USER MOD reduce.3.24.130724 H: found=0, std=0, add=839, rem=0, adj=47 USER MOD reduce.3.24.130724 removed 839 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 97 THR OG1 : rot 93:sc= 1.62 USER MOD Set 1.2: A 112 LYS NZ :NH3+ -172:sc= 0.431 (180deg=0) USER MOD Set 2.1: A 74 ASN : amide:sc= 0.709 X(o=1.4,f=0.99) USER MOD Set 2.2: A 89 SER OG : rot -174:sc= 0.658 USER MOD Set 3.1: A 73 TYR OH : rot -2:sc= 1.2 USER MOD Set 3.2: A 83 THR OG1 : rot 130:sc= 1.05 USER MOD Set 4.1: A 71 SER OG : rot 73:sc= 2.04 USER MOD Set 4.2: A 86 THR OG1 : rot 20:sc= 0.229 USER MOD Set 5.1: A 47 ASN : amide:sc= 0.894 K(o=1.7,f=-0.57) USER MOD Set 5.2: A 62 GLN : amide:sc= 0.792 K(o=1.7,f=-0.57) USER MOD Set 5.3: A 64 TYR OH : rot 180:sc= 0 USER MOD Set 6.1: A 57 ASN : amide:sc= 0.784 K(o=2.9,f=1) USER MOD Set 6.2: A 72 GLN : amide:sc= 1.44 K(o=2.9,f=0.72) USER MOD Set 6.3: A 87 SER OG : rot 150:sc= 0.66 USER MOD Set 7.1: A 42 GLN : amide:sc= 0.252 K(o=0.48,f=-0.078) USER MOD Set 7.2: A 44 SER OG : rot 180:sc= 0.224 USER MOD Set 8.1: A 24 ASN : amide:sc= 0.851 K(o=0.92,f=0.35) USER MOD Set 8.2: A 26 TYR OH : rot 152:sc= 0.072 USER MOD Set 9.1: A 16 GLN : amide:sc= 0.819 K(o=1.5,f=0) USER MOD Set 9.2: A 31 GLN : amide:sc= 0.731 K(o=1.5,f=-0.3) USER MOD Set10.1: A 14 ASN : amide:sc= 1.11 K(o=3,f=0.66) USER MOD Set10.2: A 29 ASN : amide:sc= 1.84 K(o=3,f=-0.45) USER MOD Set11.1: A 12 THR OG1 : rot 120:sc= 1.27 USER MOD Set11.2: A 15 SER OG : rot 87:sc= 1.83 USER MOD Single : A 1 ASP N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 THR OG1 : rot 180:sc= 0.409 USER MOD Single : A 6 ASN : amide:sc= 0.941 K(o=0.94,f=-10!) USER MOD Single : A 7 THR OG1 : rot 83:sc= 0.837 USER MOD Single : A 8 ASN : amide:sc= -0.305 K(o=-0.31,f=-0.84) USER MOD Single : A 9 SER OG : rot 90:sc= 0.327 USER MOD Single : A 10 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 SER OG : rot 77:sc= 1.49 USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 THR OG1 : rot 74:sc= 0.628 USER MOD Single : A 30 SER OG : rot 86:sc= 2 USER MOD Single : A 35 THR OG1 : rot -40:sc= 0.878 USER MOD Single : A 36 SER OG : rot 66:sc= 1.29 USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot 64:sc= 1.78 USER MOD Single : A 43 TYR OH : rot 30:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ -148:sc= 1.3 (180deg=0.944) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 SER OG : rot 69:sc= 1.75 USER MOD Single : A 53 THR OG1 : rot 180:sc= -0.0814 USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ -179:sc= 1.15 (180deg=1.15) USER MOD Single : A 61 SER OG : rot 64:sc= 1.69 USER MOD Single : A 66 THR OG1 : rot 76:sc= 1.52 USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot 69:sc= 1.52 USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 94 SER OG : rot 70:sc= 0.317 USER MOD Single : A 96 SER OG : rot 110:sc= 0.987 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 THR OG1 : rot 180:sc= 0 USER MOD Single : A 106 THR OG1 : rot 170:sc= 0.00546 USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 121 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 1 5.030 -11.402 -1.441 1.00 0.00 N ATOM 2 CA ASP A 1 5.545 -10.013 -1.441 1.00 0.00 C ATOM 3 C ASP A 1 5.165 -9.292 -2.735 1.00 0.00 C ATOM 4 O ASP A 1 5.288 -9.846 -3.829 1.00 0.00 O ATOM 5 CB ASP A 1 7.069 -9.957 -1.250 1.00 0.00 C ATOM 6 CG ASP A 1 7.601 -8.544 -1.534 1.00 0.00 C ATOM 7 OD1 ASP A 1 7.058 -7.570 -0.960 1.00 0.00 O ATOM 8 OD2 ASP A 1 8.498 -8.406 -2.394 1.00 0.00 O ATOM 0 H1 ASP A 1 5.300 -11.872 -0.553 1.00 0.00 H new ATOM 0 H2 ASP A 1 3.993 -11.388 -1.524 1.00 0.00 H new ATOM 0 H3 ASP A 1 5.435 -11.922 -2.245 1.00 0.00 H new ATOM 0 HA ASP A 1 5.081 -9.509 -0.594 1.00 0.00 H new ATOM 0 HB2 ASP A 1 7.324 -10.249 -0.231 1.00 0.00 H new ATOM 0 HB3 ASP A 1 7.550 -10.673 -1.916 1.00 0.00 H new ATOM 15 N GLY A 2 4.733 -8.035 -2.603 1.00 0.00 N ATOM 16 CA GLY A 2 4.526 -7.106 -3.706 1.00 0.00 C ATOM 17 C GLY A 2 4.727 -5.663 -3.236 1.00 0.00 C ATOM 18 O GLY A 2 4.167 -4.748 -3.843 1.00 0.00 O ATOM 0 H GLY A 2 4.512 -7.627 -1.694 1.00 0.00 H new ATOM 0 HA2 GLY A 2 5.221 -7.332 -4.515 1.00 0.00 H new ATOM 0 HA3 GLY A 2 3.520 -7.227 -4.107 1.00 0.00 H new ATOM 22 N THR A 3 5.480 -5.452 -2.149 1.00 0.00 N ATOM 23 CA THR A 3 5.583 -4.167 -1.460 1.00 0.00 C ATOM 24 C THR A 3 7.012 -3.865 -0.985 1.00 0.00 C ATOM 25 O THR A 3 7.309 -2.707 -0.681 1.00 0.00 O ATOM 26 CB THR A 3 4.594 -4.162 -0.277 1.00 0.00 C ATOM 27 OG1 THR A 3 4.774 -5.335 0.501 1.00 0.00 O ATOM 28 CG2 THR A 3 3.129 -4.108 -0.722 1.00 0.00 C ATOM 0 H THR A 3 6.044 -6.185 -1.719 1.00 0.00 H new ATOM 0 HA THR A 3 5.328 -3.376 -2.165 1.00 0.00 H new ATOM 0 HB THR A 3 4.807 -3.262 0.300 1.00 0.00 H new ATOM 0 HG1 THR A 3 4.146 -5.328 1.253 1.00 0.00 H new ATOM 0 HG21 THR A 3 2.482 -4.107 0.155 1.00 0.00 H new ATOM 0 HG22 THR A 3 2.958 -3.200 -1.300 1.00 0.00 H new ATOM 0 HG23 THR A 3 2.904 -4.979 -1.338 1.00 0.00 H new ATOM 36 N CYS A 4 7.911 -4.856 -0.916 1.00 0.00 N ATOM 37 CA CYS A 4 9.325 -4.619 -0.649 1.00 0.00 C ATOM 38 C CYS A 4 9.937 -3.750 -1.759 1.00 0.00 C ATOM 39 O CYS A 4 9.507 -3.801 -2.916 1.00 0.00 O ATOM 40 CB CYS A 4 10.062 -5.956 -0.510 1.00 0.00 C ATOM 41 SG CYS A 4 11.804 -5.838 -0.013 1.00 0.00 S ATOM 0 H CYS A 4 7.674 -5.840 -1.044 1.00 0.00 H new ATOM 0 HA CYS A 4 9.430 -4.078 0.291 1.00 0.00 H new ATOM 0 HB2 CYS A 4 9.534 -6.568 0.221 1.00 0.00 H new ATOM 0 HB3 CYS A 4 10.009 -6.482 -1.463 1.00 0.00 H new ATOM 46 N VAL A 5 10.975 -2.991 -1.411 1.00 0.00 N ATOM 47 CA VAL A 5 11.675 -2.054 -2.276 1.00 0.00 C ATOM 48 C VAL A 5 13.155 -2.437 -2.205 1.00 0.00 C ATOM 49 O VAL A 5 13.932 -1.889 -1.419 1.00 0.00 O ATOM 50 CB VAL A 5 11.365 -0.596 -1.856 1.00 0.00 C ATOM 51 CG1 VAL A 5 12.005 0.411 -2.826 1.00 0.00 C ATOM 52 CG2 VAL A 5 9.852 -0.315 -1.805 1.00 0.00 C ATOM 0 H VAL A 5 11.367 -3.017 -0.470 1.00 0.00 H new ATOM 0 HA VAL A 5 11.350 -2.108 -3.315 1.00 0.00 H new ATOM 0 HB VAL A 5 11.786 -0.476 -0.858 1.00 0.00 H new ATOM 0 HG11 VAL A 5 11.770 1.426 -2.505 1.00 0.00 H new ATOM 0 HG12 VAL A 5 13.086 0.274 -2.832 1.00 0.00 H new ATOM 0 HG13 VAL A 5 11.613 0.248 -3.830 1.00 0.00 H new ATOM 0 HG21 VAL A 5 9.684 0.720 -1.506 1.00 0.00 H new ATOM 0 HG22 VAL A 5 9.417 -0.483 -2.790 1.00 0.00 H new ATOM 0 HG23 VAL A 5 9.382 -0.982 -1.083 1.00 0.00 H new ATOM 62 N ASN A 6 13.533 -3.448 -2.992 1.00 0.00 N ATOM 63 CA ASN A 6 14.934 -3.789 -3.199 1.00 0.00 C ATOM 64 C ASN A 6 15.536 -2.737 -4.138 1.00 0.00 C ATOM 65 O ASN A 6 15.195 -2.711 -5.324 1.00 0.00 O ATOM 66 CB ASN A 6 15.078 -5.205 -3.789 1.00 0.00 C ATOM 67 CG ASN A 6 16.546 -5.561 -4.012 1.00 0.00 C ATOM 68 OD1 ASN A 6 17.434 -4.770 -3.729 1.00 0.00 O ATOM 69 ND2 ASN A 6 16.855 -6.752 -4.493 1.00 0.00 N ATOM 0 H ASN A 6 12.879 -4.046 -3.498 1.00 0.00 H new ATOM 0 HA ASN A 6 15.465 -3.790 -2.247 1.00 0.00 H new ATOM 0 HB2 ASN A 6 14.623 -5.931 -3.115 1.00 0.00 H new ATOM 0 HB3 ASN A 6 14.538 -5.265 -4.734 1.00 0.00 H new ATOM 0 HD21 ASN A 6 17.833 -7.010 -4.627 1.00 0.00 H new ATOM 0 HD22 ASN A 6 16.116 -7.414 -4.730 1.00 0.00 H new ATOM 76 N THR A 7 16.397 -1.862 -3.616 1.00 0.00 N ATOM 77 CA THR A 7 17.039 -0.818 -4.407 1.00 0.00 C ATOM 78 C THR A 7 18.162 -1.425 -5.267 1.00 0.00 C ATOM 79 O THR A 7 18.135 -1.304 -6.493 1.00 0.00 O ATOM 80 CB THR A 7 17.573 0.291 -3.474 1.00 0.00 C ATOM 81 OG1 THR A 7 16.638 0.614 -2.462 1.00 0.00 O ATOM 82 CG2 THR A 7 17.916 1.567 -4.244 1.00 0.00 C ATOM 0 H THR A 7 16.667 -1.859 -2.632 1.00 0.00 H new ATOM 0 HA THR A 7 16.310 -0.368 -5.081 1.00 0.00 H new ATOM 0 HB THR A 7 18.479 -0.108 -3.019 1.00 0.00 H new ATOM 0 HG1 THR A 7 16.715 -0.031 -1.728 1.00 0.00 H new ATOM 0 HG21 THR A 7 18.288 2.321 -3.551 1.00 0.00 H new ATOM 0 HG22 THR A 7 18.682 1.348 -4.988 1.00 0.00 H new ATOM 0 HG23 THR A 7 17.023 1.942 -4.743 1.00 0.00 H new ATOM 90 N ASN A 8 19.144 -2.078 -4.629 1.00 0.00 N ATOM 91 CA ASN A 8 20.353 -2.633 -5.259 1.00 0.00 C ATOM 92 C ASN A 8 20.998 -3.655 -4.309 1.00 0.00 C ATOM 93 O ASN A 8 22.211 -3.658 -4.086 1.00 0.00 O ATOM 94 CB ASN A 8 21.335 -1.497 -5.612 1.00 0.00 C ATOM 95 CG ASN A 8 22.546 -2.001 -6.400 1.00 0.00 C ATOM 96 OD1 ASN A 8 22.445 -2.910 -7.221 1.00 0.00 O ATOM 97 ND2 ASN A 8 23.714 -1.414 -6.189 1.00 0.00 N ATOM 0 H ASN A 8 19.118 -2.241 -3.622 1.00 0.00 H new ATOM 0 HA ASN A 8 20.087 -3.142 -6.186 1.00 0.00 H new ATOM 0 HB2 ASN A 8 20.814 -0.738 -6.196 1.00 0.00 H new ATOM 0 HB3 ASN A 8 21.675 -1.016 -4.695 1.00 0.00 H new ATOM 0 HD21 ASN A 8 24.538 -1.716 -6.709 1.00 0.00 H new ATOM 0 HD22 ASN A 8 23.790 -0.660 -5.506 1.00 0.00 H new ATOM 104 N SER A 9 20.168 -4.463 -3.659 1.00 0.00 N ATOM 105 CA SER A 9 20.511 -5.354 -2.560 1.00 0.00 C ATOM 106 C SER A 9 20.352 -6.816 -2.965 1.00 0.00 C ATOM 107 O SER A 9 19.760 -7.139 -4.002 1.00 0.00 O ATOM 108 CB SER A 9 19.574 -5.048 -1.387 1.00 0.00 C ATOM 109 OG SER A 9 19.571 -3.657 -1.123 1.00 0.00 O ATOM 0 H SER A 9 19.178 -4.516 -3.901 1.00 0.00 H new ATOM 0 HA SER A 9 21.552 -5.193 -2.281 1.00 0.00 H new ATOM 0 HB2 SER A 9 18.564 -5.385 -1.620 1.00 0.00 H new ATOM 0 HB3 SER A 9 19.896 -5.595 -0.501 1.00 0.00 H new ATOM 0 HG SER A 9 18.869 -3.225 -1.653 1.00 0.00 H new ATOM 115 N GLN A 10 20.836 -7.701 -2.095 1.00 0.00 N ATOM 116 CA GLN A 10 20.675 -9.135 -2.198 1.00 0.00 C ATOM 117 C GLN A 10 19.770 -9.560 -1.049 1.00 0.00 C ATOM 118 O GLN A 10 19.990 -9.185 0.104 1.00 0.00 O ATOM 119 CB GLN A 10 22.062 -9.802 -2.174 1.00 0.00 C ATOM 120 CG GLN A 10 22.095 -11.186 -1.512 1.00 0.00 C ATOM 121 CD GLN A 10 23.471 -11.844 -1.626 1.00 0.00 C ATOM 122 OE1 GLN A 10 24.296 -11.748 -0.723 1.00 0.00 O ATOM 123 NE2 GLN A 10 23.753 -12.520 -2.730 1.00 0.00 N ATOM 0 H GLN A 10 21.369 -7.420 -1.272 1.00 0.00 H new ATOM 0 HA GLN A 10 20.210 -9.445 -3.134 1.00 0.00 H new ATOM 0 HB2 GLN A 10 22.423 -9.895 -3.198 1.00 0.00 H new ATOM 0 HB3 GLN A 10 22.757 -9.146 -1.649 1.00 0.00 H new ATOM 0 HG2 GLN A 10 21.825 -11.091 -0.460 1.00 0.00 H new ATOM 0 HG3 GLN A 10 21.347 -11.828 -1.977 1.00 0.00 H new ATOM 0 HE21 GLN A 10 23.059 -12.593 -3.474 1.00 0.00 H new ATOM 0 HE22 GLN A 10 24.664 -12.967 -2.836 1.00 0.00 H new ATOM 132 N ILE A 11 18.794 -10.391 -1.388 1.00 0.00 N ATOM 133 CA ILE A 11 17.882 -11.079 -0.490 1.00 0.00 C ATOM 134 C ILE A 11 17.854 -12.501 -1.044 1.00 0.00 C ATOM 135 O ILE A 11 17.501 -12.686 -2.213 1.00 0.00 O ATOM 136 CB ILE A 11 16.488 -10.393 -0.466 1.00 0.00 C ATOM 137 CG1 ILE A 11 16.557 -8.896 -0.078 1.00 0.00 C ATOM 138 CG2 ILE A 11 15.566 -11.114 0.531 1.00 0.00 C ATOM 139 CD1 ILE A 11 16.576 -7.943 -1.280 1.00 0.00 C ATOM 0 H ILE A 11 18.607 -10.616 -2.365 1.00 0.00 H new ATOM 0 HA ILE A 11 18.193 -11.061 0.554 1.00 0.00 H new ATOM 0 HB ILE A 11 16.095 -10.458 -1.481 1.00 0.00 H new ATOM 0 HG12 ILE A 11 15.701 -8.654 0.552 1.00 0.00 H new ATOM 0 HG13 ILE A 11 17.451 -8.727 0.522 1.00 0.00 H new ATOM 0 HG21 ILE A 11 14.591 -10.627 0.542 1.00 0.00 H new ATOM 0 HG22 ILE A 11 15.449 -12.155 0.231 1.00 0.00 H new ATOM 0 HG23 ILE A 11 16.004 -11.071 1.528 1.00 0.00 H new ATOM 0 HD11 ILE A 11 16.625 -6.913 -0.927 1.00 0.00 H new ATOM 0 HD12 ILE A 11 17.447 -8.156 -1.899 1.00 0.00 H new ATOM 0 HD13 ILE A 11 15.669 -8.082 -1.869 1.00 0.00 H new ATOM 151 N THR A 12 18.323 -13.480 -0.266 1.00 0.00 N ATOM 152 CA THR A 12 18.475 -14.843 -0.789 1.00 0.00 C ATOM 153 C THR A 12 17.110 -15.494 -1.063 1.00 0.00 C ATOM 154 O THR A 12 16.067 -15.009 -0.617 1.00 0.00 O ATOM 155 CB THR A 12 19.362 -15.715 0.116 1.00 0.00 C ATOM 156 OG1 THR A 12 18.844 -15.798 1.431 1.00 0.00 O ATOM 157 CG2 THR A 12 20.806 -15.212 0.161 1.00 0.00 C ATOM 0 H THR A 12 18.599 -13.361 0.709 1.00 0.00 H new ATOM 0 HA THR A 12 18.993 -14.766 -1.745 1.00 0.00 H new ATOM 0 HB THR A 12 19.360 -16.712 -0.325 1.00 0.00 H new ATOM 0 HG1 THR A 12 18.653 -16.734 1.649 1.00 0.00 H new ATOM 0 HG21 THR A 12 21.396 -15.857 0.812 1.00 0.00 H new ATOM 0 HG22 THR A 12 21.228 -15.227 -0.844 1.00 0.00 H new ATOM 0 HG23 THR A 12 20.824 -14.193 0.547 1.00 0.00 H new ATOM 165 N ALA A 13 17.121 -16.639 -1.758 1.00 0.00 N ATOM 166 CA ALA A 13 15.926 -17.388 -2.141 1.00 0.00 C ATOM 167 C ALA A 13 15.031 -17.773 -0.954 1.00 0.00 C ATOM 168 O ALA A 13 13.825 -17.941 -1.146 1.00 0.00 O ATOM 169 CB ALA A 13 16.363 -18.660 -2.875 1.00 0.00 C ATOM 0 H ALA A 13 17.985 -17.078 -2.076 1.00 0.00 H new ATOM 0 HA ALA A 13 15.329 -16.736 -2.779 1.00 0.00 H new ATOM 0 HB1 ALA A 13 15.482 -19.232 -3.168 1.00 0.00 H new ATOM 0 HB2 ALA A 13 16.933 -18.390 -3.764 1.00 0.00 H new ATOM 0 HB3 ALA A 13 16.985 -19.265 -2.216 1.00 0.00 H new ATOM 175 N ASN A 14 15.601 -17.920 0.250 1.00 0.00 N ATOM 176 CA ASN A 14 14.849 -18.300 1.455 1.00 0.00 C ATOM 177 C ASN A 14 14.707 -17.137 2.444 1.00 0.00 C ATOM 178 O ASN A 14 14.017 -17.267 3.457 1.00 0.00 O ATOM 179 CB ASN A 14 15.468 -19.536 2.125 1.00 0.00 C ATOM 180 CG ASN A 14 14.469 -20.197 3.078 1.00 0.00 C ATOM 181 OD1 ASN A 14 13.367 -20.565 2.679 1.00 0.00 O ATOM 182 ND2 ASN A 14 14.817 -20.386 4.339 1.00 0.00 N ATOM 0 H ASN A 14 16.597 -17.779 0.416 1.00 0.00 H new ATOM 0 HA ASN A 14 13.840 -18.561 1.134 1.00 0.00 H new ATOM 0 HB2 ASN A 14 15.778 -20.251 1.363 1.00 0.00 H new ATOM 0 HB3 ASN A 14 16.364 -19.247 2.674 1.00 0.00 H new ATOM 0 HD21 ASN A 14 14.170 -20.839 4.984 1.00 0.00 H new ATOM 0 HD22 ASN A 14 15.733 -20.079 4.667 1.00 0.00 H new ATOM 189 N SER A 15 15.356 -16.004 2.168 1.00 0.00 N ATOM 190 CA SER A 15 15.127 -14.759 2.889 1.00 0.00 C ATOM 191 C SER A 15 13.775 -14.175 2.445 1.00 0.00 C ATOM 192 O SER A 15 13.185 -14.661 1.472 1.00 0.00 O ATOM 193 CB SER A 15 16.268 -13.800 2.563 1.00 0.00 C ATOM 194 OG SER A 15 17.481 -14.253 3.123 1.00 0.00 O ATOM 0 H SER A 15 16.059 -15.928 1.433 1.00 0.00 H new ATOM 0 HA SER A 15 15.099 -14.925 3.966 1.00 0.00 H new ATOM 0 HB2 SER A 15 16.374 -13.708 1.482 1.00 0.00 H new ATOM 0 HB3 SER A 15 16.034 -12.807 2.946 1.00 0.00 H new ATOM 0 HG SER A 15 17.920 -14.868 2.499 1.00 0.00 H new ATOM 200 N GLN A 16 13.262 -13.131 3.110 1.00 0.00 N ATOM 201 CA GLN A 16 11.974 -12.553 2.749 1.00 0.00 C ATOM 202 C GLN A 16 11.978 -11.082 3.129 1.00 0.00 C ATOM 203 O GLN A 16 12.502 -10.714 4.181 1.00 0.00 O ATOM 204 CB GLN A 16 10.858 -13.333 3.477 1.00 0.00 C ATOM 205 CG GLN A 16 9.448 -12.748 3.288 1.00 0.00 C ATOM 206 CD GLN A 16 8.352 -13.710 3.756 1.00 0.00 C ATOM 207 OE1 GLN A 16 7.508 -14.136 2.970 1.00 0.00 O ATOM 208 NE2 GLN A 16 8.324 -14.086 5.026 1.00 0.00 N ATOM 0 H GLN A 16 13.723 -12.675 3.898 1.00 0.00 H new ATOM 0 HA GLN A 16 11.793 -12.626 1.677 1.00 0.00 H new ATOM 0 HB2 GLN A 16 10.861 -14.364 3.123 1.00 0.00 H new ATOM 0 HB3 GLN A 16 11.087 -13.361 4.542 1.00 0.00 H new ATOM 0 HG2 GLN A 16 9.368 -11.813 3.842 1.00 0.00 H new ATOM 0 HG3 GLN A 16 9.294 -12.510 2.236 1.00 0.00 H new ATOM 0 HE21 GLN A 16 9.024 -13.733 5.678 1.00 0.00 H new ATOM 0 HE22 GLN A 16 7.602 -14.729 5.352 1.00 0.00 H new ATOM 217 N CYS A 17 11.367 -10.241 2.300 1.00 0.00 N ATOM 218 CA CYS A 17 11.104 -8.864 2.660 1.00 0.00 C ATOM 219 C CYS A 17 9.714 -8.478 2.179 1.00 0.00 C ATOM 220 O CYS A 17 9.258 -8.981 1.152 1.00 0.00 O ATOM 221 CB CYS A 17 12.206 -7.932 2.143 1.00 0.00 C ATOM 222 SG CYS A 17 12.388 -7.760 0.347 1.00 0.00 S ATOM 0 H CYS A 17 11.045 -10.499 1.367 1.00 0.00 H new ATOM 0 HA CYS A 17 11.120 -8.756 3.745 1.00 0.00 H new ATOM 0 HB2 CYS A 17 12.029 -6.940 2.559 1.00 0.00 H new ATOM 0 HB3 CYS A 17 13.157 -8.281 2.545 1.00 0.00 H new ATOM 227 N VAL A 18 9.038 -7.615 2.938 1.00 0.00 N ATOM 228 CA VAL A 18 7.668 -7.179 2.681 1.00 0.00 C ATOM 229 C VAL A 18 7.574 -5.748 3.206 1.00 0.00 C ATOM 230 O VAL A 18 8.095 -5.466 4.289 1.00 0.00 O ATOM 231 CB VAL A 18 6.640 -8.098 3.396 1.00 0.00 C ATOM 232 CG1 VAL A 18 5.214 -7.808 2.899 1.00 0.00 C ATOM 233 CG2 VAL A 18 6.888 -9.606 3.211 1.00 0.00 C ATOM 0 H VAL A 18 9.441 -7.189 3.772 1.00 0.00 H new ATOM 0 HA VAL A 18 7.435 -7.230 1.617 1.00 0.00 H new ATOM 0 HB VAL A 18 6.762 -7.865 4.454 1.00 0.00 H new ATOM 0 HG11 VAL A 18 4.510 -8.462 3.412 1.00 0.00 H new ATOM 0 HG12 VAL A 18 4.961 -6.768 3.106 1.00 0.00 H new ATOM 0 HG13 VAL A 18 5.159 -7.987 1.825 1.00 0.00 H new ATOM 0 HG21 VAL A 18 6.122 -10.169 3.745 1.00 0.00 H new ATOM 0 HG22 VAL A 18 6.848 -9.854 2.150 1.00 0.00 H new ATOM 0 HG23 VAL A 18 7.870 -9.864 3.607 1.00 0.00 H new ATOM 243 N LYS A 19 6.907 -4.858 2.460 1.00 0.00 N ATOM 244 CA LYS A 19 6.674 -3.441 2.782 1.00 0.00 C ATOM 245 C LYS A 19 7.866 -2.705 3.409 1.00 0.00 C ATOM 246 O LYS A 19 7.657 -1.834 4.252 1.00 0.00 O ATOM 247 CB LYS A 19 5.354 -3.276 3.569 1.00 0.00 C ATOM 248 CG LYS A 19 5.289 -4.022 4.915 1.00 0.00 C ATOM 249 CD LYS A 19 4.031 -3.671 5.726 1.00 0.00 C ATOM 250 CE LYS A 19 2.734 -4.078 5.006 1.00 0.00 C ATOM 251 NZ LYS A 19 1.526 -3.785 5.818 1.00 0.00 N ATOM 0 H LYS A 19 6.492 -5.120 1.566 1.00 0.00 H new ATOM 0 HA LYS A 19 6.563 -2.927 1.827 1.00 0.00 H new ATOM 0 HB2 LYS A 19 5.191 -2.214 3.753 1.00 0.00 H new ATOM 0 HB3 LYS A 19 4.532 -3.620 2.942 1.00 0.00 H new ATOM 0 HG2 LYS A 19 5.311 -5.096 4.732 1.00 0.00 H new ATOM 0 HG3 LYS A 19 6.175 -3.781 5.503 1.00 0.00 H new ATOM 0 HD2 LYS A 19 4.077 -4.169 6.695 1.00 0.00 H new ATOM 0 HD3 LYS A 19 4.014 -2.598 5.919 1.00 0.00 H new ATOM 0 HE2 LYS A 19 2.667 -3.550 4.055 1.00 0.00 H new ATOM 0 HE3 LYS A 19 2.766 -5.143 4.777 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 0.676 -4.076 5.293 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 1.575 -4.309 6.715 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 1.479 -2.765 6.015 1.00 0.00 H new ATOM 265 N SER A 20 9.094 -3.048 3.021 1.00 0.00 N ATOM 266 CA SER A 20 10.348 -2.601 3.626 1.00 0.00 C ATOM 267 C SER A 20 11.352 -2.275 2.519 1.00 0.00 C ATOM 268 O SER A 20 11.145 -2.682 1.374 1.00 0.00 O ATOM 269 CB SER A 20 10.880 -3.719 4.524 1.00 0.00 C ATOM 270 OG SER A 20 9.950 -3.982 5.553 1.00 0.00 O ATOM 0 H SER A 20 9.249 -3.679 2.234 1.00 0.00 H new ATOM 0 HA SER A 20 10.188 -1.705 4.225 1.00 0.00 H new ATOM 0 HB2 SER A 20 11.052 -4.621 3.936 1.00 0.00 H new ATOM 0 HB3 SER A 20 11.840 -3.430 4.952 1.00 0.00 H new ATOM 0 HG SER A 20 9.207 -4.512 5.195 1.00 0.00 H new ATOM 276 N THR A 21 12.447 -1.589 2.844 1.00 0.00 N ATOM 277 CA THR A 21 13.364 -1.038 1.849 1.00 0.00 C ATOM 278 C THR A 21 14.781 -1.520 2.148 1.00 0.00 C ATOM 279 O THR A 21 15.211 -1.508 3.303 1.00 0.00 O ATOM 280 CB THR A 21 13.255 0.499 1.861 1.00 0.00 C ATOM 281 OG1 THR A 21 11.896 0.888 1.728 1.00 0.00 O ATOM 282 CG2 THR A 21 14.064 1.156 0.736 1.00 0.00 C ATOM 0 H THR A 21 12.723 -1.400 3.807 1.00 0.00 H new ATOM 0 HA THR A 21 13.104 -1.383 0.848 1.00 0.00 H new ATOM 0 HB THR A 21 13.664 0.836 2.813 1.00 0.00 H new ATOM 0 HG1 THR A 21 11.833 1.866 1.738 1.00 0.00 H new ATOM 0 HG21 THR A 21 13.952 2.239 0.792 1.00 0.00 H new ATOM 0 HG22 THR A 21 15.117 0.894 0.844 1.00 0.00 H new ATOM 0 HG23 THR A 21 13.700 0.802 -0.229 1.00 0.00 H new ATOM 290 N ALA A 22 15.515 -1.925 1.111 1.00 0.00 N ATOM 291 CA ALA A 22 16.874 -2.425 1.229 1.00 0.00 C ATOM 292 C ALA A 22 17.749 -1.632 0.273 1.00 0.00 C ATOM 293 O ALA A 22 17.460 -1.579 -0.928 1.00 0.00 O ATOM 294 CB ALA A 22 16.907 -3.925 0.912 1.00 0.00 C ATOM 0 H ALA A 22 15.170 -1.912 0.151 1.00 0.00 H new ATOM 0 HA ALA A 22 17.248 -2.301 2.245 1.00 0.00 H new ATOM 0 HB1 ALA A 22 17.929 -4.294 1.002 1.00 0.00 H new ATOM 0 HB2 ALA A 22 16.265 -4.459 1.613 1.00 0.00 H new ATOM 0 HB3 ALA A 22 16.550 -4.090 -0.105 1.00 0.00 H new ATOM 300 N THR A 23 18.826 -1.055 0.794 1.00 0.00 N ATOM 301 CA THR A 23 19.665 -0.096 0.090 1.00 0.00 C ATOM 302 C THR A 23 21.097 -0.645 0.076 1.00 0.00 C ATOM 303 O THR A 23 21.899 -0.379 0.973 1.00 0.00 O ATOM 304 CB THR A 23 19.520 1.310 0.720 1.00 0.00 C ATOM 305 OG1 THR A 23 18.223 1.519 1.252 1.00 0.00 O ATOM 306 CG2 THR A 23 19.810 2.412 -0.302 1.00 0.00 C ATOM 0 H THR A 23 19.147 -1.247 1.743 1.00 0.00 H new ATOM 0 HA THR A 23 19.355 0.031 -0.947 1.00 0.00 H new ATOM 0 HB THR A 23 20.250 1.358 1.528 1.00 0.00 H new ATOM 0 HG1 THR A 23 18.123 1.006 2.081 1.00 0.00 H new ATOM 0 HG21 THR A 23 19.699 3.387 0.173 1.00 0.00 H new ATOM 0 HG22 THR A 23 20.828 2.304 -0.675 1.00 0.00 H new ATOM 0 HG23 THR A 23 19.109 2.331 -1.133 1.00 0.00 H new ATOM 314 N ASN A 24 21.387 -1.467 -0.937 1.00 0.00 N ATOM 315 CA ASN A 24 22.591 -2.283 -1.076 1.00 0.00 C ATOM 316 C ASN A 24 22.920 -3.051 0.206 1.00 0.00 C ATOM 317 O ASN A 24 24.009 -2.929 0.763 1.00 0.00 O ATOM 318 CB ASN A 24 23.764 -1.487 -1.671 1.00 0.00 C ATOM 319 CG ASN A 24 24.954 -2.398 -1.977 1.00 0.00 C ATOM 320 OD1 ASN A 24 26.054 -2.204 -1.465 1.00 0.00 O ATOM 321 ND2 ASN A 24 24.775 -3.400 -2.824 1.00 0.00 N ATOM 0 H ASN A 24 20.750 -1.585 -1.725 1.00 0.00 H new ATOM 0 HA ASN A 24 22.383 -3.059 -1.813 1.00 0.00 H new ATOM 0 HB2 ASN A 24 23.441 -0.987 -2.584 1.00 0.00 H new ATOM 0 HB3 ASN A 24 24.069 -0.708 -0.972 1.00 0.00 H new ATOM 0 HD21 ASN A 24 25.553 -4.017 -3.056 1.00 0.00 H new ATOM 0 HD22 ASN A 24 23.859 -3.555 -3.245 1.00 0.00 H new ATOM 328 N CYS A 25 21.950 -3.830 0.689 1.00 0.00 N ATOM 329 CA CYS A 25 22.142 -4.738 1.810 1.00 0.00 C ATOM 330 C CYS A 25 22.336 -6.156 1.286 1.00 0.00 C ATOM 331 O CYS A 25 22.125 -6.430 0.102 1.00 0.00 O ATOM 332 CB CYS A 25 20.955 -4.653 2.778 1.00 0.00 C ATOM 333 SG CYS A 25 20.988 -3.154 3.785 1.00 0.00 S ATOM 0 H CYS A 25 21.004 -3.845 0.307 1.00 0.00 H new ATOM 0 HA CYS A 25 23.035 -4.450 2.364 1.00 0.00 H new ATOM 0 HB2 CYS A 25 20.025 -4.685 2.211 1.00 0.00 H new ATOM 0 HB3 CYS A 25 20.960 -5.526 3.431 1.00 0.00 H new ATOM 338 N TYR A 26 22.708 -7.061 2.184 1.00 0.00 N ATOM 339 CA TYR A 26 22.976 -8.454 1.888 1.00 0.00 C ATOM 340 C TYR A 26 22.251 -9.229 2.978 1.00 0.00 C ATOM 341 O TYR A 26 22.573 -9.091 4.158 1.00 0.00 O ATOM 342 CB TYR A 26 24.495 -8.682 1.871 1.00 0.00 C ATOM 343 CG TYR A 26 25.231 -7.799 0.873 1.00 0.00 C ATOM 344 CD1 TYR A 26 25.378 -8.211 -0.466 1.00 0.00 C ATOM 345 CD2 TYR A 26 25.717 -6.537 1.272 1.00 0.00 C ATOM 346 CE1 TYR A 26 25.992 -7.364 -1.405 1.00 0.00 C ATOM 347 CE2 TYR A 26 26.331 -5.683 0.337 1.00 0.00 C ATOM 348 CZ TYR A 26 26.470 -6.093 -1.009 1.00 0.00 C ATOM 349 OH TYR A 26 27.062 -5.280 -1.929 1.00 0.00 O ATOM 0 H TYR A 26 22.834 -6.832 3.170 1.00 0.00 H new ATOM 0 HA TYR A 26 22.624 -8.780 0.909 1.00 0.00 H new ATOM 0 HB2 TYR A 26 24.893 -8.498 2.869 1.00 0.00 H new ATOM 0 HB3 TYR A 26 24.695 -9.727 1.635 1.00 0.00 H new ATOM 0 HD1 TYR A 26 25.017 -9.182 -0.773 1.00 0.00 H new ATOM 0 HD2 TYR A 26 25.618 -6.224 2.301 1.00 0.00 H new ATOM 0 HE1 TYR A 26 26.099 -7.684 -2.431 1.00 0.00 H new ATOM 0 HE2 TYR A 26 26.696 -4.715 0.647 1.00 0.00 H new ATOM 0 HH TYR A 26 26.936 -4.344 -1.668 1.00 0.00 H new ATOM 359 N ILE A 27 21.224 -9.980 2.594 1.00 0.00 N ATOM 360 CA ILE A 27 20.275 -10.607 3.500 1.00 0.00 C ATOM 361 C ILE A 27 20.298 -12.094 3.164 1.00 0.00 C ATOM 362 O ILE A 27 19.866 -12.480 2.076 1.00 0.00 O ATOM 363 CB ILE A 27 18.895 -9.922 3.310 1.00 0.00 C ATOM 364 CG1 ILE A 27 19.000 -8.409 3.641 1.00 0.00 C ATOM 365 CG2 ILE A 27 17.781 -10.591 4.127 1.00 0.00 C ATOM 366 CD1 ILE A 27 17.680 -7.629 3.617 1.00 0.00 C ATOM 0 H ILE A 27 21.025 -10.174 1.612 1.00 0.00 H new ATOM 0 HA ILE A 27 20.517 -10.494 4.557 1.00 0.00 H new ATOM 0 HB ILE A 27 18.616 -10.040 2.263 1.00 0.00 H new ATOM 0 HG12 ILE A 27 19.446 -8.303 4.630 1.00 0.00 H new ATOM 0 HG13 ILE A 27 19.686 -7.947 2.931 1.00 0.00 H new ATOM 0 HG21 ILE A 27 16.840 -10.069 3.954 1.00 0.00 H new ATOM 0 HG22 ILE A 27 17.680 -11.632 3.821 1.00 0.00 H new ATOM 0 HG23 ILE A 27 18.031 -10.547 5.187 1.00 0.00 H new ATOM 0 HD11 ILE A 27 17.870 -6.584 3.862 1.00 0.00 H new ATOM 0 HD12 ILE A 27 17.237 -7.694 2.623 1.00 0.00 H new ATOM 0 HD13 ILE A 27 16.993 -8.054 4.349 1.00 0.00 H new ATOM 378 N ASP A 28 20.845 -12.905 4.073 1.00 0.00 N ATOM 379 CA ASP A 28 21.068 -14.335 3.890 1.00 0.00 C ATOM 380 C ASP A 28 20.295 -15.098 4.956 1.00 0.00 C ATOM 381 O ASP A 28 20.484 -14.857 6.150 1.00 0.00 O ATOM 382 CB ASP A 28 22.566 -14.647 3.995 1.00 0.00 C ATOM 383 CG ASP A 28 22.815 -16.161 4.110 1.00 0.00 C ATOM 384 OD1 ASP A 28 22.432 -16.914 3.189 1.00 0.00 O ATOM 385 OD2 ASP A 28 23.428 -16.604 5.107 1.00 0.00 O ATOM 0 H ASP A 28 21.154 -12.570 4.986 1.00 0.00 H new ATOM 0 HA ASP A 28 20.719 -14.639 2.903 1.00 0.00 H new ATOM 0 HB2 ASP A 28 23.083 -14.257 3.118 1.00 0.00 H new ATOM 0 HB3 ASP A 28 22.985 -14.140 4.864 1.00 0.00 H new ATOM 390 N ASN A 29 19.415 -16.001 4.524 1.00 0.00 N ATOM 391 CA ASN A 29 18.414 -16.708 5.331 1.00 0.00 C ATOM 392 C ASN A 29 17.725 -15.802 6.367 1.00 0.00 C ATOM 393 O ASN A 29 17.453 -16.234 7.488 1.00 0.00 O ATOM 394 CB ASN A 29 19.027 -17.970 5.968 1.00 0.00 C ATOM 395 CG ASN A 29 17.933 -18.968 6.339 1.00 0.00 C ATOM 396 OD1 ASN A 29 17.203 -19.422 5.464 1.00 0.00 O ATOM 397 ND2 ASN A 29 17.779 -19.361 7.593 1.00 0.00 N ATOM 0 H ASN A 29 19.378 -16.277 3.543 1.00 0.00 H new ATOM 0 HA ASN A 29 17.619 -17.024 4.656 1.00 0.00 H new ATOM 0 HB2 ASN A 29 19.728 -18.432 5.272 1.00 0.00 H new ATOM 0 HB3 ASN A 29 19.594 -17.696 6.857 1.00 0.00 H new ATOM 0 HD21 ASN A 29 17.055 -20.039 7.830 1.00 0.00 H new ATOM 0 HD22 ASN A 29 18.384 -18.986 8.323 1.00 0.00 H new ATOM 404 N SER A 30 17.468 -14.540 6.017 1.00 0.00 N ATOM 405 CA SER A 30 17.035 -13.510 6.951 1.00 0.00 C ATOM 406 C SER A 30 15.769 -12.801 6.479 1.00 0.00 C ATOM 407 O SER A 30 15.330 -12.981 5.343 1.00 0.00 O ATOM 408 CB SER A 30 18.177 -12.506 7.138 1.00 0.00 C ATOM 409 OG SER A 30 19.300 -13.094 7.747 1.00 0.00 O ATOM 0 H SER A 30 17.558 -14.204 5.058 1.00 0.00 H new ATOM 0 HA SER A 30 16.791 -13.984 7.902 1.00 0.00 H new ATOM 0 HB2 SER A 30 18.463 -12.097 6.169 1.00 0.00 H new ATOM 0 HB3 SER A 30 17.830 -11.671 7.747 1.00 0.00 H new ATOM 0 HG SER A 30 19.866 -13.506 7.061 1.00 0.00 H new ATOM 415 N GLN A 31 15.167 -11.983 7.345 1.00 0.00 N ATOM 416 CA GLN A 31 13.901 -11.328 7.049 1.00 0.00 C ATOM 417 C GLN A 31 13.947 -9.840 7.371 1.00 0.00 C ATOM 418 O GLN A 31 14.513 -9.432 8.388 1.00 0.00 O ATOM 419 CB GLN A 31 12.744 -12.030 7.771 1.00 0.00 C ATOM 420 CG GLN A 31 12.572 -13.483 7.305 1.00 0.00 C ATOM 421 CD GLN A 31 11.235 -14.056 7.763 1.00 0.00 C ATOM 422 OE1 GLN A 31 10.192 -13.778 7.174 1.00 0.00 O ATOM 423 NE2 GLN A 31 11.231 -14.860 8.813 1.00 0.00 N ATOM 0 H GLN A 31 15.545 -11.760 8.266 1.00 0.00 H new ATOM 0 HA GLN A 31 13.725 -11.412 5.977 1.00 0.00 H new ATOM 0 HB2 GLN A 31 12.924 -12.013 8.846 1.00 0.00 H new ATOM 0 HB3 GLN A 31 11.819 -11.481 7.594 1.00 0.00 H new ATOM 0 HG2 GLN A 31 12.637 -13.529 6.218 1.00 0.00 H new ATOM 0 HG3 GLN A 31 13.386 -14.092 7.699 1.00 0.00 H new ATOM 0 HE21 GLN A 31 12.105 -15.080 9.290 1.00 0.00 H new ATOM 0 HE22 GLN A 31 10.354 -15.260 9.146 1.00 0.00 H new ATOM 432 N LEU A 32 13.324 -9.054 6.491 1.00 0.00 N ATOM 433 CA LEU A 32 13.262 -7.589 6.542 1.00 0.00 C ATOM 434 C LEU A 32 11.805 -7.178 6.312 1.00 0.00 C ATOM 435 O LEU A 32 11.371 -7.095 5.163 1.00 0.00 O ATOM 436 CB LEU A 32 14.189 -7.027 5.443 1.00 0.00 C ATOM 437 CG LEU A 32 14.136 -5.495 5.275 1.00 0.00 C ATOM 438 CD1 LEU A 32 15.050 -4.784 6.271 1.00 0.00 C ATOM 439 CD2 LEU A 32 14.559 -5.094 3.859 1.00 0.00 C ATOM 0 H LEU A 32 12.826 -9.437 5.687 1.00 0.00 H new ATOM 0 HA LEU A 32 13.593 -7.197 7.504 1.00 0.00 H new ATOM 0 HB2 LEU A 32 15.215 -7.319 5.668 1.00 0.00 H new ATOM 0 HB3 LEU A 32 13.927 -7.492 4.493 1.00 0.00 H new ATOM 0 HG LEU A 32 13.105 -5.193 5.461 1.00 0.00 H new ATOM 0 HD11 LEU A 32 14.984 -3.706 6.120 1.00 0.00 H new ATOM 0 HD12 LEU A 32 14.740 -5.028 7.287 1.00 0.00 H new ATOM 0 HD13 LEU A 32 16.079 -5.110 6.117 1.00 0.00 H new ATOM 0 HD21 LEU A 32 14.515 -4.009 3.760 1.00 0.00 H new ATOM 0 HD22 LEU A 32 15.578 -5.435 3.673 1.00 0.00 H new ATOM 0 HD23 LEU A 32 13.886 -5.552 3.135 1.00 0.00 H new ATOM 451 N VAL A 33 11.036 -6.929 7.373 1.00 0.00 N ATOM 452 CA VAL A 33 9.586 -6.763 7.249 1.00 0.00 C ATOM 453 C VAL A 33 9.052 -5.542 8.008 1.00 0.00 C ATOM 454 O VAL A 33 9.752 -4.946 8.832 1.00 0.00 O ATOM 455 CB VAL A 33 8.886 -8.083 7.661 1.00 0.00 C ATOM 456 CG1 VAL A 33 9.205 -9.226 6.681 1.00 0.00 C ATOM 457 CG2 VAL A 33 9.238 -8.539 9.087 1.00 0.00 C ATOM 0 H VAL A 33 11.391 -6.838 8.325 1.00 0.00 H new ATOM 0 HA VAL A 33 9.351 -6.554 6.205 1.00 0.00 H new ATOM 0 HB VAL A 33 7.820 -7.858 7.631 1.00 0.00 H new ATOM 0 HG11 VAL A 33 8.696 -10.134 7.004 1.00 0.00 H new ATOM 0 HG12 VAL A 33 8.864 -8.954 5.682 1.00 0.00 H new ATOM 0 HG13 VAL A 33 10.281 -9.400 6.662 1.00 0.00 H new ATOM 0 HG21 VAL A 33 8.715 -9.468 9.311 1.00 0.00 H new ATOM 0 HG22 VAL A 33 10.313 -8.701 9.162 1.00 0.00 H new ATOM 0 HG23 VAL A 33 8.936 -7.771 9.799 1.00 0.00 H new ATOM 467 N ASP A 34 7.781 -5.216 7.745 1.00 0.00 N ATOM 468 CA ASP A 34 6.988 -4.207 8.451 1.00 0.00 C ATOM 469 C ASP A 34 7.642 -2.822 8.415 1.00 0.00 C ATOM 470 O ASP A 34 7.876 -2.200 9.444 1.00 0.00 O ATOM 471 CB ASP A 34 6.649 -4.699 9.866 1.00 0.00 C ATOM 472 CG ASP A 34 5.667 -3.783 10.615 1.00 0.00 C ATOM 473 OD1 ASP A 34 4.776 -3.170 9.982 1.00 0.00 O ATOM 474 OD2 ASP A 34 5.729 -3.770 11.866 1.00 0.00 O ATOM 0 H ASP A 34 7.254 -5.671 6.999 1.00 0.00 H new ATOM 0 HA ASP A 34 6.043 -4.074 7.925 1.00 0.00 H new ATOM 0 HB2 ASP A 34 6.223 -5.700 9.802 1.00 0.00 H new ATOM 0 HB3 ASP A 34 7.570 -4.781 10.444 1.00 0.00 H new ATOM 479 N THR A 35 7.978 -2.339 7.219 1.00 0.00 N ATOM 480 CA THR A 35 8.701 -1.108 6.987 1.00 0.00 C ATOM 481 C THR A 35 10.010 -0.970 7.762 1.00 0.00 C ATOM 482 O THR A 35 10.282 0.028 8.437 1.00 0.00 O ATOM 483 CB THR A 35 7.755 0.097 6.959 1.00 0.00 C ATOM 484 OG1 THR A 35 6.539 -0.244 6.306 1.00 0.00 O ATOM 485 CG2 THR A 35 8.395 1.229 6.151 1.00 0.00 C ATOM 0 H THR A 35 7.739 -2.823 6.354 1.00 0.00 H new ATOM 0 HA THR A 35 9.106 -1.148 5.976 1.00 0.00 H new ATOM 0 HB THR A 35 7.564 0.402 7.988 1.00 0.00 H new ATOM 0 HG1 THR A 35 6.733 -0.803 5.525 1.00 0.00 H new ATOM 0 HG21 THR A 35 7.723 2.087 6.131 1.00 0.00 H new ATOM 0 HG22 THR A 35 9.338 1.518 6.614 1.00 0.00 H new ATOM 0 HG23 THR A 35 8.580 0.889 5.132 1.00 0.00 H new ATOM 493 N SER A 36 10.820 -2.020 7.672 1.00 0.00 N ATOM 494 CA SER A 36 12.200 -1.950 8.093 1.00 0.00 C ATOM 495 C SER A 36 12.919 -1.239 6.942 1.00 0.00 C ATOM 496 O SER A 36 12.458 -1.241 5.793 1.00 0.00 O ATOM 497 CB SER A 36 12.789 -3.341 8.301 1.00 0.00 C ATOM 498 OG SER A 36 12.187 -3.966 9.408 1.00 0.00 O ATOM 0 H SER A 36 10.536 -2.930 7.309 1.00 0.00 H new ATOM 0 HA SER A 36 12.305 -1.429 9.044 1.00 0.00 H new ATOM 0 HB2 SER A 36 12.637 -3.945 7.407 1.00 0.00 H new ATOM 0 HB3 SER A 36 13.865 -3.268 8.457 1.00 0.00 H new ATOM 0 HG SER A 36 11.241 -4.134 9.215 1.00 0.00 H new ATOM 504 N ILE A 37 14.058 -0.631 7.233 1.00 0.00 N ATOM 505 CA ILE A 37 14.850 0.090 6.253 1.00 0.00 C ATOM 506 C ILE A 37 16.299 -0.325 6.517 1.00 0.00 C ATOM 507 O ILE A 37 16.747 -0.328 7.665 1.00 0.00 O ATOM 508 CB ILE A 37 14.574 1.613 6.356 1.00 0.00 C ATOM 509 CG1 ILE A 37 13.109 1.940 5.973 1.00 0.00 C ATOM 510 CG2 ILE A 37 15.558 2.412 5.477 1.00 0.00 C ATOM 511 CD1 ILE A 37 12.730 3.423 6.076 1.00 0.00 C ATOM 0 H ILE A 37 14.463 -0.625 8.169 1.00 0.00 H new ATOM 0 HA ILE A 37 14.598 -0.152 5.221 1.00 0.00 H new ATOM 0 HB ILE A 37 14.726 1.910 7.394 1.00 0.00 H new ATOM 0 HG12 ILE A 37 12.933 1.605 4.951 1.00 0.00 H new ATOM 0 HG13 ILE A 37 12.443 1.364 6.616 1.00 0.00 H new ATOM 0 HG21 ILE A 37 15.344 3.477 5.567 1.00 0.00 H new ATOM 0 HG22 ILE A 37 16.579 2.218 5.806 1.00 0.00 H new ATOM 0 HG23 ILE A 37 15.448 2.106 4.437 1.00 0.00 H new ATOM 0 HD11 ILE A 37 11.687 3.553 5.788 1.00 0.00 H new ATOM 0 HD12 ILE A 37 12.869 3.764 7.102 1.00 0.00 H new ATOM 0 HD13 ILE A 37 13.365 4.008 5.411 1.00 0.00 H new ATOM 523 N CYS A 38 17.026 -0.694 5.465 1.00 0.00 N ATOM 524 CA CYS A 38 18.367 -1.240 5.560 1.00 0.00 C ATOM 525 C CYS A 38 19.239 -0.462 4.588 1.00 0.00 C ATOM 526 O CYS A 38 18.813 -0.212 3.458 1.00 0.00 O ATOM 527 CB CYS A 38 18.307 -2.735 5.214 1.00 0.00 C ATOM 528 SG CYS A 38 19.865 -3.630 5.416 1.00 0.00 S ATOM 0 H CYS A 38 16.688 -0.618 4.506 1.00 0.00 H new ATOM 0 HA CYS A 38 18.787 -1.148 6.562 1.00 0.00 H new ATOM 0 HB2 CYS A 38 17.550 -3.207 5.841 1.00 0.00 H new ATOM 0 HB3 CYS A 38 17.976 -2.840 4.181 1.00 0.00 H new ATOM 533 N THR A 39 20.461 -0.127 5.000 1.00 0.00 N ATOM 534 CA THR A 39 21.445 0.551 4.182 1.00 0.00 C ATOM 535 C THR A 39 22.792 -0.108 4.475 1.00 0.00 C ATOM 536 O THR A 39 23.199 -0.203 5.635 1.00 0.00 O ATOM 537 CB THR A 39 21.453 2.060 4.503 1.00 0.00 C ATOM 538 OG1 THR A 39 20.140 2.592 4.534 1.00 0.00 O ATOM 539 CG2 THR A 39 22.252 2.866 3.472 1.00 0.00 C ATOM 0 H THR A 39 20.796 -0.330 5.942 1.00 0.00 H new ATOM 0 HA THR A 39 21.217 0.464 3.120 1.00 0.00 H new ATOM 0 HB THR A 39 21.922 2.148 5.483 1.00 0.00 H new ATOM 0 HG1 THR A 39 20.180 3.549 4.741 1.00 0.00 H new ATOM 0 HG21 THR A 39 22.229 3.922 3.739 1.00 0.00 H new ATOM 0 HG22 THR A 39 23.285 2.517 3.458 1.00 0.00 H new ATOM 0 HG23 THR A 39 21.811 2.732 2.484 1.00 0.00 H new ATOM 547 N ARG A 40 23.482 -0.559 3.427 1.00 0.00 N ATOM 548 CA ARG A 40 24.851 -1.096 3.443 1.00 0.00 C ATOM 549 C ARG A 40 25.153 -2.077 4.590 1.00 0.00 C ATOM 550 O ARG A 40 26.249 -2.053 5.148 1.00 0.00 O ATOM 551 CB ARG A 40 25.874 0.047 3.260 1.00 0.00 C ATOM 552 CG ARG A 40 25.978 1.048 4.427 1.00 0.00 C ATOM 553 CD ARG A 40 27.039 2.130 4.187 1.00 0.00 C ATOM 554 NE ARG A 40 26.674 3.039 3.081 1.00 0.00 N ATOM 555 CZ ARG A 40 27.183 3.046 1.840 1.00 0.00 C ATOM 556 NH1 ARG A 40 28.116 2.168 1.476 1.00 0.00 N ATOM 557 NH2 ARG A 40 26.748 3.940 0.958 1.00 0.00 N ATOM 0 H ARG A 40 23.081 -0.561 2.489 1.00 0.00 H new ATOM 0 HA ARG A 40 24.953 -1.752 2.579 1.00 0.00 H new ATOM 0 HB2 ARG A 40 26.857 -0.394 3.096 1.00 0.00 H new ATOM 0 HB3 ARG A 40 25.617 0.598 2.355 1.00 0.00 H new ATOM 0 HG2 ARG A 40 25.009 1.523 4.580 1.00 0.00 H new ATOM 0 HG3 ARG A 40 26.217 0.508 5.343 1.00 0.00 H new ATOM 0 HD2 ARG A 40 27.177 2.709 5.100 1.00 0.00 H new ATOM 0 HD3 ARG A 40 27.994 1.655 3.964 1.00 0.00 H new ATOM 0 HE ARG A 40 25.958 3.736 3.283 1.00 0.00 H new ATOM 0 HH11 ARG A 40 28.454 1.476 2.145 1.00 0.00 H new ATOM 0 HH12 ARG A 40 28.492 2.187 0.528 1.00 0.00 H new ATOM 0 HH21 ARG A 40 26.032 4.615 1.227 1.00 0.00 H new ATOM 0 HH22 ARG A 40 27.130 3.951 0.012 1.00 0.00 H new ATOM 571 N SER A 41 24.196 -2.938 4.947 1.00 0.00 N ATOM 572 CA SER A 41 24.293 -3.834 6.097 1.00 0.00 C ATOM 573 C SER A 41 24.186 -5.302 5.675 1.00 0.00 C ATOM 574 O SER A 41 23.767 -5.622 4.558 1.00 0.00 O ATOM 575 CB SER A 41 23.207 -3.474 7.116 1.00 0.00 C ATOM 576 OG SER A 41 23.346 -2.134 7.541 1.00 0.00 O ATOM 0 H SER A 41 23.319 -3.032 4.435 1.00 0.00 H new ATOM 0 HA SER A 41 25.272 -3.706 6.558 1.00 0.00 H new ATOM 0 HB2 SER A 41 22.222 -3.620 6.672 1.00 0.00 H new ATOM 0 HB3 SER A 41 23.272 -4.142 7.975 1.00 0.00 H new ATOM 0 HG SER A 41 23.198 -1.533 6.781 1.00 0.00 H new ATOM 582 N GLN A 42 24.549 -6.188 6.603 1.00 0.00 N ATOM 583 CA GLN A 42 24.563 -7.638 6.437 1.00 0.00 C ATOM 584 C GLN A 42 23.598 -8.230 7.461 1.00 0.00 C ATOM 585 O GLN A 42 23.751 -7.965 8.656 1.00 0.00 O ATOM 586 CB GLN A 42 25.998 -8.153 6.665 1.00 0.00 C ATOM 587 CG GLN A 42 26.149 -9.687 6.663 1.00 0.00 C ATOM 588 CD GLN A 42 25.881 -10.329 5.298 1.00 0.00 C ATOM 589 OE1 GLN A 42 26.493 -9.968 4.297 1.00 0.00 O ATOM 590 NE2 GLN A 42 24.987 -11.301 5.222 1.00 0.00 N ATOM 0 H GLN A 42 24.855 -5.899 7.532 1.00 0.00 H new ATOM 0 HA GLN A 42 24.252 -7.930 5.434 1.00 0.00 H new ATOM 0 HB2 GLN A 42 26.644 -7.739 5.891 1.00 0.00 H new ATOM 0 HB3 GLN A 42 26.358 -7.769 7.619 1.00 0.00 H new ATOM 0 HG2 GLN A 42 27.158 -9.945 6.984 1.00 0.00 H new ATOM 0 HG3 GLN A 42 25.463 -10.112 7.396 1.00 0.00 H new ATOM 0 HE21 GLN A 42 24.482 -11.596 6.058 1.00 0.00 H new ATOM 0 HE22 GLN A 42 24.803 -11.756 4.328 1.00 0.00 H new ATOM 599 N TYR A 43 22.639 -9.041 7.016 1.00 0.00 N ATOM 600 CA TYR A 43 21.783 -9.847 7.881 1.00 0.00 C ATOM 601 C TYR A 43 22.111 -11.301 7.557 1.00 0.00 C ATOM 602 O TYR A 43 22.184 -11.661 6.376 1.00 0.00 O ATOM 603 CB TYR A 43 20.283 -9.625 7.617 1.00 0.00 C ATOM 604 CG TYR A 43 19.651 -8.251 7.783 1.00 0.00 C ATOM 605 CD1 TYR A 43 20.376 -7.112 8.186 1.00 0.00 C ATOM 606 CD2 TYR A 43 18.273 -8.128 7.516 1.00 0.00 C ATOM 607 CE1 TYR A 43 19.748 -5.860 8.271 1.00 0.00 C ATOM 608 CE2 TYR A 43 17.631 -6.886 7.633 1.00 0.00 C ATOM 609 CZ TYR A 43 18.368 -5.740 8.002 1.00 0.00 C ATOM 610 OH TYR A 43 17.739 -4.539 8.135 1.00 0.00 O ATOM 0 H TYR A 43 22.432 -9.157 6.024 1.00 0.00 H new ATOM 0 HA TYR A 43 21.967 -9.574 8.920 1.00 0.00 H new ATOM 0 HB2 TYR A 43 20.089 -9.944 6.593 1.00 0.00 H new ATOM 0 HB3 TYR A 43 19.740 -10.307 8.271 1.00 0.00 H new ATOM 0 HD1 TYR A 43 21.424 -7.203 8.432 1.00 0.00 H new ATOM 0 HD2 TYR A 43 17.706 -8.998 7.219 1.00 0.00 H new ATOM 0 HE1 TYR A 43 20.322 -4.987 8.543 1.00 0.00 H new ATOM 0 HE2 TYR A 43 16.571 -6.807 7.440 1.00 0.00 H new ATOM 0 HH TYR A 43 18.373 -3.815 7.950 1.00 0.00 H new ATOM 620 N SER A 44 22.277 -12.131 8.581 1.00 0.00 N ATOM 621 CA SER A 44 22.646 -13.525 8.430 1.00 0.00 C ATOM 622 C SER A 44 21.849 -14.340 9.450 1.00 0.00 C ATOM 623 O SER A 44 22.014 -14.166 10.659 1.00 0.00 O ATOM 624 CB SER A 44 24.158 -13.674 8.638 1.00 0.00 C ATOM 625 OG SER A 44 24.888 -12.834 7.751 1.00 0.00 O ATOM 0 H SER A 44 22.156 -11.845 9.553 1.00 0.00 H new ATOM 0 HA SER A 44 22.414 -13.891 7.430 1.00 0.00 H new ATOM 0 HB2 SER A 44 24.412 -13.426 9.669 1.00 0.00 H new ATOM 0 HB3 SER A 44 24.448 -14.713 8.480 1.00 0.00 H new ATOM 0 HG SER A 44 25.849 -12.949 7.907 1.00 0.00 H new ATOM 631 N ASP A 45 20.984 -15.227 8.954 1.00 0.00 N ATOM 632 CA ASP A 45 20.045 -16.043 9.727 1.00 0.00 C ATOM 633 C ASP A 45 19.282 -15.243 10.804 1.00 0.00 C ATOM 634 O ASP A 45 19.073 -15.719 11.921 1.00 0.00 O ATOM 635 CB ASP A 45 20.779 -17.282 10.261 1.00 0.00 C ATOM 636 CG ASP A 45 19.811 -18.329 10.829 1.00 0.00 C ATOM 637 OD1 ASP A 45 18.850 -18.695 10.115 1.00 0.00 O ATOM 638 OD2 ASP A 45 20.062 -18.851 11.940 1.00 0.00 O ATOM 0 H ASP A 45 20.916 -15.405 7.952 1.00 0.00 H new ATOM 0 HA ASP A 45 19.248 -16.386 9.067 1.00 0.00 H new ATOM 0 HB2 ASP A 45 21.365 -17.729 9.458 1.00 0.00 H new ATOM 0 HB3 ASP A 45 21.481 -16.980 11.038 1.00 0.00 H new ATOM 643 N ALA A 46 18.881 -14.006 10.486 1.00 0.00 N ATOM 644 CA ALA A 46 18.344 -13.018 11.422 1.00 0.00 C ATOM 645 C ALA A 46 16.989 -12.462 10.961 1.00 0.00 C ATOM 646 O ALA A 46 16.563 -12.689 9.830 1.00 0.00 O ATOM 647 CB ALA A 46 19.372 -11.887 11.552 1.00 0.00 C ATOM 0 H ALA A 46 18.925 -13.654 9.529 1.00 0.00 H new ATOM 0 HA ALA A 46 18.170 -13.496 12.386 1.00 0.00 H new ATOM 0 HB1 ALA A 46 18.998 -11.134 12.245 1.00 0.00 H new ATOM 0 HB2 ALA A 46 20.312 -12.291 11.928 1.00 0.00 H new ATOM 0 HB3 ALA A 46 19.537 -11.431 10.576 1.00 0.00 H new ATOM 653 N ASN A 47 16.304 -11.695 11.811 1.00 0.00 N ATOM 654 CA ASN A 47 15.003 -11.100 11.489 1.00 0.00 C ATOM 655 C ASN A 47 14.953 -9.670 11.993 1.00 0.00 C ATOM 656 O ASN A 47 15.420 -9.372 13.091 1.00 0.00 O ATOM 657 CB ASN A 47 13.877 -11.924 12.121 1.00 0.00 C ATOM 658 CG ASN A 47 12.500 -11.273 12.014 1.00 0.00 C ATOM 659 OD1 ASN A 47 12.142 -10.700 10.992 1.00 0.00 O ATOM 660 ND2 ASN A 47 11.698 -11.358 13.061 1.00 0.00 N ATOM 0 H ASN A 47 16.637 -11.467 12.748 1.00 0.00 H new ATOM 0 HA ASN A 47 14.869 -11.099 10.407 1.00 0.00 H new ATOM 0 HB2 ASN A 47 13.844 -12.903 11.643 1.00 0.00 H new ATOM 0 HB3 ASN A 47 14.109 -12.091 13.173 1.00 0.00 H new ATOM 0 HD21 ASN A 47 10.767 -10.943 13.025 1.00 0.00 H new ATOM 0 HD22 ASN A 47 12.010 -11.838 13.905 1.00 0.00 H new ATOM 667 N VAL A 48 14.375 -8.794 11.188 1.00 0.00 N ATOM 668 CA VAL A 48 14.321 -7.363 11.430 1.00 0.00 C ATOM 669 C VAL A 48 12.904 -6.888 11.106 1.00 0.00 C ATOM 670 O VAL A 48 12.367 -7.203 10.038 1.00 0.00 O ATOM 671 CB VAL A 48 15.420 -6.656 10.605 1.00 0.00 C ATOM 672 CG1 VAL A 48 15.450 -5.159 10.924 1.00 0.00 C ATOM 673 CG2 VAL A 48 16.819 -7.235 10.895 1.00 0.00 C ATOM 0 H VAL A 48 13.916 -9.069 10.320 1.00 0.00 H new ATOM 0 HA VAL A 48 14.525 -7.115 12.472 1.00 0.00 H new ATOM 0 HB VAL A 48 15.176 -6.819 9.555 1.00 0.00 H new ATOM 0 HG11 VAL A 48 16.230 -4.677 10.334 1.00 0.00 H new ATOM 0 HG12 VAL A 48 14.484 -4.716 10.681 1.00 0.00 H new ATOM 0 HG13 VAL A 48 15.657 -5.017 11.985 1.00 0.00 H new ATOM 0 HG21 VAL A 48 17.562 -6.710 10.294 1.00 0.00 H new ATOM 0 HG22 VAL A 48 17.053 -7.110 11.952 1.00 0.00 H new ATOM 0 HG23 VAL A 48 16.833 -8.296 10.644 1.00 0.00 H new ATOM 683 N LYS A 49 12.301 -6.141 12.038 1.00 0.00 N ATOM 684 CA LYS A 49 10.913 -5.693 11.961 1.00 0.00 C ATOM 685 C LYS A 49 10.866 -4.212 12.310 1.00 0.00 C ATOM 686 O LYS A 49 11.372 -3.821 13.365 1.00 0.00 O ATOM 687 CB LYS A 49 10.057 -6.534 12.925 1.00 0.00 C ATOM 688 CG LYS A 49 8.551 -6.257 12.779 1.00 0.00 C ATOM 689 CD LYS A 49 7.742 -7.073 13.799 1.00 0.00 C ATOM 690 CE LYS A 49 6.220 -6.970 13.599 1.00 0.00 C ATOM 691 NZ LYS A 49 5.666 -5.626 13.903 1.00 0.00 N ATOM 0 H LYS A 49 12.778 -5.826 12.883 1.00 0.00 H new ATOM 0 HA LYS A 49 10.511 -5.825 10.956 1.00 0.00 H new ATOM 0 HB2 LYS A 49 10.247 -7.592 12.744 1.00 0.00 H new ATOM 0 HB3 LYS A 49 10.362 -6.327 13.951 1.00 0.00 H new ATOM 0 HG2 LYS A 49 8.357 -5.194 12.922 1.00 0.00 H new ATOM 0 HG3 LYS A 49 8.227 -6.507 11.769 1.00 0.00 H new ATOM 0 HD2 LYS A 49 8.039 -8.120 13.733 1.00 0.00 H new ATOM 0 HD3 LYS A 49 7.992 -6.734 14.804 1.00 0.00 H new ATOM 0 HE2 LYS A 49 5.980 -7.227 12.567 1.00 0.00 H new ATOM 0 HE3 LYS A 49 5.729 -7.708 14.234 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 4.700 -5.725 14.275 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 6.264 -5.156 14.613 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 5.646 -5.054 13.034 1.00 0.00 H new ATOM 705 N LYS A 50 10.243 -3.404 11.451 1.00 0.00 N ATOM 706 CA LYS A 50 10.119 -1.947 11.546 1.00 0.00 C ATOM 707 C LYS A 50 11.364 -1.250 12.111 1.00 0.00 C ATOM 708 O LYS A 50 11.242 -0.374 12.966 1.00 0.00 O ATOM 709 CB LYS A 50 8.823 -1.619 12.325 1.00 0.00 C ATOM 710 CG LYS A 50 8.272 -0.206 12.058 1.00 0.00 C ATOM 711 CD LYS A 50 6.932 -0.009 12.784 1.00 0.00 C ATOM 712 CE LYS A 50 6.293 1.357 12.493 1.00 0.00 C ATOM 713 NZ LYS A 50 7.067 2.499 13.045 1.00 0.00 N ATOM 0 H LYS A 50 9.783 -3.771 10.618 1.00 0.00 H new ATOM 0 HA LYS A 50 10.046 -1.537 10.539 1.00 0.00 H new ATOM 0 HB2 LYS A 50 8.059 -2.351 12.063 1.00 0.00 H new ATOM 0 HB3 LYS A 50 9.016 -1.727 13.392 1.00 0.00 H new ATOM 0 HG2 LYS A 50 8.990 0.541 12.396 1.00 0.00 H new ATOM 0 HG3 LYS A 50 8.138 -0.057 10.987 1.00 0.00 H new ATOM 0 HD2 LYS A 50 6.243 -0.799 12.485 1.00 0.00 H new ATOM 0 HD3 LYS A 50 7.087 -0.111 13.858 1.00 0.00 H new ATOM 0 HE2 LYS A 50 6.194 1.482 11.415 1.00 0.00 H new ATOM 0 HE3 LYS A 50 5.286 1.375 12.909 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 6.583 3.390 12.814 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 7.140 2.402 14.078 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 8.020 2.505 12.630 1.00 0.00 H new ATOM 727 N SER A 51 12.566 -1.634 11.678 1.00 0.00 N ATOM 728 CA SER A 51 13.807 -1.125 12.254 1.00 0.00 C ATOM 729 C SER A 51 14.641 -0.475 11.160 1.00 0.00 C ATOM 730 O SER A 51 14.483 -0.815 9.988 1.00 0.00 O ATOM 731 CB SER A 51 14.555 -2.272 12.931 1.00 0.00 C ATOM 732 OG SER A 51 13.795 -2.809 13.999 1.00 0.00 O ATOM 0 H SER A 51 12.704 -2.304 10.921 1.00 0.00 H new ATOM 0 HA SER A 51 13.596 -0.368 13.009 1.00 0.00 H new ATOM 0 HB2 SER A 51 14.768 -3.054 12.202 1.00 0.00 H new ATOM 0 HB3 SER A 51 15.515 -1.915 13.305 1.00 0.00 H new ATOM 0 HG SER A 51 13.008 -3.271 13.641 1.00 0.00 H new ATOM 738 N VAL A 52 15.519 0.457 11.525 1.00 0.00 N ATOM 739 CA VAL A 52 16.253 1.296 10.583 1.00 0.00 C ATOM 740 C VAL A 52 17.731 1.052 10.863 1.00 0.00 C ATOM 741 O VAL A 52 18.227 1.403 11.935 1.00 0.00 O ATOM 742 CB VAL A 52 15.822 2.771 10.730 1.00 0.00 C ATOM 743 CG1 VAL A 52 16.529 3.655 9.692 1.00 0.00 C ATOM 744 CG2 VAL A 52 14.300 2.941 10.559 1.00 0.00 C ATOM 0 H VAL A 52 15.743 0.653 12.501 1.00 0.00 H new ATOM 0 HA VAL A 52 16.042 1.048 9.543 1.00 0.00 H new ATOM 0 HB VAL A 52 16.105 3.079 11.737 1.00 0.00 H new ATOM 0 HG11 VAL A 52 16.209 4.689 9.816 1.00 0.00 H new ATOM 0 HG12 VAL A 52 17.608 3.590 9.833 1.00 0.00 H new ATOM 0 HG13 VAL A 52 16.273 3.314 8.689 1.00 0.00 H new ATOM 0 HG21 VAL A 52 14.037 3.993 10.669 1.00 0.00 H new ATOM 0 HG22 VAL A 52 14.004 2.595 9.569 1.00 0.00 H new ATOM 0 HG23 VAL A 52 13.781 2.355 11.318 1.00 0.00 H new ATOM 754 N THR A 53 18.447 0.453 9.917 1.00 0.00 N ATOM 755 CA THR A 53 19.774 -0.042 10.126 1.00 0.00 C ATOM 756 C THR A 53 20.678 0.503 9.016 1.00 0.00 C ATOM 757 O THR A 53 20.318 0.455 7.836 1.00 0.00 O ATOM 758 CB THR A 53 19.573 -1.564 10.139 1.00 0.00 C ATOM 759 OG1 THR A 53 19.199 -1.995 11.433 1.00 0.00 O ATOM 760 CG2 THR A 53 20.794 -2.298 9.644 1.00 0.00 C ATOM 0 H THR A 53 18.101 0.302 8.970 1.00 0.00 H new ATOM 0 HA THR A 53 20.272 0.267 11.045 1.00 0.00 H new ATOM 0 HB THR A 53 18.765 -1.803 9.448 1.00 0.00 H new ATOM 0 HG1 THR A 53 19.072 -2.967 11.430 1.00 0.00 H new ATOM 0 HG21 THR A 53 20.608 -3.372 9.670 1.00 0.00 H new ATOM 0 HG22 THR A 53 21.013 -1.992 8.621 1.00 0.00 H new ATOM 0 HG23 THR A 53 21.645 -2.061 10.283 1.00 0.00 H new ATOM 768 N THR A 54 21.856 0.996 9.398 1.00 0.00 N ATOM 769 CA THR A 54 22.860 1.539 8.499 1.00 0.00 C ATOM 770 C THR A 54 24.222 0.996 8.936 1.00 0.00 C ATOM 771 O THR A 54 24.617 1.171 10.091 1.00 0.00 O ATOM 772 CB THR A 54 22.817 3.080 8.545 1.00 0.00 C ATOM 773 OG1 THR A 54 21.516 3.561 8.251 1.00 0.00 O ATOM 774 CG2 THR A 54 23.788 3.718 7.544 1.00 0.00 C ATOM 0 H THR A 54 22.142 1.027 10.377 1.00 0.00 H new ATOM 0 HA THR A 54 22.671 1.240 7.468 1.00 0.00 H new ATOM 0 HB THR A 54 23.109 3.358 9.558 1.00 0.00 H new ATOM 0 HG1 THR A 54 21.513 4.540 8.288 1.00 0.00 H new ATOM 0 HG21 THR A 54 23.721 4.804 7.614 1.00 0.00 H new ATOM 0 HG22 THR A 54 24.806 3.401 7.772 1.00 0.00 H new ATOM 0 HG23 THR A 54 23.528 3.403 6.533 1.00 0.00 H new ATOM 782 N ASP A 55 24.947 0.388 7.994 1.00 0.00 N ATOM 783 CA ASP A 55 26.269 -0.209 8.191 1.00 0.00 C ATOM 784 C ASP A 55 26.334 -1.099 9.439 1.00 0.00 C ATOM 785 O ASP A 55 27.079 -0.814 10.378 1.00 0.00 O ATOM 786 CB ASP A 55 27.362 0.875 8.162 1.00 0.00 C ATOM 787 CG ASP A 55 28.780 0.283 8.276 1.00 0.00 C ATOM 788 OD1 ASP A 55 29.058 -0.785 7.682 1.00 0.00 O ATOM 789 OD2 ASP A 55 29.652 0.923 8.907 1.00 0.00 O ATOM 0 H ASP A 55 24.615 0.295 7.034 1.00 0.00 H new ATOM 0 HA ASP A 55 26.460 -0.882 7.355 1.00 0.00 H new ATOM 0 HB2 ASP A 55 27.282 1.443 7.235 1.00 0.00 H new ATOM 0 HB3 ASP A 55 27.197 1.576 8.981 1.00 0.00 H new ATOM 794 N CYS A 56 25.532 -2.169 9.474 1.00 0.00 N ATOM 795 CA CYS A 56 25.501 -3.100 10.595 1.00 0.00 C ATOM 796 C CYS A 56 25.697 -4.539 10.127 1.00 0.00 C ATOM 797 O CYS A 56 25.567 -4.843 8.939 1.00 0.00 O ATOM 798 CB CYS A 56 24.209 -2.942 11.415 1.00 0.00 C ATOM 799 SG CYS A 56 24.072 -1.395 12.360 1.00 0.00 S ATOM 0 H CYS A 56 24.887 -2.410 8.722 1.00 0.00 H new ATOM 0 HA CYS A 56 26.336 -2.856 11.252 1.00 0.00 H new ATOM 0 HB2 CYS A 56 23.358 -3.011 10.738 1.00 0.00 H new ATOM 0 HB3 CYS A 56 24.134 -3.780 12.108 1.00 0.00 H new ATOM 804 N ASN A 57 25.989 -5.435 11.073 1.00 0.00 N ATOM 805 CA ASN A 57 26.223 -6.852 10.836 1.00 0.00 C ATOM 806 C ASN A 57 25.373 -7.557 11.876 1.00 0.00 C ATOM 807 O ASN A 57 25.633 -7.410 13.069 1.00 0.00 O ATOM 808 CB ASN A 57 27.715 -7.177 11.005 1.00 0.00 C ATOM 809 CG ASN A 57 27.981 -8.677 11.093 1.00 0.00 C ATOM 810 OD1 ASN A 57 27.291 -9.488 10.483 1.00 0.00 O ATOM 811 ND2 ASN A 57 28.992 -9.075 11.850 1.00 0.00 N ATOM 0 H ASN A 57 26.071 -5.180 12.057 1.00 0.00 H new ATOM 0 HA ASN A 57 25.959 -7.165 9.826 1.00 0.00 H new ATOM 0 HB2 ASN A 57 28.271 -6.762 10.165 1.00 0.00 H new ATOM 0 HB3 ASN A 57 28.089 -6.692 11.906 1.00 0.00 H new ATOM 0 HD21 ASN A 57 29.207 -10.069 11.933 1.00 0.00 H new ATOM 0 HD22 ASN A 57 29.556 -8.388 12.350 1.00 0.00 H new ATOM 818 N ILE A 58 24.334 -8.254 11.440 1.00 0.00 N ATOM 819 CA ILE A 58 23.299 -8.790 12.306 1.00 0.00 C ATOM 820 C ILE A 58 23.279 -10.294 12.067 1.00 0.00 C ATOM 821 O ILE A 58 22.841 -10.743 11.008 1.00 0.00 O ATOM 822 CB ILE A 58 21.958 -8.067 12.005 1.00 0.00 C ATOM 823 CG1 ILE A 58 22.106 -6.539 12.226 1.00 0.00 C ATOM 824 CG2 ILE A 58 20.821 -8.655 12.858 1.00 0.00 C ATOM 825 CD1 ILE A 58 20.834 -5.718 11.991 1.00 0.00 C ATOM 0 H ILE A 58 24.186 -8.466 10.453 1.00 0.00 H new ATOM 0 HA ILE A 58 23.483 -8.619 13.367 1.00 0.00 H new ATOM 0 HB ILE A 58 21.700 -8.228 10.958 1.00 0.00 H new ATOM 0 HG12 ILE A 58 22.446 -6.367 13.247 1.00 0.00 H new ATOM 0 HG13 ILE A 58 22.887 -6.166 11.563 1.00 0.00 H new ATOM 0 HG21 ILE A 58 19.890 -8.135 12.632 1.00 0.00 H new ATOM 0 HG22 ILE A 58 20.708 -9.715 12.632 1.00 0.00 H new ATOM 0 HG23 ILE A 58 21.058 -8.532 13.915 1.00 0.00 H new ATOM 0 HD11 ILE A 58 21.043 -4.664 12.172 1.00 0.00 H new ATOM 0 HD12 ILE A 58 20.500 -5.851 10.962 1.00 0.00 H new ATOM 0 HD13 ILE A 58 20.053 -6.055 12.672 1.00 0.00 H new ATOM 837 N ASP A 59 23.769 -11.068 13.036 1.00 0.00 N ATOM 838 CA ASP A 59 23.926 -12.512 12.908 1.00 0.00 C ATOM 839 C ASP A 59 23.057 -13.198 13.952 1.00 0.00 C ATOM 840 O ASP A 59 23.105 -12.826 15.126 1.00 0.00 O ATOM 841 CB ASP A 59 25.398 -12.889 13.088 1.00 0.00 C ATOM 842 CG ASP A 59 25.592 -14.409 12.979 1.00 0.00 C ATOM 843 OD1 ASP A 59 25.476 -14.950 11.858 1.00 0.00 O ATOM 844 OD2 ASP A 59 25.903 -15.058 14.001 1.00 0.00 O ATOM 0 H ASP A 59 24.070 -10.704 13.940 1.00 0.00 H new ATOM 0 HA ASP A 59 23.611 -12.838 11.917 1.00 0.00 H new ATOM 0 HB2 ASP A 59 26.001 -12.386 12.332 1.00 0.00 H new ATOM 0 HB3 ASP A 59 25.750 -12.542 14.059 1.00 0.00 H new ATOM 849 N LYS A 60 22.249 -14.175 13.530 1.00 0.00 N ATOM 850 CA LYS A 60 21.369 -15.001 14.371 1.00 0.00 C ATOM 851 C LYS A 60 20.571 -14.207 15.419 1.00 0.00 C ATOM 852 O LYS A 60 20.346 -14.701 16.525 1.00 0.00 O ATOM 853 CB LYS A 60 22.155 -16.185 14.971 1.00 0.00 C ATOM 854 CG LYS A 60 22.742 -17.108 13.889 1.00 0.00 C ATOM 855 CD LYS A 60 23.366 -18.388 14.467 1.00 0.00 C ATOM 856 CE LYS A 60 22.327 -19.394 14.990 1.00 0.00 C ATOM 857 NZ LYS A 60 21.588 -20.086 13.903 1.00 0.00 N ATOM 0 H LYS A 60 22.186 -14.426 12.543 1.00 0.00 H new ATOM 0 HA LYS A 60 20.597 -15.408 13.717 1.00 0.00 H new ATOM 0 HB2 LYS A 60 22.962 -15.802 15.595 1.00 0.00 H new ATOM 0 HB3 LYS A 60 21.497 -16.763 15.620 1.00 0.00 H new ATOM 0 HG2 LYS A 60 21.956 -17.380 13.185 1.00 0.00 H new ATOM 0 HG3 LYS A 60 23.500 -16.563 13.326 1.00 0.00 H new ATOM 0 HD2 LYS A 60 23.970 -18.868 13.697 1.00 0.00 H new ATOM 0 HD3 LYS A 60 24.041 -18.119 15.280 1.00 0.00 H new ATOM 0 HE2 LYS A 60 22.829 -20.137 15.610 1.00 0.00 H new ATOM 0 HE3 LYS A 60 21.615 -18.873 15.630 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 20.891 -20.738 14.317 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 21.097 -19.383 13.315 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 22.257 -20.623 13.315 1.00 0.00 H new ATOM 871 N SER A 61 20.141 -12.987 15.091 1.00 0.00 N ATOM 872 CA SER A 61 19.495 -12.077 16.032 1.00 0.00 C ATOM 873 C SER A 61 18.083 -11.726 15.563 1.00 0.00 C ATOM 874 O SER A 61 17.747 -11.928 14.392 1.00 0.00 O ATOM 875 CB SER A 61 20.353 -10.813 16.177 1.00 0.00 C ATOM 876 OG SER A 61 21.646 -11.128 16.662 1.00 0.00 O ATOM 0 H SER A 61 20.234 -12.601 14.152 1.00 0.00 H new ATOM 0 HA SER A 61 19.407 -12.564 17.003 1.00 0.00 H new ATOM 0 HB2 SER A 61 20.435 -10.313 15.212 1.00 0.00 H new ATOM 0 HB3 SER A 61 19.866 -10.115 16.858 1.00 0.00 H new ATOM 0 HG SER A 61 22.111 -11.693 16.010 1.00 0.00 H new ATOM 882 N GLN A 62 17.267 -11.158 16.455 1.00 0.00 N ATOM 883 CA GLN A 62 15.981 -10.575 16.098 1.00 0.00 C ATOM 884 C GLN A 62 15.944 -9.131 16.584 1.00 0.00 C ATOM 885 O GLN A 62 16.431 -8.813 17.673 1.00 0.00 O ATOM 886 CB GLN A 62 14.787 -11.390 16.608 1.00 0.00 C ATOM 887 CG GLN A 62 14.798 -12.841 16.099 1.00 0.00 C ATOM 888 CD GLN A 62 13.391 -13.438 16.055 1.00 0.00 C ATOM 889 OE1 GLN A 62 12.555 -13.021 15.254 1.00 0.00 O ATOM 890 NE2 GLN A 62 13.094 -14.424 16.887 1.00 0.00 N ATOM 0 H GLN A 62 17.486 -11.092 17.449 1.00 0.00 H new ATOM 0 HA GLN A 62 15.884 -10.594 15.012 1.00 0.00 H new ATOM 0 HB2 GLN A 62 14.792 -11.392 17.698 1.00 0.00 H new ATOM 0 HB3 GLN A 62 13.862 -10.906 16.295 1.00 0.00 H new ATOM 0 HG2 GLN A 62 15.238 -12.873 15.102 1.00 0.00 H new ATOM 0 HG3 GLN A 62 15.431 -13.448 16.746 1.00 0.00 H new ATOM 0 HE21 GLN A 62 13.794 -14.763 17.547 1.00 0.00 H new ATOM 0 HE22 GLN A 62 12.165 -14.845 16.868 1.00 0.00 H new ATOM 899 N VAL A 63 15.363 -8.264 15.764 1.00 0.00 N ATOM 900 CA VAL A 63 15.414 -6.822 15.915 1.00 0.00 C ATOM 901 C VAL A 63 14.003 -6.291 15.672 1.00 0.00 C ATOM 902 O VAL A 63 13.383 -6.644 14.665 1.00 0.00 O ATOM 903 CB VAL A 63 16.419 -6.274 14.878 1.00 0.00 C ATOM 904 CG1 VAL A 63 16.591 -4.759 14.993 1.00 0.00 C ATOM 905 CG2 VAL A 63 17.803 -6.938 14.959 1.00 0.00 C ATOM 0 H VAL A 63 14.826 -8.559 14.949 1.00 0.00 H new ATOM 0 HA VAL A 63 15.742 -6.513 16.907 1.00 0.00 H new ATOM 0 HB VAL A 63 15.981 -6.521 13.911 1.00 0.00 H new ATOM 0 HG11 VAL A 63 17.306 -4.416 14.245 1.00 0.00 H new ATOM 0 HG12 VAL A 63 15.631 -4.270 14.828 1.00 0.00 H new ATOM 0 HG13 VAL A 63 16.959 -4.509 15.988 1.00 0.00 H new ATOM 0 HG21 VAL A 63 18.459 -6.506 14.203 1.00 0.00 H new ATOM 0 HG22 VAL A 63 18.230 -6.771 15.948 1.00 0.00 H new ATOM 0 HG23 VAL A 63 17.703 -8.009 14.783 1.00 0.00 H new ATOM 915 N TYR A 64 13.505 -5.439 16.568 1.00 0.00 N ATOM 916 CA TYR A 64 12.150 -4.907 16.508 1.00 0.00 C ATOM 917 C TYR A 64 12.203 -3.421 16.847 1.00 0.00 C ATOM 918 O TYR A 64 12.775 -3.064 17.875 1.00 0.00 O ATOM 919 CB TYR A 64 11.244 -5.641 17.518 1.00 0.00 C ATOM 920 CG TYR A 64 11.377 -7.154 17.572 1.00 0.00 C ATOM 921 CD1 TYR A 64 10.636 -7.971 16.696 1.00 0.00 C ATOM 922 CD2 TYR A 64 12.223 -7.749 18.529 1.00 0.00 C ATOM 923 CE1 TYR A 64 10.725 -9.373 16.785 1.00 0.00 C ATOM 924 CE2 TYR A 64 12.321 -9.148 18.624 1.00 0.00 C ATOM 925 CZ TYR A 64 11.560 -9.967 17.759 1.00 0.00 C ATOM 926 OH TYR A 64 11.632 -11.322 17.885 1.00 0.00 O ATOM 0 H TYR A 64 14.041 -5.096 17.365 1.00 0.00 H new ATOM 0 HA TYR A 64 11.739 -5.052 15.509 1.00 0.00 H new ATOM 0 HB2 TYR A 64 11.450 -5.245 18.512 1.00 0.00 H new ATOM 0 HB3 TYR A 64 10.207 -5.398 17.286 1.00 0.00 H new ATOM 0 HD1 TYR A 64 9.996 -7.519 15.952 1.00 0.00 H new ATOM 0 HD2 TYR A 64 12.801 -7.125 19.195 1.00 0.00 H new ATOM 0 HE1 TYR A 64 10.156 -9.995 16.110 1.00 0.00 H new ATOM 0 HE2 TYR A 64 12.976 -9.596 19.356 1.00 0.00 H new ATOM 0 HH TYR A 64 12.256 -11.551 18.605 1.00 0.00 H new ATOM 936 N LEU A 65 11.587 -2.561 16.032 1.00 0.00 N ATOM 937 CA LEU A 65 11.422 -1.117 16.263 1.00 0.00 C ATOM 938 C LEU A 65 12.732 -0.404 16.677 1.00 0.00 C ATOM 939 O LEU A 65 12.702 0.615 17.371 1.00 0.00 O ATOM 940 CB LEU A 65 10.251 -0.862 17.243 1.00 0.00 C ATOM 941 CG LEU A 65 8.839 -1.050 16.647 1.00 0.00 C ATOM 942 CD1 LEU A 65 8.470 -2.509 16.338 1.00 0.00 C ATOM 943 CD2 LEU A 65 7.797 -0.491 17.624 1.00 0.00 C ATOM 0 H LEU A 65 11.169 -2.863 15.152 1.00 0.00 H new ATOM 0 HA LEU A 65 11.163 -0.660 15.308 1.00 0.00 H new ATOM 0 HB2 LEU A 65 10.360 -1.532 18.096 1.00 0.00 H new ATOM 0 HB3 LEU A 65 10.334 0.155 17.625 1.00 0.00 H new ATOM 0 HG LEU A 65 8.845 -0.515 15.698 1.00 0.00 H new ATOM 0 HD11 LEU A 65 7.463 -2.550 15.923 1.00 0.00 H new ATOM 0 HD12 LEU A 65 9.177 -2.918 15.616 1.00 0.00 H new ATOM 0 HD13 LEU A 65 8.508 -3.096 17.256 1.00 0.00 H new ATOM 0 HD21 LEU A 65 6.799 -0.622 17.206 1.00 0.00 H new ATOM 0 HD22 LEU A 65 7.866 -1.023 18.573 1.00 0.00 H new ATOM 0 HD23 LEU A 65 7.985 0.570 17.788 1.00 0.00 H new ATOM 955 N THR A 66 13.887 -0.922 16.263 1.00 0.00 N ATOM 956 CA THR A 66 15.204 -0.512 16.738 1.00 0.00 C ATOM 957 C THR A 66 15.944 0.291 15.655 1.00 0.00 C ATOM 958 O THR A 66 15.570 0.276 14.479 1.00 0.00 O ATOM 959 CB THR A 66 15.909 -1.804 17.204 1.00 0.00 C ATOM 960 OG1 THR A 66 15.303 -2.227 18.413 1.00 0.00 O ATOM 961 CG2 THR A 66 17.417 -1.752 17.455 1.00 0.00 C ATOM 0 H THR A 66 13.931 -1.664 15.564 1.00 0.00 H new ATOM 0 HA THR A 66 15.163 0.178 17.581 1.00 0.00 H new ATOM 0 HB THR A 66 15.789 -2.481 16.358 1.00 0.00 H new ATOM 0 HG1 THR A 66 14.433 -2.633 18.218 1.00 0.00 H new ATOM 0 HG21 THR A 66 17.766 -2.733 17.776 1.00 0.00 H new ATOM 0 HG22 THR A 66 17.929 -1.467 16.536 1.00 0.00 H new ATOM 0 HG23 THR A 66 17.631 -1.018 18.232 1.00 0.00 H new ATOM 969 N THR A 67 17.003 0.999 16.048 1.00 0.00 N ATOM 970 CA THR A 67 17.850 1.776 15.157 1.00 0.00 C ATOM 971 C THR A 67 19.295 1.299 15.343 1.00 0.00 C ATOM 972 O THR A 67 19.775 1.236 16.477 1.00 0.00 O ATOM 973 CB THR A 67 17.668 3.275 15.450 1.00 0.00 C ATOM 974 OG1 THR A 67 16.296 3.631 15.420 1.00 0.00 O ATOM 975 CG2 THR A 67 18.399 4.153 14.429 1.00 0.00 C ATOM 0 H THR A 67 17.299 1.046 17.023 1.00 0.00 H new ATOM 0 HA THR A 67 17.577 1.630 14.112 1.00 0.00 H new ATOM 0 HB THR A 67 18.088 3.445 16.441 1.00 0.00 H new ATOM 0 HG1 THR A 67 16.202 4.588 15.610 1.00 0.00 H new ATOM 0 HG21 THR A 67 18.243 5.203 14.675 1.00 0.00 H new ATOM 0 HG22 THR A 67 19.465 3.929 14.454 1.00 0.00 H new ATOM 0 HG23 THR A 67 18.009 3.952 13.431 1.00 0.00 H new ATOM 983 N CYS A 68 19.987 0.978 14.247 1.00 0.00 N ATOM 984 CA CYS A 68 21.344 0.443 14.260 1.00 0.00 C ATOM 985 C CYS A 68 22.214 1.323 13.372 1.00 0.00 C ATOM 986 O CYS A 68 21.870 1.545 12.210 1.00 0.00 O ATOM 987 CB CYS A 68 21.340 -1.005 13.749 1.00 0.00 C ATOM 988 SG CYS A 68 22.905 -1.897 13.961 1.00 0.00 S ATOM 0 H CYS A 68 19.608 1.087 13.306 1.00 0.00 H new ATOM 0 HA CYS A 68 21.741 0.441 15.275 1.00 0.00 H new ATOM 0 HB2 CYS A 68 20.553 -1.555 14.266 1.00 0.00 H new ATOM 0 HB3 CYS A 68 21.083 -1.000 12.690 1.00 0.00 H new ATOM 993 N THR A 69 23.346 1.792 13.895 1.00 0.00 N ATOM 994 CA THR A 69 24.296 2.603 13.149 1.00 0.00 C ATOM 995 C THR A 69 25.698 2.096 13.482 1.00 0.00 C ATOM 996 O THR A 69 26.092 2.117 14.651 1.00 0.00 O ATOM 997 CB THR A 69 24.119 4.089 13.523 1.00 0.00 C ATOM 998 OG1 THR A 69 22.760 4.488 13.455 1.00 0.00 O ATOM 999 CG2 THR A 69 24.920 5.004 12.591 1.00 0.00 C ATOM 0 H THR A 69 23.629 1.615 14.859 1.00 0.00 H new ATOM 0 HA THR A 69 24.130 2.521 12.075 1.00 0.00 H new ATOM 0 HB THR A 69 24.484 4.185 14.546 1.00 0.00 H new ATOM 0 HG1 THR A 69 22.684 5.434 13.699 1.00 0.00 H new ATOM 0 HG21 THR A 69 24.771 6.043 12.885 1.00 0.00 H new ATOM 0 HG22 THR A 69 25.979 4.756 12.660 1.00 0.00 H new ATOM 0 HG23 THR A 69 24.581 4.865 11.565 1.00 0.00 H new ATOM 1007 N GLY A 70 26.454 1.641 12.477 1.00 0.00 N ATOM 1008 CA GLY A 70 27.858 1.269 12.645 1.00 0.00 C ATOM 1009 C GLY A 70 28.057 0.253 13.773 1.00 0.00 C ATOM 1010 O GLY A 70 28.991 0.400 14.561 1.00 0.00 O ATOM 0 H GLY A 70 26.107 1.521 11.525 1.00 0.00 H new ATOM 0 HA2 GLY A 70 28.235 0.851 11.712 1.00 0.00 H new ATOM 0 HA3 GLY A 70 28.446 2.162 12.855 1.00 0.00 H new ATOM 1014 N SER A 71 27.153 -0.724 13.899 1.00 0.00 N ATOM 1015 CA SER A 71 27.083 -1.620 15.046 1.00 0.00 C ATOM 1016 C SER A 71 26.882 -3.075 14.620 1.00 0.00 C ATOM 1017 O SER A 71 26.615 -3.360 13.454 1.00 0.00 O ATOM 1018 CB SER A 71 25.957 -1.141 15.976 1.00 0.00 C ATOM 1019 OG SER A 71 26.281 0.115 16.543 1.00 0.00 O ATOM 0 H SER A 71 26.441 -0.913 13.194 1.00 0.00 H new ATOM 0 HA SER A 71 28.032 -1.591 15.582 1.00 0.00 H new ATOM 0 HB2 SER A 71 25.024 -1.064 15.417 1.00 0.00 H new ATOM 0 HB3 SER A 71 25.795 -1.873 16.767 1.00 0.00 H new ATOM 0 HG SER A 71 26.210 0.812 15.857 1.00 0.00 H new ATOM 1025 N GLN A 72 27.012 -4.018 15.552 1.00 0.00 N ATOM 1026 CA GLN A 72 26.910 -5.441 15.267 1.00 0.00 C ATOM 1027 C GLN A 72 26.021 -6.108 16.303 1.00 0.00 C ATOM 1028 O GLN A 72 26.120 -5.792 17.492 1.00 0.00 O ATOM 1029 CB GLN A 72 28.291 -6.113 15.263 1.00 0.00 C ATOM 1030 CG GLN A 72 29.329 -5.420 14.372 1.00 0.00 C ATOM 1031 CD GLN A 72 30.553 -6.312 14.204 1.00 0.00 C ATOM 1032 OE1 GLN A 72 30.634 -7.106 13.267 1.00 0.00 O ATOM 1033 NE2 GLN A 72 31.505 -6.231 15.120 1.00 0.00 N ATOM 0 H GLN A 72 27.193 -3.810 16.534 1.00 0.00 H new ATOM 0 HA GLN A 72 26.474 -5.556 14.275 1.00 0.00 H new ATOM 0 HB2 GLN A 72 28.670 -6.144 16.285 1.00 0.00 H new ATOM 0 HB3 GLN A 72 28.178 -7.146 14.933 1.00 0.00 H new ATOM 0 HG2 GLN A 72 28.894 -5.199 13.397 1.00 0.00 H new ATOM 0 HG3 GLN A 72 29.621 -4.467 14.814 1.00 0.00 H new ATOM 0 HE21 GLN A 72 31.418 -5.566 15.888 1.00 0.00 H new ATOM 0 HE22 GLN A 72 32.326 -6.834 15.057 1.00 0.00 H new ATOM 1042 N TYR A 73 25.209 -7.066 15.860 1.00 0.00 N ATOM 1043 CA TYR A 73 24.339 -7.870 16.706 1.00 0.00 C ATOM 1044 C TYR A 73 24.700 -9.324 16.427 1.00 0.00 C ATOM 1045 O TYR A 73 24.820 -9.704 15.263 1.00 0.00 O ATOM 1046 CB TYR A 73 22.867 -7.627 16.341 1.00 0.00 C ATOM 1047 CG TYR A 73 22.286 -6.226 16.481 1.00 0.00 C ATOM 1048 CD1 TYR A 73 22.852 -5.248 17.326 1.00 0.00 C ATOM 1049 CD2 TYR A 73 21.119 -5.915 15.758 1.00 0.00 C ATOM 1050 CE1 TYR A 73 22.284 -3.965 17.404 1.00 0.00 C ATOM 1051 CE2 TYR A 73 20.534 -4.643 15.844 1.00 0.00 C ATOM 1052 CZ TYR A 73 21.121 -3.656 16.662 1.00 0.00 C ATOM 1053 OH TYR A 73 20.552 -2.425 16.723 1.00 0.00 O ATOM 0 H TYR A 73 25.139 -7.309 14.872 1.00 0.00 H new ATOM 0 HA TYR A 73 24.469 -7.614 17.758 1.00 0.00 H new ATOM 0 HB2 TYR A 73 22.731 -7.936 15.305 1.00 0.00 H new ATOM 0 HB3 TYR A 73 22.263 -8.295 16.955 1.00 0.00 H new ATOM 0 HD1 TYR A 73 23.725 -5.486 17.915 1.00 0.00 H new ATOM 0 HD2 TYR A 73 20.667 -6.667 15.128 1.00 0.00 H new ATOM 0 HE1 TYR A 73 22.737 -3.213 18.033 1.00 0.00 H new ATOM 0 HE2 TYR A 73 19.637 -4.420 15.285 1.00 0.00 H new ATOM 0 HH TYR A 73 21.050 -1.865 17.355 1.00 0.00 H new ATOM 1063 N ASN A 74 24.898 -10.133 17.465 1.00 0.00 N ATOM 1064 CA ASN A 74 25.349 -11.513 17.326 1.00 0.00 C ATOM 1065 C ASN A 74 24.630 -12.397 18.351 1.00 0.00 C ATOM 1066 O ASN A 74 25.027 -12.455 19.515 1.00 0.00 O ATOM 1067 CB ASN A 74 26.875 -11.544 17.521 1.00 0.00 C ATOM 1068 CG ASN A 74 27.416 -12.943 17.803 1.00 0.00 C ATOM 1069 OD1 ASN A 74 27.036 -13.919 17.164 1.00 0.00 O ATOM 1070 ND2 ASN A 74 28.319 -13.066 18.763 1.00 0.00 N ATOM 0 H ASN A 74 24.749 -9.846 18.432 1.00 0.00 H new ATOM 0 HA ASN A 74 25.112 -11.901 16.336 1.00 0.00 H new ATOM 0 HB2 ASN A 74 27.357 -11.148 16.627 1.00 0.00 H new ATOM 0 HB3 ASN A 74 27.143 -10.884 18.346 1.00 0.00 H new ATOM 0 HD21 ASN A 74 28.710 -13.983 18.981 1.00 0.00 H new ATOM 0 HD22 ASN A 74 28.624 -12.244 19.285 1.00 0.00 H new ATOM 1077 N GLY A 75 23.566 -13.085 17.943 1.00 0.00 N ATOM 1078 CA GLY A 75 22.794 -13.948 18.824 1.00 0.00 C ATOM 1079 C GLY A 75 22.035 -13.158 19.894 1.00 0.00 C ATOM 1080 O GLY A 75 22.112 -13.521 21.071 1.00 0.00 O ATOM 0 H GLY A 75 23.216 -13.057 16.985 1.00 0.00 H new ATOM 0 HA2 GLY A 75 22.085 -14.527 18.232 1.00 0.00 H new ATOM 0 HA3 GLY A 75 23.462 -14.661 19.308 1.00 0.00 H new ATOM 1084 N ILE A 76 21.339 -12.075 19.521 1.00 0.00 N ATOM 1085 CA ILE A 76 20.642 -11.203 20.474 1.00 0.00 C ATOM 1086 C ILE A 76 19.172 -11.015 20.086 1.00 0.00 C ATOM 1087 O ILE A 76 18.771 -11.281 18.952 1.00 0.00 O ATOM 1088 CB ILE A 76 21.379 -9.847 20.653 1.00 0.00 C ATOM 1089 CG1 ILE A 76 20.983 -8.783 19.604 1.00 0.00 C ATOM 1090 CG2 ILE A 76 22.912 -10.024 20.699 1.00 0.00 C ATOM 1091 CD1 ILE A 76 21.660 -7.423 19.814 1.00 0.00 C ATOM 0 H ILE A 76 21.244 -11.780 18.549 1.00 0.00 H new ATOM 0 HA ILE A 76 20.655 -11.698 21.445 1.00 0.00 H new ATOM 0 HB ILE A 76 21.047 -9.469 21.620 1.00 0.00 H new ATOM 0 HG12 ILE A 76 21.235 -9.154 18.611 1.00 0.00 H new ATOM 0 HG13 ILE A 76 19.902 -8.647 19.628 1.00 0.00 H new ATOM 0 HG21 ILE A 76 23.387 -9.051 20.825 1.00 0.00 H new ATOM 0 HG22 ILE A 76 23.179 -10.669 21.536 1.00 0.00 H new ATOM 0 HG23 ILE A 76 23.254 -10.477 19.768 1.00 0.00 H new ATOM 0 HD11 ILE A 76 21.332 -6.730 19.039 1.00 0.00 H new ATOM 0 HD12 ILE A 76 21.388 -7.028 20.793 1.00 0.00 H new ATOM 0 HD13 ILE A 76 22.742 -7.543 19.759 1.00 0.00 H new ATOM 1103 N TYR A 77 18.389 -10.461 21.007 1.00 0.00 N ATOM 1104 CA TYR A 77 17.030 -10.004 20.784 1.00 0.00 C ATOM 1105 C TYR A 77 17.005 -8.554 21.259 1.00 0.00 C ATOM 1106 O TYR A 77 17.380 -8.285 22.404 1.00 0.00 O ATOM 1107 CB TYR A 77 16.044 -10.891 21.565 1.00 0.00 C ATOM 1108 CG TYR A 77 16.293 -12.387 21.438 1.00 0.00 C ATOM 1109 CD1 TYR A 77 16.164 -13.027 20.191 1.00 0.00 C ATOM 1110 CD2 TYR A 77 16.705 -13.130 22.563 1.00 0.00 C ATOM 1111 CE1 TYR A 77 16.441 -14.400 20.062 1.00 0.00 C ATOM 1112 CE2 TYR A 77 16.981 -14.504 22.445 1.00 0.00 C ATOM 1113 CZ TYR A 77 16.850 -15.146 21.192 1.00 0.00 C ATOM 1114 OH TYR A 77 17.128 -16.477 21.088 1.00 0.00 O ATOM 0 H TYR A 77 18.701 -10.314 21.967 1.00 0.00 H new ATOM 0 HA TYR A 77 16.729 -10.067 19.738 1.00 0.00 H new ATOM 0 HB2 TYR A 77 16.088 -10.618 22.619 1.00 0.00 H new ATOM 0 HB3 TYR A 77 15.032 -10.675 21.222 1.00 0.00 H new ATOM 0 HD1 TYR A 77 15.850 -12.460 19.327 1.00 0.00 H new ATOM 0 HD2 TYR A 77 16.809 -12.641 23.521 1.00 0.00 H new ATOM 0 HE1 TYR A 77 16.342 -14.884 19.102 1.00 0.00 H new ATOM 0 HE2 TYR A 77 17.293 -15.069 23.311 1.00 0.00 H new ATOM 0 HH TYR A 77 17.394 -16.825 21.965 1.00 0.00 H new ATOM 1124 N ILE A 78 16.617 -7.613 20.399 1.00 0.00 N ATOM 1125 CA ILE A 78 16.679 -6.186 20.716 1.00 0.00 C ATOM 1126 C ILE A 78 15.398 -5.502 20.238 1.00 0.00 C ATOM 1127 O ILE A 78 14.942 -5.735 19.116 1.00 0.00 O ATOM 1128 CB ILE A 78 17.992 -5.571 20.175 1.00 0.00 C ATOM 1129 CG1 ILE A 78 18.053 -4.069 20.528 1.00 0.00 C ATOM 1130 CG2 ILE A 78 18.208 -5.808 18.670 1.00 0.00 C ATOM 1131 CD1 ILE A 78 19.444 -3.452 20.354 1.00 0.00 C ATOM 0 H ILE A 78 16.253 -7.816 19.468 1.00 0.00 H new ATOM 0 HA ILE A 78 16.718 -6.026 21.793 1.00 0.00 H new ATOM 0 HB ILE A 78 18.815 -6.090 20.667 1.00 0.00 H new ATOM 0 HG12 ILE A 78 17.344 -3.528 19.901 1.00 0.00 H new ATOM 0 HG13 ILE A 78 17.732 -3.934 21.561 1.00 0.00 H new ATOM 0 HG21 ILE A 78 19.147 -5.350 18.361 1.00 0.00 H new ATOM 0 HG22 ILE A 78 18.245 -6.879 18.472 1.00 0.00 H new ATOM 0 HG23 ILE A 78 17.385 -5.363 18.110 1.00 0.00 H new ATOM 0 HD11 ILE A 78 19.409 -2.396 20.620 1.00 0.00 H new ATOM 0 HD12 ILE A 78 20.154 -3.966 21.002 1.00 0.00 H new ATOM 0 HD13 ILE A 78 19.760 -3.554 19.316 1.00 0.00 H new ATOM 1143 N ARG A 79 14.802 -4.681 21.108 1.00 0.00 N ATOM 1144 CA ARG A 79 13.477 -4.114 20.918 1.00 0.00 C ATOM 1145 C ARG A 79 13.511 -2.630 21.256 1.00 0.00 C ATOM 1146 O ARG A 79 14.018 -2.250 22.315 1.00 0.00 O ATOM 1147 CB ARG A 79 12.516 -4.900 21.824 1.00 0.00 C ATOM 1148 CG ARG A 79 11.085 -4.342 21.856 1.00 0.00 C ATOM 1149 CD ARG A 79 10.134 -5.284 22.602 1.00 0.00 C ATOM 1150 NE ARG A 79 10.546 -5.516 23.999 1.00 0.00 N ATOM 1151 CZ ARG A 79 9.814 -6.101 24.954 1.00 0.00 C ATOM 1152 NH1 ARG A 79 8.569 -6.507 24.715 1.00 0.00 N ATOM 1153 NH2 ARG A 79 10.357 -6.274 26.152 1.00 0.00 N ATOM 0 H ARG A 79 15.243 -4.390 21.981 1.00 0.00 H new ATOM 0 HA ARG A 79 13.139 -4.194 19.885 1.00 0.00 H new ATOM 0 HB2 ARG A 79 12.483 -5.936 21.488 1.00 0.00 H new ATOM 0 HB3 ARG A 79 12.914 -4.907 22.839 1.00 0.00 H new ATOM 0 HG2 ARG A 79 11.085 -3.365 22.339 1.00 0.00 H new ATOM 0 HG3 ARG A 79 10.728 -4.194 20.837 1.00 0.00 H new ATOM 0 HD2 ARG A 79 9.128 -4.864 22.589 1.00 0.00 H new ATOM 0 HD3 ARG A 79 10.088 -6.238 22.077 1.00 0.00 H new ATOM 0 HE ARG A 79 11.479 -5.200 24.263 1.00 0.00 H new ATOM 0 HH11 ARG A 79 8.158 -6.374 23.791 1.00 0.00 H new ATOM 0 HH12 ARG A 79 8.026 -6.951 25.456 1.00 0.00 H new ATOM 0 HH21 ARG A 79 11.312 -5.963 26.329 1.00 0.00 H new ATOM 0 HH22 ARG A 79 9.819 -6.717 26.897 1.00 0.00 H new ATOM 1167 N SER A 80 12.924 -1.805 20.395 1.00 0.00 N ATOM 1168 CA SER A 80 12.676 -0.386 20.622 1.00 0.00 C ATOM 1169 C SER A 80 13.921 0.393 21.085 1.00 0.00 C ATOM 1170 O SER A 80 13.795 1.352 21.850 1.00 0.00 O ATOM 1171 CB SER A 80 11.483 -0.264 21.577 1.00 0.00 C ATOM 1172 OG SER A 80 10.362 -0.970 21.066 1.00 0.00 O ATOM 0 H SER A 80 12.595 -2.120 19.483 1.00 0.00 H new ATOM 0 HA SER A 80 12.429 0.092 19.674 1.00 0.00 H new ATOM 0 HB2 SER A 80 11.752 -0.658 22.557 1.00 0.00 H new ATOM 0 HB3 SER A 80 11.226 0.786 21.715 1.00 0.00 H new ATOM 0 HG SER A 80 9.610 -0.884 21.688 1.00 0.00 H new ATOM 1178 N SER A 81 15.120 -0.012 20.651 1.00 0.00 N ATOM 1179 CA SER A 81 16.390 0.492 21.172 1.00 0.00 C ATOM 1180 C SER A 81 17.198 1.215 20.085 1.00 0.00 C ATOM 1181 O SER A 81 16.807 1.232 18.916 1.00 0.00 O ATOM 1182 CB SER A 81 17.166 -0.688 21.770 1.00 0.00 C ATOM 1183 OG SER A 81 16.472 -1.237 22.879 1.00 0.00 O ATOM 0 H SER A 81 15.234 -0.710 19.916 1.00 0.00 H new ATOM 0 HA SER A 81 16.201 1.233 21.949 1.00 0.00 H new ATOM 0 HB2 SER A 81 17.312 -1.456 21.010 1.00 0.00 H new ATOM 0 HB3 SER A 81 18.156 -0.357 22.083 1.00 0.00 H new ATOM 0 HG SER A 81 15.652 -1.674 22.568 1.00 0.00 H new ATOM 1189 N THR A 82 18.334 1.807 20.456 1.00 0.00 N ATOM 1190 CA THR A 82 19.244 2.484 19.539 1.00 0.00 C ATOM 1191 C THR A 82 20.674 2.064 19.891 1.00 0.00 C ATOM 1192 O THR A 82 21.035 2.055 21.070 1.00 0.00 O ATOM 1193 CB THR A 82 19.043 4.008 19.650 1.00 0.00 C ATOM 1194 OG1 THR A 82 17.700 4.359 19.367 1.00 0.00 O ATOM 1195 CG2 THR A 82 19.939 4.795 18.686 1.00 0.00 C ATOM 0 H THR A 82 18.652 1.828 21.425 1.00 0.00 H new ATOM 0 HA THR A 82 19.044 2.206 18.504 1.00 0.00 H new ATOM 0 HB THR A 82 19.309 4.267 20.675 1.00 0.00 H new ATOM 0 HG1 THR A 82 17.592 5.330 19.444 1.00 0.00 H new ATOM 0 HG21 THR A 82 19.755 5.862 18.808 1.00 0.00 H new ATOM 0 HG22 THR A 82 20.985 4.580 18.904 1.00 0.00 H new ATOM 0 HG23 THR A 82 19.715 4.503 17.660 1.00 0.00 H new ATOM 1203 N THR A 83 21.489 1.733 18.890 1.00 0.00 N ATOM 1204 CA THR A 83 22.852 1.249 19.079 1.00 0.00 C ATOM 1205 C THR A 83 23.758 1.939 18.054 1.00 0.00 C ATOM 1206 O THR A 83 23.458 1.914 16.853 1.00 0.00 O ATOM 1207 CB THR A 83 22.869 -0.285 18.956 1.00 0.00 C ATOM 1208 OG1 THR A 83 22.287 -0.685 17.735 1.00 0.00 O ATOM 1209 CG2 THR A 83 22.085 -0.969 20.081 1.00 0.00 C ATOM 0 H THR A 83 21.214 1.795 17.910 1.00 0.00 H new ATOM 0 HA THR A 83 23.228 1.492 20.073 1.00 0.00 H new ATOM 0 HB THR A 83 23.916 -0.584 19.014 1.00 0.00 H new ATOM 0 HG1 THR A 83 22.884 -1.314 17.278 1.00 0.00 H new ATOM 0 HG21 THR A 83 22.127 -2.050 19.949 1.00 0.00 H new ATOM 0 HG22 THR A 83 22.523 -0.704 21.043 1.00 0.00 H new ATOM 0 HG23 THR A 83 21.046 -0.641 20.052 1.00 0.00 H new ATOM 1217 N THR A 84 24.835 2.572 18.522 1.00 0.00 N ATOM 1218 CA THR A 84 25.703 3.415 17.716 1.00 0.00 C ATOM 1219 C THR A 84 27.160 3.106 18.073 1.00 0.00 C ATOM 1220 O THR A 84 27.590 3.348 19.203 1.00 0.00 O ATOM 1221 CB THR A 84 25.350 4.896 17.964 1.00 0.00 C ATOM 1222 OG1 THR A 84 23.961 5.130 17.801 1.00 0.00 O ATOM 1223 CG2 THR A 84 26.095 5.830 17.003 1.00 0.00 C ATOM 0 H THR A 84 25.130 2.508 19.496 1.00 0.00 H new ATOM 0 HA THR A 84 25.562 3.215 16.654 1.00 0.00 H new ATOM 0 HB THR A 84 25.651 5.107 18.990 1.00 0.00 H new ATOM 0 HG1 THR A 84 23.767 6.076 17.966 1.00 0.00 H new ATOM 0 HG21 THR A 84 25.818 6.863 17.212 1.00 0.00 H new ATOM 0 HG22 THR A 84 27.170 5.708 17.138 1.00 0.00 H new ATOM 0 HG23 THR A 84 25.828 5.583 15.975 1.00 0.00 H new ATOM 1231 N GLY A 85 27.946 2.609 17.116 1.00 0.00 N ATOM 1232 CA GLY A 85 29.349 2.285 17.349 1.00 0.00 C ATOM 1233 C GLY A 85 29.504 1.203 18.421 1.00 0.00 C ATOM 1234 O GLY A 85 30.306 1.364 19.344 1.00 0.00 O ATOM 0 H GLY A 85 27.628 2.422 16.165 1.00 0.00 H new ATOM 0 HA2 GLY A 85 29.804 1.945 16.419 1.00 0.00 H new ATOM 0 HA3 GLY A 85 29.885 3.183 17.657 1.00 0.00 H new ATOM 1238 N THR A 86 28.730 0.123 18.334 1.00 0.00 N ATOM 1239 CA THR A 86 28.614 -0.882 19.389 1.00 0.00 C ATOM 1240 C THR A 86 28.600 -2.287 18.780 1.00 0.00 C ATOM 1241 O THR A 86 27.983 -2.497 17.743 1.00 0.00 O ATOM 1242 CB THR A 86 27.323 -0.603 20.194 1.00 0.00 C ATOM 1243 OG1 THR A 86 26.261 -0.064 19.421 1.00 0.00 O ATOM 1244 CG2 THR A 86 27.550 0.404 21.317 1.00 0.00 C ATOM 0 H THR A 86 28.157 -0.082 17.516 1.00 0.00 H new ATOM 0 HA THR A 86 29.471 -0.826 20.060 1.00 0.00 H new ATOM 0 HB THR A 86 27.053 -1.589 20.571 1.00 0.00 H new ATOM 0 HG1 THR A 86 26.420 -0.250 18.472 1.00 0.00 H new ATOM 0 HG21 THR A 86 26.615 0.567 21.854 1.00 0.00 H new ATOM 0 HG22 THR A 86 28.301 0.018 22.006 1.00 0.00 H new ATOM 0 HG23 THR A 86 27.896 1.348 20.895 1.00 0.00 H new ATOM 1252 N SER A 87 29.219 -3.274 19.423 1.00 0.00 N ATOM 1253 CA SER A 87 29.092 -4.679 19.040 1.00 0.00 C ATOM 1254 C SER A 87 28.506 -5.404 20.243 1.00 0.00 C ATOM 1255 O SER A 87 28.972 -5.195 21.363 1.00 0.00 O ATOM 1256 CB SER A 87 30.455 -5.240 18.620 1.00 0.00 C ATOM 1257 OG SER A 87 30.924 -4.571 17.458 1.00 0.00 O ATOM 0 H SER A 87 29.826 -3.122 20.228 1.00 0.00 H new ATOM 0 HA SER A 87 28.438 -4.810 18.178 1.00 0.00 H new ATOM 0 HB2 SER A 87 31.172 -5.119 19.432 1.00 0.00 H new ATOM 0 HB3 SER A 87 30.372 -6.309 18.424 1.00 0.00 H new ATOM 0 HG SER A 87 31.904 -4.553 17.464 1.00 0.00 H new ATOM 1263 N ILE A 88 27.473 -6.217 20.024 1.00 0.00 N ATOM 1264 CA ILE A 88 26.659 -6.812 21.076 1.00 0.00 C ATOM 1265 C ILE A 88 26.473 -8.287 20.724 1.00 0.00 C ATOM 1266 O ILE A 88 26.106 -8.622 19.593 1.00 0.00 O ATOM 1267 CB ILE A 88 25.297 -6.075 21.170 1.00 0.00 C ATOM 1268 CG1 ILE A 88 25.443 -4.532 21.214 1.00 0.00 C ATOM 1269 CG2 ILE A 88 24.498 -6.574 22.388 1.00 0.00 C ATOM 1270 CD1 ILE A 88 24.118 -3.773 21.341 1.00 0.00 C ATOM 0 H ILE A 88 27.174 -6.485 19.086 1.00 0.00 H new ATOM 0 HA ILE A 88 27.141 -6.722 22.050 1.00 0.00 H new ATOM 0 HB ILE A 88 24.751 -6.311 20.256 1.00 0.00 H new ATOM 0 HG12 ILE A 88 26.083 -4.264 22.055 1.00 0.00 H new ATOM 0 HG13 ILE A 88 25.951 -4.202 20.308 1.00 0.00 H new ATOM 0 HG21 ILE A 88 23.545 -6.047 22.439 1.00 0.00 H new ATOM 0 HG22 ILE A 88 24.316 -7.644 22.290 1.00 0.00 H new ATOM 0 HG23 ILE A 88 25.067 -6.385 23.298 1.00 0.00 H new ATOM 0 HD11 ILE A 88 24.314 -2.701 21.364 1.00 0.00 H new ATOM 0 HD12 ILE A 88 23.481 -4.007 20.488 1.00 0.00 H new ATOM 0 HD13 ILE A 88 23.615 -4.070 22.261 1.00 0.00 H new ATOM 1282 N SER A 89 26.698 -9.154 21.706 1.00 0.00 N ATOM 1283 CA SER A 89 26.647 -10.598 21.583 1.00 0.00 C ATOM 1284 C SER A 89 25.788 -11.209 22.698 1.00 0.00 C ATOM 1285 O SER A 89 25.441 -10.528 23.669 1.00 0.00 O ATOM 1286 CB SER A 89 28.072 -11.166 21.606 1.00 0.00 C ATOM 1287 OG SER A 89 28.807 -10.735 20.471 1.00 0.00 O ATOM 0 H SER A 89 26.931 -8.850 22.651 1.00 0.00 H new ATOM 0 HA SER A 89 26.182 -10.859 20.632 1.00 0.00 H new ATOM 0 HB2 SER A 89 28.580 -10.847 22.516 1.00 0.00 H new ATOM 0 HB3 SER A 89 28.033 -12.255 21.627 1.00 0.00 H new ATOM 0 HG SER A 89 29.679 -11.183 20.456 1.00 0.00 H new ATOM 1293 N GLY A 90 25.447 -12.490 22.517 1.00 0.00 N ATOM 1294 CA GLY A 90 24.719 -13.363 23.436 1.00 0.00 C ATOM 1295 C GLY A 90 25.438 -13.627 24.776 1.00 0.00 C ATOM 1296 O GLY A 90 26.201 -12.777 25.239 1.00 0.00 O ATOM 0 H GLY A 90 25.694 -12.978 21.656 1.00 0.00 H new ATOM 0 HA2 GLY A 90 23.745 -12.920 23.643 1.00 0.00 H new ATOM 0 HA3 GLY A 90 24.537 -14.317 22.942 1.00 0.00 H new ATOM 1300 N PRO A 91 25.248 -14.803 25.413 1.00 0.00 N ATOM 1301 CA PRO A 91 24.584 -16.003 24.893 1.00 0.00 C ATOM 1302 C PRO A 91 23.047 -15.965 24.905 1.00 0.00 C ATOM 1303 O PRO A 91 22.425 -16.787 24.230 1.00 0.00 O ATOM 1304 CB PRO A 91 25.094 -17.145 25.783 1.00 0.00 C ATOM 1305 CG PRO A 91 25.333 -16.465 27.127 1.00 0.00 C ATOM 1306 CD PRO A 91 25.850 -15.091 26.710 1.00 0.00 C ATOM 0 HA PRO A 91 24.825 -16.114 23.836 1.00 0.00 H new ATOM 0 HB2 PRO A 91 24.362 -17.949 25.864 1.00 0.00 H new ATOM 0 HB3 PRO A 91 26.009 -17.585 25.387 1.00 0.00 H new ATOM 0 HG2 PRO A 91 24.418 -16.394 27.715 1.00 0.00 H new ATOM 0 HG3 PRO A 91 26.060 -17.006 27.733 1.00 0.00 H new ATOM 0 HD2 PRO A 91 25.575 -14.333 27.443 1.00 0.00 H new ATOM 0 HD3 PRO A 91 26.938 -15.089 26.643 1.00 0.00 H new ATOM 1314 N GLY A 92 22.426 -15.037 25.639 1.00 0.00 N ATOM 1315 CA GLY A 92 20.969 -14.944 25.781 1.00 0.00 C ATOM 1316 C GLY A 92 20.538 -13.483 25.806 1.00 0.00 C ATOM 1317 O GLY A 92 19.641 -13.099 26.560 1.00 0.00 O ATOM 0 H GLY A 92 22.929 -14.318 26.159 1.00 0.00 H new ATOM 0 HA2 GLY A 92 20.481 -15.461 24.954 1.00 0.00 H new ATOM 0 HA3 GLY A 92 20.653 -15.440 26.698 1.00 0.00 H new ATOM 1321 N CYS A 93 21.243 -12.662 25.028 1.00 0.00 N ATOM 1322 CA CYS A 93 21.137 -11.220 25.078 1.00 0.00 C ATOM 1323 C CYS A 93 19.740 -10.767 24.697 1.00 0.00 C ATOM 1324 O CYS A 93 19.225 -11.130 23.639 1.00 0.00 O ATOM 1325 CB CYS A 93 22.196 -10.603 24.174 1.00 0.00 C ATOM 1326 SG CYS A 93 22.225 -8.796 24.134 1.00 0.00 S ATOM 0 H CYS A 93 21.914 -12.995 24.336 1.00 0.00 H new ATOM 0 HA CYS A 93 21.314 -10.880 26.098 1.00 0.00 H new ATOM 0 HB2 CYS A 93 23.175 -10.958 24.495 1.00 0.00 H new ATOM 0 HB3 CYS A 93 22.041 -10.969 23.159 1.00 0.00 H new ATOM 1331 N SER A 94 19.172 -9.944 25.561 1.00 0.00 N ATOM 1332 CA SER A 94 17.818 -9.450 25.507 1.00 0.00 C ATOM 1333 C SER A 94 17.905 -7.978 25.901 1.00 0.00 C ATOM 1334 O SER A 94 18.459 -7.663 26.957 1.00 0.00 O ATOM 1335 CB SER A 94 16.988 -10.262 26.506 1.00 0.00 C ATOM 1336 OG SER A 94 16.968 -11.641 26.167 1.00 0.00 O ATOM 0 H SER A 94 19.681 -9.584 26.368 1.00 0.00 H new ATOM 0 HA SER A 94 17.349 -9.545 24.528 1.00 0.00 H new ATOM 0 HB2 SER A 94 17.400 -10.139 27.508 1.00 0.00 H new ATOM 0 HB3 SER A 94 15.968 -9.878 26.531 1.00 0.00 H new ATOM 0 HG SER A 94 17.855 -12.028 26.319 1.00 0.00 H new ATOM 1342 N ILE A 95 17.417 -7.080 25.044 1.00 0.00 N ATOM 1343 CA ILE A 95 17.547 -5.635 25.193 1.00 0.00 C ATOM 1344 C ILE A 95 16.183 -5.033 24.863 1.00 0.00 C ATOM 1345 O ILE A 95 15.591 -5.380 23.837 1.00 0.00 O ATOM 1346 CB ILE A 95 18.659 -5.096 24.253 1.00 0.00 C ATOM 1347 CG1 ILE A 95 20.025 -5.731 24.586 1.00 0.00 C ATOM 1348 CG2 ILE A 95 18.769 -3.561 24.336 1.00 0.00 C ATOM 1349 CD1 ILE A 95 21.215 -5.233 23.759 1.00 0.00 C ATOM 0 H ILE A 95 16.906 -7.349 24.203 1.00 0.00 H new ATOM 0 HA ILE A 95 17.839 -5.361 26.207 1.00 0.00 H new ATOM 0 HB ILE A 95 18.379 -5.372 23.236 1.00 0.00 H new ATOM 0 HG12 ILE A 95 20.240 -5.552 25.640 1.00 0.00 H new ATOM 0 HG13 ILE A 95 19.943 -6.810 24.456 1.00 0.00 H new ATOM 0 HG21 ILE A 95 19.556 -3.216 23.666 1.00 0.00 H new ATOM 0 HG22 ILE A 95 17.820 -3.112 24.043 1.00 0.00 H new ATOM 0 HG23 ILE A 95 19.008 -3.268 25.358 1.00 0.00 H new ATOM 0 HD11 ILE A 95 22.121 -5.747 24.079 1.00 0.00 H new ATOM 0 HD12 ILE A 95 21.035 -5.437 22.703 1.00 0.00 H new ATOM 0 HD13 ILE A 95 21.336 -4.160 23.906 1.00 0.00 H new ATOM 1361 N SER A 96 15.700 -4.114 25.698 1.00 0.00 N ATOM 1362 CA SER A 96 14.500 -3.335 25.434 1.00 0.00 C ATOM 1363 C SER A 96 14.738 -1.882 25.842 1.00 0.00 C ATOM 1364 O SER A 96 15.294 -1.617 26.912 1.00 0.00 O ATOM 1365 CB SER A 96 13.306 -3.926 26.188 1.00 0.00 C ATOM 1366 OG SER A 96 12.975 -5.208 25.680 1.00 0.00 O ATOM 0 H SER A 96 16.141 -3.889 26.590 1.00 0.00 H new ATOM 0 HA SER A 96 14.273 -3.368 24.368 1.00 0.00 H new ATOM 0 HB2 SER A 96 13.541 -4.000 27.250 1.00 0.00 H new ATOM 0 HB3 SER A 96 12.447 -3.261 26.097 1.00 0.00 H new ATOM 0 HG SER A 96 13.206 -5.892 26.342 1.00 0.00 H new ATOM 1372 N THR A 97 14.276 -0.968 24.984 1.00 0.00 N ATOM 1373 CA THR A 97 14.247 0.483 25.183 1.00 0.00 C ATOM 1374 C THR A 97 15.573 1.089 25.691 1.00 0.00 C ATOM 1375 O THR A 97 15.573 2.085 26.418 1.00 0.00 O ATOM 1376 CB THR A 97 12.969 0.888 25.961 1.00 0.00 C ATOM 1377 OG1 THR A 97 12.681 0.032 27.049 1.00 0.00 O ATOM 1378 CG2 THR A 97 11.731 0.825 25.061 1.00 0.00 C ATOM 0 H THR A 97 13.890 -1.237 24.079 1.00 0.00 H new ATOM 0 HA THR A 97 14.171 0.957 24.204 1.00 0.00 H new ATOM 0 HB THR A 97 13.177 1.897 26.317 1.00 0.00 H new ATOM 0 HG1 THR A 97 13.077 0.398 27.867 1.00 0.00 H new ATOM 0 HG21 THR A 97 10.850 1.114 25.634 1.00 0.00 H new ATOM 0 HG22 THR A 97 11.857 1.507 24.220 1.00 0.00 H new ATOM 0 HG23 THR A 97 11.604 -0.191 24.688 1.00 0.00 H new ATOM 1386 N CYS A 98 16.715 0.514 25.297 1.00 0.00 N ATOM 1387 CA CYS A 98 18.038 1.029 25.629 1.00 0.00 C ATOM 1388 C CYS A 98 18.551 1.968 24.538 1.00 0.00 C ATOM 1389 O CYS A 98 18.130 1.901 23.382 1.00 0.00 O ATOM 1390 CB CYS A 98 19.025 -0.139 25.774 1.00 0.00 C ATOM 1391 SG CYS A 98 18.762 -1.203 27.215 1.00 0.00 S ATOM 0 H CYS A 98 16.741 -0.334 24.731 1.00 0.00 H new ATOM 0 HA CYS A 98 17.960 1.581 26.566 1.00 0.00 H new ATOM 0 HB2 CYS A 98 18.970 -0.753 24.875 1.00 0.00 H new ATOM 0 HB3 CYS A 98 20.036 0.266 25.822 1.00 0.00 H new ATOM 1396 N THR A 99 19.536 2.787 24.892 1.00 0.00 N ATOM 1397 CA THR A 99 20.314 3.590 23.966 1.00 0.00 C ATOM 1398 C THR A 99 21.760 3.278 24.343 1.00 0.00 C ATOM 1399 O THR A 99 22.105 3.311 25.526 1.00 0.00 O ATOM 1400 CB THR A 99 19.944 5.076 24.100 1.00 0.00 C ATOM 1401 OG1 THR A 99 18.565 5.264 23.840 1.00 0.00 O ATOM 1402 CG2 THR A 99 20.732 5.961 23.126 1.00 0.00 C ATOM 0 H THR A 99 19.821 2.911 25.863 1.00 0.00 H new ATOM 0 HA THR A 99 20.130 3.364 22.916 1.00 0.00 H new ATOM 0 HB THR A 99 20.192 5.366 25.121 1.00 0.00 H new ATOM 0 HG1 THR A 99 18.342 6.214 23.930 1.00 0.00 H new ATOM 0 HG21 THR A 99 20.436 7.002 23.259 1.00 0.00 H new ATOM 0 HG22 THR A 99 21.799 5.859 23.324 1.00 0.00 H new ATOM 0 HG23 THR A 99 20.522 5.652 22.102 1.00 0.00 H new ATOM 1410 N ILE A 100 22.585 2.890 23.373 1.00 0.00 N ATOM 1411 CA ILE A 100 23.926 2.380 23.621 1.00 0.00 C ATOM 1412 C ILE A 100 24.824 3.038 22.580 1.00 0.00 C ATOM 1413 O ILE A 100 24.517 3.010 21.387 1.00 0.00 O ATOM 1414 CB ILE A 100 23.965 0.826 23.567 1.00 0.00 C ATOM 1415 CG1 ILE A 100 22.734 0.159 24.235 1.00 0.00 C ATOM 1416 CG2 ILE A 100 25.258 0.312 24.231 1.00 0.00 C ATOM 1417 CD1 ILE A 100 22.756 -1.375 24.265 1.00 0.00 C ATOM 0 H ILE A 100 22.336 2.922 22.384 1.00 0.00 H new ATOM 0 HA ILE A 100 24.273 2.625 24.625 1.00 0.00 H new ATOM 0 HB ILE A 100 23.941 0.549 22.513 1.00 0.00 H new ATOM 0 HG12 ILE A 100 22.654 0.525 25.259 1.00 0.00 H new ATOM 0 HG13 ILE A 100 21.836 0.483 23.709 1.00 0.00 H new ATOM 0 HG21 ILE A 100 25.280 -0.777 24.190 1.00 0.00 H new ATOM 0 HG22 ILE A 100 26.123 0.712 23.702 1.00 0.00 H new ATOM 0 HG23 ILE A 100 25.287 0.637 25.271 1.00 0.00 H new ATOM 0 HD11 ILE A 100 21.853 -1.742 24.752 1.00 0.00 H new ATOM 0 HD12 ILE A 100 22.800 -1.758 23.246 1.00 0.00 H new ATOM 0 HD13 ILE A 100 23.631 -1.716 24.819 1.00 0.00 H new ATOM 1429 N THR A 101 25.917 3.648 23.030 1.00 0.00 N ATOM 1430 CA THR A 101 26.824 4.407 22.184 1.00 0.00 C ATOM 1431 C THR A 101 28.246 4.044 22.603 1.00 0.00 C ATOM 1432 O THR A 101 28.532 4.003 23.799 1.00 0.00 O ATOM 1433 CB THR A 101 26.545 5.916 22.333 1.00 0.00 C ATOM 1434 OG1 THR A 101 25.171 6.204 22.135 1.00 0.00 O ATOM 1435 CG2 THR A 101 27.340 6.752 21.324 1.00 0.00 C ATOM 0 H THR A 101 26.199 3.626 24.010 1.00 0.00 H new ATOM 0 HA THR A 101 26.684 4.165 21.131 1.00 0.00 H new ATOM 0 HB THR A 101 26.850 6.177 23.346 1.00 0.00 H new ATOM 0 HG1 THR A 101 25.021 7.167 22.236 1.00 0.00 H new ATOM 0 HG21 THR A 101 27.112 7.808 21.466 1.00 0.00 H new ATOM 0 HG22 THR A 101 28.407 6.588 21.476 1.00 0.00 H new ATOM 0 HG23 THR A 101 27.068 6.455 20.311 1.00 0.00 H new ATOM 1443 N ARG A 102 29.138 3.788 21.637 1.00 0.00 N ATOM 1444 CA ARG A 102 30.571 3.543 21.858 1.00 0.00 C ATOM 1445 C ARG A 102 30.823 2.581 23.036 1.00 0.00 C ATOM 1446 O ARG A 102 31.671 2.831 23.892 1.00 0.00 O ATOM 1447 CB ARG A 102 31.283 4.904 21.997 1.00 0.00 C ATOM 1448 CG ARG A 102 32.795 4.825 21.717 1.00 0.00 C ATOM 1449 CD ARG A 102 33.484 6.190 21.868 1.00 0.00 C ATOM 1450 NE ARG A 102 33.404 6.714 23.247 1.00 0.00 N ATOM 1451 CZ ARG A 102 34.193 6.377 24.276 1.00 0.00 C ATOM 1452 NH1 ARG A 102 35.183 5.500 24.120 1.00 0.00 N ATOM 1453 NH2 ARG A 102 33.985 6.924 25.470 1.00 0.00 N ATOM 0 H ARG A 102 28.876 3.744 20.652 1.00 0.00 H new ATOM 0 HA ARG A 102 30.997 3.024 20.999 1.00 0.00 H new ATOM 0 HB2 ARG A 102 30.829 5.617 21.309 1.00 0.00 H new ATOM 0 HB3 ARG A 102 31.126 5.289 23.005 1.00 0.00 H new ATOM 0 HG2 ARG A 102 33.253 4.111 22.401 1.00 0.00 H new ATOM 0 HG3 ARG A 102 32.957 4.448 20.707 1.00 0.00 H new ATOM 0 HD2 ARG A 102 34.531 6.099 21.577 1.00 0.00 H new ATOM 0 HD3 ARG A 102 33.024 6.903 21.184 1.00 0.00 H new ATOM 0 HE ARG A 102 32.674 7.402 23.435 1.00 0.00 H new ATOM 0 HH11 ARG A 102 35.349 5.075 23.208 1.00 0.00 H new ATOM 0 HH12 ARG A 102 35.775 5.253 24.913 1.00 0.00 H new ATOM 0 HH21 ARG A 102 33.228 7.596 25.598 1.00 0.00 H new ATOM 0 HH22 ARG A 102 34.582 6.672 26.258 1.00 0.00 H new ATOM 1467 N GLY A 103 30.058 1.487 23.109 1.00 0.00 N ATOM 1468 CA GLY A 103 30.273 0.433 24.093 1.00 0.00 C ATOM 1469 C GLY A 103 29.704 0.715 25.486 1.00 0.00 C ATOM 1470 O GLY A 103 30.021 -0.050 26.399 1.00 0.00 O ATOM 0 H GLY A 103 29.272 1.312 22.484 1.00 0.00 H new ATOM 0 HA2 GLY A 103 29.830 -0.489 23.717 1.00 0.00 H new ATOM 0 HA3 GLY A 103 31.345 0.257 24.185 1.00 0.00 H new ATOM 1474 N VAL A 104 28.878 1.750 25.690 1.00 0.00 N ATOM 1475 CA VAL A 104 28.240 2.007 26.982 1.00 0.00 C ATOM 1476 C VAL A 104 26.765 2.382 26.784 1.00 0.00 C ATOM 1477 O VAL A 104 26.415 3.092 25.839 1.00 0.00 O ATOM 1478 CB VAL A 104 29.087 3.044 27.753 1.00 0.00 C ATOM 1479 CG1 VAL A 104 29.095 4.455 27.145 1.00 0.00 C ATOM 1480 CG2 VAL A 104 28.687 3.119 29.233 1.00 0.00 C ATOM 0 H VAL A 104 28.636 2.427 24.967 1.00 0.00 H new ATOM 0 HA VAL A 104 28.212 1.111 27.603 1.00 0.00 H new ATOM 0 HB VAL A 104 30.106 2.668 27.665 1.00 0.00 H new ATOM 0 HG11 VAL A 104 29.716 5.111 27.756 1.00 0.00 H new ATOM 0 HG12 VAL A 104 29.498 4.413 26.133 1.00 0.00 H new ATOM 0 HG13 VAL A 104 28.077 4.844 27.114 1.00 0.00 H new ATOM 0 HG21 VAL A 104 29.306 3.859 29.740 1.00 0.00 H new ATOM 0 HG22 VAL A 104 27.639 3.407 29.312 1.00 0.00 H new ATOM 0 HG23 VAL A 104 28.832 2.144 29.699 1.00 0.00 H new ATOM 1490 N ALA A 105 25.888 1.862 27.650 1.00 0.00 N ATOM 1491 CA ALA A 105 24.461 2.173 27.644 1.00 0.00 C ATOM 1492 C ALA A 105 24.201 3.479 28.401 1.00 0.00 C ATOM 1493 O ALA A 105 24.968 3.847 29.296 1.00 0.00 O ATOM 1494 CB ALA A 105 23.676 1.021 28.279 1.00 0.00 C ATOM 0 H ALA A 105 26.157 1.205 28.383 1.00 0.00 H new ATOM 0 HA ALA A 105 24.128 2.300 26.614 1.00 0.00 H new ATOM 0 HB1 ALA A 105 22.612 1.258 28.272 1.00 0.00 H new ATOM 0 HB2 ALA A 105 23.848 0.107 27.711 1.00 0.00 H new ATOM 0 HB3 ALA A 105 24.009 0.877 29.307 1.00 0.00 H new ATOM 1500 N THR A 106 23.101 4.157 28.082 1.00 0.00 N ATOM 1501 CA THR A 106 22.615 5.293 28.856 1.00 0.00 C ATOM 1502 C THR A 106 22.200 4.831 30.268 1.00 0.00 C ATOM 1503 O THR A 106 21.797 3.676 30.449 1.00 0.00 O ATOM 1504 CB THR A 106 21.444 5.957 28.107 1.00 0.00 C ATOM 1505 OG1 THR A 106 20.495 4.991 27.685 1.00 0.00 O ATOM 1506 CG2 THR A 106 21.942 6.717 26.873 1.00 0.00 C ATOM 0 H THR A 106 22.520 3.931 27.275 1.00 0.00 H new ATOM 0 HA THR A 106 23.408 6.031 28.972 1.00 0.00 H new ATOM 0 HB THR A 106 20.974 6.652 28.803 1.00 0.00 H new ATOM 0 HG1 THR A 106 19.690 5.444 27.358 1.00 0.00 H new ATOM 0 HG21 THR A 106 21.096 7.176 26.362 1.00 0.00 H new ATOM 0 HG22 THR A 106 22.644 7.492 27.182 1.00 0.00 H new ATOM 0 HG23 THR A 106 22.442 6.024 26.196 1.00 0.00 H new ATOM 1514 N PRO A 107 22.236 5.720 31.280 1.00 0.00 N ATOM 1515 CA PRO A 107 21.793 5.415 32.638 1.00 0.00 C ATOM 1516 C PRO A 107 20.263 5.497 32.807 1.00 0.00 C ATOM 1517 O PRO A 107 19.763 5.535 33.935 1.00 0.00 O ATOM 1518 CB PRO A 107 22.537 6.430 33.513 1.00 0.00 C ATOM 1519 CG PRO A 107 22.586 7.667 32.618 1.00 0.00 C ATOM 1520 CD PRO A 107 22.785 7.068 31.226 1.00 0.00 C ATOM 0 HA PRO A 107 22.020 4.386 32.916 1.00 0.00 H new ATOM 0 HB2 PRO A 107 22.009 6.625 34.446 1.00 0.00 H new ATOM 0 HB3 PRO A 107 23.535 6.082 33.779 1.00 0.00 H new ATOM 0 HG2 PRO A 107 21.666 8.249 32.681 1.00 0.00 H new ATOM 0 HG3 PRO A 107 23.404 8.333 32.893 1.00 0.00 H new ATOM 0 HD2 PRO A 107 22.276 7.665 30.469 1.00 0.00 H new ATOM 0 HD3 PRO A 107 23.842 7.047 30.959 1.00 0.00 H new ATOM 1528 N ALA A 108 19.517 5.578 31.704 1.00 0.00 N ATOM 1529 CA ALA A 108 18.075 5.757 31.707 1.00 0.00 C ATOM 1530 C ALA A 108 17.403 4.487 32.229 1.00 0.00 C ATOM 1531 O ALA A 108 17.734 3.384 31.788 1.00 0.00 O ATOM 1532 CB ALA A 108 17.590 6.071 30.287 1.00 0.00 C ATOM 0 H ALA A 108 19.913 5.519 30.766 1.00 0.00 H new ATOM 0 HA ALA A 108 17.812 6.590 32.359 1.00 0.00 H new ATOM 0 HB1 ALA A 108 16.508 6.205 30.293 1.00 0.00 H new ATOM 0 HB2 ALA A 108 18.067 6.985 29.934 1.00 0.00 H new ATOM 0 HB3 ALA A 108 17.850 5.247 29.623 1.00 0.00 H new ATOM 1538 N ALA A 109 16.400 4.650 33.096 1.00 0.00 N ATOM 1539 CA ALA A 109 15.602 3.543 33.616 1.00 0.00 C ATOM 1540 C ALA A 109 14.814 2.824 32.509 1.00 0.00 C ATOM 1541 O ALA A 109 14.360 1.697 32.716 1.00 0.00 O ATOM 1542 CB ALA A 109 14.651 4.065 34.701 1.00 0.00 C ATOM 0 H ALA A 109 16.119 5.561 33.458 1.00 0.00 H new ATOM 0 HA ALA A 109 16.284 2.809 34.045 1.00 0.00 H new ATOM 0 HB1 ALA A 109 14.055 3.240 35.090 1.00 0.00 H new ATOM 0 HB2 ALA A 109 15.231 4.507 35.511 1.00 0.00 H new ATOM 0 HB3 ALA A 109 13.991 4.820 34.274 1.00 0.00 H new ATOM 1548 N ALA A 110 14.647 3.458 31.340 1.00 0.00 N ATOM 1549 CA ALA A 110 14.010 2.843 30.184 1.00 0.00 C ATOM 1550 C ALA A 110 14.847 1.687 29.624 1.00 0.00 C ATOM 1551 O ALA A 110 14.278 0.776 29.025 1.00 0.00 O ATOM 1552 CB ALA A 110 13.784 3.901 29.098 1.00 0.00 C ATOM 0 H ALA A 110 14.954 4.417 31.177 1.00 0.00 H new ATOM 0 HA ALA A 110 13.053 2.432 30.505 1.00 0.00 H new ATOM 0 HB1 ALA A 110 13.307 3.439 28.234 1.00 0.00 H new ATOM 0 HB2 ALA A 110 13.142 4.691 29.488 1.00 0.00 H new ATOM 0 HB3 ALA A 110 14.742 4.327 28.800 1.00 0.00 H new ATOM 1558 N CYS A 111 16.169 1.688 29.814 1.00 0.00 N ATOM 1559 CA CYS A 111 17.004 0.596 29.344 1.00 0.00 C ATOM 1560 C CYS A 111 16.778 -0.623 30.239 1.00 0.00 C ATOM 1561 O CYS A 111 16.894 -0.529 31.464 1.00 0.00 O ATOM 1562 CB CYS A 111 18.477 1.025 29.338 1.00 0.00 C ATOM 1563 SG CYS A 111 19.661 -0.231 28.771 1.00 0.00 S ATOM 0 H CYS A 111 16.677 2.434 30.290 1.00 0.00 H new ATOM 0 HA CYS A 111 16.736 0.331 28.321 1.00 0.00 H new ATOM 0 HB2 CYS A 111 18.577 1.905 28.703 1.00 0.00 H new ATOM 0 HB3 CYS A 111 18.752 1.328 30.348 1.00 0.00 H new ATOM 1568 N LYS A 112 16.510 -1.775 29.622 1.00 0.00 N ATOM 1569 CA LYS A 112 16.433 -3.081 30.270 1.00 0.00 C ATOM 1570 C LYS A 112 17.324 -4.005 29.450 1.00 0.00 C ATOM 1571 O LYS A 112 17.151 -4.083 28.232 1.00 0.00 O ATOM 1572 CB LYS A 112 14.981 -3.586 30.268 1.00 0.00 C ATOM 1573 CG LYS A 112 14.061 -2.831 31.248 1.00 0.00 C ATOM 1574 CD LYS A 112 12.615 -2.730 30.738 1.00 0.00 C ATOM 1575 CE LYS A 112 12.556 -1.703 29.598 1.00 0.00 C ATOM 1576 NZ LYS A 112 11.208 -1.544 29.002 1.00 0.00 N ATOM 0 H LYS A 112 16.334 -1.823 28.618 1.00 0.00 H new ATOM 0 HA LYS A 112 16.757 -3.038 31.310 1.00 0.00 H new ATOM 0 HB2 LYS A 112 14.576 -3.496 29.260 1.00 0.00 H new ATOM 0 HB3 LYS A 112 14.974 -4.646 30.521 1.00 0.00 H new ATOM 0 HG2 LYS A 112 14.068 -3.339 32.212 1.00 0.00 H new ATOM 0 HG3 LYS A 112 14.456 -1.828 31.413 1.00 0.00 H new ATOM 0 HD2 LYS A 112 12.271 -3.703 30.386 1.00 0.00 H new ATOM 0 HD3 LYS A 112 11.950 -2.431 31.548 1.00 0.00 H new ATOM 0 HE2 LYS A 112 12.892 -0.737 29.975 1.00 0.00 H new ATOM 0 HE3 LYS A 112 13.255 -2.001 28.817 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 11.271 -0.941 28.157 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 10.834 -2.477 28.735 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 10.572 -1.102 29.696 1.00 0.00 H new ATOM 1590 N ILE A 113 18.271 -4.681 30.098 1.00 0.00 N ATOM 1591 CA ILE A 113 19.242 -5.546 29.448 1.00 0.00 C ATOM 1592 C ILE A 113 19.480 -6.783 30.317 1.00 0.00 C ATOM 1593 O ILE A 113 19.584 -6.665 31.543 1.00 0.00 O ATOM 1594 CB ILE A 113 20.518 -4.723 29.164 1.00 0.00 C ATOM 1595 CG1 ILE A 113 21.501 -5.539 28.302 1.00 0.00 C ATOM 1596 CG2 ILE A 113 21.230 -4.186 30.420 1.00 0.00 C ATOM 1597 CD1 ILE A 113 22.504 -4.669 27.533 1.00 0.00 C ATOM 0 H ILE A 113 18.383 -4.639 31.111 1.00 0.00 H new ATOM 0 HA ILE A 113 18.880 -5.915 28.488 1.00 0.00 H new ATOM 0 HB ILE A 113 20.179 -3.841 28.620 1.00 0.00 H new ATOM 0 HG12 ILE A 113 22.048 -6.230 28.943 1.00 0.00 H new ATOM 0 HG13 ILE A 113 20.936 -6.143 27.592 1.00 0.00 H new ATOM 0 HG21 ILE A 113 22.114 -3.621 30.124 1.00 0.00 H new ATOM 0 HG22 ILE A 113 20.552 -3.535 30.972 1.00 0.00 H new ATOM 0 HG23 ILE A 113 21.528 -5.021 31.054 1.00 0.00 H new ATOM 0 HD11 ILE A 113 23.165 -5.307 26.947 1.00 0.00 H new ATOM 0 HD12 ILE A 113 21.965 -3.996 26.866 1.00 0.00 H new ATOM 0 HD13 ILE A 113 23.095 -4.085 28.239 1.00 0.00 H new ATOM 1609 N SER A 114 19.586 -7.953 29.684 1.00 0.00 N ATOM 1610 CA SER A 114 19.836 -9.234 30.338 1.00 0.00 C ATOM 1611 C SER A 114 20.626 -10.133 29.384 1.00 0.00 C ATOM 1612 O SER A 114 20.400 -10.088 28.175 1.00 0.00 O ATOM 1613 CB SER A 114 18.499 -9.918 30.681 1.00 0.00 C ATOM 1614 OG SER A 114 17.648 -9.096 31.469 1.00 0.00 O ATOM 0 H SER A 114 19.497 -8.035 28.671 1.00 0.00 H new ATOM 0 HA SER A 114 20.401 -9.068 31.255 1.00 0.00 H new ATOM 0 HB2 SER A 114 17.985 -10.186 29.758 1.00 0.00 H new ATOM 0 HB3 SER A 114 18.698 -10.847 31.216 1.00 0.00 H new ATOM 0 HG SER A 114 16.814 -9.575 31.658 1.00 0.00 H new ATOM 1620 N GLY A 115 21.522 -10.966 29.924 1.00 0.00 N ATOM 1621 CA GLY A 115 22.203 -12.033 29.192 1.00 0.00 C ATOM 1622 C GLY A 115 23.130 -11.568 28.065 1.00 0.00 C ATOM 1623 O GLY A 115 23.415 -12.365 27.168 1.00 0.00 O ATOM 0 H GLY A 115 21.798 -10.914 30.904 1.00 0.00 H new ATOM 0 HA2 GLY A 115 22.787 -12.621 29.900 1.00 0.00 H new ATOM 0 HA3 GLY A 115 21.450 -12.698 28.769 1.00 0.00 H new ATOM 1627 N CYS A 116 23.572 -10.305 28.078 1.00 0.00 N ATOM 1628 CA CYS A 116 24.369 -9.714 27.004 1.00 0.00 C ATOM 1629 C CYS A 116 25.836 -9.560 27.395 1.00 0.00 C ATOM 1630 O CYS A 116 26.180 -9.478 28.579 1.00 0.00 O ATOM 1631 CB CYS A 116 23.825 -8.317 26.671 1.00 0.00 C ATOM 1632 SG CYS A 116 22.119 -8.238 26.084 1.00 0.00 S ATOM 0 H CYS A 116 23.382 -9.660 28.845 1.00 0.00 H new ATOM 0 HA CYS A 116 24.300 -10.385 26.148 1.00 0.00 H new ATOM 0 HB2 CYS A 116 23.908 -7.696 27.563 1.00 0.00 H new ATOM 0 HB3 CYS A 116 24.468 -7.872 25.912 1.00 0.00 H new ATOM 1637 N SER A 117 26.669 -9.413 26.368 1.00 0.00 N ATOM 1638 CA SER A 117 28.070 -9.030 26.431 1.00 0.00 C ATOM 1639 C SER A 117 28.251 -8.047 25.275 1.00 0.00 C ATOM 1640 O SER A 117 27.770 -8.323 24.173 1.00 0.00 O ATOM 1641 CB SER A 117 28.966 -10.262 26.256 1.00 0.00 C ATOM 1642 OG SER A 117 28.771 -11.196 27.309 1.00 0.00 O ATOM 0 H SER A 117 26.359 -9.569 25.409 1.00 0.00 H new ATOM 0 HA SER A 117 28.343 -8.586 27.388 1.00 0.00 H new ATOM 0 HB2 SER A 117 28.750 -10.738 25.300 1.00 0.00 H new ATOM 0 HB3 SER A 117 30.011 -9.953 26.230 1.00 0.00 H new ATOM 0 HG SER A 117 29.354 -11.972 27.170 1.00 0.00 H new ATOM 1648 N LEU A 118 28.870 -6.888 25.504 1.00 0.00 N ATOM 1649 CA LEU A 118 29.018 -5.868 24.468 1.00 0.00 C ATOM 1650 C LEU A 118 30.326 -5.101 24.615 1.00 0.00 C ATOM 1651 O LEU A 118 30.958 -5.129 25.676 1.00 0.00 O ATOM 1652 CB LEU A 118 27.773 -4.958 24.406 1.00 0.00 C ATOM 1653 CG LEU A 118 27.397 -4.143 25.661 1.00 0.00 C ATOM 1654 CD1 LEU A 118 28.242 -2.874 25.831 1.00 0.00 C ATOM 1655 CD2 LEU A 118 25.925 -3.719 25.554 1.00 0.00 C ATOM 0 H LEU A 118 29.278 -6.633 26.403 1.00 0.00 H new ATOM 0 HA LEU A 118 29.080 -6.367 23.501 1.00 0.00 H new ATOM 0 HB2 LEU A 118 27.915 -4.256 23.585 1.00 0.00 H new ATOM 0 HB3 LEU A 118 26.918 -5.582 24.147 1.00 0.00 H new ATOM 0 HG LEU A 118 27.580 -4.785 26.523 1.00 0.00 H new ATOM 0 HD11 LEU A 118 27.928 -2.346 26.731 1.00 0.00 H new ATOM 0 HD12 LEU A 118 29.294 -3.146 25.918 1.00 0.00 H new ATOM 0 HD13 LEU A 118 28.105 -2.227 24.965 1.00 0.00 H new ATOM 0 HD21 LEU A 118 25.648 -3.142 26.436 1.00 0.00 H new ATOM 0 HD22 LEU A 118 25.786 -3.108 24.662 1.00 0.00 H new ATOM 0 HD23 LEU A 118 25.295 -4.606 25.488 1.00 0.00 H new ATOM 1667 N SER A 119 30.709 -4.416 23.540 1.00 0.00 N ATOM 1668 CA SER A 119 31.963 -3.693 23.385 1.00 0.00 C ATOM 1669 C SER A 119 31.733 -2.488 22.465 1.00 0.00 C ATOM 1670 O SER A 119 30.730 -2.423 21.745 1.00 0.00 O ATOM 1671 CB SER A 119 33.020 -4.627 22.765 1.00 0.00 C ATOM 1672 OG SER A 119 33.161 -5.846 23.483 1.00 0.00 O ATOM 0 H SER A 119 30.119 -4.349 22.711 1.00 0.00 H new ATOM 0 HA SER A 119 32.316 -3.349 24.357 1.00 0.00 H new ATOM 0 HB2 SER A 119 32.745 -4.847 21.733 1.00 0.00 H new ATOM 0 HB3 SER A 119 33.981 -4.113 22.736 1.00 0.00 H new ATOM 0 HG SER A 119 33.841 -6.404 23.050 1.00 0.00 H new ATOM 1678 N ALA A 120 32.663 -1.531 22.477 1.00 0.00 N ATOM 1679 CA ALA A 120 32.679 -0.446 21.507 1.00 0.00 C ATOM 1680 C ALA A 120 33.111 -0.970 20.132 1.00 0.00 C ATOM 1681 O ALA A 120 33.801 -1.989 20.029 1.00 0.00 O ATOM 1682 CB ALA A 120 33.650 0.645 21.977 1.00 0.00 C ATOM 0 H ALA A 120 33.421 -1.490 23.158 1.00 0.00 H new ATOM 0 HA ALA A 120 31.676 -0.028 21.422 1.00 0.00 H new ATOM 0 HB1 ALA A 120 33.663 1.458 21.251 1.00 0.00 H new ATOM 0 HB2 ALA A 120 33.326 1.028 22.945 1.00 0.00 H new ATOM 0 HB3 ALA A 120 34.652 0.225 22.069 1.00 0.00 H new ATOM 1688 N MET A 121 32.723 -0.240 19.084 1.00 0.00 N ATOM 1689 CA MET A 121 33.207 -0.433 17.722 1.00 0.00 C ATOM 1690 C MET A 121 34.734 -0.346 17.723 1.00 0.00 C ATOM 1691 O MET A 121 35.383 -1.246 17.152 1.00 0.00 O ATOM 1692 CB MET A 121 32.561 0.627 16.819 1.00 0.00 C ATOM 1693 CG MET A 121 33.094 0.614 15.384 1.00 0.00 C ATOM 1694 SD MET A 121 32.305 1.845 14.311 1.00 0.00 S ATOM 1695 CE MET A 121 33.160 1.474 12.755 1.00 0.00 C ATOM 1696 OXT MET A 121 35.286 0.621 18.291 1.00 0.00 O ATOM 0 H MET A 121 32.047 0.519 19.165 1.00 0.00 H new ATOM 0 HA MET A 121 32.933 -1.415 17.336 1.00 0.00 H new ATOM 0 HB2 MET A 121 31.483 0.468 16.799 1.00 0.00 H new ATOM 0 HB3 MET A 121 32.730 1.613 17.252 1.00 0.00 H new ATOM 0 HG2 MET A 121 34.169 0.794 15.402 1.00 0.00 H new ATOM 0 HG3 MET A 121 32.944 -0.378 14.958 1.00 0.00 H new ATOM 0 HE1 MET A 121 32.798 2.141 11.973 1.00 0.00 H new ATOM 0 HE2 MET A 121 34.233 1.617 12.886 1.00 0.00 H new ATOM 0 HE3 MET A 121 32.964 0.441 12.470 1.00 0.00 H new TER 1706 MET A 121