USER MOD reduce.3.24.130724 H: found=0, std=0, add=967, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 967 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 NoAdj-H: A 52 HIS HE2 : A 52 HIS NE2 : A 129 ZNZN :(H bumps) USER MOD NoAdj-H: A 58 HIS HD1 : A 58 HIS ND1 : A 129 ZNZN :(H bumps) USER MOD NoAdj-H: A 113 HIS HE2 : A 113 HIS NE2 : A 130 ZNZN :(H bumps) USER MOD NoAdj-H: A 119 HIS HD1 : A 119 HIS ND1 : A 130 ZNZN :(H bumps) USER MOD Set 1.1: A 32 SER OG : rot 180:sc= 0.167 USER MOD Set 1.2: A 34 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 29 HIS : no HD1:sc= 0.493 K(o=0.74,f=-4!) USER MOD Set 2.2: A 65 TYR OH : rot 180:sc= 0.243 USER MOD Set 3.1: A 21 ASN : amide:sc= 0.892 K(o=4.3,f=-4.5) USER MOD Set 3.2: A 49 LYS NZ :NH3+ -156:sc= 3.38 (180deg=1.65) USER MOD Single : A 7 ASN : amide:sc= -0.0434 X(o=-0.043,f=0) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 1.21 (180deg=1.21) USER MOD Single : A 22 SER OG : rot 78:sc= 0.929 USER MOD Single : A 27 ASN : amide:sc= 0.792 K(o=0.79,f=-0.0041) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 35 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 37 LYS NZ :NH3+ 175:sc= 0.884 (180deg=0.87) USER MOD Single : A 40 SER OG : rot -12:sc= 0.0642 USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 48 GLN : amide:sc= -0.151 X(o=-0.15,f=-0.15) USER MOD Single : A 53 TYR OH : rot -166:sc= 0.92 USER MOD Single : A 54 GLN : amide:sc= 1.39 K(o=1.4,f=-3.3!) USER MOD Single : A 55 SER OG : rot 180:sc= 0.0474 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 ASN : amide:sc= 0.95 K(o=0.95,f=-4.9!) USER MOD Single : A 61 LYS NZ :NH3+ -141:sc= 0.933 (180deg=0.0762) USER MOD Single : A 66 MET CE :methyl 170:sc= 0 (180deg=-0.0117) USER MOD Single : A 69 ASN : amide:sc= 0.784 K(o=0.78,f=0) USER MOD Single : A 70 GLN : amide:sc= 0.934 K(o=0.93,f=-6.6!) USER MOD Single : A 74 SER OG : rot 180:sc= 0.019 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 94 SER OG : rot -102:sc= 1.25 USER MOD Single : A 95 LYS NZ :NH3+ 171:sc= 1.11 (180deg=1.04) USER MOD Single : A 96 CYS SG : rot 180:sc= -0.548 USER MOD Single : A 101 ASN : amide:sc= 0 X(o=0,f=-0.0068) USER MOD Single : A 102 MET CE :methyl -169:sc= -0.0159 (180deg=-0.0275) USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 180:sc= 0.00215 USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 112 SER OG : rot 88:sc= 0.0533 USER MOD Single : A 114 TYR OH : rot 159:sc= 0.577 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 ASN : amide:sc= 0.548 K(o=0.55,f=-0.14) USER MOD Single : A 128 GLN : amide:sc= 0.34 X(o=0.34,f=-0.02) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 2 -34.932 1.981 0.748 1.00 1.00 N ATOM 2 CA ALA A 2 -34.495 3.111 1.581 1.00 1.00 C ATOM 3 C ALA A 2 -35.447 4.332 1.510 1.00 1.00 C ATOM 4 O ALA A 2 -35.101 5.426 1.958 1.00 1.00 O ATOM 5 CB ALA A 2 -33.058 3.467 1.171 1.00 1.00 C ATOM 0 HA ALA A 2 -34.524 2.812 2.629 1.00 1.00 H new ATOM 0 HB1 ALA A 2 -32.705 4.304 1.773 1.00 1.00 H new ATOM 0 HB2 ALA A 2 -32.410 2.606 1.332 1.00 1.00 H new ATOM 0 HB3 ALA A 2 -33.038 3.744 0.117 1.00 1.00 H new ATOM 11 N ASP A 3 -36.653 4.162 0.955 1.00 1.00 N ATOM 12 CA ASP A 3 -37.696 5.195 0.783 1.00 1.00 C ATOM 13 C ASP A 3 -38.425 5.570 2.102 1.00 1.00 C ATOM 14 O ASP A 3 -39.652 5.688 2.156 1.00 1.00 O ATOM 15 CB ASP A 3 -38.655 4.721 -0.326 1.00 1.00 C ATOM 16 CG ASP A 3 -39.623 5.819 -0.811 1.00 1.00 C ATOM 17 OD1 ASP A 3 -39.189 6.983 -0.996 1.00 1.00 O ATOM 18 OD2 ASP A 3 -40.812 5.509 -1.069 1.00 1.00 O ATOM 0 H ASP A 3 -36.949 3.255 0.593 1.00 1.00 H new ATOM 0 HA ASP A 3 -37.224 6.130 0.482 1.00 1.00 H new ATOM 0 HB2 ASP A 3 -38.070 4.363 -1.173 1.00 1.00 H new ATOM 0 HB3 ASP A 3 -39.234 3.874 0.042 1.00 1.00 H new ATOM 23 N GLU A 4 -37.671 5.737 3.193 1.00 1.00 N ATOM 24 CA GLU A 4 -38.174 6.081 4.534 1.00 1.00 C ATOM 25 C GLU A 4 -37.143 6.887 5.353 1.00 1.00 C ATOM 26 O GLU A 4 -37.493 7.901 5.961 1.00 1.00 O ATOM 27 CB GLU A 4 -38.546 4.777 5.270 1.00 1.00 C ATOM 28 CG GLU A 4 -39.274 4.981 6.607 1.00 1.00 C ATOM 29 CD GLU A 4 -40.707 5.520 6.415 1.00 1.00 C ATOM 30 OE1 GLU A 4 -41.643 4.708 6.211 1.00 1.00 O ATOM 31 OE2 GLU A 4 -40.914 6.756 6.484 1.00 1.00 O ATOM 0 H GLU A 4 -36.657 5.633 3.170 1.00 1.00 H new ATOM 0 HA GLU A 4 -39.052 6.717 4.423 1.00 1.00 H new ATOM 0 HB2 GLU A 4 -39.177 4.174 4.617 1.00 1.00 H new ATOM 0 HB3 GLU A 4 -37.636 4.205 5.451 1.00 1.00 H new ATOM 0 HG2 GLU A 4 -39.313 4.034 7.145 1.00 1.00 H new ATOM 0 HG3 GLU A 4 -38.706 5.676 7.225 1.00 1.00 H new ATOM 38 N PHE A 5 -35.871 6.465 5.353 1.00 1.00 N ATOM 39 CA PHE A 5 -34.769 7.122 6.069 1.00 1.00 C ATOM 40 C PHE A 5 -33.398 6.802 5.439 1.00 1.00 C ATOM 41 O PHE A 5 -33.215 5.752 4.816 1.00 1.00 O ATOM 42 CB PHE A 5 -34.797 6.674 7.543 1.00 1.00 C ATOM 43 CG PHE A 5 -33.760 7.354 8.421 1.00 1.00 C ATOM 44 CD1 PHE A 5 -33.944 8.692 8.817 1.00 1.00 C ATOM 45 CD2 PHE A 5 -32.593 6.666 8.809 1.00 1.00 C ATOM 46 CE1 PHE A 5 -32.966 9.340 9.594 1.00 1.00 C ATOM 47 CE2 PHE A 5 -31.615 7.314 9.584 1.00 1.00 C ATOM 48 CZ PHE A 5 -31.801 8.652 9.976 1.00 1.00 C ATOM 0 H PHE A 5 -35.572 5.635 4.841 1.00 1.00 H new ATOM 0 HA PHE A 5 -34.907 8.201 6.000 1.00 1.00 H new ATOM 0 HB2 PHE A 5 -35.788 6.871 7.952 1.00 1.00 H new ATOM 0 HB3 PHE A 5 -34.643 5.596 7.586 1.00 1.00 H new ATOM 0 HD1 PHE A 5 -34.838 9.223 8.524 1.00 1.00 H new ATOM 0 HD2 PHE A 5 -32.449 5.638 8.510 1.00 1.00 H new ATOM 0 HE1 PHE A 5 -33.110 10.366 9.897 1.00 1.00 H new ATOM 0 HE2 PHE A 5 -30.721 6.784 9.878 1.00 1.00 H new ATOM 0 HZ PHE A 5 -31.049 9.150 10.570 1.00 1.00 H new ATOM 58 N GLY A 6 -32.423 7.696 5.630 1.00 1.00 N ATOM 59 CA GLY A 6 -31.044 7.560 5.149 1.00 1.00 C ATOM 60 C GLY A 6 -30.163 8.766 5.508 1.00 1.00 C ATOM 61 O GLY A 6 -30.654 9.779 6.016 1.00 1.00 O ATOM 0 H GLY A 6 -32.577 8.565 6.142 1.00 1.00 H new ATOM 0 HA2 GLY A 6 -30.605 6.657 5.572 1.00 1.00 H new ATOM 0 HA3 GLY A 6 -31.053 7.433 4.066 1.00 1.00 H new ATOM 65 N ASN A 7 -28.856 8.653 5.245 1.00 1.00 N ATOM 66 CA ASN A 7 -27.848 9.689 5.537 1.00 1.00 C ATOM 67 C ASN A 7 -26.761 9.844 4.442 1.00 1.00 C ATOM 68 O ASN A 7 -25.735 10.492 4.675 1.00 1.00 O ATOM 69 CB ASN A 7 -27.255 9.416 6.936 1.00 1.00 C ATOM 70 CG ASN A 7 -26.439 8.133 7.012 1.00 1.00 C ATOM 71 OD1 ASN A 7 -26.925 7.078 7.397 1.00 1.00 O ATOM 72 ND2 ASN A 7 -25.179 8.173 6.642 1.00 1.00 N ATOM 0 H ASN A 7 -28.456 7.820 4.813 1.00 1.00 H new ATOM 0 HA ASN A 7 -28.347 10.658 5.534 1.00 1.00 H new ATOM 0 HB2 ASN A 7 -26.623 10.256 7.224 1.00 1.00 H new ATOM 0 HB3 ASN A 7 -28.067 9.364 7.662 1.00 1.00 H new ATOM 0 HD21 ASN A 7 -24.610 7.327 6.676 1.00 1.00 H new ATOM 0 HD22 ASN A 7 -24.770 9.050 6.320 1.00 1.00 H new ATOM 79 N GLY A 8 -26.968 9.257 3.257 1.00 1.00 N ATOM 80 CA GLY A 8 -26.036 9.303 2.121 1.00 1.00 C ATOM 81 C GLY A 8 -24.873 8.300 2.207 1.00 1.00 C ATOM 82 O GLY A 8 -24.673 7.624 3.219 1.00 1.00 O ATOM 0 H GLY A 8 -27.812 8.721 3.055 1.00 1.00 H new ATOM 0 HA2 GLY A 8 -26.593 9.116 1.203 1.00 1.00 H new ATOM 0 HA3 GLY A 8 -25.625 10.310 2.045 1.00 1.00 H new ATOM 86 N ASP A 9 -24.111 8.192 1.115 1.00 1.00 N ATOM 87 CA ASP A 9 -22.970 7.267 0.954 1.00 1.00 C ATOM 88 C ASP A 9 -21.785 7.852 0.147 1.00 1.00 C ATOM 89 O ASP A 9 -20.847 7.133 -0.201 1.00 1.00 O ATOM 90 CB ASP A 9 -23.473 5.948 0.330 1.00 1.00 C ATOM 91 CG ASP A 9 -23.744 6.029 -1.188 1.00 1.00 C ATOM 92 OD1 ASP A 9 -24.339 7.026 -1.662 1.00 1.00 O ATOM 93 OD2 ASP A 9 -23.385 5.070 -1.914 1.00 1.00 O ATOM 0 H ASP A 9 -24.272 8.764 0.286 1.00 1.00 H new ATOM 0 HA ASP A 9 -22.564 7.085 1.949 1.00 1.00 H new ATOM 0 HB2 ASP A 9 -22.735 5.167 0.515 1.00 1.00 H new ATOM 0 HB3 ASP A 9 -24.390 5.646 0.836 1.00 1.00 H new ATOM 98 N ALA A 10 -21.811 9.156 -0.156 1.00 1.00 N ATOM 99 CA ALA A 10 -20.795 9.876 -0.937 1.00 1.00 C ATOM 100 C ALA A 10 -19.469 10.177 -0.190 1.00 1.00 C ATOM 101 O ALA A 10 -18.637 10.938 -0.696 1.00 1.00 O ATOM 102 CB ALA A 10 -21.455 11.163 -1.457 1.00 1.00 C ATOM 0 H ALA A 10 -22.571 9.764 0.148 1.00 1.00 H new ATOM 0 HA ALA A 10 -20.475 9.224 -1.749 1.00 1.00 H new ATOM 0 HB1 ALA A 10 -20.733 11.730 -2.045 1.00 1.00 H new ATOM 0 HB2 ALA A 10 -22.310 10.906 -2.082 1.00 1.00 H new ATOM 0 HB3 ALA A 10 -21.790 11.766 -0.613 1.00 1.00 H new ATOM 108 N LEU A 11 -19.256 9.613 1.006 1.00 1.00 N ATOM 109 CA LEU A 11 -18.075 9.833 1.848 1.00 1.00 C ATOM 110 C LEU A 11 -17.658 8.545 2.580 1.00 1.00 C ATOM 111 O LEU A 11 -18.409 8.004 3.394 1.00 1.00 O ATOM 112 CB LEU A 11 -18.410 10.964 2.839 1.00 1.00 C ATOM 113 CG LEU A 11 -17.261 11.363 3.784 1.00 1.00 C ATOM 114 CD1 LEU A 11 -16.091 12.003 3.034 1.00 1.00 C ATOM 115 CD2 LEU A 11 -17.794 12.356 4.817 1.00 1.00 C ATOM 0 H LEU A 11 -19.925 8.969 1.428 1.00 1.00 H new ATOM 0 HA LEU A 11 -17.224 10.119 1.231 1.00 1.00 H new ATOM 0 HB2 LEU A 11 -18.717 11.844 2.273 1.00 1.00 H new ATOM 0 HB3 LEU A 11 -19.266 10.658 3.441 1.00 1.00 H new ATOM 0 HG LEU A 11 -16.891 10.457 4.264 1.00 1.00 H new ATOM 0 HD11 LEU A 11 -15.306 12.267 3.742 1.00 1.00 H new ATOM 0 HD12 LEU A 11 -15.698 11.297 2.303 1.00 1.00 H new ATOM 0 HD13 LEU A 11 -16.435 12.902 2.522 1.00 1.00 H new ATOM 0 HD21 LEU A 11 -16.989 12.646 5.492 1.00 1.00 H new ATOM 0 HD22 LEU A 11 -18.177 13.240 4.308 1.00 1.00 H new ATOM 0 HD23 LEU A 11 -18.597 11.891 5.389 1.00 1.00 H new ATOM 127 N ASP A 12 -16.446 8.063 2.301 1.00 1.00 N ATOM 128 CA ASP A 12 -15.856 6.857 2.903 1.00 1.00 C ATOM 129 C ASP A 12 -15.222 7.144 4.285 1.00 1.00 C ATOM 130 O ASP A 12 -14.012 6.993 4.469 1.00 1.00 O ATOM 131 CB ASP A 12 -14.857 6.215 1.922 1.00 1.00 C ATOM 132 CG ASP A 12 -15.540 5.673 0.658 1.00 1.00 C ATOM 133 OD1 ASP A 12 -16.396 4.764 0.768 1.00 1.00 O ATOM 134 OD2 ASP A 12 -15.198 6.144 -0.453 1.00 1.00 O ATOM 0 H ASP A 12 -15.825 8.513 1.629 1.00 1.00 H new ATOM 0 HA ASP A 12 -16.656 6.141 3.089 1.00 1.00 H new ATOM 0 HB2 ASP A 12 -14.107 6.953 1.638 1.00 1.00 H new ATOM 0 HB3 ASP A 12 -14.331 5.403 2.424 1.00 1.00 H new ATOM 139 N LEU A 13 -16.036 7.571 5.263 1.00 1.00 N ATOM 140 CA LEU A 13 -15.594 7.869 6.636 1.00 1.00 C ATOM 141 C LEU A 13 -16.544 7.317 7.726 1.00 1.00 C ATOM 142 O LEU A 13 -17.767 7.359 7.555 1.00 1.00 O ATOM 143 CB LEU A 13 -15.433 9.392 6.840 1.00 1.00 C ATOM 144 CG LEU A 13 -14.158 10.017 6.248 1.00 1.00 C ATOM 145 CD1 LEU A 13 -14.156 11.515 6.562 1.00 1.00 C ATOM 146 CD2 LEU A 13 -12.881 9.427 6.851 1.00 1.00 C ATOM 0 H LEU A 13 -17.035 7.721 5.121 1.00 1.00 H new ATOM 0 HA LEU A 13 -14.635 7.364 6.750 1.00 1.00 H new ATOM 0 HB2 LEU A 13 -16.297 9.891 6.401 1.00 1.00 H new ATOM 0 HB3 LEU A 13 -15.454 9.600 7.910 1.00 1.00 H new ATOM 0 HG LEU A 13 -14.166 9.814 5.177 1.00 1.00 H new ATOM 0 HD11 LEU A 13 -13.257 11.972 6.148 1.00 1.00 H new ATOM 0 HD12 LEU A 13 -15.037 11.981 6.120 1.00 1.00 H new ATOM 0 HD13 LEU A 13 -14.173 11.660 7.642 1.00 1.00 H new ATOM 0 HD21 LEU A 13 -12.011 9.903 6.398 1.00 1.00 H new ATOM 0 HD22 LEU A 13 -12.872 9.602 7.927 1.00 1.00 H new ATOM 0 HD23 LEU A 13 -12.849 8.355 6.658 1.00 1.00 H new ATOM 158 N PRO A 14 -15.994 6.835 8.861 1.00 1.00 N ATOM 159 CA PRO A 14 -16.748 6.354 10.020 1.00 1.00 C ATOM 160 C PRO A 14 -17.244 7.525 10.896 1.00 1.00 C ATOM 161 O PRO A 14 -16.836 8.676 10.717 1.00 1.00 O ATOM 162 CB PRO A 14 -15.742 5.484 10.787 1.00 1.00 C ATOM 163 CG PRO A 14 -14.416 6.199 10.553 1.00 1.00 C ATOM 164 CD PRO A 14 -14.565 6.754 9.139 1.00 1.00 C ATOM 0 HA PRO A 14 -17.644 5.805 9.730 1.00 1.00 H new ATOM 0 HB2 PRO A 14 -15.986 5.425 11.848 1.00 1.00 H new ATOM 0 HB3 PRO A 14 -15.721 4.462 10.408 1.00 1.00 H new ATOM 0 HG2 PRO A 14 -14.252 6.993 11.282 1.00 1.00 H new ATOM 0 HG3 PRO A 14 -13.571 5.515 10.630 1.00 1.00 H new ATOM 0 HD2 PRO A 14 -14.100 7.737 9.060 1.00 1.00 H new ATOM 0 HD3 PRO A 14 -14.068 6.107 8.416 1.00 1.00 H new ATOM 172 N VAL A 15 -18.098 7.221 11.881 1.00 1.00 N ATOM 173 CA VAL A 15 -18.648 8.182 12.858 1.00 1.00 C ATOM 174 C VAL A 15 -18.682 7.538 14.251 1.00 1.00 C ATOM 175 O VAL A 15 -19.459 6.613 14.498 1.00 1.00 O ATOM 176 CB VAL A 15 -20.056 8.677 12.452 1.00 1.00 C ATOM 177 CG1 VAL A 15 -20.576 9.734 13.437 1.00 1.00 C ATOM 178 CG2 VAL A 15 -20.077 9.315 11.055 1.00 1.00 C ATOM 0 H VAL A 15 -18.439 6.271 12.029 1.00 1.00 H new ATOM 0 HA VAL A 15 -17.996 9.055 12.877 1.00 1.00 H new ATOM 0 HB VAL A 15 -20.688 7.789 12.458 1.00 1.00 H new ATOM 0 HG11 VAL A 15 -21.567 10.064 13.127 1.00 1.00 H new ATOM 0 HG12 VAL A 15 -20.633 9.303 14.437 1.00 1.00 H new ATOM 0 HG13 VAL A 15 -19.897 10.587 13.448 1.00 1.00 H new ATOM 0 HG21 VAL A 15 -21.089 9.645 10.821 1.00 1.00 H new ATOM 0 HG22 VAL A 15 -19.403 10.171 11.036 1.00 1.00 H new ATOM 0 HG23 VAL A 15 -19.754 8.582 10.316 1.00 1.00 H new ATOM 188 N GLY A 16 -17.831 8.018 15.162 1.00 1.00 N ATOM 189 CA GLY A 16 -17.720 7.529 16.544 1.00 1.00 C ATOM 190 C GLY A 16 -16.822 6.294 16.715 1.00 1.00 C ATOM 191 O GLY A 16 -16.395 5.668 15.738 1.00 1.00 O ATOM 0 H GLY A 16 -17.182 8.777 14.956 1.00 1.00 H new ATOM 0 HA2 GLY A 16 -17.333 8.333 17.170 1.00 1.00 H new ATOM 0 HA3 GLY A 16 -18.718 7.290 16.912 1.00 1.00 H new ATOM 195 N LYS A 17 -16.529 5.934 17.976 1.00 1.00 N ATOM 196 CA LYS A 17 -15.642 4.803 18.324 1.00 1.00 C ATOM 197 C LYS A 17 -16.074 3.472 17.717 1.00 1.00 C ATOM 198 O LYS A 17 -15.238 2.731 17.210 1.00 1.00 O ATOM 199 CB LYS A 17 -15.535 4.613 19.847 1.00 1.00 C ATOM 200 CG LYS A 17 -15.028 5.844 20.607 1.00 1.00 C ATOM 201 CD LYS A 17 -14.328 5.400 21.901 1.00 1.00 C ATOM 202 CE LYS A 17 -13.825 6.585 22.732 1.00 1.00 C ATOM 203 NZ LYS A 17 -12.986 6.113 23.864 1.00 1.00 N ATOM 0 H LYS A 17 -16.902 6.421 18.791 1.00 1.00 H new ATOM 0 HA LYS A 17 -14.676 5.078 17.900 1.00 1.00 H new ATOM 0 HB2 LYS A 17 -16.516 4.340 20.236 1.00 1.00 H new ATOM 0 HB3 LYS A 17 -14.867 3.776 20.050 1.00 1.00 H new ATOM 0 HG2 LYS A 17 -14.336 6.409 19.983 1.00 1.00 H new ATOM 0 HG3 LYS A 17 -15.861 6.507 20.841 1.00 1.00 H new ATOM 0 HD2 LYS A 17 -15.020 4.808 22.500 1.00 1.00 H new ATOM 0 HD3 LYS A 17 -13.488 4.752 21.652 1.00 1.00 H new ATOM 0 HE2 LYS A 17 -13.247 7.259 22.100 1.00 1.00 H new ATOM 0 HE3 LYS A 17 -14.673 7.154 23.113 1.00 1.00 H new ATOM 0 HZ1 LYS A 17 -12.655 6.930 24.415 1.00 1.00 H new ATOM 0 HZ2 LYS A 17 -13.548 5.488 24.476 1.00 1.00 H new ATOM 0 HZ3 LYS A 17 -12.167 5.590 23.494 1.00 1.00 H new ATOM 217 N ASP A 18 -17.372 3.174 17.759 1.00 1.00 N ATOM 218 CA ASP A 18 -17.946 1.923 17.242 1.00 1.00 C ATOM 219 C ASP A 18 -17.647 1.717 15.749 1.00 1.00 C ATOM 220 O ASP A 18 -17.190 0.644 15.347 1.00 1.00 O ATOM 221 CB ASP A 18 -19.460 1.902 17.494 1.00 1.00 C ATOM 222 CG ASP A 18 -19.794 1.853 18.993 1.00 1.00 C ATOM 223 OD1 ASP A 18 -19.800 0.743 19.577 1.00 1.00 O ATOM 224 OD2 ASP A 18 -20.053 2.925 19.590 1.00 1.00 O ATOM 0 H ASP A 18 -18.069 3.802 18.159 1.00 1.00 H new ATOM 0 HA ASP A 18 -17.475 1.098 17.777 1.00 1.00 H new ATOM 0 HB2 ASP A 18 -19.914 2.788 17.050 1.00 1.00 H new ATOM 0 HB3 ASP A 18 -19.898 1.037 16.997 1.00 1.00 H new ATOM 229 N ALA A 19 -17.853 2.753 14.928 1.00 1.00 N ATOM 230 CA ALA A 19 -17.564 2.696 13.496 1.00 1.00 C ATOM 231 C ALA A 19 -16.054 2.618 13.221 1.00 1.00 C ATOM 232 O ALA A 19 -15.639 1.842 12.364 1.00 1.00 O ATOM 233 CB ALA A 19 -18.188 3.912 12.811 1.00 1.00 C ATOM 0 H ALA A 19 -18.224 3.651 15.239 1.00 1.00 H new ATOM 0 HA ALA A 19 -18.002 1.786 13.086 1.00 1.00 H new ATOM 0 HB1 ALA A 19 -17.976 3.876 11.742 1.00 1.00 H new ATOM 0 HB2 ALA A 19 -19.267 3.904 12.968 1.00 1.00 H new ATOM 0 HB3 ALA A 19 -17.767 4.824 13.234 1.00 1.00 H new ATOM 239 N VAL A 20 -15.222 3.376 13.952 1.00 1.00 N ATOM 240 CA VAL A 20 -13.755 3.329 13.793 1.00 1.00 C ATOM 241 C VAL A 20 -13.215 1.940 14.157 1.00 1.00 C ATOM 242 O VAL A 20 -12.444 1.364 13.391 1.00 1.00 O ATOM 243 CB VAL A 20 -13.064 4.441 14.609 1.00 1.00 C ATOM 244 CG1 VAL A 20 -11.538 4.281 14.611 1.00 1.00 C ATOM 245 CG2 VAL A 20 -13.377 5.821 14.015 1.00 1.00 C ATOM 0 H VAL A 20 -15.540 4.034 14.664 1.00 1.00 H new ATOM 0 HA VAL A 20 -13.522 3.512 12.744 1.00 1.00 H new ATOM 0 HB VAL A 20 -13.445 4.359 15.627 1.00 1.00 H new ATOM 0 HG11 VAL A 20 -11.089 5.083 15.196 1.00 1.00 H new ATOM 0 HG12 VAL A 20 -11.274 3.319 15.051 1.00 1.00 H new ATOM 0 HG13 VAL A 20 -11.166 4.326 13.587 1.00 1.00 H new ATOM 0 HG21 VAL A 20 -12.881 6.592 14.604 1.00 1.00 H new ATOM 0 HG22 VAL A 20 -13.019 5.864 12.986 1.00 1.00 H new ATOM 0 HG23 VAL A 20 -14.454 5.989 14.032 1.00 1.00 H new ATOM 255 N ASN A 21 -13.649 1.356 15.279 1.00 1.00 N ATOM 256 CA ASN A 21 -13.249 0.006 15.690 1.00 1.00 C ATOM 257 C ASN A 21 -13.686 -1.046 14.651 1.00 1.00 C ATOM 258 O ASN A 21 -12.909 -1.941 14.315 1.00 1.00 O ATOM 259 CB ASN A 21 -13.823 -0.301 17.087 1.00 1.00 C ATOM 260 CG ASN A 21 -13.186 0.499 18.218 1.00 1.00 C ATOM 261 OD1 ASN A 21 -12.105 1.063 18.113 1.00 1.00 O ATOM 262 ND2 ASN A 21 -13.830 0.551 19.363 1.00 1.00 N ATOM 0 H ASN A 21 -14.290 1.808 15.930 1.00 1.00 H new ATOM 0 HA ASN A 21 -12.161 -0.040 15.746 1.00 1.00 H new ATOM 0 HB2 ASN A 21 -14.895 -0.104 17.078 1.00 1.00 H new ATOM 0 HB3 ASN A 21 -13.696 -1.364 17.293 1.00 1.00 H new ATOM 0 HD21 ASN A 21 -13.428 1.058 20.152 1.00 1.00 H new ATOM 0 HD22 ASN A 21 -14.732 0.085 19.463 1.00 1.00 H new ATOM 269 N SER A 22 -14.898 -0.915 14.098 1.00 1.00 N ATOM 270 CA SER A 22 -15.403 -1.809 13.041 1.00 1.00 C ATOM 271 C SER A 22 -14.581 -1.672 11.752 1.00 1.00 C ATOM 272 O SER A 22 -14.194 -2.678 11.158 1.00 1.00 O ATOM 273 CB SER A 22 -16.879 -1.523 12.736 1.00 1.00 C ATOM 274 OG SER A 22 -17.687 -1.729 13.883 1.00 1.00 O ATOM 0 H SER A 22 -15.559 -0.187 14.369 1.00 1.00 H new ATOM 0 HA SER A 22 -15.306 -2.829 13.412 1.00 1.00 H new ATOM 0 HB2 SER A 22 -16.989 -0.495 12.390 1.00 1.00 H new ATOM 0 HB3 SER A 22 -17.218 -2.170 11.927 1.00 1.00 H new ATOM 0 HG SER A 22 -17.601 -0.961 14.486 1.00 1.00 H new ATOM 280 N LEU A 23 -14.261 -0.441 11.338 1.00 1.00 N ATOM 281 CA LEU A 23 -13.439 -0.138 10.160 1.00 1.00 C ATOM 282 C LEU A 23 -12.031 -0.735 10.293 1.00 1.00 C ATOM 283 O LEU A 23 -11.525 -1.324 9.336 1.00 1.00 O ATOM 284 CB LEU A 23 -13.412 1.393 9.986 1.00 1.00 C ATOM 285 CG LEU A 23 -12.683 1.908 8.733 1.00 1.00 C ATOM 286 CD1 LEU A 23 -13.408 1.506 7.448 1.00 1.00 C ATOM 287 CD2 LEU A 23 -12.632 3.435 8.784 1.00 1.00 C ATOM 0 H LEU A 23 -14.576 0.397 11.827 1.00 1.00 H new ATOM 0 HA LEU A 23 -13.869 -0.595 9.269 1.00 1.00 H new ATOM 0 HB2 LEU A 23 -14.440 1.756 9.961 1.00 1.00 H new ATOM 0 HB3 LEU A 23 -12.940 1.832 10.865 1.00 1.00 H new ATOM 0 HG LEU A 23 -11.685 1.470 8.725 1.00 1.00 H new ATOM 0 HD11 LEU A 23 -12.861 1.889 6.587 1.00 1.00 H new ATOM 0 HD12 LEU A 23 -13.465 0.419 7.387 1.00 1.00 H new ATOM 0 HD13 LEU A 23 -14.415 1.923 7.453 1.00 1.00 H new ATOM 0 HD21 LEU A 23 -12.117 3.812 7.900 1.00 1.00 H new ATOM 0 HD22 LEU A 23 -13.647 3.832 8.810 1.00 1.00 H new ATOM 0 HD23 LEU A 23 -12.096 3.751 9.679 1.00 1.00 H new ATOM 299 N ILE A 24 -11.428 -0.631 11.485 1.00 1.00 N ATOM 300 CA ILE A 24 -10.127 -1.229 11.808 1.00 1.00 C ATOM 301 C ILE A 24 -10.215 -2.760 11.690 1.00 1.00 C ATOM 302 O ILE A 24 -9.387 -3.366 11.011 1.00 1.00 O ATOM 303 CB ILE A 24 -9.666 -0.787 13.220 1.00 1.00 C ATOM 304 CG1 ILE A 24 -9.242 0.701 13.226 1.00 1.00 C ATOM 305 CG2 ILE A 24 -8.504 -1.659 13.728 1.00 1.00 C ATOM 306 CD1 ILE A 24 -9.155 1.293 14.641 1.00 1.00 C ATOM 0 H ILE A 24 -11.839 -0.119 12.266 1.00 1.00 H new ATOM 0 HA ILE A 24 -9.379 -0.878 11.097 1.00 1.00 H new ATOM 0 HB ILE A 24 -10.516 -0.915 13.890 1.00 1.00 H new ATOM 0 HG12 ILE A 24 -8.273 0.799 12.736 1.00 1.00 H new ATOM 0 HG13 ILE A 24 -9.956 1.279 12.639 1.00 1.00 H new ATOM 0 HG21 ILE A 24 -8.204 -1.323 14.721 1.00 1.00 H new ATOM 0 HG22 ILE A 24 -8.825 -2.699 13.778 1.00 1.00 H new ATOM 0 HG23 ILE A 24 -7.659 -1.573 13.045 1.00 1.00 H new ATOM 0 HD11 ILE A 24 -8.853 2.339 14.580 1.00 1.00 H new ATOM 0 HD12 ILE A 24 -10.129 1.224 15.125 1.00 1.00 H new ATOM 0 HD13 ILE A 24 -8.421 0.737 15.224 1.00 1.00 H new ATOM 318 N ARG A 25 -11.220 -3.394 12.316 1.00 1.00 N ATOM 319 CA ARG A 25 -11.409 -4.857 12.284 1.00 1.00 C ATOM 320 C ARG A 25 -11.643 -5.412 10.877 1.00 1.00 C ATOM 321 O ARG A 25 -11.089 -6.457 10.541 1.00 1.00 O ATOM 322 CB ARG A 25 -12.533 -5.255 13.258 1.00 1.00 C ATOM 323 CG ARG A 25 -12.801 -6.769 13.293 1.00 1.00 C ATOM 324 CD ARG A 25 -11.584 -7.616 13.700 1.00 1.00 C ATOM 325 NE ARG A 25 -11.847 -9.058 13.527 1.00 1.00 N ATOM 326 CZ ARG A 25 -11.697 -9.769 12.421 1.00 1.00 C ATOM 327 NH1 ARG A 25 -11.333 -9.244 11.283 1.00 1.00 N ATOM 328 NH2 ARG A 25 -11.918 -11.052 12.437 1.00 1.00 N ATOM 0 H ARG A 25 -11.929 -2.905 12.862 1.00 1.00 H new ATOM 0 HA ARG A 25 -10.476 -5.315 12.612 1.00 1.00 H new ATOM 0 HB2 ARG A 25 -12.272 -4.916 14.261 1.00 1.00 H new ATOM 0 HB3 ARG A 25 -13.450 -4.737 12.975 1.00 1.00 H new ATOM 0 HG2 ARG A 25 -13.616 -6.966 13.990 1.00 1.00 H new ATOM 0 HG3 ARG A 25 -13.139 -7.089 12.308 1.00 1.00 H new ATOM 0 HD2 ARG A 25 -10.721 -7.328 13.099 1.00 1.00 H new ATOM 0 HD3 ARG A 25 -11.330 -7.414 14.740 1.00 1.00 H new ATOM 0 HE ARG A 25 -12.181 -9.561 14.349 1.00 1.00 H new ATOM 0 HH11 ARG A 25 -11.150 -8.243 11.219 1.00 1.00 H new ATOM 0 HH12 ARG A 25 -11.231 -9.835 10.458 1.00 1.00 H new ATOM 0 HH21 ARG A 25 -12.207 -11.509 13.302 1.00 1.00 H new ATOM 0 HH22 ARG A 25 -11.802 -11.600 11.585 1.00 1.00 H new ATOM 342 N GLU A 26 -12.444 -4.731 10.059 1.00 1.00 N ATOM 343 CA GLU A 26 -12.748 -5.134 8.676 1.00 1.00 C ATOM 344 C GLU A 26 -11.562 -4.946 7.707 1.00 1.00 C ATOM 345 O GLU A 26 -11.580 -5.493 6.602 1.00 1.00 O ATOM 346 CB GLU A 26 -13.969 -4.345 8.167 1.00 1.00 C ATOM 347 CG GLU A 26 -15.294 -4.785 8.808 1.00 1.00 C ATOM 348 CD GLU A 26 -15.737 -6.179 8.317 1.00 1.00 C ATOM 349 OE1 GLU A 26 -16.389 -6.272 7.247 1.00 1.00 O ATOM 350 OE2 GLU A 26 -15.445 -7.191 8.998 1.00 1.00 O ATOM 0 H GLU A 26 -12.911 -3.868 10.338 1.00 1.00 H new ATOM 0 HA GLU A 26 -12.963 -6.202 8.698 1.00 1.00 H new ATOM 0 HB2 GLU A 26 -13.814 -3.284 8.364 1.00 1.00 H new ATOM 0 HB3 GLU A 26 -14.042 -4.461 7.086 1.00 1.00 H new ATOM 0 HG2 GLU A 26 -15.185 -4.800 9.892 1.00 1.00 H new ATOM 0 HG3 GLU A 26 -16.069 -4.055 8.576 1.00 1.00 H new ATOM 357 N ASN A 27 -10.533 -4.188 8.106 1.00 1.00 N ATOM 358 CA ASN A 27 -9.344 -3.881 7.302 1.00 1.00 C ATOM 359 C ASN A 27 -8.036 -4.074 8.101 1.00 1.00 C ATOM 360 O ASN A 27 -7.092 -3.291 7.971 1.00 1.00 O ATOM 361 CB ASN A 27 -9.480 -2.454 6.745 1.00 1.00 C ATOM 362 CG ASN A 27 -10.709 -2.244 5.880 1.00 1.00 C ATOM 363 OD1 ASN A 27 -10.715 -2.515 4.688 1.00 1.00 O ATOM 364 ND2 ASN A 27 -11.779 -1.746 6.456 1.00 1.00 N ATOM 0 H ASN A 27 -10.505 -3.757 9.030 1.00 1.00 H new ATOM 0 HA ASN A 27 -9.283 -4.583 6.471 1.00 1.00 H new ATOM 0 HB2 ASN A 27 -9.510 -1.751 7.578 1.00 1.00 H new ATOM 0 HB3 ASN A 27 -8.591 -2.217 6.160 1.00 1.00 H new ATOM 0 HD21 ASN A 27 -12.624 -1.583 5.908 1.00 1.00 H new ATOM 0 HD22 ASN A 27 -11.765 -1.523 7.451 1.00 1.00 H new ATOM 371 N SER A 28 -7.978 -5.107 8.951 1.00 1.00 N ATOM 372 CA SER A 28 -6.836 -5.425 9.831 1.00 1.00 C ATOM 373 C SER A 28 -5.467 -5.531 9.133 1.00 1.00 C ATOM 374 O SER A 28 -4.426 -5.384 9.777 1.00 1.00 O ATOM 375 CB SER A 28 -7.131 -6.705 10.619 1.00 1.00 C ATOM 376 OG SER A 28 -7.351 -7.800 9.740 1.00 1.00 O ATOM 0 H SER A 28 -8.748 -5.769 9.052 1.00 1.00 H new ATOM 0 HA SER A 28 -6.740 -4.567 10.497 1.00 1.00 H new ATOM 0 HB2 SER A 28 -6.297 -6.929 11.284 1.00 1.00 H new ATOM 0 HB3 SER A 28 -8.009 -6.556 11.248 1.00 1.00 H new ATOM 0 HG SER A 28 -7.536 -8.608 10.263 1.00 1.00 H new ATOM 382 N HIS A 29 -5.448 -5.751 7.814 1.00 1.00 N ATOM 383 CA HIS A 29 -4.247 -5.813 6.971 1.00 1.00 C ATOM 384 C HIS A 29 -3.610 -4.437 6.694 1.00 1.00 C ATOM 385 O HIS A 29 -2.429 -4.382 6.341 1.00 1.00 O ATOM 386 CB HIS A 29 -4.612 -6.517 5.651 1.00 1.00 C ATOM 387 CG HIS A 29 -5.687 -5.831 4.832 1.00 1.00 C ATOM 388 ND1 HIS A 29 -7.009 -5.611 5.238 1.00 1.00 N ATOM 389 CD2 HIS A 29 -5.534 -5.346 3.565 1.00 1.00 C ATOM 390 CE1 HIS A 29 -7.613 -4.990 4.210 1.00 1.00 C ATOM 391 NE2 HIS A 29 -6.750 -4.813 3.196 1.00 1.00 N ATOM 0 H HIS A 29 -6.305 -5.897 7.281 1.00 1.00 H new ATOM 0 HA HIS A 29 -3.490 -6.376 7.517 1.00 1.00 H new ATOM 0 HB2 HIS A 29 -3.712 -6.602 5.042 1.00 1.00 H new ATOM 0 HB3 HIS A 29 -4.941 -7.531 5.877 1.00 1.00 H new ATOM 0 HD2 HIS A 29 -4.635 -5.375 2.968 1.00 1.00 H new ATOM 0 HE1 HIS A 29 -8.647 -4.677 4.201 1.00 1.00 H new ATOM 0 HE2 HIS A 29 -6.959 -4.361 2.306 1.00 1.00 H new ATOM 399 N ILE A 30 -4.359 -3.337 6.860 1.00 1.00 N ATOM 400 CA ILE A 30 -3.918 -1.948 6.595 1.00 1.00 C ATOM 401 C ILE A 30 -4.238 -0.935 7.706 1.00 1.00 C ATOM 402 O ILE A 30 -3.607 0.121 7.748 1.00 1.00 O ATOM 403 CB ILE A 30 -4.490 -1.429 5.254 1.00 1.00 C ATOM 404 CG1 ILE A 30 -6.027 -1.597 5.196 1.00 1.00 C ATOM 405 CG2 ILE A 30 -3.771 -2.104 4.075 1.00 1.00 C ATOM 406 CD1 ILE A 30 -6.706 -0.924 4.003 1.00 1.00 C ATOM 0 H ILE A 30 -5.322 -3.385 7.193 1.00 1.00 H new ATOM 0 HA ILE A 30 -2.831 -2.018 6.551 1.00 1.00 H new ATOM 0 HB ILE A 30 -4.301 -0.358 5.179 1.00 1.00 H new ATOM 0 HG12 ILE A 30 -6.260 -2.661 5.175 1.00 1.00 H new ATOM 0 HG13 ILE A 30 -6.456 -1.195 6.114 1.00 1.00 H new ATOM 0 HG21 ILE A 30 -4.182 -1.731 3.137 1.00 1.00 H new ATOM 0 HG22 ILE A 30 -2.706 -1.877 4.120 1.00 1.00 H new ATOM 0 HG23 ILE A 30 -3.915 -3.183 4.131 1.00 1.00 H new ATOM 0 HD11 ILE A 30 -7.781 -1.098 4.050 1.00 1.00 H new ATOM 0 HD12 ILE A 30 -6.510 0.148 4.030 1.00 1.00 H new ATOM 0 HD13 ILE A 30 -6.312 -1.342 3.077 1.00 1.00 H new ATOM 418 N PHE A 31 -5.169 -1.236 8.609 1.00 1.00 N ATOM 419 CA PHE A 31 -5.566 -0.378 9.730 1.00 1.00 C ATOM 420 C PHE A 31 -5.446 -1.162 11.046 1.00 1.00 C ATOM 421 O PHE A 31 -5.762 -2.353 11.108 1.00 1.00 O ATOM 422 CB PHE A 31 -7.033 0.068 9.560 1.00 1.00 C ATOM 423 CG PHE A 31 -7.434 0.863 8.322 1.00 1.00 C ATOM 424 CD1 PHE A 31 -6.518 1.662 7.609 1.00 1.00 C ATOM 425 CD2 PHE A 31 -8.779 0.827 7.906 1.00 1.00 C ATOM 426 CE1 PHE A 31 -6.934 2.367 6.465 1.00 1.00 C ATOM 427 CE2 PHE A 31 -9.193 1.514 6.753 1.00 1.00 C ATOM 428 CZ PHE A 31 -8.266 2.278 6.026 1.00 1.00 C ATOM 0 H PHE A 31 -5.687 -2.114 8.582 1.00 1.00 H new ATOM 0 HA PHE A 31 -4.914 0.495 9.750 1.00 1.00 H new ATOM 0 HB2 PHE A 31 -7.653 -0.828 9.589 1.00 1.00 H new ATOM 0 HB3 PHE A 31 -7.297 0.666 10.432 1.00 1.00 H new ATOM 0 HD1 PHE A 31 -5.493 1.733 7.942 1.00 1.00 H new ATOM 0 HD2 PHE A 31 -9.500 0.265 8.480 1.00 1.00 H new ATOM 0 HE1 PHE A 31 -6.228 2.978 5.923 1.00 1.00 H new ATOM 0 HE2 PHE A 31 -10.221 1.455 6.427 1.00 1.00 H new ATOM 0 HZ PHE A 31 -8.576 2.796 5.131 1.00 1.00 H new ATOM 438 N SER A 32 -5.018 -0.491 12.111 1.00 1.00 N ATOM 439 CA SER A 32 -4.897 -1.049 13.462 1.00 1.00 C ATOM 440 C SER A 32 -5.163 0.023 14.523 1.00 1.00 C ATOM 441 O SER A 32 -5.261 1.217 14.221 1.00 1.00 O ATOM 442 CB SER A 32 -3.519 -1.695 13.672 1.00 1.00 C ATOM 443 OG SER A 32 -2.529 -0.728 13.977 1.00 1.00 O ATOM 0 H SER A 32 -4.736 0.488 12.060 1.00 1.00 H new ATOM 0 HA SER A 32 -5.653 -1.827 13.570 1.00 1.00 H new ATOM 0 HB2 SER A 32 -3.578 -2.423 14.481 1.00 1.00 H new ATOM 0 HB3 SER A 32 -3.231 -2.240 12.773 1.00 1.00 H new ATOM 0 HG SER A 32 -1.666 -1.173 14.106 1.00 1.00 H new ATOM 449 N ASP A 33 -5.246 -0.392 15.788 1.00 1.00 N ATOM 450 CA ASP A 33 -5.419 0.518 16.926 1.00 1.00 C ATOM 451 C ASP A 33 -4.214 1.462 17.141 1.00 1.00 C ATOM 452 O ASP A 33 -4.310 2.395 17.940 1.00 1.00 O ATOM 453 CB ASP A 33 -5.672 -0.305 18.197 1.00 1.00 C ATOM 454 CG ASP A 33 -7.054 -0.964 18.177 1.00 1.00 C ATOM 455 OD1 ASP A 33 -8.054 -0.234 18.373 1.00 1.00 O ATOM 456 OD2 ASP A 33 -7.141 -2.200 17.977 1.00 1.00 O ATOM 0 H ASP A 33 -5.195 -1.375 16.056 1.00 1.00 H new ATOM 0 HA ASP A 33 -6.275 1.155 16.702 1.00 1.00 H new ATOM 0 HB2 ASP A 33 -4.904 -1.072 18.293 1.00 1.00 H new ATOM 0 HB3 ASP A 33 -5.589 0.340 19.071 1.00 1.00 H new ATOM 461 N THR A 34 -3.085 1.225 16.455 1.00 1.00 N ATOM 462 CA THR A 34 -1.831 1.985 16.602 1.00 1.00 C ATOM 463 C THR A 34 -1.177 2.447 15.292 1.00 1.00 C ATOM 464 O THR A 34 -0.167 3.148 15.356 1.00 1.00 O ATOM 465 CB THR A 34 -0.798 1.193 17.428 1.00 1.00 C ATOM 466 OG1 THR A 34 -0.538 -0.061 16.827 1.00 1.00 O ATOM 467 CG2 THR A 34 -1.266 0.936 18.863 1.00 1.00 C ATOM 0 H THR A 34 -3.016 0.479 15.763 1.00 1.00 H new ATOM 0 HA THR A 34 -2.136 2.893 17.122 1.00 1.00 H new ATOM 0 HB THR A 34 0.102 1.807 17.455 1.00 1.00 H new ATOM 0 HG1 THR A 34 0.121 -0.550 17.363 1.00 1.00 H new ATOM 0 HG21 THR A 34 -0.501 0.375 19.400 1.00 1.00 H new ATOM 0 HG22 THR A 34 -1.438 1.888 19.366 1.00 1.00 H new ATOM 0 HG23 THR A 34 -2.192 0.362 18.846 1.00 1.00 H new ATOM 475 N GLN A 35 -1.702 2.111 14.105 1.00 1.00 N ATOM 476 CA GLN A 35 -1.121 2.534 12.819 1.00 1.00 C ATOM 477 C GLN A 35 -2.102 2.447 11.632 1.00 1.00 C ATOM 478 O GLN A 35 -2.895 1.510 11.532 1.00 1.00 O ATOM 479 CB GLN A 35 0.101 1.627 12.530 1.00 1.00 C ATOM 480 CG GLN A 35 0.974 2.083 11.348 1.00 1.00 C ATOM 481 CD GLN A 35 2.140 1.125 11.096 1.00 1.00 C ATOM 482 OE1 GLN A 35 1.965 -0.052 10.810 1.00 1.00 O ATOM 483 NE2 GLN A 35 3.372 1.583 11.177 1.00 1.00 N ATOM 0 H GLN A 35 -2.541 1.539 14.007 1.00 1.00 H new ATOM 0 HA GLN A 35 -0.848 3.585 12.913 1.00 1.00 H new ATOM 0 HB2 GLN A 35 0.721 1.580 13.425 1.00 1.00 H new ATOM 0 HB3 GLN A 35 -0.253 0.615 12.334 1.00 1.00 H new ATOM 0 HG2 GLN A 35 0.361 2.153 10.450 1.00 1.00 H new ATOM 0 HG3 GLN A 35 1.362 3.082 11.547 1.00 1.00 H new ATOM 0 HE21 GLN A 35 3.538 2.561 11.414 1.00 1.00 H new ATOM 0 HE22 GLN A 35 4.160 0.960 11.003 1.00 1.00 H new ATOM 492 N CYS A 36 -1.975 3.381 10.682 1.00 1.00 N ATOM 493 CA CYS A 36 -2.692 3.382 9.398 1.00 1.00 C ATOM 494 C CYS A 36 -1.658 3.279 8.261 1.00 1.00 C ATOM 495 O CYS A 36 -0.861 4.200 8.062 1.00 1.00 O ATOM 496 CB CYS A 36 -3.516 4.672 9.249 1.00 1.00 C ATOM 497 SG CYS A 36 -4.479 4.778 7.715 1.00 1.00 S ATOM 0 H CYS A 36 -1.352 4.182 10.787 1.00 1.00 H new ATOM 0 HA CYS A 36 -3.376 2.535 9.356 1.00 1.00 H new ATOM 0 HB2 CYS A 36 -4.197 4.753 10.096 1.00 1.00 H new ATOM 0 HB3 CYS A 36 -2.841 5.527 9.299 1.00 1.00 H new ATOM 502 N LYS A 37 -1.655 2.176 7.499 1.00 1.00 N ATOM 503 CA LYS A 37 -0.704 1.947 6.389 1.00 1.00 C ATOM 504 C LYS A 37 -1.046 2.732 5.121 1.00 1.00 C ATOM 505 O LYS A 37 -0.133 3.178 4.432 1.00 1.00 O ATOM 506 CB LYS A 37 -0.621 0.452 6.048 1.00 1.00 C ATOM 507 CG LYS A 37 -0.165 -0.414 7.231 1.00 1.00 C ATOM 508 CD LYS A 37 0.118 -1.836 6.737 1.00 1.00 C ATOM 509 CE LYS A 37 0.258 -2.813 7.909 1.00 1.00 C ATOM 510 NZ LYS A 37 0.255 -4.220 7.431 1.00 1.00 N ATOM 0 H LYS A 37 -2.315 1.409 7.632 1.00 1.00 H new ATOM 0 HA LYS A 37 0.260 2.310 6.746 1.00 1.00 H new ATOM 0 HB2 LYS A 37 -1.599 0.108 5.710 1.00 1.00 H new ATOM 0 HB3 LYS A 37 0.070 0.313 5.217 1.00 1.00 H new ATOM 0 HG2 LYS A 37 0.731 0.011 7.684 1.00 1.00 H new ATOM 0 HG3 LYS A 37 -0.935 -0.431 8.002 1.00 1.00 H new ATOM 0 HD2 LYS A 37 -0.689 -2.163 6.082 1.00 1.00 H new ATOM 0 HD3 LYS A 37 1.032 -1.842 6.144 1.00 1.00 H new ATOM 0 HE2 LYS A 37 1.183 -2.610 8.448 1.00 1.00 H new ATOM 0 HE3 LYS A 37 -0.561 -2.662 8.613 1.00 1.00 H new ATOM 0 HZ1 LYS A 37 0.436 -4.859 8.231 1.00 1.00 H new ATOM 0 HZ2 LYS A 37 -0.671 -4.442 7.012 1.00 1.00 H new ATOM 0 HZ3 LYS A 37 0.998 -4.345 6.714 1.00 1.00 H new ATOM 524 N VAL A 38 -2.336 2.949 4.831 1.00 1.00 N ATOM 525 CA VAL A 38 -2.805 3.731 3.660 1.00 1.00 C ATOM 526 C VAL A 38 -2.275 5.174 3.700 1.00 1.00 C ATOM 527 O VAL A 38 -2.029 5.784 2.659 1.00 1.00 O ATOM 528 CB VAL A 38 -4.348 3.717 3.557 1.00 1.00 C ATOM 529 CG1 VAL A 38 -4.884 4.444 2.318 1.00 1.00 C ATOM 530 CG2 VAL A 38 -4.877 2.281 3.476 1.00 1.00 C ATOM 0 H VAL A 38 -3.098 2.586 5.404 1.00 1.00 H new ATOM 0 HA VAL A 38 -2.403 3.251 2.768 1.00 1.00 H new ATOM 0 HB VAL A 38 -4.691 4.230 4.455 1.00 1.00 H new ATOM 0 HG11 VAL A 38 -5.973 4.395 2.310 1.00 1.00 H new ATOM 0 HG12 VAL A 38 -4.568 5.487 2.343 1.00 1.00 H new ATOM 0 HG13 VAL A 38 -4.493 3.968 1.419 1.00 1.00 H new ATOM 0 HG21 VAL A 38 -5.965 2.297 3.404 1.00 1.00 H new ATOM 0 HG22 VAL A 38 -4.463 1.790 2.596 1.00 1.00 H new ATOM 0 HG23 VAL A 38 -4.581 1.733 4.370 1.00 1.00 H new ATOM 540 N CYS A 39 -2.058 5.701 4.908 1.00 1.00 N ATOM 541 CA CYS A 39 -1.543 7.037 5.183 1.00 1.00 C ATOM 542 C CYS A 39 -0.135 7.011 5.817 1.00 1.00 C ATOM 543 O CYS A 39 0.363 8.053 6.246 1.00 1.00 O ATOM 544 CB CYS A 39 -2.582 7.696 6.088 1.00 1.00 C ATOM 545 SG CYS A 39 -4.240 7.736 5.352 1.00 1.00 S ATOM 0 H CYS A 39 -2.248 5.177 5.762 1.00 1.00 H new ATOM 0 HA CYS A 39 -1.405 7.604 4.262 1.00 1.00 H new ATOM 0 HB2 CYS A 39 -2.624 7.158 7.035 1.00 1.00 H new ATOM 0 HB3 CYS A 39 -2.266 8.715 6.313 1.00 1.00 H new ATOM 550 N SER A 40 0.491 5.826 5.867 1.00 1.00 N ATOM 551 CA SER A 40 1.809 5.504 6.444 1.00 1.00 C ATOM 552 C SER A 40 2.146 6.316 7.705 1.00 1.00 C ATOM 553 O SER A 40 3.171 7.000 7.778 1.00 1.00 O ATOM 554 CB SER A 40 2.915 5.609 5.378 1.00 1.00 C ATOM 555 OG SER A 40 2.596 4.881 4.199 1.00 1.00 O ATOM 0 H SER A 40 0.052 4.995 5.471 1.00 1.00 H new ATOM 0 HA SER A 40 1.754 4.468 6.779 1.00 1.00 H new ATOM 0 HB2 SER A 40 3.074 6.657 5.124 1.00 1.00 H new ATOM 0 HB3 SER A 40 3.852 5.236 5.791 1.00 1.00 H new ATOM 0 HG SER A 40 1.825 4.301 4.371 1.00 1.00 H new ATOM 561 N ALA A 41 1.247 6.259 8.689 1.00 1.00 N ATOM 562 CA ALA A 41 1.330 7.027 9.934 1.00 1.00 C ATOM 563 C ALA A 41 0.975 6.209 11.186 1.00 1.00 C ATOM 564 O ALA A 41 0.086 5.354 11.168 1.00 1.00 O ATOM 565 CB ALA A 41 0.407 8.246 9.804 1.00 1.00 C ATOM 0 H ALA A 41 0.421 5.663 8.642 1.00 1.00 H new ATOM 0 HA ALA A 41 2.367 7.333 10.074 1.00 1.00 H new ATOM 0 HB1 ALA A 41 0.451 8.835 10.720 1.00 1.00 H new ATOM 0 HB2 ALA A 41 0.730 8.859 8.962 1.00 1.00 H new ATOM 0 HB3 ALA A 41 -0.617 7.911 9.637 1.00 1.00 H new ATOM 571 N VAL A 42 1.662 6.511 12.291 1.00 1.00 N ATOM 572 CA VAL A 42 1.458 5.892 13.612 1.00 1.00 C ATOM 573 C VAL A 42 0.376 6.665 14.380 1.00 1.00 C ATOM 574 O VAL A 42 0.223 7.879 14.234 1.00 1.00 O ATOM 575 CB VAL A 42 2.792 5.850 14.393 1.00 1.00 C ATOM 576 CG1 VAL A 42 2.665 5.273 15.810 1.00 1.00 C ATOM 577 CG2 VAL A 42 3.821 4.983 13.651 1.00 1.00 C ATOM 0 H VAL A 42 2.400 7.215 12.295 1.00 1.00 H new ATOM 0 HA VAL A 42 1.118 4.864 13.488 1.00 1.00 H new ATOM 0 HB VAL A 42 3.106 6.891 14.467 1.00 1.00 H new ATOM 0 HG11 VAL A 42 3.642 5.277 16.293 1.00 1.00 H new ATOM 0 HG12 VAL A 42 1.971 5.882 16.390 1.00 1.00 H new ATOM 0 HG13 VAL A 42 2.292 4.250 15.754 1.00 1.00 H new ATOM 0 HG21 VAL A 42 4.754 4.964 14.214 1.00 1.00 H new ATOM 0 HG22 VAL A 42 3.437 3.968 13.551 1.00 1.00 H new ATOM 0 HG23 VAL A 42 4.003 5.401 12.661 1.00 1.00 H new ATOM 587 N LEU A 43 -0.379 5.942 15.204 1.00 1.00 N ATOM 588 CA LEU A 43 -1.522 6.401 15.994 1.00 1.00 C ATOM 589 C LEU A 43 -1.233 6.134 17.483 1.00 1.00 C ATOM 590 O LEU A 43 -1.691 5.153 18.066 1.00 1.00 O ATOM 591 CB LEU A 43 -2.798 5.709 15.457 1.00 1.00 C ATOM 592 CG LEU A 43 -3.021 5.840 13.935 1.00 1.00 C ATOM 593 CD1 LEU A 43 -4.203 4.986 13.490 1.00 1.00 C ATOM 594 CD2 LEU A 43 -3.277 7.285 13.515 1.00 1.00 C ATOM 0 H LEU A 43 -0.196 4.949 15.348 1.00 1.00 H new ATOM 0 HA LEU A 43 -1.688 7.474 15.902 1.00 1.00 H new ATOM 0 HB2 LEU A 43 -2.754 4.650 15.713 1.00 1.00 H new ATOM 0 HB3 LEU A 43 -3.663 6.125 15.973 1.00 1.00 H new ATOM 0 HG LEU A 43 -2.106 5.494 13.455 1.00 1.00 H new ATOM 0 HD11 LEU A 43 -4.344 5.092 12.414 1.00 1.00 H new ATOM 0 HD12 LEU A 43 -4.007 3.941 13.729 1.00 1.00 H new ATOM 0 HD13 LEU A 43 -5.104 5.314 14.008 1.00 1.00 H new ATOM 0 HD21 LEU A 43 -3.428 7.329 12.436 1.00 1.00 H new ATOM 0 HD22 LEU A 43 -4.167 7.659 14.022 1.00 1.00 H new ATOM 0 HD23 LEU A 43 -2.419 7.900 13.786 1.00 1.00 H new ATOM 606 N ILE A 44 -0.390 6.989 18.071 1.00 1.00 N ATOM 607 CA ILE A 44 0.146 6.896 19.449 1.00 1.00 C ATOM 608 C ILE A 44 -0.876 6.739 20.596 1.00 1.00 C ATOM 609 O ILE A 44 -0.492 6.335 21.697 1.00 1.00 O ATOM 610 CB ILE A 44 1.095 8.086 19.735 1.00 1.00 C ATOM 611 CG1 ILE A 44 0.359 9.446 19.680 1.00 1.00 C ATOM 612 CG2 ILE A 44 2.300 8.045 18.775 1.00 1.00 C ATOM 613 CD1 ILE A 44 1.220 10.636 20.117 1.00 1.00 C ATOM 0 H ILE A 44 -0.040 7.811 17.579 1.00 1.00 H new ATOM 0 HA ILE A 44 0.681 5.946 19.453 1.00 1.00 H new ATOM 0 HB ILE A 44 1.466 7.984 20.755 1.00 1.00 H new ATOM 0 HG12 ILE A 44 0.009 9.618 18.662 1.00 1.00 H new ATOM 0 HG13 ILE A 44 -0.524 9.396 20.317 1.00 1.00 H new ATOM 0 HG21 ILE A 44 2.961 8.886 18.985 1.00 1.00 H new ATOM 0 HG22 ILE A 44 2.845 7.111 18.915 1.00 1.00 H new ATOM 0 HG23 ILE A 44 1.947 8.108 17.746 1.00 1.00 H new ATOM 0 HD11 ILE A 44 0.634 11.553 20.051 1.00 1.00 H new ATOM 0 HD12 ILE A 44 1.549 10.489 21.146 1.00 1.00 H new ATOM 0 HD13 ILE A 44 2.090 10.714 19.466 1.00 1.00 H new ATOM 625 N SER A 45 -2.158 7.036 20.367 1.00 1.00 N ATOM 626 CA SER A 45 -3.249 6.911 21.348 1.00 1.00 C ATOM 627 C SER A 45 -4.600 6.775 20.638 1.00 1.00 C ATOM 628 O SER A 45 -4.728 7.133 19.465 1.00 1.00 O ATOM 629 CB SER A 45 -3.262 8.147 22.260 1.00 1.00 C ATOM 630 OG SER A 45 -4.169 7.967 23.335 1.00 1.00 O ATOM 0 H SER A 45 -2.480 7.382 19.463 1.00 1.00 H new ATOM 0 HA SER A 45 -3.082 6.016 21.947 1.00 1.00 H new ATOM 0 HB2 SER A 45 -2.260 8.328 22.649 1.00 1.00 H new ATOM 0 HB3 SER A 45 -3.544 9.028 21.683 1.00 1.00 H new ATOM 0 HG SER A 45 -4.162 8.764 23.906 1.00 1.00 H new ATOM 636 N GLU A 46 -5.635 6.302 21.339 1.00 1.00 N ATOM 637 CA GLU A 46 -6.992 6.184 20.788 1.00 1.00 C ATOM 638 C GLU A 46 -7.534 7.538 20.305 1.00 1.00 C ATOM 639 O GLU A 46 -8.182 7.583 19.266 1.00 1.00 O ATOM 640 CB GLU A 46 -7.924 5.511 21.807 1.00 1.00 C ATOM 641 CG GLU A 46 -9.339 5.341 21.237 1.00 1.00 C ATOM 642 CD GLU A 46 -10.116 4.228 21.949 1.00 1.00 C ATOM 643 OE1 GLU A 46 -9.981 3.054 21.524 1.00 1.00 O ATOM 644 OE2 GLU A 46 -10.880 4.533 22.897 1.00 1.00 O ATOM 0 H GLU A 46 -5.557 5.989 22.307 1.00 1.00 H new ATOM 0 HA GLU A 46 -6.948 5.546 19.905 1.00 1.00 H new ATOM 0 HB2 GLU A 46 -7.521 4.537 22.084 1.00 1.00 H new ATOM 0 HB3 GLU A 46 -7.965 6.110 22.717 1.00 1.00 H new ATOM 0 HG2 GLU A 46 -9.883 6.281 21.332 1.00 1.00 H new ATOM 0 HG3 GLU A 46 -9.276 5.115 20.173 1.00 1.00 H new ATOM 651 N SER A 47 -7.227 8.655 20.973 1.00 1.00 N ATOM 652 CA SER A 47 -7.642 9.986 20.501 1.00 1.00 C ATOM 653 C SER A 47 -7.059 10.311 19.118 1.00 1.00 C ATOM 654 O SER A 47 -7.781 10.782 18.236 1.00 1.00 O ATOM 655 CB SER A 47 -7.265 11.065 21.516 1.00 1.00 C ATOM 656 OG SER A 47 -5.876 11.018 21.818 1.00 1.00 O ATOM 0 H SER A 47 -6.693 8.667 21.842 1.00 1.00 H new ATOM 0 HA SER A 47 -8.727 9.970 20.401 1.00 1.00 H new ATOM 0 HB2 SER A 47 -7.522 12.047 21.120 1.00 1.00 H new ATOM 0 HB3 SER A 47 -7.844 10.928 22.429 1.00 1.00 H new ATOM 0 HG SER A 47 -5.659 11.719 22.468 1.00 1.00 H new ATOM 662 N GLN A 48 -5.776 10.002 18.889 1.00 1.00 N ATOM 663 CA GLN A 48 -5.111 10.159 17.606 1.00 1.00 C ATOM 664 C GLN A 48 -5.720 9.215 16.558 1.00 1.00 C ATOM 665 O GLN A 48 -5.968 9.639 15.430 1.00 1.00 O ATOM 666 CB GLN A 48 -3.615 9.888 17.829 1.00 1.00 C ATOM 667 CG GLN A 48 -2.748 10.258 16.625 1.00 1.00 C ATOM 668 CD GLN A 48 -2.830 11.736 16.235 1.00 1.00 C ATOM 669 OE1 GLN A 48 -3.075 12.094 15.091 1.00 1.00 O ATOM 670 NE2 GLN A 48 -2.646 12.651 17.165 1.00 1.00 N ATOM 0 H GLN A 48 -5.164 9.627 19.614 1.00 1.00 H new ATOM 0 HA GLN A 48 -5.245 11.169 17.218 1.00 1.00 H new ATOM 0 HB2 GLN A 48 -3.276 10.451 18.699 1.00 1.00 H new ATOM 0 HB3 GLN A 48 -3.474 8.832 18.059 1.00 1.00 H new ATOM 0 HG2 GLN A 48 -1.710 10.007 16.846 1.00 1.00 H new ATOM 0 HG3 GLN A 48 -3.049 9.650 15.772 1.00 1.00 H new ATOM 0 HE21 GLN A 48 -2.441 12.370 18.124 1.00 1.00 H new ATOM 0 HE22 GLN A 48 -2.709 13.641 16.926 1.00 1.00 H new ATOM 679 N LYS A 49 -6.008 7.955 16.927 1.00 1.00 N ATOM 680 CA LYS A 49 -6.646 6.971 16.033 1.00 1.00 C ATOM 681 C LYS A 49 -8.034 7.455 15.592 1.00 1.00 C ATOM 682 O LYS A 49 -8.334 7.468 14.402 1.00 1.00 O ATOM 683 CB LYS A 49 -6.634 5.562 16.698 1.00 1.00 C ATOM 684 CG LYS A 49 -8.005 4.948 17.037 1.00 1.00 C ATOM 685 CD LYS A 49 -7.942 3.596 17.760 1.00 1.00 C ATOM 686 CE LYS A 49 -9.393 3.169 18.005 1.00 1.00 C ATOM 687 NZ LYS A 49 -9.541 2.023 18.932 1.00 1.00 N ATOM 0 H LYS A 49 -5.804 7.588 17.857 1.00 1.00 H new ATOM 0 HA LYS A 49 -6.072 6.874 15.111 1.00 1.00 H new ATOM 0 HB2 LYS A 49 -6.108 4.876 16.034 1.00 1.00 H new ATOM 0 HB3 LYS A 49 -6.052 5.624 17.617 1.00 1.00 H new ATOM 0 HG2 LYS A 49 -8.559 5.651 17.659 1.00 1.00 H new ATOM 0 HG3 LYS A 49 -8.571 4.825 16.114 1.00 1.00 H new ATOM 0 HD2 LYS A 49 -7.416 2.857 17.156 1.00 1.00 H new ATOM 0 HD3 LYS A 49 -7.399 3.684 18.701 1.00 1.00 H new ATOM 0 HE2 LYS A 49 -9.947 4.018 18.404 1.00 1.00 H new ATOM 0 HE3 LYS A 49 -9.850 2.910 17.050 1.00 1.00 H new ATOM 0 HZ1 LYS A 49 -10.443 1.540 18.746 1.00 1.00 H new ATOM 0 HZ2 LYS A 49 -8.756 1.357 18.788 1.00 1.00 H new ATOM 0 HZ3 LYS A 49 -9.528 2.367 19.914 1.00 1.00 H new ATOM 701 N LEU A 50 -8.855 7.914 16.539 1.00 1.00 N ATOM 702 CA LEU A 50 -10.207 8.420 16.296 1.00 1.00 C ATOM 703 C LEU A 50 -10.194 9.654 15.390 1.00 1.00 C ATOM 704 O LEU A 50 -11.018 9.745 14.483 1.00 1.00 O ATOM 705 CB LEU A 50 -10.907 8.705 17.642 1.00 1.00 C ATOM 706 CG LEU A 50 -11.289 7.439 18.435 1.00 1.00 C ATOM 707 CD1 LEU A 50 -11.837 7.822 19.806 1.00 1.00 C ATOM 708 CD2 LEU A 50 -12.357 6.587 17.754 1.00 1.00 C ATOM 0 H LEU A 50 -8.590 7.945 17.523 1.00 1.00 H new ATOM 0 HA LEU A 50 -10.775 7.655 15.767 1.00 1.00 H new ATOM 0 HB2 LEU A 50 -10.251 9.321 18.257 1.00 1.00 H new ATOM 0 HB3 LEU A 50 -11.808 9.288 17.454 1.00 1.00 H new ATOM 0 HG LEU A 50 -10.370 6.857 18.505 1.00 1.00 H new ATOM 0 HD11 LEU A 50 -12.103 6.920 20.356 1.00 1.00 H new ATOM 0 HD12 LEU A 50 -11.078 8.374 20.360 1.00 1.00 H new ATOM 0 HD13 LEU A 50 -12.722 8.446 19.683 1.00 1.00 H new ATOM 0 HD21 LEU A 50 -12.574 5.714 18.370 1.00 1.00 H new ATOM 0 HD22 LEU A 50 -13.265 7.176 17.626 1.00 1.00 H new ATOM 0 HD23 LEU A 50 -11.995 6.262 16.779 1.00 1.00 H new ATOM 720 N ALA A 51 -9.262 10.587 15.597 1.00 1.00 N ATOM 721 CA ALA A 51 -9.140 11.764 14.742 1.00 1.00 C ATOM 722 C ALA A 51 -8.620 11.408 13.340 1.00 1.00 C ATOM 723 O ALA A 51 -9.164 11.901 12.352 1.00 1.00 O ATOM 724 CB ALA A 51 -8.238 12.788 15.442 1.00 1.00 C ATOM 0 H ALA A 51 -8.579 10.547 16.354 1.00 1.00 H new ATOM 0 HA ALA A 51 -10.128 12.198 14.590 1.00 1.00 H new ATOM 0 HB1 ALA A 51 -8.138 13.674 14.814 1.00 1.00 H new ATOM 0 HB2 ALA A 51 -8.680 13.069 16.398 1.00 1.00 H new ATOM 0 HB3 ALA A 51 -7.254 12.350 15.612 1.00 1.00 H new ATOM 730 N HIS A 52 -7.606 10.542 13.226 1.00 1.00 N ATOM 731 CA HIS A 52 -7.055 10.141 11.930 1.00 1.00 C ATOM 732 C HIS A 52 -8.091 9.388 11.082 1.00 1.00 C ATOM 733 O HIS A 52 -8.346 9.786 9.947 1.00 1.00 O ATOM 734 CB HIS A 52 -5.796 9.288 12.143 1.00 1.00 C ATOM 735 CG HIS A 52 -5.055 8.991 10.861 1.00 1.00 C ATOM 736 ND1 HIS A 52 -3.873 9.570 10.451 1.00 1.00 N ATOM 737 CD2 HIS A 52 -5.439 8.123 9.873 1.00 1.00 C ATOM 738 CE1 HIS A 52 -3.561 9.077 9.240 1.00 1.00 C ATOM 739 NE2 HIS A 52 -4.496 8.198 8.843 1.00 1.00 N ATOM 0 H HIS A 52 -7.148 10.103 14.025 1.00 1.00 H new ATOM 0 HA HIS A 52 -6.785 11.042 11.379 1.00 1.00 H new ATOM 0 HB2 HIS A 52 -5.127 9.805 12.831 1.00 1.00 H new ATOM 0 HB3 HIS A 52 -6.078 8.348 12.618 1.00 1.00 H new ATOM 0 HD1 HIS A 52 -3.329 10.255 10.976 1.00 1.00 H new ATOM 0 HD2 HIS A 52 -6.315 7.492 9.887 1.00 1.00 H new ATOM 0 HE1 HIS A 52 -2.685 9.348 8.669 1.00 1.00 H new ATOM 747 N TYR A 53 -8.739 8.351 11.626 1.00 1.00 N ATOM 748 CA TYR A 53 -9.748 7.568 10.901 1.00 1.00 C ATOM 749 C TYR A 53 -11.004 8.365 10.509 1.00 1.00 C ATOM 750 O TYR A 53 -11.724 7.928 9.615 1.00 1.00 O ATOM 751 CB TYR A 53 -10.093 6.280 11.670 1.00 1.00 C ATOM 752 CG TYR A 53 -8.969 5.252 11.698 1.00 1.00 C ATOM 753 CD1 TYR A 53 -8.440 4.756 10.491 1.00 1.00 C ATOM 754 CD2 TYR A 53 -8.452 4.782 12.920 1.00 1.00 C ATOM 755 CE1 TYR A 53 -7.371 3.840 10.502 1.00 1.00 C ATOM 756 CE2 TYR A 53 -7.389 3.858 12.940 1.00 1.00 C ATOM 757 CZ TYR A 53 -6.842 3.390 11.729 1.00 1.00 C ATOM 758 OH TYR A 53 -5.816 2.502 11.745 1.00 1.00 O ATOM 0 H TYR A 53 -8.579 8.031 12.581 1.00 1.00 H new ATOM 0 HA TYR A 53 -9.293 7.292 9.950 1.00 1.00 H new ATOM 0 HB2 TYR A 53 -10.357 6.541 12.695 1.00 1.00 H new ATOM 0 HB3 TYR A 53 -10.975 5.826 11.219 1.00 1.00 H new ATOM 0 HD1 TYR A 53 -8.858 5.081 9.549 1.00 1.00 H new ATOM 0 HD2 TYR A 53 -8.874 5.133 13.850 1.00 1.00 H new ATOM 0 HE1 TYR A 53 -6.956 3.482 9.571 1.00 1.00 H new ATOM 0 HE2 TYR A 53 -6.994 3.509 13.882 1.00 1.00 H new ATOM 0 HH TYR A 53 -5.724 2.124 12.645 1.00 1.00 H new ATOM 768 N GLN A 54 -11.265 9.526 11.127 1.00 1.00 N ATOM 769 CA GLN A 54 -12.406 10.410 10.817 1.00 1.00 C ATOM 770 C GLN A 54 -11.996 11.682 10.034 1.00 1.00 C ATOM 771 O GLN A 54 -12.858 12.487 9.675 1.00 1.00 O ATOM 772 CB GLN A 54 -13.154 10.771 12.115 1.00 1.00 C ATOM 773 CG GLN A 54 -13.792 9.539 12.781 1.00 1.00 C ATOM 774 CD GLN A 54 -14.516 9.878 14.081 1.00 1.00 C ATOM 775 OE1 GLN A 54 -15.738 9.870 14.179 1.00 1.00 O ATOM 776 NE2 GLN A 54 -13.787 10.173 15.134 1.00 1.00 N ATOM 0 H GLN A 54 -10.675 9.889 11.876 1.00 1.00 H new ATOM 0 HA GLN A 54 -13.074 9.858 10.156 1.00 1.00 H new ATOM 0 HB2 GLN A 54 -12.461 11.241 12.813 1.00 1.00 H new ATOM 0 HB3 GLN A 54 -13.929 11.504 11.893 1.00 1.00 H new ATOM 0 HG2 GLN A 54 -14.496 9.081 12.087 1.00 1.00 H new ATOM 0 HG3 GLN A 54 -13.017 8.799 12.984 1.00 1.00 H new ATOM 0 HE21 GLN A 54 -12.769 10.183 15.063 1.00 1.00 H new ATOM 0 HE22 GLN A 54 -14.239 10.392 16.022 1.00 1.00 H new ATOM 785 N SER A 55 -10.702 11.891 9.766 1.00 1.00 N ATOM 786 CA SER A 55 -10.179 13.057 9.033 1.00 1.00 C ATOM 787 C SER A 55 -10.476 13.026 7.526 1.00 1.00 C ATOM 788 O SER A 55 -10.356 11.991 6.864 1.00 1.00 O ATOM 789 CB SER A 55 -8.659 13.143 9.227 1.00 1.00 C ATOM 790 OG SER A 55 -8.124 14.222 8.472 1.00 1.00 O ATOM 0 H SER A 55 -9.971 11.242 10.058 1.00 1.00 H new ATOM 0 HA SER A 55 -10.689 13.928 9.445 1.00 1.00 H new ATOM 0 HB2 SER A 55 -8.428 13.280 10.283 1.00 1.00 H new ATOM 0 HB3 SER A 55 -8.193 12.208 8.917 1.00 1.00 H new ATOM 0 HG SER A 55 -7.154 14.266 8.606 1.00 1.00 H new ATOM 796 N ARG A 56 -10.779 14.194 6.940 1.00 1.00 N ATOM 797 CA ARG A 56 -10.970 14.356 5.484 1.00 1.00 C ATOM 798 C ARG A 56 -9.681 14.065 4.697 1.00 1.00 C ATOM 799 O ARG A 56 -9.748 13.605 3.556 1.00 1.00 O ATOM 800 CB ARG A 56 -11.517 15.769 5.177 1.00 1.00 C ATOM 801 CG ARG A 56 -12.860 15.754 4.429 1.00 1.00 C ATOM 802 CD ARG A 56 -12.762 15.161 3.017 1.00 1.00 C ATOM 803 NE ARG A 56 -14.056 15.245 2.312 1.00 1.00 N ATOM 804 CZ ARG A 56 -14.334 14.772 1.110 1.00 1.00 C ATOM 805 NH1 ARG A 56 -13.450 14.132 0.396 1.00 1.00 N ATOM 806 NH2 ARG A 56 -15.518 14.936 0.595 1.00 1.00 N ATOM 0 H ARG A 56 -10.900 15.061 7.464 1.00 1.00 H new ATOM 0 HA ARG A 56 -11.704 13.620 5.155 1.00 1.00 H new ATOM 0 HB2 ARG A 56 -11.637 16.315 6.112 1.00 1.00 H new ATOM 0 HB3 ARG A 56 -10.784 16.313 4.582 1.00 1.00 H new ATOM 0 HG2 ARG A 56 -13.584 15.180 5.007 1.00 1.00 H new ATOM 0 HG3 ARG A 56 -13.242 16.773 4.362 1.00 1.00 H new ATOM 0 HD2 ARG A 56 -12.000 15.693 2.448 1.00 1.00 H new ATOM 0 HD3 ARG A 56 -12.445 14.120 3.078 1.00 1.00 H new ATOM 0 HE ARG A 56 -14.815 15.717 2.804 1.00 1.00 H new ATOM 0 HH11 ARG A 56 -12.510 13.983 0.762 1.00 1.00 H new ATOM 0 HH12 ARG A 56 -13.699 13.780 -0.528 1.00 1.00 H new ATOM 0 HH21 ARG A 56 -16.238 15.432 1.120 1.00 1.00 H new ATOM 0 HH22 ARG A 56 -15.726 14.568 -0.333 1.00 1.00 H new ATOM 820 N LYS A 57 -8.509 14.276 5.314 1.00 1.00 N ATOM 821 CA LYS A 57 -7.184 13.983 4.727 1.00 1.00 C ATOM 822 C LYS A 57 -6.960 12.471 4.589 1.00 1.00 C ATOM 823 O LYS A 57 -6.376 12.023 3.602 1.00 1.00 O ATOM 824 CB LYS A 57 -6.069 14.638 5.571 1.00 1.00 C ATOM 825 CG LYS A 57 -6.247 16.150 5.827 1.00 1.00 C ATOM 826 CD LYS A 57 -6.399 17.024 4.569 1.00 1.00 C ATOM 827 CE LYS A 57 -5.195 16.988 3.614 1.00 1.00 C ATOM 828 NZ LYS A 57 -3.992 17.646 4.192 1.00 1.00 N ATOM 0 H LYS A 57 -8.450 14.663 6.256 1.00 1.00 H new ATOM 0 HA LYS A 57 -7.151 14.409 3.724 1.00 1.00 H new ATOM 0 HB2 LYS A 57 -6.013 14.126 6.532 1.00 1.00 H new ATOM 0 HB3 LYS A 57 -5.114 14.480 5.070 1.00 1.00 H new ATOM 0 HG2 LYS A 57 -7.126 16.293 6.455 1.00 1.00 H new ATOM 0 HG3 LYS A 57 -5.388 16.508 6.395 1.00 1.00 H new ATOM 0 HD2 LYS A 57 -7.287 16.703 4.025 1.00 1.00 H new ATOM 0 HD3 LYS A 57 -6.570 18.055 4.878 1.00 1.00 H new ATOM 0 HE2 LYS A 57 -4.958 15.952 3.372 1.00 1.00 H new ATOM 0 HE3 LYS A 57 -5.461 17.481 2.679 1.00 1.00 H new ATOM 0 HZ1 LYS A 57 -3.208 17.596 3.511 1.00 1.00 H new ATOM 0 HZ2 LYS A 57 -4.207 18.642 4.399 1.00 1.00 H new ATOM 0 HZ3 LYS A 57 -3.719 17.161 5.070 1.00 1.00 H new ATOM 842 N HIS A 58 -7.465 11.688 5.548 1.00 1.00 N ATOM 843 CA HIS A 58 -7.465 10.217 5.512 1.00 1.00 C ATOM 844 C HIS A 58 -8.449 9.725 4.443 1.00 1.00 C ATOM 845 O HIS A 58 -8.116 8.822 3.679 1.00 1.00 O ATOM 846 CB HIS A 58 -7.804 9.676 6.913 1.00 1.00 C ATOM 847 CG HIS A 58 -8.120 8.199 6.996 1.00 1.00 C ATOM 848 ND1 HIS A 58 -7.195 7.163 7.154 1.00 1.00 N ATOM 849 CD2 HIS A 58 -9.375 7.664 6.972 1.00 1.00 C ATOM 850 CE1 HIS A 58 -7.913 6.030 7.202 1.00 1.00 C ATOM 851 NE2 HIS A 58 -9.226 6.302 7.109 1.00 1.00 N ATOM 0 H HIS A 58 -7.896 12.066 6.392 1.00 1.00 H new ATOM 0 HA HIS A 58 -6.478 9.842 5.240 1.00 1.00 H new ATOM 0 HB2 HIS A 58 -6.963 9.885 7.574 1.00 1.00 H new ATOM 0 HB3 HIS A 58 -8.659 10.232 7.298 1.00 1.00 H new ATOM 0 HD2 HIS A 58 -10.304 8.204 6.866 1.00 1.00 H new ATOM 0 HE1 HIS A 58 -7.495 5.039 7.301 1.00 1.00 H new ATOM 0 HE2 HIS A 58 -9.982 5.617 7.135 1.00 1.00 H new ATOM 859 N ALA A 59 -9.626 10.356 4.322 1.00 1.00 N ATOM 860 CA ALA A 59 -10.640 9.993 3.327 1.00 1.00 C ATOM 861 C ALA A 59 -10.112 10.052 1.884 1.00 1.00 C ATOM 862 O ALA A 59 -10.302 9.104 1.129 1.00 1.00 O ATOM 863 CB ALA A 59 -11.856 10.914 3.474 1.00 1.00 C ATOM 0 H ALA A 59 -9.901 11.138 4.917 1.00 1.00 H new ATOM 0 HA ALA A 59 -10.922 8.958 3.518 1.00 1.00 H new ATOM 0 HB1 ALA A 59 -12.609 10.643 2.734 1.00 1.00 H new ATOM 0 HB2 ALA A 59 -12.275 10.806 4.474 1.00 1.00 H new ATOM 0 HB3 ALA A 59 -11.550 11.948 3.318 1.00 1.00 H new ATOM 869 N ASN A 60 -9.417 11.128 1.488 1.00 1.00 N ATOM 870 CA ASN A 60 -8.858 11.247 0.133 1.00 1.00 C ATOM 871 C ASN A 60 -7.805 10.160 -0.172 1.00 1.00 C ATOM 872 O ASN A 60 -7.719 9.696 -1.308 1.00 1.00 O ATOM 873 CB ASN A 60 -8.298 12.669 -0.045 1.00 1.00 C ATOM 874 CG ASN A 60 -7.895 12.943 -1.487 1.00 1.00 C ATOM 875 OD1 ASN A 60 -6.800 12.625 -1.926 1.00 1.00 O ATOM 876 ND2 ASN A 60 -8.767 13.525 -2.277 1.00 1.00 N ATOM 0 H ASN A 60 -9.228 11.931 2.088 1.00 1.00 H new ATOM 0 HA ASN A 60 -9.653 11.081 -0.593 1.00 1.00 H new ATOM 0 HB2 ASN A 60 -9.048 13.396 0.267 1.00 1.00 H new ATOM 0 HB3 ASN A 60 -7.434 12.803 0.605 1.00 1.00 H new ATOM 0 HD21 ASN A 60 -8.529 13.709 -3.252 1.00 1.00 H new ATOM 0 HD22 ASN A 60 -9.683 13.793 -1.916 1.00 1.00 H new ATOM 883 N LYS A 61 -7.044 9.705 0.834 1.00 1.00 N ATOM 884 CA LYS A 61 -6.103 8.578 0.689 1.00 1.00 C ATOM 885 C LYS A 61 -6.850 7.238 0.625 1.00 1.00 C ATOM 886 O LYS A 61 -6.518 6.399 -0.212 1.00 1.00 O ATOM 887 CB LYS A 61 -5.012 8.648 1.769 1.00 1.00 C ATOM 888 CG LYS A 61 -3.994 9.734 1.374 1.00 1.00 C ATOM 889 CD LYS A 61 -2.801 9.843 2.334 1.00 1.00 C ATOM 890 CE LYS A 61 -3.116 10.530 3.671 1.00 1.00 C ATOM 891 NZ LYS A 61 -3.477 11.962 3.503 1.00 1.00 N ATOM 0 H LYS A 61 -7.061 10.106 1.772 1.00 1.00 H new ATOM 0 HA LYS A 61 -5.582 8.657 -0.265 1.00 1.00 H new ATOM 0 HB2 LYS A 61 -5.454 8.879 2.738 1.00 1.00 H new ATOM 0 HB3 LYS A 61 -4.515 7.683 1.867 1.00 1.00 H new ATOM 0 HG2 LYS A 61 -3.623 9.524 0.371 1.00 1.00 H new ATOM 0 HG3 LYS A 61 -4.503 10.697 1.330 1.00 1.00 H new ATOM 0 HD2 LYS A 61 -2.421 8.841 2.536 1.00 1.00 H new ATOM 0 HD3 LYS A 61 -2.001 10.393 1.838 1.00 1.00 H new ATOM 0 HE2 LYS A 61 -3.937 10.006 4.160 1.00 1.00 H new ATOM 0 HE3 LYS A 61 -2.251 10.451 4.329 1.00 1.00 H new ATOM 0 HZ1 LYS A 61 -3.060 12.518 4.277 1.00 1.00 H new ATOM 0 HZ2 LYS A 61 -3.112 12.307 2.592 1.00 1.00 H new ATOM 0 HZ3 LYS A 61 -4.512 12.064 3.522 1.00 1.00 H new ATOM 905 N VAL A 62 -7.914 7.059 1.414 1.00 1.00 N ATOM 906 CA VAL A 62 -8.804 5.882 1.332 1.00 1.00 C ATOM 907 C VAL A 62 -9.481 5.812 -0.040 1.00 1.00 C ATOM 908 O VAL A 62 -9.613 4.719 -0.585 1.00 1.00 O ATOM 909 CB VAL A 62 -9.833 5.866 2.482 1.00 1.00 C ATOM 910 CG1 VAL A 62 -10.950 4.828 2.298 1.00 1.00 C ATOM 911 CG2 VAL A 62 -9.116 5.525 3.790 1.00 1.00 C ATOM 0 H VAL A 62 -8.189 7.727 2.134 1.00 1.00 H new ATOM 0 HA VAL A 62 -8.192 4.987 1.447 1.00 1.00 H new ATOM 0 HB VAL A 62 -10.288 6.856 2.493 1.00 1.00 H new ATOM 0 HG11 VAL A 62 -11.634 4.876 3.145 1.00 1.00 H new ATOM 0 HG12 VAL A 62 -11.495 5.040 1.378 1.00 1.00 H new ATOM 0 HG13 VAL A 62 -10.514 3.831 2.240 1.00 1.00 H new ATOM 0 HG21 VAL A 62 -9.837 5.512 4.607 1.00 1.00 H new ATOM 0 HG22 VAL A 62 -8.648 4.545 3.703 1.00 1.00 H new ATOM 0 HG23 VAL A 62 -8.352 6.275 3.992 1.00 1.00 H new ATOM 921 N ARG A 63 -9.850 6.947 -0.654 1.00 1.00 N ATOM 922 CA ARG A 63 -10.428 6.993 -2.012 1.00 1.00 C ATOM 923 C ARG A 63 -9.503 6.341 -3.042 1.00 1.00 C ATOM 924 O ARG A 63 -9.998 5.646 -3.924 1.00 1.00 O ATOM 925 CB ARG A 63 -10.741 8.439 -2.433 1.00 1.00 C ATOM 926 CG ARG A 63 -11.908 9.087 -1.671 1.00 1.00 C ATOM 927 CD ARG A 63 -13.239 8.998 -2.421 1.00 1.00 C ATOM 928 NE ARG A 63 -13.817 7.640 -2.391 1.00 1.00 N ATOM 929 CZ ARG A 63 -13.955 6.762 -3.366 1.00 1.00 C ATOM 930 NH1 ARG A 63 -13.509 6.928 -4.576 1.00 1.00 N ATOM 931 NH2 ARG A 63 -14.576 5.654 -3.120 1.00 1.00 N ATOM 0 H ARG A 63 -9.756 7.866 -0.222 1.00 1.00 H new ATOM 0 HA ARG A 63 -11.358 6.426 -1.980 1.00 1.00 H new ATOM 0 HB2 ARG A 63 -9.848 9.047 -2.289 1.00 1.00 H new ATOM 0 HB3 ARG A 63 -10.968 8.452 -3.499 1.00 1.00 H new ATOM 0 HG2 ARG A 63 -12.012 8.604 -0.700 1.00 1.00 H new ATOM 0 HG3 ARG A 63 -11.674 10.135 -1.482 1.00 1.00 H new ATOM 0 HD2 ARG A 63 -13.947 9.700 -1.981 1.00 1.00 H new ATOM 0 HD3 ARG A 63 -13.089 9.303 -3.457 1.00 1.00 H new ATOM 0 HE ARG A 63 -14.161 7.335 -1.481 1.00 1.00 H new ATOM 0 HH11 ARG A 63 -13.013 7.784 -4.824 1.00 1.00 H new ATOM 0 HH12 ARG A 63 -13.655 6.202 -5.277 1.00 1.00 H new ATOM 0 HH21 ARG A 63 -14.947 5.474 -2.187 1.00 1.00 H new ATOM 0 HH22 ARG A 63 -14.694 4.961 -3.859 1.00 1.00 H new ATOM 945 N ARG A 64 -8.176 6.500 -2.909 1.00 1.00 N ATOM 946 CA ARG A 64 -7.181 5.852 -3.792 1.00 1.00 C ATOM 947 C ARG A 64 -7.256 4.329 -3.656 1.00 1.00 C ATOM 948 O ARG A 64 -7.361 3.620 -4.655 1.00 1.00 O ATOM 949 CB ARG A 64 -5.748 6.329 -3.485 1.00 1.00 C ATOM 950 CG ARG A 64 -5.563 7.841 -3.312 1.00 1.00 C ATOM 951 CD ARG A 64 -6.109 8.697 -4.456 1.00 1.00 C ATOM 952 NE ARG A 64 -5.981 10.128 -4.113 1.00 1.00 N ATOM 953 CZ ARG A 64 -5.196 11.032 -4.673 1.00 1.00 C ATOM 954 NH1 ARG A 64 -4.447 10.772 -5.709 1.00 1.00 N ATOM 955 NH2 ARG A 64 -5.147 12.236 -4.185 1.00 1.00 N ATOM 0 H ARG A 64 -7.757 7.083 -2.184 1.00 1.00 H new ATOM 0 HA ARG A 64 -7.422 6.138 -4.816 1.00 1.00 H new ATOM 0 HB2 ARG A 64 -5.410 5.836 -2.574 1.00 1.00 H new ATOM 0 HB3 ARG A 64 -5.095 5.993 -4.290 1.00 1.00 H new ATOM 0 HG2 ARG A 64 -6.049 8.147 -2.386 1.00 1.00 H new ATOM 0 HG3 ARG A 64 -4.499 8.050 -3.198 1.00 1.00 H new ATOM 0 HD2 ARG A 64 -5.563 8.483 -5.375 1.00 1.00 H new ATOM 0 HD3 ARG A 64 -7.154 8.450 -4.641 1.00 1.00 H new ATOM 0 HE ARG A 64 -6.571 10.459 -3.350 1.00 1.00 H new ATOM 0 HH11 ARG A 64 -4.452 9.839 -6.120 1.00 1.00 H new ATOM 0 HH12 ARG A 64 -3.857 11.502 -6.108 1.00 1.00 H new ATOM 0 HH21 ARG A 64 -5.713 12.480 -3.373 1.00 1.00 H new ATOM 0 HH22 ARG A 64 -4.542 12.936 -4.615 1.00 1.00 H new ATOM 969 N TYR A 65 -7.252 3.838 -2.414 1.00 1.00 N ATOM 970 CA TYR A 65 -7.375 2.413 -2.085 1.00 1.00 C ATOM 971 C TYR A 65 -8.717 1.826 -2.572 1.00 1.00 C ATOM 972 O TYR A 65 -8.745 0.745 -3.160 1.00 1.00 O ATOM 973 CB TYR A 65 -7.168 2.236 -0.572 1.00 1.00 C ATOM 974 CG TYR A 65 -7.435 0.835 -0.054 1.00 1.00 C ATOM 975 CD1 TYR A 65 -6.615 -0.238 -0.454 1.00 1.00 C ATOM 976 CD2 TYR A 65 -8.519 0.605 0.816 1.00 1.00 C ATOM 977 CE1 TYR A 65 -6.892 -1.544 -0.001 1.00 1.00 C ATOM 978 CE2 TYR A 65 -8.803 -0.699 1.264 1.00 1.00 C ATOM 979 CZ TYR A 65 -7.995 -1.780 0.848 1.00 1.00 C ATOM 980 OH TYR A 65 -8.269 -3.045 1.271 1.00 1.00 O ATOM 0 H TYR A 65 -7.161 4.432 -1.590 1.00 1.00 H new ATOM 0 HA TYR A 65 -6.604 1.850 -2.611 1.00 1.00 H new ATOM 0 HB2 TYR A 65 -6.142 2.510 -0.325 1.00 1.00 H new ATOM 0 HB3 TYR A 65 -7.820 2.933 -0.046 1.00 1.00 H new ATOM 0 HD1 TYR A 65 -5.774 -0.060 -1.108 1.00 1.00 H new ATOM 0 HD2 TYR A 65 -9.134 1.432 1.140 1.00 1.00 H new ATOM 0 HE1 TYR A 65 -6.259 -2.365 -0.304 1.00 1.00 H new ATOM 0 HE2 TYR A 65 -9.639 -0.873 1.926 1.00 1.00 H new ATOM 0 HH TYR A 65 -9.060 -3.032 1.849 1.00 1.00 H new ATOM 990 N MET A 66 -9.826 2.555 -2.389 1.00 1.00 N ATOM 991 CA MET A 66 -11.160 2.163 -2.861 1.00 1.00 C ATOM 992 C MET A 66 -11.232 2.108 -4.394 1.00 1.00 C ATOM 993 O MET A 66 -11.715 1.118 -4.941 1.00 1.00 O ATOM 994 CB MET A 66 -12.223 3.142 -2.331 1.00 1.00 C ATOM 995 CG MET A 66 -12.484 3.036 -0.823 1.00 1.00 C ATOM 996 SD MET A 66 -13.339 1.525 -0.291 1.00 1.00 S ATOM 997 CE MET A 66 -11.963 0.613 0.457 1.00 1.00 C ATOM 0 H MET A 66 -9.821 3.450 -1.900 1.00 1.00 H new ATOM 0 HA MET A 66 -11.357 1.162 -2.477 1.00 1.00 H new ATOM 0 HB2 MET A 66 -11.910 4.160 -2.563 1.00 1.00 H new ATOM 0 HB3 MET A 66 -13.158 2.967 -2.863 1.00 1.00 H new ATOM 0 HG2 MET A 66 -11.530 3.098 -0.300 1.00 1.00 H new ATOM 0 HG3 MET A 66 -13.075 3.897 -0.511 1.00 1.00 H new ATOM 0 HE1 MET A 66 -12.349 -0.256 0.989 1.00 1.00 H new ATOM 0 HE2 MET A 66 -11.277 0.285 -0.324 1.00 1.00 H new ATOM 0 HE3 MET A 66 -11.435 1.261 1.156 1.00 1.00 H new ATOM 1007 N ALA A 67 -10.740 3.132 -5.101 1.00 1.00 N ATOM 1008 CA ALA A 67 -10.756 3.223 -6.567 1.00 1.00 C ATOM 1009 C ALA A 67 -10.123 2.013 -7.289 1.00 1.00 C ATOM 1010 O ALA A 67 -10.541 1.667 -8.395 1.00 1.00 O ATOM 1011 CB ALA A 67 -10.078 4.534 -6.986 1.00 1.00 C ATOM 0 H ALA A 67 -10.308 3.943 -4.658 1.00 1.00 H new ATOM 0 HA ALA A 67 -11.800 3.212 -6.879 1.00 1.00 H new ATOM 0 HB1 ALA A 67 -10.083 4.615 -8.073 1.00 1.00 H new ATOM 0 HB2 ALA A 67 -10.620 5.377 -6.557 1.00 1.00 H new ATOM 0 HB3 ALA A 67 -9.049 4.543 -6.626 1.00 1.00 H new ATOM 1017 N ILE A 68 -9.151 1.345 -6.656 1.00 1.00 N ATOM 1018 CA ILE A 68 -8.477 0.139 -7.174 1.00 1.00 C ATOM 1019 C ILE A 68 -9.438 -1.073 -7.257 1.00 1.00 C ATOM 1020 O ILE A 68 -9.192 -1.998 -8.034 1.00 1.00 O ATOM 1021 CB ILE A 68 -7.201 -0.121 -6.328 1.00 1.00 C ATOM 1022 CG1 ILE A 68 -6.177 1.018 -6.579 1.00 1.00 C ATOM 1023 CG2 ILE A 68 -6.532 -1.477 -6.619 1.00 1.00 C ATOM 1024 CD1 ILE A 68 -5.070 1.125 -5.523 1.00 1.00 C ATOM 0 H ILE A 68 -8.799 1.633 -5.743 1.00 1.00 H new ATOM 0 HA ILE A 68 -8.164 0.301 -8.205 1.00 1.00 H new ATOM 0 HB ILE A 68 -7.518 -0.145 -5.285 1.00 1.00 H new ATOM 0 HG12 ILE A 68 -5.716 0.866 -7.555 1.00 1.00 H new ATOM 0 HG13 ILE A 68 -6.712 1.967 -6.623 1.00 1.00 H new ATOM 0 HG21 ILE A 68 -5.648 -1.589 -5.991 1.00 1.00 H new ATOM 0 HG22 ILE A 68 -7.234 -2.283 -6.404 1.00 1.00 H new ATOM 0 HG23 ILE A 68 -6.240 -1.521 -7.668 1.00 1.00 H new ATOM 0 HD11 ILE A 68 -4.401 1.947 -5.779 1.00 1.00 H new ATOM 0 HD12 ILE A 68 -5.516 1.311 -4.546 1.00 1.00 H new ATOM 0 HD13 ILE A 68 -4.505 0.193 -5.493 1.00 1.00 H new ATOM 1036 N ASN A 69 -10.555 -1.066 -6.512 1.00 1.00 N ATOM 1037 CA ASN A 69 -11.573 -2.134 -6.495 1.00 1.00 C ATOM 1038 C ASN A 69 -13.008 -1.635 -6.820 1.00 1.00 C ATOM 1039 O ASN A 69 -13.915 -2.447 -7.020 1.00 1.00 O ATOM 1040 CB ASN A 69 -11.489 -2.843 -5.124 1.00 1.00 C ATOM 1041 CG ASN A 69 -11.817 -4.331 -5.166 1.00 1.00 C ATOM 1042 OD1 ASN A 69 -11.024 -5.173 -4.767 1.00 1.00 O ATOM 1043 ND2 ASN A 69 -12.973 -4.723 -5.653 1.00 1.00 N ATOM 0 H ASN A 69 -10.783 -0.294 -5.885 1.00 1.00 H new ATOM 0 HA ASN A 69 -11.357 -2.840 -7.297 1.00 1.00 H new ATOM 0 HB2 ASN A 69 -10.483 -2.716 -4.723 1.00 1.00 H new ATOM 0 HB3 ASN A 69 -12.172 -2.352 -4.432 1.00 1.00 H new ATOM 0 HD21 ASN A 69 -13.198 -5.717 -5.694 1.00 1.00 H new ATOM 0 HD22 ASN A 69 -13.645 -4.033 -5.990 1.00 1.00 H new ATOM 1050 N GLN A 70 -13.237 -0.318 -6.873 1.00 1.00 N ATOM 1051 CA GLN A 70 -14.525 0.318 -7.183 1.00 1.00 C ATOM 1052 C GLN A 70 -14.995 -0.007 -8.620 1.00 1.00 C ATOM 1053 O GLN A 70 -14.178 -0.146 -9.537 1.00 1.00 O ATOM 1054 CB GLN A 70 -14.366 1.835 -6.955 1.00 1.00 C ATOM 1055 CG GLN A 70 -15.680 2.631 -6.979 1.00 1.00 C ATOM 1056 CD GLN A 70 -15.478 4.111 -6.637 1.00 1.00 C ATOM 1057 OE1 GLN A 70 -14.710 4.494 -5.759 1.00 1.00 O ATOM 1058 NE2 GLN A 70 -16.161 5.012 -7.311 1.00 1.00 N ATOM 0 H GLN A 70 -12.500 0.364 -6.694 1.00 1.00 H new ATOM 0 HA GLN A 70 -15.302 -0.074 -6.527 1.00 1.00 H new ATOM 0 HB2 GLN A 70 -13.878 1.995 -5.993 1.00 1.00 H new ATOM 0 HB3 GLN A 70 -13.701 2.235 -7.720 1.00 1.00 H new ATOM 0 HG2 GLN A 70 -16.133 2.549 -7.967 1.00 1.00 H new ATOM 0 HG3 GLN A 70 -16.381 2.190 -6.270 1.00 1.00 H new ATOM 0 HE21 GLN A 70 -16.805 4.719 -8.045 1.00 1.00 H new ATOM 0 HE22 GLN A 70 -16.046 6.003 -7.099 1.00 1.00 H new ATOM 1067 N GLY A 71 -16.312 -0.116 -8.829 1.00 1.00 N ATOM 1068 CA GLY A 71 -16.913 -0.430 -10.133 1.00 1.00 C ATOM 1069 C GLY A 71 -18.447 -0.414 -10.139 1.00 1.00 C ATOM 1070 O GLY A 71 -19.088 0.028 -9.183 1.00 1.00 O ATOM 0 H GLY A 71 -17.001 0.013 -8.088 1.00 1.00 H new ATOM 0 HA2 GLY A 71 -16.551 0.287 -10.870 1.00 1.00 H new ATOM 0 HA3 GLY A 71 -16.570 -1.415 -10.451 1.00 1.00 H new ATOM 1074 N GLU A 72 -19.036 -0.907 -11.231 1.00 1.00 N ATOM 1075 CA GLU A 72 -20.486 -1.000 -11.467 1.00 1.00 C ATOM 1076 C GLU A 72 -20.858 -2.271 -12.266 1.00 1.00 C ATOM 1077 O GLU A 72 -19.982 -3.014 -12.719 1.00 1.00 O ATOM 1078 CB GLU A 72 -20.985 0.284 -12.162 1.00 1.00 C ATOM 1079 CG GLU A 72 -20.418 0.503 -13.573 1.00 1.00 C ATOM 1080 CD GLU A 72 -20.921 1.831 -14.169 1.00 1.00 C ATOM 1081 OE1 GLU A 72 -21.998 1.844 -14.818 1.00 1.00 O ATOM 1082 OE2 GLU A 72 -20.243 2.875 -14.005 1.00 1.00 O ATOM 0 H GLU A 72 -18.493 -1.270 -12.014 1.00 1.00 H new ATOM 0 HA GLU A 72 -20.989 -1.088 -10.504 1.00 1.00 H new ATOM 0 HB2 GLU A 72 -22.073 0.251 -12.222 1.00 1.00 H new ATOM 0 HB3 GLU A 72 -20.726 1.142 -11.542 1.00 1.00 H new ATOM 0 HG2 GLU A 72 -19.329 0.507 -13.535 1.00 1.00 H new ATOM 0 HG3 GLU A 72 -20.711 -0.324 -14.219 1.00 1.00 H new ATOM 1089 N ASP A 73 -22.158 -2.530 -12.442 1.00 1.00 N ATOM 1090 CA ASP A 73 -22.697 -3.703 -13.155 1.00 1.00 C ATOM 1091 C ASP A 73 -24.006 -3.380 -13.916 1.00 1.00 C ATOM 1092 O ASP A 73 -24.638 -2.346 -13.677 1.00 1.00 O ATOM 1093 CB ASP A 73 -22.902 -4.832 -12.124 1.00 1.00 C ATOM 1094 CG ASP A 73 -23.216 -6.201 -12.753 1.00 1.00 C ATOM 1095 OD1 ASP A 73 -22.686 -6.508 -13.848 1.00 1.00 O ATOM 1096 OD2 ASP A 73 -23.983 -6.983 -12.138 1.00 1.00 O ATOM 0 H ASP A 73 -22.888 -1.915 -12.084 1.00 1.00 H new ATOM 0 HA ASP A 73 -21.987 -4.018 -13.920 1.00 1.00 H new ATOM 0 HB2 ASP A 73 -22.003 -4.921 -11.514 1.00 1.00 H new ATOM 0 HB3 ASP A 73 -23.716 -4.556 -11.454 1.00 1.00 H new ATOM 1101 N SER A 74 -24.421 -4.265 -14.829 1.00 1.00 N ATOM 1102 CA SER A 74 -25.633 -4.138 -15.662 1.00 1.00 C ATOM 1103 C SER A 74 -26.243 -5.511 -16.014 1.00 1.00 C ATOM 1104 O SER A 74 -25.695 -6.557 -15.652 1.00 1.00 O ATOM 1105 CB SER A 74 -25.287 -3.344 -16.931 1.00 1.00 C ATOM 1106 OG SER A 74 -26.465 -2.900 -17.588 1.00 1.00 O ATOM 0 H SER A 74 -23.905 -5.124 -15.019 1.00 1.00 H new ATOM 0 HA SER A 74 -26.392 -3.603 -15.091 1.00 1.00 H new ATOM 0 HB2 SER A 74 -24.666 -2.487 -16.670 1.00 1.00 H new ATOM 0 HB3 SER A 74 -24.702 -3.968 -17.607 1.00 1.00 H new ATOM 0 HG SER A 74 -26.221 -2.396 -18.392 1.00 1.00 H new ATOM 1112 N VAL A 75 -27.378 -5.529 -16.721 1.00 1.00 N ATOM 1113 CA VAL A 75 -28.111 -6.744 -17.132 1.00 1.00 C ATOM 1114 C VAL A 75 -28.787 -6.558 -18.508 1.00 1.00 C ATOM 1115 O VAL A 75 -29.435 -5.529 -18.729 1.00 1.00 O ATOM 1116 CB VAL A 75 -29.124 -7.141 -16.027 1.00 1.00 C ATOM 1117 CG1 VAL A 75 -30.195 -6.080 -15.727 1.00 1.00 C ATOM 1118 CG2 VAL A 75 -29.829 -8.470 -16.321 1.00 1.00 C ATOM 0 H VAL A 75 -27.832 -4.672 -17.036 1.00 1.00 H new ATOM 0 HA VAL A 75 -27.402 -7.563 -17.251 1.00 1.00 H new ATOM 0 HB VAL A 75 -28.496 -7.240 -15.142 1.00 1.00 H new ATOM 0 HG11 VAL A 75 -30.858 -6.444 -14.942 1.00 1.00 H new ATOM 0 HG12 VAL A 75 -29.713 -5.160 -15.397 1.00 1.00 H new ATOM 0 HG13 VAL A 75 -30.774 -5.883 -16.629 1.00 1.00 H new ATOM 0 HG21 VAL A 75 -30.526 -8.698 -15.515 1.00 1.00 H new ATOM 0 HG22 VAL A 75 -30.375 -8.392 -17.261 1.00 1.00 H new ATOM 0 HG23 VAL A 75 -29.088 -9.266 -16.396 1.00 1.00 H new ATOM 1128 N PRO A 76 -28.671 -7.518 -19.454 1.00 1.00 N ATOM 1129 CA PRO A 76 -29.273 -7.452 -20.796 1.00 1.00 C ATOM 1130 C PRO A 76 -30.787 -7.776 -20.785 1.00 1.00 C ATOM 1131 O PRO A 76 -31.265 -8.646 -21.518 1.00 1.00 O ATOM 1132 CB PRO A 76 -28.436 -8.430 -21.633 1.00 1.00 C ATOM 1133 CG PRO A 76 -28.117 -9.535 -20.631 1.00 1.00 C ATOM 1134 CD PRO A 76 -27.906 -8.758 -19.333 1.00 1.00 C ATOM 0 HA PRO A 76 -29.246 -6.447 -21.217 1.00 1.00 H new ATOM 0 HB2 PRO A 76 -28.992 -8.808 -22.491 1.00 1.00 H new ATOM 0 HB3 PRO A 76 -27.532 -7.961 -22.021 1.00 1.00 H new ATOM 0 HG2 PRO A 76 -28.933 -10.253 -20.546 1.00 1.00 H new ATOM 0 HG3 PRO A 76 -27.227 -10.096 -20.916 1.00 1.00 H new ATOM 0 HD2 PRO A 76 -28.245 -9.339 -18.475 1.00 1.00 H new ATOM 0 HD3 PRO A 76 -26.848 -8.546 -19.177 1.00 1.00 H new ATOM 1142 N ALA A 77 -31.555 -7.096 -19.928 1.00 1.00 N ATOM 1143 CA ALA A 77 -33.004 -7.249 -19.737 1.00 1.00 C ATOM 1144 C ALA A 77 -33.844 -6.696 -20.919 1.00 1.00 C ATOM 1145 O ALA A 77 -34.615 -5.741 -20.769 1.00 1.00 O ATOM 1146 CB ALA A 77 -33.368 -6.618 -18.383 1.00 1.00 C ATOM 0 H ALA A 77 -31.162 -6.383 -19.313 1.00 1.00 H new ATOM 0 HA ALA A 77 -33.257 -8.309 -19.724 1.00 1.00 H new ATOM 0 HB1 ALA A 77 -34.440 -6.716 -18.212 1.00 1.00 H new ATOM 0 HB2 ALA A 77 -32.826 -7.128 -17.587 1.00 1.00 H new ATOM 0 HB3 ALA A 77 -33.097 -5.562 -18.389 1.00 1.00 H new ATOM 1152 N LYS A 78 -33.679 -7.288 -22.108 1.00 1.00 N ATOM 1153 CA LYS A 78 -34.335 -6.918 -23.379 1.00 1.00 C ATOM 1154 C LYS A 78 -35.168 -8.078 -23.953 1.00 1.00 C ATOM 1155 O LYS A 78 -34.996 -9.235 -23.560 1.00 1.00 O ATOM 1156 CB LYS A 78 -33.256 -6.478 -24.394 1.00 1.00 C ATOM 1157 CG LYS A 78 -32.356 -5.308 -23.947 1.00 1.00 C ATOM 1158 CD LYS A 78 -33.082 -3.983 -23.660 1.00 1.00 C ATOM 1159 CE LYS A 78 -33.770 -3.415 -24.909 1.00 1.00 C ATOM 1160 NZ LYS A 78 -34.390 -2.090 -24.635 1.00 1.00 N ATOM 0 H LYS A 78 -33.050 -8.083 -22.221 1.00 1.00 H new ATOM 0 HA LYS A 78 -35.023 -6.095 -23.185 1.00 1.00 H new ATOM 0 HB2 LYS A 78 -32.622 -7.336 -24.617 1.00 1.00 H new ATOM 0 HB3 LYS A 78 -33.751 -6.197 -25.324 1.00 1.00 H new ATOM 0 HG2 LYS A 78 -31.819 -5.609 -23.048 1.00 1.00 H new ATOM 0 HG3 LYS A 78 -31.609 -5.132 -24.721 1.00 1.00 H new ATOM 0 HD2 LYS A 78 -33.825 -4.140 -22.878 1.00 1.00 H new ATOM 0 HD3 LYS A 78 -32.367 -3.254 -23.278 1.00 1.00 H new ATOM 0 HE2 LYS A 78 -33.042 -3.318 -25.714 1.00 1.00 H new ATOM 0 HE3 LYS A 78 -34.535 -4.112 -25.253 1.00 1.00 H new ATOM 0 HZ1 LYS A 78 -34.846 -1.735 -25.499 1.00 1.00 H new ATOM 0 HZ2 LYS A 78 -35.102 -2.189 -23.883 1.00 1.00 H new ATOM 0 HZ3 LYS A 78 -33.656 -1.419 -24.330 1.00 1.00 H new ATOM 1174 N LYS A 79 -36.055 -7.759 -24.904 1.00 1.00 N ATOM 1175 CA LYS A 79 -36.944 -8.697 -25.621 1.00 1.00 C ATOM 1176 C LYS A 79 -36.896 -8.423 -27.131 1.00 1.00 C ATOM 1177 O LYS A 79 -36.679 -7.283 -27.545 1.00 1.00 O ATOM 1178 CB LYS A 79 -38.396 -8.600 -25.100 1.00 1.00 C ATOM 1179 CG LYS A 79 -38.600 -9.075 -23.647 1.00 1.00 C ATOM 1180 CD LYS A 79 -38.486 -7.988 -22.561 1.00 1.00 C ATOM 1181 CE LYS A 79 -39.626 -6.964 -22.649 1.00 1.00 C ATOM 1182 NZ LYS A 79 -39.564 -5.978 -21.538 1.00 1.00 N ATOM 0 H LYS A 79 -36.182 -6.795 -25.213 1.00 1.00 H new ATOM 0 HA LYS A 79 -36.589 -9.711 -25.434 1.00 1.00 H new ATOM 0 HB2 LYS A 79 -38.725 -7.564 -25.177 1.00 1.00 H new ATOM 0 HB3 LYS A 79 -39.040 -9.189 -25.753 1.00 1.00 H new ATOM 0 HG2 LYS A 79 -39.585 -9.535 -23.571 1.00 1.00 H new ATOM 0 HG3 LYS A 79 -37.867 -9.853 -23.433 1.00 1.00 H new ATOM 0 HD2 LYS A 79 -38.495 -8.457 -21.577 1.00 1.00 H new ATOM 0 HD3 LYS A 79 -37.530 -7.475 -22.661 1.00 1.00 H new ATOM 0 HE2 LYS A 79 -39.573 -6.441 -23.604 1.00 1.00 H new ATOM 0 HE3 LYS A 79 -40.584 -7.483 -22.623 1.00 1.00 H new ATOM 0 HZ1 LYS A 79 -40.349 -5.302 -21.630 1.00 1.00 H new ATOM 0 HZ2 LYS A 79 -39.640 -6.475 -20.628 1.00 1.00 H new ATOM 0 HZ3 LYS A 79 -38.660 -5.466 -21.578 1.00 1.00 H new ATOM 1196 N PHE A 80 -37.085 -9.470 -27.940 1.00 1.00 N ATOM 1197 CA PHE A 80 -36.974 -9.417 -29.412 1.00 1.00 C ATOM 1198 C PHE A 80 -38.099 -10.160 -30.171 1.00 1.00 C ATOM 1199 O PHE A 80 -37.970 -10.414 -31.373 1.00 1.00 O ATOM 1200 CB PHE A 80 -35.577 -9.944 -29.803 1.00 1.00 C ATOM 1201 CG PHE A 80 -34.418 -9.264 -29.088 1.00 1.00 C ATOM 1202 CD1 PHE A 80 -33.966 -8.002 -29.518 1.00 1.00 C ATOM 1203 CD2 PHE A 80 -33.818 -9.874 -27.968 1.00 1.00 C ATOM 1204 CE1 PHE A 80 -32.921 -7.354 -28.832 1.00 1.00 C ATOM 1205 CE2 PHE A 80 -32.776 -9.225 -27.280 1.00 1.00 C ATOM 1206 CZ PHE A 80 -32.327 -7.964 -27.713 1.00 1.00 C ATOM 0 H PHE A 80 -37.324 -10.398 -27.590 1.00 1.00 H new ATOM 0 HA PHE A 80 -37.099 -8.378 -29.718 1.00 1.00 H new ATOM 0 HB2 PHE A 80 -35.536 -11.014 -29.597 1.00 1.00 H new ATOM 0 HB3 PHE A 80 -35.445 -9.821 -30.878 1.00 1.00 H new ATOM 0 HD1 PHE A 80 -34.422 -7.530 -30.376 1.00 1.00 H new ATOM 0 HD2 PHE A 80 -34.159 -10.844 -27.636 1.00 1.00 H new ATOM 0 HE1 PHE A 80 -32.575 -6.387 -29.166 1.00 1.00 H new ATOM 0 HE2 PHE A 80 -32.321 -9.695 -26.420 1.00 1.00 H new ATOM 0 HZ PHE A 80 -31.527 -7.465 -27.186 1.00 1.00 H new ATOM 1216 N LYS A 81 -39.206 -10.505 -29.495 1.00 1.00 N ATOM 1217 CA LYS A 81 -40.378 -11.204 -30.070 1.00 1.00 C ATOM 1218 C LYS A 81 -41.708 -10.769 -29.433 1.00 1.00 C ATOM 1219 O LYS A 81 -41.715 -10.056 -28.426 1.00 1.00 O ATOM 1220 CB LYS A 81 -40.149 -12.735 -30.032 1.00 1.00 C ATOM 1221 CG LYS A 81 -39.903 -13.399 -28.661 1.00 1.00 C ATOM 1222 CD LYS A 81 -41.140 -13.468 -27.747 1.00 1.00 C ATOM 1223 CE LYS A 81 -40.966 -14.471 -26.595 1.00 1.00 C ATOM 1224 NZ LYS A 81 -39.924 -14.052 -25.620 1.00 1.00 N ATOM 0 H LYS A 81 -39.319 -10.301 -28.502 1.00 1.00 H new ATOM 0 HA LYS A 81 -40.472 -10.909 -31.115 1.00 1.00 H new ATOM 0 HB2 LYS A 81 -41.018 -13.214 -30.483 1.00 1.00 H new ATOM 0 HB3 LYS A 81 -39.294 -12.960 -30.670 1.00 1.00 H new ATOM 0 HG2 LYS A 81 -39.532 -14.411 -28.824 1.00 1.00 H new ATOM 0 HG3 LYS A 81 -39.116 -12.851 -28.143 1.00 1.00 H new ATOM 0 HD2 LYS A 81 -41.339 -12.478 -27.336 1.00 1.00 H new ATOM 0 HD3 LYS A 81 -42.011 -13.748 -28.340 1.00 1.00 H new ATOM 0 HE2 LYS A 81 -41.917 -14.589 -26.075 1.00 1.00 H new ATOM 0 HE3 LYS A 81 -40.703 -15.446 -27.005 1.00 1.00 H new ATOM 0 HZ1 LYS A 81 -39.849 -14.764 -24.865 1.00 1.00 H new ATOM 0 HZ2 LYS A 81 -39.009 -13.964 -26.106 1.00 1.00 H new ATOM 0 HZ3 LYS A 81 -40.185 -13.134 -25.206 1.00 1.00 H new ATOM 1238 N ALA A 82 -42.823 -11.208 -30.017 1.00 1.00 N ATOM 1239 CA ALA A 82 -44.192 -10.916 -29.575 1.00 1.00 C ATOM 1240 C ALA A 82 -45.163 -12.082 -29.878 1.00 1.00 C ATOM 1241 O ALA A 82 -44.819 -13.028 -30.593 1.00 1.00 O ATOM 1242 CB ALA A 82 -44.647 -9.619 -30.264 1.00 1.00 C ATOM 0 H ALA A 82 -42.799 -11.802 -30.846 1.00 1.00 H new ATOM 0 HA ALA A 82 -44.202 -10.791 -28.492 1.00 1.00 H new ATOM 0 HB1 ALA A 82 -45.663 -9.379 -29.952 1.00 1.00 H new ATOM 0 HB2 ALA A 82 -43.979 -8.804 -29.984 1.00 1.00 H new ATOM 0 HB3 ALA A 82 -44.621 -9.753 -31.345 1.00 1.00 H new ATOM 1248 N ALA A 83 -46.383 -12.012 -29.332 1.00 1.00 N ATOM 1249 CA ALA A 83 -47.439 -13.015 -29.517 1.00 1.00 C ATOM 1250 C ALA A 83 -47.924 -13.131 -30.988 1.00 1.00 C ATOM 1251 O ALA A 83 -47.879 -12.139 -31.729 1.00 1.00 O ATOM 1252 CB ALA A 83 -48.598 -12.642 -28.580 1.00 1.00 C ATOM 0 H ALA A 83 -46.670 -11.237 -28.734 1.00 1.00 H new ATOM 0 HA ALA A 83 -47.038 -13.999 -29.273 1.00 1.00 H new ATOM 0 HB1 ALA A 83 -49.404 -13.368 -28.691 1.00 1.00 H new ATOM 0 HB2 ALA A 83 -48.247 -12.644 -27.548 1.00 1.00 H new ATOM 0 HB3 ALA A 83 -48.967 -11.649 -28.835 1.00 1.00 H new ATOM 1258 N PRO A 84 -48.409 -14.313 -31.427 1.00 1.00 N ATOM 1259 CA PRO A 84 -48.912 -14.532 -32.788 1.00 1.00 C ATOM 1260 C PRO A 84 -50.266 -13.842 -33.052 1.00 1.00 C ATOM 1261 O PRO A 84 -50.963 -13.408 -32.129 1.00 1.00 O ATOM 1262 CB PRO A 84 -49.014 -16.056 -32.930 1.00 1.00 C ATOM 1263 CG PRO A 84 -49.314 -16.522 -31.508 1.00 1.00 C ATOM 1264 CD PRO A 84 -48.508 -15.546 -30.653 1.00 1.00 C ATOM 0 HA PRO A 84 -48.243 -14.090 -33.526 1.00 1.00 H new ATOM 0 HB2 PRO A 84 -49.805 -16.343 -33.623 1.00 1.00 H new ATOM 0 HB3 PRO A 84 -48.087 -16.488 -33.308 1.00 1.00 H new ATOM 0 HG2 PRO A 84 -50.379 -16.472 -31.283 1.00 1.00 H new ATOM 0 HG3 PRO A 84 -49.002 -17.554 -31.346 1.00 1.00 H new ATOM 0 HD2 PRO A 84 -49.001 -15.367 -29.697 1.00 1.00 H new ATOM 0 HD3 PRO A 84 -47.519 -15.947 -30.432 1.00 1.00 H new ATOM 1272 N ALA A 85 -50.645 -13.762 -34.332 1.00 1.00 N ATOM 1273 CA ALA A 85 -51.886 -13.139 -34.821 1.00 1.00 C ATOM 1274 C ALA A 85 -52.514 -13.922 -36.002 1.00 1.00 C ATOM 1275 O ALA A 85 -53.096 -13.340 -36.919 1.00 1.00 O ATOM 1276 CB ALA A 85 -51.565 -11.675 -35.171 1.00 1.00 C ATOM 0 H ALA A 85 -50.076 -14.143 -35.087 1.00 1.00 H new ATOM 0 HA ALA A 85 -52.650 -13.166 -34.044 1.00 1.00 H new ATOM 0 HB1 ALA A 85 -52.466 -11.183 -35.538 1.00 1.00 H new ATOM 0 HB2 ALA A 85 -51.206 -11.158 -34.281 1.00 1.00 H new ATOM 0 HB3 ALA A 85 -50.796 -11.646 -35.943 1.00 1.00 H new ATOM 1282 N GLU A 86 -52.370 -15.254 -36.002 1.00 1.00 N ATOM 1283 CA GLU A 86 -52.839 -16.175 -37.059 1.00 1.00 C ATOM 1284 C GLU A 86 -54.363 -16.184 -37.316 1.00 1.00 C ATOM 1285 O GLU A 86 -54.827 -16.641 -38.364 1.00 1.00 O ATOM 1286 CB GLU A 86 -52.301 -17.581 -36.727 1.00 1.00 C ATOM 1287 CG GLU A 86 -52.402 -18.591 -37.879 1.00 1.00 C ATOM 1288 CD GLU A 86 -51.651 -19.892 -37.535 1.00 1.00 C ATOM 1289 OE1 GLU A 86 -52.244 -20.792 -36.890 1.00 1.00 O ATOM 1290 OE2 GLU A 86 -50.460 -20.032 -37.912 1.00 1.00 O ATOM 0 H GLU A 86 -51.906 -15.744 -35.237 1.00 1.00 H new ATOM 0 HA GLU A 86 -52.443 -15.809 -38.006 1.00 1.00 H new ATOM 0 HB2 GLU A 86 -51.257 -17.495 -36.427 1.00 1.00 H new ATOM 0 HB3 GLU A 86 -52.848 -17.972 -35.869 1.00 1.00 H new ATOM 0 HG2 GLU A 86 -53.449 -18.814 -38.082 1.00 1.00 H new ATOM 0 HG3 GLU A 86 -51.986 -18.155 -38.788 1.00 1.00 H new ATOM 1297 N ILE A 87 -55.149 -15.640 -36.383 1.00 1.00 N ATOM 1298 CA ILE A 87 -56.616 -15.511 -36.450 1.00 1.00 C ATOM 1299 C ILE A 87 -57.012 -14.325 -37.363 1.00 1.00 C ATOM 1300 O ILE A 87 -57.645 -13.352 -36.945 1.00 1.00 O ATOM 1301 CB ILE A 87 -57.277 -15.468 -35.042 1.00 1.00 C ATOM 1302 CG1 ILE A 87 -56.741 -16.534 -34.051 1.00 1.00 C ATOM 1303 CG2 ILE A 87 -58.791 -15.728 -35.190 1.00 1.00 C ATOM 1304 CD1 ILE A 87 -55.496 -16.111 -33.254 1.00 1.00 C ATOM 0 H ILE A 87 -54.767 -15.258 -35.518 1.00 1.00 H new ATOM 0 HA ILE A 87 -57.018 -16.413 -36.911 1.00 1.00 H new ATOM 0 HB ILE A 87 -57.042 -14.483 -34.639 1.00 1.00 H new ATOM 0 HG12 ILE A 87 -57.535 -16.787 -33.349 1.00 1.00 H new ATOM 0 HG13 ILE A 87 -56.507 -17.441 -34.608 1.00 1.00 H new ATOM 0 HG21 ILE A 87 -59.263 -15.700 -34.208 1.00 1.00 H new ATOM 0 HG22 ILE A 87 -59.231 -14.960 -35.826 1.00 1.00 H new ATOM 0 HG23 ILE A 87 -58.950 -16.708 -35.641 1.00 1.00 H new ATOM 0 HD11 ILE A 87 -55.197 -16.921 -32.589 1.00 1.00 H new ATOM 0 HD12 ILE A 87 -54.681 -15.888 -33.943 1.00 1.00 H new ATOM 0 HD13 ILE A 87 -55.726 -15.224 -32.664 1.00 1.00 H new ATOM 1316 N SER A 88 -56.577 -14.392 -38.623 1.00 1.00 N ATOM 1317 CA SER A 88 -56.788 -13.380 -39.675 1.00 1.00 C ATOM 1318 C SER A 88 -57.098 -13.978 -41.058 1.00 1.00 C ATOM 1319 O SER A 88 -57.584 -13.268 -41.940 1.00 1.00 O ATOM 1320 CB SER A 88 -55.556 -12.470 -39.765 1.00 1.00 C ATOM 1321 OG SER A 88 -54.404 -13.207 -40.154 1.00 1.00 O ATOM 0 H SER A 88 -56.040 -15.191 -38.960 1.00 1.00 H new ATOM 0 HA SER A 88 -57.670 -12.809 -39.385 1.00 1.00 H new ATOM 0 HB2 SER A 88 -55.741 -11.672 -40.484 1.00 1.00 H new ATOM 0 HB3 SER A 88 -55.379 -11.995 -38.800 1.00 1.00 H new ATOM 0 HG SER A 88 -53.633 -12.605 -40.206 1.00 1.00 H new ATOM 1327 N ASP A 89 -56.854 -15.279 -41.263 1.00 1.00 N ATOM 1328 CA ASP A 89 -57.123 -15.994 -42.523 1.00 1.00 C ATOM 1329 C ASP A 89 -58.630 -16.203 -42.806 1.00 1.00 C ATOM 1330 O ASP A 89 -59.026 -16.428 -43.954 1.00 1.00 O ATOM 1331 CB ASP A 89 -56.386 -17.341 -42.473 1.00 1.00 C ATOM 1332 CG ASP A 89 -56.443 -18.101 -43.810 1.00 1.00 C ATOM 1333 OD1 ASP A 89 -55.840 -17.627 -44.803 1.00 1.00 O ATOM 1334 OD2 ASP A 89 -57.058 -19.195 -43.864 1.00 1.00 O ATOM 0 H ASP A 89 -56.455 -15.880 -40.542 1.00 1.00 H new ATOM 0 HA ASP A 89 -56.759 -15.379 -43.346 1.00 1.00 H new ATOM 0 HB2 ASP A 89 -55.344 -17.170 -42.201 1.00 1.00 H new ATOM 0 HB3 ASP A 89 -56.823 -17.960 -41.689 1.00 1.00 H new ATOM 1339 N GLY A 90 -59.480 -16.113 -41.776 1.00 1.00 N ATOM 1340 CA GLY A 90 -60.935 -16.279 -41.870 1.00 1.00 C ATOM 1341 C GLY A 90 -61.678 -16.002 -40.555 1.00 1.00 C ATOM 1342 O GLY A 90 -61.079 -15.618 -39.546 1.00 1.00 O ATOM 0 H GLY A 90 -59.165 -15.917 -40.826 1.00 1.00 H new ATOM 0 HA2 GLY A 90 -61.318 -15.610 -42.641 1.00 1.00 H new ATOM 0 HA3 GLY A 90 -61.155 -17.297 -42.193 1.00 1.00 H new ATOM 1346 N GLU A 91 -62.999 -16.188 -40.579 1.00 1.00 N ATOM 1347 CA GLU A 91 -63.909 -15.986 -39.438 1.00 1.00 C ATOM 1348 C GLU A 91 -63.637 -16.956 -38.262 1.00 1.00 C ATOM 1349 O GLU A 91 -63.159 -18.077 -38.452 1.00 1.00 O ATOM 1350 CB GLU A 91 -65.353 -16.126 -39.964 1.00 1.00 C ATOM 1351 CG GLU A 91 -66.439 -15.756 -38.945 1.00 1.00 C ATOM 1352 CD GLU A 91 -67.830 -15.728 -39.609 1.00 1.00 C ATOM 1353 OE1 GLU A 91 -68.482 -16.797 -39.710 1.00 1.00 O ATOM 1354 OE2 GLU A 91 -68.285 -14.637 -40.032 1.00 1.00 O ATOM 0 H GLU A 91 -63.487 -16.494 -41.421 1.00 1.00 H new ATOM 0 HA GLU A 91 -63.743 -14.992 -39.024 1.00 1.00 H new ATOM 0 HB2 GLU A 91 -65.468 -15.494 -40.845 1.00 1.00 H new ATOM 0 HB3 GLU A 91 -65.511 -17.155 -40.287 1.00 1.00 H new ATOM 0 HG2 GLU A 91 -66.437 -16.477 -38.127 1.00 1.00 H new ATOM 0 HG3 GLU A 91 -66.219 -14.781 -38.511 1.00 1.00 H new ATOM 1361 N ASP A 92 -63.985 -16.536 -37.040 1.00 1.00 N ATOM 1362 CA ASP A 92 -63.858 -17.308 -35.796 1.00 1.00 C ATOM 1363 C ASP A 92 -65.070 -17.070 -34.864 1.00 1.00 C ATOM 1364 O ASP A 92 -65.692 -16.002 -34.895 1.00 1.00 O ATOM 1365 CB ASP A 92 -62.537 -16.934 -35.100 1.00 1.00 C ATOM 1366 CG ASP A 92 -62.354 -17.721 -33.797 1.00 1.00 C ATOM 1367 OD1 ASP A 92 -61.928 -18.898 -33.856 1.00 1.00 O ATOM 1368 OD2 ASP A 92 -62.712 -17.190 -32.721 1.00 1.00 O ATOM 0 H ASP A 92 -64.380 -15.609 -36.883 1.00 1.00 H new ATOM 0 HA ASP A 92 -63.845 -18.371 -36.036 1.00 1.00 H new ATOM 0 HB2 ASP A 92 -61.701 -17.135 -35.770 1.00 1.00 H new ATOM 0 HB3 ASP A 92 -62.525 -15.865 -34.887 1.00 1.00 H new ATOM 1373 N ARG A 93 -65.406 -18.072 -34.035 1.00 1.00 N ATOM 1374 CA ARG A 93 -66.537 -18.066 -33.079 1.00 1.00 C ATOM 1375 C ARG A 93 -66.206 -18.740 -31.733 1.00 1.00 C ATOM 1376 O ARG A 93 -67.062 -19.347 -31.092 1.00 1.00 O ATOM 1377 CB ARG A 93 -67.793 -18.617 -33.774 1.00 1.00 C ATOM 1378 CG ARG A 93 -67.683 -20.065 -34.271 1.00 1.00 C ATOM 1379 CD ARG A 93 -68.960 -20.390 -35.046 1.00 1.00 C ATOM 1380 NE ARG A 93 -69.075 -21.832 -35.344 1.00 1.00 N ATOM 1381 CZ ARG A 93 -68.745 -22.456 -36.460 1.00 1.00 C ATOM 1382 NH1 ARG A 93 -68.212 -21.838 -37.478 1.00 1.00 N ATOM 1383 NH2 ARG A 93 -68.949 -23.737 -36.575 1.00 1.00 N ATOM 0 H ARG A 93 -64.879 -18.945 -34.008 1.00 1.00 H new ATOM 0 HA ARG A 93 -66.745 -17.036 -32.790 1.00 1.00 H new ATOM 0 HB2 ARG A 93 -68.631 -18.551 -33.080 1.00 1.00 H new ATOM 0 HB3 ARG A 93 -68.030 -17.975 -34.623 1.00 1.00 H new ATOM 0 HG2 ARG A 93 -66.808 -20.185 -34.909 1.00 1.00 H new ATOM 0 HG3 ARG A 93 -67.561 -20.749 -33.431 1.00 1.00 H new ATOM 0 HD2 ARG A 93 -69.826 -20.069 -34.468 1.00 1.00 H new ATOM 0 HD3 ARG A 93 -68.972 -19.825 -35.978 1.00 1.00 H new ATOM 0 HE ARG A 93 -69.455 -22.416 -34.599 1.00 1.00 H new ATOM 0 HH11 ARG A 93 -68.035 -20.835 -37.430 1.00 1.00 H new ATOM 0 HH12 ARG A 93 -67.972 -22.358 -38.322 1.00 1.00 H new ATOM 0 HH21 ARG A 93 -69.364 -24.259 -35.803 1.00 1.00 H new ATOM 0 HH22 ARG A 93 -68.694 -24.219 -37.437 1.00 1.00 H new ATOM 1397 N SER A 94 -64.946 -18.644 -31.307 1.00 1.00 N ATOM 1398 CA SER A 94 -64.368 -19.246 -30.086 1.00 1.00 C ATOM 1399 C SER A 94 -64.947 -18.833 -28.714 1.00 1.00 C ATOM 1400 O SER A 94 -64.469 -19.336 -27.694 1.00 1.00 O ATOM 1401 CB SER A 94 -62.854 -18.989 -30.077 1.00 1.00 C ATOM 1402 OG SER A 94 -62.559 -17.605 -30.115 1.00 1.00 O ATOM 0 H SER A 94 -64.252 -18.112 -31.832 1.00 1.00 H new ATOM 0 HA SER A 94 -64.643 -20.297 -30.171 1.00 1.00 H new ATOM 0 HB2 SER A 94 -62.415 -19.430 -29.182 1.00 1.00 H new ATOM 0 HB3 SER A 94 -62.396 -19.483 -30.934 1.00 1.00 H new ATOM 0 HG SER A 94 -62.295 -17.352 -31.024 1.00 1.00 H new ATOM 1408 N LYS A 95 -65.941 -17.932 -28.639 1.00 1.00 N ATOM 1409 CA LYS A 95 -66.492 -17.424 -27.360 1.00 1.00 C ATOM 1410 C LYS A 95 -68.016 -17.441 -27.198 1.00 1.00 C ATOM 1411 O LYS A 95 -68.471 -17.426 -26.052 1.00 1.00 O ATOM 1412 CB LYS A 95 -65.966 -15.990 -27.135 1.00 1.00 C ATOM 1413 CG LYS A 95 -64.479 -15.908 -26.738 1.00 1.00 C ATOM 1414 CD LYS A 95 -64.152 -16.488 -25.350 1.00 1.00 C ATOM 1415 CE LYS A 95 -64.843 -15.701 -24.227 1.00 1.00 C ATOM 1416 NZ LYS A 95 -64.634 -16.340 -22.904 1.00 1.00 N ATOM 0 H LYS A 95 -66.390 -17.531 -29.463 1.00 1.00 H new ATOM 0 HA LYS A 95 -66.145 -18.132 -26.607 1.00 1.00 H new ATOM 0 HB2 LYS A 95 -66.117 -15.414 -28.048 1.00 1.00 H new ATOM 0 HB3 LYS A 95 -66.563 -15.516 -26.356 1.00 1.00 H new ATOM 0 HG2 LYS A 95 -63.887 -16.436 -27.486 1.00 1.00 H new ATOM 0 HG3 LYS A 95 -64.167 -14.864 -26.763 1.00 1.00 H new ATOM 0 HD2 LYS A 95 -64.465 -17.531 -25.309 1.00 1.00 H new ATOM 0 HD3 LYS A 95 -63.073 -16.473 -25.194 1.00 1.00 H new ATOM 0 HE2 LYS A 95 -64.456 -14.682 -24.205 1.00 1.00 H new ATOM 0 HE3 LYS A 95 -65.911 -15.632 -24.434 1.00 1.00 H new ATOM 0 HZ1 LYS A 95 -64.980 -15.708 -22.154 1.00 1.00 H new ATOM 0 HZ2 LYS A 95 -65.155 -17.239 -22.867 1.00 1.00 H new ATOM 0 HZ3 LYS A 95 -63.620 -16.522 -22.762 1.00 1.00 H new ATOM 1430 N CYS A 96 -68.809 -17.484 -28.272 1.00 1.00 N ATOM 1431 CA CYS A 96 -70.278 -17.455 -28.180 1.00 1.00 C ATOM 1432 C CYS A 96 -70.988 -18.323 -29.233 1.00 1.00 C ATOM 1433 O CYS A 96 -70.407 -18.697 -30.254 1.00 1.00 O ATOM 1434 CB CYS A 96 -70.790 -16.002 -28.296 1.00 1.00 C ATOM 1435 SG CYS A 96 -69.899 -14.807 -27.248 1.00 1.00 S ATOM 0 H CYS A 96 -68.456 -17.540 -29.228 1.00 1.00 H new ATOM 0 HA CYS A 96 -70.521 -17.878 -27.205 1.00 1.00 H new ATOM 0 HB2 CYS A 96 -70.713 -15.684 -29.336 1.00 1.00 H new ATOM 0 HB3 CYS A 96 -71.848 -15.980 -28.034 1.00 1.00 H new ATOM 0 HG CYS A 96 -70.402 -13.620 -27.419 1.00 1.00 H new ATOM 1441 N CYS A 97 -72.270 -18.605 -28.981 1.00 1.00 N ATOM 1442 CA CYS A 97 -73.171 -19.363 -29.846 1.00 1.00 C ATOM 1443 C CYS A 97 -74.602 -18.789 -29.768 1.00 1.00 C ATOM 1444 O CYS A 97 -75.382 -19.199 -28.902 1.00 1.00 O ATOM 1445 CB CYS A 97 -73.131 -20.847 -29.463 1.00 1.00 C ATOM 1446 SG CYS A 97 -74.198 -21.892 -30.485 1.00 1.00 S ATOM 0 H CYS A 97 -72.728 -18.294 -28.124 1.00 1.00 H new ATOM 0 HA CYS A 97 -72.841 -19.273 -30.881 1.00 1.00 H new ATOM 0 HB2 CYS A 97 -72.105 -21.205 -29.541 1.00 1.00 H new ATOM 0 HB3 CYS A 97 -73.427 -20.952 -28.419 1.00 1.00 H new ATOM 1451 N PRO A 98 -74.979 -17.834 -30.645 1.00 1.00 N ATOM 1452 CA PRO A 98 -76.311 -17.220 -30.632 1.00 1.00 C ATOM 1453 C PRO A 98 -77.437 -18.181 -31.049 1.00 1.00 C ATOM 1454 O PRO A 98 -78.591 -17.949 -30.693 1.00 1.00 O ATOM 1455 CB PRO A 98 -76.208 -16.009 -31.566 1.00 1.00 C ATOM 1456 CG PRO A 98 -75.117 -16.412 -32.556 1.00 1.00 C ATOM 1457 CD PRO A 98 -74.163 -17.251 -31.705 1.00 1.00 C ATOM 0 HA PRO A 98 -76.588 -16.931 -29.618 1.00 1.00 H new ATOM 0 HB2 PRO A 98 -77.154 -15.810 -32.070 1.00 1.00 H new ATOM 0 HB3 PRO A 98 -75.941 -15.104 -31.021 1.00 1.00 H new ATOM 0 HG2 PRO A 98 -75.522 -16.985 -33.390 1.00 1.00 H new ATOM 0 HG3 PRO A 98 -74.617 -15.541 -32.981 1.00 1.00 H new ATOM 0 HD2 PRO A 98 -73.687 -18.028 -32.303 1.00 1.00 H new ATOM 0 HD3 PRO A 98 -73.366 -16.635 -31.290 1.00 1.00 H new ATOM 1465 N VAL A 99 -77.126 -19.282 -31.751 1.00 1.00 N ATOM 1466 CA VAL A 99 -78.111 -20.319 -32.135 1.00 1.00 C ATOM 1467 C VAL A 99 -78.718 -20.965 -30.883 1.00 1.00 C ATOM 1468 O VAL A 99 -79.930 -21.162 -30.806 1.00 1.00 O ATOM 1469 CB VAL A 99 -77.462 -21.401 -33.026 1.00 1.00 C ATOM 1470 CG1 VAL A 99 -78.455 -22.498 -33.431 1.00 1.00 C ATOM 1471 CG2 VAL A 99 -76.889 -20.801 -34.316 1.00 1.00 C ATOM 0 H VAL A 99 -76.179 -19.484 -32.073 1.00 1.00 H new ATOM 0 HA VAL A 99 -78.903 -19.835 -32.707 1.00 1.00 H new ATOM 0 HB VAL A 99 -76.666 -21.833 -32.420 1.00 1.00 H new ATOM 0 HG11 VAL A 99 -77.949 -23.234 -34.056 1.00 1.00 H new ATOM 0 HG12 VAL A 99 -78.842 -22.987 -32.537 1.00 1.00 H new ATOM 0 HG13 VAL A 99 -79.280 -22.054 -33.988 1.00 1.00 H new ATOM 0 HG21 VAL A 99 -76.441 -21.592 -34.917 1.00 1.00 H new ATOM 0 HG22 VAL A 99 -77.689 -20.324 -34.882 1.00 1.00 H new ATOM 0 HG23 VAL A 99 -76.129 -20.060 -34.067 1.00 1.00 H new ATOM 1481 N CYS A 100 -77.875 -21.258 -29.889 1.00 1.00 N ATOM 1482 CA CYS A 100 -78.258 -21.854 -28.605 1.00 1.00 C ATOM 1483 C CYS A 100 -78.419 -20.822 -27.469 1.00 1.00 C ATOM 1484 O CYS A 100 -78.887 -21.157 -26.379 1.00 1.00 O ATOM 1485 CB CYS A 100 -77.162 -22.851 -28.229 1.00 1.00 C ATOM 1486 SG CYS A 100 -76.925 -24.207 -29.410 1.00 1.00 S ATOM 0 H CYS A 100 -76.873 -21.081 -29.958 1.00 1.00 H new ATOM 0 HA CYS A 100 -79.233 -22.326 -28.724 1.00 1.00 H new ATOM 0 HB2 CYS A 100 -76.221 -22.311 -28.124 1.00 1.00 H new ATOM 0 HB3 CYS A 100 -77.397 -23.276 -27.253 1.00 1.00 H new ATOM 1491 N ASN A 101 -77.993 -19.582 -27.722 1.00 1.00 N ATOM 1492 CA ASN A 101 -77.952 -18.438 -26.803 1.00 1.00 C ATOM 1493 C ASN A 101 -77.047 -18.718 -25.587 1.00 1.00 C ATOM 1494 O ASN A 101 -77.467 -18.628 -24.430 1.00 1.00 O ATOM 1495 CB ASN A 101 -79.375 -17.949 -26.457 1.00 1.00 C ATOM 1496 CG ASN A 101 -80.190 -17.560 -27.679 1.00 1.00 C ATOM 1497 OD1 ASN A 101 -80.967 -18.340 -28.214 1.00 1.00 O ATOM 1498 ND2 ASN A 101 -80.057 -16.340 -28.151 1.00 1.00 N ATOM 0 H ASN A 101 -77.640 -19.331 -28.645 1.00 1.00 H new ATOM 0 HA ASN A 101 -77.478 -17.596 -27.308 1.00 1.00 H new ATOM 0 HB2 ASN A 101 -79.900 -18.735 -25.914 1.00 1.00 H new ATOM 0 HB3 ASN A 101 -79.304 -17.092 -25.788 1.00 1.00 H new ATOM 0 HD21 ASN A 101 -80.601 -16.045 -28.962 1.00 1.00 H new ATOM 0 HD22 ASN A 101 -79.410 -15.689 -27.706 1.00 1.00 H new ATOM 1505 N MET A 102 -75.791 -19.081 -25.873 1.00 1.00 N ATOM 1506 CA MET A 102 -74.763 -19.435 -24.878 1.00 1.00 C ATOM 1507 C MET A 102 -73.390 -18.799 -25.164 1.00 1.00 C ATOM 1508 O MET A 102 -73.128 -18.282 -26.253 1.00 1.00 O ATOM 1509 CB MET A 102 -74.604 -20.969 -24.809 1.00 1.00 C ATOM 1510 CG MET A 102 -75.893 -21.708 -24.431 1.00 1.00 C ATOM 1511 SD MET A 102 -75.667 -23.431 -23.895 1.00 1.00 S ATOM 1512 CE MET A 102 -74.831 -24.149 -25.336 1.00 1.00 C ATOM 0 H MET A 102 -75.448 -19.139 -26.832 1.00 1.00 H new ATOM 0 HA MET A 102 -75.110 -19.037 -23.924 1.00 1.00 H new ATOM 0 HB2 MET A 102 -74.258 -21.333 -25.776 1.00 1.00 H new ATOM 0 HB3 MET A 102 -73.830 -21.212 -24.081 1.00 1.00 H new ATOM 0 HG2 MET A 102 -76.388 -21.157 -23.631 1.00 1.00 H new ATOM 0 HG3 MET A 102 -76.565 -21.696 -25.289 1.00 1.00 H new ATOM 0 HE1 MET A 102 -74.803 -25.234 -25.237 1.00 1.00 H new ATOM 0 HE2 MET A 102 -75.374 -23.881 -26.242 1.00 1.00 H new ATOM 0 HE3 MET A 102 -73.813 -23.764 -25.395 1.00 1.00 H new ATOM 1522 N THR A 103 -72.499 -18.884 -24.174 1.00 1.00 N ATOM 1523 CA THR A 103 -71.099 -18.416 -24.195 1.00 1.00 C ATOM 1524 C THR A 103 -70.166 -19.513 -23.663 1.00 1.00 C ATOM 1525 O THR A 103 -70.626 -20.468 -23.028 1.00 1.00 O ATOM 1526 CB THR A 103 -70.917 -17.120 -23.383 1.00 1.00 C ATOM 1527 OG1 THR A 103 -71.290 -17.316 -22.034 1.00 1.00 O ATOM 1528 CG2 THR A 103 -71.760 -15.968 -23.934 1.00 1.00 C ATOM 0 H THR A 103 -72.744 -19.306 -23.278 1.00 1.00 H new ATOM 0 HA THR A 103 -70.840 -18.194 -25.230 1.00 1.00 H new ATOM 0 HB THR A 103 -69.861 -16.863 -23.459 1.00 1.00 H new ATOM 0 HG1 THR A 103 -71.165 -16.482 -21.536 1.00 1.00 H new ATOM 0 HG21 THR A 103 -71.598 -15.076 -23.328 1.00 1.00 H new ATOM 0 HG22 THR A 103 -71.469 -15.765 -24.965 1.00 1.00 H new ATOM 0 HG23 THR A 103 -72.815 -16.241 -23.902 1.00 1.00 H new ATOM 1536 N PHE A 104 -68.857 -19.403 -23.925 1.00 1.00 N ATOM 1537 CA PHE A 104 -67.862 -20.416 -23.532 1.00 1.00 C ATOM 1538 C PHE A 104 -66.640 -19.816 -22.822 1.00 1.00 C ATOM 1539 O PHE A 104 -66.187 -18.712 -23.137 1.00 1.00 O ATOM 1540 CB PHE A 104 -67.429 -21.222 -24.771 1.00 1.00 C ATOM 1541 CG PHE A 104 -68.568 -21.677 -25.669 1.00 1.00 C ATOM 1542 CD1 PHE A 104 -69.456 -22.680 -25.234 1.00 1.00 C ATOM 1543 CD2 PHE A 104 -68.758 -21.079 -26.929 1.00 1.00 C ATOM 1544 CE1 PHE A 104 -70.523 -23.084 -26.055 1.00 1.00 C ATOM 1545 CE2 PHE A 104 -69.817 -21.492 -27.756 1.00 1.00 C ATOM 1546 CZ PHE A 104 -70.703 -22.489 -27.315 1.00 1.00 C ATOM 0 H PHE A 104 -68.454 -18.606 -24.418 1.00 1.00 H new ATOM 0 HA PHE A 104 -68.340 -21.076 -22.808 1.00 1.00 H new ATOM 0 HB2 PHE A 104 -66.742 -20.614 -25.360 1.00 1.00 H new ATOM 0 HB3 PHE A 104 -66.874 -22.100 -24.440 1.00 1.00 H new ATOM 0 HD1 PHE A 104 -69.317 -23.140 -24.267 1.00 1.00 H new ATOM 0 HD2 PHE A 104 -68.088 -20.300 -27.262 1.00 1.00 H new ATOM 0 HE1 PHE A 104 -71.204 -23.851 -25.717 1.00 1.00 H new ATOM 0 HE2 PHE A 104 -69.949 -21.043 -28.729 1.00 1.00 H new ATOM 0 HZ PHE A 104 -71.524 -22.799 -27.945 1.00 1.00 H new ATOM 1556 N SER A 105 -66.087 -20.560 -21.861 1.00 1.00 N ATOM 1557 CA SER A 105 -64.915 -20.172 -21.059 1.00 1.00 C ATOM 1558 C SER A 105 -63.569 -20.297 -21.792 1.00 1.00 C ATOM 1559 O SER A 105 -62.584 -19.685 -21.371 1.00 1.00 O ATOM 1560 CB SER A 105 -64.873 -21.032 -19.789 1.00 1.00 C ATOM 1561 OG SER A 105 -64.878 -22.414 -20.123 1.00 1.00 O ATOM 0 H SER A 105 -66.451 -21.479 -21.609 1.00 1.00 H new ATOM 0 HA SER A 105 -65.040 -19.113 -20.832 1.00 1.00 H new ATOM 0 HB2 SER A 105 -63.980 -20.795 -19.211 1.00 1.00 H new ATOM 0 HB3 SER A 105 -65.731 -20.801 -19.158 1.00 1.00 H new ATOM 0 HG SER A 105 -64.849 -22.949 -19.302 1.00 1.00 H new ATOM 1567 N SER A 106 -63.507 -21.072 -22.882 1.00 1.00 N ATOM 1568 CA SER A 106 -62.293 -21.323 -23.672 1.00 1.00 C ATOM 1569 C SER A 106 -62.621 -21.724 -25.122 1.00 1.00 C ATOM 1570 O SER A 106 -63.640 -22.394 -25.337 1.00 1.00 O ATOM 1571 CB SER A 106 -61.522 -22.467 -22.992 1.00 1.00 C ATOM 1572 OG SER A 106 -60.499 -23.004 -23.817 1.00 1.00 O ATOM 0 H SER A 106 -64.325 -21.557 -23.251 1.00 1.00 H new ATOM 0 HA SER A 106 -61.703 -20.408 -23.714 1.00 1.00 H new ATOM 0 HB2 SER A 106 -61.081 -22.102 -22.065 1.00 1.00 H new ATOM 0 HB3 SER A 106 -62.220 -23.260 -22.722 1.00 1.00 H new ATOM 0 HG SER A 106 -60.038 -23.725 -23.339 1.00 1.00 H new ATOM 1578 N PRO A 107 -61.770 -21.384 -26.117 1.00 1.00 N ATOM 1579 CA PRO A 107 -61.933 -21.812 -27.512 1.00 1.00 C ATOM 1580 C PRO A 107 -62.149 -23.323 -27.674 1.00 1.00 C ATOM 1581 O PRO A 107 -62.901 -23.746 -28.552 1.00 1.00 O ATOM 1582 CB PRO A 107 -60.647 -21.379 -28.229 1.00 1.00 C ATOM 1583 CG PRO A 107 -60.149 -20.199 -27.403 1.00 1.00 C ATOM 1584 CD PRO A 107 -60.554 -20.586 -25.983 1.00 1.00 C ATOM 0 HA PRO A 107 -62.830 -21.356 -27.931 1.00 1.00 H new ATOM 0 HB2 PRO A 107 -59.914 -22.185 -28.257 1.00 1.00 H new ATOM 0 HB3 PRO A 107 -60.843 -21.090 -29.262 1.00 1.00 H new ATOM 0 HG2 PRO A 107 -59.071 -20.067 -27.495 1.00 1.00 H new ATOM 0 HG3 PRO A 107 -60.612 -19.263 -27.715 1.00 1.00 H new ATOM 0 HD2 PRO A 107 -59.765 -21.156 -25.493 1.00 1.00 H new ATOM 0 HD3 PRO A 107 -60.733 -19.701 -25.373 1.00 1.00 H new ATOM 1592 N VAL A 108 -61.520 -24.135 -26.811 1.00 1.00 N ATOM 1593 CA VAL A 108 -61.647 -25.603 -26.807 1.00 1.00 C ATOM 1594 C VAL A 108 -63.094 -26.023 -26.521 1.00 1.00 C ATOM 1595 O VAL A 108 -63.646 -26.875 -27.216 1.00 1.00 O ATOM 1596 CB VAL A 108 -60.685 -26.239 -25.781 1.00 1.00 C ATOM 1597 CG1 VAL A 108 -60.747 -27.772 -25.815 1.00 1.00 C ATOM 1598 CG2 VAL A 108 -59.228 -25.834 -26.052 1.00 1.00 C ATOM 0 H VAL A 108 -60.897 -23.785 -26.083 1.00 1.00 H new ATOM 0 HA VAL A 108 -61.374 -25.965 -27.798 1.00 1.00 H new ATOM 0 HB VAL A 108 -61.007 -25.874 -24.806 1.00 1.00 H new ATOM 0 HG11 VAL A 108 -60.055 -28.181 -25.078 1.00 1.00 H new ATOM 0 HG12 VAL A 108 -61.760 -28.100 -25.583 1.00 1.00 H new ATOM 0 HG13 VAL A 108 -60.470 -28.125 -26.808 1.00 1.00 H new ATOM 0 HG21 VAL A 108 -58.577 -26.299 -25.311 1.00 1.00 H new ATOM 0 HG22 VAL A 108 -58.938 -26.165 -27.049 1.00 1.00 H new ATOM 0 HG23 VAL A 108 -59.134 -24.750 -25.988 1.00 1.00 H new ATOM 1608 N VAL A 109 -63.742 -25.388 -25.537 1.00 1.00 N ATOM 1609 CA VAL A 109 -65.151 -25.645 -25.187 1.00 1.00 C ATOM 1610 C VAL A 109 -66.070 -25.239 -26.344 1.00 1.00 C ATOM 1611 O VAL A 109 -67.000 -25.974 -26.677 1.00 1.00 O ATOM 1612 CB VAL A 109 -65.547 -24.908 -23.890 1.00 1.00 C ATOM 1613 CG1 VAL A 109 -66.994 -25.208 -23.476 1.00 1.00 C ATOM 1614 CG2 VAL A 109 -64.649 -25.321 -22.716 1.00 1.00 C ATOM 0 H VAL A 109 -63.303 -24.675 -24.955 1.00 1.00 H new ATOM 0 HA VAL A 109 -65.267 -26.714 -25.010 1.00 1.00 H new ATOM 0 HB VAL A 109 -65.433 -23.846 -24.109 1.00 1.00 H new ATOM 0 HG11 VAL A 109 -67.229 -24.669 -22.559 1.00 1.00 H new ATOM 0 HG12 VAL A 109 -67.672 -24.890 -24.268 1.00 1.00 H new ATOM 0 HG13 VAL A 109 -67.110 -26.279 -23.307 1.00 1.00 H new ATOM 0 HG21 VAL A 109 -64.954 -24.784 -21.818 1.00 1.00 H new ATOM 0 HG22 VAL A 109 -64.742 -26.394 -22.547 1.00 1.00 H new ATOM 0 HG23 VAL A 109 -63.612 -25.079 -22.949 1.00 1.00 H new ATOM 1624 N ALA A 110 -65.790 -24.098 -26.985 1.00 1.00 N ATOM 1625 CA ALA A 110 -66.560 -23.614 -28.128 1.00 1.00 C ATOM 1626 C ALA A 110 -66.530 -24.600 -29.310 1.00 1.00 C ATOM 1627 O ALA A 110 -67.588 -25.015 -29.786 1.00 1.00 O ATOM 1628 CB ALA A 110 -66.037 -22.229 -28.529 1.00 1.00 C ATOM 0 H ALA A 110 -65.019 -23.485 -26.721 1.00 1.00 H new ATOM 0 HA ALA A 110 -67.607 -23.533 -27.837 1.00 1.00 H new ATOM 0 HB1 ALA A 110 -66.605 -21.858 -29.382 1.00 1.00 H new ATOM 0 HB2 ALA A 110 -66.150 -21.541 -27.691 1.00 1.00 H new ATOM 0 HB3 ALA A 110 -64.984 -22.302 -28.799 1.00 1.00 H new ATOM 1634 N GLU A 111 -65.344 -25.018 -29.777 1.00 1.00 N ATOM 1635 CA GLU A 111 -65.253 -25.978 -30.890 1.00 1.00 C ATOM 1636 C GLU A 111 -65.904 -27.328 -30.551 1.00 1.00 C ATOM 1637 O GLU A 111 -66.657 -27.861 -31.367 1.00 1.00 O ATOM 1638 CB GLU A 111 -63.815 -26.136 -31.414 1.00 1.00 C ATOM 1639 CG GLU A 111 -62.798 -26.767 -30.458 1.00 1.00 C ATOM 1640 CD GLU A 111 -61.411 -26.869 -31.122 1.00 1.00 C ATOM 1641 OE1 GLU A 111 -61.146 -27.870 -31.832 1.00 1.00 O ATOM 1642 OE2 GLU A 111 -60.570 -25.956 -30.938 1.00 1.00 O ATOM 0 H GLU A 111 -64.444 -24.712 -29.407 1.00 1.00 H new ATOM 0 HA GLU A 111 -65.832 -25.553 -31.710 1.00 1.00 H new ATOM 0 HB2 GLU A 111 -63.848 -26.739 -32.321 1.00 1.00 H new ATOM 0 HB3 GLU A 111 -63.447 -25.151 -31.700 1.00 1.00 H new ATOM 0 HG2 GLU A 111 -62.728 -26.170 -29.549 1.00 1.00 H new ATOM 0 HG3 GLU A 111 -63.138 -27.759 -30.162 1.00 1.00 H new ATOM 1649 N SER A 112 -65.677 -27.846 -29.337 1.00 1.00 N ATOM 1650 CA SER A 112 -66.291 -29.096 -28.858 1.00 1.00 C ATOM 1651 C SER A 112 -67.824 -29.019 -28.845 1.00 1.00 C ATOM 1652 O SER A 112 -68.484 -30.005 -29.177 1.00 1.00 O ATOM 1653 CB SER A 112 -65.788 -29.465 -27.457 1.00 1.00 C ATOM 1654 OG SER A 112 -64.439 -29.907 -27.502 1.00 1.00 O ATOM 0 H SER A 112 -65.059 -27.409 -28.654 1.00 1.00 H new ATOM 0 HA SER A 112 -65.992 -29.873 -29.562 1.00 1.00 H new ATOM 0 HB2 SER A 112 -65.870 -28.601 -26.798 1.00 1.00 H new ATOM 0 HB3 SER A 112 -66.418 -30.248 -27.035 1.00 1.00 H new ATOM 0 HG SER A 112 -63.839 -29.137 -27.416 1.00 1.00 H new ATOM 1660 N HIS A 113 -68.406 -27.859 -28.516 1.00 1.00 N ATOM 1661 CA HIS A 113 -69.855 -27.659 -28.564 1.00 1.00 C ATOM 1662 C HIS A 113 -70.373 -27.712 -30.013 1.00 1.00 C ATOM 1663 O HIS A 113 -71.314 -28.455 -30.296 1.00 1.00 O ATOM 1664 CB HIS A 113 -70.227 -26.324 -27.900 1.00 1.00 C ATOM 1665 CG HIS A 113 -71.667 -25.945 -28.135 1.00 1.00 C ATOM 1666 ND1 HIS A 113 -72.763 -26.420 -27.450 1.00 1.00 N ATOM 1667 CD2 HIS A 113 -72.137 -25.145 -29.144 1.00 1.00 C ATOM 1668 CE1 HIS A 113 -73.865 -25.917 -28.031 1.00 1.00 C ATOM 1669 NE2 HIS A 113 -73.533 -25.124 -29.063 1.00 1.00 N ATOM 0 H HIS A 113 -67.885 -27.037 -28.210 1.00 1.00 H new ATOM 0 HA HIS A 113 -70.332 -28.468 -28.012 1.00 1.00 H new ATOM 0 HB2 HIS A 113 -70.042 -26.391 -26.828 1.00 1.00 H new ATOM 0 HB3 HIS A 113 -69.580 -25.537 -28.286 1.00 1.00 H new ATOM 0 HD1 HIS A 113 -72.742 -27.044 -26.643 1.00 1.00 H new ATOM 0 HD2 HIS A 113 -71.535 -24.623 -29.873 1.00 1.00 H new ATOM 0 HE1 HIS A 113 -74.877 -26.122 -27.713 1.00 1.00 H new ATOM 1677 N TYR A 114 -69.756 -26.960 -30.936 1.00 1.00 N ATOM 1678 CA TYR A 114 -70.170 -26.918 -32.346 1.00 1.00 C ATOM 1679 C TYR A 114 -70.109 -28.282 -33.056 1.00 1.00 C ATOM 1680 O TYR A 114 -70.983 -28.570 -33.878 1.00 1.00 O ATOM 1681 CB TYR A 114 -69.359 -25.859 -33.111 1.00 1.00 C ATOM 1682 CG TYR A 114 -69.843 -24.435 -32.892 1.00 1.00 C ATOM 1683 CD1 TYR A 114 -71.101 -24.044 -33.393 1.00 1.00 C ATOM 1684 CD2 TYR A 114 -69.047 -23.497 -32.204 1.00 1.00 C ATOM 1685 CE1 TYR A 114 -71.567 -22.732 -33.187 1.00 1.00 C ATOM 1686 CE2 TYR A 114 -69.524 -22.192 -31.969 1.00 1.00 C ATOM 1687 CZ TYR A 114 -70.788 -21.807 -32.463 1.00 1.00 C ATOM 1688 OH TYR A 114 -71.243 -20.540 -32.294 1.00 1.00 O ATOM 0 H TYR A 114 -68.956 -26.364 -30.726 1.00 1.00 H new ATOM 0 HA TYR A 114 -71.223 -26.637 -32.346 1.00 1.00 H new ATOM 0 HB2 TYR A 114 -68.314 -25.928 -32.809 1.00 1.00 H new ATOM 0 HB3 TYR A 114 -69.398 -26.086 -34.176 1.00 1.00 H new ATOM 0 HD1 TYR A 114 -71.709 -24.753 -33.936 1.00 1.00 H new ATOM 0 HD2 TYR A 114 -68.065 -23.780 -31.855 1.00 1.00 H new ATOM 0 HE1 TYR A 114 -72.525 -22.433 -33.585 1.00 1.00 H new ATOM 0 HE2 TYR A 114 -68.923 -21.488 -31.412 1.00 1.00 H new ATOM 0 HH TYR A 114 -70.794 -20.131 -31.525 1.00 1.00 H new ATOM 1698 N ILE A 115 -69.120 -29.134 -32.747 1.00 1.00 N ATOM 1699 CA ILE A 115 -69.000 -30.484 -33.342 1.00 1.00 C ATOM 1700 C ILE A 115 -69.826 -31.554 -32.601 1.00 1.00 C ATOM 1701 O ILE A 115 -69.954 -32.678 -33.093 1.00 1.00 O ATOM 1702 CB ILE A 115 -67.522 -30.915 -33.524 1.00 1.00 C ATOM 1703 CG1 ILE A 115 -66.711 -31.117 -32.222 1.00 1.00 C ATOM 1704 CG2 ILE A 115 -66.800 -29.892 -34.420 1.00 1.00 C ATOM 1705 CD1 ILE A 115 -66.916 -32.465 -31.519 1.00 1.00 C ATOM 0 H ILE A 115 -68.380 -28.913 -32.080 1.00 1.00 H new ATOM 0 HA ILE A 115 -69.438 -30.406 -34.337 1.00 1.00 H new ATOM 0 HB ILE A 115 -67.570 -31.903 -33.983 1.00 1.00 H new ATOM 0 HG12 ILE A 115 -65.652 -31.005 -32.453 1.00 1.00 H new ATOM 0 HG13 ILE A 115 -66.971 -30.320 -31.525 1.00 1.00 H new ATOM 0 HG21 ILE A 115 -65.760 -30.192 -34.550 1.00 1.00 H new ATOM 0 HG22 ILE A 115 -67.290 -29.850 -35.393 1.00 1.00 H new ATOM 0 HG23 ILE A 115 -66.838 -28.908 -33.952 1.00 1.00 H new ATOM 0 HD11 ILE A 115 -66.302 -32.503 -30.619 1.00 1.00 H new ATOM 0 HD12 ILE A 115 -67.966 -32.578 -31.248 1.00 1.00 H new ATOM 0 HD13 ILE A 115 -66.626 -33.273 -32.190 1.00 1.00 H new ATOM 1717 N GLY A 116 -70.394 -31.225 -31.435 1.00 1.00 N ATOM 1718 CA GLY A 116 -71.194 -32.134 -30.607 1.00 1.00 C ATOM 1719 C GLY A 116 -72.701 -32.044 -30.872 1.00 1.00 C ATOM 1720 O GLY A 116 -73.211 -31.049 -31.398 1.00 1.00 O ATOM 0 H GLY A 116 -70.307 -30.293 -31.030 1.00 1.00 H new ATOM 0 HA2 GLY A 116 -70.864 -33.158 -30.784 1.00 1.00 H new ATOM 0 HA3 GLY A 116 -71.005 -31.915 -29.556 1.00 1.00 H new ATOM 1724 N LYS A 117 -73.439 -33.096 -30.494 1.00 1.00 N ATOM 1725 CA LYS A 117 -74.898 -33.181 -30.701 1.00 1.00 C ATOM 1726 C LYS A 117 -75.722 -32.142 -29.927 1.00 1.00 C ATOM 1727 O LYS A 117 -76.869 -31.899 -30.287 1.00 1.00 O ATOM 1728 CB LYS A 117 -75.389 -34.630 -30.514 1.00 1.00 C ATOM 1729 CG LYS A 117 -75.422 -35.155 -29.068 1.00 1.00 C ATOM 1730 CD LYS A 117 -76.776 -34.929 -28.378 1.00 1.00 C ATOM 1731 CE LYS A 117 -76.757 -35.598 -26.997 1.00 1.00 C ATOM 1732 NZ LYS A 117 -78.063 -35.469 -26.300 1.00 1.00 N ATOM 0 H LYS A 117 -73.044 -33.916 -30.034 1.00 1.00 H new ATOM 0 HA LYS A 117 -75.079 -32.902 -31.739 1.00 1.00 H new ATOM 0 HB2 LYS A 117 -76.394 -34.708 -30.930 1.00 1.00 H new ATOM 0 HB3 LYS A 117 -74.749 -35.287 -31.103 1.00 1.00 H new ATOM 0 HG2 LYS A 117 -75.194 -36.221 -29.069 1.00 1.00 H new ATOM 0 HG3 LYS A 117 -74.640 -34.663 -28.491 1.00 1.00 H new ATOM 0 HD2 LYS A 117 -76.972 -33.862 -28.275 1.00 1.00 H new ATOM 0 HD3 LYS A 117 -77.581 -35.344 -28.985 1.00 1.00 H new ATOM 0 HE2 LYS A 117 -76.508 -36.653 -27.108 1.00 1.00 H new ATOM 0 HE3 LYS A 117 -75.974 -35.148 -26.387 1.00 1.00 H new ATOM 0 HZ1 LYS A 117 -78.008 -35.934 -25.371 1.00 1.00 H new ATOM 0 HZ2 LYS A 117 -78.289 -34.462 -26.171 1.00 1.00 H new ATOM 0 HZ3 LYS A 117 -78.807 -35.921 -26.870 1.00 1.00 H new ATOM 1746 N THR A 118 -75.158 -31.496 -28.903 1.00 1.00 N ATOM 1747 CA THR A 118 -75.819 -30.423 -28.127 1.00 1.00 C ATOM 1748 C THR A 118 -76.231 -29.256 -29.034 1.00 1.00 C ATOM 1749 O THR A 118 -77.333 -28.715 -28.907 1.00 1.00 O ATOM 1750 CB THR A 118 -74.885 -29.905 -27.018 1.00 1.00 C ATOM 1751 OG1 THR A 118 -74.317 -30.985 -26.305 1.00 1.00 O ATOM 1752 CG2 THR A 118 -75.598 -29.008 -26.005 1.00 1.00 C ATOM 0 H THR A 118 -74.213 -31.701 -28.578 1.00 1.00 H new ATOM 0 HA THR A 118 -76.715 -30.848 -27.676 1.00 1.00 H new ATOM 0 HB THR A 118 -74.120 -29.319 -27.527 1.00 1.00 H new ATOM 0 HG1 THR A 118 -73.725 -30.639 -25.605 1.00 1.00 H new ATOM 0 HG21 THR A 118 -74.886 -28.675 -25.249 1.00 1.00 H new ATOM 0 HG22 THR A 118 -76.015 -28.141 -26.517 1.00 1.00 H new ATOM 0 HG23 THR A 118 -76.401 -29.568 -25.526 1.00 1.00 H new ATOM 1760 N HIS A 119 -75.377 -28.898 -30.000 1.00 1.00 N ATOM 1761 CA HIS A 119 -75.678 -27.868 -30.999 1.00 1.00 C ATOM 1762 C HIS A 119 -76.780 -28.353 -31.953 1.00 1.00 C ATOM 1763 O HIS A 119 -77.742 -27.637 -32.214 1.00 1.00 O ATOM 1764 CB HIS A 119 -74.389 -27.514 -31.751 1.00 1.00 C ATOM 1765 CG HIS A 119 -74.546 -26.312 -32.645 1.00 1.00 C ATOM 1766 ND1 HIS A 119 -74.727 -25.001 -32.201 1.00 1.00 N ATOM 1767 CD2 HIS A 119 -74.518 -26.323 -34.009 1.00 1.00 C ATOM 1768 CE1 HIS A 119 -74.805 -24.249 -33.311 1.00 1.00 C ATOM 1769 NE2 HIS A 119 -74.681 -25.014 -34.410 1.00 1.00 N ATOM 0 H HIS A 119 -74.454 -29.317 -30.110 1.00 1.00 H new ATOM 0 HA HIS A 119 -76.053 -26.970 -30.508 1.00 1.00 H new ATOM 0 HB2 HIS A 119 -73.594 -27.324 -31.030 1.00 1.00 H new ATOM 0 HB3 HIS A 119 -74.077 -28.369 -32.351 1.00 1.00 H new ATOM 0 HD2 HIS A 119 -74.393 -27.185 -34.647 1.00 1.00 H new ATOM 0 HE1 HIS A 119 -74.948 -23.178 -33.320 1.00 1.00 H new ATOM 0 HE2 HIS A 119 -74.704 -24.683 -35.374 1.00 1.00 H new ATOM 1777 N ILE A 120 -76.683 -29.604 -32.420 1.00 1.00 N ATOM 1778 CA ILE A 120 -77.663 -30.260 -33.309 1.00 1.00 C ATOM 1779 C ILE A 120 -79.061 -30.340 -32.677 1.00 1.00 C ATOM 1780 O ILE A 120 -80.051 -30.094 -33.367 1.00 1.00 O ATOM 1781 CB ILE A 120 -77.109 -31.624 -33.777 1.00 1.00 C ATOM 1782 CG1 ILE A 120 -75.943 -31.342 -34.757 1.00 1.00 C ATOM 1783 CG2 ILE A 120 -78.187 -32.527 -34.404 1.00 1.00 C ATOM 1784 CD1 ILE A 120 -75.180 -32.591 -35.218 1.00 1.00 C ATOM 0 H ILE A 120 -75.897 -30.211 -32.185 1.00 1.00 H new ATOM 0 HA ILE A 120 -77.803 -29.646 -34.198 1.00 1.00 H new ATOM 0 HB ILE A 120 -76.750 -32.185 -32.914 1.00 1.00 H new ATOM 0 HG12 ILE A 120 -76.339 -30.830 -35.634 1.00 1.00 H new ATOM 0 HG13 ILE A 120 -75.241 -30.659 -34.279 1.00 1.00 H new ATOM 0 HG21 ILE A 120 -77.737 -33.470 -34.713 1.00 1.00 H new ATOM 0 HG22 ILE A 120 -78.970 -32.721 -33.671 1.00 1.00 H new ATOM 0 HG23 ILE A 120 -78.618 -32.029 -35.272 1.00 1.00 H new ATOM 0 HD11 ILE A 120 -74.382 -32.299 -35.901 1.00 1.00 H new ATOM 0 HD12 ILE A 120 -74.750 -33.095 -34.352 1.00 1.00 H new ATOM 0 HD13 ILE A 120 -75.865 -33.268 -35.729 1.00 1.00 H new ATOM 1796 N LYS A 121 -79.170 -30.605 -31.368 1.00 1.00 N ATOM 1797 CA LYS A 121 -80.453 -30.594 -30.640 1.00 1.00 C ATOM 1798 C LYS A 121 -81.142 -29.229 -30.778 1.00 1.00 C ATOM 1799 O LYS A 121 -82.351 -29.159 -30.994 1.00 1.00 O ATOM 1800 CB LYS A 121 -80.210 -30.977 -29.168 1.00 1.00 C ATOM 1801 CG LYS A 121 -81.525 -31.091 -28.378 1.00 1.00 C ATOM 1802 CD LYS A 121 -81.280 -31.512 -26.926 1.00 1.00 C ATOM 1803 CE LYS A 121 -82.615 -31.577 -26.171 1.00 1.00 C ATOM 1804 NZ LYS A 121 -82.427 -31.961 -24.747 1.00 1.00 N ATOM 0 H LYS A 121 -78.369 -30.834 -30.779 1.00 1.00 H new ATOM 0 HA LYS A 121 -81.128 -31.332 -31.074 1.00 1.00 H new ATOM 0 HB2 LYS A 121 -79.677 -31.927 -29.124 1.00 1.00 H new ATOM 0 HB3 LYS A 121 -79.569 -30.230 -28.700 1.00 1.00 H new ATOM 0 HG2 LYS A 121 -82.044 -30.133 -28.396 1.00 1.00 H new ATOM 0 HG3 LYS A 121 -82.178 -31.817 -28.862 1.00 1.00 H new ATOM 0 HD2 LYS A 121 -80.788 -32.484 -26.898 1.00 1.00 H new ATOM 0 HD3 LYS A 121 -80.611 -30.802 -26.440 1.00 1.00 H new ATOM 0 HE2 LYS A 121 -83.110 -30.607 -26.223 1.00 1.00 H new ATOM 0 HE3 LYS A 121 -83.273 -32.297 -26.658 1.00 1.00 H new ATOM 0 HZ1 LYS A 121 -83.351 -31.994 -24.271 1.00 1.00 H new ATOM 0 HZ2 LYS A 121 -81.978 -32.898 -24.696 1.00 1.00 H new ATOM 0 HZ3 LYS A 121 -81.820 -31.260 -24.276 1.00 1.00 H new ATOM 1818 N ASN A 122 -80.363 -28.145 -30.726 1.00 1.00 N ATOM 1819 CA ASN A 122 -80.860 -26.787 -30.935 1.00 1.00 C ATOM 1820 C ASN A 122 -81.210 -26.540 -32.415 1.00 1.00 C ATOM 1821 O ASN A 122 -82.251 -25.940 -32.675 1.00 1.00 O ATOM 1822 CB ASN A 122 -79.861 -25.769 -30.364 1.00 1.00 C ATOM 1823 CG ASN A 122 -79.911 -25.728 -28.845 1.00 1.00 C ATOM 1824 OD1 ASN A 122 -80.644 -24.948 -28.255 1.00 1.00 O ATOM 1825 ND2 ASN A 122 -79.162 -26.560 -28.152 1.00 1.00 N ATOM 0 H ASN A 122 -79.362 -28.188 -30.536 1.00 1.00 H new ATOM 0 HA ASN A 122 -81.794 -26.657 -30.389 1.00 1.00 H new ATOM 0 HB2 ASN A 122 -78.853 -26.026 -30.689 1.00 1.00 H new ATOM 0 HB3 ASN A 122 -80.081 -24.779 -30.763 1.00 1.00 H new ATOM 0 HD21 ASN A 122 -79.197 -26.550 -27.133 1.00 1.00 H new ATOM 0 HD22 ASN A 122 -78.547 -27.215 -28.634 1.00 1.00 H new ATOM 1832 N LEU A 123 -80.432 -27.045 -33.389 1.00 1.00 N ATOM 1833 CA LEU A 123 -80.785 -26.941 -34.821 1.00 1.00 C ATOM 1834 C LEU A 123 -82.186 -27.536 -35.065 1.00 1.00 C ATOM 1835 O LEU A 123 -83.049 -26.894 -35.663 1.00 1.00 O ATOM 1836 CB LEU A 123 -79.776 -27.669 -35.738 1.00 1.00 C ATOM 1837 CG LEU A 123 -78.296 -27.261 -35.659 1.00 1.00 C ATOM 1838 CD1 LEU A 123 -77.492 -28.057 -36.688 1.00 1.00 C ATOM 1839 CD2 LEU A 123 -78.060 -25.782 -35.926 1.00 1.00 C ATOM 0 H LEU A 123 -79.553 -27.531 -33.213 1.00 1.00 H new ATOM 0 HA LEU A 123 -80.765 -25.880 -35.069 1.00 1.00 H new ATOM 0 HB2 LEU A 123 -79.839 -28.735 -35.522 1.00 1.00 H new ATOM 0 HB3 LEU A 123 -80.104 -27.533 -36.768 1.00 1.00 H new ATOM 0 HG LEU A 123 -77.976 -27.472 -34.639 1.00 1.00 H new ATOM 0 HD11 LEU A 123 -76.442 -27.768 -36.632 1.00 1.00 H new ATOM 0 HD12 LEU A 123 -77.587 -29.122 -36.478 1.00 1.00 H new ATOM 0 HD13 LEU A 123 -77.873 -27.849 -37.688 1.00 1.00 H new ATOM 0 HD21 LEU A 123 -76.994 -25.565 -35.854 1.00 1.00 H new ATOM 0 HD22 LEU A 123 -78.415 -25.532 -36.926 1.00 1.00 H new ATOM 0 HD23 LEU A 123 -78.602 -25.188 -35.190 1.00 1.00 H new ATOM 1851 N ARG A 124 -82.423 -28.747 -34.539 1.00 1.00 N ATOM 1852 CA ARG A 124 -83.709 -29.462 -34.615 1.00 1.00 C ATOM 1853 C ARG A 124 -84.839 -28.668 -33.951 1.00 1.00 C ATOM 1854 O ARG A 124 -85.924 -28.576 -34.520 1.00 1.00 O ATOM 1855 CB ARG A 124 -83.559 -30.864 -33.998 1.00 1.00 C ATOM 1856 CG ARG A 124 -82.660 -31.769 -34.859 1.00 1.00 C ATOM 1857 CD ARG A 124 -82.369 -33.096 -34.151 1.00 1.00 C ATOM 1858 NE ARG A 124 -81.499 -33.959 -34.974 1.00 1.00 N ATOM 1859 CZ ARG A 124 -80.970 -35.117 -34.622 1.00 1.00 C ATOM 1860 NH1 ARG A 124 -81.183 -35.650 -33.451 1.00 1.00 N ATOM 1861 NH2 ARG A 124 -80.208 -35.771 -35.450 1.00 1.00 N ATOM 0 H ARG A 124 -81.708 -29.271 -34.035 1.00 1.00 H new ATOM 0 HA ARG A 124 -83.985 -29.572 -35.664 1.00 1.00 H new ATOM 0 HB2 ARG A 124 -83.137 -30.778 -32.997 1.00 1.00 H new ATOM 0 HB3 ARG A 124 -84.542 -31.322 -33.892 1.00 1.00 H new ATOM 0 HG2 ARG A 124 -83.145 -31.963 -35.816 1.00 1.00 H new ATOM 0 HG3 ARG A 124 -81.723 -31.256 -35.075 1.00 1.00 H new ATOM 0 HD2 ARG A 124 -81.890 -32.902 -33.191 1.00 1.00 H new ATOM 0 HD3 ARG A 124 -83.306 -33.613 -33.942 1.00 1.00 H new ATOM 0 HE ARG A 124 -81.284 -33.626 -35.914 1.00 1.00 H new ATOM 0 HH11 ARG A 124 -81.775 -35.171 -32.773 1.00 1.00 H new ATOM 0 HH12 ARG A 124 -80.758 -36.546 -33.214 1.00 1.00 H new ATOM 0 HH21 ARG A 124 -80.016 -35.390 -36.376 1.00 1.00 H new ATOM 0 HH22 ARG A 124 -79.802 -36.665 -35.172 1.00 1.00 H new ATOM 1875 N LEU A 125 -84.585 -28.053 -32.792 1.00 1.00 N ATOM 1876 CA LEU A 125 -85.552 -27.199 -32.085 1.00 1.00 C ATOM 1877 C LEU A 125 -85.945 -25.976 -32.939 1.00 1.00 C ATOM 1878 O LEU A 125 -87.134 -25.675 -33.064 1.00 1.00 O ATOM 1879 CB LEU A 125 -84.959 -26.830 -30.706 1.00 1.00 C ATOM 1880 CG LEU A 125 -85.850 -26.079 -29.693 1.00 1.00 C ATOM 1881 CD1 LEU A 125 -85.947 -24.575 -29.962 1.00 1.00 C ATOM 1882 CD2 LEU A 125 -87.258 -26.663 -29.580 1.00 1.00 C ATOM 0 H LEU A 125 -83.690 -28.134 -32.309 1.00 1.00 H new ATOM 0 HA LEU A 125 -86.486 -27.735 -31.916 1.00 1.00 H new ATOM 0 HB2 LEU A 125 -84.625 -27.753 -30.232 1.00 1.00 H new ATOM 0 HB3 LEU A 125 -84.071 -26.222 -30.880 1.00 1.00 H new ATOM 0 HG LEU A 125 -85.338 -26.222 -28.741 1.00 1.00 H new ATOM 0 HD11 LEU A 125 -86.588 -24.112 -29.212 1.00 1.00 H new ATOM 0 HD12 LEU A 125 -84.952 -24.132 -29.913 1.00 1.00 H new ATOM 0 HD13 LEU A 125 -86.369 -24.409 -30.953 1.00 1.00 H new ATOM 0 HD21 LEU A 125 -87.832 -26.090 -28.852 1.00 1.00 H new ATOM 0 HD22 LEU A 125 -87.751 -26.614 -30.551 1.00 1.00 H new ATOM 0 HD23 LEU A 125 -87.196 -27.702 -29.256 1.00 1.00 H new ATOM 1894 N ARG A 126 -84.971 -25.300 -33.572 1.00 1.00 N ATOM 1895 CA ARG A 126 -85.219 -24.156 -34.476 1.00 1.00 C ATOM 1896 C ARG A 126 -86.020 -24.573 -35.717 1.00 1.00 C ATOM 1897 O ARG A 126 -86.929 -23.850 -36.123 1.00 1.00 O ATOM 1898 CB ARG A 126 -83.897 -23.468 -34.880 1.00 1.00 C ATOM 1899 CG ARG A 126 -83.453 -22.345 -33.924 1.00 1.00 C ATOM 1900 CD ARG A 126 -83.085 -22.843 -32.522 1.00 1.00 C ATOM 1901 NE ARG A 126 -82.567 -21.767 -31.660 1.00 1.00 N ATOM 1902 CZ ARG A 126 -83.237 -20.888 -30.942 1.00 1.00 C ATOM 1903 NH1 ARG A 126 -84.539 -20.816 -30.940 1.00 1.00 N ATOM 1904 NH2 ARG A 126 -82.573 -20.056 -30.198 1.00 1.00 N ATOM 0 H ARG A 126 -83.982 -25.531 -33.472 1.00 1.00 H new ATOM 0 HA ARG A 126 -85.822 -23.435 -33.924 1.00 1.00 H new ATOM 0 HB2 ARG A 126 -83.109 -24.220 -34.930 1.00 1.00 H new ATOM 0 HB3 ARG A 126 -84.007 -23.054 -35.882 1.00 1.00 H new ATOM 0 HG2 ARG A 126 -82.594 -21.831 -34.355 1.00 1.00 H new ATOM 0 HG3 ARG A 126 -84.255 -21.611 -33.841 1.00 1.00 H new ATOM 0 HD2 ARG A 126 -83.964 -23.287 -32.055 1.00 1.00 H new ATOM 0 HD3 ARG A 126 -82.336 -23.631 -32.605 1.00 1.00 H new ATOM 0 HE ARG A 126 -81.551 -21.692 -31.612 1.00 1.00 H new ATOM 0 HH11 ARG A 126 -85.086 -21.459 -31.512 1.00 1.00 H new ATOM 0 HH12 ARG A 126 -85.010 -20.117 -30.366 1.00 1.00 H new ATOM 0 HH21 ARG A 126 -81.554 -20.091 -30.178 1.00 1.00 H new ATOM 0 HH22 ARG A 126 -83.071 -19.367 -29.634 1.00 1.00 H new ATOM 1918 N GLU A 127 -85.719 -25.733 -36.307 1.00 1.00 N ATOM 1919 CA GLU A 127 -86.455 -26.271 -37.465 1.00 1.00 C ATOM 1920 C GLU A 127 -87.899 -26.678 -37.102 1.00 1.00 C ATOM 1921 O GLU A 127 -88.823 -26.455 -37.889 1.00 1.00 O ATOM 1922 CB GLU A 127 -85.709 -27.473 -38.070 1.00 1.00 C ATOM 1923 CG GLU A 127 -84.458 -27.051 -38.850 1.00 1.00 C ATOM 1924 CD GLU A 127 -83.786 -28.269 -39.512 1.00 1.00 C ATOM 1925 OE1 GLU A 127 -82.964 -28.955 -38.857 1.00 1.00 O ATOM 1926 OE2 GLU A 127 -84.072 -28.549 -40.704 1.00 1.00 O ATOM 0 H GLU A 127 -84.954 -26.332 -35.996 1.00 1.00 H new ATOM 0 HA GLU A 127 -86.512 -25.471 -38.203 1.00 1.00 H new ATOM 0 HB2 GLU A 127 -85.423 -28.159 -37.272 1.00 1.00 H new ATOM 0 HB3 GLU A 127 -86.381 -28.018 -38.733 1.00 1.00 H new ATOM 0 HG2 GLU A 127 -84.729 -26.321 -39.613 1.00 1.00 H new ATOM 0 HG3 GLU A 127 -83.753 -26.562 -38.178 1.00 1.00 H new ATOM 1933 N GLN A 128 -88.111 -27.251 -35.911 1.00 1.00 N ATOM 1934 CA GLN A 128 -89.422 -27.661 -35.395 1.00 1.00 C ATOM 1935 C GLN A 128 -90.321 -26.436 -35.155 1.00 1.00 C ATOM 1936 O GLN A 128 -91.555 -26.540 -35.215 1.00 1.00 O ATOM 1937 CB GLN A 128 -89.214 -28.499 -34.117 1.00 1.00 C ATOM 1938 CG GLN A 128 -90.497 -29.038 -33.458 1.00 1.00 C ATOM 1939 CD GLN A 128 -91.309 -29.959 -34.368 1.00 1.00 C ATOM 1940 OE1 GLN A 128 -91.122 -31.170 -34.406 1.00 1.00 O ATOM 1941 NE2 GLN A 128 -92.237 -29.432 -35.141 1.00 1.00 N ATOM 0 H GLN A 128 -87.351 -27.448 -35.260 1.00 1.00 H new ATOM 0 HA GLN A 128 -89.937 -28.279 -36.130 1.00 1.00 H new ATOM 0 HB2 GLN A 128 -88.569 -29.344 -34.359 1.00 1.00 H new ATOM 0 HB3 GLN A 128 -88.681 -27.890 -33.387 1.00 1.00 H new ATOM 0 HG2 GLN A 128 -90.230 -29.580 -32.551 1.00 1.00 H new ATOM 0 HG3 GLN A 128 -91.121 -28.197 -33.155 1.00 1.00 H new ATOM 0 HE21 GLN A 128 -92.406 -28.426 -35.122 1.00 1.00 H new ATOM 0 HE22 GLN A 128 -92.787 -30.030 -35.758 1.00 1.00 H new TER 1950 GLN A 128 HETATM 1951 ZN ZN A 129 -5.129 6.947 7.306 1.00 1.00 ZN HETATM 1952 ZN ZN A 130 -74.829 -24.088 -30.324 1.00 1.00 ZN