USER MOD reduce.3.24.130724 H: found=0, std=0, add=1135, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1137 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 132 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 135 GLN : amide:sc= -1.65 K(o=-1.7,f=-0.76) USER MOD Set 2.1: A 3 ASN : amide:sc= -1.78 K(o=-5.4,f=-3.6!) USER MOD Set 2.2: A 59 THR OG1 : rot 180:sc= 0 USER MOD Set 2.3: A 63 ASN : amide:sc= -3.64 K(o=-5.4,f=-3.6) USER MOD Set 3.1: A 23 TYR OH : rot 180:sc= -0.0332 USER MOD Set 3.2: A 86 CYS SG : rot 58:sc= 0.0179 USER MOD Set 4.1: A 21 MET CE :methyl -132:sc= -1.19 (180deg=-4.29!) USER MOD Set 4.2: A 28 CYS SG : rot 153:sc= -0.134 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 HIS : no HD1:sc= -0.757 X(o=-0.76,f=-0.46) USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 GLN : amide:sc= -3.68! C(o=-3.7!,f=-2.3!) USER MOD Single : A 15 HIS : no HE2:sc= -0.831 K(o=-0.83,f=-2.3!) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 CYS SG : rot -158:sc= -7.29! USER MOD Single : A 22 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.0298) USER MOD Single : A 24 CYS SG : rot -60:sc= -8.63! USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 GLN : amide:sc= -6.61! C(o=-6.6!,f=-15!) USER MOD Single : A 33 HIS : no HD1:sc= -0.0221 X(o=-0.022,f=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 MET CE :methyl -162:sc= 0 (180deg=-0.0534) USER MOD Single : A 46 GLN : amide:sc= -7.45! C(o=-7.4!,f=-7.4!) USER MOD Single : A 55 SER OG : rot 15:sc= -0.417 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 MET CE :methyl 153:sc= -6.53 (180deg=-10.3!) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 ASN : amide:sc= -4.18 K(o=-4.2,f=-11!) USER MOD Single : A 78 LYS NZ :NH3+ -139:sc= -0.106 (180deg=-1.5!) USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 81 ASN : amide:sc= 0 X(o=0,f=-0.0044) USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 84 ASN : amide:sc= -1.08 K(o=-1.1,f=-0.57) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot -9:sc= 0.0815 USER MOD Single : A 93 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 ASN : amide:sc= -6.4! C(o=-6.4!,f=-17!) USER MOD Single : A 104 LYS NZ :NH3+ -132:sc= -3.96 (180deg=-7.73!) USER MOD Single : A 106 SER OG : rot -125:sc= -0.208 USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 SER OG : rot 180:sc= -0.137 USER MOD Single : A 117 GLN : amide:sc= -5.09! K(o=-5.1!,f=-2.8) USER MOD Single : A 120 GLN : amide:sc= -6.99! C(o=-7!,f=-8.7!) USER MOD Single : A 122 MET CE :methyl 148:sc= -6.87! (180deg=-10.3!) USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 129 GLN : amide:sc= -8.1! C(o=-8.1!,f=-19!) USER MOD Single : A 138 GLN : amide:sc= -1.11 K(o=-1.1,f=-0.091) USER MOD Single : A 139 GLN : amide:sc= -0.0149 K(o=-0.015,f=-1.4) USER MOD ----------------------------------------------------------------- ATOM 20 N GLU A 2 -18.207 -0.522 -5.344 1.00 0.00 N ATOM 21 CA GLU A 2 -17.730 -1.524 -6.290 1.00 0.00 C ATOM 22 C GLU A 2 -16.206 -1.603 -6.282 1.00 0.00 C ATOM 23 O GLU A 2 -15.629 -2.651 -6.574 1.00 0.00 O ATOM 24 CB GLU A 2 -18.226 -1.198 -7.701 1.00 0.00 C ATOM 25 CG GLU A 2 -19.646 -1.668 -7.970 1.00 0.00 C ATOM 26 CD GLU A 2 -20.690 -0.719 -7.414 1.00 0.00 C ATOM 27 OE1 GLU A 2 -20.459 0.508 -7.457 1.00 0.00 O ATOM 28 OE2 GLU A 2 -21.737 -1.202 -6.936 1.00 0.00 O ATOM 0 HA GLU A 2 -18.127 -2.492 -5.984 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -18.173 -0.120 -7.856 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -17.556 -1.657 -8.428 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -19.792 -1.774 -9.045 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -19.787 -2.655 -7.531 1.00 0.00 H new ATOM 35 N ASN A 3 -15.560 -0.490 -5.949 1.00 0.00 N ATOM 36 CA ASN A 3 -14.107 -0.434 -5.905 1.00 0.00 C ATOM 37 C ASN A 3 -13.574 -0.981 -4.587 1.00 0.00 C ATOM 38 O ASN A 3 -12.478 -1.538 -4.531 1.00 0.00 O ATOM 39 CB ASN A 3 -13.636 1.008 -6.075 1.00 0.00 C ATOM 40 CG ASN A 3 -14.297 1.714 -7.239 1.00 0.00 C ATOM 41 OD1 ASN A 3 -14.985 1.094 -8.051 1.00 0.00 O ATOM 42 ND2 ASN A 3 -14.088 3.021 -7.322 1.00 0.00 N ATOM 0 H ASN A 3 -16.023 0.386 -5.706 1.00 0.00 H new ATOM 0 HA ASN A 3 -13.724 -1.049 -6.719 1.00 0.00 H new ATOM 0 HB2 ASN A 3 -13.840 1.561 -5.158 1.00 0.00 H new ATOM 0 HB3 ASN A 3 -12.556 1.017 -6.218 1.00 0.00 H new ATOM 0 HD21 ASN A 3 -14.505 3.557 -8.083 1.00 0.00 H new ATOM 0 HD22 ASN A 3 -13.510 3.490 -6.625 1.00 0.00 H new ATOM 49 N LEU A 4 -14.354 -0.811 -3.523 1.00 0.00 N ATOM 50 CA LEU A 4 -13.959 -1.274 -2.200 1.00 0.00 C ATOM 51 C LEU A 4 -13.570 -2.742 -2.230 1.00 0.00 C ATOM 52 O LEU A 4 -12.516 -3.128 -1.731 1.00 0.00 O ATOM 53 CB LEU A 4 -15.097 -1.054 -1.200 1.00 0.00 C ATOM 54 CG LEU A 4 -15.108 0.320 -0.528 1.00 0.00 C ATOM 55 CD1 LEU A 4 -16.536 0.774 -0.259 1.00 0.00 C ATOM 56 CD2 LEU A 4 -14.305 0.285 0.765 1.00 0.00 C ATOM 0 H LEU A 4 -15.266 -0.354 -3.554 1.00 0.00 H new ATOM 0 HA LEU A 4 -13.090 -0.696 -1.885 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -16.047 -1.198 -1.715 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -15.035 -1.820 -0.427 1.00 0.00 H new ATOM 0 HG LEU A 4 -14.643 1.038 -1.204 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -16.522 1.753 0.219 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -17.081 0.838 -1.201 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -17.028 0.056 0.397 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -14.323 1.270 1.231 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -14.742 -0.446 1.445 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -13.274 0.006 0.546 1.00 0.00 H new ATOM 68 N LYS A 5 -14.423 -3.558 -2.826 1.00 0.00 N ATOM 69 CA LYS A 5 -14.156 -4.988 -2.921 1.00 0.00 C ATOM 70 C LYS A 5 -12.946 -5.256 -3.807 1.00 0.00 C ATOM 71 O LYS A 5 -12.317 -6.310 -3.712 1.00 0.00 O ATOM 72 CB LYS A 5 -15.382 -5.728 -3.458 1.00 0.00 C ATOM 73 CG LYS A 5 -16.552 -5.755 -2.488 1.00 0.00 C ATOM 74 CD LYS A 5 -17.868 -5.459 -3.190 1.00 0.00 C ATOM 75 CE LYS A 5 -19.059 -5.761 -2.293 1.00 0.00 C ATOM 76 NZ LYS A 5 -19.924 -6.834 -2.860 1.00 0.00 N ATOM 0 H LYS A 5 -15.302 -3.260 -3.250 1.00 0.00 H new ATOM 0 HA LYS A 5 -13.936 -5.359 -1.920 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -15.702 -5.256 -4.387 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -15.100 -6.752 -3.702 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -16.606 -6.733 -2.009 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -16.387 -5.022 -1.698 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -17.894 -4.411 -3.490 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -17.937 -6.053 -4.101 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -18.704 -6.064 -1.308 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -19.648 -4.855 -2.155 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -20.724 -7.010 -2.219 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -20.284 -6.535 -3.789 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -19.369 -7.707 -2.968 1.00 0.00 H new ATOM 90 N HIS A 6 -12.610 -4.289 -4.652 1.00 0.00 N ATOM 91 CA HIS A 6 -11.459 -4.416 -5.536 1.00 0.00 C ATOM 92 C HIS A 6 -10.208 -3.925 -4.822 1.00 0.00 C ATOM 93 O HIS A 6 -9.100 -4.391 -5.085 1.00 0.00 O ATOM 94 CB HIS A 6 -11.678 -3.623 -6.826 1.00 0.00 C ATOM 95 CG HIS A 6 -11.203 -4.340 -8.053 1.00 0.00 C ATOM 96 ND1 HIS A 6 -11.414 -5.686 -8.266 1.00 0.00 N ATOM 97 CD2 HIS A 6 -10.523 -3.892 -9.136 1.00 0.00 C ATOM 98 CE1 HIS A 6 -10.884 -6.035 -9.425 1.00 0.00 C ATOM 99 NE2 HIS A 6 -10.339 -4.965 -9.972 1.00 0.00 N ATOM 0 H HIS A 6 -13.118 -3.409 -4.743 1.00 0.00 H new ATOM 0 HA HIS A 6 -11.333 -5.466 -5.799 1.00 0.00 H new ATOM 0 HB2 HIS A 6 -12.740 -3.402 -6.932 1.00 0.00 H new ATOM 0 HB3 HIS A 6 -11.159 -2.667 -6.749 1.00 0.00 H new ATOM 0 HD2 HIS A 6 -10.188 -2.880 -9.309 1.00 0.00 H new ATOM 0 HE1 HIS A 6 -10.895 -7.027 -9.852 1.00 0.00 H new ATOM 0 HE2 HIS A 6 -9.858 -4.939 -10.871 1.00 0.00 H new ATOM 108 N ILE A 7 -10.405 -2.985 -3.902 1.00 0.00 N ATOM 109 CA ILE A 7 -9.311 -2.426 -3.124 1.00 0.00 C ATOM 110 C ILE A 7 -8.991 -3.325 -1.936 1.00 0.00 C ATOM 111 O ILE A 7 -7.830 -3.639 -1.681 1.00 0.00 O ATOM 112 CB ILE A 7 -9.663 -1.016 -2.612 1.00 0.00 C ATOM 113 CG1 ILE A 7 -9.602 -0.016 -3.768 1.00 0.00 C ATOM 114 CG2 ILE A 7 -8.720 -0.587 -1.489 1.00 0.00 C ATOM 115 CD1 ILE A 7 -10.925 0.639 -4.099 1.00 0.00 C ATOM 0 H ILE A 7 -11.320 -2.594 -3.678 1.00 0.00 H new ATOM 0 HA ILE A 7 -8.440 -2.359 -3.776 1.00 0.00 H new ATOM 0 HB ILE A 7 -10.675 -1.038 -2.208 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -8.877 0.761 -3.523 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -9.232 -0.528 -4.656 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -8.992 0.412 -1.147 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -8.800 -1.289 -0.659 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -7.695 -0.577 -1.859 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -10.790 1.332 -4.929 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -11.650 -0.126 -4.379 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -11.290 1.183 -3.228 1.00 0.00 H new ATOM 127 N ILE A 8 -10.029 -3.734 -1.214 1.00 0.00 N ATOM 128 CA ILE A 8 -9.849 -4.595 -0.057 1.00 0.00 C ATOM 129 C ILE A 8 -9.222 -5.908 -0.479 1.00 0.00 C ATOM 130 O ILE A 8 -8.199 -6.331 0.059 1.00 0.00 O ATOM 131 CB ILE A 8 -11.185 -4.892 0.638 1.00 0.00 C ATOM 132 CG1 ILE A 8 -11.909 -3.592 0.989 1.00 0.00 C ATOM 133 CG2 ILE A 8 -10.961 -5.741 1.884 1.00 0.00 C ATOM 134 CD1 ILE A 8 -13.397 -3.769 1.201 1.00 0.00 C ATOM 0 H ILE A 8 -10.998 -3.483 -1.410 1.00 0.00 H new ATOM 0 HA ILE A 8 -9.197 -4.070 0.641 1.00 0.00 H new ATOM 0 HB ILE A 8 -11.815 -5.456 -0.050 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -11.468 -3.173 1.893 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -11.747 -2.868 0.190 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -11.919 -5.942 2.364 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -10.491 -6.683 1.602 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -10.313 -5.205 2.577 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -13.847 -2.807 1.447 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -13.850 -4.159 0.290 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -13.567 -4.469 2.019 1.00 0.00 H new ATOM 146 N THR A 9 -9.840 -6.541 -1.463 1.00 0.00 N ATOM 147 CA THR A 9 -9.340 -7.804 -1.982 1.00 0.00 C ATOM 148 C THR A 9 -7.906 -7.624 -2.455 1.00 0.00 C ATOM 149 O THR A 9 -7.032 -8.444 -2.171 1.00 0.00 O ATOM 150 CB THR A 9 -10.220 -8.301 -3.131 1.00 0.00 C ATOM 151 OG1 THR A 9 -10.071 -9.697 -3.312 1.00 0.00 O ATOM 152 CG2 THR A 9 -9.910 -7.631 -4.452 1.00 0.00 C ATOM 0 H THR A 9 -10.688 -6.202 -1.918 1.00 0.00 H new ATOM 0 HA THR A 9 -9.367 -8.550 -1.188 1.00 0.00 H new ATOM 0 HB THR A 9 -11.241 -8.049 -2.843 1.00 0.00 H new ATOM 0 HG1 THR A 9 -10.643 -9.994 -4.050 1.00 0.00 H new ATOM 0 HG21 THR A 9 -10.568 -8.028 -5.225 1.00 0.00 H new ATOM 0 HG22 THR A 9 -10.065 -6.556 -4.360 1.00 0.00 H new ATOM 0 HG23 THR A 9 -8.873 -7.826 -4.724 1.00 0.00 H new ATOM 160 N LEU A 10 -7.672 -6.526 -3.169 1.00 0.00 N ATOM 161 CA LEU A 10 -6.347 -6.217 -3.670 1.00 0.00 C ATOM 162 C LEU A 10 -5.417 -5.918 -2.510 1.00 0.00 C ATOM 163 O LEU A 10 -4.229 -6.236 -2.560 1.00 0.00 O ATOM 164 CB LEU A 10 -6.387 -5.032 -4.636 1.00 0.00 C ATOM 165 CG LEU A 10 -5.041 -4.670 -5.268 1.00 0.00 C ATOM 166 CD1 LEU A 10 -4.254 -5.927 -5.622 1.00 0.00 C ATOM 167 CD2 LEU A 10 -5.249 -3.807 -6.503 1.00 0.00 C ATOM 0 H LEU A 10 -8.386 -5.839 -3.411 1.00 0.00 H new ATOM 0 HA LEU A 10 -5.974 -7.083 -4.217 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -7.097 -5.255 -5.432 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -6.768 -4.161 -4.103 1.00 0.00 H new ATOM 0 HG LEU A 10 -4.464 -4.100 -4.540 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -3.301 -5.646 -6.070 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -4.073 -6.509 -4.719 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -4.825 -6.526 -6.331 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -4.282 -3.558 -6.940 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -5.847 -4.353 -7.232 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -5.767 -2.890 -6.223 1.00 0.00 H new ATOM 179 N GLY A 11 -5.966 -5.335 -1.446 1.00 0.00 N ATOM 180 CA GLY A 11 -5.155 -5.050 -0.288 1.00 0.00 C ATOM 181 C GLY A 11 -4.627 -6.333 0.308 1.00 0.00 C ATOM 182 O GLY A 11 -3.554 -6.357 0.908 1.00 0.00 O ATOM 0 H GLY A 11 -6.945 -5.060 -1.371 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -4.325 -4.402 -0.567 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -5.744 -4.511 0.454 1.00 0.00 H new ATOM 186 N GLN A 12 -5.388 -7.411 0.117 1.00 0.00 N ATOM 187 CA GLN A 12 -5.002 -8.719 0.614 1.00 0.00 C ATOM 188 C GLN A 12 -4.059 -9.400 -0.367 1.00 0.00 C ATOM 189 O GLN A 12 -3.180 -10.161 0.034 1.00 0.00 O ATOM 190 CB GLN A 12 -6.243 -9.565 0.870 1.00 0.00 C ATOM 191 CG GLN A 12 -7.106 -8.985 1.972 1.00 0.00 C ATOM 192 CD GLN A 12 -8.585 -9.202 1.755 1.00 0.00 C ATOM 193 OE1 GLN A 12 -9.002 -10.158 1.100 1.00 0.00 O ATOM 194 NE2 GLN A 12 -9.384 -8.303 2.311 1.00 0.00 N ATOM 0 H GLN A 12 -6.278 -7.397 -0.381 1.00 0.00 H new ATOM 0 HA GLN A 12 -4.471 -8.602 1.559 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -6.827 -9.639 -0.047 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -5.943 -10.578 1.139 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -6.817 -9.432 2.923 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -6.911 -7.915 2.051 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -8.988 -7.529 2.844 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -10.395 -8.385 2.206 1.00 0.00 H new ATOM 203 N VAL A 13 -4.211 -9.086 -1.651 1.00 0.00 N ATOM 204 CA VAL A 13 -3.330 -9.638 -2.664 1.00 0.00 C ATOM 205 C VAL A 13 -1.989 -8.942 -2.555 1.00 0.00 C ATOM 206 O VAL A 13 -0.960 -9.569 -2.309 1.00 0.00 O ATOM 207 CB VAL A 13 -3.896 -9.447 -4.081 1.00 0.00 C ATOM 208 CG1 VAL A 13 -2.802 -9.600 -5.129 1.00 0.00 C ATOM 209 CG2 VAL A 13 -5.028 -10.427 -4.329 1.00 0.00 C ATOM 0 H VAL A 13 -4.931 -8.457 -2.008 1.00 0.00 H new ATOM 0 HA VAL A 13 -3.230 -10.710 -2.495 1.00 0.00 H new ATOM 0 HB VAL A 13 -4.292 -8.435 -4.162 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -3.228 -9.460 -6.123 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -2.027 -8.853 -4.958 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -2.367 -10.597 -5.058 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -5.421 -10.282 -5.335 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -4.655 -11.446 -4.228 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -5.822 -10.257 -3.602 1.00 0.00 H new ATOM 219 N ILE A 14 -2.026 -7.624 -2.691 1.00 0.00 N ATOM 220 CA ILE A 14 -0.834 -6.805 -2.558 1.00 0.00 C ATOM 221 C ILE A 14 -0.047 -7.266 -1.338 1.00 0.00 C ATOM 222 O ILE A 14 1.179 -7.229 -1.317 1.00 0.00 O ATOM 223 CB ILE A 14 -1.222 -5.316 -2.396 1.00 0.00 C ATOM 224 CG1 ILE A 14 -0.932 -4.541 -3.676 1.00 0.00 C ATOM 225 CG2 ILE A 14 -0.513 -4.672 -1.212 1.00 0.00 C ATOM 226 CD1 ILE A 14 -1.585 -3.180 -3.694 1.00 0.00 C ATOM 0 H ILE A 14 -2.876 -7.098 -2.895 1.00 0.00 H new ATOM 0 HA ILE A 14 -0.223 -6.911 -3.454 1.00 0.00 H new ATOM 0 HB ILE A 14 -2.293 -5.279 -2.199 1.00 0.00 H new ATOM 0 HG12 ILE A 14 0.146 -4.424 -3.789 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -1.281 -5.118 -4.532 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -0.813 -3.627 -1.133 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -0.784 -5.197 -0.296 1.00 0.00 H new ATOM 0 HG23 ILE A 14 0.566 -4.730 -1.358 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -1.344 -2.673 -4.629 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -2.666 -3.294 -3.611 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -1.217 -2.589 -2.856 1.00 0.00 H new ATOM 238 N HIS A 15 -0.792 -7.703 -0.328 1.00 0.00 N ATOM 239 CA HIS A 15 -0.223 -8.186 0.918 1.00 0.00 C ATOM 240 C HIS A 15 0.183 -9.654 0.803 1.00 0.00 C ATOM 241 O HIS A 15 1.209 -10.060 1.345 1.00 0.00 O ATOM 242 CB HIS A 15 -1.242 -7.973 2.045 1.00 0.00 C ATOM 243 CG HIS A 15 -1.331 -9.085 3.042 1.00 0.00 C ATOM 244 ND1 HIS A 15 -2.316 -10.045 2.998 1.00 0.00 N ATOM 245 CD2 HIS A 15 -0.568 -9.377 4.120 1.00 0.00 C ATOM 246 CE1 HIS A 15 -2.161 -10.879 4.006 1.00 0.00 C ATOM 247 NE2 HIS A 15 -1.106 -10.498 4.703 1.00 0.00 N ATOM 0 H HIS A 15 -1.811 -7.731 -0.354 1.00 0.00 H new ATOM 0 HA HIS A 15 0.683 -7.624 1.146 1.00 0.00 H new ATOM 0 HB2 HIS A 15 -0.990 -7.053 2.572 1.00 0.00 H new ATOM 0 HB3 HIS A 15 -2.226 -7.826 1.600 1.00 0.00 H new ATOM 0 HD1 HIS A 15 -3.052 -10.102 2.294 1.00 0.00 H new ATOM 0 HD2 HIS A 15 0.300 -8.831 4.458 1.00 0.00 H new ATOM 0 HE1 HIS A 15 -2.790 -11.729 4.225 1.00 0.00 H new ATOM 256 N LYS A 16 -0.618 -10.451 0.095 1.00 0.00 N ATOM 257 CA LYS A 16 -0.303 -11.864 -0.071 1.00 0.00 C ATOM 258 C LYS A 16 0.944 -12.022 -0.934 1.00 0.00 C ATOM 259 O LYS A 16 1.823 -12.829 -0.630 1.00 0.00 O ATOM 260 CB LYS A 16 -1.493 -12.631 -0.667 1.00 0.00 C ATOM 261 CG LYS A 16 -1.583 -12.586 -2.185 1.00 0.00 C ATOM 262 CD LYS A 16 -2.953 -13.030 -2.664 1.00 0.00 C ATOM 263 CE LYS A 16 -3.053 -14.545 -2.752 1.00 0.00 C ATOM 264 NZ LYS A 16 -3.674 -14.986 -4.031 1.00 0.00 N ATOM 0 H LYS A 16 -1.476 -10.146 -0.365 1.00 0.00 H new ATOM 0 HA LYS A 16 -0.101 -12.293 0.911 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -1.431 -13.672 -0.351 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -2.415 -12.225 -0.250 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -1.383 -11.573 -2.534 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -0.817 -13.230 -2.617 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -3.716 -12.654 -1.983 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -3.156 -12.594 -3.642 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -2.058 -14.981 -2.662 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -3.641 -14.919 -1.914 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -3.724 -16.025 -4.053 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -4.633 -14.591 -4.105 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -3.099 -14.651 -4.830 1.00 0.00 H new ATOM 278 N ARG A 17 1.025 -11.231 -2.001 1.00 0.00 N ATOM 279 CA ARG A 17 2.181 -11.270 -2.885 1.00 0.00 C ATOM 280 C ARG A 17 3.404 -10.718 -2.165 1.00 0.00 C ATOM 281 O ARG A 17 4.522 -11.191 -2.363 1.00 0.00 O ATOM 282 CB ARG A 17 1.915 -10.466 -4.158 1.00 0.00 C ATOM 283 CG ARG A 17 0.575 -10.772 -4.805 1.00 0.00 C ATOM 284 CD ARG A 17 0.688 -10.830 -6.319 1.00 0.00 C ATOM 285 NE ARG A 17 -0.501 -11.416 -6.935 1.00 0.00 N ATOM 286 CZ ARG A 17 -0.525 -11.925 -8.164 1.00 0.00 C ATOM 287 NH1 ARG A 17 0.570 -11.920 -8.915 1.00 0.00 N ATOM 288 NH2 ARG A 17 -1.648 -12.441 -8.645 1.00 0.00 N ATOM 0 H ARG A 17 0.307 -10.559 -2.271 1.00 0.00 H new ATOM 0 HA ARG A 17 2.368 -12.307 -3.165 1.00 0.00 H new ATOM 0 HB2 ARG A 17 1.960 -9.403 -3.922 1.00 0.00 H new ATOM 0 HB3 ARG A 17 2.710 -10.667 -4.877 1.00 0.00 H new ATOM 0 HG2 ARG A 17 0.198 -11.724 -4.431 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -0.150 -10.008 -4.522 1.00 0.00 H new ATOM 0 HD2 ARG A 17 0.840 -9.824 -6.710 1.00 0.00 H new ATOM 0 HD3 ARG A 17 1.565 -11.415 -6.595 1.00 0.00 H new ATOM 0 HE ARG A 17 -1.363 -11.436 -6.390 1.00 0.00 H new ATOM 0 HH11 ARG A 17 1.437 -11.524 -8.551 1.00 0.00 H new ATOM 0 HH12 ARG A 17 0.545 -12.312 -9.856 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -2.492 -12.447 -8.073 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -1.667 -12.831 -9.587 1.00 0.00 H new ATOM 302 N CYS A 18 3.177 -9.721 -1.313 1.00 0.00 N ATOM 303 CA CYS A 18 4.255 -9.113 -0.547 1.00 0.00 C ATOM 304 C CYS A 18 4.631 -10.009 0.625 1.00 0.00 C ATOM 305 O CYS A 18 5.788 -10.057 1.039 1.00 0.00 O ATOM 306 CB CYS A 18 3.846 -7.729 -0.045 1.00 0.00 C ATOM 307 SG CYS A 18 4.864 -6.387 -0.689 1.00 0.00 S ATOM 0 H CYS A 18 2.256 -9.319 -1.138 1.00 0.00 H new ATOM 0 HA CYS A 18 5.122 -8.999 -1.198 1.00 0.00 H new ATOM 0 HB2 CYS A 18 2.807 -7.547 -0.318 1.00 0.00 H new ATOM 0 HB3 CYS A 18 3.896 -7.719 1.044 1.00 0.00 H new ATOM 0 HG CYS A 18 4.772 -5.357 0.098 1.00 0.00 H new ATOM 313 N GLU A 19 3.647 -10.731 1.144 1.00 0.00 N ATOM 314 CA GLU A 19 3.880 -11.643 2.251 1.00 0.00 C ATOM 315 C GLU A 19 4.794 -12.772 1.796 1.00 0.00 C ATOM 316 O GLU A 19 5.595 -13.293 2.572 1.00 0.00 O ATOM 317 CB GLU A 19 2.557 -12.208 2.769 1.00 0.00 C ATOM 318 CG GLU A 19 2.042 -11.504 4.015 1.00 0.00 C ATOM 319 CD GLU A 19 2.672 -12.037 5.287 1.00 0.00 C ATOM 320 OE1 GLU A 19 3.873 -12.380 5.257 1.00 0.00 O ATOM 321 OE2 GLU A 19 1.964 -12.111 6.314 1.00 0.00 O ATOM 0 H GLU A 19 2.682 -10.702 0.815 1.00 0.00 H new ATOM 0 HA GLU A 19 4.359 -11.098 3.064 1.00 0.00 H new ATOM 0 HB2 GLU A 19 1.806 -12.133 1.982 1.00 0.00 H new ATOM 0 HB3 GLU A 19 2.685 -13.268 2.987 1.00 0.00 H new ATOM 0 HG2 GLU A 19 2.243 -10.436 3.934 1.00 0.00 H new ATOM 0 HG3 GLU A 19 0.960 -11.621 4.073 1.00 0.00 H new ATOM 328 N GLU A 20 4.670 -13.138 0.522 1.00 0.00 N ATOM 329 CA GLU A 20 5.491 -14.201 -0.048 1.00 0.00 C ATOM 330 C GLU A 20 6.762 -13.642 -0.695 1.00 0.00 C ATOM 331 O GLU A 20 7.563 -14.394 -1.251 1.00 0.00 O ATOM 332 CB GLU A 20 4.688 -15.004 -1.076 1.00 0.00 C ATOM 333 CG GLU A 20 4.205 -14.181 -2.260 1.00 0.00 C ATOM 334 CD GLU A 20 5.298 -13.925 -3.279 1.00 0.00 C ATOM 335 OE1 GLU A 20 6.251 -14.730 -3.341 1.00 0.00 O ATOM 336 OE2 GLU A 20 5.198 -12.923 -4.018 1.00 0.00 O ATOM 0 H GLU A 20 4.011 -12.715 -0.132 1.00 0.00 H new ATOM 0 HA GLU A 20 5.789 -14.861 0.767 1.00 0.00 H new ATOM 0 HB2 GLU A 20 5.305 -15.824 -1.444 1.00 0.00 H new ATOM 0 HB3 GLU A 20 3.826 -15.450 -0.581 1.00 0.00 H new ATOM 0 HG2 GLU A 20 3.377 -14.699 -2.744 1.00 0.00 H new ATOM 0 HG3 GLU A 20 3.818 -13.227 -1.901 1.00 0.00 H new ATOM 343 N MET A 21 6.947 -12.323 -0.621 1.00 0.00 N ATOM 344 CA MET A 21 8.126 -11.683 -1.201 1.00 0.00 C ATOM 345 C MET A 21 9.400 -12.196 -0.548 1.00 0.00 C ATOM 346 O MET A 21 9.517 -12.225 0.676 1.00 0.00 O ATOM 347 CB MET A 21 8.049 -10.162 -1.051 1.00 0.00 C ATOM 348 CG MET A 21 7.307 -9.475 -2.186 1.00 0.00 C ATOM 349 SD MET A 21 8.164 -9.621 -3.763 1.00 0.00 S ATOM 350 CE MET A 21 8.580 -7.911 -4.093 1.00 0.00 C ATOM 0 H MET A 21 6.298 -11.680 -0.167 1.00 0.00 H new ATOM 0 HA MET A 21 8.148 -11.934 -2.261 1.00 0.00 H new ATOM 0 HB2 MET A 21 7.556 -9.923 -0.109 1.00 0.00 H new ATOM 0 HB3 MET A 21 9.060 -9.759 -0.993 1.00 0.00 H new ATOM 0 HG2 MET A 21 6.310 -9.907 -2.277 1.00 0.00 H new ATOM 0 HG3 MET A 21 7.177 -8.420 -1.944 1.00 0.00 H new ATOM 0 HE1 MET A 21 8.304 -7.660 -5.117 1.00 0.00 H new ATOM 0 HE2 MET A 21 8.038 -7.265 -3.402 1.00 0.00 H new ATOM 0 HE3 MET A 21 9.652 -7.765 -3.960 1.00 0.00 H new ATOM 360 N LYS A 22 10.356 -12.591 -1.378 1.00 0.00 N ATOM 361 CA LYS A 22 11.631 -13.094 -0.886 1.00 0.00 C ATOM 362 C LYS A 22 12.678 -11.985 -0.869 1.00 0.00 C ATOM 363 O LYS A 22 13.871 -12.249 -0.716 1.00 0.00 O ATOM 364 CB LYS A 22 12.114 -14.257 -1.755 1.00 0.00 C ATOM 365 CG LYS A 22 12.872 -15.322 -0.979 1.00 0.00 C ATOM 366 CD LYS A 22 11.925 -16.240 -0.223 1.00 0.00 C ATOM 367 CE LYS A 22 12.372 -17.690 -0.303 1.00 0.00 C ATOM 368 NZ LYS A 22 12.133 -18.271 -1.652 1.00 0.00 N ATOM 0 H LYS A 22 10.273 -12.573 -2.394 1.00 0.00 H new ATOM 0 HA LYS A 22 11.487 -13.450 0.134 1.00 0.00 H new ATOM 0 HB2 LYS A 22 11.254 -14.717 -2.242 1.00 0.00 H new ATOM 0 HB3 LYS A 22 12.757 -13.867 -2.544 1.00 0.00 H new ATOM 0 HG2 LYS A 22 13.480 -15.911 -1.666 1.00 0.00 H new ATOM 0 HG3 LYS A 22 13.556 -14.845 -0.277 1.00 0.00 H new ATOM 0 HD2 LYS A 22 11.874 -15.931 0.821 1.00 0.00 H new ATOM 0 HD3 LYS A 22 10.920 -16.145 -0.633 1.00 0.00 H new ATOM 0 HE2 LYS A 22 13.433 -17.757 -0.062 1.00 0.00 H new ATOM 0 HE3 LYS A 22 11.838 -18.276 0.445 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 12.258 -19.303 -1.613 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 11.164 -18.051 -1.958 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 12.810 -17.866 -2.329 1.00 0.00 H new ATOM 382 N TYR A 23 12.229 -10.741 -1.032 1.00 0.00 N ATOM 383 CA TYR A 23 13.140 -9.602 -1.037 1.00 0.00 C ATOM 384 C TYR A 23 12.502 -8.371 -0.402 1.00 0.00 C ATOM 385 O TYR A 23 11.285 -8.187 -0.458 1.00 0.00 O ATOM 386 CB TYR A 23 13.582 -9.287 -2.465 1.00 0.00 C ATOM 387 CG TYR A 23 14.813 -10.052 -2.894 1.00 0.00 C ATOM 388 CD1 TYR A 23 14.713 -11.347 -3.383 1.00 0.00 C ATOM 389 CD2 TYR A 23 16.076 -9.480 -2.804 1.00 0.00 C ATOM 390 CE1 TYR A 23 15.836 -12.052 -3.771 1.00 0.00 C ATOM 391 CE2 TYR A 23 17.205 -10.178 -3.192 1.00 0.00 C ATOM 392 CZ TYR A 23 17.078 -11.464 -3.674 1.00 0.00 C ATOM 393 OH TYR A 23 18.200 -12.163 -4.060 1.00 0.00 O ATOM 0 H TYR A 23 11.247 -10.499 -1.161 1.00 0.00 H new ATOM 0 HA TYR A 23 14.012 -9.871 -0.441 1.00 0.00 H new ATOM 0 HB2 TYR A 23 12.765 -9.515 -3.149 1.00 0.00 H new ATOM 0 HB3 TYR A 23 13.780 -8.218 -2.549 1.00 0.00 H new ATOM 0 HD1 TYR A 23 13.741 -11.811 -3.462 1.00 0.00 H new ATOM 0 HD2 TYR A 23 16.178 -8.474 -2.425 1.00 0.00 H new ATOM 0 HE1 TYR A 23 15.741 -13.059 -4.149 1.00 0.00 H new ATOM 0 HE2 TYR A 23 18.180 -9.719 -3.118 1.00 0.00 H new ATOM 0 HH TYR A 23 18.995 -11.605 -3.929 1.00 0.00 H new ATOM 403 N CYS A 24 13.343 -7.527 0.195 1.00 0.00 N ATOM 404 CA CYS A 24 12.894 -6.297 0.846 1.00 0.00 C ATOM 405 C CYS A 24 11.595 -6.507 1.623 1.00 0.00 C ATOM 406 O CYS A 24 10.671 -5.697 1.534 1.00 0.00 O ATOM 407 CB CYS A 24 12.709 -5.188 -0.190 1.00 0.00 C ATOM 408 SG CYS A 24 13.985 -5.150 -1.473 1.00 0.00 S ATOM 0 H CYS A 24 14.351 -7.676 0.241 1.00 0.00 H new ATOM 0 HA CYS A 24 13.664 -6.003 1.559 1.00 0.00 H new ATOM 0 HB2 CYS A 24 11.736 -5.309 -0.665 1.00 0.00 H new ATOM 0 HB3 CYS A 24 12.696 -4.226 0.322 1.00 0.00 H new ATOM 0 HG CYS A 24 15.148 -4.965 -0.923 1.00 0.00 H new ATOM 414 N LYS A 25 11.528 -7.595 2.384 1.00 0.00 N ATOM 415 CA LYS A 25 10.337 -7.900 3.169 1.00 0.00 C ATOM 416 C LYS A 25 9.959 -6.734 4.075 1.00 0.00 C ATOM 417 O LYS A 25 8.780 -6.461 4.291 1.00 0.00 O ATOM 418 CB LYS A 25 10.548 -9.155 4.010 1.00 0.00 C ATOM 419 CG LYS A 25 11.222 -10.291 3.256 1.00 0.00 C ATOM 420 CD LYS A 25 10.991 -11.628 3.943 1.00 0.00 C ATOM 421 CE LYS A 25 11.218 -12.793 2.992 1.00 0.00 C ATOM 422 NZ LYS A 25 12.434 -13.573 3.349 1.00 0.00 N ATOM 0 H LYS A 25 12.281 -8.277 2.474 1.00 0.00 H new ATOM 0 HA LYS A 25 9.521 -8.075 2.468 1.00 0.00 H new ATOM 0 HB2 LYS A 25 11.152 -8.900 4.881 1.00 0.00 H new ATOM 0 HB3 LYS A 25 9.583 -9.499 4.381 1.00 0.00 H new ATOM 0 HG2 LYS A 25 10.837 -10.332 2.237 1.00 0.00 H new ATOM 0 HG3 LYS A 25 12.292 -10.097 3.184 1.00 0.00 H new ATOM 0 HD2 LYS A 25 11.662 -11.719 4.798 1.00 0.00 H new ATOM 0 HD3 LYS A 25 9.973 -11.667 4.331 1.00 0.00 H new ATOM 0 HE2 LYS A 25 10.348 -13.450 3.008 1.00 0.00 H new ATOM 0 HE3 LYS A 25 11.314 -12.417 1.974 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 12.553 -14.358 2.677 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 13.268 -12.953 3.309 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 12.332 -13.954 4.311 1.00 0.00 H new ATOM 436 N LYS A 26 10.964 -6.041 4.603 1.00 0.00 N ATOM 437 CA LYS A 26 10.719 -4.901 5.480 1.00 0.00 C ATOM 438 C LYS A 26 9.712 -3.949 4.842 1.00 0.00 C ATOM 439 O LYS A 26 8.633 -3.709 5.386 1.00 0.00 O ATOM 440 CB LYS A 26 12.026 -4.162 5.772 1.00 0.00 C ATOM 441 CG LYS A 26 13.114 -5.054 6.345 1.00 0.00 C ATOM 442 CD LYS A 26 14.344 -4.251 6.735 1.00 0.00 C ATOM 443 CE LYS A 26 15.608 -5.093 6.659 1.00 0.00 C ATOM 444 NZ LYS A 26 16.836 -4.269 6.826 1.00 0.00 N ATOM 0 H LYS A 26 11.950 -6.247 4.440 1.00 0.00 H new ATOM 0 HA LYS A 26 10.308 -5.271 6.420 1.00 0.00 H new ATOM 0 HB2 LYS A 26 12.389 -3.706 4.851 1.00 0.00 H new ATOM 0 HB3 LYS A 26 11.826 -3.351 6.472 1.00 0.00 H new ATOM 0 HG2 LYS A 26 12.731 -5.582 7.218 1.00 0.00 H new ATOM 0 HG3 LYS A 26 13.390 -5.811 5.611 1.00 0.00 H new ATOM 0 HD2 LYS A 26 14.440 -3.388 6.076 1.00 0.00 H new ATOM 0 HD3 LYS A 26 14.222 -3.866 7.748 1.00 0.00 H new ATOM 0 HE2 LYS A 26 15.579 -5.862 7.431 1.00 0.00 H new ATOM 0 HE3 LYS A 26 15.644 -5.607 5.699 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 17.675 -4.881 6.768 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 16.878 -3.552 6.074 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 16.815 -3.798 7.753 1.00 0.00 H new ATOM 458 N GLN A 27 10.069 -3.425 3.677 1.00 0.00 N ATOM 459 CA GLN A 27 9.200 -2.512 2.949 1.00 0.00 C ATOM 460 C GLN A 27 8.031 -3.269 2.326 1.00 0.00 C ATOM 461 O GLN A 27 6.886 -2.821 2.378 1.00 0.00 O ATOM 462 CB GLN A 27 9.991 -1.787 1.858 1.00 0.00 C ATOM 463 CG GLN A 27 10.771 -0.586 2.364 1.00 0.00 C ATOM 464 CD GLN A 27 12.166 -0.508 1.778 1.00 0.00 C ATOM 465 OE1 GLN A 27 12.509 0.448 1.083 1.00 0.00 O ATOM 466 NE2 GLN A 27 12.981 -1.521 2.053 1.00 0.00 N ATOM 0 H GLN A 27 10.958 -3.618 3.215 1.00 0.00 H new ATOM 0 HA GLN A 27 8.807 -1.777 3.652 1.00 0.00 H new ATOM 0 HB2 GLN A 27 10.684 -2.490 1.396 1.00 0.00 H new ATOM 0 HB3 GLN A 27 9.302 -1.460 1.079 1.00 0.00 H new ATOM 0 HG2 GLN A 27 10.226 0.326 2.119 1.00 0.00 H new ATOM 0 HG3 GLN A 27 10.840 -0.634 3.451 1.00 0.00 H new ATOM 0 HE21 GLN A 27 12.656 -2.294 2.634 1.00 0.00 H new ATOM 0 HE22 GLN A 27 13.932 -1.526 1.683 1.00 0.00 H new ATOM 475 N CYS A 28 8.332 -4.419 1.731 1.00 0.00 N ATOM 476 CA CYS A 28 7.310 -5.237 1.090 1.00 0.00 C ATOM 477 C CYS A 28 6.195 -5.597 2.070 1.00 0.00 C ATOM 478 O CYS A 28 5.039 -5.227 1.869 1.00 0.00 O ATOM 479 CB CYS A 28 7.945 -6.507 0.518 1.00 0.00 C ATOM 480 SG CYS A 28 9.098 -6.203 -0.841 1.00 0.00 S ATOM 0 H CYS A 28 9.275 -4.805 1.680 1.00 0.00 H new ATOM 0 HA CYS A 28 6.867 -4.659 0.279 1.00 0.00 H new ATOM 0 HB2 CYS A 28 8.471 -7.030 1.317 1.00 0.00 H new ATOM 0 HB3 CYS A 28 7.154 -7.171 0.169 1.00 0.00 H new ATOM 0 HG CYS A 28 9.982 -7.156 -0.882 1.00 0.00 H new ATOM 486 N ARG A 29 6.544 -6.310 3.135 1.00 0.00 N ATOM 487 CA ARG A 29 5.560 -6.705 4.137 1.00 0.00 C ATOM 488 C ARG A 29 4.803 -5.495 4.674 1.00 0.00 C ATOM 489 O ARG A 29 3.640 -5.601 5.058 1.00 0.00 O ATOM 490 CB ARG A 29 6.242 -7.446 5.285 1.00 0.00 C ATOM 491 CG ARG A 29 7.006 -8.675 4.832 1.00 0.00 C ATOM 492 CD ARG A 29 7.728 -9.345 5.989 1.00 0.00 C ATOM 493 NE ARG A 29 8.728 -8.468 6.594 1.00 0.00 N ATOM 494 CZ ARG A 29 8.465 -7.597 7.567 1.00 0.00 C ATOM 495 NH1 ARG A 29 7.235 -7.478 8.051 1.00 0.00 N ATOM 496 NH2 ARG A 29 9.437 -6.841 8.056 1.00 0.00 N ATOM 0 H ARG A 29 7.495 -6.625 3.327 1.00 0.00 H new ATOM 0 HA ARG A 29 4.842 -7.370 3.658 1.00 0.00 H new ATOM 0 HB2 ARG A 29 6.927 -6.766 5.791 1.00 0.00 H new ATOM 0 HB3 ARG A 29 5.489 -7.743 6.015 1.00 0.00 H new ATOM 0 HG2 ARG A 29 6.316 -9.384 4.374 1.00 0.00 H new ATOM 0 HG3 ARG A 29 7.729 -8.393 4.066 1.00 0.00 H new ATOM 0 HD2 ARG A 29 7.002 -9.642 6.746 1.00 0.00 H new ATOM 0 HD3 ARG A 29 8.211 -10.256 5.636 1.00 0.00 H new ATOM 0 HE ARG A 29 9.687 -8.526 6.250 1.00 0.00 H new ATOM 0 HH11 ARG A 29 6.482 -8.056 7.678 1.00 0.00 H new ATOM 0 HH12 ARG A 29 7.043 -6.808 8.796 1.00 0.00 H new ATOM 0 HH21 ARG A 29 10.384 -6.927 7.687 1.00 0.00 H new ATOM 0 HH22 ARG A 29 9.238 -6.173 8.801 1.00 0.00 H new ATOM 510 N ARG A 30 5.471 -4.348 4.700 1.00 0.00 N ATOM 511 CA ARG A 30 4.856 -3.122 5.195 1.00 0.00 C ATOM 512 C ARG A 30 3.744 -2.647 4.271 1.00 0.00 C ATOM 513 O ARG A 30 2.654 -2.308 4.725 1.00 0.00 O ATOM 514 CB ARG A 30 5.900 -2.017 5.331 1.00 0.00 C ATOM 515 CG ARG A 30 6.750 -2.129 6.586 1.00 0.00 C ATOM 516 CD ARG A 30 6.159 -1.328 7.734 1.00 0.00 C ATOM 517 NE ARG A 30 6.648 -1.788 9.031 1.00 0.00 N ATOM 518 CZ ARG A 30 7.888 -1.581 9.471 1.00 0.00 C ATOM 519 NH1 ARG A 30 8.763 -0.920 8.724 1.00 0.00 N ATOM 520 NH2 ARG A 30 8.253 -2.037 10.661 1.00 0.00 N ATOM 0 H ARG A 30 6.435 -4.241 4.385 1.00 0.00 H new ATOM 0 HA ARG A 30 4.428 -3.345 6.173 1.00 0.00 H new ATOM 0 HB2 ARG A 30 6.553 -2.037 4.458 1.00 0.00 H new ATOM 0 HB3 ARG A 30 5.395 -1.051 5.330 1.00 0.00 H new ATOM 0 HG2 ARG A 30 6.834 -3.176 6.877 1.00 0.00 H new ATOM 0 HG3 ARG A 30 7.759 -1.775 6.376 1.00 0.00 H new ATOM 0 HD2 ARG A 30 6.407 -0.274 7.606 1.00 0.00 H new ATOM 0 HD3 ARG A 30 5.072 -1.405 7.708 1.00 0.00 H new ATOM 0 HE ARG A 30 6.003 -2.297 9.635 1.00 0.00 H new ATOM 0 HH11 ARG A 30 8.487 -0.567 7.807 1.00 0.00 H new ATOM 0 HH12 ARG A 30 9.711 -0.765 9.066 1.00 0.00 H new ATOM 0 HH21 ARG A 30 7.584 -2.546 11.239 1.00 0.00 H new ATOM 0 HH22 ARG A 30 9.202 -1.879 10.999 1.00 0.00 H new ATOM 534 N LEU A 31 4.028 -2.612 2.972 1.00 0.00 N ATOM 535 CA LEU A 31 3.045 -2.161 1.989 1.00 0.00 C ATOM 536 C LEU A 31 1.736 -2.926 2.136 1.00 0.00 C ATOM 537 O LEU A 31 0.666 -2.331 2.243 1.00 0.00 O ATOM 538 CB LEU A 31 3.594 -2.322 0.569 1.00 0.00 C ATOM 539 CG LEU A 31 2.602 -2.024 -0.563 1.00 0.00 C ATOM 540 CD1 LEU A 31 1.886 -0.696 -0.331 1.00 0.00 C ATOM 541 CD2 LEU A 31 3.322 -2.018 -1.904 1.00 0.00 C ATOM 0 H LEU A 31 4.926 -2.889 2.576 1.00 0.00 H new ATOM 0 HA LEU A 31 2.847 -1.105 2.172 1.00 0.00 H new ATOM 0 HB2 LEU A 31 4.456 -1.664 0.455 1.00 0.00 H new ATOM 0 HB3 LEU A 31 3.955 -3.344 0.452 1.00 0.00 H new ATOM 0 HG LEU A 31 1.848 -2.811 -0.573 1.00 0.00 H new ATOM 0 HD11 LEU A 31 1.189 -0.511 -1.149 1.00 0.00 H new ATOM 0 HD12 LEU A 31 1.338 -0.738 0.610 1.00 0.00 H new ATOM 0 HD13 LEU A 31 2.619 0.110 -0.289 1.00 0.00 H new ATOM 0 HD21 LEU A 31 2.608 -1.805 -2.699 1.00 0.00 H new ATOM 0 HD22 LEU A 31 4.097 -1.251 -1.898 1.00 0.00 H new ATOM 0 HD23 LEU A 31 3.778 -2.993 -2.077 1.00 0.00 H new ATOM 553 N GLY A 32 1.831 -4.249 2.145 1.00 0.00 N ATOM 554 CA GLY A 32 0.648 -5.073 2.282 1.00 0.00 C ATOM 555 C GLY A 32 -0.029 -4.895 3.626 1.00 0.00 C ATOM 556 O GLY A 32 -1.233 -4.647 3.693 1.00 0.00 O ATOM 0 H GLY A 32 2.706 -4.765 2.060 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -0.057 -4.826 1.488 1.00 0.00 H new ATOM 0 HA3 GLY A 32 0.921 -6.120 2.152 1.00 0.00 H new ATOM 560 N HIS A 33 0.744 -5.027 4.699 1.00 0.00 N ATOM 561 CA HIS A 33 0.202 -4.881 6.044 1.00 0.00 C ATOM 562 C HIS A 33 -0.357 -3.478 6.252 1.00 0.00 C ATOM 563 O HIS A 33 -1.369 -3.302 6.931 1.00 0.00 O ATOM 564 CB HIS A 33 1.274 -5.185 7.093 1.00 0.00 C ATOM 565 CG HIS A 33 0.781 -6.042 8.216 1.00 0.00 C ATOM 566 ND1 HIS A 33 0.795 -5.638 9.535 1.00 0.00 N ATOM 567 CD2 HIS A 33 0.254 -7.290 8.214 1.00 0.00 C ATOM 568 CE1 HIS A 33 0.300 -6.599 10.294 1.00 0.00 C ATOM 569 NE2 HIS A 33 -0.037 -7.612 9.517 1.00 0.00 N ATOM 0 H HIS A 33 1.742 -5.234 4.664 1.00 0.00 H new ATOM 0 HA HIS A 33 -0.611 -5.597 6.160 1.00 0.00 H new ATOM 0 HB2 HIS A 33 2.115 -5.682 6.609 1.00 0.00 H new ATOM 0 HB3 HIS A 33 1.650 -4.246 7.500 1.00 0.00 H new ATOM 0 HD2 HIS A 33 0.093 -7.916 7.349 1.00 0.00 H new ATOM 0 HE1 HIS A 33 0.190 -6.562 11.368 1.00 0.00 H new ATOM 0 HE2 HIS A 33 -0.447 -8.491 9.833 1.00 0.00 H new ATOM 578 N ARG A 34 0.289 -2.481 5.652 1.00 0.00 N ATOM 579 CA ARG A 34 -0.180 -1.110 5.770 1.00 0.00 C ATOM 580 C ARG A 34 -1.397 -0.925 4.884 1.00 0.00 C ATOM 581 O ARG A 34 -2.407 -0.359 5.303 1.00 0.00 O ATOM 582 CB ARG A 34 0.920 -0.117 5.394 1.00 0.00 C ATOM 583 CG ARG A 34 1.882 0.168 6.537 1.00 0.00 C ATOM 584 CD ARG A 34 3.332 0.051 6.097 1.00 0.00 C ATOM 585 NE ARG A 34 4.181 1.051 6.739 1.00 0.00 N ATOM 586 CZ ARG A 34 4.411 1.099 8.050 1.00 0.00 C ATOM 587 NH1 ARG A 34 3.869 0.199 8.861 1.00 0.00 N ATOM 588 NH2 ARG A 34 5.191 2.047 8.552 1.00 0.00 N ATOM 0 H ARG A 34 1.129 -2.598 5.086 1.00 0.00 H new ATOM 0 HA ARG A 34 -0.453 -0.915 6.807 1.00 0.00 H new ATOM 0 HB2 ARG A 34 1.480 -0.509 4.545 1.00 0.00 H new ATOM 0 HB3 ARG A 34 0.462 0.818 5.070 1.00 0.00 H new ATOM 0 HG2 ARG A 34 1.699 1.170 6.924 1.00 0.00 H new ATOM 0 HG3 ARG A 34 1.693 -0.529 7.354 1.00 0.00 H new ATOM 0 HD2 ARG A 34 3.703 -0.946 6.334 1.00 0.00 H new ATOM 0 HD3 ARG A 34 3.393 0.165 5.015 1.00 0.00 H new ATOM 0 HE ARG A 34 4.624 1.755 6.148 1.00 0.00 H new ATOM 0 HH11 ARG A 34 3.272 -0.536 8.481 1.00 0.00 H new ATOM 0 HH12 ARG A 34 4.050 0.242 9.864 1.00 0.00 H new ATOM 0 HH21 ARG A 34 5.615 2.739 7.934 1.00 0.00 H new ATOM 0 HH22 ARG A 34 5.367 2.084 9.556 1.00 0.00 H new ATOM 602 N VAL A 35 -1.305 -1.444 3.663 1.00 0.00 N ATOM 603 CA VAL A 35 -2.418 -1.374 2.726 1.00 0.00 C ATOM 604 C VAL A 35 -3.664 -1.969 3.379 1.00 0.00 C ATOM 605 O VAL A 35 -4.727 -1.347 3.399 1.00 0.00 O ATOM 606 CB VAL A 35 -2.101 -2.127 1.414 1.00 0.00 C ATOM 607 CG1 VAL A 35 -3.375 -2.474 0.654 1.00 0.00 C ATOM 608 CG2 VAL A 35 -1.166 -1.303 0.541 1.00 0.00 C ATOM 0 H VAL A 35 -0.475 -1.915 3.302 1.00 0.00 H new ATOM 0 HA VAL A 35 -2.592 -0.328 2.475 1.00 0.00 H new ATOM 0 HB VAL A 35 -1.603 -3.061 1.675 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -3.118 -3.003 -0.264 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -4.007 -3.109 1.274 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -3.912 -1.558 0.407 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -0.953 -1.848 -0.379 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -1.639 -0.352 0.298 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -0.235 -1.119 1.078 1.00 0.00 H new ATOM 618 N LEU A 36 -3.511 -3.171 3.937 1.00 0.00 N ATOM 619 CA LEU A 36 -4.610 -3.848 4.623 1.00 0.00 C ATOM 620 C LEU A 36 -5.259 -2.904 5.626 1.00 0.00 C ATOM 621 O LEU A 36 -6.481 -2.805 5.704 1.00 0.00 O ATOM 622 CB LEU A 36 -4.097 -5.089 5.368 1.00 0.00 C ATOM 623 CG LEU A 36 -3.819 -6.325 4.506 1.00 0.00 C ATOM 624 CD1 LEU A 36 -3.817 -7.578 5.365 1.00 0.00 C ATOM 625 CD2 LEU A 36 -4.846 -6.458 3.399 1.00 0.00 C ATOM 0 H LEU A 36 -2.636 -3.695 3.927 1.00 0.00 H new ATOM 0 HA LEU A 36 -5.342 -4.153 3.875 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -3.178 -4.821 5.890 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -4.829 -5.359 6.129 1.00 0.00 H new ATOM 0 HG LEU A 36 -2.836 -6.204 4.050 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -3.618 -8.448 4.739 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -3.043 -7.495 6.128 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -4.789 -7.691 5.846 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -4.625 -7.343 2.802 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -5.841 -6.553 3.835 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -4.812 -5.574 2.763 1.00 0.00 H new ATOM 637 N GLY A 37 -4.418 -2.214 6.391 1.00 0.00 N ATOM 638 CA GLY A 37 -4.908 -1.280 7.389 1.00 0.00 C ATOM 639 C GLY A 37 -5.808 -0.216 6.797 1.00 0.00 C ATOM 640 O GLY A 37 -6.716 0.279 7.463 1.00 0.00 O ATOM 0 H GLY A 37 -3.402 -2.286 6.337 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -5.455 -1.828 8.157 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -4.061 -0.802 7.881 1.00 0.00 H new ATOM 644 N LEU A 38 -5.559 0.134 5.540 1.00 0.00 N ATOM 645 CA LEU A 38 -6.361 1.139 4.852 1.00 0.00 C ATOM 646 C LEU A 38 -7.715 0.549 4.492 1.00 0.00 C ATOM 647 O LEU A 38 -8.730 1.245 4.461 1.00 0.00 O ATOM 648 CB LEU A 38 -5.644 1.621 3.589 1.00 0.00 C ATOM 649 CG LEU A 38 -4.362 2.417 3.836 1.00 0.00 C ATOM 650 CD1 LEU A 38 -3.777 2.902 2.521 1.00 0.00 C ATOM 651 CD2 LEU A 38 -4.630 3.591 4.770 1.00 0.00 C ATOM 0 H LEU A 38 -4.808 -0.264 4.976 1.00 0.00 H new ATOM 0 HA LEU A 38 -6.504 1.993 5.514 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -5.402 0.754 2.974 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -6.332 2.239 3.013 1.00 0.00 H new ATOM 0 HG LEU A 38 -3.636 1.760 4.315 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -2.865 3.467 2.715 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -3.546 2.045 1.888 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -4.500 3.542 2.015 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -3.705 4.145 4.933 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -5.373 4.250 4.322 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -5.003 3.219 5.724 1.00 0.00 H new ATOM 663 N ILE A 39 -7.712 -0.752 4.237 1.00 0.00 N ATOM 664 CA ILE A 39 -8.917 -1.485 3.894 1.00 0.00 C ATOM 665 C ILE A 39 -9.596 -2.001 5.161 1.00 0.00 C ATOM 666 O ILE A 39 -10.776 -2.353 5.153 1.00 0.00 O ATOM 667 CB ILE A 39 -8.592 -2.661 2.932 1.00 0.00 C ATOM 668 CG1 ILE A 39 -8.593 -4.013 3.662 1.00 0.00 C ATOM 669 CG2 ILE A 39 -7.244 -2.433 2.260 1.00 0.00 C ATOM 670 CD1 ILE A 39 -7.867 -5.115 2.911 1.00 0.00 C ATOM 0 H ILE A 39 -6.871 -1.328 4.263 1.00 0.00 H new ATOM 0 HA ILE A 39 -9.600 -0.808 3.381 1.00 0.00 H new ATOM 0 HB ILE A 39 -9.375 -2.692 2.174 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -8.130 -3.887 4.641 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -9.624 -4.322 3.834 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -7.027 -3.264 1.588 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -7.274 -1.504 1.691 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -6.465 -2.368 3.020 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -7.910 -6.038 3.489 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -8.343 -5.270 1.943 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -6.826 -4.829 2.762 1.00 0.00 H new ATOM 682 N LYS A 40 -8.826 -2.047 6.248 1.00 0.00 N ATOM 683 CA LYS A 40 -9.329 -2.525 7.535 1.00 0.00 C ATOM 684 C LYS A 40 -10.624 -1.816 7.942 1.00 0.00 C ATOM 685 O LYS A 40 -11.662 -2.457 8.093 1.00 0.00 O ATOM 686 CB LYS A 40 -8.271 -2.339 8.626 1.00 0.00 C ATOM 687 CG LYS A 40 -7.250 -3.465 8.692 1.00 0.00 C ATOM 688 CD LYS A 40 -7.919 -4.827 8.792 1.00 0.00 C ATOM 689 CE LYS A 40 -6.957 -5.883 9.312 1.00 0.00 C ATOM 690 NZ LYS A 40 -7.557 -7.247 9.279 1.00 0.00 N ATOM 0 H LYS A 40 -7.848 -1.758 6.262 1.00 0.00 H new ATOM 0 HA LYS A 40 -9.550 -3.586 7.421 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -7.749 -1.398 8.455 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -8.770 -2.257 9.592 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -6.617 -3.435 7.805 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -6.599 -3.316 9.553 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -8.782 -4.762 9.454 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -8.291 -5.124 7.811 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -6.047 -5.872 8.712 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -6.668 -5.638 10.334 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -6.869 -7.938 9.642 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -8.411 -7.265 9.872 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -7.810 -7.491 8.300 1.00 0.00 H new ATOM 704 N PRO A 41 -10.590 -0.484 8.135 1.00 0.00 N ATOM 705 CA PRO A 41 -11.779 0.274 8.531 1.00 0.00 C ATOM 706 C PRO A 41 -12.914 0.112 7.532 1.00 0.00 C ATOM 707 O PRO A 41 -14.088 0.113 7.905 1.00 0.00 O ATOM 708 CB PRO A 41 -11.300 1.732 8.588 1.00 0.00 C ATOM 709 CG PRO A 41 -9.997 1.758 7.860 1.00 0.00 C ATOM 710 CD PRO A 41 -9.407 0.379 7.987 1.00 0.00 C ATOM 0 HA PRO A 41 -12.182 -0.074 9.482 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -12.023 2.400 8.120 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -11.179 2.064 9.619 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -10.143 2.022 6.813 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -9.329 2.506 8.287 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -8.820 0.110 7.108 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -8.744 0.303 8.849 1.00 0.00 H new ATOM 718 N LEU A 42 -12.562 -0.048 6.262 1.00 0.00 N ATOM 719 CA LEU A 42 -13.565 -0.232 5.225 1.00 0.00 C ATOM 720 C LEU A 42 -14.281 -1.555 5.425 1.00 0.00 C ATOM 721 O LEU A 42 -15.490 -1.655 5.225 1.00 0.00 O ATOM 722 CB LEU A 42 -12.929 -0.207 3.841 1.00 0.00 C ATOM 723 CG LEU A 42 -11.979 0.956 3.578 1.00 0.00 C ATOM 724 CD1 LEU A 42 -11.182 0.692 2.315 1.00 0.00 C ATOM 725 CD2 LEU A 42 -12.751 2.263 3.467 1.00 0.00 C ATOM 0 H LEU A 42 -11.598 -0.054 5.929 1.00 0.00 H new ATOM 0 HA LEU A 42 -14.280 0.588 5.297 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -12.384 -1.139 3.693 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -13.723 -0.181 3.095 1.00 0.00 H new ATOM 0 HG LEU A 42 -11.288 1.045 4.416 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -10.505 1.526 2.131 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -10.605 -0.225 2.434 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -11.863 0.585 1.471 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -12.056 3.081 3.279 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -13.463 2.196 2.645 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -13.287 2.449 4.397 1.00 0.00 H new ATOM 737 N GLU A 43 -13.526 -2.572 5.830 1.00 0.00 N ATOM 738 CA GLU A 43 -14.099 -3.889 6.065 1.00 0.00 C ATOM 739 C GLU A 43 -15.290 -3.780 7.013 1.00 0.00 C ATOM 740 O GLU A 43 -16.242 -4.554 6.927 1.00 0.00 O ATOM 741 CB GLU A 43 -13.049 -4.843 6.639 1.00 0.00 C ATOM 742 CG GLU A 43 -12.425 -5.757 5.599 1.00 0.00 C ATOM 743 CD GLU A 43 -11.690 -6.930 6.220 1.00 0.00 C ATOM 744 OE1 GLU A 43 -12.359 -7.812 6.797 1.00 0.00 O ATOM 745 OE2 GLU A 43 -10.445 -6.965 6.129 1.00 0.00 O ATOM 0 H GLU A 43 -12.522 -2.508 6.001 1.00 0.00 H new ATOM 0 HA GLU A 43 -14.441 -4.292 5.112 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -12.262 -4.259 7.116 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -13.510 -5.452 7.416 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -13.204 -6.131 4.935 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -11.732 -5.182 4.985 1.00 0.00 H new ATOM 752 N MET A 44 -15.236 -2.798 7.907 1.00 0.00 N ATOM 753 CA MET A 44 -16.318 -2.575 8.856 1.00 0.00 C ATOM 754 C MET A 44 -17.415 -1.721 8.222 1.00 0.00 C ATOM 755 O MET A 44 -18.563 -1.738 8.661 1.00 0.00 O ATOM 756 CB MET A 44 -15.786 -1.887 10.114 1.00 0.00 C ATOM 757 CG MET A 44 -14.585 -2.586 10.730 1.00 0.00 C ATOM 758 SD MET A 44 -13.511 -1.456 11.635 1.00 0.00 S ATOM 759 CE MET A 44 -11.970 -2.369 11.621 1.00 0.00 C ATOM 0 H MET A 44 -14.456 -2.146 7.993 1.00 0.00 H new ATOM 0 HA MET A 44 -16.739 -3.542 9.132 1.00 0.00 H new ATOM 0 HB2 MET A 44 -15.512 -0.861 9.868 1.00 0.00 H new ATOM 0 HB3 MET A 44 -16.584 -1.835 10.854 1.00 0.00 H new ATOM 0 HG2 MET A 44 -14.932 -3.369 11.404 1.00 0.00 H new ATOM 0 HG3 MET A 44 -14.011 -3.074 9.943 1.00 0.00 H new ATOM 0 HE1 MET A 44 -11.307 -1.976 12.392 1.00 0.00 H new ATOM 0 HE2 MET A 44 -12.170 -3.423 11.817 1.00 0.00 H new ATOM 0 HE3 MET A 44 -11.494 -2.265 10.646 1.00 0.00 H new ATOM 769 N LEU A 45 -17.044 -0.965 7.191 1.00 0.00 N ATOM 770 CA LEU A 45 -17.983 -0.093 6.497 1.00 0.00 C ATOM 771 C LEU A 45 -18.662 -0.801 5.322 1.00 0.00 C ATOM 772 O LEU A 45 -19.888 -0.906 5.276 1.00 0.00 O ATOM 773 CB LEU A 45 -17.258 1.157 5.994 1.00 0.00 C ATOM 774 CG LEU A 45 -17.480 2.418 6.828 1.00 0.00 C ATOM 775 CD1 LEU A 45 -16.625 2.384 8.085 1.00 0.00 C ATOM 776 CD2 LEU A 45 -17.171 3.659 6.002 1.00 0.00 C ATOM 0 H LEU A 45 -16.095 -0.940 6.818 1.00 0.00 H new ATOM 0 HA LEU A 45 -18.758 0.187 7.210 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -16.189 0.948 5.959 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -17.578 1.356 4.971 1.00 0.00 H new ATOM 0 HG LEU A 45 -18.527 2.455 7.129 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -16.796 3.290 8.666 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -16.892 1.513 8.683 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -15.573 2.325 7.808 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -17.334 4.550 6.609 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -16.132 3.628 5.674 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -17.826 3.689 5.131 1.00 0.00 H new ATOM 788 N GLN A 46 -17.863 -1.260 4.358 1.00 0.00 N ATOM 789 CA GLN A 46 -18.403 -1.923 3.173 1.00 0.00 C ATOM 790 C GLN A 46 -18.740 -3.396 3.422 1.00 0.00 C ATOM 791 O GLN A 46 -19.807 -3.864 3.025 1.00 0.00 O ATOM 792 CB GLN A 46 -17.418 -1.797 2.007 1.00 0.00 C ATOM 793 CG GLN A 46 -16.156 -2.630 2.168 1.00 0.00 C ATOM 794 CD GLN A 46 -16.333 -4.056 1.685 1.00 0.00 C ATOM 795 OE1 GLN A 46 -17.018 -4.308 0.693 1.00 0.00 O ATOM 796 NE2 GLN A 46 -15.715 -5.000 2.386 1.00 0.00 N ATOM 0 H GLN A 46 -16.846 -1.185 4.375 1.00 0.00 H new ATOM 0 HA GLN A 46 -19.338 -1.421 2.923 1.00 0.00 H new ATOM 0 HB2 GLN A 46 -17.921 -2.093 1.087 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -17.137 -0.750 1.894 1.00 0.00 H new ATOM 0 HG2 GLN A 46 -15.343 -2.161 1.614 1.00 0.00 H new ATOM 0 HG3 GLN A 46 -15.863 -2.640 3.218 1.00 0.00 H new ATOM 0 HE21 GLN A 46 -15.157 -4.747 3.202 1.00 0.00 H new ATOM 0 HE22 GLN A 46 -15.798 -5.978 2.109 1.00 0.00 H new ATOM 805 N ASP A 47 -17.832 -4.127 4.059 1.00 0.00 N ATOM 806 CA ASP A 47 -18.054 -5.546 4.326 1.00 0.00 C ATOM 807 C ASP A 47 -19.235 -5.758 5.270 1.00 0.00 C ATOM 808 O ASP A 47 -20.268 -6.298 4.873 1.00 0.00 O ATOM 809 CB ASP A 47 -16.795 -6.189 4.909 1.00 0.00 C ATOM 810 CG ASP A 47 -16.412 -7.468 4.189 1.00 0.00 C ATOM 811 OD1 ASP A 47 -16.351 -7.452 2.942 1.00 0.00 O ATOM 812 OD2 ASP A 47 -16.172 -8.486 4.873 1.00 0.00 O ATOM 0 H ASP A 47 -16.941 -3.765 4.399 1.00 0.00 H new ATOM 0 HA ASP A 47 -18.289 -6.025 3.376 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -15.968 -5.481 4.850 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -16.956 -6.404 5.965 1.00 0.00 H new ATOM 928 N SER A 55 -20.912 7.534 -4.055 1.00 0.00 N ATOM 929 CA SER A 55 -20.909 8.934 -4.461 1.00 0.00 C ATOM 930 C SER A 55 -19.866 9.186 -5.543 1.00 0.00 C ATOM 931 O SER A 55 -18.904 8.430 -5.681 1.00 0.00 O ATOM 932 CB SER A 55 -20.638 9.836 -3.256 1.00 0.00 C ATOM 933 OG SER A 55 -21.071 9.226 -2.053 1.00 0.00 O ATOM 0 HA SER A 55 -21.892 9.169 -4.869 1.00 0.00 H new ATOM 0 HB2 SER A 55 -19.572 10.053 -3.193 1.00 0.00 H new ATOM 0 HB3 SER A 55 -21.150 10.789 -3.389 1.00 0.00 H new ATOM 0 HG SER A 55 -21.231 8.272 -2.209 1.00 0.00 H new ATOM 939 N GLU A 56 -20.062 10.254 -6.311 1.00 0.00 N ATOM 940 CA GLU A 56 -19.137 10.605 -7.382 1.00 0.00 C ATOM 941 C GLU A 56 -17.739 10.866 -6.831 1.00 0.00 C ATOM 942 O GLU A 56 -16.739 10.546 -7.473 1.00 0.00 O ATOM 943 CB GLU A 56 -19.640 11.838 -8.134 1.00 0.00 C ATOM 944 CG GLU A 56 -18.826 12.168 -9.375 1.00 0.00 C ATOM 945 CD GLU A 56 -19.475 13.240 -10.229 1.00 0.00 C ATOM 946 OE1 GLU A 56 -19.529 14.404 -9.782 1.00 0.00 O ATOM 947 OE2 GLU A 56 -19.929 12.914 -11.347 1.00 0.00 O ATOM 0 H GLU A 56 -20.853 10.890 -6.211 1.00 0.00 H new ATOM 0 HA GLU A 56 -19.084 9.763 -8.072 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -20.679 11.678 -8.423 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -19.624 12.695 -7.461 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -17.832 12.500 -9.076 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -18.695 11.264 -9.970 1.00 0.00 H new ATOM 954 N LYS A 57 -17.678 11.449 -5.638 1.00 0.00 N ATOM 955 CA LYS A 57 -16.402 11.751 -5.000 1.00 0.00 C ATOM 956 C LYS A 57 -15.815 10.505 -4.344 1.00 0.00 C ATOM 957 O LYS A 57 -14.647 10.175 -4.549 1.00 0.00 O ATOM 958 CB LYS A 57 -16.576 12.857 -3.957 1.00 0.00 C ATOM 959 CG LYS A 57 -15.997 14.195 -4.387 1.00 0.00 C ATOM 960 CD LYS A 57 -16.489 15.326 -3.498 1.00 0.00 C ATOM 961 CE LYS A 57 -15.379 16.319 -3.195 1.00 0.00 C ATOM 962 NZ LYS A 57 -15.750 17.249 -2.093 1.00 0.00 N ATOM 0 H LYS A 57 -18.497 11.721 -5.094 1.00 0.00 H new ATOM 0 HA LYS A 57 -15.712 12.095 -5.770 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -17.638 12.981 -3.745 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -16.100 12.546 -3.027 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -14.909 14.150 -4.352 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -16.274 14.397 -5.422 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -17.316 15.841 -3.987 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -16.876 14.915 -2.565 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -14.472 15.778 -2.924 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -15.151 16.893 -4.093 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -14.966 17.910 -1.918 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -16.600 17.784 -2.362 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -15.943 16.704 -1.229 1.00 0.00 H new ATOM 976 N LEU A 58 -16.634 9.817 -3.555 1.00 0.00 N ATOM 977 CA LEU A 58 -16.197 8.605 -2.870 1.00 0.00 C ATOM 978 C LEU A 58 -15.650 7.589 -3.867 1.00 0.00 C ATOM 979 O LEU A 58 -14.581 7.017 -3.662 1.00 0.00 O ATOM 980 CB LEU A 58 -17.356 7.994 -2.082 1.00 0.00 C ATOM 981 CG LEU A 58 -17.038 6.674 -1.374 1.00 0.00 C ATOM 982 CD1 LEU A 58 -15.755 6.794 -0.565 1.00 0.00 C ATOM 983 CD2 LEU A 58 -18.196 6.258 -0.478 1.00 0.00 C ATOM 0 H LEU A 58 -17.603 10.078 -3.374 1.00 0.00 H new ATOM 0 HA LEU A 58 -15.400 8.873 -2.177 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -17.689 8.717 -1.337 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -18.191 7.831 -2.763 1.00 0.00 H new ATOM 0 HG LEU A 58 -16.894 5.905 -2.132 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -15.547 5.845 -0.070 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -14.928 7.046 -1.229 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -15.869 7.577 0.185 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -17.953 5.318 0.017 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -18.371 7.029 0.272 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -19.095 6.129 -1.081 1.00 0.00 H new ATOM 995 N THR A 59 -16.390 7.377 -4.951 1.00 0.00 N ATOM 996 CA THR A 59 -15.974 6.438 -5.982 1.00 0.00 C ATOM 997 C THR A 59 -14.650 6.878 -6.599 1.00 0.00 C ATOM 998 O THR A 59 -13.770 6.058 -6.854 1.00 0.00 O ATOM 999 CB THR A 59 -17.050 6.320 -7.065 1.00 0.00 C ATOM 1000 OG1 THR A 59 -16.841 5.163 -7.855 1.00 0.00 O ATOM 1001 CG2 THR A 59 -17.098 7.511 -8.000 1.00 0.00 C ATOM 0 H THR A 59 -17.278 7.843 -5.136 1.00 0.00 H new ATOM 0 HA THR A 59 -15.836 5.460 -5.521 1.00 0.00 H new ATOM 0 HB THR A 59 -17.995 6.266 -6.525 1.00 0.00 H new ATOM 0 HG1 THR A 59 -17.539 5.104 -8.540 1.00 0.00 H new ATOM 0 HG21 THR A 59 -17.883 7.360 -8.742 1.00 0.00 H new ATOM 0 HG22 THR A 59 -17.309 8.415 -7.428 1.00 0.00 H new ATOM 0 HG23 THR A 59 -16.137 7.617 -8.504 1.00 0.00 H new ATOM 1009 N THR A 60 -14.515 8.182 -6.830 1.00 0.00 N ATOM 1010 CA THR A 60 -13.296 8.730 -7.411 1.00 0.00 C ATOM 1011 C THR A 60 -12.106 8.454 -6.498 1.00 0.00 C ATOM 1012 O THR A 60 -10.995 8.203 -6.967 1.00 0.00 O ATOM 1013 CB THR A 60 -13.456 10.236 -7.668 1.00 0.00 C ATOM 1014 OG1 THR A 60 -13.013 10.567 -8.972 1.00 0.00 O ATOM 1015 CG2 THR A 60 -12.699 11.115 -6.694 1.00 0.00 C ATOM 0 H THR A 60 -15.234 8.876 -6.624 1.00 0.00 H new ATOM 0 HA THR A 60 -13.111 8.242 -8.368 1.00 0.00 H new ATOM 0 HB THR A 60 -14.521 10.429 -7.540 1.00 0.00 H new ATOM 0 HG1 THR A 60 -13.123 11.529 -9.120 1.00 0.00 H new ATOM 0 HG21 THR A 60 -12.865 12.163 -6.945 1.00 0.00 H new ATOM 0 HG22 THR A 60 -13.053 10.924 -5.681 1.00 0.00 H new ATOM 0 HG23 THR A 60 -11.634 10.892 -6.754 1.00 0.00 H new ATOM 1023 N ALA A 61 -12.349 8.482 -5.191 1.00 0.00 N ATOM 1024 CA ALA A 61 -11.300 8.212 -4.221 1.00 0.00 C ATOM 1025 C ALA A 61 -10.948 6.739 -4.260 1.00 0.00 C ATOM 1026 O ALA A 61 -9.796 6.364 -4.481 1.00 0.00 O ATOM 1027 CB ALA A 61 -11.736 8.615 -2.824 1.00 0.00 C ATOM 0 H ALA A 61 -13.261 8.688 -4.783 1.00 0.00 H new ATOM 0 HA ALA A 61 -10.421 8.802 -4.479 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -10.934 8.403 -2.117 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -11.962 9.681 -2.807 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -12.625 8.051 -2.543 1.00 0.00 H new ATOM 1033 N MET A 62 -11.963 5.903 -4.076 1.00 0.00 N ATOM 1034 CA MET A 62 -11.782 4.467 -4.122 1.00 0.00 C ATOM 1035 C MET A 62 -11.216 4.077 -5.479 1.00 0.00 C ATOM 1036 O MET A 62 -10.457 3.116 -5.596 1.00 0.00 O ATOM 1037 CB MET A 62 -13.113 3.761 -3.873 1.00 0.00 C ATOM 1038 CG MET A 62 -13.782 4.174 -2.572 1.00 0.00 C ATOM 1039 SD MET A 62 -15.508 3.662 -2.484 1.00 0.00 S ATOM 1040 CE MET A 62 -15.424 2.068 -3.289 1.00 0.00 C ATOM 0 H MET A 62 -12.921 6.202 -3.893 1.00 0.00 H new ATOM 0 HA MET A 62 -11.084 4.162 -3.343 1.00 0.00 H new ATOM 0 HB2 MET A 62 -13.788 3.971 -4.703 1.00 0.00 H new ATOM 0 HB3 MET A 62 -12.948 2.684 -3.862 1.00 0.00 H new ATOM 0 HG2 MET A 62 -13.236 3.741 -1.734 1.00 0.00 H new ATOM 0 HG3 MET A 62 -13.723 5.257 -2.466 1.00 0.00 H new ATOM 0 HE1 MET A 62 -16.226 1.430 -2.917 1.00 0.00 H new ATOM 0 HE2 MET A 62 -15.533 2.198 -4.366 1.00 0.00 H new ATOM 0 HE3 MET A 62 -14.462 1.603 -3.075 1.00 0.00 H new ATOM 1050 N ASN A 63 -11.565 4.857 -6.503 1.00 0.00 N ATOM 1051 CA ASN A 63 -11.056 4.608 -7.844 1.00 0.00 C ATOM 1052 C ASN A 63 -9.552 4.814 -7.837 1.00 0.00 C ATOM 1053 O ASN A 63 -8.790 3.956 -8.281 1.00 0.00 O ATOM 1054 CB ASN A 63 -11.719 5.541 -8.860 1.00 0.00 C ATOM 1055 CG ASN A 63 -13.011 4.973 -9.414 1.00 0.00 C ATOM 1056 OD1 ASN A 63 -13.061 3.822 -9.849 1.00 0.00 O ATOM 1057 ND2 ASN A 63 -14.066 5.779 -9.399 1.00 0.00 N ATOM 0 H ASN A 63 -12.192 5.658 -6.427 1.00 0.00 H new ATOM 0 HA ASN A 63 -11.288 3.584 -8.137 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -11.922 6.502 -8.387 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -11.027 5.729 -9.681 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -14.963 5.452 -9.757 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -13.979 6.726 -9.029 1.00 0.00 H new ATOM 1064 N ARG A 64 -9.133 5.945 -7.278 1.00 0.00 N ATOM 1065 CA ARG A 64 -7.719 6.251 -7.149 1.00 0.00 C ATOM 1066 C ARG A 64 -7.078 5.208 -6.246 1.00 0.00 C ATOM 1067 O ARG A 64 -5.923 4.830 -6.422 1.00 0.00 O ATOM 1068 CB ARG A 64 -7.530 7.645 -6.546 1.00 0.00 C ATOM 1069 CG ARG A 64 -7.194 8.715 -7.568 1.00 0.00 C ATOM 1070 CD ARG A 64 -8.434 9.487 -7.993 1.00 0.00 C ATOM 1071 NE ARG A 64 -8.187 10.310 -9.176 1.00 0.00 N ATOM 1072 CZ ARG A 64 -7.477 11.436 -9.160 1.00 0.00 C ATOM 1073 NH1 ARG A 64 -6.940 11.874 -8.028 1.00 0.00 N ATOM 1074 NH2 ARG A 64 -7.303 12.124 -10.280 1.00 0.00 N ATOM 0 H ARG A 64 -9.756 6.663 -6.908 1.00 0.00 H new ATOM 0 HA ARG A 64 -7.250 6.235 -8.133 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -8.442 7.930 -6.022 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -6.734 7.604 -5.802 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -6.461 9.404 -7.148 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -6.734 8.254 -8.442 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -9.244 8.787 -8.201 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -8.765 10.123 -7.172 1.00 0.00 H new ATOM 0 HE ARG A 64 -8.582 10.004 -10.065 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -7.070 11.347 -7.164 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -6.397 12.737 -8.022 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -7.713 11.790 -11.152 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -6.759 12.987 -10.269 1.00 0.00 H new ATOM 1088 N PHE A 65 -7.866 4.751 -5.276 1.00 0.00 N ATOM 1089 CA PHE A 65 -7.435 3.744 -4.320 1.00 0.00 C ATOM 1090 C PHE A 65 -7.156 2.425 -5.023 1.00 0.00 C ATOM 1091 O PHE A 65 -6.030 1.927 -5.017 1.00 0.00 O ATOM 1092 CB PHE A 65 -8.529 3.561 -3.272 1.00 0.00 C ATOM 1093 CG PHE A 65 -8.077 2.958 -1.976 1.00 0.00 C ATOM 1094 CD1 PHE A 65 -6.736 2.918 -1.615 1.00 0.00 C ATOM 1095 CD2 PHE A 65 -9.014 2.437 -1.107 1.00 0.00 C ATOM 1096 CE1 PHE A 65 -6.348 2.362 -0.412 1.00 0.00 C ATOM 1097 CE2 PHE A 65 -8.636 1.882 0.096 1.00 0.00 C ATOM 1098 CZ PHE A 65 -7.298 1.842 0.445 1.00 0.00 C ATOM 0 H PHE A 65 -8.824 5.072 -5.134 1.00 0.00 H new ATOM 0 HA PHE A 65 -6.513 4.071 -3.839 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -8.978 4.532 -3.065 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -9.312 2.931 -3.694 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -5.990 3.326 -2.281 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -10.060 2.465 -1.374 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -5.303 2.334 -0.142 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -9.382 1.479 0.765 1.00 0.00 H new ATOM 0 HZ PHE A 65 -6.997 1.405 1.386 1.00 0.00 H new ATOM 1108 N LYS A 66 -8.194 1.870 -5.636 1.00 0.00 N ATOM 1109 CA LYS A 66 -8.083 0.615 -6.360 1.00 0.00 C ATOM 1110 C LYS A 66 -6.966 0.696 -7.400 1.00 0.00 C ATOM 1111 O LYS A 66 -6.249 -0.277 -7.636 1.00 0.00 O ATOM 1112 CB LYS A 66 -9.446 0.289 -6.990 1.00 0.00 C ATOM 1113 CG LYS A 66 -9.391 -0.430 -8.321 1.00 0.00 C ATOM 1114 CD LYS A 66 -9.641 0.523 -9.479 1.00 0.00 C ATOM 1115 CE LYS A 66 -8.433 0.617 -10.395 1.00 0.00 C ATOM 1116 NZ LYS A 66 -8.827 0.716 -11.828 1.00 0.00 N ATOM 0 H LYS A 66 -9.130 2.276 -5.644 1.00 0.00 H new ATOM 0 HA LYS A 66 -7.816 -0.194 -5.680 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -10.014 -0.323 -6.289 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -9.998 1.219 -7.121 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -8.416 -0.902 -8.441 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -10.135 -1.227 -8.337 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -10.506 0.185 -10.050 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -9.882 1.513 -9.091 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -7.837 1.488 -10.122 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -7.801 -0.259 -10.252 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -7.974 0.778 -12.419 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -9.374 -0.127 -12.097 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -9.409 1.566 -11.970 1.00 0.00 H new ATOM 1130 N ALA A 67 -6.812 1.869 -7.999 1.00 0.00 N ATOM 1131 CA ALA A 67 -5.767 2.083 -8.992 1.00 0.00 C ATOM 1132 C ALA A 67 -4.406 2.199 -8.314 1.00 0.00 C ATOM 1133 O ALA A 67 -3.442 1.539 -8.709 1.00 0.00 O ATOM 1134 CB ALA A 67 -6.061 3.329 -9.814 1.00 0.00 C ATOM 0 H ALA A 67 -7.395 2.685 -7.816 1.00 0.00 H new ATOM 0 HA ALA A 67 -5.747 1.225 -9.664 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -5.271 3.474 -10.551 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -7.016 3.211 -10.325 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -6.107 4.197 -9.156 1.00 0.00 H new ATOM 1140 N ALA A 68 -4.338 3.031 -7.278 1.00 0.00 N ATOM 1141 CA ALA A 68 -3.100 3.220 -6.532 1.00 0.00 C ATOM 1142 C ALA A 68 -2.546 1.875 -6.088 1.00 0.00 C ATOM 1143 O ALA A 68 -1.334 1.670 -6.049 1.00 0.00 O ATOM 1144 CB ALA A 68 -3.334 4.130 -5.332 1.00 0.00 C ATOM 0 H ALA A 68 -5.125 3.584 -6.938 1.00 0.00 H new ATOM 0 HA ALA A 68 -2.368 3.698 -7.183 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -2.399 4.260 -4.786 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -3.692 5.101 -5.676 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -4.078 3.681 -4.674 1.00 0.00 H new ATOM 1150 N LEU A 69 -3.451 0.955 -5.771 1.00 0.00 N ATOM 1151 CA LEU A 69 -3.064 -0.381 -5.350 1.00 0.00 C ATOM 1152 C LEU A 69 -2.327 -1.088 -6.472 1.00 0.00 C ATOM 1153 O LEU A 69 -1.253 -1.649 -6.261 1.00 0.00 O ATOM 1154 CB LEU A 69 -4.291 -1.186 -4.940 1.00 0.00 C ATOM 1155 CG LEU A 69 -4.797 -0.893 -3.534 1.00 0.00 C ATOM 1156 CD1 LEU A 69 -6.297 -1.122 -3.443 1.00 0.00 C ATOM 1157 CD2 LEU A 69 -4.051 -1.741 -2.518 1.00 0.00 C ATOM 0 H LEU A 69 -4.458 1.113 -5.799 1.00 0.00 H new ATOM 0 HA LEU A 69 -2.401 -0.296 -4.489 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -5.094 -0.988 -5.650 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -4.055 -2.248 -5.014 1.00 0.00 H new ATOM 0 HG LEU A 69 -4.607 0.156 -3.307 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -6.637 -0.907 -2.430 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -6.809 -0.464 -4.145 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -6.522 -2.160 -3.689 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -4.423 -1.521 -1.517 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -4.208 -2.797 -2.740 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -2.986 -1.515 -2.567 1.00 0.00 H new ATOM 1169 N GLU A 70 -2.901 -1.045 -7.675 1.00 0.00 N ATOM 1170 CA GLU A 70 -2.273 -1.670 -8.832 1.00 0.00 C ATOM 1171 C GLU A 70 -0.798 -1.299 -8.872 1.00 0.00 C ATOM 1172 O GLU A 70 0.046 -2.093 -9.285 1.00 0.00 O ATOM 1173 CB GLU A 70 -2.964 -1.235 -10.127 1.00 0.00 C ATOM 1174 CG GLU A 70 -4.282 -1.947 -10.383 1.00 0.00 C ATOM 1175 CD GLU A 70 -4.944 -1.502 -11.672 1.00 0.00 C ATOM 1176 OE1 GLU A 70 -5.073 -0.277 -11.880 1.00 0.00 O ATOM 1177 OE2 GLU A 70 -5.332 -2.378 -12.474 1.00 0.00 O ATOM 0 H GLU A 70 -3.792 -0.588 -7.870 1.00 0.00 H new ATOM 0 HA GLU A 70 -2.372 -2.752 -8.744 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -3.143 -0.160 -10.090 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -2.293 -1.418 -10.966 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -4.108 -3.022 -10.420 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -4.959 -1.762 -9.549 1.00 0.00 H new ATOM 1184 N GLU A 71 -0.498 -0.090 -8.403 1.00 0.00 N ATOM 1185 CA GLU A 71 0.877 0.377 -8.348 1.00 0.00 C ATOM 1186 C GLU A 71 1.663 -0.479 -7.362 1.00 0.00 C ATOM 1187 O GLU A 71 2.676 -1.079 -7.721 1.00 0.00 O ATOM 1188 CB GLU A 71 0.930 1.851 -7.939 1.00 0.00 C ATOM 1189 CG GLU A 71 -0.134 2.707 -8.610 1.00 0.00 C ATOM 1190 CD GLU A 71 -0.198 2.493 -10.111 1.00 0.00 C ATOM 1191 OE1 GLU A 71 -0.579 1.383 -10.538 1.00 0.00 O ATOM 1192 OE2 GLU A 71 0.132 3.437 -10.859 1.00 0.00 O ATOM 0 H GLU A 71 -1.188 0.578 -8.058 1.00 0.00 H new ATOM 0 HA GLU A 71 1.324 0.287 -9.338 1.00 0.00 H new ATOM 0 HB2 GLU A 71 0.815 1.924 -6.858 1.00 0.00 H new ATOM 0 HB3 GLU A 71 1.914 2.252 -8.182 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -1.106 2.479 -8.173 1.00 0.00 H new ATOM 0 HG3 GLU A 71 0.069 3.758 -8.405 1.00 0.00 H new ATOM 1199 N ALA A 72 1.177 -0.558 -6.121 1.00 0.00 N ATOM 1200 CA ALA A 72 1.828 -1.373 -5.108 1.00 0.00 C ATOM 1201 C ALA A 72 1.884 -2.826 -5.566 1.00 0.00 C ATOM 1202 O ALA A 72 2.937 -3.458 -5.531 1.00 0.00 O ATOM 1203 CB ALA A 72 1.097 -1.254 -3.781 1.00 0.00 C ATOM 0 H ALA A 72 0.341 -0.069 -5.801 1.00 0.00 H new ATOM 0 HA ALA A 72 2.847 -1.014 -4.966 1.00 0.00 H new ATOM 0 HB1 ALA A 72 1.597 -1.870 -3.034 1.00 0.00 H new ATOM 0 HB2 ALA A 72 1.101 -0.214 -3.455 1.00 0.00 H new ATOM 0 HB3 ALA A 72 0.068 -1.593 -3.901 1.00 0.00 H new ATOM 1209 N ASN A 73 0.745 -3.348 -6.018 1.00 0.00 N ATOM 1210 CA ASN A 73 0.683 -4.720 -6.504 1.00 0.00 C ATOM 1211 C ASN A 73 1.631 -4.896 -7.684 1.00 0.00 C ATOM 1212 O ASN A 73 2.205 -5.966 -7.882 1.00 0.00 O ATOM 1213 CB ASN A 73 -0.743 -5.081 -6.922 1.00 0.00 C ATOM 1214 CG ASN A 73 -1.075 -6.533 -6.636 1.00 0.00 C ATOM 1215 OD1 ASN A 73 -0.630 -7.099 -5.637 1.00 0.00 O ATOM 1216 ND2 ASN A 73 -1.861 -7.146 -7.513 1.00 0.00 N ATOM 0 H ASN A 73 -0.141 -2.843 -6.057 1.00 0.00 H new ATOM 0 HA ASN A 73 0.986 -5.387 -5.697 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -1.448 -4.438 -6.394 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -0.868 -4.885 -7.987 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -2.118 -8.123 -7.372 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -2.208 -6.640 -8.328 1.00 0.00 H new ATOM 1223 N GLY A 74 1.797 -3.827 -8.459 1.00 0.00 N ATOM 1224 CA GLY A 74 2.685 -3.871 -9.606 1.00 0.00 C ATOM 1225 C GLY A 74 4.140 -3.812 -9.191 1.00 0.00 C ATOM 1226 O GLY A 74 4.968 -4.573 -9.691 1.00 0.00 O ATOM 0 H GLY A 74 1.332 -2.931 -8.312 1.00 0.00 H new ATOM 0 HA2 GLY A 74 2.505 -4.786 -10.171 1.00 0.00 H new ATOM 0 HA3 GLY A 74 2.462 -3.036 -10.271 1.00 0.00 H new ATOM 1230 N GLU A 75 4.449 -2.911 -8.262 1.00 0.00 N ATOM 1231 CA GLU A 75 5.809 -2.764 -7.766 1.00 0.00 C ATOM 1232 C GLU A 75 6.255 -4.054 -7.086 1.00 0.00 C ATOM 1233 O GLU A 75 7.404 -4.476 -7.210 1.00 0.00 O ATOM 1234 CB GLU A 75 5.895 -1.572 -6.798 1.00 0.00 C ATOM 1235 CG GLU A 75 5.647 -1.923 -5.337 1.00 0.00 C ATOM 1236 CD GLU A 75 6.881 -2.471 -4.648 1.00 0.00 C ATOM 1237 OE1 GLU A 75 7.923 -1.783 -4.661 1.00 0.00 O ATOM 1238 OE2 GLU A 75 6.804 -3.588 -4.096 1.00 0.00 O ATOM 0 H GLU A 75 3.774 -2.273 -7.839 1.00 0.00 H new ATOM 0 HA GLU A 75 6.478 -2.568 -8.604 1.00 0.00 H new ATOM 0 HB2 GLU A 75 6.883 -1.119 -6.887 1.00 0.00 H new ATOM 0 HB3 GLU A 75 5.170 -0.818 -7.105 1.00 0.00 H new ATOM 0 HG2 GLU A 75 5.305 -1.034 -4.807 1.00 0.00 H new ATOM 0 HG3 GLU A 75 4.845 -2.659 -5.276 1.00 0.00 H new ATOM 1245 N ILE A 76 5.319 -4.677 -6.382 1.00 0.00 N ATOM 1246 CA ILE A 76 5.572 -5.927 -5.687 1.00 0.00 C ATOM 1247 C ILE A 76 5.666 -7.076 -6.683 1.00 0.00 C ATOM 1248 O ILE A 76 6.366 -8.062 -6.451 1.00 0.00 O ATOM 1249 CB ILE A 76 4.451 -6.220 -4.673 1.00 0.00 C ATOM 1250 CG1 ILE A 76 4.380 -5.097 -3.641 1.00 0.00 C ATOM 1251 CG2 ILE A 76 4.671 -7.563 -3.990 1.00 0.00 C ATOM 1252 CD1 ILE A 76 3.069 -5.057 -2.888 1.00 0.00 C ATOM 0 H ILE A 76 4.366 -4.329 -6.278 1.00 0.00 H new ATOM 0 HA ILE A 76 6.518 -5.833 -5.154 1.00 0.00 H new ATOM 0 HB ILE A 76 3.503 -6.270 -5.208 1.00 0.00 H new ATOM 0 HG12 ILE A 76 5.196 -5.216 -2.929 1.00 0.00 H new ATOM 0 HG13 ILE A 76 4.532 -4.142 -4.143 1.00 0.00 H new ATOM 0 HG21 ILE A 76 3.865 -7.746 -3.279 1.00 0.00 H new ATOM 0 HG22 ILE A 76 4.680 -8.355 -4.739 1.00 0.00 H new ATOM 0 HG23 ILE A 76 5.625 -7.551 -3.463 1.00 0.00 H new ATOM 0 HD11 ILE A 76 3.086 -4.236 -2.171 1.00 0.00 H new ATOM 0 HD12 ILE A 76 2.250 -4.908 -3.591 1.00 0.00 H new ATOM 0 HD13 ILE A 76 2.925 -5.998 -2.358 1.00 0.00 H new ATOM 1264 N GLU A 77 4.954 -6.934 -7.795 1.00 0.00 N ATOM 1265 CA GLU A 77 4.953 -7.951 -8.837 1.00 0.00 C ATOM 1266 C GLU A 77 6.247 -7.895 -9.642 1.00 0.00 C ATOM 1267 O GLU A 77 6.849 -8.925 -9.943 1.00 0.00 O ATOM 1268 CB GLU A 77 3.749 -7.756 -9.762 1.00 0.00 C ATOM 1269 CG GLU A 77 3.697 -8.748 -10.911 1.00 0.00 C ATOM 1270 CD GLU A 77 2.845 -8.259 -12.066 1.00 0.00 C ATOM 1271 OE1 GLU A 77 1.866 -7.527 -11.812 1.00 0.00 O ATOM 1272 OE2 GLU A 77 3.158 -8.609 -13.224 1.00 0.00 O ATOM 0 H GLU A 77 4.370 -6.123 -7.997 1.00 0.00 H new ATOM 0 HA GLU A 77 4.882 -8.930 -8.364 1.00 0.00 H new ATOM 0 HB2 GLU A 77 2.834 -7.843 -9.176 1.00 0.00 H new ATOM 0 HB3 GLU A 77 3.773 -6.744 -10.167 1.00 0.00 H new ATOM 0 HG2 GLU A 77 4.709 -8.939 -11.267 1.00 0.00 H new ATOM 0 HG3 GLU A 77 3.302 -9.697 -10.549 1.00 0.00 H new ATOM 1279 N LYS A 78 6.666 -6.682 -9.985 1.00 0.00 N ATOM 1280 CA LYS A 78 7.890 -6.484 -10.754 1.00 0.00 C ATOM 1281 C LYS A 78 9.129 -6.694 -9.885 1.00 0.00 C ATOM 1282 O LYS A 78 10.229 -6.895 -10.401 1.00 0.00 O ATOM 1283 CB LYS A 78 7.910 -5.077 -11.358 1.00 0.00 C ATOM 1284 CG LYS A 78 7.580 -5.048 -12.842 1.00 0.00 C ATOM 1285 CD LYS A 78 6.248 -4.365 -13.107 1.00 0.00 C ATOM 1286 CE LYS A 78 5.079 -5.249 -12.703 1.00 0.00 C ATOM 1287 NZ LYS A 78 4.940 -6.429 -13.600 1.00 0.00 N ATOM 0 H LYS A 78 6.176 -5.821 -9.743 1.00 0.00 H new ATOM 0 HA LYS A 78 7.907 -7.222 -11.556 1.00 0.00 H new ATOM 0 HB2 LYS A 78 7.196 -4.451 -10.823 1.00 0.00 H new ATOM 0 HB3 LYS A 78 8.896 -4.639 -11.205 1.00 0.00 H new ATOM 0 HG2 LYS A 78 8.371 -4.526 -13.381 1.00 0.00 H new ATOM 0 HG3 LYS A 78 7.550 -6.067 -13.228 1.00 0.00 H new ATOM 0 HD2 LYS A 78 6.203 -3.426 -12.555 1.00 0.00 H new ATOM 0 HD3 LYS A 78 6.169 -4.117 -14.165 1.00 0.00 H new ATOM 0 HE2 LYS A 78 5.218 -5.588 -11.676 1.00 0.00 H new ATOM 0 HE3 LYS A 78 4.158 -4.666 -12.725 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 3.933 -6.594 -13.803 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 5.448 -6.251 -14.490 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 5.341 -7.268 -13.135 1.00 0.00 H new ATOM 1301 N PHE A 79 8.948 -6.645 -8.568 1.00 0.00 N ATOM 1302 CA PHE A 79 10.060 -6.828 -7.641 1.00 0.00 C ATOM 1303 C PHE A 79 10.168 -8.279 -7.178 1.00 0.00 C ATOM 1304 O PHE A 79 11.175 -8.677 -6.593 1.00 0.00 O ATOM 1305 CB PHE A 79 9.895 -5.915 -6.425 1.00 0.00 C ATOM 1306 CG PHE A 79 10.445 -4.530 -6.624 1.00 0.00 C ATOM 1307 CD1 PHE A 79 11.653 -4.329 -7.275 1.00 0.00 C ATOM 1308 CD2 PHE A 79 9.752 -3.428 -6.155 1.00 0.00 C ATOM 1309 CE1 PHE A 79 12.155 -3.054 -7.453 1.00 0.00 C ATOM 1310 CE2 PHE A 79 10.249 -2.151 -6.328 1.00 0.00 C ATOM 1311 CZ PHE A 79 11.453 -1.963 -6.978 1.00 0.00 C ATOM 0 H PHE A 79 8.046 -6.481 -8.121 1.00 0.00 H new ATOM 0 HA PHE A 79 10.976 -6.567 -8.171 1.00 0.00 H new ATOM 0 HB2 PHE A 79 8.836 -5.843 -6.178 1.00 0.00 H new ATOM 0 HB3 PHE A 79 10.391 -6.373 -5.569 1.00 0.00 H new ATOM 0 HD1 PHE A 79 12.207 -5.178 -7.647 1.00 0.00 H new ATOM 0 HD2 PHE A 79 8.810 -3.568 -5.647 1.00 0.00 H new ATOM 0 HE1 PHE A 79 13.096 -2.910 -7.963 1.00 0.00 H new ATOM 0 HE2 PHE A 79 9.697 -1.301 -5.956 1.00 0.00 H new ATOM 0 HZ PHE A 79 11.845 -0.966 -7.115 1.00 0.00 H new ATOM 1321 N SER A 80 9.126 -9.066 -7.436 1.00 0.00 N ATOM 1322 CA SER A 80 9.115 -10.469 -7.035 1.00 0.00 C ATOM 1323 C SER A 80 10.363 -11.193 -7.531 1.00 0.00 C ATOM 1324 O SER A 80 10.888 -12.078 -6.857 1.00 0.00 O ATOM 1325 CB SER A 80 7.858 -11.163 -7.563 1.00 0.00 C ATOM 1326 OG SER A 80 7.113 -11.742 -6.505 1.00 0.00 O ATOM 0 H SER A 80 8.282 -8.757 -7.919 1.00 0.00 H new ATOM 0 HA SER A 80 9.111 -10.507 -5.946 1.00 0.00 H new ATOM 0 HB2 SER A 80 7.238 -10.443 -8.097 1.00 0.00 H new ATOM 0 HB3 SER A 80 8.139 -11.935 -8.279 1.00 0.00 H new ATOM 0 HG SER A 80 6.314 -12.178 -6.868 1.00 0.00 H new ATOM 1332 N ASN A 81 10.836 -10.806 -8.710 1.00 0.00 N ATOM 1333 CA ASN A 81 12.025 -11.416 -9.290 1.00 0.00 C ATOM 1334 C ASN A 81 13.286 -10.840 -8.654 1.00 0.00 C ATOM 1335 O ASN A 81 13.587 -9.658 -8.813 1.00 0.00 O ATOM 1336 CB ASN A 81 12.052 -11.197 -10.805 1.00 0.00 C ATOM 1337 CG ASN A 81 12.160 -12.498 -11.575 1.00 0.00 C ATOM 1338 OD1 ASN A 81 11.272 -13.347 -11.510 1.00 0.00 O ATOM 1339 ND2 ASN A 81 13.255 -12.661 -12.310 1.00 0.00 N ATOM 0 H ASN A 81 10.415 -10.074 -9.282 1.00 0.00 H new ATOM 0 HA ASN A 81 11.993 -12.487 -9.091 1.00 0.00 H new ATOM 0 HB2 ASN A 81 11.147 -10.672 -11.110 1.00 0.00 H new ATOM 0 HB3 ASN A 81 12.895 -10.555 -11.062 1.00 0.00 H new ATOM 0 HD21 ASN A 81 13.384 -13.517 -12.850 1.00 0.00 H new ATOM 0 HD22 ASN A 81 13.966 -11.930 -12.335 1.00 0.00 H new ATOM 1346 N ARG A 82 14.019 -11.682 -7.930 1.00 0.00 N ATOM 1347 CA ARG A 82 15.248 -11.253 -7.266 1.00 0.00 C ATOM 1348 C ARG A 82 16.141 -10.471 -8.224 1.00 0.00 C ATOM 1349 O ARG A 82 16.864 -9.562 -7.815 1.00 0.00 O ATOM 1350 CB ARG A 82 16.005 -12.465 -6.717 1.00 0.00 C ATOM 1351 CG ARG A 82 16.563 -13.378 -7.798 1.00 0.00 C ATOM 1352 CD ARG A 82 18.040 -13.113 -8.042 1.00 0.00 C ATOM 1353 NE ARG A 82 18.787 -14.347 -8.273 1.00 0.00 N ATOM 1354 CZ ARG A 82 20.108 -14.447 -8.156 1.00 0.00 C ATOM 1355 NH1 ARG A 82 20.834 -13.389 -7.812 1.00 0.00 N ATOM 1356 NH2 ARG A 82 20.709 -15.607 -8.384 1.00 0.00 N ATOM 0 H ARG A 82 13.784 -12.664 -7.788 1.00 0.00 H new ATOM 0 HA ARG A 82 14.975 -10.598 -6.438 1.00 0.00 H new ATOM 0 HB2 ARG A 82 16.825 -12.116 -6.089 1.00 0.00 H new ATOM 0 HB3 ARG A 82 15.336 -13.041 -6.077 1.00 0.00 H new ATOM 0 HG2 ARG A 82 16.422 -14.419 -7.505 1.00 0.00 H new ATOM 0 HG3 ARG A 82 16.008 -13.229 -8.724 1.00 0.00 H new ATOM 0 HD2 ARG A 82 18.153 -12.455 -8.903 1.00 0.00 H new ATOM 0 HD3 ARG A 82 18.461 -12.590 -7.183 1.00 0.00 H new ATOM 0 HE ARG A 82 18.264 -15.181 -8.540 1.00 0.00 H new ATOM 0 HH11 ARG A 82 20.379 -12.493 -7.636 1.00 0.00 H new ATOM 0 HH12 ARG A 82 21.847 -13.472 -7.724 1.00 0.00 H new ATOM 0 HH21 ARG A 82 20.158 -16.423 -8.649 1.00 0.00 H new ATOM 0 HH22 ARG A 82 21.722 -15.683 -8.294 1.00 0.00 H new ATOM 1370 N SER A 83 16.081 -10.828 -9.502 1.00 0.00 N ATOM 1371 CA SER A 83 16.878 -10.158 -10.521 1.00 0.00 C ATOM 1372 C SER A 83 16.537 -8.673 -10.580 1.00 0.00 C ATOM 1373 O SER A 83 17.385 -7.844 -10.912 1.00 0.00 O ATOM 1374 CB SER A 83 16.641 -10.800 -11.888 1.00 0.00 C ATOM 1375 OG SER A 83 17.772 -10.646 -12.728 1.00 0.00 O ATOM 0 H SER A 83 15.488 -11.578 -9.857 1.00 0.00 H new ATOM 0 HA SER A 83 17.930 -10.265 -10.256 1.00 0.00 H new ATOM 0 HB2 SER A 83 16.420 -11.860 -11.762 1.00 0.00 H new ATOM 0 HB3 SER A 83 15.769 -10.346 -12.360 1.00 0.00 H new ATOM 0 HG SER A 83 17.595 -11.067 -13.595 1.00 0.00 H new ATOM 1381 N ASN A 84 15.291 -8.346 -10.255 1.00 0.00 N ATOM 1382 CA ASN A 84 14.834 -6.962 -10.268 1.00 0.00 C ATOM 1383 C ASN A 84 15.276 -6.233 -9.003 1.00 0.00 C ATOM 1384 O ASN A 84 15.756 -5.102 -9.065 1.00 0.00 O ATOM 1385 CB ASN A 84 13.311 -6.907 -10.398 1.00 0.00 C ATOM 1386 CG ASN A 84 12.857 -6.814 -11.841 1.00 0.00 C ATOM 1387 OD1 ASN A 84 13.315 -5.955 -12.595 1.00 0.00 O ATOM 1388 ND2 ASN A 84 11.948 -7.699 -12.233 1.00 0.00 N ATOM 0 H ASN A 84 14.579 -9.022 -9.979 1.00 0.00 H new ATOM 0 HA ASN A 84 15.282 -6.464 -11.128 1.00 0.00 H new ATOM 0 HB2 ASN A 84 12.878 -7.796 -9.940 1.00 0.00 H new ATOM 0 HB3 ASN A 84 12.933 -6.047 -9.845 1.00 0.00 H new ATOM 0 HD21 ASN A 84 11.602 -7.684 -13.192 1.00 0.00 H new ATOM 0 HD22 ASN A 84 11.596 -8.394 -11.575 1.00 0.00 H new ATOM 1395 N ILE A 85 15.113 -6.890 -7.859 1.00 0.00 N ATOM 1396 CA ILE A 85 15.499 -6.301 -6.581 1.00 0.00 C ATOM 1397 C ILE A 85 16.991 -5.983 -6.562 1.00 0.00 C ATOM 1398 O ILE A 85 17.389 -4.819 -6.507 1.00 0.00 O ATOM 1399 CB ILE A 85 15.168 -7.244 -5.404 1.00 0.00 C ATOM 1400 CG1 ILE A 85 13.655 -7.483 -5.322 1.00 0.00 C ATOM 1401 CG2 ILE A 85 15.705 -6.682 -4.091 1.00 0.00 C ATOM 1402 CD1 ILE A 85 12.874 -6.349 -4.685 1.00 0.00 C ATOM 0 H ILE A 85 14.717 -7.828 -7.790 1.00 0.00 H new ATOM 0 HA ILE A 85 14.928 -5.380 -6.465 1.00 0.00 H new ATOM 0 HB ILE A 85 15.657 -8.202 -5.581 1.00 0.00 H new ATOM 0 HG12 ILE A 85 13.271 -7.652 -6.328 1.00 0.00 H new ATOM 0 HG13 ILE A 85 13.474 -8.396 -4.755 1.00 0.00 H new ATOM 0 HG21 ILE A 85 15.460 -7.363 -3.276 1.00 0.00 H new ATOM 0 HG22 ILE A 85 16.787 -6.571 -4.158 1.00 0.00 H new ATOM 0 HG23 ILE A 85 15.252 -5.709 -3.899 1.00 0.00 H new ATOM 0 HD11 ILE A 85 11.814 -6.602 -4.668 1.00 0.00 H new ATOM 0 HD12 ILE A 85 13.226 -6.192 -3.665 1.00 0.00 H new ATOM 0 HD13 ILE A 85 13.020 -5.437 -5.263 1.00 0.00 H new ATOM 1414 N CYS A 86 17.812 -7.027 -6.613 1.00 0.00 N ATOM 1415 CA CYS A 86 19.264 -6.868 -6.604 1.00 0.00 C ATOM 1416 C CYS A 86 19.705 -5.804 -7.604 1.00 0.00 C ATOM 1417 O CYS A 86 20.724 -5.140 -7.411 1.00 0.00 O ATOM 1418 CB CYS A 86 19.944 -8.200 -6.926 1.00 0.00 C ATOM 1419 SG CYS A 86 20.313 -9.210 -5.472 1.00 0.00 S ATOM 0 H CYS A 86 17.496 -7.996 -6.661 1.00 0.00 H new ATOM 0 HA CYS A 86 19.562 -6.545 -5.606 1.00 0.00 H new ATOM 0 HB2 CYS A 86 19.303 -8.770 -7.598 1.00 0.00 H new ATOM 0 HB3 CYS A 86 20.872 -8.002 -7.463 1.00 0.00 H new ATOM 0 HG CYS A 86 19.214 -9.449 -4.820 1.00 0.00 H new ATOM 1425 N ARG A 87 18.928 -5.644 -8.671 1.00 0.00 N ATOM 1426 CA ARG A 87 19.236 -4.658 -9.698 1.00 0.00 C ATOM 1427 C ARG A 87 18.731 -3.279 -9.291 1.00 0.00 C ATOM 1428 O ARG A 87 19.406 -2.273 -9.504 1.00 0.00 O ATOM 1429 CB ARG A 87 18.611 -5.065 -11.033 1.00 0.00 C ATOM 1430 CG ARG A 87 19.546 -5.861 -11.928 1.00 0.00 C ATOM 1431 CD ARG A 87 19.149 -5.743 -13.390 1.00 0.00 C ATOM 1432 NE ARG A 87 20.303 -5.826 -14.280 1.00 0.00 N ATOM 1433 CZ ARG A 87 21.113 -4.803 -14.543 1.00 0.00 C ATOM 1434 NH1 ARG A 87 20.902 -3.619 -13.984 1.00 0.00 N ATOM 1435 NH2 ARG A 87 22.139 -4.966 -15.367 1.00 0.00 N ATOM 0 H ARG A 87 18.081 -6.185 -8.846 1.00 0.00 H new ATOM 0 HA ARG A 87 20.319 -4.615 -9.811 1.00 0.00 H new ATOM 0 HB2 ARG A 87 17.716 -5.657 -10.840 1.00 0.00 H new ATOM 0 HB3 ARG A 87 18.291 -4.168 -11.563 1.00 0.00 H new ATOM 0 HG2 ARG A 87 20.568 -5.505 -11.797 1.00 0.00 H new ATOM 0 HG3 ARG A 87 19.533 -6.909 -11.629 1.00 0.00 H new ATOM 0 HD2 ARG A 87 18.442 -6.535 -13.638 1.00 0.00 H new ATOM 0 HD3 ARG A 87 18.635 -4.795 -13.550 1.00 0.00 H new ATOM 0 HE ARG A 87 20.500 -6.721 -14.727 1.00 0.00 H new ATOM 0 HH11 ARG A 87 20.115 -3.488 -13.348 1.00 0.00 H new ATOM 0 HH12 ARG A 87 21.527 -2.839 -14.190 1.00 0.00 H new ATOM 0 HH21 ARG A 87 22.307 -5.875 -15.799 1.00 0.00 H new ATOM 0 HH22 ARG A 87 22.760 -4.183 -15.569 1.00 0.00 H new ATOM 1449 N PHE A 88 17.537 -3.238 -8.708 1.00 0.00 N ATOM 1450 CA PHE A 88 16.942 -1.981 -8.278 1.00 0.00 C ATOM 1451 C PHE A 88 17.710 -1.388 -7.095 1.00 0.00 C ATOM 1452 O PHE A 88 17.872 -0.174 -7.001 1.00 0.00 O ATOM 1453 CB PHE A 88 15.463 -2.189 -7.916 1.00 0.00 C ATOM 1454 CG PHE A 88 15.092 -1.686 -6.548 1.00 0.00 C ATOM 1455 CD1 PHE A 88 15.081 -0.327 -6.275 1.00 0.00 C ATOM 1456 CD2 PHE A 88 14.772 -2.572 -5.534 1.00 0.00 C ATOM 1457 CE1 PHE A 88 14.756 0.137 -5.017 1.00 0.00 C ATOM 1458 CE2 PHE A 88 14.449 -2.117 -4.279 1.00 0.00 C ATOM 1459 CZ PHE A 88 14.441 -0.759 -4.016 1.00 0.00 C ATOM 0 H PHE A 88 16.964 -4.061 -8.523 1.00 0.00 H new ATOM 0 HA PHE A 88 17.002 -1.273 -9.104 1.00 0.00 H new ATOM 0 HB2 PHE A 88 14.844 -1.685 -8.658 1.00 0.00 H new ATOM 0 HB3 PHE A 88 15.231 -3.252 -7.976 1.00 0.00 H new ATOM 0 HD1 PHE A 88 15.330 0.376 -7.056 1.00 0.00 H new ATOM 0 HD2 PHE A 88 14.776 -3.634 -5.732 1.00 0.00 H new ATOM 0 HE1 PHE A 88 14.748 1.198 -4.816 1.00 0.00 H new ATOM 0 HE2 PHE A 88 14.201 -2.820 -3.497 1.00 0.00 H new ATOM 0 HZ PHE A 88 14.189 -0.401 -3.029 1.00 0.00 H new ATOM 1469 N LEU A 89 18.168 -2.247 -6.191 1.00 0.00 N ATOM 1470 CA LEU A 89 18.905 -1.789 -5.019 1.00 0.00 C ATOM 1471 C LEU A 89 20.190 -1.076 -5.430 1.00 0.00 C ATOM 1472 O LEU A 89 20.389 0.097 -5.113 1.00 0.00 O ATOM 1473 CB LEU A 89 19.235 -2.960 -4.088 1.00 0.00 C ATOM 1474 CG LEU A 89 18.034 -3.763 -3.573 1.00 0.00 C ATOM 1475 CD1 LEU A 89 18.481 -4.758 -2.513 1.00 0.00 C ATOM 1476 CD2 LEU A 89 16.960 -2.843 -3.010 1.00 0.00 C ATOM 0 H LEU A 89 18.043 -3.258 -6.246 1.00 0.00 H new ATOM 0 HA LEU A 89 18.269 -1.085 -4.483 1.00 0.00 H new ATOM 0 HB2 LEU A 89 19.904 -3.641 -4.614 1.00 0.00 H new ATOM 0 HB3 LEU A 89 19.784 -2.573 -3.230 1.00 0.00 H new ATOM 0 HG LEU A 89 17.607 -4.308 -4.414 1.00 0.00 H new ATOM 0 HD11 LEU A 89 17.619 -5.321 -2.156 1.00 0.00 H new ATOM 0 HD12 LEU A 89 19.210 -5.445 -2.943 1.00 0.00 H new ATOM 0 HD13 LEU A 89 18.935 -4.222 -1.679 1.00 0.00 H new ATOM 0 HD21 LEU A 89 16.121 -3.440 -2.652 1.00 0.00 H new ATOM 0 HD22 LEU A 89 17.373 -2.265 -2.183 1.00 0.00 H new ATOM 0 HD23 LEU A 89 16.616 -2.165 -3.791 1.00 0.00 H new ATOM 1488 N THR A 90 21.061 -1.792 -6.135 1.00 0.00 N ATOM 1489 CA THR A 90 22.326 -1.225 -6.586 1.00 0.00 C ATOM 1490 C THR A 90 22.091 -0.075 -7.562 1.00 0.00 C ATOM 1491 O THR A 90 22.688 0.994 -7.433 1.00 0.00 O ATOM 1492 CB THR A 90 23.184 -2.304 -7.250 1.00 0.00 C ATOM 1493 OG1 THR A 90 24.404 -1.756 -7.719 1.00 0.00 O ATOM 1494 CG2 THR A 90 22.501 -2.974 -8.422 1.00 0.00 C ATOM 0 H THR A 90 20.914 -2.764 -6.406 1.00 0.00 H new ATOM 0 HA THR A 90 22.852 -0.836 -5.714 1.00 0.00 H new ATOM 0 HB THR A 90 23.358 -3.052 -6.476 1.00 0.00 H new ATOM 0 HG1 THR A 90 24.939 -2.461 -8.139 1.00 0.00 H new ATOM 0 HG21 THR A 90 23.164 -3.728 -8.847 1.00 0.00 H new ATOM 0 HG22 THR A 90 21.580 -3.449 -8.083 1.00 0.00 H new ATOM 0 HG23 THR A 90 22.266 -2.228 -9.181 1.00 0.00 H new ATOM 1502 N ALA A 91 21.217 -0.303 -8.536 1.00 0.00 N ATOM 1503 CA ALA A 91 20.900 0.710 -9.534 1.00 0.00 C ATOM 1504 C ALA A 91 20.163 1.888 -8.909 1.00 0.00 C ATOM 1505 O ALA A 91 20.277 3.024 -9.370 1.00 0.00 O ATOM 1506 CB ALA A 91 20.066 0.102 -10.651 1.00 0.00 C ATOM 0 H ALA A 91 20.715 -1.183 -8.655 1.00 0.00 H new ATOM 0 HA ALA A 91 21.837 1.080 -9.949 1.00 0.00 H new ATOM 0 HB1 ALA A 91 19.835 0.868 -11.391 1.00 0.00 H new ATOM 0 HB2 ALA A 91 20.626 -0.704 -11.126 1.00 0.00 H new ATOM 0 HB3 ALA A 91 19.139 -0.295 -10.238 1.00 0.00 H new ATOM 1512 N SER A 92 19.400 1.608 -7.858 1.00 0.00 N ATOM 1513 CA SER A 92 18.635 2.639 -7.166 1.00 0.00 C ATOM 1514 C SER A 92 17.566 3.226 -8.083 1.00 0.00 C ATOM 1515 O SER A 92 17.636 4.395 -8.468 1.00 0.00 O ATOM 1516 CB SER A 92 19.563 3.748 -6.664 1.00 0.00 C ATOM 1517 OG SER A 92 20.589 3.221 -5.842 1.00 0.00 O ATOM 0 H SER A 92 19.295 0.672 -7.466 1.00 0.00 H new ATOM 0 HA SER A 92 18.142 2.178 -6.310 1.00 0.00 H new ATOM 0 HB2 SER A 92 20.005 4.269 -7.513 1.00 0.00 H new ATOM 0 HB3 SER A 92 18.986 4.484 -6.104 1.00 0.00 H new ATOM 0 HG SER A 92 20.400 2.280 -5.646 1.00 0.00 H new ATOM 1523 N GLN A 93 16.574 2.410 -8.432 1.00 0.00 N ATOM 1524 CA GLN A 93 15.493 2.854 -9.306 1.00 0.00 C ATOM 1525 C GLN A 93 14.805 4.086 -8.727 1.00 0.00 C ATOM 1526 O GLN A 93 14.677 5.110 -9.399 1.00 0.00 O ATOM 1527 CB GLN A 93 14.473 1.731 -9.503 1.00 0.00 C ATOM 1528 CG GLN A 93 13.346 2.092 -10.457 1.00 0.00 C ATOM 1529 CD GLN A 93 12.591 0.875 -10.953 1.00 0.00 C ATOM 1530 OE1 GLN A 93 13.140 0.041 -11.674 1.00 0.00 O ATOM 1531 NE2 GLN A 93 11.324 0.766 -10.569 1.00 0.00 N ATOM 0 H GLN A 93 16.497 1.441 -8.124 1.00 0.00 H new ATOM 0 HA GLN A 93 15.922 3.116 -10.273 1.00 0.00 H new ATOM 0 HB2 GLN A 93 14.987 0.847 -9.880 1.00 0.00 H new ATOM 0 HB3 GLN A 93 14.047 1.464 -8.536 1.00 0.00 H new ATOM 0 HG2 GLN A 93 12.652 2.766 -9.955 1.00 0.00 H new ATOM 0 HG3 GLN A 93 13.756 2.633 -11.310 1.00 0.00 H new ATOM 0 HE21 GLN A 93 10.909 1.481 -9.971 1.00 0.00 H new ATOM 0 HE22 GLN A 93 10.766 -0.032 -10.872 1.00 0.00 H new ATOM 1540 N ASP A 94 14.371 3.984 -7.475 1.00 0.00 N ATOM 1541 CA ASP A 94 13.708 5.093 -6.807 1.00 0.00 C ATOM 1542 C ASP A 94 14.180 5.214 -5.361 1.00 0.00 C ATOM 1543 O ASP A 94 13.552 5.896 -4.551 1.00 0.00 O ATOM 1544 CB ASP A 94 12.196 4.885 -6.845 1.00 0.00 C ATOM 1545 CG ASP A 94 11.536 5.635 -7.986 1.00 0.00 C ATOM 1546 OD1 ASP A 94 11.949 5.431 -9.147 1.00 0.00 O ATOM 1547 OD2 ASP A 94 10.606 6.424 -7.718 1.00 0.00 O ATOM 0 H ASP A 94 14.467 3.144 -6.904 1.00 0.00 H new ATOM 0 HA ASP A 94 13.962 6.016 -7.329 1.00 0.00 H new ATOM 0 HB2 ASP A 94 11.981 3.821 -6.941 1.00 0.00 H new ATOM 0 HB3 ASP A 94 11.763 5.213 -5.900 1.00 0.00 H new ATOM 1552 N LYS A 95 15.280 4.528 -5.038 1.00 0.00 N ATOM 1553 CA LYS A 95 15.833 4.536 -3.687 1.00 0.00 C ATOM 1554 C LYS A 95 14.921 3.786 -2.714 1.00 0.00 C ATOM 1555 O LYS A 95 15.293 3.552 -1.565 1.00 0.00 O ATOM 1556 CB LYS A 95 16.058 5.971 -3.199 1.00 0.00 C ATOM 1557 CG LYS A 95 17.392 6.556 -3.630 1.00 0.00 C ATOM 1558 CD LYS A 95 17.366 6.985 -5.089 1.00 0.00 C ATOM 1559 CE LYS A 95 18.297 8.159 -5.340 1.00 0.00 C ATOM 1560 NZ LYS A 95 19.729 7.774 -5.196 1.00 0.00 N ATOM 0 H LYS A 95 15.806 3.958 -5.701 1.00 0.00 H new ATOM 0 HA LYS A 95 16.795 4.024 -3.721 1.00 0.00 H new ATOM 0 HB2 LYS A 95 15.254 6.604 -3.575 1.00 0.00 H new ATOM 0 HB3 LYS A 95 15.997 5.990 -2.111 1.00 0.00 H new ATOM 0 HG2 LYS A 95 17.635 7.413 -3.002 1.00 0.00 H new ATOM 0 HG3 LYS A 95 18.180 5.818 -3.481 1.00 0.00 H new ATOM 0 HD2 LYS A 95 17.657 6.146 -5.721 1.00 0.00 H new ATOM 0 HD3 LYS A 95 16.349 7.259 -5.371 1.00 0.00 H new ATOM 0 HE2 LYS A 95 18.125 8.550 -6.343 1.00 0.00 H new ATOM 0 HE3 LYS A 95 18.065 8.962 -4.641 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 20.331 8.603 -5.375 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 19.899 7.424 -4.231 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 19.958 7.025 -5.881 1.00 0.00 H new ATOM 1574 N ILE A 96 13.729 3.408 -3.182 1.00 0.00 N ATOM 1575 CA ILE A 96 12.770 2.686 -2.357 1.00 0.00 C ATOM 1576 C ILE A 96 11.777 1.921 -3.230 1.00 0.00 C ATOM 1577 O ILE A 96 11.184 2.479 -4.155 1.00 0.00 O ATOM 1578 CB ILE A 96 11.984 3.637 -1.438 1.00 0.00 C ATOM 1579 CG1 ILE A 96 12.918 4.641 -0.756 1.00 0.00 C ATOM 1580 CG2 ILE A 96 11.185 2.848 -0.409 1.00 0.00 C ATOM 1581 CD1 ILE A 96 12.217 5.536 0.237 1.00 0.00 C ATOM 0 H ILE A 96 13.408 3.593 -4.132 1.00 0.00 H new ATOM 0 HA ILE A 96 13.341 1.990 -1.743 1.00 0.00 H new ATOM 0 HB ILE A 96 11.283 4.202 -2.053 1.00 0.00 H new ATOM 0 HG12 ILE A 96 13.713 4.097 -0.245 1.00 0.00 H new ATOM 0 HG13 ILE A 96 13.393 5.259 -1.518 1.00 0.00 H new ATOM 0 HG21 ILE A 96 10.636 3.538 0.232 1.00 0.00 H new ATOM 0 HG22 ILE A 96 10.482 2.190 -0.920 1.00 0.00 H new ATOM 0 HG23 ILE A 96 11.864 2.251 0.199 1.00 0.00 H new ATOM 0 HD11 ILE A 96 12.939 6.221 0.682 1.00 0.00 H new ATOM 0 HD12 ILE A 96 11.441 6.107 -0.272 1.00 0.00 H new ATOM 0 HD13 ILE A 96 11.765 4.927 1.020 1.00 0.00 H new ATOM 1593 N LEU A 97 11.613 0.641 -2.932 1.00 0.00 N ATOM 1594 CA LEU A 97 10.709 -0.232 -3.677 1.00 0.00 C ATOM 1595 C LEU A 97 9.352 0.420 -3.966 1.00 0.00 C ATOM 1596 O LEU A 97 9.094 0.842 -5.092 1.00 0.00 O ATOM 1597 CB LEU A 97 10.521 -1.540 -2.909 1.00 0.00 C ATOM 1598 CG LEU A 97 11.820 -2.306 -2.658 1.00 0.00 C ATOM 1599 CD1 LEU A 97 12.154 -2.349 -1.182 1.00 0.00 C ATOM 1600 CD2 LEU A 97 11.763 -3.715 -3.234 1.00 0.00 C ATOM 0 H LEU A 97 12.101 0.175 -2.167 1.00 0.00 H new ATOM 0 HA LEU A 97 11.167 -0.429 -4.646 1.00 0.00 H new ATOM 0 HB2 LEU A 97 10.049 -1.322 -1.951 1.00 0.00 H new ATOM 0 HB3 LEU A 97 9.835 -2.180 -3.464 1.00 0.00 H new ATOM 0 HG LEU A 97 12.615 -1.767 -3.174 1.00 0.00 H new ATOM 0 HD11 LEU A 97 13.083 -2.900 -1.035 1.00 0.00 H new ATOM 0 HD12 LEU A 97 12.272 -1.333 -0.806 1.00 0.00 H new ATOM 0 HD13 LEU A 97 11.348 -2.845 -0.641 1.00 0.00 H new ATOM 0 HD21 LEU A 97 12.704 -4.228 -3.036 1.00 0.00 H new ATOM 0 HD22 LEU A 97 10.945 -4.265 -2.769 1.00 0.00 H new ATOM 0 HD23 LEU A 97 11.599 -3.662 -4.310 1.00 0.00 H new ATOM 1612 N PHE A 98 8.475 0.476 -2.963 1.00 0.00 N ATOM 1613 CA PHE A 98 7.142 1.050 -3.155 1.00 0.00 C ATOM 1614 C PHE A 98 7.009 2.451 -2.555 1.00 0.00 C ATOM 1615 O PHE A 98 5.987 2.781 -1.955 1.00 0.00 O ATOM 1616 CB PHE A 98 6.074 0.120 -2.568 1.00 0.00 C ATOM 1617 CG PHE A 98 5.968 0.171 -1.070 1.00 0.00 C ATOM 1618 CD1 PHE A 98 6.916 -0.448 -0.272 1.00 0.00 C ATOM 1619 CD2 PHE A 98 4.915 0.834 -0.461 1.00 0.00 C ATOM 1620 CE1 PHE A 98 6.816 -0.404 1.105 1.00 0.00 C ATOM 1621 CE2 PHE A 98 4.809 0.879 0.916 1.00 0.00 C ATOM 1622 CZ PHE A 98 5.761 0.260 1.700 1.00 0.00 C ATOM 0 H PHE A 98 8.660 0.135 -2.020 1.00 0.00 H new ATOM 0 HA PHE A 98 6.991 1.148 -4.230 1.00 0.00 H new ATOM 0 HB2 PHE A 98 5.107 0.379 -2.998 1.00 0.00 H new ATOM 0 HB3 PHE A 98 6.294 -0.904 -2.871 1.00 0.00 H new ATOM 0 HD1 PHE A 98 7.742 -0.971 -0.731 1.00 0.00 H new ATOM 0 HD2 PHE A 98 4.168 1.322 -1.070 1.00 0.00 H new ATOM 0 HE1 PHE A 98 7.563 -0.889 1.716 1.00 0.00 H new ATOM 0 HE2 PHE A 98 3.982 1.398 1.378 1.00 0.00 H new ATOM 0 HZ PHE A 98 5.681 0.295 2.777 1.00 0.00 H new ATOM 1632 N LYS A 99 8.029 3.280 -2.736 1.00 0.00 N ATOM 1633 CA LYS A 99 7.994 4.644 -2.225 1.00 0.00 C ATOM 1634 C LYS A 99 6.941 5.458 -2.970 1.00 0.00 C ATOM 1635 O LYS A 99 6.101 6.119 -2.359 1.00 0.00 O ATOM 1636 CB LYS A 99 9.373 5.296 -2.370 1.00 0.00 C ATOM 1637 CG LYS A 99 9.341 6.733 -2.867 1.00 0.00 C ATOM 1638 CD LYS A 99 10.688 7.415 -2.698 1.00 0.00 C ATOM 1639 CE LYS A 99 10.746 8.729 -3.461 1.00 0.00 C ATOM 1640 NZ LYS A 99 12.135 9.066 -3.879 1.00 0.00 N ATOM 0 H LYS A 99 8.887 3.034 -3.230 1.00 0.00 H new ATOM 0 HA LYS A 99 7.730 4.618 -1.168 1.00 0.00 H new ATOM 0 HB2 LYS A 99 9.877 5.270 -1.404 1.00 0.00 H new ATOM 0 HB3 LYS A 99 9.972 4.700 -3.058 1.00 0.00 H new ATOM 0 HG2 LYS A 99 9.055 6.748 -3.919 1.00 0.00 H new ATOM 0 HG3 LYS A 99 8.580 7.290 -2.321 1.00 0.00 H new ATOM 0 HD2 LYS A 99 10.874 7.599 -1.640 1.00 0.00 H new ATOM 0 HD3 LYS A 99 11.479 6.753 -3.050 1.00 0.00 H new ATOM 0 HE2 LYS A 99 10.107 8.666 -4.342 1.00 0.00 H new ATOM 0 HE3 LYS A 99 10.350 9.530 -2.836 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 12.133 9.968 -4.396 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 12.740 9.151 -3.037 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 12.504 8.314 -4.496 1.00 0.00 H new ATOM 1654 N ASP A 100 7.001 5.402 -4.294 1.00 0.00 N ATOM 1655 CA ASP A 100 6.061 6.130 -5.136 1.00 0.00 C ATOM 1656 C ASP A 100 4.623 5.748 -4.805 1.00 0.00 C ATOM 1657 O ASP A 100 3.694 6.511 -5.066 1.00 0.00 O ATOM 1658 CB ASP A 100 6.348 5.853 -6.611 1.00 0.00 C ATOM 1659 CG ASP A 100 5.648 6.834 -7.532 1.00 0.00 C ATOM 1660 OD1 ASP A 100 5.845 8.054 -7.358 1.00 0.00 O ATOM 1661 OD2 ASP A 100 4.902 6.381 -8.426 1.00 0.00 O ATOM 0 H ASP A 100 7.693 4.858 -4.809 1.00 0.00 H new ATOM 0 HA ASP A 100 6.187 7.195 -4.941 1.00 0.00 H new ATOM 0 HB2 ASP A 100 7.423 5.901 -6.784 1.00 0.00 H new ATOM 0 HB3 ASP A 100 6.030 4.839 -6.856 1.00 0.00 H new ATOM 1666 N VAL A 101 4.443 4.560 -4.235 1.00 0.00 N ATOM 1667 CA VAL A 101 3.118 4.083 -3.878 1.00 0.00 C ATOM 1668 C VAL A 101 2.717 4.561 -2.499 1.00 0.00 C ATOM 1669 O VAL A 101 1.696 5.220 -2.346 1.00 0.00 O ATOM 1670 CB VAL A 101 3.047 2.555 -3.953 1.00 0.00 C ATOM 1671 CG1 VAL A 101 1.640 2.058 -3.659 1.00 0.00 C ATOM 1672 CG2 VAL A 101 3.501 2.116 -5.326 1.00 0.00 C ATOM 0 H VAL A 101 5.200 3.913 -4.012 1.00 0.00 H new ATOM 0 HA VAL A 101 2.414 4.497 -4.600 1.00 0.00 H new ATOM 0 HB VAL A 101 3.703 2.123 -3.197 1.00 0.00 H new ATOM 0 HG11 VAL A 101 1.619 0.970 -3.719 1.00 0.00 H new ATOM 0 HG12 VAL A 101 1.345 2.372 -2.658 1.00 0.00 H new ATOM 0 HG13 VAL A 101 0.947 2.475 -4.389 1.00 0.00 H new ATOM 0 HG21 VAL A 101 3.456 1.029 -5.394 1.00 0.00 H new ATOM 0 HG22 VAL A 101 2.850 2.554 -6.082 1.00 0.00 H new ATOM 0 HG23 VAL A 101 4.526 2.448 -5.494 1.00 0.00 H new ATOM 1682 N ASN A 102 3.530 4.270 -1.493 1.00 0.00 N ATOM 1683 CA ASN A 102 3.224 4.738 -0.148 1.00 0.00 C ATOM 1684 C ASN A 102 2.958 6.240 -0.192 1.00 0.00 C ATOM 1685 O ASN A 102 2.231 6.786 0.637 1.00 0.00 O ATOM 1686 CB ASN A 102 4.370 4.411 0.817 1.00 0.00 C ATOM 1687 CG ASN A 102 5.639 5.202 0.548 1.00 0.00 C ATOM 1688 OD1 ASN A 102 5.601 6.325 0.049 1.00 0.00 O ATOM 1689 ND2 ASN A 102 6.777 4.614 0.891 1.00 0.00 N ATOM 0 H ASN A 102 4.388 3.725 -1.578 1.00 0.00 H new ATOM 0 HA ASN A 102 2.334 4.227 0.219 1.00 0.00 H new ATOM 0 HB2 ASN A 102 4.041 4.606 1.838 1.00 0.00 H new ATOM 0 HB3 ASN A 102 4.595 3.346 0.752 1.00 0.00 H new ATOM 0 HD21 ASN A 102 7.664 5.095 0.743 1.00 0.00 H new ATOM 0 HD22 ASN A 102 6.765 3.681 1.303 1.00 0.00 H new ATOM 1696 N ARG A 103 3.549 6.892 -1.195 1.00 0.00 N ATOM 1697 CA ARG A 103 3.386 8.321 -1.396 1.00 0.00 C ATOM 1698 C ARG A 103 2.076 8.623 -2.117 1.00 0.00 C ATOM 1699 O ARG A 103 1.321 9.497 -1.691 1.00 0.00 O ATOM 1700 CB ARG A 103 4.558 8.879 -2.202 1.00 0.00 C ATOM 1701 CG ARG A 103 5.855 8.965 -1.412 1.00 0.00 C ATOM 1702 CD ARG A 103 6.366 10.395 -1.325 1.00 0.00 C ATOM 1703 NE ARG A 103 7.020 10.667 -0.048 1.00 0.00 N ATOM 1704 CZ ARG A 103 8.172 10.118 0.328 1.00 0.00 C ATOM 1705 NH1 ARG A 103 8.801 9.267 -0.472 1.00 0.00 N ATOM 1706 NH2 ARG A 103 8.698 10.423 1.507 1.00 0.00 N ATOM 0 H ARG A 103 4.150 6.441 -1.884 1.00 0.00 H new ATOM 0 HA ARG A 103 3.363 8.799 -0.417 1.00 0.00 H new ATOM 0 HB2 ARG A 103 4.717 8.251 -3.078 1.00 0.00 H new ATOM 0 HB3 ARG A 103 4.297 9.873 -2.566 1.00 0.00 H new ATOM 0 HG2 ARG A 103 5.696 8.573 -0.407 1.00 0.00 H new ATOM 0 HG3 ARG A 103 6.611 8.336 -1.883 1.00 0.00 H new ATOM 0 HD2 ARG A 103 7.068 10.579 -2.138 1.00 0.00 H new ATOM 0 HD3 ARG A 103 5.534 11.086 -1.460 1.00 0.00 H new ATOM 0 HE ARG A 103 6.566 11.317 0.594 1.00 0.00 H new ATOM 0 HH11 ARG A 103 8.402 9.031 -1.380 1.00 0.00 H new ATOM 0 HH12 ARG A 103 9.684 8.849 -0.179 1.00 0.00 H new ATOM 0 HH21 ARG A 103 8.219 11.078 2.125 1.00 0.00 H new ATOM 0 HH22 ARG A 103 9.581 10.002 1.796 1.00 0.00 H new ATOM 1720 N LYS A 104 1.791 7.897 -3.206 1.00 0.00 N ATOM 1721 CA LYS A 104 0.552 8.125 -3.934 1.00 0.00 C ATOM 1722 C LYS A 104 -0.588 7.419 -3.214 1.00 0.00 C ATOM 1723 O LYS A 104 -1.635 8.007 -2.954 1.00 0.00 O ATOM 1724 CB LYS A 104 0.711 7.655 -5.391 1.00 0.00 C ATOM 1725 CG LYS A 104 -0.307 6.623 -5.874 1.00 0.00 C ATOM 1726 CD LYS A 104 0.370 5.383 -6.441 1.00 0.00 C ATOM 1727 CE LYS A 104 1.423 5.735 -7.484 1.00 0.00 C ATOM 1728 NZ LYS A 104 2.269 4.562 -7.838 1.00 0.00 N ATOM 0 H LYS A 104 2.390 7.166 -3.589 1.00 0.00 H new ATOM 0 HA LYS A 104 0.316 9.189 -3.965 1.00 0.00 H new ATOM 0 HB2 LYS A 104 0.652 8.527 -6.042 1.00 0.00 H new ATOM 0 HB3 LYS A 104 1.710 7.235 -5.510 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -0.955 6.337 -5.046 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -0.944 7.070 -6.637 1.00 0.00 H new ATOM 0 HD2 LYS A 104 0.835 4.822 -5.631 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -0.381 4.733 -6.889 1.00 0.00 H new ATOM 0 HE2 LYS A 104 0.933 6.113 -8.381 1.00 0.00 H new ATOM 0 HE3 LYS A 104 2.056 6.537 -7.104 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 3.272 4.836 -7.811 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 2.102 3.795 -7.156 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 2.025 4.234 -8.794 1.00 0.00 H new ATOM 1742 N LEU A 105 -0.349 6.157 -2.876 1.00 0.00 N ATOM 1743 CA LEU A 105 -1.315 5.337 -2.160 1.00 0.00 C ATOM 1744 C LEU A 105 -1.796 6.051 -0.896 1.00 0.00 C ATOM 1745 O LEU A 105 -2.964 5.946 -0.517 1.00 0.00 O ATOM 1746 CB LEU A 105 -0.674 3.990 -1.804 1.00 0.00 C ATOM 1747 CG LEU A 105 -1.616 2.947 -1.203 1.00 0.00 C ATOM 1748 CD1 LEU A 105 -1.017 1.555 -1.307 1.00 0.00 C ATOM 1749 CD2 LEU A 105 -1.921 3.291 0.242 1.00 0.00 C ATOM 0 H LEU A 105 0.523 5.674 -3.092 1.00 0.00 H new ATOM 0 HA LEU A 105 -2.181 5.165 -2.800 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -0.226 3.572 -2.705 1.00 0.00 H new ATOM 0 HB3 LEU A 105 0.137 4.170 -1.099 1.00 0.00 H new ATOM 0 HG LEU A 105 -2.548 2.955 -1.769 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -1.705 0.829 -0.873 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -0.845 1.310 -2.355 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -0.070 1.525 -0.768 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -2.593 2.542 0.660 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -0.994 3.308 0.815 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -2.396 4.271 0.290 1.00 0.00 H new ATOM 1761 N SER A 106 -0.890 6.787 -0.251 1.00 0.00 N ATOM 1762 CA SER A 106 -1.230 7.524 0.964 1.00 0.00 C ATOM 1763 C SER A 106 -2.229 8.636 0.663 1.00 0.00 C ATOM 1764 O SER A 106 -3.317 8.682 1.238 1.00 0.00 O ATOM 1765 CB SER A 106 0.027 8.122 1.599 1.00 0.00 C ATOM 1766 OG SER A 106 0.806 8.811 0.636 1.00 0.00 O ATOM 0 H SER A 106 0.080 6.888 -0.549 1.00 0.00 H new ATOM 0 HA SER A 106 -1.685 6.822 1.663 1.00 0.00 H new ATOM 0 HB2 SER A 106 -0.256 8.806 2.399 1.00 0.00 H new ATOM 0 HB3 SER A 106 0.622 7.329 2.053 1.00 0.00 H new ATOM 0 HG SER A 106 1.721 8.459 0.642 1.00 0.00 H new ATOM 1772 N ASP A 107 -1.850 9.532 -0.243 1.00 0.00 N ATOM 1773 CA ASP A 107 -2.704 10.652 -0.628 1.00 0.00 C ATOM 1774 C ASP A 107 -4.116 10.181 -0.960 1.00 0.00 C ATOM 1775 O ASP A 107 -5.090 10.900 -0.740 1.00 0.00 O ATOM 1776 CB ASP A 107 -2.110 11.375 -1.835 1.00 0.00 C ATOM 1777 CG ASP A 107 -1.094 12.428 -1.439 1.00 0.00 C ATOM 1778 OD1 ASP A 107 -0.393 12.224 -0.426 1.00 0.00 O ATOM 1779 OD2 ASP A 107 -0.998 13.454 -2.144 1.00 0.00 O ATOM 0 H ASP A 107 -0.952 9.504 -0.727 1.00 0.00 H new ATOM 0 HA ASP A 107 -2.759 11.337 0.218 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -1.636 10.647 -2.493 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -2.912 11.845 -2.404 1.00 0.00 H new ATOM 1784 N VAL A 108 -4.215 8.969 -1.488 1.00 0.00 N ATOM 1785 CA VAL A 108 -5.502 8.397 -1.848 1.00 0.00 C ATOM 1786 C VAL A 108 -6.370 8.240 -0.616 1.00 0.00 C ATOM 1787 O VAL A 108 -7.524 8.662 -0.605 1.00 0.00 O ATOM 1788 CB VAL A 108 -5.353 7.025 -2.524 1.00 0.00 C ATOM 1789 CG1 VAL A 108 -6.583 6.696 -3.348 1.00 0.00 C ATOM 1790 CG2 VAL A 108 -4.107 6.976 -3.386 1.00 0.00 C ATOM 0 H VAL A 108 -3.417 8.363 -1.676 1.00 0.00 H new ATOM 0 HA VAL A 108 -5.968 9.083 -2.555 1.00 0.00 H new ATOM 0 HB VAL A 108 -5.253 6.274 -1.740 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -6.456 5.721 -3.818 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -7.460 6.676 -2.701 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -6.718 7.455 -4.119 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -4.026 5.994 -3.853 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -4.169 7.741 -4.160 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -3.229 7.157 -2.766 1.00 0.00 H new ATOM 1800 N TRP A 109 -5.809 7.642 0.433 1.00 0.00 N ATOM 1801 CA TRP A 109 -6.565 7.462 1.664 1.00 0.00 C ATOM 1802 C TRP A 109 -6.915 8.823 2.249 1.00 0.00 C ATOM 1803 O TRP A 109 -7.976 9.001 2.840 1.00 0.00 O ATOM 1804 CB TRP A 109 -5.806 6.625 2.699 1.00 0.00 C ATOM 1805 CG TRP A 109 -6.599 6.438 3.960 1.00 0.00 C ATOM 1806 CD1 TRP A 109 -6.190 6.685 5.237 1.00 0.00 C ATOM 1807 CD2 TRP A 109 -7.955 5.987 4.052 1.00 0.00 C ATOM 1808 NE1 TRP A 109 -7.213 6.423 6.120 1.00 0.00 N ATOM 1809 CE2 TRP A 109 -8.308 5.991 5.415 1.00 0.00 C ATOM 1810 CE3 TRP A 109 -8.903 5.584 3.113 1.00 0.00 C ATOM 1811 CZ2 TRP A 109 -9.576 5.608 5.854 1.00 0.00 C ATOM 1812 CZ3 TRP A 109 -10.156 5.205 3.548 1.00 0.00 C ATOM 1813 CH2 TRP A 109 -10.484 5.221 4.907 1.00 0.00 C ATOM 0 H TRP A 109 -4.855 7.282 0.455 1.00 0.00 H new ATOM 0 HA TRP A 109 -7.475 6.915 1.416 1.00 0.00 H new ATOM 0 HB2 TRP A 109 -5.567 5.651 2.273 1.00 0.00 H new ATOM 0 HB3 TRP A 109 -4.859 7.111 2.935 1.00 0.00 H new ATOM 0 HD1 TRP A 109 -5.207 7.035 5.515 1.00 0.00 H new ATOM 0 HE1 TRP A 109 -7.165 6.532 7.133 1.00 0.00 H new ATOM 0 HE3 TRP A 109 -8.660 5.569 2.061 1.00 0.00 H new ATOM 0 HZ2 TRP A 109 -9.831 5.617 6.903 1.00 0.00 H new ATOM 0 HZ3 TRP A 109 -10.896 4.891 2.827 1.00 0.00 H new ATOM 0 HH2 TRP A 109 -11.475 4.922 5.215 1.00 0.00 H new ATOM 1824 N LYS A 110 -6.026 9.790 2.055 1.00 0.00 N ATOM 1825 CA LYS A 110 -6.262 11.140 2.541 1.00 0.00 C ATOM 1826 C LYS A 110 -7.527 11.693 1.906 1.00 0.00 C ATOM 1827 O LYS A 110 -8.303 12.403 2.541 1.00 0.00 O ATOM 1828 CB LYS A 110 -5.078 12.047 2.197 1.00 0.00 C ATOM 1829 CG LYS A 110 -3.769 11.608 2.824 1.00 0.00 C ATOM 1830 CD LYS A 110 -3.688 12.046 4.273 1.00 0.00 C ATOM 1831 CE LYS A 110 -3.057 13.422 4.405 1.00 0.00 C ATOM 1832 NZ LYS A 110 -2.785 13.776 5.826 1.00 0.00 N ATOM 0 H LYS A 110 -5.140 9.663 1.567 1.00 0.00 H new ATOM 0 HA LYS A 110 -6.377 11.109 3.625 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -4.959 12.078 1.114 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -5.304 13.063 2.522 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -3.678 10.524 2.762 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -2.934 12.031 2.265 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -4.688 12.060 4.706 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -3.105 11.321 4.841 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -2.126 13.450 3.840 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -3.719 14.168 3.966 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -2.355 14.722 5.872 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -3.677 13.775 6.361 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -2.133 13.079 6.239 1.00 0.00 H new ATOM 1846 N GLU A 111 -7.715 11.352 0.640 1.00 0.00 N ATOM 1847 CA GLU A 111 -8.873 11.798 -0.123 1.00 0.00 C ATOM 1848 C GLU A 111 -10.033 10.813 -0.009 1.00 0.00 C ATOM 1849 O GLU A 111 -11.196 11.182 -0.162 1.00 0.00 O ATOM 1850 CB GLU A 111 -8.485 11.970 -1.588 1.00 0.00 C ATOM 1851 CG GLU A 111 -8.594 13.408 -2.069 1.00 0.00 C ATOM 1852 CD GLU A 111 -8.309 13.553 -3.551 1.00 0.00 C ATOM 1853 OE1 GLU A 111 -9.258 13.429 -4.353 1.00 0.00 O ATOM 1854 OE2 GLU A 111 -7.136 13.791 -3.909 1.00 0.00 O ATOM 0 H GLU A 111 -7.072 10.761 0.113 1.00 0.00 H new ATOM 0 HA GLU A 111 -9.202 12.752 0.289 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -7.462 11.622 -1.730 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -9.125 11.338 -2.204 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -9.596 13.782 -1.858 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -7.896 14.029 -1.507 1.00 0.00 H new ATOM 1861 N LEU A 112 -9.709 9.558 0.255 1.00 0.00 N ATOM 1862 CA LEU A 112 -10.721 8.519 0.384 1.00 0.00 C ATOM 1863 C LEU A 112 -11.340 8.553 1.775 1.00 0.00 C ATOM 1864 O LEU A 112 -12.559 8.458 1.929 1.00 0.00 O ATOM 1865 CB LEU A 112 -10.105 7.145 0.101 1.00 0.00 C ATOM 1866 CG LEU A 112 -11.083 5.966 0.105 1.00 0.00 C ATOM 1867 CD1 LEU A 112 -12.305 6.264 -0.740 1.00 0.00 C ATOM 1868 CD2 LEU A 112 -10.403 4.714 -0.408 1.00 0.00 C ATOM 0 H LEU A 112 -8.751 9.232 0.385 1.00 0.00 H new ATOM 0 HA LEU A 112 -11.509 8.703 -0.346 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -9.612 7.181 -0.870 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -9.331 6.954 0.844 1.00 0.00 H new ATOM 0 HG LEU A 112 -11.405 5.806 1.134 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -12.980 5.409 -0.717 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -12.817 7.141 -0.343 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -11.998 6.457 -1.768 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -11.111 3.886 -0.399 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -10.053 4.881 -1.427 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -9.554 4.473 0.232 1.00 0.00 H new ATOM 1880 N SER A 113 -10.491 8.703 2.783 1.00 0.00 N ATOM 1881 CA SER A 113 -10.942 8.768 4.164 1.00 0.00 C ATOM 1882 C SER A 113 -11.692 10.069 4.426 1.00 0.00 C ATOM 1883 O SER A 113 -12.742 10.070 5.065 1.00 0.00 O ATOM 1884 CB SER A 113 -9.749 8.649 5.118 1.00 0.00 C ATOM 1885 OG SER A 113 -9.332 9.920 5.588 1.00 0.00 O ATOM 0 H SER A 113 -9.481 8.782 2.667 1.00 0.00 H new ATOM 0 HA SER A 113 -11.622 7.935 4.341 1.00 0.00 H new ATOM 0 HB2 SER A 113 -10.020 8.018 5.964 1.00 0.00 H new ATOM 0 HB3 SER A 113 -8.920 8.159 4.607 1.00 0.00 H new ATOM 0 HG SER A 113 -8.571 9.811 6.195 1.00 0.00 H new ATOM 1891 N LEU A 114 -11.142 11.179 3.936 1.00 0.00 N ATOM 1892 CA LEU A 114 -11.763 12.483 4.130 1.00 0.00 C ATOM 1893 C LEU A 114 -13.109 12.558 3.405 1.00 0.00 C ATOM 1894 O LEU A 114 -14.015 13.263 3.845 1.00 0.00 O ATOM 1895 CB LEU A 114 -10.791 13.605 3.709 1.00 0.00 C ATOM 1896 CG LEU A 114 -11.135 14.419 2.454 1.00 0.00 C ATOM 1897 CD1 LEU A 114 -11.329 13.513 1.258 1.00 0.00 C ATOM 1898 CD2 LEU A 114 -12.366 15.281 2.680 1.00 0.00 C ATOM 0 H LEU A 114 -10.272 11.199 3.405 1.00 0.00 H new ATOM 0 HA LEU A 114 -11.976 12.626 5.189 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -10.700 14.300 4.544 1.00 0.00 H new ATOM 0 HB3 LEU A 114 -9.809 13.158 3.559 1.00 0.00 H new ATOM 0 HG LEU A 114 -10.294 15.081 2.247 1.00 0.00 H new ATOM 0 HD11 LEU A 114 -11.572 14.114 0.382 1.00 0.00 H new ATOM 0 HD12 LEU A 114 -10.412 12.954 1.072 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -12.144 12.817 1.457 1.00 0.00 H new ATOM 0 HD21 LEU A 114 -12.586 15.846 1.774 1.00 0.00 H new ATOM 0 HD22 LEU A 114 -13.216 14.644 2.926 1.00 0.00 H new ATOM 0 HD23 LEU A 114 -12.181 15.972 3.503 1.00 0.00 H new ATOM 1910 N LEU A 115 -13.244 11.813 2.306 1.00 0.00 N ATOM 1911 CA LEU A 115 -14.492 11.789 1.549 1.00 0.00 C ATOM 1912 C LEU A 115 -15.510 10.883 2.228 1.00 0.00 C ATOM 1913 O LEU A 115 -16.686 11.227 2.348 1.00 0.00 O ATOM 1914 CB LEU A 115 -14.247 11.291 0.123 1.00 0.00 C ATOM 1915 CG LEU A 115 -13.701 12.334 -0.847 1.00 0.00 C ATOM 1916 CD1 LEU A 115 -13.505 11.731 -2.232 1.00 0.00 C ATOM 1917 CD2 LEU A 115 -14.629 13.538 -0.909 1.00 0.00 C ATOM 0 H LEU A 115 -12.506 11.221 1.924 1.00 0.00 H new ATOM 0 HA LEU A 115 -14.882 12.806 1.512 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -13.549 10.455 0.163 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -15.185 10.904 -0.275 1.00 0.00 H new ATOM 0 HG LEU A 115 -12.729 12.668 -0.483 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -13.115 12.492 -2.908 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -12.799 10.903 -2.172 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -14.461 11.366 -2.609 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -14.225 14.273 -1.605 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -15.615 13.220 -1.248 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -14.712 13.985 0.082 1.00 0.00 H new ATOM 1929 N LEU A 116 -15.047 9.715 2.661 1.00 0.00 N ATOM 1930 CA LEU A 116 -15.908 8.742 3.319 1.00 0.00 C ATOM 1931 C LEU A 116 -16.672 9.369 4.481 1.00 0.00 C ATOM 1932 O LEU A 116 -17.888 9.215 4.587 1.00 0.00 O ATOM 1933 CB LEU A 116 -15.081 7.548 3.794 1.00 0.00 C ATOM 1934 CG LEU A 116 -14.964 6.420 2.770 1.00 0.00 C ATOM 1935 CD1 LEU A 116 -13.969 5.366 3.229 1.00 0.00 C ATOM 1936 CD2 LEU A 116 -16.329 5.802 2.525 1.00 0.00 C ATOM 0 H LEU A 116 -14.075 9.419 2.567 1.00 0.00 H new ATOM 0 HA LEU A 116 -16.645 8.395 2.595 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -14.080 7.894 4.053 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -15.527 7.151 4.706 1.00 0.00 H new ATOM 0 HG LEU A 116 -14.593 6.838 1.834 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -13.906 4.575 2.481 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -12.988 5.823 3.358 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -14.299 4.943 4.178 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -16.239 4.999 1.794 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -16.719 5.400 3.460 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -17.010 6.563 2.145 1.00 0.00 H new ATOM 1948 N GLN A 117 -15.961 10.087 5.342 1.00 0.00 N ATOM 1949 CA GLN A 117 -16.597 10.747 6.483 1.00 0.00 C ATOM 1950 C GLN A 117 -17.719 11.672 6.016 1.00 0.00 C ATOM 1951 O GLN A 117 -18.600 12.034 6.793 1.00 0.00 O ATOM 1952 CB GLN A 117 -15.581 11.544 7.312 1.00 0.00 C ATOM 1953 CG GLN A 117 -14.474 12.195 6.499 1.00 0.00 C ATOM 1954 CD GLN A 117 -13.230 12.465 7.318 1.00 0.00 C ATOM 1955 OE1 GLN A 117 -13.124 13.488 7.995 1.00 0.00 O ATOM 1956 NE2 GLN A 117 -12.277 11.543 7.260 1.00 0.00 N ATOM 0 H GLN A 117 -14.953 10.228 5.276 1.00 0.00 H new ATOM 0 HA GLN A 117 -17.017 9.965 7.115 1.00 0.00 H new ATOM 0 HB2 GLN A 117 -16.111 12.319 7.866 1.00 0.00 H new ATOM 0 HB3 GLN A 117 -15.130 10.878 8.048 1.00 0.00 H new ATOM 0 HG2 GLN A 117 -14.218 11.549 5.659 1.00 0.00 H new ATOM 0 HG3 GLN A 117 -14.839 13.133 6.081 1.00 0.00 H new ATOM 0 HE21 GLN A 117 -12.407 10.710 6.686 1.00 0.00 H new ATOM 0 HE22 GLN A 117 -11.414 11.667 7.790 1.00 0.00 H new ATOM 1965 N VAL A 118 -17.679 12.056 4.743 1.00 0.00 N ATOM 1966 CA VAL A 118 -18.693 12.938 4.179 1.00 0.00 C ATOM 1967 C VAL A 118 -19.867 12.143 3.624 1.00 0.00 C ATOM 1968 O VAL A 118 -21.014 12.337 4.028 1.00 0.00 O ATOM 1969 CB VAL A 118 -18.119 13.797 3.039 1.00 0.00 C ATOM 1970 CG1 VAL A 118 -19.064 14.936 2.702 1.00 0.00 C ATOM 1971 CG2 VAL A 118 -16.742 14.317 3.402 1.00 0.00 C ATOM 0 H VAL A 118 -16.955 11.770 4.084 1.00 0.00 H new ATOM 0 HA VAL A 118 -19.030 13.582 4.992 1.00 0.00 H new ATOM 0 HB VAL A 118 -18.017 13.171 2.152 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -18.641 15.533 1.894 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -20.026 14.530 2.389 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -19.205 15.564 3.581 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -16.354 14.922 2.583 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -16.809 14.927 4.303 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -16.071 13.477 3.582 1.00 0.00 H new ATOM 1981 N GLU A 119 -19.568 11.263 2.677 1.00 0.00 N ATOM 1982 CA GLU A 119 -20.593 10.446 2.035 1.00 0.00 C ATOM 1983 C GLU A 119 -21.103 9.337 2.955 1.00 0.00 C ATOM 1984 O GLU A 119 -22.310 9.133 3.080 1.00 0.00 O ATOM 1985 CB GLU A 119 -20.044 9.835 0.745 1.00 0.00 C ATOM 1986 CG GLU A 119 -19.262 10.818 -0.111 1.00 0.00 C ATOM 1987 CD GLU A 119 -20.052 12.075 -0.423 1.00 0.00 C ATOM 1988 OE1 GLU A 119 -21.176 11.953 -0.953 1.00 0.00 O ATOM 1989 OE2 GLU A 119 -19.545 13.180 -0.138 1.00 0.00 O ATOM 0 H GLU A 119 -18.622 11.096 2.335 1.00 0.00 H new ATOM 0 HA GLU A 119 -21.434 11.100 1.806 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -19.399 8.993 0.998 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -20.873 9.437 0.160 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -18.341 11.090 0.404 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -18.974 10.333 -1.044 1.00 0.00 H new ATOM 1996 N GLN A 120 -20.182 8.613 3.581 1.00 0.00 N ATOM 1997 CA GLN A 120 -20.549 7.516 4.470 1.00 0.00 C ATOM 1998 C GLN A 120 -20.789 7.994 5.901 1.00 0.00 C ATOM 1999 O GLN A 120 -21.391 7.281 6.705 1.00 0.00 O ATOM 2000 CB GLN A 120 -19.459 6.447 4.449 1.00 0.00 C ATOM 2001 CG GLN A 120 -19.485 5.584 3.199 1.00 0.00 C ATOM 2002 CD GLN A 120 -19.064 4.156 3.469 1.00 0.00 C ATOM 2003 OE1 GLN A 120 -18.205 3.606 2.779 1.00 0.00 O ATOM 2004 NE2 GLN A 120 -19.671 3.548 4.478 1.00 0.00 N ATOM 0 H GLN A 120 -19.178 8.765 3.490 1.00 0.00 H new ATOM 0 HA GLN A 120 -21.486 7.093 4.107 1.00 0.00 H new ATOM 0 HB2 GLN A 120 -18.485 6.930 4.528 1.00 0.00 H new ATOM 0 HB3 GLN A 120 -19.570 5.808 5.325 1.00 0.00 H new ATOM 0 HG2 GLN A 120 -20.491 5.589 2.779 1.00 0.00 H new ATOM 0 HG3 GLN A 120 -18.824 6.018 2.449 1.00 0.00 H new ATOM 0 HE21 GLN A 120 -20.377 4.044 5.022 1.00 0.00 H new ATOM 0 HE22 GLN A 120 -19.432 2.584 4.711 1.00 0.00 H new ATOM 2013 N ARG A 121 -20.321 9.196 6.220 1.00 0.00 N ATOM 2014 CA ARG A 121 -20.496 9.751 7.559 1.00 0.00 C ATOM 2015 C ARG A 121 -19.756 8.918 8.604 1.00 0.00 C ATOM 2016 O ARG A 121 -20.067 8.980 9.793 1.00 0.00 O ATOM 2017 CB ARG A 121 -21.983 9.824 7.915 1.00 0.00 C ATOM 2018 CG ARG A 121 -22.829 10.508 6.851 1.00 0.00 C ATOM 2019 CD ARG A 121 -23.580 11.708 7.411 1.00 0.00 C ATOM 2020 NE ARG A 121 -23.128 12.963 6.814 1.00 0.00 N ATOM 2021 CZ ARG A 121 -22.024 13.607 7.189 1.00 0.00 C ATOM 2022 NH1 ARG A 121 -21.259 13.121 8.158 1.00 0.00 N ATOM 2023 NH2 ARG A 121 -21.684 14.741 6.591 1.00 0.00 N ATOM 0 H ARG A 121 -19.819 9.804 5.573 1.00 0.00 H new ATOM 0 HA ARG A 121 -20.075 10.757 7.560 1.00 0.00 H new ATOM 0 HB2 ARG A 121 -22.360 8.814 8.074 1.00 0.00 H new ATOM 0 HB3 ARG A 121 -22.097 10.359 8.858 1.00 0.00 H new ATOM 0 HG2 ARG A 121 -22.189 10.831 6.030 1.00 0.00 H new ATOM 0 HG3 ARG A 121 -23.541 9.794 6.438 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -24.648 11.584 7.230 1.00 0.00 H new ATOM 0 HD3 ARG A 121 -23.442 11.750 8.491 1.00 0.00 H new ATOM 0 HE ARG A 121 -23.691 13.369 6.067 1.00 0.00 H new ATOM 0 HH11 ARG A 121 -21.515 12.249 8.621 1.00 0.00 H new ATOM 0 HH12 ARG A 121 -20.415 13.619 8.440 1.00 0.00 H new ATOM 0 HH21 ARG A 121 -22.268 15.119 5.845 1.00 0.00 H new ATOM 0 HH22 ARG A 121 -20.839 15.235 6.877 1.00 0.00 H new ATOM 2037 N MET A 122 -18.778 8.135 8.155 1.00 0.00 N ATOM 2038 CA MET A 122 -18.003 7.289 9.052 1.00 0.00 C ATOM 2039 C MET A 122 -16.850 8.068 9.690 1.00 0.00 C ATOM 2040 O MET A 122 -16.022 8.647 8.989 1.00 0.00 O ATOM 2041 CB MET A 122 -17.463 6.078 8.286 1.00 0.00 C ATOM 2042 CG MET A 122 -16.348 6.411 7.301 1.00 0.00 C ATOM 2043 SD MET A 122 -14.758 5.700 7.778 1.00 0.00 S ATOM 2044 CE MET A 122 -13.694 6.337 6.484 1.00 0.00 C ATOM 0 H MET A 122 -18.505 8.070 7.174 1.00 0.00 H new ATOM 0 HA MET A 122 -18.659 6.947 9.852 1.00 0.00 H new ATOM 0 HB2 MET A 122 -17.093 5.344 9.002 1.00 0.00 H new ATOM 0 HB3 MET A 122 -18.284 5.609 7.744 1.00 0.00 H new ATOM 0 HG2 MET A 122 -16.622 6.045 6.311 1.00 0.00 H new ATOM 0 HG3 MET A 122 -16.248 7.494 7.224 1.00 0.00 H new ATOM 0 HE1 MET A 122 -12.692 6.496 6.882 1.00 0.00 H new ATOM 0 HE2 MET A 122 -13.649 5.620 5.664 1.00 0.00 H new ATOM 0 HE3 MET A 122 -14.093 7.283 6.118 1.00 0.00 H new ATOM 2054 N PRO A 123 -16.771 8.092 11.036 1.00 0.00 N ATOM 2055 CA PRO A 123 -15.700 8.804 11.739 1.00 0.00 C ATOM 2056 C PRO A 123 -14.328 8.275 11.342 1.00 0.00 C ATOM 2057 O PRO A 123 -14.073 7.073 11.413 1.00 0.00 O ATOM 2058 CB PRO A 123 -15.978 8.515 13.219 1.00 0.00 C ATOM 2059 CG PRO A 123 -17.411 8.113 13.274 1.00 0.00 C ATOM 2060 CD PRO A 123 -17.703 7.433 11.968 1.00 0.00 C ATOM 0 HA PRO A 123 -15.688 9.868 11.505 1.00 0.00 H new ATOM 0 HB2 PRO A 123 -15.331 7.722 13.594 1.00 0.00 H new ATOM 0 HB3 PRO A 123 -15.792 9.395 13.834 1.00 0.00 H new ATOM 0 HG2 PRO A 123 -17.596 7.442 14.113 1.00 0.00 H new ATOM 0 HG3 PRO A 123 -18.054 8.982 13.413 1.00 0.00 H new ATOM 0 HD2 PRO A 123 -17.526 6.359 12.024 1.00 0.00 H new ATOM 0 HD3 PRO A 123 -18.741 7.570 11.665 1.00 0.00 H new ATOM 2068 N VAL A 124 -13.451 9.172 10.904 1.00 0.00 N ATOM 2069 CA VAL A 124 -12.116 8.782 10.476 1.00 0.00 C ATOM 2070 C VAL A 124 -11.037 9.508 11.269 1.00 0.00 C ATOM 2071 O VAL A 124 -11.282 10.565 11.849 1.00 0.00 O ATOM 2072 CB VAL A 124 -11.914 9.091 8.984 1.00 0.00 C ATOM 2073 CG1 VAL A 124 -10.809 8.231 8.392 1.00 0.00 C ATOM 2074 CG2 VAL A 124 -13.212 8.903 8.219 1.00 0.00 C ATOM 0 H VAL A 124 -13.642 10.172 10.837 1.00 0.00 H new ATOM 0 HA VAL A 124 -12.028 7.710 10.653 1.00 0.00 H new ATOM 0 HB VAL A 124 -11.610 10.134 8.893 1.00 0.00 H new ATOM 0 HG11 VAL A 124 -10.688 8.471 7.336 1.00 0.00 H new ATOM 0 HG12 VAL A 124 -9.875 8.426 8.918 1.00 0.00 H new ATOM 0 HG13 VAL A 124 -11.071 7.178 8.497 1.00 0.00 H new ATOM 0 HG21 VAL A 124 -13.049 9.126 7.165 1.00 0.00 H new ATOM 0 HG22 VAL A 124 -13.550 7.872 8.323 1.00 0.00 H new ATOM 0 HG23 VAL A 124 -13.971 9.576 8.619 1.00 0.00 H new ATOM 2084 N SER A 125 -9.838 8.937 11.275 1.00 0.00 N ATOM 2085 CA SER A 125 -8.711 9.534 11.981 1.00 0.00 C ATOM 2086 C SER A 125 -7.557 9.787 11.016 1.00 0.00 C ATOM 2087 O SER A 125 -7.564 9.279 9.895 1.00 0.00 O ATOM 2088 CB SER A 125 -8.251 8.622 13.121 1.00 0.00 C ATOM 2089 OG SER A 125 -9.354 8.145 13.870 1.00 0.00 O ATOM 0 H SER A 125 -9.621 8.061 10.799 1.00 0.00 H new ATOM 0 HA SER A 125 -9.033 10.486 12.403 1.00 0.00 H new ATOM 0 HB2 SER A 125 -7.693 7.779 12.714 1.00 0.00 H new ATOM 0 HB3 SER A 125 -7.572 9.168 13.776 1.00 0.00 H new ATOM 0 HG SER A 125 -9.033 7.564 14.591 1.00 0.00 H new ATOM 2095 N PRO A 126 -6.550 10.575 11.434 1.00 0.00 N ATOM 2096 CA PRO A 126 -5.386 10.882 10.592 1.00 0.00 C ATOM 2097 C PRO A 126 -4.633 9.618 10.194 1.00 0.00 C ATOM 2098 O PRO A 126 -3.552 9.334 10.710 1.00 0.00 O ATOM 2099 CB PRO A 126 -4.513 11.772 11.485 1.00 0.00 C ATOM 2100 CG PRO A 126 -5.435 12.296 12.532 1.00 0.00 C ATOM 2101 CD PRO A 126 -6.461 11.222 12.752 1.00 0.00 C ATOM 0 HA PRO A 126 -5.670 11.362 9.655 1.00 0.00 H new ATOM 0 HB2 PRO A 126 -3.695 11.204 11.928 1.00 0.00 H new ATOM 0 HB3 PRO A 126 -4.064 12.584 10.913 1.00 0.00 H new ATOM 0 HG2 PRO A 126 -4.895 12.515 13.453 1.00 0.00 H new ATOM 0 HG3 PRO A 126 -5.905 13.225 12.209 1.00 0.00 H new ATOM 0 HD2 PRO A 126 -6.151 10.520 13.526 1.00 0.00 H new ATOM 0 HD3 PRO A 126 -7.420 11.637 13.063 1.00 0.00 H new ATOM 2109 N ILE A 127 -5.226 8.849 9.285 1.00 0.00 N ATOM 2110 CA ILE A 127 -4.635 7.598 8.825 1.00 0.00 C ATOM 2111 C ILE A 127 -4.152 6.756 10.002 1.00 0.00 C ATOM 2112 O ILE A 127 -2.953 6.526 10.163 1.00 0.00 O ATOM 2113 CB ILE A 127 -3.454 7.826 7.859 1.00 0.00 C ATOM 2114 CG1 ILE A 127 -3.796 8.906 6.828 1.00 0.00 C ATOM 2115 CG2 ILE A 127 -3.087 6.518 7.167 1.00 0.00 C ATOM 2116 CD1 ILE A 127 -2.706 9.131 5.803 1.00 0.00 C ATOM 0 H ILE A 127 -6.121 9.073 8.851 1.00 0.00 H new ATOM 0 HA ILE A 127 -5.423 7.070 8.288 1.00 0.00 H new ATOM 0 HB ILE A 127 -2.595 8.171 8.434 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -4.715 8.627 6.313 1.00 0.00 H new ATOM 0 HG13 ILE A 127 -3.994 9.843 7.348 1.00 0.00 H new ATOM 0 HG21 ILE A 127 -2.252 6.688 6.487 1.00 0.00 H new ATOM 0 HG22 ILE A 127 -2.801 5.779 7.915 1.00 0.00 H new ATOM 0 HG23 ILE A 127 -3.945 6.151 6.604 1.00 0.00 H new ATOM 0 HD11 ILE A 127 -3.017 9.909 5.106 1.00 0.00 H new ATOM 0 HD12 ILE A 127 -1.791 9.441 6.307 1.00 0.00 H new ATOM 0 HD13 ILE A 127 -2.524 8.206 5.257 1.00 0.00 H new ATOM 2128 N SER A 128 -5.094 6.290 10.821 1.00 0.00 N ATOM 2129 CA SER A 128 -4.758 5.462 11.978 1.00 0.00 C ATOM 2130 C SER A 128 -3.799 4.348 11.569 1.00 0.00 C ATOM 2131 O SER A 128 -2.996 3.872 12.372 1.00 0.00 O ATOM 2132 CB SER A 128 -6.026 4.865 12.590 1.00 0.00 C ATOM 2133 OG SER A 128 -6.512 5.674 13.648 1.00 0.00 O ATOM 0 H SER A 128 -6.091 6.471 10.706 1.00 0.00 H new ATOM 0 HA SER A 128 -4.271 6.089 12.724 1.00 0.00 H new ATOM 0 HB2 SER A 128 -6.793 4.767 11.822 1.00 0.00 H new ATOM 0 HB3 SER A 128 -5.817 3.862 12.962 1.00 0.00 H new ATOM 0 HG SER A 128 -7.324 5.272 14.021 1.00 0.00 H new ATOM 2139 N GLN A 129 -3.888 3.951 10.304 1.00 0.00 N ATOM 2140 CA GLN A 129 -3.034 2.910 9.753 1.00 0.00 C ATOM 2141 C GLN A 129 -1.558 3.264 9.929 1.00 0.00 C ATOM 2142 O GLN A 129 -0.693 2.389 9.910 1.00 0.00 O ATOM 2143 CB GLN A 129 -3.339 2.720 8.266 1.00 0.00 C ATOM 2144 CG GLN A 129 -4.805 2.448 7.963 1.00 0.00 C ATOM 2145 CD GLN A 129 -5.603 3.712 7.693 1.00 0.00 C ATOM 2146 OE1 GLN A 129 -5.118 4.822 7.909 1.00 0.00 O ATOM 2147 NE2 GLN A 129 -6.836 3.547 7.224 1.00 0.00 N ATOM 0 H GLN A 129 -4.552 4.341 9.636 1.00 0.00 H new ATOM 0 HA GLN A 129 -3.236 1.984 10.291 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -3.027 3.613 7.725 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -2.741 1.892 7.886 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -4.875 1.790 7.097 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -5.251 1.917 8.804 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -7.198 2.608 7.060 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -7.420 4.360 7.029 1.00 0.00 H new ATOM 2156 N GLY A 130 -1.278 4.556 10.080 1.00 0.00 N ATOM 2157 CA GLY A 130 0.091 5.007 10.235 1.00 0.00 C ATOM 2158 C GLY A 130 0.700 5.394 8.904 1.00 0.00 C ATOM 2159 O GLY A 130 1.392 4.596 8.279 1.00 0.00 O ATOM 0 H GLY A 130 -1.977 5.298 10.098 1.00 0.00 H new ATOM 0 HA2 GLY A 130 0.120 5.861 10.912 1.00 0.00 H new ATOM 0 HA3 GLY A 130 0.686 4.217 10.693 1.00 0.00 H new ATOM 2163 N ALA A 131 0.424 6.618 8.462 1.00 0.00 N ATOM 2164 CA ALA A 131 0.925 7.111 7.181 1.00 0.00 C ATOM 2165 C ALA A 131 2.426 7.405 7.196 1.00 0.00 C ATOM 2166 O ALA A 131 2.921 8.153 6.353 1.00 0.00 O ATOM 2167 CB ALA A 131 0.153 8.353 6.767 1.00 0.00 C ATOM 0 H ALA A 131 -0.147 7.290 8.975 1.00 0.00 H new ATOM 0 HA ALA A 131 0.770 6.315 6.453 1.00 0.00 H new ATOM 0 HB1 ALA A 131 0.532 8.715 5.811 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -0.905 8.108 6.669 1.00 0.00 H new ATOM 0 HB3 ALA A 131 0.277 9.128 7.524 1.00 0.00 H new ATOM 2173 N SER A 132 3.153 6.815 8.139 1.00 0.00 N ATOM 2174 CA SER A 132 4.593 7.023 8.224 1.00 0.00 C ATOM 2175 C SER A 132 5.348 6.042 7.326 1.00 0.00 C ATOM 2176 O SER A 132 6.568 5.916 7.424 1.00 0.00 O ATOM 2177 CB SER A 132 5.064 6.864 9.668 1.00 0.00 C ATOM 2178 OG SER A 132 4.491 7.853 10.506 1.00 0.00 O ATOM 0 H SER A 132 2.771 6.193 8.851 1.00 0.00 H new ATOM 0 HA SER A 132 4.805 8.036 7.882 1.00 0.00 H new ATOM 0 HB2 SER A 132 4.795 5.873 10.034 1.00 0.00 H new ATOM 0 HB3 SER A 132 6.151 6.934 9.709 1.00 0.00 H new ATOM 0 HG SER A 132 4.808 7.727 11.425 1.00 0.00 H new ATOM 2184 N TRP A 133 4.618 5.346 6.456 1.00 0.00 N ATOM 2185 CA TRP A 133 5.225 4.374 5.546 1.00 0.00 C ATOM 2186 C TRP A 133 6.468 4.945 4.870 1.00 0.00 C ATOM 2187 O TRP A 133 7.511 4.298 4.818 1.00 0.00 O ATOM 2188 CB TRP A 133 4.239 3.948 4.452 1.00 0.00 C ATOM 2189 CG TRP A 133 2.812 3.843 4.895 1.00 0.00 C ATOM 2190 CD1 TRP A 133 2.350 3.385 6.092 1.00 0.00 C ATOM 2191 CD2 TRP A 133 1.657 4.200 4.128 1.00 0.00 C ATOM 2192 NE1 TRP A 133 0.976 3.434 6.117 1.00 0.00 N ATOM 2193 CE2 TRP A 133 0.528 3.930 4.922 1.00 0.00 C ATOM 2194 CE3 TRP A 133 1.468 4.723 2.846 1.00 0.00 C ATOM 2195 CZ2 TRP A 133 -0.771 4.163 4.476 1.00 0.00 C ATOM 2196 CZ3 TRP A 133 0.180 4.953 2.404 1.00 0.00 C ATOM 2197 CH2 TRP A 133 -0.925 4.673 3.216 1.00 0.00 C ATOM 0 H TRP A 133 3.606 5.436 6.361 1.00 0.00 H new ATOM 0 HA TRP A 133 5.501 3.511 6.152 1.00 0.00 H new ATOM 0 HB2 TRP A 133 4.298 4.663 3.632 1.00 0.00 H new ATOM 0 HB3 TRP A 133 4.553 2.982 4.056 1.00 0.00 H new ATOM 0 HD1 TRP A 133 2.972 3.035 6.903 1.00 0.00 H new ATOM 0 HE1 TRP A 133 0.387 3.147 6.899 1.00 0.00 H new ATOM 0 HE3 TRP A 133 2.314 4.943 2.212 1.00 0.00 H new ATOM 0 HZ2 TRP A 133 -1.625 3.949 5.102 1.00 0.00 H new ATOM 0 HZ3 TRP A 133 0.023 5.356 1.414 1.00 0.00 H new ATOM 0 HH2 TRP A 133 -1.919 4.863 2.840 1.00 0.00 H new ATOM 2208 N ALA A 134 6.331 6.150 4.334 1.00 0.00 N ATOM 2209 CA ALA A 134 7.423 6.812 3.630 1.00 0.00 C ATOM 2210 C ALA A 134 8.675 6.938 4.495 1.00 0.00 C ATOM 2211 O ALA A 134 9.793 6.826 3.996 1.00 0.00 O ATOM 2212 CB ALA A 134 6.972 8.179 3.144 1.00 0.00 C ATOM 0 H ALA A 134 5.468 6.693 4.373 1.00 0.00 H new ATOM 0 HA ALA A 134 7.688 6.192 2.774 1.00 0.00 H new ATOM 0 HB1 ALA A 134 7.793 8.668 2.619 1.00 0.00 H new ATOM 0 HB2 ALA A 134 6.126 8.063 2.467 1.00 0.00 H new ATOM 0 HB3 ALA A 134 6.673 8.788 3.997 1.00 0.00 H new ATOM 2218 N GLN A 135 8.486 7.176 5.787 1.00 0.00 N ATOM 2219 CA GLN A 135 9.614 7.321 6.701 1.00 0.00 C ATOM 2220 C GLN A 135 10.297 5.976 6.947 1.00 0.00 C ATOM 2221 O GLN A 135 11.523 5.891 7.011 1.00 0.00 O ATOM 2222 CB GLN A 135 9.151 7.954 8.024 1.00 0.00 C ATOM 2223 CG GLN A 135 8.939 6.965 9.165 1.00 0.00 C ATOM 2224 CD GLN A 135 8.587 7.650 10.472 1.00 0.00 C ATOM 2225 OE1 GLN A 135 9.145 7.333 11.522 1.00 0.00 O ATOM 2226 NE2 GLN A 135 7.655 8.595 10.413 1.00 0.00 N ATOM 0 H GLN A 135 7.569 7.272 6.224 1.00 0.00 H new ATOM 0 HA GLN A 135 10.346 7.984 6.240 1.00 0.00 H new ATOM 0 HB2 GLN A 135 9.889 8.693 8.335 1.00 0.00 H new ATOM 0 HB3 GLN A 135 8.218 8.489 7.848 1.00 0.00 H new ATOM 0 HG2 GLN A 135 8.142 6.271 8.896 1.00 0.00 H new ATOM 0 HG3 GLN A 135 9.844 6.373 9.301 1.00 0.00 H new ATOM 0 HE21 GLN A 135 7.218 8.826 9.520 1.00 0.00 H new ATOM 0 HE22 GLN A 135 7.376 9.090 11.260 1.00 0.00 H new ATOM 2235 N GLU A 136 9.492 4.929 7.089 1.00 0.00 N ATOM 2236 CA GLU A 136 10.014 3.590 7.336 1.00 0.00 C ATOM 2237 C GLU A 136 10.475 2.922 6.044 1.00 0.00 C ATOM 2238 O GLU A 136 11.394 2.103 6.054 1.00 0.00 O ATOM 2239 CB GLU A 136 8.947 2.726 8.007 1.00 0.00 C ATOM 2240 CG GLU A 136 8.776 3.009 9.490 1.00 0.00 C ATOM 2241 CD GLU A 136 9.907 2.444 10.325 1.00 0.00 C ATOM 2242 OE1 GLU A 136 10.463 1.393 9.940 1.00 0.00 O ATOM 2243 OE2 GLU A 136 10.239 3.052 11.365 1.00 0.00 O ATOM 0 H GLU A 136 8.475 4.982 7.037 1.00 0.00 H new ATOM 0 HA GLU A 136 10.876 3.687 7.996 1.00 0.00 H new ATOM 0 HB2 GLU A 136 7.994 2.885 7.503 1.00 0.00 H new ATOM 0 HB3 GLU A 136 9.206 1.676 7.874 1.00 0.00 H new ATOM 0 HG2 GLU A 136 8.717 4.086 9.646 1.00 0.00 H new ATOM 0 HG3 GLU A 136 7.831 2.585 9.830 1.00 0.00 H new ATOM 2250 N ASP A 137 9.830 3.268 4.936 1.00 0.00 N ATOM 2251 CA ASP A 137 10.175 2.692 3.647 1.00 0.00 C ATOM 2252 C ASP A 137 11.593 3.066 3.246 1.00 0.00 C ATOM 2253 O ASP A 137 12.369 2.215 2.817 1.00 0.00 O ATOM 2254 CB ASP A 137 9.188 3.157 2.576 1.00 0.00 C ATOM 2255 CG ASP A 137 8.210 2.069 2.187 1.00 0.00 C ATOM 2256 OD1 ASP A 137 8.029 1.122 2.981 1.00 0.00 O ATOM 2257 OD2 ASP A 137 7.623 2.167 1.089 1.00 0.00 O ATOM 0 H ASP A 137 9.067 3.944 4.907 1.00 0.00 H new ATOM 0 HA ASP A 137 10.118 1.607 3.736 1.00 0.00 H new ATOM 0 HB2 ASP A 137 8.638 4.023 2.943 1.00 0.00 H new ATOM 0 HB3 ASP A 137 9.739 3.480 1.693 1.00 0.00 H new ATOM 2262 N GLN A 138 11.926 4.344 3.388 1.00 0.00 N ATOM 2263 CA GLN A 138 13.256 4.816 3.034 1.00 0.00 C ATOM 2264 C GLN A 138 14.290 4.309 4.034 1.00 0.00 C ATOM 2265 O GLN A 138 15.420 3.993 3.662 1.00 0.00 O ATOM 2266 CB GLN A 138 13.284 6.346 2.941 1.00 0.00 C ATOM 2267 CG GLN A 138 13.382 7.054 4.281 1.00 0.00 C ATOM 2268 CD GLN A 138 14.711 7.762 4.476 1.00 0.00 C ATOM 2269 OE1 GLN A 138 14.768 8.838 5.071 1.00 0.00 O ATOM 2270 NE2 GLN A 138 15.786 7.163 3.975 1.00 0.00 N ATOM 0 H GLN A 138 11.298 5.065 3.743 1.00 0.00 H new ATOM 0 HA GLN A 138 13.511 4.417 2.052 1.00 0.00 H new ATOM 0 HB2 GLN A 138 14.131 6.645 2.323 1.00 0.00 H new ATOM 0 HB3 GLN A 138 12.382 6.683 2.431 1.00 0.00 H new ATOM 0 HG2 GLN A 138 12.573 7.780 4.363 1.00 0.00 H new ATOM 0 HG3 GLN A 138 13.241 6.328 5.082 1.00 0.00 H new ATOM 0 HE21 GLN A 138 15.693 6.271 3.489 1.00 0.00 H new ATOM 0 HE22 GLN A 138 16.704 7.595 4.077 1.00 0.00 H new ATOM 2279 N GLN A 139 13.891 4.211 5.299 1.00 0.00 N ATOM 2280 CA GLN A 139 14.784 3.716 6.336 1.00 0.00 C ATOM 2281 C GLN A 139 15.162 2.277 6.023 1.00 0.00 C ATOM 2282 O GLN A 139 16.308 1.862 6.206 1.00 0.00 O ATOM 2283 CB GLN A 139 14.113 3.801 7.709 1.00 0.00 C ATOM 2284 CG GLN A 139 14.273 5.155 8.380 1.00 0.00 C ATOM 2285 CD GLN A 139 13.922 5.118 9.856 1.00 0.00 C ATOM 2286 OE1 GLN A 139 13.598 4.064 10.403 1.00 0.00 O ATOM 2287 NE2 GLN A 139 13.986 6.273 10.508 1.00 0.00 N ATOM 0 H GLN A 139 12.960 4.467 5.627 1.00 0.00 H new ATOM 0 HA GLN A 139 15.683 4.332 6.360 1.00 0.00 H new ATOM 0 HB2 GLN A 139 13.051 3.582 7.599 1.00 0.00 H new ATOM 0 HB3 GLN A 139 14.532 3.031 8.357 1.00 0.00 H new ATOM 0 HG2 GLN A 139 15.302 5.495 8.263 1.00 0.00 H new ATOM 0 HG3 GLN A 139 13.637 5.883 7.877 1.00 0.00 H new ATOM 0 HE21 GLN A 139 14.259 7.123 10.014 1.00 0.00 H new ATOM 0 HE22 GLN A 139 13.762 6.310 11.502 1.00 0.00 H new ATOM 2296 N ASP A 140 14.184 1.531 5.523 1.00 0.00 N ATOM 2297 CA ASP A 140 14.391 0.142 5.147 1.00 0.00 C ATOM 2298 C ASP A 140 15.004 0.057 3.753 1.00 0.00 C ATOM 2299 O ASP A 140 15.621 -0.944 3.401 1.00 0.00 O ATOM 2300 CB ASP A 140 13.067 -0.620 5.183 1.00 0.00 C ATOM 2301 CG ASP A 140 12.545 -0.811 6.593 1.00 0.00 C ATOM 2302 OD1 ASP A 140 13.367 -1.055 7.502 1.00 0.00 O ATOM 2303 OD2 ASP A 140 11.316 -0.714 6.791 1.00 0.00 O ATOM 0 H ASP A 140 13.234 1.870 5.369 1.00 0.00 H new ATOM 0 HA ASP A 140 15.078 -0.312 5.862 1.00 0.00 H new ATOM 0 HB2 ASP A 140 12.325 -0.081 4.594 1.00 0.00 H new ATOM 0 HB3 ASP A 140 13.200 -1.595 4.713 1.00 0.00 H new ATOM 2308 N ALA A 141 14.835 1.122 2.969 1.00 0.00 N ATOM 2309 CA ALA A 141 15.376 1.178 1.618 1.00 0.00 C ATOM 2310 C ALA A 141 16.883 1.370 1.662 1.00 0.00 C ATOM 2311 O ALA A 141 17.642 0.523 1.190 1.00 0.00 O ATOM 2312 CB ALA A 141 14.724 2.304 0.825 1.00 0.00 C ATOM 0 H ALA A 141 14.325 1.959 3.251 1.00 0.00 H new ATOM 0 HA ALA A 141 15.156 0.234 1.120 1.00 0.00 H new ATOM 0 HB1 ALA A 141 15.142 2.329 -0.182 1.00 0.00 H new ATOM 0 HB2 ALA A 141 13.649 2.133 0.768 1.00 0.00 H new ATOM 0 HB3 ALA A 141 14.914 3.256 1.321 1.00 0.00 H new ATOM 2318 N ASP A 142 17.313 2.483 2.250 1.00 0.00 N ATOM 2319 CA ASP A 142 18.734 2.772 2.376 1.00 0.00 C ATOM 2320 C ASP A 142 19.421 1.633 3.113 1.00 0.00 C ATOM 2321 O ASP A 142 20.565 1.284 2.822 1.00 0.00 O ATOM 2322 CB ASP A 142 18.950 4.090 3.122 1.00 0.00 C ATOM 2323 CG ASP A 142 18.313 5.268 2.412 1.00 0.00 C ATOM 2324 OD1 ASP A 142 17.195 5.107 1.880 1.00 0.00 O ATOM 2325 OD2 ASP A 142 18.933 6.353 2.387 1.00 0.00 O ATOM 0 H ASP A 142 16.699 3.195 2.645 1.00 0.00 H new ATOM 0 HA ASP A 142 19.165 2.869 1.380 1.00 0.00 H new ATOM 0 HB2 ASP A 142 18.535 4.008 4.127 1.00 0.00 H new ATOM 0 HB3 ASP A 142 20.019 4.271 3.232 1.00 0.00 H new ATOM 2330 N GLU A 143 18.696 1.043 4.060 1.00 0.00 N ATOM 2331 CA GLU A 143 19.212 -0.074 4.833 1.00 0.00 C ATOM 2332 C GLU A 143 19.142 -1.358 4.016 1.00 0.00 C ATOM 2333 O GLU A 143 20.004 -2.226 4.137 1.00 0.00 O ATOM 2334 CB GLU A 143 18.419 -0.234 6.132 1.00 0.00 C ATOM 2335 CG GLU A 143 18.795 0.777 7.203 1.00 0.00 C ATOM 2336 CD GLU A 143 18.200 0.439 8.556 1.00 0.00 C ATOM 2337 OE1 GLU A 143 17.089 -0.128 8.591 1.00 0.00 O ATOM 2338 OE2 GLU A 143 18.846 0.743 9.581 1.00 0.00 O ATOM 0 H GLU A 143 17.747 1.324 4.308 1.00 0.00 H new ATOM 0 HA GLU A 143 20.254 0.128 5.082 1.00 0.00 H new ATOM 0 HB2 GLU A 143 17.355 -0.140 5.913 1.00 0.00 H new ATOM 0 HB3 GLU A 143 18.576 -1.240 6.522 1.00 0.00 H new ATOM 0 HG2 GLU A 143 19.881 0.824 7.289 1.00 0.00 H new ATOM 0 HG3 GLU A 143 18.456 1.767 6.898 1.00 0.00 H new ATOM 2345 N ASP A 144 18.110 -1.471 3.179 1.00 0.00 N ATOM 2346 CA ASP A 144 17.942 -2.655 2.340 1.00 0.00 C ATOM 2347 C ASP A 144 19.134 -2.834 1.407 1.00 0.00 C ATOM 2348 O ASP A 144 19.849 -3.833 1.480 1.00 0.00 O ATOM 2349 CB ASP A 144 16.655 -2.557 1.516 1.00 0.00 C ATOM 2350 CG ASP A 144 15.511 -3.336 2.136 1.00 0.00 C ATOM 2351 OD1 ASP A 144 15.464 -3.432 3.381 1.00 0.00 O ATOM 2352 OD2 ASP A 144 14.662 -3.850 1.376 1.00 0.00 O ATOM 0 H ASP A 144 17.384 -0.763 3.065 1.00 0.00 H new ATOM 0 HA ASP A 144 17.877 -3.521 2.999 1.00 0.00 H new ATOM 0 HB2 ASP A 144 16.368 -1.510 1.419 1.00 0.00 H new ATOM 0 HB3 ASP A 144 16.842 -2.931 0.509 1.00 0.00 H new ATOM 2357 N ARG A 145 19.339 -1.859 0.527 1.00 0.00 N ATOM 2358 CA ARG A 145 20.443 -1.909 -0.428 1.00 0.00 C ATOM 2359 C ARG A 145 21.778 -2.129 0.281 1.00 0.00 C ATOM 2360 O ARG A 145 22.622 -2.888 -0.191 1.00 0.00 O ATOM 2361 CB ARG A 145 20.497 -0.624 -1.259 1.00 0.00 C ATOM 2362 CG ARG A 145 20.230 0.638 -0.455 1.00 0.00 C ATOM 2363 CD ARG A 145 20.896 1.854 -1.081 1.00 0.00 C ATOM 2364 NE ARG A 145 21.941 2.410 -0.222 1.00 0.00 N ATOM 2365 CZ ARG A 145 23.223 2.054 -0.281 1.00 0.00 C ATOM 2366 NH1 ARG A 145 23.632 1.141 -1.154 1.00 0.00 N ATOM 2367 NH2 ARG A 145 24.103 2.614 0.538 1.00 0.00 N ATOM 0 H ARG A 145 18.756 -1.025 0.455 1.00 0.00 H new ATOM 0 HA ARG A 145 20.265 -2.753 -1.094 1.00 0.00 H new ATOM 0 HB2 ARG A 145 21.479 -0.545 -1.726 1.00 0.00 H new ATOM 0 HB3 ARG A 145 19.766 -0.692 -2.064 1.00 0.00 H new ATOM 0 HG2 ARG A 145 19.155 0.806 -0.387 1.00 0.00 H new ATOM 0 HG3 ARG A 145 20.597 0.506 0.563 1.00 0.00 H new ATOM 0 HD2 ARG A 145 21.327 1.576 -2.043 1.00 0.00 H new ATOM 0 HD3 ARG A 145 20.144 2.618 -1.278 1.00 0.00 H new ATOM 0 HE ARG A 145 21.671 3.114 0.465 1.00 0.00 H new ATOM 0 HH11 ARG A 145 22.962 0.705 -1.788 1.00 0.00 H new ATOM 0 HH12 ARG A 145 24.616 0.876 -1.191 1.00 0.00 H new ATOM 0 HH21 ARG A 145 23.798 3.316 1.212 1.00 0.00 H new ATOM 0 HH22 ARG A 145 25.085 2.342 0.494 1.00 0.00 H new