 0 H CYS A 11 66.246 -0.812 3.453 1.00 0.00 H new ATOM 0 HA CYS A 11 65.664 -2.088 6.098 1.00 0.00 H new ATOM 0 HB2 CYS A 11 68.460 -1.772 4.935 1.00 0.00 H new ATOM 0 HB3 CYS A 11 67.994 -2.650 6.378 1.00 0.00 H new ATOM 153 N CYS A 12 67.483 -0.095 7.004 1.00 0.00 N ATOM 154 CA CYS A 12 67.808 1.240 7.592 1.00 0.00 C ATOM 155 C CYS A 12 69.312 1.335 7.858 1.00 0.00 C ATOM 156 O CYS A 12 70.059 0.406 7.619 1.00 0.00 O ATOM 157 CB CYS A 12 67.074 1.418 8.930 1.00 0.00 C ATOM 158 SG CYS A 12 65.447 0.636 8.863 1.00 0.00 S ATOM 0 H CYS A 12 67.939 -0.890 7.452 1.00 0.00 H new ATOM 0 HA CYS A 12 67.497 2.013 6.889 1.00 0.00 H new ATOM 0 HB2 CYS A 12 67.662 0.980 9.736 1.00 0.00 H new ATOM 0 HB3 CYS A 12 66.966 2.479 9.155 1.00 0.00 H new ATOM 163 N TYR A 13 69.747 2.440 8.398 1.00 0.00 N ATOM 164 CA TYR A 13 71.192 2.596 8.743 1.00 0.00 C ATOM 165 C TYR A 13 71.299 3.193 10.151 1.00 0.00 C ATOM 166 O TYR A 13 72.153 2.823 10.931 1.00 0.00 O ATOM 167 CB TYR A 13 71.875 3.525 7.736 1.00 0.00 C ATOM 168 CG TYR A 13 72.016 2.814 6.409 1.00 0.00 C ATOM 169 CD1 TYR A 13 72.419 1.465 6.377 1.00 0.00 C ATOM 170 CD2 TYR A 13 71.760 3.502 5.199 1.00 0.00 C ATOM 171 CE1 TYR A 13 72.563 0.800 5.141 1.00 0.00 C ATOM 172 CE2 TYR A 13 71.908 2.837 3.964 1.00 0.00 C ATOM 173 CZ TYR A 13 72.310 1.487 3.934 1.00 0.00 C ATOM 174 OH TYR A 13 72.453 0.837 2.727 1.00 0.00 O ATOM 0 H TYR A 13 69.162 3.247 8.617 1.00 0.00 H new ATOM 0 HA TYR A 13 71.684 1.624 8.711 1.00 0.00 H new ATOM 0 HB2 TYR A 13 71.291 4.437 7.612 1.00 0.00 H new ATOM 0 HB3 TYR A 13 72.856 3.823 8.107 1.00 0.00 H new ATOM 0 HD1 TYR A 13 72.618 0.939 7.299 1.00 0.00 H new ATOM 0 HD2 TYR A 13 71.451 4.537 5.221 1.00 0.00 H new ATOM 0 HE1 TYR A 13 72.867 -0.236 5.118 1.00 0.00 H new ATOM 0 HE2 TYR A 13 71.713 3.363 3.041 1.00 0.00 H new ATOM 0 HH TYR A 13 71.650 0.977 2.183 1.00 0.00 H new ATOM 184 N ASN A 14 70.414 4.096 10.489 1.00 0.00 N ATOM 185 CA ASN A 14 70.430 4.698 11.848 1.00 0.00 C ATOM 186 C ASN A 14 69.054 4.495 12.482 1.00 0.00 C ATOM 187 O ASN A 14 68.195 3.857 11.909 1.00 0.00 O ATOM 188 CB ASN A 14 70.735 6.193 11.743 1.00 0.00 C ATOM 189 CG ASN A 14 72.076 6.391 11.040 1.00 0.00 C ATOM 190 OD1 ASN A 14 73.120 6.244 11.643 1.00 0.00 O ATOM 191 ND2 ASN A 14 72.094 6.720 9.778 1.00 0.00 N ATOM 0 H ASN A 14 69.677 4.442 9.874 1.00 0.00 H new ATOM 0 HA ASN A 14 71.197 4.224 12.460 1.00 0.00 H new ATOM 0 HB2 ASN A 14 69.944 6.698 11.189 1.00 0.00 H new ATOM 0 HB3 ASN A 14 70.764 6.640 12.737 1.00 0.00 H new ATOM 0 HD21 ASN A 14 72.984 6.854 9.298 1.00 0.00 H new ATOM 0 HD22 ASN A 14 71.218 6.844 9.271 1.00 0.00 H new ATOM 198 N PHE A 15 68.829 5.023 13.653 1.00 0.00 N ATOM 199 CA PHE A 15 67.496 4.832 14.293 1.00 0.00 C ATOM 200 C PHE A 15 67.153 6.033 15.180 1.00 0.00 C ATOM 201 O PHE A 15 67.847 6.331 16.131 1.00 0.00 O ATOM 202 CB PHE A 15 67.516 3.560 15.147 1.00 0.00 C ATOM 203 CG PHE A 15 67.799 2.364 14.269 1.00 0.00 C ATOM 204 CD1 PHE A 15 66.877 1.988 13.267 1.00 0.00 C ATOM 205 CD2 PHE A 15 68.987 1.620 14.449 1.00 0.00 C ATOM 206 CE1 PHE A 15 67.139 0.868 12.448 1.00 0.00 C ATOM 207 CE2 PHE A 15 69.251 0.500 13.629 1.00 0.00 C ATOM 208 CZ PHE A 15 68.326 0.123 12.628 1.00 0.00 C ATOM 0 H PHE A 15 69.501 5.572 14.190 1.00 0.00 H new ATOM 0 HA PHE A 15 66.741 4.742 13.512 1.00 0.00 H new ATOM 0 HB2 PHE A 15 68.277 3.643 15.923 1.00 0.00 H new ATOM 0 HB3 PHE A 15 66.559 3.434 15.652 1.00 0.00 H new ATOM 0 HD1 PHE A 15 65.970 2.558 13.127 1.00 0.00 H new ATOM 0 HD2 PHE A 15 69.693 1.908 15.214 1.00 0.00 H new ATOM 0 HE1 PHE A 15 66.432 0.581 11.684 1.00 0.00 H new ATOM 0 HE2 PHE A 15 70.159 -0.068 13.767 1.00 0.00 H new ATOM 0 HZ PHE A 15 68.527 -0.734 12.002 1.00 0.00 H new ATOM 218 N THR A 16 66.058 6.708 14.896 1.00 0.00 N ATOM 219 CA THR A 16 65.647 7.874 15.760 1.00 0.00 C ATOM 220 C THR A 16 65.682 7.431 17.225 1.00 0.00 C ATOM 221 O THR A 16 64.791 6.760 17.693 1.00 0.00 O ATOM 222 CB THR A 16 64.211 8.344 15.406 1.00 0.00 C ATOM 223 OG1 THR A 16 63.586 8.874 16.568 1.00 0.00 O ATOM 224 CG2 THR A 16 63.380 7.170 14.880 1.00 0.00 C ATOM 0 H THR A 16 65.436 6.507 14.113 1.00 0.00 H new ATOM 0 HA THR A 16 66.334 8.703 15.590 1.00 0.00 H new ATOM 0 HB THR A 16 64.274 9.111 14.634 1.00 0.00 H new ATOM 0 HG1 THR A 16 63.279 8.139 17.138 1.00 0.00 H new ATOM 0 HG21 THR A 16 62.375 7.516 14.636 1.00 0.00 H new ATOM 0 HG22 THR A 16 63.851 6.763 13.985 1.00 0.00 H new ATOM 0 HG23 THR A 16 63.321 6.395 15.644 1.00 0.00 H new ATOM 232 N ASN A 17 66.709 7.776 17.945 1.00 0.00 N ATOM 233 CA ASN A 17 66.782 7.340 19.368 1.00 0.00 C ATOM 234 C ASN A 17 66.182 8.415 20.274 1.00 0.00 C ATOM 235 O ASN A 17 66.348 8.384 21.478 1.00 0.00 O ATOM 236 CB ASN A 17 68.242 7.098 19.756 1.00 0.00 C ATOM 237 CG ASN A 17 68.303 6.501 21.163 1.00 0.00 C ATOM 238 OD1 ASN A 17 67.292 6.115 21.716 1.00 0.00 O ATOM 239 ND2 ASN A 17 69.455 6.407 21.770 1.00 0.00 N ATOM 0 H ASN A 17 67.496 8.336 17.616 1.00 0.00 H new ATOM 0 HA ASN A 17 66.216 6.416 19.488 1.00 0.00 H new ATOM 0 HB2 ASN A 17 68.712 6.422 19.042 1.00 0.00 H new ATOM 0 HB3 ASN A 17 68.799 8.035 19.722 1.00 0.00 H new ATOM 0 HD21 ASN A 17 69.506 6.010 22.708 1.00 0.00 H new ATOM 0 HD22 ASN A 17 70.304 6.731 21.306 1.00 0.00 H new ATOM 246 N ARG A 18 65.465 9.346 19.716 1.00 0.00 N ATOM 247 CA ARG A 18 64.834 10.396 20.557 1.00 0.00 C ATOM 248 C ARG A 18 63.358 10.060 20.728 1.00 0.00 C ATOM 249 O ARG A 18 62.693 9.672 19.792 1.00 0.00 O ATOM 250 CB ARG A 18 64.975 11.757 19.875 1.00 0.00 C ATOM 251 CG ARG A 18 66.255 12.440 20.358 1.00 0.00 C ATOM 252 CD ARG A 18 66.080 13.958 20.295 1.00 0.00 C ATOM 253 NE ARG A 18 65.109 14.391 21.345 1.00 0.00 N ATOM 254 CZ ARG A 18 64.579 15.594 21.309 1.00 0.00 C ATOM 255 NH1 ARG A 18 64.894 16.436 20.355 1.00 0.00 N ATOM 256 NH2 ARG A 18 63.731 15.954 22.234 1.00 0.00 N ATOM 0 H ARG A 18 65.289 9.425 18.715 1.00 0.00 H new ATOM 0 HA ARG A 18 65.323 10.436 21.530 1.00 0.00 H new ATOM 0 HB2 ARG A 18 65.003 11.632 18.793 1.00 0.00 H new ATOM 0 HB3 ARG A 18 64.110 12.380 20.101 1.00 0.00 H new ATOM 0 HG2 ARG A 18 66.481 12.132 21.379 1.00 0.00 H new ATOM 0 HG3 ARG A 18 67.098 12.135 19.739 1.00 0.00 H new ATOM 0 HD2 ARG A 18 67.040 14.452 20.446 1.00 0.00 H new ATOM 0 HD3 ARG A 18 65.721 14.253 19.309 1.00 0.00 H new ATOM 0 HE ARG A 18 64.855 13.749 22.095 1.00 0.00 H new ATOM 0 HH11 ARG A 18 65.557 16.161 19.630 1.00 0.00 H new ATOM 0 HH12 ARG A 18 64.476 17.366 20.338 1.00 0.00 H new ATOM 0 HH21 ARG A 18 63.483 15.303 22.979 1.00 0.00 H new ATOM 0 HH22 ARG A 18 63.317 16.886 22.211 1.00 0.00 H new ATOM 270 N LYS A 19 62.839 10.190 21.918 1.00 0.00 N ATOM 271 CA LYS A 19 61.402 9.862 22.140 1.00 0.00 C ATOM 272 C LYS A 19 60.542 10.656 21.159 1.00 0.00 C ATOM 273 O LYS A 19 60.157 11.779 21.419 1.00 0.00 O ATOM 274 CB LYS A 19 61.007 10.219 23.574 1.00 0.00 C ATOM 275 CG LYS A 19 61.988 9.569 24.552 1.00 0.00 C ATOM 276 CD LYS A 19 61.315 9.408 25.917 1.00 0.00 C ATOM 277 CE LYS A 19 62.152 8.472 26.791 1.00 0.00 C ATOM 278 NZ LYS A 19 62.572 9.189 28.029 1.00 0.00 N ATOM 0 H LYS A 19 63.346 10.508 22.744 1.00 0.00 H new ATOM 0 HA LYS A 19 61.246 8.795 21.980 1.00 0.00 H new ATOM 0 HB2 LYS A 19 61.011 11.301 23.705 1.00 0.00 H new ATOM 0 HB3 LYS A 19 59.993 9.877 23.779 1.00 0.00 H new ATOM 0 HG2 LYS A 19 62.305 8.597 24.174 1.00 0.00 H new ATOM 0 HG3 LYS A 19 62.884 10.182 24.646 1.00 0.00 H new ATOM 0 HD2 LYS A 19 61.212 10.379 26.401 1.00 0.00 H new ATOM 0 HD3 LYS A 19 60.310 9.005 25.794 1.00 0.00 H new ATOM 0 HE2 LYS A 19 61.573 7.585 27.050 1.00 0.00 H new ATOM 0 HE3 LYS A 19 63.029 8.131 26.241 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 63.141 8.552 28.623 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 63.139 10.022 27.772 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 61.729 9.493 28.557 1.00 0.00 H new ATOM 292 N ILE A 20 60.246 10.081 20.032 1.00 0.00 N ATOM 293 CA ILE A 20 59.424 10.785 19.028 1.00 0.00 C ATOM 294 C ILE A 20 57.965 10.754 19.465 1.00 0.00 C ATOM 295 O ILE A 20 57.355 9.711 19.596 1.00 0.00 O ATOM 296 CB ILE A 20 59.601 10.108 17.665 1.00 0.00 C ATOM 297 CG1 ILE A 20 60.991 10.490 17.107 1.00 0.00 C ATOM 298 CG2 ILE A 20 58.494 10.569 16.699 1.00 0.00 C ATOM 299 CD1 ILE A 20 60.948 10.566 15.580 1.00 0.00 C ATOM 0 H ILE A 20 60.544 9.143 19.765 1.00 0.00 H new ATOM 0 HA ILE A 20 59.740 11.825 18.942 1.00 0.00 H new ATOM 0 HB ILE A 20 59.530 9.026 17.773 1.00 0.00 H new ATOM 0 HG12 ILE A 20 61.303 11.450 17.517 1.00 0.00 H new ATOM 0 HG13 ILE A 20 61.731 9.754 17.420 1.00 0.00 H new ATOM 0 HG21 ILE A 20 58.628 10.082 15.733 1.00 0.00 H new ATOM 0 HG22 ILE A 20 57.520 10.301 17.108 1.00 0.00 H new ATOM 0 HG23 ILE A 20 58.549 11.650 16.572 1.00 0.00 H new ATOM 0 HD11 ILE A 20 61.934 10.836 15.201 1.00 0.00 H new ATOM 0 HD12 ILE A 20 60.657 9.597 15.176 1.00 0.00 H new ATOM 0 HD13 ILE A 20 60.223 11.320 15.273 1.00 0.00 H new ATOM 311 N SER A 21 57.422 11.897 19.707 1.00 0.00 N ATOM 312 CA SER A 21 56.009 12.000 20.159 1.00 0.00 C ATOM 313 C SER A 21 55.093 11.101 19.318 1.00 0.00 C ATOM 314 O SER A 21 55.088 11.160 18.105 1.00 0.00 O ATOM 315 CB SER A 21 55.562 13.447 20.004 1.00 0.00 C ATOM 316 OG SER A 21 54.599 13.757 21.003 1.00 0.00 O ATOM 0 H SER A 21 57.903 12.791 19.611 1.00 0.00 H new ATOM 0 HA SER A 21 55.944 11.678 21.198 1.00 0.00 H new ATOM 0 HB2 SER A 21 56.419 14.115 20.091 1.00 0.00 H new ATOM 0 HB3 SER A 21 55.136 13.603 19.013 1.00 0.00 H new ATOM 0 HG SER A 21 54.313 14.689 20.904 1.00 0.00 H new ATOM 322 N VAL A 22 54.286 10.297 19.965 1.00 0.00 N ATOM 323 CA VAL A 22 53.331 9.425 19.228 1.00 0.00 C ATOM 324 C VAL A 22 52.510 10.278 18.242 1.00 0.00 C ATOM 325 O VAL A 22 51.952 9.773 17.288 1.00 0.00 O ATOM 326 CB VAL A 22 52.388 8.727 20.252 1.00 0.00 C ATOM 327 CG1 VAL A 22 52.089 9.669 21.419 1.00 0.00 C ATOM 328 CG2 VAL A 22 51.050 8.341 19.587 1.00 0.00 C ATOM 0 H VAL A 22 54.251 10.210 20.981 1.00 0.00 H new ATOM 0 HA VAL A 22 53.876 8.667 18.666 1.00 0.00 H new ATOM 0 HB VAL A 22 52.892 7.829 20.611 1.00 0.00 H new ATOM 0 HG11 VAL A 22 51.429 9.171 22.129 1.00 0.00 H new ATOM 0 HG12 VAL A 22 53.020 9.938 21.917 1.00 0.00 H new ATOM 0 HG13 VAL A 22 51.604 10.570 21.044 1.00 0.00 H new ATOM 0 HG21 VAL A 22 50.406 7.855 20.320 1.00 0.00 H new ATOM 0 HG22 VAL A 22 50.558 9.238 19.211 1.00 0.00 H new ATOM 0 HG23 VAL A 22 51.239 7.657 18.760 1.00 0.00 H new ATOM 338 N GLN A 23 52.433 11.559 18.468 1.00 0.00 N ATOM 339 CA GLN A 23 51.661 12.424 17.567 1.00 0.00 C ATOM 340 C GLN A 23 52.388 12.506 16.229 1.00 0.00 C ATOM 341 O GLN A 23 51.797 12.374 15.176 1.00 0.00 O ATOM 342 CB GLN A 23 51.518 13.824 18.216 1.00 0.00 C ATOM 343 CG GLN A 23 52.141 14.922 17.336 1.00 0.00 C ATOM 344 CD GLN A 23 51.788 16.297 17.907 1.00 0.00 C ATOM 345 OE1 GLN A 23 51.123 17.083 17.264 1.00 0.00 O ATOM 346 NE2 GLN A 23 52.212 16.622 19.098 1.00 0.00 N ATOM 0 H GLN A 23 52.880 12.038 19.249 1.00 0.00 H new ATOM 0 HA GLN A 23 50.663 12.020 17.397 1.00 0.00 H new ATOM 0 HB2 GLN A 23 50.463 14.044 18.380 1.00 0.00 H new ATOM 0 HB3 GLN A 23 52.000 13.823 19.194 1.00 0.00 H new ATOM 0 HG2 GLN A 23 53.223 14.800 17.296 1.00 0.00 H new ATOM 0 HG3 GLN A 23 51.773 14.836 16.314 1.00 0.00 H new ATOM 0 HE21 GLN A 23 52.771 15.961 19.638 1.00 0.00 H new ATOM 0 HE22 GLN A 23 51.985 17.536 19.488 1.00 0.00 H new ATOM 355 N ARG A 24 53.665 12.732 16.270 1.00 0.00 N ATOM 356 CA ARG A 24 54.430 12.836 15.016 1.00 0.00 C ATOM 357 C ARG A 24 54.342 11.531 14.261 1.00 0.00 C ATOM 358 O ARG A 24 54.413 11.494 13.053 1.00 0.00 O ATOM 359 CB ARG A 24 55.895 13.133 15.325 1.00 0.00 C ATOM 360 CG ARG A 24 55.990 14.411 16.143 1.00 0.00 C ATOM 361 CD ARG A 24 55.950 15.614 15.207 1.00 0.00 C ATOM 362 NE ARG A 24 56.724 16.740 15.810 1.00 0.00 N ATOM 363 CZ ARG A 24 56.596 17.963 15.345 1.00 0.00 C ATOM 364 NH1 ARG A 24 55.782 18.216 14.347 1.00 0.00 N ATOM 365 NH2 ARG A 24 57.284 18.933 15.880 1.00 0.00 N ATOM 0 H ARG A 24 54.210 12.849 17.124 1.00 0.00 H new ATOM 0 HA ARG A 24 54.014 13.642 14.412 1.00 0.00 H new ATOM 0 HB2 ARG A 24 56.338 12.303 15.875 1.00 0.00 H new ATOM 0 HB3 ARG A 24 56.459 13.239 14.398 1.00 0.00 H new ATOM 0 HG2 ARG A 24 55.166 14.462 16.855 1.00 0.00 H new ATOM 0 HG3 ARG A 24 56.913 14.417 16.723 1.00 0.00 H new ATOM 0 HD2 ARG A 24 56.371 15.348 14.237 1.00 0.00 H new ATOM 0 HD3 ARG A 24 54.918 15.919 15.034 1.00 0.00 H new ATOM 0 HE ARG A 24 57.357 16.559 16.589 1.00 0.00 H new ATOM 0 HH11 ARG A 24 55.242 17.460 13.925 1.00 0.00 H new ATOM 0 HH12 ARG A 24 55.689 19.168 13.993 1.00 0.00 H new ATOM 0 HH21 ARG A 24 57.918 18.741 16.656 1.00 0.00 H new ATOM 0 HH22 ARG A 24 57.188 19.884 15.523 1.00 0.00 H new ATOM 379 N LEU A 25 54.224 10.460 14.967 1.00 0.00 N ATOM 380 CA LEU A 25 54.182 9.139 14.310 1.00 0.00 C ATOM 381 C LEU A 25 52.839 8.917 13.635 1.00 0.00 C ATOM 382 O LEU A 25 51.865 8.548 14.259 1.00 0.00 O ATOM 383 CB LEU A 25 54.429 8.060 15.350 1.00 0.00 C ATOM 384 CG LEU A 25 55.776 8.332 16.035 1.00 0.00 C ATOM 385 CD1 LEU A 25 56.132 7.167 16.947 1.00 0.00 C ATOM 386 CD2 LEU A 25 56.868 8.497 14.974 1.00 0.00 C ATOM 0 H LEU A 25 54.154 10.440 15.984 1.00 0.00 H new ATOM 0 HA LEU A 25 54.956 9.096 13.544 1.00 0.00 H new ATOM 0 HB2 LEU A 25 53.625 8.055 16.086 1.00 0.00 H new ATOM 0 HB3 LEU A 25 54.437 7.077 14.879 1.00 0.00 H new ATOM 0 HG LEU A 25 55.700 9.245 16.625 1.00 0.00 H new ATOM 0 HD11 LEU A 25 57.088 7.363 17.431 1.00 0.00 H new ATOM 0 HD12 LEU A 25 55.358 7.049 17.706 1.00 0.00 H new ATOM 0 HD13 LEU A 25 56.205 6.253 16.358 1.00 0.00 H new ATOM 0 HD21 LEU A 25 57.823 8.690 15.462 1.00 0.00 H new ATOM 0 HD22 LEU A 25 56.941 7.585 14.382 1.00 0.00 H new ATOM 0 HD23 LEU A 25 56.618 9.334 14.322 1.00 0.00 H new ATOM 398 N ALA A 26 52.786 9.138 12.356 1.00 0.00 N ATOM 399 CA ALA A 26 51.517 8.941 11.617 1.00 0.00 C ATOM 400 C ALA A 26 51.271 7.445 11.383 1.00 0.00 C ATOM 401 O ALA A 26 50.160 7.021 11.138 1.00 0.00 O ATOM 402 CB ALA A 26 51.605 9.647 10.266 1.00 0.00 C ATOM 0 H ALA A 26 53.574 9.449 11.788 1.00 0.00 H new ATOM 0 HA ALA A 26 50.696 9.355 12.203 1.00 0.00 H new ATOM 0 HB1 ALA A 26 50.673 9.504 9.719 1.00 0.00 H new ATOM 0 HB2 ALA A 26 51.774 10.712 10.423 1.00 0.00 H new ATOM 0 HB3 ALA A 26 52.431 9.229 9.690 1.00 0.00 H new ATOM 408 N SER A 27 52.302 6.648 11.438 1.00 0.00 N ATOM 409 CA SER A 27 52.128 5.182 11.196 1.00 0.00 C ATOM 410 C SER A 27 53.443 4.451 11.486 1.00 0.00 C ATOM 411 O SER A 27 54.428 5.055 11.862 1.00 0.00 O ATOM 412 CB SER A 27 51.729 4.949 9.738 1.00 0.00 C ATOM 413 OG SER A 27 52.256 5.997 8.934 1.00 0.00 O ATOM 0 H SER A 27 53.257 6.945 11.639 1.00 0.00 H new ATOM 0 HA SER A 27 51.348 4.799 11.854 1.00 0.00 H new ATOM 0 HB2 SER A 27 52.107 3.986 9.395 1.00 0.00 H new ATOM 0 HB3 SER A 27 50.643 4.916 9.647 1.00 0.00 H new ATOM 0 HG SER A 27 52.004 5.850 7.999 1.00 0.00 H new ATOM 419 N TYR A 28 53.464 3.149 11.332 1.00 0.00 N ATOM 420 CA TYR A 28 54.714 2.386 11.620 1.00 0.00 C ATOM 421 C TYR A 28 54.747 1.106 10.751 1.00 0.00 C ATOM 422 O TYR A 28 53.748 0.433 10.583 1.00 0.00 O ATOM 423 CB TYR A 28 54.737 2.060 13.139 1.00 0.00 C ATOM 424 CG TYR A 28 54.838 0.576 13.404 1.00 0.00 C ATOM 425 CD1 TYR A 28 53.717 -0.252 13.193 1.00 0.00 C ATOM 426 CD2 TYR A 28 56.063 0.017 13.824 1.00 0.00 C ATOM 427 CE1 TYR A 28 53.815 -1.640 13.409 1.00 0.00 C ATOM 428 CE2 TYR A 28 56.167 -1.371 14.037 1.00 0.00 C ATOM 429 CZ TYR A 28 55.042 -2.204 13.830 1.00 0.00 C ATOM 430 OH TYR A 28 55.142 -3.565 14.038 1.00 0.00 O ATOM 0 H TYR A 28 52.673 2.586 11.021 1.00 0.00 H new ATOM 0 HA TYR A 28 55.602 2.968 11.373 1.00 0.00 H new ATOM 0 HB2 TYR A 28 55.581 2.569 13.605 1.00 0.00 H new ATOM 0 HB3 TYR A 28 53.833 2.450 13.606 1.00 0.00 H new ATOM 0 HD1 TYR A 28 52.782 0.178 12.865 1.00 0.00 H new ATOM 0 HD2 TYR A 28 56.921 0.653 13.982 1.00 0.00 H new ATOM 0 HE1 TYR A 28 52.954 -2.273 13.253 1.00 0.00 H new ATOM 0 HE2 TYR A 28 57.105 -1.800 14.358 1.00 0.00 H new ATOM 0 HH TYR A 28 54.521 -4.034 13.442 1.00 0.00 H new ATOM 440 N ARG A 29 55.889 0.773 10.194 1.00 0.00 N ATOM 441 CA ARG A 29 55.980 -0.453 9.337 1.00 0.00 C ATOM 442 C ARG A 29 57.266 -1.222 9.665 1.00 0.00 C ATOM 443 O ARG A 29 58.249 -1.117 8.974 1.00 0.00 O ATOM 444 CB ARG A 29 55.998 -0.041 7.862 1.00 0.00 C ATOM 445 CG ARG A 29 54.905 0.998 7.608 1.00 0.00 C ATOM 446 CD ARG A 29 54.987 1.480 6.157 1.00 0.00 C ATOM 447 NE ARG A 29 53.707 2.153 5.783 1.00 0.00 N ATOM 448 CZ ARG A 29 53.420 2.389 4.521 1.00 0.00 C ATOM 449 NH1 ARG A 29 54.252 2.036 3.570 1.00 0.00 N ATOM 450 NH2 ARG A 29 52.299 2.980 4.212 1.00 0.00 N ATOM 0 H ARG A 29 56.759 1.296 10.296 1.00 0.00 H new ATOM 0 HA ARG A 29 55.119 -1.092 9.531 1.00 0.00 H new ATOM 0 HB2 ARG A 29 56.973 0.370 7.600 1.00 0.00 H new ATOM 0 HB3 ARG A 29 55.839 -0.913 7.228 1.00 0.00 H new ATOM 0 HG2 ARG A 29 53.924 0.565 7.804 1.00 0.00 H new ATOM 0 HG3 ARG A 29 55.023 1.840 8.290 1.00 0.00 H new ATOM 0 HD2 ARG A 29 55.822 2.171 6.039 1.00 0.00 H new ATOM 0 HD3 ARG A 29 55.175 0.637 5.492 1.00 0.00 H new ATOM 0 HE ARG A 29 53.050 2.432 6.512 1.00 0.00 H new ATOM 0 HH11 ARG A 29 55.130 1.574 3.806 1.00 0.00 H new ATOM 0 HH12 ARG A 29 54.021 2.223 2.594 1.00 0.00 H new ATOM 0 HH21 ARG A 29 51.649 3.257 4.948 1.00 0.00 H new ATOM 0 HH22 ARG A 29 52.072 3.165 3.235 1.00 0.00 H new ATOM 464 N ARG A 30 57.257 -1.986 10.731 1.00 0.00 N ATOM 465 CA ARG A 30 58.486 -2.759 11.145 1.00 0.00 C ATOM 466 C ARG A 30 59.229 -3.339 9.926 1.00 0.00 C ATOM 467 O ARG A 30 58.665 -4.050 9.118 1.00 0.00 O ATOM 468 CB ARG A 30 58.065 -3.907 12.066 1.00 0.00 C ATOM 469 CG ARG A 30 59.186 -4.197 13.067 1.00 0.00 C ATOM 470 CD ARG A 30 58.621 -4.978 14.253 1.00 0.00 C ATOM 471 NE ARG A 30 59.303 -6.305 14.346 1.00 0.00 N ATOM 472 CZ ARG A 30 58.802 -7.264 15.093 1.00 0.00 C ATOM 473 NH1 ARG A 30 57.695 -7.074 15.771 1.00 0.00 N ATOM 474 NH2 ARG A 30 59.412 -8.416 15.160 1.00 0.00 N ATOM 0 H ARG A 30 56.449 -2.112 11.340 1.00 0.00 H new ATOM 0 HA ARG A 30 59.161 -2.076 11.661 1.00 0.00 H new ATOM 0 HB2 ARG A 30 57.149 -3.645 12.596 1.00 0.00 H new ATOM 0 HB3 ARG A 30 57.849 -4.799 11.478 1.00 0.00 H new ATOM 0 HG2 ARG A 30 59.979 -4.769 12.586 1.00 0.00 H new ATOM 0 HG3 ARG A 30 59.631 -3.263 13.411 1.00 0.00 H new ATOM 0 HD2 ARG A 30 58.768 -4.416 15.175 1.00 0.00 H new ATOM 0 HD3 ARG A 30 57.547 -5.117 14.132 1.00 0.00 H new ATOM 0 HE ARG A 30 60.165 -6.468 13.825 1.00 0.00 H new ATOM 0 HH11 ARG A 30 57.215 -6.176 15.722 1.00 0.00 H new ATOM 0 HH12 ARG A 30 57.315 -7.825 16.347 1.00 0.00 H new ATOM 0 HH21 ARG A 30 60.273 -8.569 14.634 1.00 0.00 H new ATOM 0 HH22 ARG A 30 59.028 -9.164 15.738 1.00 0.00 H new ATOM 488 N ILE A 31 60.511 -3.057 9.816 1.00 0.00 N ATOM 489 CA ILE A 31 61.317 -3.607 8.682 1.00 0.00 C ATOM 490 C ILE A 31 61.948 -4.943 9.105 1.00 0.00 C ATOM 491 O ILE A 31 62.686 -5.014 10.066 1.00 0.00 O ATOM 492 CB ILE A 31 62.433 -2.592 8.296 1.00 0.00 C ATOM 493 CG1 ILE A 31 61.916 -1.678 7.171 1.00 0.00 C ATOM 494 CG2 ILE A 31 63.702 -3.333 7.814 1.00 0.00 C ATOM 495 CD1 ILE A 31 63.066 -0.814 6.627 1.00 0.00 C ATOM 0 H ILE A 31 61.031 -2.468 10.467 1.00 0.00 H new ATOM 0 HA ILE A 31 60.671 -3.772 7.820 1.00 0.00 H new ATOM 0 HB ILE A 31 62.689 -1.999 9.174 1.00 0.00 H new ATOM 0 HG12 ILE A 31 61.491 -2.280 6.368 1.00 0.00 H new ATOM 0 HG13 ILE A 31 61.117 -1.040 7.548 1.00 0.00 H new ATOM 0 HG21 ILE A 31 64.469 -2.606 7.549 1.00 0.00 H new ATOM 0 HG22 ILE A 31 64.072 -3.977 8.612 1.00 0.00 H new ATOM 0 HG23 ILE A 31 63.460 -3.939 6.941 1.00 0.00 H new ATOM 0 HD11 ILE A 31 62.692 -0.170 5.831 1.00 0.00 H new ATOM 0 HD12 ILE A 31 63.471 -0.200 7.431 1.00 0.00 H new ATOM 0 HD13 ILE A 31 63.851 -1.459 6.233 1.00 0.00 H new ATOM 507 N THR A 32 61.697 -5.982 8.361 1.00 0.00 N ATOM 508 CA THR A 32 62.311 -7.302 8.680 1.00 0.00 C ATOM 509 C THR A 32 62.287 -8.171 7.423 1.00 0.00 C ATOM 510 O THR A 32 61.934 -9.333 7.464 1.00 0.00 O ATOM 511 CB THR A 32 61.522 -7.991 9.796 1.00 0.00 C ATOM 512 OG1 THR A 32 60.146 -8.031 9.448 1.00 0.00 O ATOM 513 CG2 THR A 32 61.699 -7.220 11.102 1.00 0.00 C ATOM 0 H THR A 32 61.090 -5.975 7.541 1.00 0.00 H new ATOM 0 HA THR A 32 63.338 -7.157 9.015 1.00 0.00 H new ATOM 0 HB THR A 32 61.892 -9.008 9.926 1.00 0.00 H new ATOM 0 HG1 THR A 32 59.641 -8.474 10.162 1.00 0.00 H new ATOM 0 HG21 THR A 32 61.136 -7.713 11.895 1.00 0.00 H new ATOM 0 HG22 THR A 32 62.755 -7.194 11.369 1.00 0.00 H new ATOM 0 HG23 THR A 32 61.332 -6.201 10.976 1.00 0.00 H new ATOM 521 N SER A 33 62.644 -7.606 6.300 1.00 0.00 N ATOM 522 CA SER A 33 62.626 -8.384 5.029 1.00 0.00 C ATOM 523 C SER A 33 63.408 -9.690 5.206 1.00 0.00 C ATOM 524 O SER A 33 62.847 -10.723 5.516 1.00 0.00 O ATOM 525 CB SER A 33 63.263 -7.553 3.914 1.00 0.00 C ATOM 526 OG SER A 33 63.580 -8.399 2.817 1.00 0.00 O ATOM 0 H SER A 33 62.948 -6.637 6.209 1.00 0.00 H new ATOM 0 HA SER A 33 61.594 -8.618 4.766 1.00 0.00 H new ATOM 0 HB2 SER A 33 62.579 -6.767 3.595 1.00 0.00 H new ATOM 0 HB3 SER A 33 64.164 -7.062 4.281 1.00 0.00 H new ATOM 0 HG SER A 33 63.836 -7.852 2.045 1.00 0.00 H new ATOM 532 N SER A 34 64.699 -9.656 5.008 1.00 0.00 N ATOM 533 CA SER A 34 65.508 -10.897 5.162 1.00 0.00 C ATOM 534 C SER A 34 66.992 -10.557 5.021 1.00 0.00 C ATOM 535 O SER A 34 67.826 -11.067 5.744 1.00 0.00 O ATOM 536 CB SER A 34 65.110 -11.901 4.079 1.00 0.00 C ATOM 537 OG SER A 34 66.099 -12.921 3.996 1.00 0.00 O ATOM 0 H SER A 34 65.226 -8.823 4.747 1.00 0.00 H new ATOM 0 HA SER A 34 65.326 -11.331 6.145 1.00 0.00 H new ATOM 0 HB2 SER A 34 64.139 -12.338 4.312 1.00 0.00 H new ATOM 0 HB3 SER A 34 65.010 -11.396 3.118 1.00 0.00 H new ATOM 0 HG SER A 34 65.846 -13.567 3.304 1.00 0.00 H new ATOM 543 N LYS A 35 67.331 -9.695 4.100 1.00 0.00 N ATOM 544 CA LYS A 35 68.762 -9.324 3.923 1.00 0.00 C ATOM 545 C LYS A 35 69.100 -8.117 4.814 1.00 0.00 C ATOM 546 O LYS A 35 70.253 -7.790 5.013 1.00 0.00 O ATOM 547 CB LYS A 35 69.029 -8.958 2.459 1.00 0.00 C ATOM 548 CG LYS A 35 68.675 -10.130 1.539 1.00 0.00 C ATOM 549 CD LYS A 35 69.441 -11.385 1.970 1.00 0.00 C ATOM 550 CE LYS A 35 70.945 -11.137 1.839 1.00 0.00 C ATOM 551 NZ LYS A 35 71.603 -11.366 3.157 1.00 0.00 N ATOM 0 H LYS A 35 66.680 -9.234 3.465 1.00 0.00 H new ATOM 0 HA LYS A 35 69.384 -10.174 4.205 1.00 0.00 H new ATOM 0 HB2 LYS A 35 68.441 -8.082 2.184 1.00 0.00 H new ATOM 0 HB3 LYS A 35 70.078 -8.691 2.330 1.00 0.00 H new ATOM 0 HG2 LYS A 35 67.602 -10.319 1.574 1.00 0.00 H new ATOM 0 HG3 LYS A 35 68.921 -9.880 0.507 1.00 0.00 H new ATOM 0 HD2 LYS A 35 69.192 -11.639 3.000 1.00 0.00 H new ATOM 0 HD3 LYS A 35 69.147 -12.233 1.352 1.00 0.00 H new ATOM 0 HE2 LYS A 35 71.370 -11.803 1.088 1.00 0.00 H new ATOM 0 HE3 LYS A 35 71.128 -10.117 1.501 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 72.619 -11.533 3.013 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 71.472 -10.529 3.760 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 71.177 -12.195 3.618 1.00 0.00 H new ATOM 565 N CYS A 36 68.106 -7.449 5.349 1.00 0.00 N ATOM 566 CA CYS A 36 68.391 -6.265 6.215 1.00 0.00 C ATOM 567 C CYS A 36 69.313 -6.681 7.370 1.00 0.00 C ATOM 568 O CYS A 36 68.976 -7.560 8.138 1.00 0.00 O ATOM 569 CB CYS A 36 67.079 -5.710 6.788 1.00 0.00 C ATOM 570 SG CYS A 36 66.090 -4.966 5.460 1.00 0.00 S ATOM 0 H CYS A 36 67.118 -7.671 5.224 1.00 0.00 H new ATOM 0 HA CYS A 36 68.879 -5.496 5.616 1.00 0.00 H new ATOM 0 HB2 CYS A 36 66.515 -6.509 7.269 1.00 0.00 H new ATOM 0 HB3 CYS A 36 67.293 -4.965 7.555 1.00 0.00 H new ATOM 575 N PRO A 37 70.461 -6.028 7.463 1.00 0.00 N ATOM 576 CA PRO A 37 71.424 -6.321 8.517 1.00 0.00 C ATOM 577 C PRO A 37 70.816 -6.040 9.890 1.00 0.00 C ATOM 578 O PRO A 37 71.308 -6.498 10.902 1.00 0.00 O ATOM 579 CB PRO A 37 72.600 -5.365 8.259 1.00 0.00 C ATOM 580 CG PRO A 37 72.239 -4.502 7.014 1.00 0.00 C ATOM 581 CD PRO A 37 70.862 -4.966 6.525 1.00 0.00 C ATOM 0 HA PRO A 37 71.729 -7.367 8.509 1.00 0.00 H new ATOM 0 HB2 PRO A 37 72.775 -4.730 9.127 1.00 0.00 H new ATOM 0 HB3 PRO A 37 73.518 -5.926 8.083 1.00 0.00 H new ATOM 0 HG2 PRO A 37 72.219 -3.443 7.272 1.00 0.00 H new ATOM 0 HG3 PRO A 37 72.987 -4.625 6.231 1.00 0.00 H new ATOM 0 HD2 PRO A 37 70.145 -4.145 6.529 1.00 0.00 H new ATOM 0 HD3 PRO A 37 70.912 -5.341 5.503 1.00 0.00 H new ATOM 589 N LYS A 38 69.769 -5.271 9.937 1.00 0.00 N ATOM 590 CA LYS A 38 69.156 -4.941 11.243 1.00 0.00 C ATOM 591 C LYS A 38 67.657 -4.676 11.076 1.00 0.00 C ATOM 592 O LYS A 38 67.242 -3.917 10.223 1.00 0.00 O ATOM 593 CB LYS A 38 69.822 -3.685 11.805 1.00 0.00 C ATOM 594 CG LYS A 38 71.152 -4.057 12.460 1.00 0.00 C ATOM 595 CD LYS A 38 71.308 -3.283 13.770 1.00 0.00 C ATOM 596 CE LYS A 38 72.674 -3.592 14.387 1.00 0.00 C ATOM 597 NZ LYS A 38 73.750 -3.062 13.503 1.00 0.00 N ATOM 0 H LYS A 38 69.312 -4.857 9.124 1.00 0.00 H new ATOM 0 HA LYS A 38 69.297 -5.782 11.923 1.00 0.00 H new ATOM 0 HB2 LYS A 38 69.988 -2.962 11.007 1.00 0.00 H new ATOM 0 HB3 LYS A 38 69.167 -3.209 12.535 1.00 0.00 H new ATOM 0 HG2 LYS A 38 71.188 -5.129 12.652 1.00 0.00 H new ATOM 0 HG3 LYS A 38 71.978 -3.826 11.788 1.00 0.00 H new ATOM 0 HD2 LYS A 38 71.214 -2.213 13.586 1.00 0.00 H new ATOM 0 HD3 LYS A 38 70.513 -3.558 14.464 1.00 0.00 H new ATOM 0 HE2 LYS A 38 72.748 -3.142 15.377 1.00 0.00 H new ATOM 0 HE3 LYS A 38 72.792 -4.668 14.516 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 74.620 -2.928 14.057 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 73.931 -3.737 12.733 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 73.452 -2.150 13.101 1.00 0.00 H new ATOM 611 N GLU A 39 66.845 -5.253 11.924 1.00 0.00 N ATOM 612 CA GLU A 39 65.383 -4.982 11.852 1.00 0.00 C ATOM 613 C GLU A 39 65.144 -3.546 12.321 1.00 0.00 C ATOM 614 O GLU A 39 66.073 -2.849 12.685 1.00 0.00 O ATOM 615 CB GLU A 39 64.635 -5.954 12.768 1.00 0.00 C ATOM 616 CG GLU A 39 65.079 -7.386 12.464 1.00 0.00 C ATOM 617 CD GLU A 39 65.516 -8.071 13.760 1.00 0.00 C ATOM 618 OE1 GLU A 39 64.697 -8.172 14.658 1.00 0.00 O ATOM 619 OE2 GLU A 39 66.662 -8.483 13.830 1.00 0.00 O ATOM 0 H GLU A 39 67.132 -5.898 12.660 1.00 0.00 H new ATOM 0 HA GLU A 39 65.022 -5.112 10.832 1.00 0.00 H new ATOM 0 HB2 GLU A 39 64.836 -5.714 13.812 1.00 0.00 H new ATOM 0 HB3 GLU A 39 63.560 -5.856 12.619 1.00 0.00 H new ATOM 0 HG2 GLU A 39 64.262 -7.942 12.004 1.00 0.00 H new ATOM 0 HG3 GLU A 39 65.901 -7.379 11.749 1.00 0.00 H new ATOM 626 N ALA A 40 63.924 -3.084 12.319 1.00 0.00 N ATOM 627 CA ALA A 40 63.679 -1.682 12.769 1.00 0.00 C ATOM 628 C ALA A 40 62.186 -1.367 12.745 1.00 0.00 C ATOM 629 O ALA A 40 61.354 -2.232 12.561 1.00 0.00 O ATOM 630 CB ALA A 40 64.406 -0.723 11.828 1.00 0.00 C ATOM 0 H ALA A 40 63.097 -3.606 12.030 1.00 0.00 H new ATOM 0 HA ALA A 40 64.048 -1.567 13.788 1.00 0.00 H new ATOM 0 HB1 ALA A 40 64.232 0.304 12.150 1.00 0.00 H new ATOM 0 HB2 ALA A 40 65.475 -0.934 11.849 1.00 0.00 H new ATOM 0 HB3 ALA A 40 64.030 -0.854 10.813 1.00 0.00 H new ATOM 636 N VAL A 41 61.849 -0.118 12.903 1.00 0.00 N ATOM 637 CA VAL A 41 60.420 0.295 12.853 1.00 0.00 C ATOM 638 C VAL A 41 60.304 1.485 11.919 1.00 0.00 C ATOM 639 O VAL A 41 60.919 2.506 12.131 1.00 0.00 O ATOM 640 CB VAL A 41 59.927 0.692 14.260 1.00 0.00 C ATOM 641 CG1 VAL A 41 58.996 1.920 14.176 1.00 0.00 C ATOM 642 CG2 VAL A 41 59.152 -0.468 14.860 1.00 0.00 C ATOM 0 H VAL A 41 62.510 0.642 13.066 1.00 0.00 H new ATOM 0 HA VAL A 41 59.808 -0.533 12.495 1.00 0.00 H new ATOM 0 HB VAL A 41 60.789 0.937 14.880 1.00 0.00 H new ATOM 0 HG11 VAL A 41 58.656 2.188 15.176 1.00 0.00 H new ATOM 0 HG12 VAL A 41 59.539 2.759 13.740 1.00 0.00 H new ATOM 0 HG13 VAL A 41 58.135 1.682 13.552 1.00 0.00 H new ATOM 0 HG21 VAL A 41 58.800 -0.195 15.855 1.00 0.00 H new ATOM 0 HG22 VAL A 41 58.298 -0.702 14.225 1.00 0.00 H new ATOM 0 HG23 VAL A 41 59.801 -1.341 14.932 1.00 0.00 H new ATOM 652 N ILE A 42 59.509 1.385 10.914 1.00 0.00 N ATOM 653 CA ILE A 42 59.364 2.530 10.003 1.00 0.00 C ATOM 654 C ILE A 42 58.321 3.488 10.550 1.00 0.00 C ATOM 655 O ILE A 42 57.205 3.537 10.082 1.00 0.00 O ATOM 656 CB ILE A 42 58.944 2.046 8.635 1.00 0.00 C ATOM 657 CG1 ILE A 42 59.844 0.878 8.219 1.00 0.00 C ATOM 658 CG2 ILE A 42 59.082 3.195 7.645 1.00 0.00 C ATOM 659 CD1 ILE A 42 61.260 1.379 7.972 1.00 0.00 C ATOM 0 H ILE A 42 58.953 0.562 10.682 1.00 0.00 H new ATOM 0 HA ILE A 42 60.320 3.047 9.921 1.00 0.00 H new ATOM 0 HB ILE A 42 57.908 1.707 8.652 1.00 0.00 H new ATOM 0 HG12 ILE A 42 59.849 0.116 8.998 1.00 0.00 H new ATOM 0 HG13 ILE A 42 59.452 0.409 7.317 1.00 0.00 H new ATOM 0 HG21 ILE A 42 58.782 2.858 6.653 1.00 0.00 H new ATOM 0 HG22 ILE A 42 58.444 4.022 7.956 1.00 0.00 H new ATOM 0 HG23 ILE A 42 60.119 3.528 7.616 1.00 0.00 H new ATOM 0 HD11 ILE A 42 61.895 0.544 7.677 1.00 0.00 H new ATOM 0 HD12 ILE A 42 61.249 2.125 7.177 1.00 0.00 H new ATOM 0 HD13 ILE A 42 61.652 1.827 8.885 1.00 0.00 H new ATOM 671 N PHE A 43 58.681 4.260 11.535 1.00 0.00 N ATOM 672 CA PHE A 43 57.719 5.229 12.115 1.00 0.00 C ATOM 673 C PHE A 43 57.386 6.303 11.074 1.00 0.00 C ATOM 674 O PHE A 43 57.996 7.352 11.041 1.00 0.00 O ATOM 675 CB PHE A 43 58.350 5.895 13.340 1.00 0.00 C ATOM 676 CG PHE A 43 58.141 5.035 14.568 1.00 0.00 C ATOM 677 CD1 PHE A 43 56.881 4.446 14.822 1.00 0.00 C ATOM 678 CD2 PHE A 43 59.208 4.830 15.470 1.00 0.00 C ATOM 679 CE1 PHE A 43 56.695 3.650 15.977 1.00 0.00 C ATOM 680 CE2 PHE A 43 59.017 4.037 16.623 1.00 0.00 C ATOM 681 CZ PHE A 43 57.760 3.448 16.874 1.00 0.00 C ATOM 0 H PHE A 43 59.606 4.260 11.964 1.00 0.00 H new ATOM 0 HA PHE A 43 56.808 4.707 12.407 1.00 0.00 H new ATOM 0 HB2 PHE A 43 59.416 6.048 13.171 1.00 0.00 H new ATOM 0 HB3 PHE A 43 57.908 6.879 13.496 1.00 0.00 H new ATOM 0 HD1 PHE A 43 56.062 4.603 14.136 1.00 0.00 H new ATOM 0 HD2 PHE A 43 60.171 5.280 15.278 1.00 0.00 H new ATOM 0 HE1 PHE A 43 55.734 3.197 16.170 1.00 0.00 H new ATOM 0 HE2 PHE A 43 59.833 3.882 17.313 1.00 0.00 H new ATOM 0 HZ PHE A 43 57.615 2.841 17.756 1.00 0.00 H new ATOM 691 N LYS A 44 56.418 6.061 10.229 1.00 0.00 N ATOM 692 CA LYS A 44 56.056 7.087 9.212 1.00 0.00 C ATOM 693 C LYS A 44 55.514 8.307 9.934 1.00 0.00 C ATOM 694 O LYS A 44 54.378 8.329 10.347 1.00 0.00 O ATOM 695 CB LYS A 44 54.976 6.536 8.276 1.00 0.00 C ATOM 696 CG LYS A 44 55.514 6.491 6.844 1.00 0.00 C ATOM 697 CD LYS A 44 54.498 7.129 5.896 1.00 0.00 C ATOM 698 CE LYS A 44 55.133 7.315 4.517 1.00 0.00 C ATOM 699 NZ LYS A 44 54.063 7.475 3.493 1.00 0.00 N ATOM 0 H LYS A 44 55.867 5.203 10.200 1.00 0.00 H new ATOM 0 HA LYS A 44 56.935 7.350 8.624 1.00 0.00 H new ATOM 0 HB2 LYS A 44 54.679 5.537 8.595 1.00 0.00 H new ATOM 0 HB3 LYS A 44 54.086 7.164 8.322 1.00 0.00 H new ATOM 0 HG2 LYS A 44 56.465 7.021 6.785 1.00 0.00 H new ATOM 0 HG3 LYS A 44 55.705 5.459 6.548 1.00 0.00 H new ATOM 0 HD2 LYS A 44 53.612 6.499 5.818 1.00 0.00 H new ATOM 0 HD3 LYS A 44 54.171 8.091 6.290 1.00 0.00 H new ATOM 0 HE2 LYS A 44 55.782 8.191 4.519 1.00 0.00 H new ATOM 0 HE3 LYS A 44 55.758 6.455 4.274 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 54.496 7.601 2.556 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 53.461 6.627 3.485 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 53.485 8.308 3.723 1.00 0.00 H new ATOM 713 N THR A 45 56.325 9.309 10.121 1.00 0.00 N ATOM 714 CA THR A 45 55.857 10.514 10.856 1.00 0.00 C ATOM 715 C THR A 45 54.652 11.137 10.126 1.00 0.00 C ATOM 716 O THR A 45 53.962 10.475 9.380 1.00 0.00 O ATOM 717 CB THR A 45 57.005 11.523 10.958 1.00 0.00 C ATOM 718 OG1 THR A 45 57.674 11.614 9.707 1.00 0.00 O ATOM 719 CG2 THR A 45 57.983 11.054 12.036 1.00 0.00 C ATOM 0 H THR A 45 57.291 9.345 9.797 1.00 0.00 H new ATOM 0 HA THR A 45 55.543 10.232 11.861 1.00 0.00 H new ATOM 0 HB THR A 45 56.612 12.505 11.221 1.00 0.00 H new ATOM 0 HG1 THR A 45 58.397 10.953 9.674 1.00 0.00 H new ATOM 0 HG21 THR A 45 58.805 11.766 12.117 1.00 0.00 H new ATOM 0 HG22 THR A 45 57.465 10.988 12.993 1.00 0.00 H new ATOM 0 HG23 THR A 45 58.377 10.074 11.768 1.00 0.00 H new ATOM 727 N ILE A 46 54.396 12.402 10.333 1.00 0.00 N ATOM 728 CA ILE A 46 53.235 13.046 9.656 1.00 0.00 C ATOM 729 C ILE A 46 53.680 13.601 8.341 1.00 0.00 C ATOM 730 O ILE A 46 52.912 13.713 7.404 1.00 0.00 O ATOM 731 CB ILE A 46 52.698 14.198 10.507 1.00 0.00 C ATOM 732 CG1 ILE A 46 53.876 15.096 10.981 1.00 0.00 C ATOM 733 CG2 ILE A 46 51.919 13.641 11.715 1.00 0.00 C ATOM 734 CD1 ILE A 46 54.375 14.663 12.368 1.00 0.00 C ATOM 0 H ILE A 46 54.940 13.015 10.940 1.00 0.00 H new ATOM 0 HA ILE A 46 52.453 12.300 9.515 1.00 0.00 H new ATOM 0 HB ILE A 46 52.018 14.803 9.907 1.00 0.00 H new ATOM 0 HG12 ILE A 46 54.694 15.039 10.262 1.00 0.00 H new ATOM 0 HG13 ILE A 46 53.554 16.137 11.015 1.00 0.00 H new ATOM 0 HG21 ILE A 46 51.540 14.468 12.316 1.00 0.00 H new ATOM 0 HG22 ILE A 46 51.084 13.036 11.362 1.00 0.00 H new ATOM 0 HG23 ILE A 46 52.582 13.025 12.323 1.00 0.00 H new ATOM 0 HD11 ILE A 46 55.199 15.307 12.676 1.00 0.00 H new ATOM 0 HD12 ILE A 46 53.562 14.745 13.089 1.00 0.00 H new ATOM 0 HD13 ILE A 46 54.719 13.630 12.325 1.00 0.00 H new ATOM 746 N VAL A 47 54.911 13.947 8.250 1.00 0.00 N ATOM 747 CA VAL A 47 55.419 14.487 6.999 1.00 0.00 C ATOM 748 C VAL A 47 55.910 13.332 6.125 1.00 0.00 C ATOM 749 O VAL A 47 56.611 13.528 5.151 1.00 0.00 O ATOM 750 CB VAL A 47 56.547 15.455 7.316 1.00 0.00 C ATOM 751 CG1 VAL A 47 57.801 14.687 7.740 1.00 0.00 C ATOM 752 CG2 VAL A 47 56.838 16.289 6.093 1.00 0.00 C ATOM 0 H VAL A 47 55.595 13.876 9.004 1.00 0.00 H new ATOM 0 HA VAL A 47 54.640 15.022 6.456 1.00 0.00 H new ATOM 0 HB VAL A 47 56.248 16.104 8.139 1.00 0.00 H new ATOM 0 HG11 VAL A 47 58.601 15.392 7.964 1.00 0.00 H new ATOM 0 HG12 VAL A 47 57.581 14.093 8.627 1.00 0.00 H new ATOM 0 HG13 VAL A 47 58.115 14.028 6.931 1.00 0.00 H new ATOM 0 HG21 VAL A 47 57.646 16.986 6.312 1.00 0.00 H new ATOM 0 HG22 VAL A 47 57.134 15.638 5.270 1.00 0.00 H new ATOM 0 HG23 VAL A 47 55.944 16.846 5.812 1.00 0.00 H new ATOM 762 N ALA A 48 55.525 12.120 6.461 1.00 0.00 N ATOM 763 CA ALA A 48 55.939 10.954 5.657 1.00 0.00 C ATOM 764 C ALA A 48 57.435 10.701 5.843 1.00 0.00 C ATOM 765 O ALA A 48 58.063 10.029 5.049 1.00 0.00 O ATOM 766 CB ALA A 48 55.634 11.228 4.193 1.00 0.00 C ATOM 0 H ALA A 48 54.938 11.902 7.266 1.00 0.00 H new ATOM 0 HA ALA A 48 55.392 10.069 5.983 1.00 0.00 H new ATOM 0 HB1 ALA A 48 55.937 10.371 3.592 1.00 0.00 H new ATOM 0 HB2 ALA A 48 54.564 11.398 4.070 1.00 0.00 H new ATOM 0 HB3 ALA A 48 56.182 12.112 3.867 1.00 0.00 H new ATOM 772 N LYS A 49 58.007 11.216 6.898 1.00 0.00 N ATOM 773 CA LYS A 49 59.454 10.984 7.143 1.00 0.00 C ATOM 774 C LYS A 49 59.635 9.607 7.778 1.00 0.00 C ATOM 775 O LYS A 49 59.787 9.479 8.976 1.00 0.00 O ATOM 776 CB LYS A 49 59.993 12.055 8.085 1.00 0.00 C ATOM 777 CG LYS A 49 61.121 12.824 7.393 1.00 0.00 C ATOM 778 CD LYS A 49 61.226 14.227 7.996 1.00 0.00 C ATOM 779 CE LYS A 49 61.897 14.143 9.367 1.00 0.00 C ATOM 780 NZ LYS A 49 61.697 15.428 10.096 1.00 0.00 N ATOM 0 H LYS A 49 57.533 11.786 7.598 1.00 0.00 H new ATOM 0 HA LYS A 49 59.999 11.031 6.200 1.00 0.00 H new ATOM 0 HB2 LYS A 49 59.194 12.739 8.370 1.00 0.00 H new ATOM 0 HB3 LYS A 49 60.361 11.595 9.002 1.00 0.00 H new ATOM 0 HG2 LYS A 49 62.065 12.293 7.514 1.00 0.00 H new ATOM 0 HG3 LYS A 49 60.927 12.890 6.322 1.00 0.00 H new ATOM 0 HD2 LYS A 49 61.802 14.876 7.336 1.00 0.00 H new ATOM 0 HD3 LYS A 49 60.234 14.669 8.091 1.00 0.00 H new ATOM 0 HE2 LYS A 49 61.475 13.317 9.940 1.00 0.00 H new ATOM 0 HE3 LYS A 49 62.962 13.940 9.251 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 62.153 15.372 11.029 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 62.119 16.206 9.550 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 60.679 15.603 10.218 1.00 0.00 H new ATOM 794 N GLU A 50 59.616 8.572 6.986 1.00 0.00 N ATOM 795 CA GLU A 50 59.779 7.201 7.547 1.00 0.00 C ATOM 796 C GLU A 50 61.019 7.165 8.433 1.00 0.00 C ATOM 797 O GLU A 50 62.131 7.287 7.961 1.00 0.00 O ATOM 798 CB GLU A 50 59.937 6.199 6.401 1.00 0.00 C ATOM 799 CG GLU A 50 58.584 5.981 5.722 1.00 0.00 C ATOM 800 CD GLU A 50 58.799 5.351 4.345 1.00 0.00 C ATOM 801 OE1 GLU A 50 59.088 6.088 3.416 1.00 0.00 O ATOM 802 OE2 GLU A 50 58.670 4.142 4.241 1.00 0.00 O ATOM 0 H GLU A 50 59.495 8.615 5.974 1.00 0.00 H new ATOM 0 HA GLU A 50 58.902 6.938 8.138 1.00 0.00 H new ATOM 0 HB2 GLU A 50 60.663 6.570 5.678 1.00 0.00 H new ATOM 0 HB3 GLU A 50 60.321 5.253 6.782 1.00 0.00 H new ATOM 0 HG2 GLU A 50 57.957 5.334 6.336 1.00 0.00 H new ATOM 0 HG3 GLU A 50 58.059 6.931 5.621 1.00 0.00 H new ATOM 809 N ILE A 51 60.845 7.017 9.719 1.00 0.00 N ATOM 810 CA ILE A 51 62.035 6.992 10.617 1.00 0.00 C ATOM 811 C ILE A 51 62.252 5.600 11.163 1.00 0.00 C ATOM 812 O ILE A 51 61.537 5.148 12.036 1.00 0.00 O ATOM 813 CB ILE A 51 61.861 7.928 11.809 1.00 0.00 C ATOM 814 CG1 ILE A 51 60.780 8.961 11.547 1.00 0.00 C ATOM 815 CG2 ILE A 51 63.176 8.644 12.069 1.00 0.00 C ATOM 816 CD1 ILE A 51 60.592 9.775 12.814 1.00 0.00 C ATOM 0 H ILE A 51 59.942 6.914 10.182 1.00 0.00 H new ATOM 0 HA ILE A 51 62.887 7.314 10.018 1.00 0.00 H new ATOM 0 HB ILE A 51 61.566 7.334 12.674 1.00 0.00 H new ATOM 0 HG12 ILE A 51 61.064 9.608 10.717 1.00 0.00 H new ATOM 0 HG13 ILE A 51 59.847 8.473 11.266 1.00 0.00 H new ATOM 0 HG21 ILE A 51 63.062 9.316 12.920 1.00 0.00 H new ATOM 0 HG22 ILE A 51 63.953 7.911 12.287 1.00 0.00 H new ATOM 0 HG23 ILE A 51 63.458 9.219 11.187 1.00 0.00 H new ATOM 0 HD11 ILE A 51 59.819 10.526 12.652 1.00 0.00 H new ATOM 0 HD12 ILE A 51 60.293 9.116 13.629 1.00 0.00 H new ATOM 0 HD13 ILE A 51 61.529 10.268 13.072 1.00 0.00 H new ATOM 828 N CYS A 52 63.274 4.947 10.729 1.00 0.00 N ATOM 829 CA CYS A 52 63.583 3.627 11.299 1.00 0.00 C ATOM 830 C CYS A 52 63.920 3.829 12.771 1.00 0.00 C ATOM 831 O CYS A 52 64.696 4.689 13.120 1.00 0.00 O ATOM 832 CB CYS A 52 64.767 3.025 10.568 1.00 0.00 C ATOM 833 SG CYS A 52 64.170 2.172 9.089 1.00 0.00 S ATOM 0 H CYS A 52 63.911 5.271 10.002 1.00 0.00 H new ATOM 0 HA CYS A 52 62.735 2.949 11.196 1.00 0.00 H new ATOM 0 HB2 CYS A 52 65.476 3.805 10.293 1.00 0.00 H new ATOM 0 HB3 CYS A 52 65.296 2.328 11.218 1.00 0.00 H new ATOM 838 N ALA A 53 63.313 3.086 13.636 1.00 0.00 N ATOM 839 CA ALA A 53 63.577 3.278 15.086 1.00 0.00 C ATOM 840 C ALA A 53 63.875 1.923 15.734 1.00 0.00 C ATOM 841 O ALA A 53 63.270 0.923 15.409 1.00 0.00 O ATOM 842 CB ALA A 53 62.347 3.912 15.745 1.00 0.00 C ATOM 0 H ALA A 53 62.643 2.351 13.408 1.00 0.00 H new ATOM 0 HA ALA A 53 64.436 3.935 15.220 1.00 0.00 H new ATOM 0 HB1 ALA A 53 62.537 4.054 16.809 1.00 0.00 H new ATOM 0 HB2 ALA A 53 62.142 4.877 15.281 1.00 0.00 H new ATOM 0 HB3 ALA A 53 61.486 3.256 15.615 1.00 0.00 H new ATOM 848 N ASP A 54 64.815 1.884 16.639 1.00 0.00 N ATOM 849 CA ASP A 54 65.167 0.593 17.297 1.00 0.00 C ATOM 850 C ASP A 54 63.967 0.082 18.123 1.00 0.00 C ATOM 851 O ASP A 54 63.594 0.701 19.099 1.00 0.00 O ATOM 852 CB ASP A 54 66.362 0.813 18.229 1.00 0.00 C ATOM 853 CG ASP A 54 66.720 -0.504 18.920 1.00 0.00 C ATOM 854 OD1 ASP A 54 66.746 -1.518 18.240 1.00 0.00 O ATOM 855 OD2 ASP A 54 66.962 -0.477 20.115 1.00 0.00 O ATOM 0 H ASP A 54 65.355 2.691 16.951 1.00 0.00 H new ATOM 0 HA ASP A 54 65.420 -0.144 16.534 1.00 0.00 H new ATOM 0 HB2 ASP A 54 67.216 1.182 17.661 1.00 0.00 H new ATOM 0 HB3 ASP A 54 66.122 1.573 18.973 1.00 0.00 H new ATOM 860 N PRO A 55 63.396 -1.045 17.713 1.00 0.00 N ATOM 861 CA PRO A 55 62.257 -1.631 18.425 1.00 0.00 C ATOM 862 C PRO A 55 62.679 -2.055 19.837 1.00 0.00 C ATOM 863 O PRO A 55 61.853 -2.295 20.695 1.00 0.00 O ATOM 864 CB PRO A 55 61.854 -2.863 17.596 1.00 0.00 C ATOM 865 CG PRO A 55 62.861 -2.973 16.408 1.00 0.00 C ATOM 866 CD PRO A 55 63.840 -1.792 16.526 1.00 0.00 C ATOM 0 HA PRO A 55 61.433 -0.925 18.533 1.00 0.00 H new ATOM 0 HB2 PRO A 55 61.882 -3.764 18.208 1.00 0.00 H new ATOM 0 HB3 PRO A 55 60.834 -2.761 17.227 1.00 0.00 H new ATOM 0 HG2 PRO A 55 63.397 -3.921 16.445 1.00 0.00 H new ATOM 0 HG3 PRO A 55 62.335 -2.942 15.454 1.00 0.00 H new ATOM 0 HD2 PRO A 55 64.866 -2.140 16.640 1.00 0.00 H new ATOM 0 HD3 PRO A 55 63.813 -1.167 15.634 1.00 0.00 H new ATOM 874 N LYS A 56 63.960 -2.158 20.080 1.00 0.00 N ATOM 875 CA LYS A 56 64.433 -2.575 21.423 1.00 0.00 C ATOM 876 C LYS A 56 64.513 -1.359 22.357 1.00 0.00 C ATOM 877 O LYS A 56 65.060 -1.436 23.439 1.00 0.00 O ATOM 878 CB LYS A 56 65.818 -3.212 21.299 1.00 0.00 C ATOM 879 CG LYS A 56 65.733 -4.451 20.406 1.00 0.00 C ATOM 880 CD LYS A 56 65.319 -5.660 21.248 1.00 0.00 C ATOM 881 CE LYS A 56 66.094 -6.894 20.786 1.00 0.00 C ATOM 882 NZ LYS A 56 66.092 -7.918 21.870 1.00 0.00 N ATOM 0 H LYS A 56 64.697 -1.970 19.401 1.00 0.00 H new ATOM 0 HA LYS A 56 63.730 -3.297 21.839 1.00 0.00 H new ATOM 0 HB2 LYS A 56 66.523 -2.495 20.878 1.00 0.00 H new ATOM 0 HB3 LYS A 56 66.193 -3.487 22.285 1.00 0.00 H new ATOM 0 HG2 LYS A 56 65.011 -4.287 19.606 1.00 0.00 H new ATOM 0 HG3 LYS A 56 66.697 -4.637 19.932 1.00 0.00 H new ATOM 0 HD2 LYS A 56 65.517 -5.467 22.302 1.00 0.00 H new ATOM 0 HD3 LYS A 56 64.247 -5.834 21.152 1.00 0.00 H new ATOM 0 HE2 LYS A 56 65.641 -7.304 19.883 1.00 0.00 H new ATOM 0 HE3 LYS A 56 67.118 -6.620 20.533 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 66.619 -8.757 21.556 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 66.543 -7.524 22.720 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 65.112 -8.187 22.091 1.00 0.00 H new ATOM 896 N GLN A 57 63.971 -0.239 21.954 1.00 0.00 N ATOM 897 CA GLN A 57 64.020 0.965 22.829 1.00 0.00 C ATOM 898 C GLN A 57 62.793 0.977 23.740 1.00 0.00 C ATOM 899 O GLN A 57 61.837 0.260 23.518 1.00 0.00 O ATOM 900 CB GLN A 57 64.028 2.227 21.963 1.00 0.00 C ATOM 901 CG GLN A 57 65.355 2.965 22.149 1.00 0.00 C ATOM 902 CD GLN A 57 65.531 3.337 23.623 1.00 0.00 C ATOM 903 OE1 GLN A 57 64.756 4.098 24.167 1.00 0.00 O ATOM 904 NE2 GLN A 57 66.526 2.828 24.298 1.00 0.00 N ATOM 0 H GLN A 57 63.499 -0.108 21.060 1.00 0.00 H new ATOM 0 HA GLN A 57 64.925 0.939 23.436 1.00 0.00 H new ATOM 0 HB2 GLN A 57 63.891 1.962 20.915 1.00 0.00 H new ATOM 0 HB3 GLN A 57 63.197 2.876 22.239 1.00 0.00 H new ATOM 0 HG2 GLN A 57 66.182 2.336 21.821 1.00 0.00 H new ATOM 0 HG3 GLN A 57 65.373 3.863 21.532 1.00 0.00 H new ATOM 0 HE21 GLN A 57 67.177 2.189 23.842 1.00 0.00 H new ATOM 0 HE22 GLN A 57 66.652 3.069 25.281 1.00 0.00 H new ATOM 913 N LYS A 58 62.811 1.779 24.767 1.00 0.00 N ATOM 914 CA LYS A 58 61.645 1.824 25.692 1.00 0.00 C ATOM 915 C LYS A 58 60.678 2.930 25.256 1.00 0.00 C ATOM 916 O LYS A 58 59.558 2.999 25.722 1.00 0.00 O ATOM 917 CB LYS A 58 62.138 2.099 27.122 1.00 0.00 C ATOM 918 CG LYS A 58 60.945 2.414 28.051 1.00 0.00 C ATOM 919 CD LYS A 58 59.859 1.340 27.897 1.00 0.00 C ATOM 920 CE LYS A 58 59.476 0.800 29.277 1.00 0.00 C ATOM 921 NZ LYS A 58 58.392 -0.212 29.131 1.00 0.00 N ATOM 0 H LYS A 58 63.581 2.404 25.006 1.00 0.00 H new ATOM 0 HA LYS A 58 61.125 0.866 25.665 1.00 0.00 H new ATOM 0 HB2 LYS A 58 62.682 1.233 27.499 1.00 0.00 H new ATOM 0 HB3 LYS A 58 62.835 2.937 27.118 1.00 0.00 H new ATOM 0 HG2 LYS A 58 61.282 2.456 29.087 1.00 0.00 H new ATOM 0 HG3 LYS A 58 60.535 3.394 27.809 1.00 0.00 H new ATOM 0 HD2 LYS A 58 58.983 1.761 27.404 1.00 0.00 H new ATOM 0 HD3 LYS A 58 60.221 0.529 27.265 1.00 0.00 H new ATOM 0 HE2 LYS A 58 60.345 0.351 29.758 1.00 0.00 H new ATOM 0 HE3 LYS A 58 59.143 1.616 29.919 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 58.131 -0.579 30.068 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 57.561 0.231 28.689 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 58.726 -0.995 28.533 1.00 0.00 H new ATOM 935 N TRP A 59 61.086 3.784 24.360 1.00 0.00 N ATOM 936 CA TRP A 59 60.167 4.856 23.907 1.00 0.00 C ATOM 937 C TRP A 59 59.472 4.392 22.632 1.00 0.00 C ATOM 938 O TRP A 59 58.340 4.735 22.368 1.00 0.00 O ATOM 939 CB TRP A 59 60.957 6.163 23.668 1.00 0.00 C ATOM 940 CG TRP A 59 61.660 6.133 22.342 1.00 0.00 C ATOM 941 CD1 TRP A 59 62.965 5.818 22.157 1.00 0.00 C ATOM 942 CD2 TRP A 59 61.122 6.444 21.027 1.00 0.00 C ATOM 943 NE1 TRP A 59 63.265 5.922 20.806 1.00 0.00 N ATOM 944 CE2 TRP A 59 62.163 6.304 20.067 1.00 0.00 C ATOM 945 CE3 TRP A 59 59.836 6.835 20.570 1.00 0.00 C ATOM 946 CZ2 TRP A 59 61.940 6.548 18.699 1.00 0.00 C ATOM 947 CZ3 TRP A 59 59.612 7.079 19.192 1.00 0.00 C ATOM 948 CH2 TRP A 59 60.670 6.934 18.264 1.00 0.00 C ATOM 0 H TRP A 59 62.009 3.784 23.926 1.00 0.00 H new ATOM 0 HA TRP A 59 59.416 5.058 24.670 1.00 0.00 H new ATOM 0 HB2 TRP A 59 60.277 7.014 23.704 1.00 0.00 H new ATOM 0 HB3 TRP A 59 61.686 6.303 24.467 1.00 0.00 H new ATOM 0 HD1 TRP A 59 63.658 5.533 22.934 1.00 0.00 H new ATOM 0 HE1 TRP A 59 64.186 5.739 20.408 1.00 0.00 H new ATOM 0 HE3 TRP A 59 59.026 6.947 21.275 1.00 0.00 H new ATOM 0 HZ2 TRP A 59 62.747 6.437 17.989 1.00 0.00 H new ATOM 0 HZ3 TRP A 59 58.632 7.376 18.850 1.00 0.00 H new ATOM 0 HH2 TRP A 59 60.495 7.123 17.215 1.00 0.00 H new ATOM 959 N VAL A 60 60.131 3.574 21.863 1.00 0.00 N ATOM 960 CA VAL A 60 59.498 3.044 20.636 1.00 0.00 C ATOM 961 C VAL A 60 58.490 1.963 21.035 1.00 0.00 C ATOM 962 O VAL A 60 57.563 1.678 20.321 1.00 0.00 O ATOM 963 CB VAL A 60 60.579 2.450 19.724 1.00 0.00 C ATOM 964 CG1 VAL A 60 59.927 1.659 18.587 1.00 0.00 C ATOM 965 CG2 VAL A 60 61.412 3.585 19.134 1.00 0.00 C ATOM 0 H VAL A 60 61.083 3.251 22.035 1.00 0.00 H new ATOM 0 HA VAL A 60 58.984 3.841 20.099 1.00 0.00 H new ATOM 0 HB VAL A 60 61.215 1.782 20.305 1.00 0.00 H new ATOM 0 HG11 VAL A 60 60.701 1.241 17.944 1.00 0.00 H new ATOM 0 HG12 VAL A 60 59.326 0.851 19.004 1.00 0.00 H new ATOM 0 HG13 VAL A 60 59.289 2.321 18.002 1.00 0.00 H new ATOM 0 HG21 VAL A 60 62.183 3.171 18.484 1.00 0.00 H new ATOM 0 HG22 VAL A 60 60.767 4.247 18.556 1.00 0.00 H new ATOM 0 HG23 VAL A 60 61.881 4.149 19.940 1.00 0.00 H new ATOM 975 N GLN A 61 58.655 1.374 22.185 1.00 0.00 N ATOM 976 CA GLN A 61 57.688 0.338 22.625 1.00 0.00 C ATOM 977 C GLN A 61 56.366 1.015 22.971 1.00 0.00 C ATOM 978 O GLN A 61 55.306 0.434 22.846 1.00 0.00 O ATOM 979 CB GLN A 61 58.233 -0.387 23.858 1.00 0.00 C ATOM 980 CG GLN A 61 59.322 -1.373 23.431 1.00 0.00 C ATOM 981 CD GLN A 61 58.711 -2.763 23.253 1.00 0.00 C ATOM 982 OE1 GLN A 61 58.489 -3.205 22.143 1.00 0.00 O ATOM 983 NE2 GLN A 61 58.426 -3.477 24.307 1.00 0.00 N ATOM 0 H GLN A 61 59.416 1.566 22.836 1.00 0.00 H new ATOM 0 HA GLN A 61 57.535 -0.388 21.826 1.00 0.00 H new ATOM 0 HB2 GLN A 61 58.639 0.334 24.567 1.00 0.00 H new ATOM 0 HB3 GLN A 61 57.428 -0.916 24.367 1.00 0.00 H new ATOM 0 HG2 GLN A 61 59.780 -1.044 22.498 1.00 0.00 H new ATOM 0 HG3 GLN A 61 60.113 -1.405 24.181 1.00 0.00 H new ATOM 0 HE21 GLN A 61 58.612 -3.107 25.239 1.00 0.00 H new ATOM 0 HE22 GLN A 61 58.017 -4.405 24.199 1.00 0.00 H new ATOM 992 N ASP A 62 56.419 2.251 23.390 1.00 0.00 N ATOM 993 CA ASP A 62 55.173 2.971 23.726 1.00 0.00 C ATOM 994 C ASP A 62 54.581 3.572 22.450 1.00 0.00 C ATOM 995 O ASP A 62 53.381 3.588 22.256 1.00 0.00 O ATOM 996 CB ASP A 62 55.481 4.089 24.725 1.00 0.00 C ATOM 997 CG ASP A 62 55.242 3.584 26.148 1.00 0.00 C ATOM 998 OD1 ASP A 62 55.786 2.546 26.487 1.00 0.00 O ATOM 999 OD2 ASP A 62 54.518 4.243 26.876 1.00 0.00 O ATOM 0 H ASP A 62 57.277 2.788 23.512 1.00 0.00 H new ATOM 0 HA ASP A 62 54.458 2.279 24.171 1.00 0.00 H new ATOM 0 HB2 ASP A 62 56.515 4.416 24.613 1.00 0.00 H new ATOM 0 HB3 ASP A 62 54.849 4.954 24.524 1.00 0.00 H new ATOM 1004 N SER A 63 55.416 4.072 21.580 1.00 0.00 N ATOM 1005 CA SER A 63 54.917 4.674 20.330 1.00 0.00 C ATOM 1006 C SER A 63 54.348 3.583 19.414 1.00 0.00 C ATOM 1007 O SER A 63 53.197 3.613 19.030 1.00 0.00 O ATOM 1008 CB SER A 63 56.061 5.353 19.612 1.00 0.00 C ATOM 1009 OG SER A 63 57.088 5.672 20.538 1.00 0.00 O ATOM 0 H SER A 63 56.430 4.085 21.691 1.00 0.00 H new ATOM 0 HA SER A 63 54.137 5.396 20.572 1.00 0.00 H new ATOM 0 HB2 SER A 63 56.452 4.700 18.832 1.00 0.00 H new ATOM 0 HB3 SER A 63 55.707 6.259 19.121 1.00 0.00 H new ATOM 0 HG SER A 63 57.827 6.113 20.068 1.00 0.00 H new ATOM 1015 N MET A 64 55.170 2.641 19.029 1.00 0.00 N ATOM 1016 CA MET A 64 54.711 1.562 18.106 1.00 0.00 C ATOM 1017 C MET A 64 53.474 0.859 18.677 1.00 0.00 C ATOM 1018 O MET A 64 52.775 0.168 17.974 1.00 0.00 O ATOM 1019 CB MET A 64 55.857 0.538 17.884 1.00 0.00 C ATOM 1020 CG MET A 64 55.928 -0.475 19.046 1.00 0.00 C ATOM 1021 SD MET A 64 57.084 -1.801 18.614 1.00 0.00 S ATOM 1022 CE MET A 64 58.513 -1.173 19.529 1.00 0.00 C ATOM 0 H MET A 64 56.146 2.573 19.317 1.00 0.00 H new ATOM 0 HA MET A 64 54.441 2.008 17.149 1.00 0.00 H new ATOM 0 HB2 MET A 64 55.699 0.008 16.945 1.00 0.00 H new ATOM 0 HB3 MET A 64 56.808 1.064 17.797 1.00 0.00 H new ATOM 0 HG2 MET A 64 56.253 0.024 19.959 1.00 0.00 H new ATOM 0 HG3 MET A 64 54.939 -0.889 19.244 1.00 0.00 H new ATOM 0 HE1 MET A 64 59.232 -0.743 18.831 1.00 0.00 H new ATOM 0 HE2 MET A 64 58.187 -0.406 20.232 1.00 0.00 H new ATOM 0 HE3 MET A 64 58.983 -1.990 20.076 1.00 0.00 H new ATOM 1032 N ASP A 65 53.208 1.018 19.947 1.00 0.00 N ATOM 1033 CA ASP A 65 52.025 0.357 20.544 1.00 0.00 C ATOM 1034 C ASP A 65 50.786 1.165 20.222 1.00 0.00 C ATOM 1035 O ASP A 65 49.738 0.619 19.936 1.00 0.00 O ATOM 1036 CB ASP A 65 52.198 0.261 22.062 1.00 0.00 C ATOM 1037 CG ASP A 65 52.435 -1.196 22.458 1.00 0.00 C ATOM 1038 OD1 ASP A 65 53.435 -1.750 22.031 1.00 0.00 O ATOM 1039 OD2 ASP A 65 51.614 -1.734 23.181 1.00 0.00 O ATOM 0 H ASP A 65 53.764 1.579 20.592 1.00 0.00 H new ATOM 0 HA ASP A 65 51.923 -0.647 20.133 1.00 0.00 H new ATOM 0 HB2 ASP A 65 53.038 0.877 22.382 1.00 0.00 H new ATOM 0 HB3 ASP A 65 51.311 0.646 22.565 1.00 0.00 H new ATOM 1044 N HIS A 66 50.891 2.464 20.226 1.00 0.00 N ATOM 1045 CA HIS A 66 49.707 3.277 19.875 1.00 0.00 C ATOM 1046 C HIS A 66 49.458 3.115 18.385 1.00 0.00 C ATOM 1047 O HIS A 66 48.333 3.083 17.935 1.00 0.00 O ATOM 1048 CB HIS A 66 49.919 4.752 20.241 1.00 0.00 C ATOM 1049 CG HIS A 66 50.941 5.367 19.343 1.00 0.00 C ATOM 1050 ND1 HIS A 66 52.167 5.770 19.810 1.00 0.00 N ATOM 1051 CD2 HIS A 66 50.930 5.657 18.009 1.00 0.00 C ATOM 1052 CE1 HIS A 66 52.858 6.269 18.767 1.00 0.00 C ATOM 1053 NE2 HIS A 66 52.146 6.227 17.646 1.00 0.00 N ATOM 0 H HIS A 66 51.736 2.988 20.455 1.00 0.00 H new ATOM 0 HA HIS A 66 48.840 2.936 20.440 1.00 0.00 H new ATOM 0 HB2 HIS A 66 48.977 5.294 20.156 1.00 0.00 H new ATOM 0 HB3 HIS A 66 50.241 4.833 21.279 1.00 0.00 H new ATOM 0 HD1 HIS A 66 52.496 5.704 20.773 1.00 0.00 H new ATOM 0 HD2 HIS A 66 50.104 5.472 17.338 1.00 0.00 H new ATOM 0 HE1 HIS A 66 53.865 6.655 18.834 1.00 0.00 H new ATOM 1061 N LEU A 67 50.505 2.924 17.622 1.00 0.00 N ATOM 1062 CA LEU A 67 50.318 2.663 16.176 1.00 0.00 C ATOM 1063 C LEU A 67 49.771 1.259 16.042 1.00 0.00 C ATOM 1064 O LEU A 67 48.967 0.961 15.181 1.00 0.00 O ATOM 1065 CB LEU A 67 51.661 2.757 15.439 1.00 0.00 C ATOM 1066 CG LEU A 67 52.328 4.083 15.770 1.00 0.00 C ATOM 1067 CD1 LEU A 67 53.734 4.118 15.188 1.00 0.00 C ATOM 1068 CD2 LEU A 67 51.511 5.212 15.167 1.00 0.00 C ATOM 0 H LEU A 67 51.473 2.939 17.942 1.00 0.00 H new ATOM 0 HA LEU A 67 49.638 3.397 15.743 1.00 0.00 H new ATOM 0 HB2 LEU A 67 52.307 1.929 15.731 1.00 0.00 H new ATOM 0 HB3 LEU A 67 51.505 2.675 14.363 1.00 0.00 H new ATOM 0 HG LEU A 67 52.385 4.197 16.852 1.00 0.00 H new ATOM 0 HD11 LEU A 67 54.204 5.071 15.430 1.00 0.00 H new ATOM 0 HD12 LEU A 67 54.323 3.305 15.611 1.00 0.00 H new ATOM 0 HD13 LEU A 67 53.683 4.003 14.105 1.00 0.00 H new ATOM 0 HD21 LEU A 67 51.982 6.167 15.400 1.00 0.00 H new ATOM 0 HD22 LEU A 67 51.460 5.087 14.085 1.00 0.00 H new ATOM 0 HD23 LEU A 67 50.503 5.194 15.582 1.00 0.00 H new ATOM 1080 N ASP A 68 50.171 0.403 16.936 1.00 0.00 N ATOM 1081 CA ASP A 68 49.659 -0.972 16.939 1.00 0.00 C ATOM 1082 C ASP A 68 48.173 -0.941 17.283 1.00 0.00 C ATOM 1083 O ASP A 68 47.468 -1.917 17.126 1.00 0.00 O ATOM 1084 CB ASP A 68 50.428 -1.789 17.987 1.00 0.00 C ATOM 1085 CG ASP A 68 51.083 -2.996 17.315 1.00 0.00 C ATOM 1086 OD1 ASP A 68 50.386 -3.967 17.074 1.00 0.00 O ATOM 1087 OD2 ASP A 68 52.273 -2.928 17.052 1.00 0.00 O ATOM 0 H ASP A 68 50.844 0.612 17.674 1.00 0.00 H new ATOM 0 HA ASP A 68 49.793 -1.432 15.960 1.00 0.00 H new ATOM 0 HB2 ASP A 68 51.187 -1.168 18.462 1.00 0.00 H new ATOM 0 HB3 ASP A 68 49.750 -2.121 18.773 1.00 0.00 H new ATOM 1092 N LYS A 69 47.681 0.188 17.741 1.00 0.00 N ATOM 1093 CA LYS A 69 46.253 0.284 18.072 1.00 0.00 C ATOM 1094 C LYS A 69 45.693 1.625 17.601 1.00 0.00 C ATOM 1095 O LYS A 69 44.856 2.222 18.248 1.00 0.00 O ATOM 1096 CB LYS A 69 46.059 0.142 19.583 1.00 0.00 C ATOM 1097 CG LYS A 69 46.846 1.236 20.303 1.00 0.00 C ATOM 1098 CD LYS A 69 47.250 0.744 21.694 1.00 0.00 C ATOM 1099 CE LYS A 69 46.248 1.260 22.730 1.00 0.00 C ATOM 1100 NZ LYS A 69 45.736 0.116 23.538 1.00 0.00 N ATOM 0 H LYS A 69 48.221 1.039 17.894 1.00 0.00 H new ATOM 0 HA LYS A 69 45.719 -0.519 17.565 1.00 0.00 H new ATOM 0 HB2 LYS A 69 45.001 0.216 19.833 1.00 0.00 H new ATOM 0 HB3 LYS A 69 46.396 -0.841 19.913 1.00 0.00 H new ATOM 0 HG2 LYS A 69 47.733 1.499 19.727 1.00 0.00 H new ATOM 0 HG3 LYS A 69 46.241 2.139 20.387 1.00 0.00 H new ATOM 0 HD2 LYS A 69 47.279 -0.345 21.712 1.00 0.00 H new ATOM 0 HD3 LYS A 69 48.253 1.093 21.938 1.00 0.00 H new ATOM 0 HE2 LYS A 69 46.725 1.993 23.380 1.00 0.00 H new ATOM 0 HE3 LYS A 69 45.421 1.766 22.232 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 45.055 0.466 24.242 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 45.266 -0.568 22.912 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 46.529 -0.348 24.024 1.00 0.00 H new ATOM 1114 N GLN A 70 46.116 2.083 16.458 1.00 0.00 N ATOM 1115 CA GLN A 70 45.574 3.357 15.921 1.00 0.00 C ATOM 1116 C GLN A 70 45.964 3.504 14.440 1.00 0.00 C ATOM 1117 O GLN A 70 46.107 4.598 13.933 1.00 0.00 O ATOM 1118 CB GLN A 70 46.104 4.554 16.750 1.00 0.00 C ATOM 1119 CG GLN A 70 47.509 4.968 16.279 1.00 0.00 C ATOM 1120 CD GLN A 70 47.422 6.290 15.513 1.00 0.00 C ATOM 1121 OE1 GLN A 70 46.784 7.222 15.958 1.00 0.00 O ATOM 1122 NE2 GLN A 70 48.042 6.409 14.370 1.00 0.00 N ATOM 0 H GLN A 70 46.816 1.628 15.872 1.00 0.00 H new ATOM 0 HA GLN A 70 44.487 3.346 15.996 1.00 0.00 H new ATOM 0 HB2 GLN A 70 45.421 5.398 16.655 1.00 0.00 H new ATOM 0 HB3 GLN A 70 46.134 4.285 17.806 1.00 0.00 H new ATOM 0 HG2 GLN A 70 48.174 5.075 17.136 1.00 0.00 H new ATOM 0 HG3 GLN A 70 47.933 4.193 15.641 1.00 0.00 H new ATOM 0 HE21 GLN A 70 48.578 5.626 13.997 1.00 0.00 H new ATOM 0 HE22 GLN A 70 47.990 7.285 13.851 1.00 0.00 H new ATOM 1131 N THR A 71 46.129 2.411 13.748 1.00 0.00 N ATOM 1132 CA THR A 71 46.499 2.489 12.317 1.00 0.00 C ATOM 1133 C THR A 71 45.359 1.931 11.464 1.00 0.00 C ATOM 1134 O THR A 71 45.561 1.495 10.348 1.00 0.00 O ATOM 1135 CB THR A 71 47.770 1.672 12.073 1.00 0.00 C ATOM 1136 OG1 THR A 71 48.092 1.701 10.690 1.00 0.00 O ATOM 1137 CG2 THR A 71 47.541 0.225 12.513 1.00 0.00 C ATOM 0 H THR A 71 46.022 1.466 14.118 1.00 0.00 H new ATOM 0 HA THR A 71 46.679 3.529 12.044 1.00 0.00 H new ATOM 0 HB THR A 71 48.592 2.099 12.648 1.00 0.00 H new ATOM 0 HG1 THR A 71 47.280 1.554 10.162 1.00 0.00 H new ATOM 0 HG21 THR A 71 48.447 -0.356 12.339 1.00 0.00 H new ATOM 0 HG22 THR A 71 47.294 0.202 13.574 1.00 0.00 H new ATOM 0 HG23 THR A 71 46.719 -0.204 11.940 1.00 0.00 H new ATOM 1145 N GLN A 72 44.159 1.942 11.979 1.00 0.00 N ATOM 1146 CA GLN A 72 43.012 1.419 11.202 1.00 0.00 C ATOM 1147 C GLN A 72 41.735 2.153 11.617 1.00 0.00 C ATOM 1148 O GLN A 72 41.556 2.508 12.765 1.00 0.00 O ATOM 1149 CB GLN A 72 42.851 -0.079 11.473 1.00 0.00 C ATOM 1150 CG GLN A 72 42.710 -0.314 12.978 1.00 0.00 C ATOM 1151 CD GLN A 72 42.103 -1.696 13.226 1.00 0.00 C ATOM 1152 OE1 GLN A 72 41.132 -2.067 12.596 1.00 0.00 O ATOM 1153 NE2 GLN A 72 42.637 -2.479 14.123 1.00 0.00 N ATOM 0 H GLN A 72 43.929 2.293 12.908 1.00 0.00 H new ATOM 0 HA GLN A 72 43.192 1.578 10.139 1.00 0.00 H new ATOM 0 HB2 GLN A 72 41.974 -0.461 10.951 1.00 0.00 H new ATOM 0 HB3 GLN A 72 43.713 -0.624 11.089 1.00 0.00 H new ATOM 0 HG2 GLN A 72 43.685 -0.242 13.461 1.00 0.00 H new ATOM 0 HG3 GLN A 72 42.078 0.457 13.419 1.00 0.00 H new ATOM 0 HE21 GLN A 72 43.452 -2.168 14.652 1.00 0.00 H new ATOM 0 HE22 GLN A 72 42.240 -3.402 14.295 1.00 0.00 H new ATOM 1162 N THR A 73 40.844 2.382 10.691 1.00 0.00 N ATOM 1163 CA THR A 73 39.579 3.090 11.031 1.00 0.00 C ATOM 1164 C THR A 73 38.383 2.168 10.739 1.00 0.00 C ATOM 1165 O THR A 73 37.734 2.308 9.722 1.00 0.00 O ATOM 1166 CB THR A 73 39.464 4.361 10.185 1.00 0.00 C ATOM 1167 OG1 THR A 73 40.550 5.227 10.484 1.00 0.00 O ATOM 1168 CG2 THR A 73 38.145 5.067 10.500 1.00 0.00 C ATOM 0 H THR A 73 40.938 2.109 9.713 1.00 0.00 H new ATOM 0 HA THR A 73 39.582 3.357 12.088 1.00 0.00 H new ATOM 0 HB THR A 73 39.489 4.098 9.128 1.00 0.00 H new ATOM 0 HG1 THR A 73 40.479 6.040 9.942 1.00 0.00 H new ATOM 0 HG21 THR A 73 38.064 5.972 9.898 1.00 0.00 H new ATOM 0 HG22 THR A 73 37.312 4.402 10.270 1.00 0.00 H new ATOM 0 HG23 THR A 73 38.117 5.331 11.557 1.00 0.00 H new ATOM 1176 N PRO A 74 38.127 1.243 11.648 1.00 0.00 N ATOM 1177 CA PRO A 74 37.020 0.296 11.494 1.00 0.00 C ATOM 1178 C PRO A 74 35.686 1.046 11.424 1.00 0.00 C ATOM 1179 O PRO A 74 35.638 2.257 11.523 1.00 0.00 O ATOM 1180 CB PRO A 74 37.074 -0.590 12.751 1.00 0.00 C ATOM 1181 CG PRO A 74 38.271 -0.090 13.623 1.00 0.00 C ATOM 1182 CD PRO A 74 38.921 1.087 12.875 1.00 0.00 C ATOM 0 HA PRO A 74 37.104 -0.289 10.578 1.00 0.00 H new ATOM 0 HB2 PRO A 74 36.139 -0.524 13.308 1.00 0.00 H new ATOM 0 HB3 PRO A 74 37.209 -1.637 12.478 1.00 0.00 H new ATOM 0 HG2 PRO A 74 37.924 0.225 14.607 1.00 0.00 H new ATOM 0 HG3 PRO A 74 38.993 -0.891 13.780 1.00 0.00 H new ATOM 0 HD2 PRO A 74 38.901 1.996 13.476 1.00 0.00 H new ATOM 0 HD3 PRO A 74 39.966 0.880 12.645 1.00 0.00 H new ATOM 1190 N LYS A 75 34.605 0.336 11.255 1.00 0.00 N ATOM 1191 CA LYS A 75 33.276 1.008 11.179 1.00 0.00 C ATOM 1192 C LYS A 75 33.301 2.063 10.072 1.00 0.00 C ATOM 1193 O LYS A 75 33.572 3.223 10.313 1.00 0.00 O ATOM 1194 CB LYS A 75 32.968 1.680 12.518 1.00 0.00 C ATOM 1195 CG LYS A 75 31.452 1.827 12.678 1.00 0.00 C ATOM 1196 CD LYS A 75 30.903 0.632 13.459 1.00 0.00 C ATOM 1197 CE LYS A 75 29.413 0.465 13.156 1.00 0.00 C ATOM 1198 NZ LYS A 75 28.947 -0.854 13.669 1.00 0.00 N ATOM 0 H LYS A 75 34.584 -0.680 11.166 1.00 0.00 H new ATOM 0 HA LYS A 75 32.506 0.268 10.958 1.00 0.00 H new ATOM 0 HB2 LYS A 75 33.375 1.087 13.337 1.00 0.00 H new ATOM 0 HB3 LYS A 75 33.446 2.658 12.565 1.00 0.00 H new ATOM 0 HG2 LYS A 75 31.219 2.755 13.201 1.00 0.00 H new ATOM 0 HG3 LYS A 75 30.976 1.885 11.699 1.00 0.00 H new ATOM 0 HD2 LYS A 75 31.444 -0.274 13.186 1.00 0.00 H new ATOM 0 HD3 LYS A 75 31.053 0.783 14.528 1.00 0.00 H new ATOM 0 HE2 LYS A 75 28.844 1.270 13.621 1.00 0.00 H new ATOM 0 HE3 LYS A 75 29.240 0.531 12.082 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 27.934 -0.968 13.463 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 29.482 -1.616 13.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 29.099 -0.900 14.697 1.00 0.00 H new ATOM 1212 N THR A 76 33.022 1.671 8.859 1.00 0.00 N ATOM 1213 CA THR A 76 33.030 2.652 7.739 1.00 0.00 C ATOM 1214 C THR A 76 31.872 2.348 6.786 1.00 0.00 C ATOM 1215 O THR A 76 31.112 1.440 7.079 1.00 0.00 O ATOM 1216 CB THR A 76 34.355 2.549 6.980 1.00 0.00 C ATOM 1217 OG1 THR A 76 34.305 3.375 5.826 1.00 0.00 O ATOM 1218 CG2 THR A 76 34.592 1.098 6.560 1.00 0.00 C ATOM 1219 OXT THR A 76 31.765 3.028 5.778 1.00 0.00 O ATOM 0 H THR A 76 32.789 0.713 8.596 1.00 0.00 H new ATOM 0 HA THR A 76 32.917 3.660 8.138 1.00 0.00 H new ATOM 0 HB THR A 76 35.170 2.877 7.626 1.00 0.00 H new ATOM 0 HG1 THR A 76 33.384 3.677 5.679 1.00 0.00 H new ATOM 0 HG21 THR A 76 35.536 1.025 6.019 1.00 0.00 H new ATOM 0 HG22 THR A 76 34.632 0.465 7.446 1.00 0.00 H new ATOM 0 HG23 THR A 76 33.778 0.768 5.915 1.00 0.00 H new TER 1227 THR A 76 ATOM 1228 N GLN B 1 72.220 19.816 9.278 1.00 0.00 N ATOM 1229 CA GLN B 1 71.093 20.220 8.388 1.00 0.00 C ATOM 1230 C GLN B 1 70.125 19.034 8.191 1.00 0.00 C ATOM 1231 O GLN B 1 68.948 19.158 8.466 1.00 0.00 O ATOM 1232 CB GLN B 1 71.640 20.670 7.029 1.00 0.00 C ATOM 1233 CG GLN B 1 71.207 22.112 6.755 1.00 0.00 C ATOM 1234 CD GLN B 1 72.410 23.045 6.908 1.00 0.00 C ATOM 1235 OE1 GLN B 1 72.738 23.456 8.002 1.00 0.00 O ATOM 1236 NE2 GLN B 1 73.084 23.399 5.848 1.00 0.00 N ATOM 0 H1 GLN B 1 72.391 20.562 9.982 1.00 0.00 H new ATOM 0 H2 GLN B 1 71.978 18.929 9.764 1.00 0.00 H new ATOM 0 H3 GLN B 1 73.079 19.675 8.708 1.00 0.00 H new ATOM 0 HA GLN B 1 70.555 21.047 8.851 1.00 0.00 H new ATOM 0 HB2 GLN B 1 72.728 20.598 7.021 1.00 0.00 H new ATOM 0 HB3 GLN B 1 71.272 20.013 6.241 1.00 0.00 H new ATOM 0 HG2 GLN B 1 70.795 22.194 5.749 1.00 0.00 H new ATOM 0 HG3 GLN B 1 70.417 22.403 7.447 1.00 0.00 H new ATOM 0 HE21 GLN B 1 72.808 23.053 4.929 1.00 0.00 H new ATOM 0 HE22 GLN B 1 73.887 24.021 5.939 1.00 0.00 H new ATOM 1247 N PRO B 2 70.647 17.909 7.715 1.00 0.00 N ATOM 1248 CA PRO B 2 69.822 16.722 7.486 1.00 0.00 C ATOM 1249 C PRO B 2 69.209 16.237 8.804 1.00 0.00 C ATOM 1250 O PRO B 2 69.798 15.453 9.521 1.00 0.00 O ATOM 1251 CB PRO B 2 70.785 15.664 6.922 1.00 0.00 C ATOM 1252 CG PRO B 2 72.203 16.314 6.854 1.00 0.00 C ATOM 1253 CD PRO B 2 72.072 17.754 7.380 1.00 0.00 C ATOM 0 HA PRO B 2 68.995 16.925 6.806 1.00 0.00 H new ATOM 0 HB2 PRO B 2 70.798 14.779 7.558 1.00 0.00 H new ATOM 0 HB3 PRO B 2 70.463 15.340 5.932 1.00 0.00 H new ATOM 0 HG2 PRO B 2 72.914 15.748 7.456 1.00 0.00 H new ATOM 0 HG3 PRO B 2 72.578 16.311 5.831 1.00 0.00 H new ATOM 0 HD2 PRO B 2 72.703 17.914 8.255 1.00 0.00 H new ATOM 0 HD3 PRO B 2 72.382 18.479 6.627 1.00 0.00 H new ATOM 1261 N ASP B 3 68.030 16.696 9.128 1.00 0.00 N ATOM 1262 CA ASP B 3 67.385 16.262 10.389 1.00 0.00 C ATOM 1263 C ASP B 3 66.571 14.992 10.137 1.00 0.00 C ATOM 1264 O ASP B 3 65.420 14.894 10.513 1.00 0.00 O ATOM 1265 CB ASP B 3 66.463 17.368 10.901 1.00 0.00 C ATOM 1266 CG ASP B 3 67.304 18.528 11.437 1.00 0.00 C ATOM 1267 OD1 ASP B 3 68.267 18.888 10.781 1.00 0.00 O ATOM 1268 OD2 ASP B 3 66.969 19.037 12.494 1.00 0.00 O ATOM 0 H ASP B 3 67.488 17.355 8.568 1.00 0.00 H new ATOM 0 HA ASP B 3 68.153 16.058 11.136 1.00 0.00 H new ATOM 0 HB2 ASP B 3 65.815 17.716 10.097 1.00 0.00 H new ATOM 0 HB3 ASP B 3 65.815 16.981 11.688 1.00 0.00 H new ATOM 1273 N ALA B 4 67.163 14.021 9.506 1.00 0.00 N ATOM 1274 CA ALA B 4 66.436 12.752 9.227 1.00 0.00 C ATOM 1275 C ALA B 4 67.435 11.703 8.749 1.00 0.00 C ATOM 1276 O ALA B 4 67.432 11.301 7.603 1.00 0.00 O ATOM 1277 CB ALA B 4 65.386 12.988 8.141 1.00 0.00 C ATOM 0 H ALA B 4 68.125 14.050 9.169 1.00 0.00 H new ATOM 0 HA ALA B 4 65.941 12.406 10.134 1.00 0.00 H new ATOM 0 HB1 ALA B 4 64.856 12.057 7.939 1.00 0.00 H new ATOM 0 HB2 ALA B 4 64.677 13.744 8.479 1.00 0.00 H new ATOM 0 HB3 ALA B 4 65.876 13.331 7.230 1.00 0.00 H new ATOM 1283 N ILE B 5 68.302 11.265 9.617 1.00 0.00 N ATOM 1284 CA ILE B 5 69.313 10.257 9.213 1.00 0.00 C ATOM 1285 C ILE B 5 68.823 8.856 9.579 1.00 0.00 C ATOM 1286 O ILE B 5 69.335 7.866 9.096 1.00 0.00 O ATOM 1287 CB ILE B 5 70.629 10.544 9.929 1.00 0.00 C ATOM 1288 CG1 ILE B 5 71.212 11.858 9.410 1.00 0.00 C ATOM 1289 CG2 ILE B 5 71.610 9.412 9.660 1.00 0.00 C ATOM 1290 CD1 ILE B 5 71.617 12.732 10.594 1.00 0.00 C ATOM 0 H ILE B 5 68.352 11.564 10.591 1.00 0.00 H new ATOM 0 HA ILE B 5 69.466 10.311 8.135 1.00 0.00 H new ATOM 0 HB ILE B 5 70.451 10.623 11.002 1.00 0.00 H new ATOM 0 HG12 ILE B 5 72.077 11.661 8.776 1.00 0.00 H new ATOM 0 HG13 ILE B 5 70.477 12.377 8.794 1.00 0.00 H new ATOM 0 HG21 ILE B 5 72.551 9.616 10.171 1.00 0.00 H new ATOM 0 HG22 ILE B 5 71.193 8.474 10.028 1.00 0.00 H new ATOM 0 HG23 ILE B 5 71.790 9.333 8.588 1.00 0.00 H new ATOM 0 HD11 ILE B 5 72.033 13.670 10.228 1.00 0.00 H new ATOM 0 HD12 ILE B 5 70.742 12.939 11.210 1.00 0.00 H new ATOM 0 HD13 ILE B 5 72.366 12.211 11.191 1.00 0.00 H new ATOM 1302 N ASN B 6 67.823 8.761 10.399 1.00 0.00 N ATOM 1303 CA ASN B 6 67.289 7.419 10.748 1.00 0.00 C ATOM 1304 C ASN B 6 66.220 7.076 9.731 1.00 0.00 C ATOM 1305 O ASN B 6 65.066 6.938 10.052 1.00 0.00 O ATOM 1306 CB ASN B 6 66.671 7.388 12.173 1.00 0.00 C ATOM 1307 CG ASN B 6 66.737 8.767 12.850 1.00 0.00 C ATOM 1308 OD1 ASN B 6 67.519 8.974 13.757 1.00 0.00 O ATOM 1309 ND2 ASN B 6 65.943 9.721 12.442 1.00 0.00 N ATOM 0 H ASN B 6 67.352 9.549 10.843 1.00 0.00 H new ATOM 0 HA ASN B 6 68.106 6.698 10.736 1.00 0.00 H new ATOM 0 HB2 ASN B 6 65.633 7.061 12.113 1.00 0.00 H new ATOM 0 HB3 ASN B 6 67.200 6.657 12.784 1.00 0.00 H new ATOM 0 HD21 ASN B 6 65.980 10.639 12.885 1.00 0.00 H new ATOM 0 HD22 ASN B 6 65.287 9.548 11.681 1.00 0.00 H new ATOM 1316 N ALA B 7 66.588 7.005 8.489 1.00 0.00 N ATOM 1317 CA ALA B 7 65.586 6.725 7.434 1.00 0.00 C ATOM 1318 C ALA B 7 65.762 5.309 6.882 1.00 0.00 C ATOM 1319 O ALA B 7 66.873 4.887 6.628 1.00 0.00 O ATOM 1320 CB ALA B 7 65.785 7.700 6.276 1.00 0.00 C ATOM 0 H ALA B 7 67.544 7.129 8.157 1.00 0.00 H new ATOM 0 HA ALA B 7 64.594 6.830 7.872 1.00 0.00 H new ATOM 0 HB1 ALA B 7 65.049 7.496 5.498 1.00 0.00 H new ATOM 0 HB2 ALA B 7 65.660 8.722 6.635 1.00 0.00 H new ATOM 0 HB3 ALA B 7 66.788 7.579 5.867 1.00 0.00 H new ATOM 1326 N PRO B 8 64.650 4.645 6.611 1.00 0.00 N ATOM 1327 CA PRO B 8 64.691 3.345 5.975 1.00 0.00 C ATOM 1328 C PRO B 8 65.177 3.556 4.557 1.00 0.00 C ATOM 1329 O PRO B 8 64.452 4.039 3.709 1.00 0.00 O ATOM 1330 CB PRO B 8 63.248 2.842 5.979 1.00 0.00 C ATOM 1331 CG PRO B 8 62.362 3.999 6.535 1.00 0.00 C ATOM 1332 CD PRO B 8 63.308 5.142 6.932 1.00 0.00 C ATOM 0 HA PRO B 8 65.347 2.632 6.473 1.00 0.00 H new ATOM 0 HB2 PRO B 8 62.934 2.565 4.973 1.00 0.00 H new ATOM 0 HB3 PRO B 8 63.152 1.951 6.599 1.00 0.00 H new ATOM 0 HG2 PRO B 8 61.648 4.334 5.782 1.00 0.00 H new ATOM 0 HG3 PRO B 8 61.783 3.662 7.395 1.00 0.00 H new ATOM 0 HD2 PRO B 8 63.081 6.054 6.379 1.00 0.00 H new ATOM 0 HD3 PRO B 8 63.217 5.381 7.992 1.00 0.00 H new ATOM 1340 N VAL B 9 66.409 3.287 4.307 1.00 0.00 N ATOM 1341 CA VAL B 9 66.961 3.565 2.971 1.00 0.00 C ATOM 1342 C VAL B 9 66.706 2.367 2.043 1.00 0.00 C ATOM 1343 O VAL B 9 67.437 1.399 2.036 1.00 0.00 O ATOM 1344 CB VAL B 9 68.449 3.802 3.133 1.00 0.00 C ATOM 1345 CG1 VAL B 9 69.072 2.560 3.729 1.00 0.00 C ATOM 1346 CG2 VAL B 9 69.078 4.112 1.789 1.00 0.00 C ATOM 0 H VAL B 9 67.066 2.883 4.975 1.00 0.00 H new ATOM 0 HA VAL B 9 66.486 4.440 2.528 1.00 0.00 H new ATOM 0 HB VAL B 9 68.619 4.653 3.792 1.00 0.00 H new ATOM 0 HG11 VAL B 9 70.144 2.714 3.852 1.00 0.00 H new ATOM 0 HG12 VAL B 9 68.621 2.357 4.700 1.00 0.00 H new ATOM 0 HG13 VAL B 9 68.901 1.713 3.065 1.00 0.00 H new ATOM 0 HG21 VAL B 9 70.147 4.280 1.918 1.00 0.00 H new ATOM 0 HG22 VAL B 9 68.922 3.272 1.112 1.00 0.00 H new ATOM 0 HG23 VAL B 9 68.618 5.007 1.370 1.00 0.00 H new ATOM 1356 N THR B 10 65.663 2.426 1.266 1.00 0.00 N ATOM 1357 CA THR B 10 65.355 1.295 0.353 1.00 0.00 C ATOM 1358 C THR B 10 66.522 1.084 -0.611 1.00 0.00 C ATOM 1359 O THR B 10 66.773 1.891 -1.483 1.00 0.00 O ATOM 1360 CB THR B 10 64.087 1.611 -0.443 1.00 0.00 C ATOM 1361 OG1 THR B 10 63.210 2.390 0.359 1.00 0.00 O ATOM 1362 CG2 THR B 10 63.396 0.307 -0.840 1.00 0.00 C ATOM 0 H THR B 10 65.011 3.209 1.224 1.00 0.00 H new ATOM 0 HA THR B 10 65.200 0.389 0.939 1.00 0.00 H new ATOM 0 HB THR B 10 64.349 2.169 -1.342 1.00 0.00 H new ATOM 0 HG1 THR B 10 62.398 2.595 -0.149 1.00 0.00 H new ATOM 0 HG21 THR B 10 62.493 0.532 -1.407 1.00 0.00 H new ATOM 0 HG22 THR B 10 64.071 -0.290 -1.454 1.00 0.00 H new ATOM 0 HG23 THR B 10 63.131 -0.252 0.057 1.00 0.00 H new ATOM 1370 N CYS B 11 67.233 -0.004 -0.470 1.00 0.00 N ATOM 1371 CA CYS B 11 68.374 -0.271 -1.391 1.00 0.00 C ATOM 1372 C CYS B 11 68.302 -1.717 -1.882 1.00 0.00 C ATOM 1373 O CYS B 11 67.281 -2.368 -1.780 1.00 0.00 O ATOM 1374 CB CYS B 11 69.701 -0.050 -0.662 1.00 0.00 C ATOM 1375 SG CYS B 11 69.642 1.509 0.246 1.00 0.00 S ATOM 0 H CYS B 11 67.073 -0.717 0.242 1.00 0.00 H new ATOM 0 HA CYS B 11 68.314 0.411 -2.239 1.00 0.00 H new ATOM 0 HB2 CYS B 11 69.892 -0.875 0.024 1.00 0.00 H new ATOM 0 HB3 CYS B 11 70.523 -0.034 -1.378 1.00 0.00 H new ATOM 1380 N CYS B 12 69.375 -2.221 -2.420 1.00 0.00 N ATOM 1381 CA CYS B 12 69.367 -3.626 -2.928 1.00 0.00 C ATOM 1382 C CYS B 12 70.649 -4.341 -2.496 1.00 0.00 C ATOM 1383 O CYS B 12 71.509 -3.770 -1.854 1.00 0.00 O ATOM 1384 CB CYS B 12 69.314 -3.630 -4.464 1.00 0.00 C ATOM 1385 SG CYS B 12 68.298 -2.259 -5.062 1.00 0.00 S ATOM 0 H CYS B 12 70.259 -1.724 -2.532 1.00 0.00 H new ATOM 0 HA CYS B 12 68.493 -4.134 -2.521 1.00 0.00 H new ATOM 0 HB2 CYS B 12 70.322 -3.548 -4.869 1.00 0.00 H new ATOM 0 HB3 CYS B 12 68.904 -4.576 -4.818 1.00 0.00 H new ATOM 1390 N TYR B 13 70.798 -5.575 -2.890 1.00 0.00 N ATOM 1391 CA TYR B 13 72.043 -6.330 -2.560 1.00 0.00 C ATOM 1392 C TYR B 13 72.526 -7.059 -3.819 1.00 0.00 C ATOM 1393 O TYR B 13 73.708 -7.141 -4.089 1.00 0.00 O ATOM 1394 CB TYR B 13 71.763 -7.349 -1.451 1.00 0.00 C ATOM 1395 CG TYR B 13 71.561 -6.625 -0.139 1.00 0.00 C ATOM 1396 CD1 TYR B 13 72.407 -5.555 0.208 1.00 0.00 C ATOM 1397 CD2 TYR B 13 70.536 -7.030 0.751 1.00 0.00 C ATOM 1398 CE1 TYR B 13 72.229 -4.884 1.437 1.00 0.00 C ATOM 1399 CE2 TYR B 13 70.362 -6.361 1.979 1.00 0.00 C ATOM 1400 CZ TYR B 13 71.208 -5.289 2.323 1.00 0.00 C ATOM 1401 OH TYR B 13 71.039 -4.633 3.526 1.00 0.00 O ATOM 0 H TYR B 13 70.108 -6.097 -3.430 1.00 0.00 H new ATOM 0 HA TYR B 13 72.809 -5.637 -2.212 1.00 0.00 H new ATOM 0 HB2 TYR B 13 70.877 -7.934 -1.696 1.00 0.00 H new ATOM 0 HB3 TYR B 13 72.594 -8.049 -1.368 1.00 0.00 H new ATOM 0 HD1 TYR B 13 73.193 -5.247 -0.466 1.00 0.00 H new ATOM 0 HD2 TYR B 13 69.887 -7.852 0.488 1.00 0.00 H new ATOM 0 HE1 TYR B 13 72.875 -4.059 1.700 1.00 0.00 H new ATOM 0 HE2 TYR B 13 69.580 -6.670 2.656 1.00 0.00 H new ATOM 0 HH TYR B 13 70.095 -4.666 3.787 1.00 0.00 H new ATOM 1411 N ASN B 14 71.610 -7.561 -4.608 1.00 0.00 N ATOM 1412 CA ASN B 14 71.997 -8.253 -5.867 1.00 0.00 C ATOM 1413 C ASN B 14 71.267 -7.581 -7.030 1.00 0.00 C ATOM 1414 O ASN B 14 70.577 -6.599 -6.845 1.00 0.00 O ATOM 1415 CB ASN B 14 71.594 -9.726 -5.787 1.00 0.00 C ATOM 1416 CG ASN B 14 72.269 -10.372 -4.577 1.00 0.00 C ATOM 1417 OD1 ASN B 14 73.432 -10.716 -4.627 1.00 0.00 O ATOM 1418 ND2 ASN B 14 71.581 -10.552 -3.483 1.00 0.00 N ATOM 0 H ASN B 14 70.607 -7.519 -4.430 1.00 0.00 H new ATOM 0 HA ASN B 14 73.075 -8.190 -6.015 1.00 0.00 H new ATOM 0 HB2 ASN B 14 70.511 -9.814 -5.703 1.00 0.00 H new ATOM 0 HB3 ASN B 14 71.886 -10.245 -6.700 1.00 0.00 H new ATOM 0 HD21 ASN B 14 72.020 -10.982 -2.669 1.00 0.00 H new ATOM 0 HD22 ASN B 14 70.604 -10.263 -3.442 1.00 0.00 H new ATOM 1425 N PHE B 15 71.405 -8.089 -8.223 1.00 0.00 N ATOM 1426 CA PHE B 15 70.706 -7.446 -9.372 1.00 0.00 C ATOM 1427 C PHE B 15 70.352 -8.493 -10.435 1.00 0.00 C ATOM 1428 O PHE B 15 71.216 -9.137 -10.994 1.00 0.00 O ATOM 1429 CB PHE B 15 71.615 -6.382 -9.993 1.00 0.00 C ATOM 1430 CG PHE B 15 71.923 -5.316 -8.967 1.00 0.00 C ATOM 1431 CD1 PHE B 15 70.884 -4.505 -8.459 1.00 0.00 C ATOM 1432 CD2 PHE B 15 73.250 -5.131 -8.515 1.00 0.00 C ATOM 1433 CE1 PHE B 15 71.170 -3.508 -7.501 1.00 0.00 C ATOM 1434 CE2 PHE B 15 73.535 -4.132 -7.557 1.00 0.00 C ATOM 1435 CZ PHE B 15 72.497 -3.320 -7.052 1.00 0.00 C ATOM 0 H PHE B 15 71.964 -8.911 -8.451 1.00 0.00 H new ATOM 0 HA PHE B 15 69.788 -6.983 -9.010 1.00 0.00 H new ATOM 0 HB2 PHE B 15 72.539 -6.840 -10.345 1.00 0.00 H new ATOM 0 HB3 PHE B 15 71.129 -5.936 -10.861 1.00 0.00 H new ATOM 0 HD1 PHE B 15 69.870 -4.648 -8.804 1.00 0.00 H new ATOM 0 HD2 PHE B 15 74.044 -5.752 -8.901 1.00 0.00 H new ATOM 0 HE1 PHE B 15 70.375 -2.889 -7.111 1.00 0.00 H new ATOM 0 HE2 PHE B 15 74.548 -3.990 -7.211 1.00 0.00 H new ATOM 0 HZ PHE B 15 72.717 -2.555 -6.322 1.00 0.00 H new ATOM 1445 N THR B 16 69.079 -8.642 -10.745 1.00 0.00 N ATOM 1446 CA THR B 16 68.676 -9.627 -11.813 1.00 0.00 C ATOM 1447 C THR B 16 69.542 -9.383 -13.052 1.00 0.00 C ATOM 1448 O THR B 16 69.311 -8.463 -13.801 1.00 0.00 O ATOM 1449 CB THR B 16 67.182 -9.445 -12.194 1.00 0.00 C ATOM 1450 OG1 THR B 16 66.997 -9.794 -13.561 1.00 0.00 O ATOM 1451 CG2 THR B 16 66.751 -7.990 -11.985 1.00 0.00 C ATOM 0 H THR B 16 68.310 -8.132 -10.311 1.00 0.00 H new ATOM 0 HA THR B 16 68.817 -10.640 -11.436 1.00 0.00 H new ATOM 0 HB THR B 16 66.576 -10.091 -11.558 1.00 0.00 H new ATOM 0 HG1 THR B 16 67.333 -9.071 -14.131 1.00 0.00 H new ATOM 0 HG21 THR B 16 65.701 -7.879 -12.257 1.00 0.00 H new ATOM 0 HG22 THR B 16 66.886 -7.717 -10.938 1.00 0.00 H new ATOM 0 HG23 THR B 16 67.359 -7.337 -12.611 1.00 0.00 H new ATOM 1459 N ASN B 17 70.549 -10.181 -13.262 1.00 0.00 N ATOM 1460 CA ASN B 17 71.423 -9.957 -14.446 1.00 0.00 C ATOM 1461 C ASN B 17 70.925 -10.786 -15.629 1.00 0.00 C ATOM 1462 O ASN B 17 71.612 -10.945 -16.619 1.00 0.00 O ATOM 1463 CB ASN B 17 72.861 -10.358 -14.107 1.00 0.00 C ATOM 1464 CG ASN B 17 73.782 -9.979 -15.267 1.00 0.00 C ATOM 1465 OD1 ASN B 17 73.380 -9.279 -16.176 1.00 0.00 O ATOM 1466 ND2 ASN B 17 75.013 -10.415 -15.278 1.00 0.00 N ATOM 0 H ASN B 17 70.804 -10.972 -12.671 1.00 0.00 H new ATOM 0 HA ASN B 17 71.394 -8.901 -14.714 1.00 0.00 H new ATOM 0 HB2 ASN B 17 73.184 -9.858 -13.194 1.00 0.00 H new ATOM 0 HB3 ASN B 17 72.916 -11.430 -13.920 1.00 0.00 H new ATOM 0 HD21 ASN B 17 75.635 -10.168 -16.048 1.00 0.00 H new ATOM 0 HD22 ASN B 17 75.353 -11.002 -14.517 1.00 0.00 H new ATOM 1473 N ARG B 18 69.728 -11.292 -15.551 1.00 0.00 N ATOM 1474 CA ARG B 18 69.184 -12.081 -16.686 1.00 0.00 C ATOM 1475 C ARG B 18 68.218 -11.202 -17.471 1.00 0.00 C ATOM 1476 O ARG B 18 67.420 -10.488 -16.901 1.00 0.00 O ATOM 1477 CB ARG B 18 68.445 -13.309 -16.155 1.00 0.00 C ATOM 1478 CG ARG B 18 69.411 -14.491 -16.074 1.00 0.00 C ATOM 1479 CD ARG B 18 68.636 -15.798 -16.250 1.00 0.00 C ATOM 1480 NE ARG B 18 68.162 -15.910 -17.662 1.00 0.00 N ATOM 1481 CZ ARG B 18 67.242 -16.790 -17.991 1.00 0.00 C ATOM 1482 NH1 ARG B 18 66.727 -17.588 -17.086 1.00 0.00 N ATOM 1483 NH2 ARG B 18 66.839 -16.871 -19.229 1.00 0.00 N ATOM 0 H ARG B 18 69.104 -11.193 -14.750 1.00 0.00 H new ATOM 0 HA ARG B 18 69.998 -12.411 -17.332 1.00 0.00 H new ATOM 0 HB2 ARG B 18 68.029 -13.098 -15.170 1.00 0.00 H new ATOM 0 HB3 ARG B 18 67.608 -13.554 -16.809 1.00 0.00 H new ATOM 0 HG2 ARG B 18 70.176 -14.403 -16.846 1.00 0.00 H new ATOM 0 HG3 ARG B 18 69.926 -14.488 -15.113 1.00 0.00 H new ATOM 0 HD2 ARG B 18 69.272 -16.647 -16.000 1.00 0.00 H new ATOM 0 HD3 ARG B 18 67.787 -15.825 -15.567 1.00 0.00 H new ATOM 0 HE ARG B 18 68.555 -15.298 -18.377 1.00 0.00 H new ATOM 0 HH11 ARG B 18 67.040 -17.529 -16.117 1.00 0.00 H new ATOM 0 HH12 ARG B 18 66.014 -18.267 -17.351 1.00 0.00 H new ATOM 0 HH21 ARG B 18 67.237 -16.253 -19.936 1.00 0.00 H new ATOM 0 HH22 ARG B 18 66.126 -17.552 -19.490 1.00 0.00 H new ATOM 1497 N LYS B 19 68.289 -11.232 -18.773 1.00 0.00 N ATOM 1498 CA LYS B 19 67.374 -10.380 -19.585 1.00 0.00 C ATOM 1499 C LYS B 19 65.929 -10.662 -19.183 1.00 0.00 C ATOM 1500 O LYS B 19 65.290 -11.557 -19.700 1.00 0.00 O ATOM 1501 CB LYS B 19 67.564 -10.692 -21.072 1.00 0.00 C ATOM 1502 CG LYS B 19 69.047 -10.590 -21.430 1.00 0.00 C ATOM 1503 CD LYS B 19 69.191 -10.311 -22.928 1.00 0.00 C ATOM 1504 CE LYS B 19 70.627 -9.880 -23.232 1.00 0.00 C ATOM 1505 NZ LYS B 19 71.233 -10.826 -24.211 1.00 0.00 N ATOM 0 H LYS B 19 68.939 -11.807 -19.309 1.00 0.00 H new ATOM 0 HA LYS B 19 67.603 -9.329 -19.407 1.00 0.00 H new ATOM 0 HB2 LYS B 19 67.193 -11.693 -21.295 1.00 0.00 H new ATOM 0 HB3 LYS B 19 66.984 -9.995 -21.677 1.00 0.00 H new ATOM 0 HG2 LYS B 19 69.517 -9.793 -20.854 1.00 0.00 H new ATOM 0 HG3 LYS B 19 69.559 -11.516 -21.171 1.00 0.00 H new ATOM 0 HD2 LYS B 19 68.939 -11.204 -23.501 1.00 0.00 H new ATOM 0 HD3 LYS B 19 68.494 -9.530 -23.232 1.00 0.00 H new ATOM 0 HE2 LYS B 19 70.636 -8.867 -23.635 1.00 0.00 H new ATOM 0 HE3 LYS B 19 71.215 -9.863 -22.314 1.00 0.00 H new ATOM 0 HZ1 LYS B 19 72.209 -10.533 -24.418 1.00 0.00 H new ATOM 0 HZ2 LYS B 19 71.237 -11.786 -23.810 1.00 0.00 H new ATOM 0 HZ3 LYS B 19 70.676 -10.820 -25.089 1.00 0.00 H new ATOM 1519 N ILE B 20 65.412 -9.906 -18.260 1.00 0.00 N ATOM 1520 CA ILE B 20 64.022 -10.119 -17.811 1.00 0.00 C ATOM 1521 C ILE B 20 63.069 -9.550 -18.855 1.00 0.00 C ATOM 1522 O ILE B 20 63.058 -8.370 -19.141 1.00 0.00 O ATOM 1523 CB ILE B 20 63.819 -9.436 -16.454 1.00 0.00 C ATOM 1524 CG1 ILE B 20 64.524 -10.283 -15.371 1.00 0.00 C ATOM 1525 CG2 ILE B 20 62.316 -9.316 -16.144 1.00 0.00 C ATOM 1526 CD1 ILE B 20 63.770 -10.182 -14.044 1.00 0.00 C ATOM 0 H ILE B 20 65.903 -9.142 -17.795 1.00 0.00 H new ATOM 0 HA ILE B 20 63.819 -11.184 -17.696 1.00 0.00 H new ATOM 0 HB ILE B 20 64.244 -8.432 -16.473 1.00 0.00 H new ATOM 0 HG12 ILE B 20 64.575 -11.324 -15.690 1.00 0.00 H new ATOM 0 HG13 ILE B 20 65.550 -9.939 -15.241 1.00 0.00 H new ATOM 0 HG21 ILE B 20 62.181 -8.830 -15.178 1.00 0.00 H new ATOM 0 HG22 ILE B 20 61.831 -8.723 -16.919 1.00 0.00 H new ATOM 0 HG23 ILE B 20 61.870 -10.310 -16.115 1.00 0.00 H new ATOM 0 HD11 ILE B 20 64.278 -10.784 -13.290 1.00 0.00 H new ATOM 0 HD12 ILE B 20 63.742 -9.142 -13.720 1.00 0.00 H new ATOM 0 HD13 ILE B 20 62.752 -10.549 -14.175 1.00 0.00 H new ATOM 1538 N SER B 21 62.288 -10.398 -19.428 1.00 0.00 N ATOM 1539 CA SER B 21 61.323 -9.974 -20.478 1.00 0.00 C ATOM 1540 C SER B 21 60.571 -8.704 -20.054 1.00 0.00 C ATOM 1541 O SER B 21 59.996 -8.634 -18.987 1.00 0.00 O ATOM 1542 CB SER B 21 60.317 -11.098 -20.686 1.00 0.00 C ATOM 1543 OG SER B 21 59.877 -11.096 -22.039 1.00 0.00 O ATOM 0 H SER B 21 62.270 -11.395 -19.214 1.00 0.00 H new ATOM 0 HA SER B 21 61.869 -9.761 -21.397 1.00 0.00 H new ATOM 0 HB2 SER B 21 60.772 -12.058 -20.442 1.00 0.00 H new ATOM 0 HB3 SER B 21 59.467 -10.969 -20.016 1.00 0.00 H new ATOM 0 HG SER B 21 59.231 -11.820 -22.174 1.00 0.00 H new ATOM 1549 N VAL B 22 60.542 -7.714 -20.911 1.00 0.00 N ATOM 1550 CA VAL B 22 59.795 -6.463 -20.602 1.00 0.00 C ATOM 1551 C VAL B 22 58.355 -6.813 -20.183 1.00 0.00 C ATOM 1552 O VAL B 22 57.681 -6.035 -19.539 1.00 0.00 O ATOM 1553 CB VAL B 22 59.785 -5.553 -21.865 1.00 0.00 C ATOM 1554 CG1 VAL B 22 59.695 -6.409 -23.129 1.00 0.00 C ATOM 1555 CG2 VAL B 22 58.571 -4.600 -21.840 1.00 0.00 C ATOM 0 H VAL B 22 61.009 -7.722 -21.818 1.00 0.00 H new ATOM 0 HA VAL B 22 60.278 -5.933 -19.782 1.00 0.00 H new ATOM 0 HB VAL B 22 60.708 -4.973 -21.866 1.00 0.00 H new ATOM 0 HG11 VAL B 22 59.689 -5.763 -24.007 1.00 0.00 H new ATOM 0 HG12 VAL B 22 60.554 -7.078 -23.177 1.00 0.00 H new ATOM 0 HG13 VAL B 22 58.778 -6.998 -23.105 1.00 0.00 H new ATOM 0 HG21 VAL B 22 58.583 -3.973 -22.731 1.00 0.00 H new ATOM 0 HG22 VAL B 22 57.651 -5.184 -21.819 1.00 0.00 H new ATOM 0 HG23 VAL B 22 58.621 -3.970 -20.952 1.00 0.00 H new ATOM 1565 N GLN B 23 57.883 -7.972 -20.548 1.00 0.00 N ATOM 1566 CA GLN B 23 56.514 -8.361 -20.182 1.00 0.00 C ATOM 1567 C GLN B 23 56.458 -8.592 -18.678 1.00 0.00 C ATOM 1568 O GLN B 23 55.565 -8.130 -17.996 1.00 0.00 O ATOM 1569 CB GLN B 23 56.134 -9.644 -20.964 1.00 0.00 C ATOM 1570 CG GLN B 23 55.794 -10.806 -20.012 1.00 0.00 C ATOM 1571 CD GLN B 23 55.221 -11.975 -20.817 1.00 0.00 C ATOM 1572 OE1 GLN B 23 54.085 -12.361 -20.625 1.00 0.00 O ATOM 1573 NE2 GLN B 23 55.966 -12.560 -21.713 1.00 0.00 N ATOM 0 H GLN B 23 58.400 -8.665 -21.089 1.00 0.00 H new ATOM 0 HA GLN B 23 55.802 -7.577 -20.439 1.00 0.00 H new ATOM 0 HB2 GLN B 23 55.279 -9.439 -21.609 1.00 0.00 H new ATOM 0 HB3 GLN B 23 56.960 -9.934 -21.613 1.00 0.00 H new ATOM 0 HG2 GLN B 23 56.688 -11.124 -19.475 1.00 0.00 H new ATOM 0 HG3 GLN B 23 55.073 -10.478 -19.264 1.00 0.00 H new ATOM 0 HE21 GLN B 23 56.920 -12.236 -21.874 1.00 0.00 H new ATOM 0 HE22 GLN B 23 55.595 -13.342 -22.253 1.00 0.00 H new ATOM 1582 N ARG B 24 57.404 -9.313 -18.160 1.00 0.00 N ATOM 1583 CA ARG B 24 57.406 -9.588 -16.713 1.00 0.00 C ATOM 1584 C ARG B 24 57.518 -8.288 -15.952 1.00 0.00 C ATOM 1585 O ARG B 24 57.044 -8.162 -14.846 1.00 0.00 O ATOM 1586 CB ARG B 24 58.597 -10.475 -16.356 1.00 0.00 C ATOM 1587 CG ARG B 24 58.532 -11.760 -17.166 1.00 0.00 C ATOM 1588 CD ARG B 24 57.597 -12.746 -16.476 1.00 0.00 C ATOM 1589 NE ARG B 24 58.036 -14.142 -16.774 1.00 0.00 N ATOM 1590 CZ ARG B 24 57.234 -15.158 -16.541 1.00 0.00 C ATOM 1591 NH1 ARG B 24 56.033 -14.963 -16.050 1.00 0.00 N ATOM 1592 NH2 ARG B 24 57.636 -16.371 -16.803 1.00 0.00 N ATOM 0 H ARG B 24 58.178 -9.724 -18.683 1.00 0.00 H new ATOM 0 HA ARG B 24 56.479 -10.095 -16.447 1.00 0.00 H new ATOM 0 HB2 ARG B 24 59.530 -9.950 -16.561 1.00 0.00 H new ATOM 0 HB3 ARG B 24 58.588 -10.703 -15.290 1.00 0.00 H new ATOM 0 HG2 ARG B 24 58.176 -11.550 -18.175 1.00 0.00 H new ATOM 0 HG3 ARG B 24 59.528 -12.193 -17.263 1.00 0.00 H new ATOM 0 HD2 ARG B 24 57.601 -12.574 -15.400 1.00 0.00 H new ATOM 0 HD3 ARG B 24 56.574 -12.594 -16.819 1.00 0.00 H new ATOM 0 HE ARG B 24 58.965 -14.309 -17.161 1.00 0.00 H new ATOM 0 HH11 ARG B 24 55.713 -14.016 -15.845 1.00 0.00 H new ATOM 0 HH12 ARG B 24 55.419 -15.758 -15.873 1.00 0.00 H new ATOM 0 HH21 ARG B 24 58.568 -16.528 -17.187 1.00 0.00 H new ATOM 0 HH22 ARG B 24 57.018 -17.163 -16.624 1.00 0.00 H new ATOM 1606 N LEU B 25 58.171 -7.336 -16.523 1.00 0.00 N ATOM 1607 CA LEU B 25 58.370 -6.050 -15.828 1.00 0.00 C ATOM 1608 C LEU B 25 57.082 -5.243 -15.812 1.00 0.00 C ATOM 1609 O LEU B 25 56.734 -4.579 -16.769 1.00 0.00 O ATOM 1610 CB LEU B 25 59.467 -5.270 -16.531 1.00 0.00 C ATOM 1611 CG LEU B 25 60.742 -6.125 -16.558 1.00 0.00 C ATOM 1612 CD1 LEU B 25 61.903 -5.298 -17.088 1.00 0.00 C ATOM 1613 CD2 LEU B 25 61.068 -6.604 -15.140 1.00 0.00 C ATOM 0 H LEU B 25 58.582 -7.392 -17.455 1.00 0.00 H new ATOM 0 HA LEU B 25 58.661 -6.243 -14.795 1.00 0.00 H new ATOM 0 HB2 LEU B 25 59.160 -5.018 -17.546 1.00 0.00 H new ATOM 0 HB3 LEU B 25 59.654 -4.330 -16.012 1.00 0.00 H new ATOM 0 HG LEU B 25 60.583 -6.986 -17.208 1.00 0.00 H new ATOM 0 HD11 LEU B 25 62.806 -5.908 -17.106 1.00 0.00 H new ATOM 0 HD12 LEU B 25 61.676 -4.957 -18.098 1.00 0.00 H new ATOM 0 HD13 LEU B 25 62.061 -4.435 -16.441 1.00 0.00 H new ATOM 0 HD21 LEU B 25 61.973 -7.211 -15.160 1.00 0.00 H new ATOM 0 HD22 LEU B 25 61.223 -5.742 -14.491 1.00 0.00 H new ATOM 0 HD23 LEU B 25 60.240 -7.201 -14.758 1.00 0.00 H new ATOM 1625 N ALA B 26 56.374 -5.294 -14.725 1.00 0.00 N ATOM 1626 CA ALA B 26 55.107 -4.534 -14.622 1.00 0.00 C ATOM 1627 C ALA B 26 55.403 -3.049 -14.376 1.00 0.00 C ATOM 1628 O ALA B 26 54.576 -2.194 -14.618 1.00 0.00 O ATOM 1629 CB ALA B 26 54.286 -5.076 -13.456 1.00 0.00 C ATOM 0 H ALA B 26 56.622 -5.835 -13.896 1.00 0.00 H new ATOM 0 HA ALA B 26 54.551 -4.642 -15.553 1.00 0.00 H new ATOM 0 HB1 ALA B 26 53.353 -4.518 -13.378 1.00 0.00 H new ATOM 0 HB2 ALA B 26 54.066 -6.130 -13.625 1.00 0.00 H new ATOM 0 HB3 ALA B 26 54.852 -4.967 -12.531 1.00 0.00 H new ATOM 1635 N SER B 27 56.569 -2.740 -13.878 1.00 0.00 N ATOM 1636 CA SER B 27 56.907 -1.310 -13.597 1.00 0.00 C ATOM 1637 C SER B 27 58.380 -1.199 -13.186 1.00 0.00 C ATOM 1638 O SER B 27 59.094 -2.181 -13.136 1.00 0.00 O ATOM 1639 CB SER B 27 56.024 -0.793 -12.461 1.00 0.00 C ATOM 1640 OG SER B 27 55.663 -1.877 -11.614 1.00 0.00 O ATOM 0 H SER B 27 57.303 -3.412 -13.653 1.00 0.00 H new ATOM 0 HA SER B 27 56.736 -0.716 -14.494 1.00 0.00 H new ATOM 0 HB2 SER B 27 56.555 -0.032 -11.890 1.00 0.00 H new ATOM 0 HB3 SER B 27 55.130 -0.320 -12.867 1.00 0.00 H new ATOM 0 HG SER B 27 55.098 -1.548 -10.884 1.00 0.00 H new ATOM 1646 N TYR B 28 58.846 -0.006 -12.911 1.00 0.00 N ATOM 1647 CA TYR B 28 60.279 0.159 -12.526 1.00 0.00 C ATOM 1648 C TYR B 28 60.426 1.401 -11.610 1.00 0.00 C ATOM 1649 O TYR B 28 59.821 2.429 -11.845 1.00 0.00 O ATOM 1650 CB TYR B 28 61.113 0.296 -13.829 1.00 0.00 C ATOM 1651 CG TYR B 28 61.908 1.580 -13.870 1.00 0.00 C ATOM 1652 CD1 TYR B 28 61.249 2.806 -14.105 1.00 0.00 C ATOM 1653 CD2 TYR B 28 63.297 1.557 -13.632 1.00 0.00 C ATOM 1654 CE1 TYR B 28 61.980 4.009 -14.111 1.00 0.00 C ATOM 1655 CE2 TYR B 28 64.032 2.759 -13.633 1.00 0.00 C ATOM 1656 CZ TYR B 28 63.375 3.989 -13.875 1.00 0.00 C ATOM 1657 OH TYR B 28 64.092 5.167 -13.876 1.00 0.00 O ATOM 0 H TYR B 28 58.299 0.855 -12.936 1.00 0.00 H new ATOM 0 HA TYR B 28 60.642 -0.703 -11.966 1.00 0.00 H new ATOM 0 HB2 TYR B 28 61.793 -0.552 -13.913 1.00 0.00 H new ATOM 0 HB3 TYR B 28 60.446 0.257 -14.690 1.00 0.00 H new ATOM 0 HD1 TYR B 28 60.183 2.821 -14.280 1.00 0.00 H new ATOM 0 HD2 TYR B 28 63.798 0.618 -13.449 1.00 0.00 H new ATOM 0 HE1 TYR B 28 61.476 4.946 -14.296 1.00 0.00 H new ATOM 0 HE2 TYR B 28 65.096 2.742 -13.449 1.00 0.00 H new ATOM 0 HH TYR B 28 63.515 5.901 -13.579 1.00 0.00 H new ATOM 1667 N ARG B 29 61.219 1.303 -10.569 1.00 0.00 N ATOM 1668 CA ARG B 29 61.393 2.469 -9.644 1.00 0.00 C ATOM 1669 C ARG B 29 62.876 2.623 -9.279 1.00 0.00 C ATOM 1670 O ARG B 29 63.307 2.204 -8.231 1.00 0.00 O ATOM 1671 CB ARG B 29 60.578 2.235 -8.370 1.00 0.00 C ATOM 1672 CG ARG B 29 59.175 1.751 -8.742 1.00 0.00 C ATOM 1673 CD ARG B 29 58.394 1.426 -7.467 1.00 0.00 C ATOM 1674 NE ARG B 29 56.935 1.360 -7.781 1.00 0.00 N ATOM 1675 CZ ARG B 29 56.043 1.388 -6.814 1.00 0.00 C ATOM 1676 NH1 ARG B 29 56.419 1.472 -5.560 1.00 0.00 N ATOM 1677 NH2 ARG B 29 54.772 1.328 -7.106 1.00 0.00 N ATOM 0 H ARG B 29 61.752 0.469 -10.320 1.00 0.00 H new ATOM 0 HA ARG B 29 61.046 3.376 -10.139 1.00 0.00 H new ATOM 0 HB2 ARG B 29 61.073 1.497 -7.739 1.00 0.00 H new ATOM 0 HB3 ARG B 29 60.515 3.157 -7.792 1.00 0.00 H new ATOM 0 HG2 ARG B 29 58.654 2.518 -9.315 1.00 0.00 H new ATOM 0 HG3 ARG B 29 59.240 0.867 -9.377 1.00 0.00 H new ATOM 0 HD2 ARG B 29 58.731 0.476 -7.053 1.00 0.00 H new ATOM 0 HD3 ARG B 29 58.580 2.187 -6.710 1.00 0.00 H new ATOM 0 HE ARG B 29 56.628 1.293 -8.751 1.00 0.00 H new ATOM 0 HH11 ARG B 29 57.411 1.516 -5.327 1.00 0.00 H new ATOM 0 HH12 ARG B 29 55.719 1.493 -4.818 1.00 0.00 H new ATOM 0 HH21 ARG B 29 54.475 1.260 -8.079 1.00 0.00 H new ATOM 0 HH22 ARG B 29 54.076 1.349 -6.361 1.00 0.00 H new ATOM 1691 N ARG B 30 63.656 3.216 -10.150 1.00 0.00 N ATOM 1692 CA ARG B 30 65.132 3.388 -9.886 1.00 0.00 C ATOM 1693 C ARG B 30 65.406 3.741 -8.411 1.00 0.00 C ATOM 1694 O ARG B 30 64.876 4.695 -7.878 1.00 0.00 O ATOM 1695 CB ARG B 30 65.670 4.510 -10.777 1.00 0.00 C ATOM 1696 CG ARG B 30 67.131 4.225 -11.128 1.00 0.00 C ATOM 1697 CD ARG B 30 67.530 5.044 -12.358 1.00 0.00 C ATOM 1698 NE ARG B 30 68.645 5.970 -11.998 1.00 0.00 N ATOM 1699 CZ ARG B 30 68.966 6.969 -12.791 1.00 0.00 C ATOM 1700 NH1 ARG B 30 68.313 7.171 -13.911 1.00 0.00 N ATOM 1701 NH2 ARG B 30 69.944 7.767 -12.459 1.00 0.00 N ATOM 0 H ARG B 30 63.337 3.594 -11.042 1.00 0.00 H new ATOM 0 HA ARG B 30 65.631 2.445 -10.108 1.00 0.00 H new ATOM 0 HB2 ARG B 30 65.074 4.584 -11.687 1.00 0.00 H new ATOM 0 HB3 ARG B 30 65.588 5.468 -10.263 1.00 0.00 H new ATOM 0 HG2 ARG B 30 67.774 4.478 -10.285 1.00 0.00 H new ATOM 0 HG3 ARG B 30 67.268 3.162 -11.326 1.00 0.00 H new ATOM 0 HD2 ARG B 30 67.840 4.380 -13.165 1.00 0.00 H new ATOM 0 HD3 ARG B 30 66.674 5.612 -12.723 1.00 0.00 H new ATOM 0 HE ARG B 30 69.162 5.827 -11.130 1.00 0.00 H new ATOM 0 HH11 ARG B 30 67.548 6.550 -14.174 1.00 0.00 H new ATOM 0 HH12 ARG B 30 68.571 7.949 -14.518 1.00 0.00 H new ATOM 0 HH21 ARG B 30 70.454 7.614 -11.589 1.00 0.00 H new ATOM 0 HH22 ARG B 30 70.198 8.544 -13.069 1.00 0.00 H new ATOM 1715 N ILE B 31 66.266 2.983 -7.763 1.00 0.00 N ATOM 1716 CA ILE B 31 66.618 3.275 -6.338 1.00 0.00 C ATOM 1717 C ILE B 31 67.846 4.199 -6.296 1.00 0.00 C ATOM 1718 O ILE B 31 68.898 3.871 -6.807 1.00 0.00 O ATOM 1719 CB ILE B 31 66.928 1.943 -5.594 1.00 0.00 C ATOM 1720 CG1 ILE B 31 65.643 1.430 -4.922 1.00 0.00 C ATOM 1721 CG2 ILE B 31 68.020 2.159 -4.521 1.00 0.00 C ATOM 1722 CD1 ILE B 31 65.969 0.238 -4.006 1.00 0.00 C ATOM 0 H ILE B 31 66.739 2.173 -8.165 1.00 0.00 H new ATOM 0 HA ILE B 31 65.780 3.769 -5.847 1.00 0.00 H new ATOM 0 HB ILE B 31 67.291 1.211 -6.316 1.00 0.00 H new ATOM 0 HG12 ILE B 31 65.182 2.229 -4.342 1.00 0.00 H new ATOM 0 HG13 ILE B 31 64.921 1.129 -5.681 1.00 0.00 H new ATOM 0 HG21 ILE B 31 68.222 1.216 -4.013 1.00 0.00 H new ATOM 0 HG22 ILE B 31 68.933 2.517 -4.998 1.00 0.00 H new ATOM 0 HG23 ILE B 31 67.676 2.896 -3.795 1.00 0.00 H new ATOM 0 HD11 ILE B 31 65.054 -0.119 -3.534 1.00 0.00 H new ATOM 0 HD12 ILE B 31 66.410 -0.565 -4.597 1.00 0.00 H new ATOM 0 HD13 ILE B 31 66.675 0.552 -3.237 1.00 0.00 H new ATOM 1734 N THR B 32 67.726 5.320 -5.644 1.00 0.00 N ATOM 1735 CA THR B 32 68.887 6.244 -5.517 1.00 0.00 C ATOM 1736 C THR B 32 68.648 7.172 -4.327 1.00 0.00 C ATOM 1737 O THR B 32 68.850 8.368 -4.405 1.00 0.00 O ATOM 1738 CB THR B 32 69.038 7.076 -6.793 1.00 0.00 C ATOM 1739 OG1 THR B 32 67.798 7.698 -7.102 1.00 0.00 O ATOM 1740 CG2 THR B 32 69.459 6.172 -7.949 1.00 0.00 C ATOM 0 H THR B 32 66.869 5.638 -5.191 1.00 0.00 H new ATOM 0 HA THR B 32 69.799 5.666 -5.365 1.00 0.00 H new ATOM 0 HB THR B 32 69.800 7.840 -6.639 1.00 0.00 H new ATOM 0 HG1 THR B 32 67.894 8.232 -7.918 1.00 0.00 H new ATOM 0 HG21 THR B 32 69.566 6.767 -8.856 1.00 0.00 H new ATOM 0 HG22 THR B 32 70.411 5.698 -7.712 1.00 0.00 H new ATOM 0 HG23 THR B 32 68.701 5.405 -8.106 1.00 0.00 H new ATOM 1748 N SER B 33 68.201 6.627 -3.226 1.00 0.00 N ATOM 1749 CA SER B 33 67.923 7.471 -2.029 1.00 0.00 C ATOM 1750 C SER B 33 69.150 8.330 -1.703 1.00 0.00 C ATOM 1751 O SER B 33 69.255 9.464 -2.126 1.00 0.00 O ATOM 1752 CB SER B 33 67.596 6.571 -0.836 1.00 0.00 C ATOM 1753 OG SER B 33 67.692 7.325 0.364 1.00 0.00 O ATOM 0 H SER B 33 68.016 5.631 -3.105 1.00 0.00 H new ATOM 0 HA SER B 33 67.075 8.123 -2.237 1.00 0.00 H new ATOM 0 HB2 SER B 33 66.592 6.160 -0.941 1.00 0.00 H new ATOM 0 HB3 SER B 33 68.284 5.727 -0.804 1.00 0.00 H new ATOM 0 HG SER B 33 67.330 6.802 1.109 1.00 0.00 H new ATOM 1759 N SER B 34 70.077 7.804 -0.948 1.00 0.00 N ATOM 1760 CA SER B 34 71.287 8.595 -0.594 1.00 0.00 C ATOM 1761 C SER B 34 72.273 7.706 0.166 1.00 0.00 C ATOM 1762 O SER B 34 73.467 7.765 -0.047 1.00 0.00 O ATOM 1763 CB SER B 34 70.883 9.777 0.287 1.00 0.00 C ATOM 1764 OG SER B 34 72.041 10.320 0.909 1.00 0.00 O ATOM 0 H SER B 34 70.047 6.860 -0.562 1.00 0.00 H new ATOM 0 HA SER B 34 71.759 8.965 -1.504 1.00 0.00 H new ATOM 0 HB2 SER B 34 70.388 10.540 -0.314 1.00 0.00 H new ATOM 0 HB3 SER B 34 70.168 9.453 1.044 1.00 0.00 H new ATOM 0 HG SER B 34 71.784 11.079 1.473 1.00 0.00 H new ATOM 1770 N LYS B 35 71.783 6.878 1.048 1.00 0.00 N ATOM 1771 CA LYS B 35 72.696 5.985 1.814 1.00 0.00 C ATOM 1772 C LYS B 35 72.885 4.662 1.056 1.00 0.00 C ATOM 1773 O LYS B 35 73.764 3.883 1.367 1.00 0.00 O ATOM 1774 CB LYS B 35 72.102 5.692 3.196 1.00 0.00 C ATOM 1775 CG LYS B 35 71.872 6.993 3.970 1.00 0.00 C ATOM 1776 CD LYS B 35 73.180 7.786 4.059 1.00 0.00 C ATOM 1777 CE LYS B 35 74.222 6.973 4.829 1.00 0.00 C ATOM 1778 NZ LYS B 35 75.433 6.786 3.981 1.00 0.00 N ATOM 0 H LYS B 35 70.792 6.782 1.270 1.00 0.00 H new ATOM 0 HA LYS B 35 73.659 6.482 1.930 1.00 0.00 H new ATOM 0 HB2 LYS B 35 71.159 5.156 3.086 1.00 0.00 H new ATOM 0 HB3 LYS B 35 72.774 5.043 3.757 1.00 0.00 H new ATOM 0 HG2 LYS B 35 71.107 7.591 3.474 1.00 0.00 H new ATOM 0 HG3 LYS B 35 71.503 6.770 4.971 1.00 0.00 H new ATOM 0 HD2 LYS B 35 73.548 8.013 3.058 1.00 0.00 H new ATOM 0 HD3 LYS B 35 73.006 8.739 4.559 1.00 0.00 H new ATOM 0 HE2 LYS B 35 74.488 7.486 5.753 1.00 0.00 H new ATOM 0 HE3 LYS B 35 73.808 6.004 5.109 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 76.246 6.547 4.584 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 75.267 6.015 3.303 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 75.633 7.665 3.463 1.00 0.00 H new ATOM 1792 N CYS B 36 72.066 4.396 0.067 1.00 0.00 N ATOM 1793 CA CYS B 36 72.211 3.116 -0.692 1.00 0.00 C ATOM 1794 C CYS B 36 73.634 3.012 -1.258 1.00 0.00 C ATOM 1795 O CYS B 36 74.063 3.869 -2.003 1.00 0.00 O ATOM 1796 CB CYS B 36 71.201 3.078 -1.848 1.00 0.00 C ATOM 1797 SG CYS B 36 69.516 2.928 -1.192 1.00 0.00 S ATOM 0 H CYS B 36 71.310 5.005 -0.245 1.00 0.00 H new ATOM 0 HA CYS B 36 72.022 2.279 -0.019 1.00 0.00 H new ATOM 0 HB2 CYS B 36 71.288 3.984 -2.448 1.00 0.00 H new ATOM 0 HB3 CYS B 36 71.420 2.237 -2.506 1.00 0.00 H new ATOM 1802 N PRO B 37 74.330 1.948 -0.888 1.00 0.00 N ATOM 1803 CA PRO B 37 75.692 1.723 -1.359 1.00 0.00 C ATOM 1804 C PRO B 37 75.714 1.573 -2.879 1.00 0.00 C ATOM 1805 O PRO B 37 76.746 1.692 -3.510 1.00 0.00 O ATOM 1806 CB PRO B 37 76.131 0.409 -0.695 1.00 0.00 C ATOM 1807 CG PRO B 37 74.937 -0.109 0.160 1.00 0.00 C ATOM 1808 CD PRO B 37 73.804 0.913 0.017 1.00 0.00 C ATOM 0 HA PRO B 37 76.351 2.554 -1.109 1.00 0.00 H new ATOM 0 HB2 PRO B 37 76.409 -0.327 -1.449 1.00 0.00 H new ATOM 0 HB3 PRO B 37 77.008 0.571 -0.069 1.00 0.00 H new ATOM 0 HG2 PRO B 37 74.615 -1.092 -0.184 1.00 0.00 H new ATOM 0 HG3 PRO B 37 75.229 -0.217 1.205 1.00 0.00 H new ATOM 0 HD2 PRO B 37 72.906 0.451 -0.393 1.00 0.00 H new ATOM 0 HD3 PRO B 37 73.531 1.337 0.984 1.00 0.00 H new ATOM 1816 N LYS B 38 74.592 1.286 -3.471 1.00 0.00 N ATOM 1817 CA LYS B 38 74.560 1.099 -4.937 1.00 0.00 C ATOM 1818 C LYS B 38 73.184 1.474 -5.493 1.00 0.00 C ATOM 1819 O LYS B 38 72.165 1.034 -5.000 1.00 0.00 O ATOM 1820 CB LYS B 38 74.843 -0.367 -5.261 1.00 0.00 C ATOM 1821 CG LYS B 38 76.349 -0.626 -5.205 1.00 0.00 C ATOM 1822 CD LYS B 38 76.756 -1.526 -6.375 1.00 0.00 C ATOM 1823 CE LYS B 38 78.246 -1.850 -6.274 1.00 0.00 C ATOM 1824 NZ LYS B 38 78.494 -2.676 -5.057 1.00 0.00 N ATOM 0 H LYS B 38 73.695 1.173 -2.998 1.00 0.00 H new ATOM 0 HA LYS B 38 75.315 1.741 -5.391 1.00 0.00 H new ATOM 0 HB2 LYS B 38 74.327 -1.013 -4.551 1.00 0.00 H new ATOM 0 HB3 LYS B 38 74.459 -0.611 -6.251 1.00 0.00 H new ATOM 0 HG2 LYS B 38 76.893 0.317 -5.252 1.00 0.00 H new ATOM 0 HG3 LYS B 38 76.612 -1.100 -4.259 1.00 0.00 H new ATOM 0 HD2 LYS B 38 76.171 -2.446 -6.361 1.00 0.00 H new ATOM 0 HD3 LYS B 38 76.544 -1.028 -7.321 1.00 0.00 H new ATOM 0 HE2 LYS B 38 78.573 -2.387 -7.164 1.00 0.00 H new ATOM 0 HE3 LYS B 38 78.827 -0.929 -6.226 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 79.385 -3.200 -5.169 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 78.559 -2.056 -4.224 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 77.711 -3.348 -4.928 1.00 0.00 H new ATOM 1838 N GLU B 39 73.149 2.239 -6.553 1.00 0.00 N ATOM 1839 CA GLU B 39 71.841 2.585 -7.177 1.00 0.00 C ATOM 1840 C GLU B 39 71.289 1.324 -7.845 1.00 0.00 C ATOM 1841 O GLU B 39 71.916 0.282 -7.817 1.00 0.00 O ATOM 1842 CB GLU B 39 72.046 3.677 -8.230 1.00 0.00 C ATOM 1843 CG GLU B 39 72.836 4.835 -7.615 1.00 0.00 C ATOM 1844 CD GLU B 39 74.044 5.154 -8.498 1.00 0.00 C ATOM 1845 OE1 GLU B 39 73.837 5.484 -9.655 1.00 0.00 O ATOM 1846 OE2 GLU B 39 75.155 5.064 -8.003 1.00 0.00 O ATOM 0 H GLU B 39 73.968 2.637 -7.011 1.00 0.00 H new ATOM 0 HA GLU B 39 71.145 2.952 -6.423 1.00 0.00 H new ATOM 0 HB2 GLU B 39 72.581 3.273 -9.089 1.00 0.00 H new ATOM 0 HB3 GLU B 39 71.082 4.033 -8.593 1.00 0.00 H new ATOM 0 HG2 GLU B 39 72.199 5.714 -7.521 1.00 0.00 H new ATOM 0 HG3 GLU B 39 73.166 4.571 -6.610 1.00 0.00 H new ATOM 1853 N ALA B 40 70.130 1.391 -8.441 1.00 0.00 N ATOM 1854 CA ALA B 40 69.577 0.167 -9.091 1.00 0.00 C ATOM 1855 C ALA B 40 68.248 0.480 -9.774 1.00 0.00 C ATOM 1856 O ALA B 40 67.849 1.618 -9.899 1.00 0.00 O ATOM 1857 CB ALA B 40 69.349 -0.903 -8.024 1.00 0.00 C ATOM 0 H ALA B 40 69.549 2.227 -8.507 1.00 0.00 H new ATOM 0 HA ALA B 40 70.285 -0.188 -9.840 1.00 0.00 H new ATOM 0 HB1 ALA B 40 68.945 -1.801 -8.490 1.00 0.00 H new ATOM 0 HB2 ALA B 40 70.296 -1.141 -7.539 1.00 0.00 H new ATOM 0 HB3 ALA B 40 68.644 -0.531 -7.281 1.00 0.00 H new ATOM 1863 N VAL B 41 67.552 -0.540 -10.191 1.00 0.00 N ATOM 1864 CA VAL B 41 66.224 -0.340 -10.833 1.00 0.00 C ATOM 1865 C VAL B 41 65.235 -1.283 -10.177 1.00 0.00 C ATOM 1866 O VAL B 41 65.412 -2.481 -10.190 1.00 0.00 O ATOM 1867 CB VAL B 41 66.308 -0.646 -12.344 1.00 0.00 C ATOM 1868 CG1 VAL B 41 65.037 -1.384 -12.812 1.00 0.00 C ATOM 1869 CG2 VAL B 41 66.424 0.662 -13.109 1.00 0.00 C ATOM 0 H VAL B 41 67.850 -1.513 -10.114 1.00 0.00 H new ATOM 0 HA VAL B 41 65.905 0.695 -10.709 1.00 0.00 H new ATOM 0 HB VAL B 41 67.178 -1.276 -12.530 1.00 0.00 H new ATOM 0 HG11 VAL B 41 65.110 -1.593 -13.879 1.00 0.00 H new ATOM 0 HG12 VAL B 41 64.938 -2.321 -12.264 1.00 0.00 H new ATOM 0 HG13 VAL B 41 64.164 -0.760 -12.624 1.00 0.00 H new ATOM 0 HG21 VAL B 41 66.484 0.455 -14.177 1.00 0.00 H new ATOM 0 HG22 VAL B 41 65.549 1.280 -12.908 1.00 0.00 H new ATOM 0 HG23 VAL B 41 67.323 1.191 -12.791 1.00 0.00 H new ATOM 1879 N ILE B 42 64.186 -0.774 -9.635 1.00 0.00 N ATOM 1880 CA ILE B 42 63.202 -1.667 -9.007 1.00 0.00 C ATOM 1881 C ILE B 42 62.234 -2.180 -10.060 1.00 0.00 C ATOM 1882 O ILE B 42 61.113 -1.729 -10.153 1.00 0.00 O ATOM 1883 CB ILE B 42 62.444 -0.921 -7.935 1.00 0.00 C ATOM 1884 CG1 ILE B 42 63.441 -0.175 -7.042 1.00 0.00 C ATOM 1885 CG2 ILE B 42 61.647 -1.924 -7.110 1.00 0.00 C ATOM 1886 CD1 ILE B 42 64.259 -1.174 -6.235 1.00 0.00 C ATOM 0 H ILE B 42 63.965 0.221 -9.599 1.00 0.00 H new ATOM 0 HA ILE B 42 63.721 -2.511 -8.553 1.00 0.00 H new ATOM 0 HB ILE B 42 61.761 -0.200 -8.384 1.00 0.00 H new ATOM 0 HG12 ILE B 42 64.101 0.440 -7.653 1.00 0.00 H new ATOM 0 HG13 ILE B 42 62.909 0.499 -6.371 1.00 0.00 H new ATOM 0 HG21 ILE B 42 61.095 -1.398 -6.332 1.00 0.00 H new ATOM 0 HG22 ILE B 42 60.947 -2.453 -7.757 1.00 0.00 H new ATOM 0 HG23 ILE B 42 62.328 -2.640 -6.650 1.00 0.00 H new ATOM 0 HD11 ILE B 42 64.966 -0.638 -5.602 1.00 0.00 H new ATOM 0 HD12 ILE B 42 63.593 -1.770 -5.611 1.00 0.00 H new ATOM 0 HD13 ILE B 42 64.804 -1.830 -6.913 1.00 0.00 H new ATOM 1898 N PHE B 43 62.657 -3.125 -10.847 1.00 0.00 N ATOM 1899 CA PHE B 43 61.764 -3.681 -11.893 1.00 0.00 C ATOM 1900 C PHE B 43 60.599 -4.422 -11.228 1.00 0.00 C ATOM 1901 O PHE B 43 60.651 -5.619 -11.030 1.00 0.00 O ATOM 1902 CB PHE B 43 62.555 -4.664 -12.762 1.00 0.00 C ATOM 1903 CG PHE B 43 63.285 -3.920 -13.858 1.00 0.00 C ATOM 1904 CD1 PHE B 43 62.630 -2.903 -14.593 1.00 0.00 C ATOM 1905 CD2 PHE B 43 64.625 -4.250 -14.156 1.00 0.00 C ATOM 1906 CE1 PHE B 43 63.321 -2.220 -15.621 1.00 0.00 C ATOM 1907 CE2 PHE B 43 65.309 -3.566 -15.185 1.00 0.00 C ATOM 1908 CZ PHE B 43 64.656 -2.552 -15.916 1.00 0.00 C ATOM 0 H PHE B 43 63.589 -3.538 -10.810 1.00 0.00 H new ATOM 0 HA PHE B 43 61.377 -2.870 -12.511 1.00 0.00 H new ATOM 0 HB2 PHE B 43 63.268 -5.212 -12.147 1.00 0.00 H new ATOM 0 HB3 PHE B 43 61.880 -5.400 -13.199 1.00 0.00 H new ATOM 0 HD1 PHE B 43 61.604 -2.649 -14.369 1.00 0.00 H new ATOM 0 HD2 PHE B 43 65.127 -5.026 -13.597 1.00 0.00 H new ATOM 0 HE1 PHE B 43 62.823 -1.442 -16.181 1.00 0.00 H new ATOM 0 HE2 PHE B 43 66.334 -3.820 -15.412 1.00 0.00 H new ATOM 0 HZ PHE B 43 65.181 -2.030 -16.703 1.00 0.00 H new ATOM 1918 N LYS B 44 59.542 -3.729 -10.892 1.00 0.00 N ATOM 1919 CA LYS B 44 58.385 -4.418 -10.256 1.00 0.00 C ATOM 1920 C LYS B 44 57.790 -5.385 -11.264 1.00 0.00 C ATOM 1921 O LYS B 44 57.061 -4.992 -12.144 1.00 0.00 O ATOM 1922 CB LYS B 44 57.321 -3.390 -9.858 1.00 0.00 C ATOM 1923 CG LYS B 44 57.122 -3.420 -8.341 1.00 0.00 C ATOM 1924 CD LYS B 44 55.628 -3.500 -8.023 1.00 0.00 C ATOM 1925 CE LYS B 44 55.438 -3.786 -6.532 1.00 0.00 C ATOM 1926 NZ LYS B 44 54.058 -3.400 -6.123 1.00 0.00 N ATOM 0 H LYS B 44 59.432 -2.724 -11.030 1.00 0.00 H new ATOM 0 HA LYS B 44 58.717 -4.951 -9.365 1.00 0.00 H new ATOM 0 HB2 LYS B 44 57.627 -2.393 -10.175 1.00 0.00 H new ATOM 0 HB3 LYS B 44 56.381 -3.611 -10.363 1.00 0.00 H new ATOM 0 HG2 LYS B 44 57.642 -4.277 -7.912 1.00 0.00 H new ATOM 0 HG3 LYS B 44 57.553 -2.527 -7.889 1.00 0.00 H new ATOM 0 HD2 LYS B 44 55.138 -2.564 -8.290 1.00 0.00 H new ATOM 0 HD3 LYS B 44 55.160 -4.285 -8.617 1.00 0.00 H new ATOM 0 HE2 LYS B 44 55.606 -4.844 -6.330 1.00 0.00 H new ATOM 0 HE3 LYS B 44 56.171 -3.229 -5.948 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 53.929 -3.594 -5.110 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 53.914 -2.386 -6.302 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 53.367 -3.950 -6.672 1.00 0.00 H new ATOM 1940 N THR B 45 58.121 -6.641 -11.163 1.00 0.00 N ATOM 1941 CA THR B 45 57.597 -7.625 -12.147 1.00 0.00 C ATOM 1942 C THR B 45 56.057 -7.638 -12.106 1.00 0.00 C ATOM 1943 O THR B 45 55.435 -6.685 -11.690 1.00 0.00 O ATOM 1944 CB THR B 45 58.156 -9.014 -11.821 1.00 0.00 C ATOM 1945 OG1 THR B 45 58.088 -9.239 -10.419 1.00 0.00 O ATOM 1946 CG2 THR B 45 59.610 -9.086 -12.288 1.00 0.00 C ATOM 0 H THR B 45 58.731 -7.028 -10.443 1.00 0.00 H new ATOM 0 HA THR B 45 57.912 -7.343 -13.152 1.00 0.00 H new ATOM 0 HB THR B 45 57.569 -9.778 -12.331 1.00 0.00 H new ATOM 0 HG1 THR B 45 58.907 -8.908 -9.994 1.00 0.00 H new ATOM 0 HG21 THR B 45 60.017 -10.071 -12.060 1.00 0.00 H new ATOM 0 HG22 THR B 45 59.656 -8.914 -13.363 1.00 0.00 H new ATOM 0 HG23 THR B 45 60.195 -8.324 -11.774 1.00 0.00 H new ATOM 1954 N ILE B 46 55.440 -8.709 -12.532 1.00 0.00 N ATOM 1955 CA ILE B 46 53.951 -8.764 -12.521 1.00 0.00 C ATOM 1956 C ILE B 46 53.490 -9.315 -11.210 1.00 0.00 C ATOM 1957 O ILE B 46 52.411 -9.016 -10.736 1.00 0.00 O ATOM 1958 CB ILE B 46 53.447 -9.685 -13.633 1.00 0.00 C ATOM 1959 CG1 ILE B 46 54.241 -11.020 -13.612 1.00 0.00 C ATOM 1960 CG2 ILE B 46 53.592 -8.986 -14.999 1.00 0.00 C ATOM 1961 CD1 ILE B 46 55.437 -10.965 -14.573 1.00 0.00 C ATOM 0 H ILE B 46 55.903 -9.546 -12.886 1.00 0.00 H new ATOM 0 HA ILE B 46 53.562 -7.758 -12.675 1.00 0.00 H new ATOM 0 HB ILE B 46 52.392 -9.907 -13.469 1.00 0.00 H new ATOM 0 HG12 ILE B 46 54.592 -11.222 -12.600 1.00 0.00 H new ATOM 0 HG13 ILE B 46 53.583 -11.843 -13.892 1.00 0.00 H new ATOM 0 HG21 ILE B 46 53.231 -9.648 -15.786 1.00 0.00 H new ATOM 0 HG22 ILE B 46 53.007 -8.066 -15.001 1.00 0.00 H new ATOM 0 HG23 ILE B 46 54.641 -8.749 -15.177 1.00 0.00 H new ATOM 0 HD11 ILE B 46 55.975 -11.912 -14.539 1.00 0.00 H new ATOM 0 HD12 ILE B 46 55.081 -10.787 -15.588 1.00 0.00 H new ATOM 0 HD13 ILE B 46 56.105 -10.157 -14.276 1.00 0.00 H new ATOM 1973 N VAL B 47 54.294 -10.113 -10.608 1.00 0.00 N ATOM 1974 CA VAL B 47 53.918 -10.684 -9.324 1.00 0.00 C ATOM 1975 C VAL B 47 54.378 -9.740 -8.210 1.00 0.00 C ATOM 1976 O VAL B 47 54.420 -10.100 -7.051 1.00 0.00 O ATOM 1977 CB VAL B 47 54.575 -12.047 -9.193 1.00 0.00 C ATOM 1978 CG1 VAL B 47 56.074 -11.892 -8.926 1.00 0.00 C ATOM 1979 CG2 VAL B 47 53.921 -12.801 -8.062 1.00 0.00 C ATOM 0 H VAL B 47 55.209 -10.396 -10.960 1.00 0.00 H new ATOM 0 HA VAL B 47 52.837 -10.806 -9.249 1.00 0.00 H new ATOM 0 HB VAL B 47 54.449 -12.601 -10.123 1.00 0.00 H new ATOM 0 HG11 VAL B 47 56.531 -12.877 -8.834 1.00 0.00 H new ATOM 0 HG12 VAL B 47 56.537 -11.353 -9.752 1.00 0.00 H new ATOM 0 HG13 VAL B 47 56.223 -11.336 -8.001 1.00 0.00 H new ATOM 0 HG21 VAL B 47 54.387 -13.781 -7.961 1.00 0.00 H new ATOM 0 HG22 VAL B 47 54.044 -12.243 -7.134 1.00 0.00 H new ATOM 0 HG23 VAL B 47 52.859 -12.924 -8.273 1.00 0.00 H new ATOM 1989 N ALA B 48 54.707 -8.516 -8.561 1.00 0.00 N ATOM 1990 CA ALA B 48 55.140 -7.537 -7.545 1.00 0.00 C ATOM 1991 C ALA B 48 56.519 -7.924 -7.009 1.00 0.00 C ATOM 1992 O ALA B 48 56.930 -7.483 -5.954 1.00 0.00 O ATOM 1993 CB ALA B 48 54.128 -7.518 -6.412 1.00 0.00 C ATOM 0 H ALA B 48 54.689 -8.164 -9.518 1.00 0.00 H new ATOM 0 HA ALA B 48 55.203 -6.545 -7.993 1.00 0.00 H new ATOM 0 HB1 ALA B 48 54.441 -6.797 -5.657 1.00 0.00 H new ATOM 0 HB2 ALA B 48 53.151 -7.234 -6.802 1.00 0.00 H new ATOM 0 HB3 ALA B 48 54.066 -8.509 -5.963 1.00 0.00 H new ATOM 1999 N LYS B 49 57.246 -8.727 -7.737 1.00 0.00 N ATOM 2000 CA LYS B 49 58.604 -9.118 -7.279 1.00 0.00 C ATOM 2001 C LYS B 49 59.584 -8.000 -7.622 1.00 0.00 C ATOM 2002 O LYS B 49 60.297 -8.065 -8.603 1.00 0.00 O ATOM 2003 CB LYS B 49 59.029 -10.404 -7.978 1.00 0.00 C ATOM 2004 CG LYS B 49 59.311 -11.487 -6.933 1.00 0.00 C ATOM 2005 CD LYS B 49 59.105 -12.867 -7.560 1.00 0.00 C ATOM 2006 CE LYS B 49 60.293 -13.198 -8.466 1.00 0.00 C ATOM 2007 NZ LYS B 49 59.949 -14.361 -9.332 1.00 0.00 N ATOM 0 H LYS B 49 56.956 -9.128 -8.629 1.00 0.00 H new ATOM 0 HA LYS B 49 58.596 -9.283 -6.202 1.00 0.00 H new ATOM 0 HB2 LYS B 49 58.245 -10.736 -8.658 1.00 0.00 H new ATOM 0 HB3 LYS B 49 59.919 -10.225 -8.581 1.00 0.00 H new ATOM 0 HG2 LYS B 49 60.332 -11.393 -6.563 1.00 0.00 H new ATOM 0 HG3 LYS B 49 58.648 -11.362 -6.077 1.00 0.00 H new ATOM 0 HD2 LYS B 49 59.008 -13.622 -6.780 1.00 0.00 H new ATOM 0 HD3 LYS B 49 58.180 -12.882 -8.136 1.00 0.00 H new ATOM 0 HE2 LYS B 49 60.546 -12.335 -9.082 1.00 0.00 H new ATOM 0 HE3 LYS B 49 61.171 -13.428 -7.863 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 60.756 -14.586 -9.948 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 59.728 -15.184 -8.736 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 59.122 -14.125 -9.917 1.00 0.00 H new ATOM 2021 N GLU B 50 59.626 -6.970 -6.824 1.00 0.00 N ATOM 2022 CA GLU B 50 60.556 -5.843 -7.110 1.00 0.00 C ATOM 2023 C GLU B 50 61.962 -6.395 -7.333 1.00 0.00 C ATOM 2024 O GLU B 50 62.586 -6.903 -6.426 1.00 0.00 O ATOM 2025 CB GLU B 50 60.567 -4.878 -5.923 1.00 0.00 C ATOM 2026 CG GLU B 50 59.269 -4.070 -5.910 1.00 0.00 C ATOM 2027 CD GLU B 50 59.070 -3.443 -4.528 1.00 0.00 C ATOM 2028 OE1 GLU B 50 58.587 -4.137 -3.649 1.00 0.00 O ATOM 2029 OE2 GLU B 50 59.405 -2.281 -4.374 1.00 0.00 O ATOM 0 H GLU B 50 59.056 -6.860 -5.985 1.00 0.00 H new ATOM 0 HA GLU B 50 60.226 -5.313 -8.003 1.00 0.00 H new ATOM 0 HB2 GLU B 50 60.672 -5.433 -4.991 1.00 0.00 H new ATOM 0 HB3 GLU B 50 61.424 -4.208 -5.993 1.00 0.00 H new ATOM 0 HG2 GLU B 50 59.305 -3.292 -6.672 1.00 0.00 H new ATOM 0 HG3 GLU B 50 58.425 -4.715 -6.153 1.00 0.00 H new ATOM 2036 N ILE B 51 62.462 -6.319 -8.537 1.00 0.00 N ATOM 2037 CA ILE B 51 63.827 -6.863 -8.794 1.00 0.00 C ATOM 2038 C ILE B 51 64.802 -5.735 -9.040 1.00 0.00 C ATOM 2039 O ILE B 51 64.806 -5.126 -10.092 1.00 0.00 O ATOM 2040 CB ILE B 51 63.850 -7.765 -10.024 1.00 0.00 C ATOM 2041 CG1 ILE B 51 62.458 -8.248 -10.383 1.00 0.00 C ATOM 2042 CG2 ILE B 51 64.731 -8.969 -9.734 1.00 0.00 C ATOM 2043 CD1 ILE B 51 62.553 -9.042 -11.672 1.00 0.00 C ATOM 0 H ILE B 51 61.992 -5.909 -9.344 1.00 0.00 H new ATOM 0 HA ILE B 51 64.109 -7.438 -7.912 1.00 0.00 H new ATOM 0 HB ILE B 51 64.240 -7.191 -10.864 1.00 0.00 H new ATOM 0 HG12 ILE B 51 62.052 -8.868 -9.583 1.00 0.00 H new ATOM 0 HG13 ILE B 51 61.781 -7.402 -10.506 1.00 0.00 H new ATOM 0 HG21 ILE B 51 64.755 -9.621 -10.607 1.00 0.00 H new ATOM 0 HG22 ILE B 51 65.742 -8.633 -9.504 1.00 0.00 H new ATOM 0 HG23 ILE B 51 64.329 -9.517 -8.882 1.00 0.00 H new ATOM 0 HD11 ILE B 51 61.563 -9.401 -11.952 1.00 0.00 H new ATOM 0 HD12 ILE B 51 62.945 -8.404 -12.464 1.00 0.00 H new ATOM 0 HD13 ILE B 51 63.220 -9.892 -11.527 1.00 0.00 H new ATOM 2055 N CYS B 52 65.683 -5.506 -8.130 1.00 0.00 N ATOM 2056 CA CYS B 52 66.714 -4.483 -8.362 1.00 0.00 C ATOM 2057 C CYS B 52 67.567 -4.950 -9.536 1.00 0.00 C ATOM 2058 O CYS B 52 67.999 -6.079 -9.582 1.00 0.00 O ATOM 2059 CB CYS B 52 67.570 -4.336 -7.119 1.00 0.00 C ATOM 2060 SG CYS B 52 66.767 -3.172 -5.992 1.00 0.00 S ATOM 0 H CYS B 52 65.735 -5.985 -7.231 1.00 0.00 H new ATOM 0 HA CYS B 52 66.262 -3.516 -8.584 1.00 0.00 H new ATOM 0 HB2 CYS B 52 67.699 -5.303 -6.633 1.00 0.00 H new ATOM 0 HB3 CYS B 52 68.564 -3.978 -7.386 1.00 0.00 H new ATOM 2065 N ALA B 53 67.771 -4.118 -10.503 1.00 0.00 N ATOM 2066 CA ALA B 53 68.558 -4.543 -11.689 1.00 0.00 C ATOM 2067 C ALA B 53 69.630 -3.494 -11.993 1.00 0.00 C ATOM 2068 O ALA B 53 69.401 -2.308 -11.878 1.00 0.00 O ATOM 2069 CB ALA B 53 67.621 -4.696 -12.891 1.00 0.00 C ATOM 0 H ALA B 53 67.428 -3.158 -10.529 1.00 0.00 H new ATOM 0 HA ALA B 53 69.042 -5.499 -11.486 1.00 0.00 H new ATOM 0 HB1 ALA B 53 68.196 -5.008 -13.763 1.00 0.00 H new ATOM 0 HB2 ALA B 53 66.863 -5.447 -12.668 1.00 0.00 H new ATOM 0 HB3 ALA B 53 67.136 -3.742 -13.098 1.00 0.00 H new ATOM 2075 N ASP B 54 70.805 -3.924 -12.367 1.00 0.00 N ATOM 2076 CA ASP B 54 71.899 -2.956 -12.662 1.00 0.00 C ATOM 2077 C ASP B 54 71.517 -2.093 -13.885 1.00 0.00 C ATOM 2078 O ASP B 54 71.412 -2.606 -14.981 1.00 0.00 O ATOM 2079 CB ASP B 54 73.185 -3.727 -12.971 1.00 0.00 C ATOM 2080 CG ASP B 54 74.308 -2.740 -13.291 1.00 0.00 C ATOM 2081 OD1 ASP B 54 74.429 -1.759 -12.576 1.00 0.00 O ATOM 2082 OD2 ASP B 54 75.028 -2.981 -14.246 1.00 0.00 O ATOM 0 H ASP B 54 71.054 -4.906 -12.481 1.00 0.00 H new ATOM 0 HA ASP B 54 72.053 -2.310 -11.798 1.00 0.00 H new ATOM 0 HB2 ASP B 54 73.463 -4.347 -12.119 1.00 0.00 H new ATOM 0 HB3 ASP B 54 73.025 -4.398 -13.815 1.00 0.00 H new ATOM 2087 N PRO B 55 71.327 -0.796 -13.665 1.00 0.00 N ATOM 2088 CA PRO B 55 70.975 0.121 -14.752 1.00 0.00 C ATOM 2089 C PRO B 55 72.117 0.197 -15.772 1.00 0.00 C ATOM 2090 O PRO B 55 71.943 0.660 -16.880 1.00 0.00 O ATOM 2091 CB PRO B 55 70.772 1.488 -14.075 1.00 0.00 C ATOM 2092 CG PRO B 55 71.083 1.305 -12.556 1.00 0.00 C ATOM 2093 CD PRO B 55 71.445 -0.174 -12.338 1.00 0.00 C ATOM 0 HA PRO B 55 70.085 -0.204 -15.291 1.00 0.00 H new ATOM 0 HB2 PRO B 55 71.431 2.236 -14.515 1.00 0.00 H new ATOM 0 HB3 PRO B 55 69.750 1.840 -14.218 1.00 0.00 H new ATOM 0 HG2 PRO B 55 71.907 1.951 -12.252 1.00 0.00 H new ATOM 0 HG3 PRO B 55 70.220 1.583 -11.951 1.00 0.00 H new ATOM 0 HD2 PRO B 55 72.455 -0.279 -11.942 1.00 0.00 H new ATOM 0 HD3 PRO B 55 70.771 -0.643 -11.621 1.00 0.00 H new ATOM 2101 N LYS B 56 73.292 -0.246 -15.399 1.00 0.00 N ATOM 2102 CA LYS B 56 74.440 -0.189 -16.334 1.00 0.00 C ATOM 2103 C LYS B 56 74.440 -1.423 -17.248 1.00 0.00 C ATOM 2104 O LYS B 56 75.395 -1.681 -17.953 1.00 0.00 O ATOM 2105 CB LYS B 56 75.745 -0.151 -15.534 1.00 0.00 C ATOM 2106 CG LYS B 56 75.770 1.102 -14.657 1.00 0.00 C ATOM 2107 CD LYS B 56 76.302 2.285 -15.469 1.00 0.00 C ATOM 2108 CE LYS B 56 77.205 3.146 -14.585 1.00 0.00 C ATOM 2109 NZ LYS B 56 78.102 3.970 -15.445 1.00 0.00 N ATOM 0 H LYS B 56 73.499 -0.644 -14.483 1.00 0.00 H new ATOM 0 HA LYS B 56 74.355 0.708 -16.947 1.00 0.00 H new ATOM 0 HB2 LYS B 56 75.830 -1.043 -14.914 1.00 0.00 H new ATOM 0 HB3 LYS B 56 76.599 -0.151 -16.211 1.00 0.00 H new ATOM 0 HG2 LYS B 56 74.767 1.321 -14.290 1.00 0.00 H new ATOM 0 HG3 LYS B 56 76.400 0.935 -13.783 1.00 0.00 H new ATOM 0 HD2 LYS B 56 76.859 1.925 -16.334 1.00 0.00 H new ATOM 0 HD3 LYS B 56 75.472 2.881 -15.849 1.00 0.00 H new ATOM 0 HE2 LYS B 56 76.600 3.792 -13.948 1.00 0.00 H new ATOM 0 HE3 LYS B 56 77.797 2.512 -13.925 1.00 0.00 H new ATOM 0 HZ1 LYS B 56 78.717 4.556 -14.844 1.00 0.00 H new ATOM 0 HZ2 LYS B 56 78.688 3.345 -16.034 1.00 0.00 H new ATOM 0 HZ3 LYS B 56 77.528 4.585 -16.057 1.00 0.00 H new ATOM 2123 N GLN B 57 73.377 -2.187 -17.249 1.00 0.00 N ATOM 2124 CA GLN B 57 73.331 -3.391 -18.123 1.00 0.00 C ATOM 2125 C GLN B 57 72.757 -3.003 -19.485 1.00 0.00 C ATOM 2126 O GLN B 57 72.182 -1.945 -19.647 1.00 0.00 O ATOM 2127 CB GLN B 57 72.442 -4.457 -17.478 1.00 0.00 C ATOM 2128 CG GLN B 57 73.289 -5.678 -17.118 1.00 0.00 C ATOM 2129 CD GLN B 57 73.946 -6.236 -18.383 1.00 0.00 C ATOM 2130 OE1 GLN B 57 73.269 -6.673 -19.291 1.00 0.00 O ATOM 2131 NE2 GLN B 57 75.248 -6.237 -18.480 1.00 0.00 N ATOM 0 H GLN B 57 72.543 -2.027 -16.683 1.00 0.00 H new ATOM 0 HA GLN B 57 74.338 -3.789 -18.251 1.00 0.00 H new ATOM 0 HB2 GLN B 57 71.965 -4.056 -16.584 1.00 0.00 H new ATOM 0 HB3 GLN B 57 71.644 -4.744 -18.163 1.00 0.00 H new ATOM 0 HG2 GLN B 57 74.052 -5.402 -16.391 1.00 0.00 H new ATOM 0 HG3 GLN B 57 72.666 -6.441 -16.652 1.00 0.00 H new ATOM 0 HE21 GLN B 57 75.817 -5.870 -17.717 1.00 0.00 H new ATOM 0 HE22 GLN B 57 75.697 -6.605 -19.319 1.00 0.00 H new ATOM 2140 N LYS B 58 72.916 -3.843 -20.468 1.00 0.00 N ATOM 2141 CA LYS B 58 72.384 -3.511 -21.819 1.00 0.00 C ATOM 2142 C LYS B 58 70.974 -4.087 -21.979 1.00 0.00 C ATOM 2143 O LYS B 58 70.263 -3.751 -22.905 1.00 0.00 O ATOM 2144 CB LYS B 58 73.313 -4.103 -22.892 1.00 0.00 C ATOM 2145 CG LYS B 58 72.654 -4.006 -24.284 1.00 0.00 C ATOM 2146 CD LYS B 58 72.148 -2.577 -24.532 1.00 0.00 C ATOM 2147 CE LYS B 58 72.681 -2.071 -25.873 1.00 0.00 C ATOM 2148 NZ LYS B 58 72.154 -0.700 -26.131 1.00 0.00 N ATOM 0 H LYS B 58 73.390 -4.743 -20.396 1.00 0.00 H new ATOM 0 HA LYS B 58 72.339 -2.428 -21.934 1.00 0.00 H new ATOM 0 HB2 LYS B 58 74.264 -3.569 -22.894 1.00 0.00 H new ATOM 0 HB3 LYS B 58 73.533 -5.145 -22.658 1.00 0.00 H new ATOM 0 HG2 LYS B 58 73.373 -4.284 -25.055 1.00 0.00 H new ATOM 0 HG3 LYS B 58 71.825 -4.710 -24.352 1.00 0.00 H new ATOM 0 HD2 LYS B 58 71.058 -2.561 -24.533 1.00 0.00 H new ATOM 0 HD3 LYS B 58 72.476 -1.919 -23.727 1.00 0.00 H new ATOM 0 HE2 LYS B 58 73.771 -2.057 -25.862 1.00 0.00 H new ATOM 0 HE3 LYS B 58 72.379 -2.745 -26.674 1.00 0.00 H new ATOM 0 HZ1 LYS B 58 72.516 -0.355 -27.043 1.00 0.00 H new ATOM 0 HZ2 LYS B 58 71.115 -0.727 -26.159 1.00 0.00 H new ATOM 0 HZ3 LYS B 58 72.463 -0.061 -25.371 1.00 0.00 H new ATOM 2162 N TRP B 59 70.553 -4.939 -21.087 1.00 0.00 N ATOM 2163 CA TRP B 59 69.186 -5.503 -21.207 1.00 0.00 C ATOM 2164 C TRP B 59 68.244 -4.675 -20.343 1.00 0.00 C ATOM 2165 O TRP B 59 67.084 -4.509 -20.656 1.00 0.00 O ATOM 2166 CB TRP B 59 69.186 -6.985 -20.770 1.00 0.00 C ATOM 2167 CG TRP B 59 69.162 -7.106 -19.274 1.00 0.00 C ATOM 2168 CD1 TRP B 59 70.245 -7.323 -18.489 1.00 0.00 C ATOM 2169 CD2 TRP B 59 68.016 -7.043 -18.382 1.00 0.00 C ATOM 2170 NE1 TRP B 59 69.834 -7.402 -17.167 1.00 0.00 N ATOM 2171 CE2 TRP B 59 68.468 -7.236 -17.047 1.00 0.00 C ATOM 2172 CE3 TRP B 59 66.626 -6.840 -18.597 1.00 0.00 C ATOM 2173 CZ2 TRP B 59 67.575 -7.231 -15.959 1.00 0.00 C ATOM 2174 CZ3 TRP B 59 65.728 -6.833 -17.500 1.00 0.00 C ATOM 2175 CH2 TRP B 59 66.211 -7.032 -16.185 1.00 0.00 C ATOM 0 H TRP B 59 71.094 -5.266 -20.286 1.00 0.00 H new ATOM 0 HA TRP B 59 68.849 -5.464 -22.243 1.00 0.00 H new ATOM 0 HB2 TRP B 59 68.319 -7.492 -21.193 1.00 0.00 H new ATOM 0 HB3 TRP B 59 70.071 -7.484 -21.164 1.00 0.00 H new ATOM 0 HD1 TRP B 59 71.263 -7.419 -18.837 1.00 0.00 H new ATOM 0 HE1 TRP B 59 70.463 -7.563 -16.380 1.00 0.00 H new ATOM 0 HE3 TRP B 59 66.253 -6.691 -19.599 1.00 0.00 H new ATOM 0 HZ2 TRP B 59 67.943 -7.380 -14.955 1.00 0.00 H new ATOM 0 HZ3 TRP B 59 64.673 -6.675 -17.668 1.00 0.00 H new ATOM 0 HH2 TRP B 59 65.522 -7.030 -15.353 1.00 0.00 H new ATOM 2186 N VAL B 60 68.749 -4.116 -19.283 1.00 0.00 N ATOM 2187 CA VAL B 60 67.902 -3.257 -18.426 1.00 0.00 C ATOM 2188 C VAL B 60 67.710 -1.909 -19.127 1.00 0.00 C ATOM 2189 O VAL B 60 66.762 -1.207 -18.883 1.00 0.00 O ATOM 2190 CB VAL B 60 68.590 -3.055 -17.071 1.00 0.00 C ATOM 2191 CG1 VAL B 60 67.872 -1.961 -16.277 1.00 0.00 C ATOM 2192 CG2 VAL B 60 68.536 -4.364 -16.285 1.00 0.00 C ATOM 0 H VAL B 60 69.716 -4.219 -18.975 1.00 0.00 H new ATOM 0 HA VAL B 60 66.931 -3.725 -18.260 1.00 0.00 H new ATOM 0 HB VAL B 60 69.626 -2.757 -17.233 1.00 0.00 H new ATOM 0 HG11 VAL B 60 68.368 -1.824 -15.316 1.00 0.00 H new ATOM 0 HG12 VAL B 60 67.902 -1.026 -16.837 1.00 0.00 H new ATOM 0 HG13 VAL B 60 66.835 -2.252 -16.112 1.00 0.00 H new ATOM 0 HG21 VAL B 60 69.023 -4.229 -15.319 1.00 0.00 H new ATOM 0 HG22 VAL B 60 67.496 -4.652 -16.130 1.00 0.00 H new ATOM 0 HG23 VAL B 60 69.050 -5.146 -16.845 1.00 0.00 H new ATOM 2202 N GLN B 61 68.596 -1.554 -20.014 1.00 0.00 N ATOM 2203 CA GLN B 61 68.437 -0.266 -20.737 1.00 0.00 C ATOM 2204 C GLN B 61 67.267 -0.390 -21.707 1.00 0.00 C ATOM 2205 O GLN B 61 66.599 0.575 -22.017 1.00 0.00 O ATOM 2206 CB GLN B 61 69.719 0.051 -21.510 1.00 0.00 C ATOM 2207 CG GLN B 61 70.789 0.557 -20.541 1.00 0.00 C ATOM 2208 CD GLN B 61 70.777 2.086 -20.520 1.00 0.00 C ATOM 2209 OE1 GLN B 61 70.275 2.688 -19.591 1.00 0.00 O ATOM 2210 NE2 GLN B 61 71.310 2.745 -21.512 1.00 0.00 N ATOM 0 H GLN B 61 69.420 -2.099 -20.268 1.00 0.00 H new ATOM 0 HA GLN B 61 68.244 0.538 -20.027 1.00 0.00 H new ATOM 0 HB2 GLN B 61 70.074 -0.841 -22.027 1.00 0.00 H new ATOM 0 HB3 GLN B 61 69.519 0.804 -22.273 1.00 0.00 H new ATOM 0 HG2 GLN B 61 70.602 0.168 -19.540 1.00 0.00 H new ATOM 0 HG3 GLN B 61 71.771 0.195 -20.845 1.00 0.00 H new ATOM 0 HE21 GLN B 61 71.731 2.240 -22.292 1.00 0.00 H new ATOM 0 HE22 GLN B 61 71.305 3.765 -21.508 1.00 0.00 H new ATOM 2219 N ASP B 62 67.005 -1.579 -22.179 1.00 0.00 N ATOM 2220 CA ASP B 62 65.875 -1.771 -23.112 1.00 0.00 C ATOM 2221 C ASP B 62 64.586 -1.954 -22.307 1.00 0.00 C ATOM 2222 O ASP B 62 63.536 -1.470 -22.678 1.00 0.00 O ATOM 2223 CB ASP B 62 66.124 -3.014 -23.969 1.00 0.00 C ATOM 2224 CG ASP B 62 66.778 -2.600 -25.289 1.00 0.00 C ATOM 2225 OD1 ASP B 62 67.780 -1.906 -25.239 1.00 0.00 O ATOM 2226 OD2 ASP B 62 66.266 -2.984 -26.328 1.00 0.00 O ATOM 0 H ASP B 62 67.531 -2.424 -21.954 1.00 0.00 H new ATOM 0 HA ASP B 62 65.782 -0.900 -23.761 1.00 0.00 H new ATOM 0 HB2 ASP B 62 66.767 -3.714 -23.436 1.00 0.00 H new ATOM 0 HB3 ASP B 62 65.184 -3.530 -24.163 1.00 0.00 H new ATOM 2231 N SER B 63 64.660 -2.656 -21.209 1.00 0.00 N ATOM 2232 CA SER B 63 63.457 -2.879 -20.385 1.00 0.00 C ATOM 2233 C SER B 63 63.026 -1.566 -19.721 1.00 0.00 C ATOM 2234 O SER B 63 61.923 -1.094 -19.904 1.00 0.00 O ATOM 2235 CB SER B 63 63.774 -3.883 -19.301 1.00 0.00 C ATOM 2236 OG SER B 63 64.886 -4.678 -19.692 1.00 0.00 O ATOM 0 H SER B 63 65.514 -3.085 -20.852 1.00 0.00 H new ATOM 0 HA SER B 63 62.655 -3.249 -21.023 1.00 0.00 H new ATOM 0 HB2 SER B 63 63.995 -3.366 -18.367 1.00 0.00 H new ATOM 0 HB3 SER B 63 62.908 -4.518 -19.116 1.00 0.00 H new ATOM 0 HG SER B 63 65.107 -5.307 -18.974 1.00 0.00 H new ATOM 2242 N MET B 64 63.886 -0.999 -18.914 1.00 0.00 N ATOM 2243 CA MET B 64 63.534 0.262 -18.194 1.00 0.00 C ATOM 2244 C MET B 64 63.085 1.339 -19.189 1.00 0.00 C ATOM 2245 O MET B 64 62.486 2.318 -18.811 1.00 0.00 O ATOM 2246 CB MET B 64 64.758 0.758 -17.378 1.00 0.00 C ATOM 2247 CG MET B 64 65.743 1.536 -18.274 1.00 0.00 C ATOM 2248 SD MET B 64 67.001 2.326 -17.237 1.00 0.00 S ATOM 2249 CE MET B 64 68.303 1.091 -17.467 1.00 0.00 C ATOM 0 H MET B 64 64.822 -1.357 -18.722 1.00 0.00 H new ATOM 0 HA MET B 64 62.709 0.061 -17.511 1.00 0.00 H new ATOM 0 HB2 MET B 64 64.420 1.397 -16.562 1.00 0.00 H new ATOM 0 HB3 MET B 64 65.267 -0.093 -16.926 1.00 0.00 H new ATOM 0 HG2 MET B 64 66.215 0.860 -18.987 1.00 0.00 H new ATOM 0 HG3 MET B 64 65.208 2.288 -18.854 1.00 0.00 H new ATOM 0 HE1 MET B 64 68.439 0.529 -16.543 1.00 0.00 H new ATOM 0 HE2 MET B 64 68.020 0.408 -18.268 1.00 0.00 H new ATOM 0 HE3 MET B 64 69.236 1.590 -17.729 1.00 0.00 H new ATOM 2259 N ASP B 65 63.383 1.173 -20.451 1.00 0.00 N ATOM 2260 CA ASP B 65 62.973 2.188 -21.448 1.00 0.00 C ATOM 2261 C ASP B 65 61.516 1.980 -21.802 1.00 0.00 C ATOM 2262 O ASP B 65 60.769 2.925 -21.967 1.00 0.00 O ATOM 2263 CB ASP B 65 63.834 2.054 -22.706 1.00 0.00 C ATOM 2264 CG ASP B 65 64.785 3.247 -22.804 1.00 0.00 C ATOM 2265 OD1 ASP B 65 65.611 3.395 -21.919 1.00 0.00 O ATOM 2266 OD2 ASP B 65 64.671 3.994 -23.762 1.00 0.00 O ATOM 0 H ASP B 65 63.894 0.375 -20.829 1.00 0.00 H new ATOM 0 HA ASP B 65 63.108 3.185 -21.029 1.00 0.00 H new ATOM 0 HB2 ASP B 65 64.402 1.124 -22.673 1.00 0.00 H new ATOM 0 HB3 ASP B 65 63.199 2.008 -23.591 1.00 0.00 H new ATOM 2271 N HIS B 66 61.083 0.754 -21.889 1.00 0.00 N ATOM 2272 CA HIS B 66 59.655 0.522 -22.194 1.00 0.00 C ATOM 2273 C HIS B 66 58.847 0.919 -20.969 1.00 0.00 C ATOM 2274 O HIS B 66 57.759 1.442 -21.074 1.00 0.00 O ATOM 2275 CB HIS B 66 59.398 -0.943 -22.571 1.00 0.00 C ATOM 2276 CG HIS B 66 59.563 -1.822 -21.375 1.00 0.00 C ATOM 2277 ND1 HIS B 66 60.591 -2.727 -21.276 1.00 0.00 N ATOM 2278 CD2 HIS B 66 58.837 -1.949 -20.227 1.00 0.00 C ATOM 2279 CE1 HIS B 66 60.471 -3.353 -20.089 1.00 0.00 C ATOM 2280 NE2 HIS B 66 59.414 -2.918 -19.411 1.00 0.00 N ATOM 0 H HIS B 66 61.651 -0.084 -21.763 1.00 0.00 H new ATOM 0 HA HIS B 66 59.356 1.123 -23.053 1.00 0.00 H new ATOM 0 HB2 HIS B 66 58.391 -1.051 -22.974 1.00 0.00 H new ATOM 0 HB3 HIS B 66 60.090 -1.251 -23.355 1.00 0.00 H new ATOM 0 HD1 HIS B 66 61.315 -2.895 -21.975 1.00 0.00 H new ATOM 0 HD2 HIS B 66 57.949 -1.383 -19.987 1.00 0.00 H new ATOM 0 HE1 HIS B 66 61.150 -4.114 -19.733 1.00 0.00 H new ATOM 2288 N LEU B 67 59.414 0.750 -19.800 1.00 0.00 N ATOM 2289 CA LEU B 67 58.718 1.208 -18.576 1.00 0.00 C ATOM 2290 C LEU B 67 58.783 2.720 -18.563 1.00 0.00 C ATOM 2291 O LEU B 67 57.871 3.399 -18.134 1.00 0.00 O ATOM 2292 CB LEU B 67 59.419 0.658 -17.326 1.00 0.00 C ATOM 2293 CG LEU B 67 59.570 -0.849 -17.451 1.00 0.00 C ATOM 2294 CD1 LEU B 67 60.415 -1.384 -16.305 1.00 0.00 C ATOM 2295 CD2 LEU B 67 58.196 -1.490 -17.399 1.00 0.00 C ATOM 0 H LEU B 67 60.325 0.316 -19.649 1.00 0.00 H new ATOM 0 HA LEU B 67 57.687 0.855 -18.572 1.00 0.00 H new ATOM 0 HB2 LEU B 67 60.398 1.124 -17.210 1.00 0.00 H new ATOM 0 HB3 LEU B 67 58.842 0.904 -16.435 1.00 0.00 H new ATOM 0 HG LEU B 67 60.058 -1.085 -18.396 1.00 0.00 H new ATOM 0 HD11 LEU B 67 60.518 -2.465 -16.403 1.00 0.00 H new ATOM 0 HD12 LEU B 67 61.402 -0.921 -16.334 1.00 0.00 H new ATOM 0 HD13 LEU B 67 59.932 -1.150 -15.356 1.00 0.00 H new ATOM 0 HD21 LEU B 67 58.296 -2.572 -17.488 1.00 0.00 H new ATOM 0 HD22 LEU B 67 57.717 -1.247 -16.451 1.00 0.00 H new ATOM 0 HD23 LEU B 67 57.587 -1.113 -18.221 1.00 0.00 H new ATOM 2307 N ASP B 68 59.848 3.250 -19.090 1.00 0.00 N ATOM 2308 CA ASP B 68 59.989 4.707 -19.186 1.00 0.00 C ATOM 2309 C ASP B 68 58.946 5.238 -20.165 1.00 0.00 C ATOM 2310 O ASP B 68 58.703 6.426 -20.246 1.00 0.00 O ATOM 2311 CB ASP B 68 61.402 5.039 -19.687 1.00 0.00 C ATOM 2312 CG ASP B 68 62.105 5.944 -18.673 1.00 0.00 C ATOM 2313 OD1 ASP B 68 61.829 7.132 -18.677 1.00 0.00 O ATOM 2314 OD2 ASP B 68 62.909 5.433 -17.910 1.00 0.00 O ATOM 0 H ASP B 68 60.634 2.717 -19.462 1.00 0.00 H new ATOM 0 HA ASP B 68 59.837 5.170 -18.211 1.00 0.00 H new ATOM 0 HB2 ASP B 68 61.974 4.122 -19.829 1.00 0.00 H new ATOM 0 HB3 ASP B 68 61.348 5.534 -20.656 1.00 0.00 H new ATOM 2319 N LYS B 69 58.310 4.360 -20.905 1.00 0.00 N ATOM 2320 CA LYS B 69 57.282 4.811 -21.853 1.00 0.00 C ATOM 2321 C LYS B 69 56.086 3.859 -21.823 1.00 0.00 C ATOM 2322 O LYS B 69 55.471 3.586 -22.835 1.00 0.00 O ATOM 2323 CB LYS B 69 57.866 4.867 -23.266 1.00 0.00 C ATOM 2324 CG LYS B 69 58.380 3.482 -23.661 1.00 0.00 C ATOM 2325 CD LYS B 69 59.528 3.630 -24.662 1.00 0.00 C ATOM 2326 CE LYS B 69 58.989 3.457 -26.083 1.00 0.00 C ATOM 2327 NZ LYS B 69 59.402 4.622 -26.916 1.00 0.00 N ATOM 0 H LYS B 69 58.470 3.353 -20.882 1.00 0.00 H new ATOM 0 HA LYS B 69 56.948 5.808 -21.564 1.00 0.00 H new ATOM 0 HB2 LYS B 69 57.105 5.199 -23.972 1.00 0.00 H new ATOM 0 HB3 LYS B 69 58.678 5.593 -23.307 1.00 0.00 H new ATOM 0 HG2 LYS B 69 58.721 2.943 -22.777 1.00 0.00 H new ATOM 0 HG3 LYS B 69 57.574 2.895 -24.100 1.00 0.00 H new ATOM 0 HD2 LYS B 69 59.994 4.609 -24.555 1.00 0.00 H new ATOM 0 HD3 LYS B 69 60.299 2.886 -24.461 1.00 0.00 H new ATOM 0 HE2 LYS B 69 59.369 2.533 -26.518 1.00 0.00 H new ATOM 0 HE3 LYS B 69 57.902 3.377 -26.064 1.00 0.00 H new ATOM 0 HZ1 LYS B 69 59.036 4.505 -27.882 1.00 0.00 H new ATOM 0 HZ2 LYS B 69 59.019 5.497 -26.504 1.00 0.00 H new ATOM 0 HZ3 LYS B 69 60.440 4.678 -26.944 1.00 0.00 H new ATOM 2341 N GLN B 70 55.724 3.389 -20.665 1.00 0.00 N ATOM 2342 CA GLN B 70 54.541 2.498 -20.561 1.00 0.00 C ATOM 2343 C GLN B 70 54.124 2.357 -19.086 1.00 0.00 C ATOM 2344 O GLN B 70 53.573 1.353 -18.682 1.00 0.00 O ATOM 2345 CB GLN B 70 54.860 1.112 -21.177 1.00 0.00 C ATOM 2346 CG GLN B 70 55.602 0.220 -20.167 1.00 0.00 C ATOM 2347 CD GLN B 70 54.658 -0.872 -19.659 1.00 0.00 C ATOM 2348 OE1 GLN B 70 53.977 -1.512 -20.435 1.00 0.00 O ATOM 2349 NE2 GLN B 70 54.588 -1.114 -18.379 1.00 0.00 N ATOM 0 H GLN B 70 56.199 3.585 -19.784 1.00 0.00 H new ATOM 0 HA GLN B 70 53.712 2.935 -21.117 1.00 0.00 H new ATOM 0 HB2 GLN B 70 53.935 0.626 -21.487 1.00 0.00 H new ATOM 0 HB3 GLN B 70 55.469 1.239 -22.072 1.00 0.00 H new ATOM 0 HG2 GLN B 70 56.476 -0.230 -20.637 1.00 0.00 H new ATOM 0 HG3 GLN B 70 55.963 0.821 -19.332 1.00 0.00 H new ATOM 0 HE21 GLN B 70 55.159 -0.577 -17.726 1.00 0.00 H new ATOM 0 HE22 GLN B 70 53.962 -1.840 -18.031 1.00 0.00 H new ATOM 2358 N THR B 71 54.380 3.356 -18.288 1.00 0.00 N ATOM 2359 CA THR B 71 54.000 3.281 -16.861 1.00 0.00 C ATOM 2360 C THR B 71 52.928 4.331 -16.562 1.00 0.00 C ATOM 2361 O THR B 71 52.759 4.760 -15.437 1.00 0.00 O ATOM 2362 CB THR B 71 55.229 3.542 -15.989 1.00 0.00 C ATOM 2363 OG1 THR B 71 54.850 3.524 -14.620 1.00 0.00 O ATOM 2364 CG2 THR B 71 55.824 4.907 -16.337 1.00 0.00 C ATOM 0 H THR B 71 54.838 4.223 -18.570 1.00 0.00 H new ATOM 0 HA THR B 71 53.606 2.288 -16.643 1.00 0.00 H new ATOM 0 HB THR B 71 55.974 2.767 -16.170 1.00 0.00 H new ATOM 0 HG1 THR B 71 54.078 4.113 -14.486 1.00 0.00 H new ATOM 0 HG21 THR B 71 56.700 5.092 -15.715 1.00 0.00 H new ATOM 0 HG22 THR B 71 56.116 4.920 -17.387 1.00 0.00 H new ATOM 0 HG23 THR B 71 55.081 5.684 -16.158 1.00 0.00 H new ATOM 2372 N GLN B 72 52.199 4.749 -17.562 1.00 0.00 N ATOM 2373 CA GLN B 72 51.142 5.762 -17.338 1.00 0.00 C ATOM 2374 C GLN B 72 50.017 5.562 -18.356 1.00 0.00 C ATOM 2375 O GLN B 72 50.250 5.194 -19.490 1.00 0.00 O ATOM 2376 CB GLN B 72 51.734 7.164 -17.500 1.00 0.00 C ATOM 2377 CG GLN B 72 52.395 7.283 -18.876 1.00 0.00 C ATOM 2378 CD GLN B 72 52.574 8.760 -19.231 1.00 0.00 C ATOM 2379 OE1 GLN B 72 51.665 9.550 -19.072 1.00 0.00 O ATOM 2380 NE2 GLN B 72 53.719 9.170 -19.706 1.00 0.00 N ATOM 0 H GLN B 72 52.295 4.428 -18.525 1.00 0.00 H new ATOM 0 HA GLN B 72 50.743 5.651 -16.330 1.00 0.00 H new ATOM 0 HB2 GLN B 72 50.951 7.915 -17.394 1.00 0.00 H new ATOM 0 HB3 GLN B 72 52.466 7.354 -16.715 1.00 0.00 H new ATOM 0 HG2 GLN B 72 53.362 6.780 -18.871 1.00 0.00 H new ATOM 0 HG3 GLN B 72 51.782 6.789 -19.630 1.00 0.00 H new ATOM 0 HE21 GLN B 72 54.483 8.507 -19.840 1.00 0.00 H new ATOM 0 HE22 GLN B 72 53.850 10.153 -19.943 1.00 0.00 H new ATOM 2389 N THR B 73 48.796 5.802 -17.960 1.00 0.00 N ATOM 2390 CA THR B 73 47.658 5.629 -18.903 1.00 0.00 C ATOM 2391 C THR B 73 46.941 6.977 -19.092 1.00 0.00 C ATOM 2392 O THR B 73 45.907 7.211 -18.496 1.00 0.00 O ATOM 2393 CB THR B 73 46.676 4.603 -18.333 1.00 0.00 C ATOM 2394 OG1 THR B 73 47.331 3.349 -18.194 1.00 0.00 O ATOM 2395 CG2 THR B 73 45.484 4.455 -19.277 1.00 0.00 C ATOM 0 H THR B 73 48.539 6.111 -17.022 1.00 0.00 H new ATOM 0 HA THR B 73 48.032 5.278 -19.865 1.00 0.00 H new ATOM 0 HB THR B 73 46.324 4.940 -17.358 1.00 0.00 H new ATOM 0 HG1 THR B 73 46.704 2.691 -17.827 1.00 0.00 H new ATOM 0 HG21 THR B 73 44.786 3.724 -18.869 1.00 0.00 H new ATOM 0 HG22 THR B 73 44.982 5.417 -19.383 1.00 0.00 H new ATOM 0 HG23 THR B 73 45.833 4.119 -20.253 1.00 0.00 H new ATOM 2403 N PRO B 74 47.517 7.831 -19.919 1.00 0.00 N ATOM 2404 CA PRO B 74 46.942 9.150 -20.188 1.00 0.00 C ATOM 2405 C PRO B 74 45.547 9.008 -20.804 1.00 0.00 C ATOM 2406 O PRO B 74 45.069 7.914 -21.035 1.00 0.00 O ATOM 2407 CB PRO B 74 47.906 9.811 -21.190 1.00 0.00 C ATOM 2408 CG PRO B 74 49.054 8.790 -21.473 1.00 0.00 C ATOM 2409 CD PRO B 74 48.765 7.532 -20.633 1.00 0.00 C ATOM 0 HA PRO B 74 46.829 9.740 -19.279 1.00 0.00 H new ATOM 0 HB2 PRO B 74 47.385 10.068 -22.112 1.00 0.00 H new ATOM 0 HB3 PRO B 74 48.308 10.738 -20.782 1.00 0.00 H new ATOM 0 HG2 PRO B 74 49.095 8.543 -22.534 1.00 0.00 H new ATOM 0 HG3 PRO B 74 50.021 9.216 -21.207 1.00 0.00 H new ATOM 0 HD2 PRO B 74 48.657 6.651 -21.266 1.00 0.00 H new ATOM 0 HD3 PRO B 74 49.578 7.326 -19.937 1.00 0.00 H new ATOM 2417 N LYS B 75 44.891 10.104 -21.071 1.00 0.00 N ATOM 2418 CA LYS B 75 43.528 10.031 -21.670 1.00 0.00 C ATOM 2419 C LYS B 75 42.626 9.170 -20.783 1.00 0.00 C ATOM 2420 O LYS B 75 42.488 7.981 -20.991 1.00 0.00 O ATOM 2421 CB LYS B 75 43.618 9.408 -23.064 1.00 0.00 C ATOM 2422 CG LYS B 75 42.423 9.863 -23.905 1.00 0.00 C ATOM 2423 CD LYS B 75 42.815 11.094 -24.725 1.00 0.00 C ATOM 2424 CE LYS B 75 41.556 11.871 -25.112 1.00 0.00 C ATOM 2425 NZ LYS B 75 41.942 13.208 -25.645 1.00 0.00 N ATOM 0 H LYS B 75 45.240 11.047 -20.900 1.00 0.00 H new ATOM 0 HA LYS B 75 43.110 11.035 -21.746 1.00 0.00 H new ATOM 0 HB2 LYS B 75 44.549 9.704 -23.547 1.00 0.00 H new ATOM 0 HB3 LYS B 75 43.630 8.321 -22.988 1.00 0.00 H new ATOM 0 HG2 LYS B 75 42.103 9.058 -24.567 1.00 0.00 H new ATOM 0 HG3 LYS B 75 41.578 10.098 -23.258 1.00 0.00 H new ATOM 0 HD2 LYS B 75 43.485 11.731 -24.147 1.00 0.00 H new ATOM 0 HD3 LYS B 75 43.357 10.790 -25.620 1.00 0.00 H new ATOM 0 HE2 LYS B 75 40.991 11.318 -25.862 1.00 0.00 H new ATOM 0 HE3 LYS B 75 40.906 11.987 -24.245 1.00 0.00 H new ATOM 0 HZ1 LYS B 75 41.086 13.737 -25.908 1.00 0.00 H new ATOM 0 HZ2 LYS B 75 42.464 13.735 -24.916 1.00 0.00 H new ATOM 0 HZ3 LYS B 75 42.546 13.087 -26.483 1.00 0.00 H new ATOM 2439 N THR B 76 42.012 9.761 -19.794 1.00 0.00 N ATOM 2440 CA THR B 76 41.121 8.977 -18.895 1.00 0.00 C ATOM 2441 C THR B 76 39.889 9.812 -18.542 1.00 0.00 C ATOM 2442 O THR B 76 39.779 10.914 -19.054 1.00 0.00 O ATOM 2443 CB THR B 76 41.878 8.617 -17.614 1.00 0.00 C ATOM 2444 OG1 THR B 76 40.986 8.000 -16.696 1.00 0.00 O ATOM 2445 CG2 THR B 76 42.458 9.886 -16.989 1.00 0.00 C ATOM 2446 OXT THR B 76 39.078 9.336 -17.766 1.00 0.00 O ATOM 0 H THR B 76 42.090 10.753 -19.571 1.00 0.00 H new ATOM 0 HA THR B 76 40.807 8.064 -19.401 1.00 0.00 H new ATOM 0 HB THR B 76 42.689 7.928 -17.852 1.00 0.00 H new ATOM 0 HG1 THR B 76 40.076 8.024 -17.058 1.00 0.00 H new ATOM 0 HG21 THR B 76 42.997 9.629 -16.077 1.00 0.00 H new ATOM 0 HG22 THR B 76 43.142 10.359 -17.694 1.00 0.00 H new ATOM 0 HG23 THR B 76 41.649 10.576 -16.750 1.00 0.00 H new TER 2454 THR B 76