USER MOD reduce.3.24.130724 H: found=0, std=0, add=1072, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1070 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 88 GLN :FLIP amide:sc= -0.907 F(o=-3.3!,f=-2.3) USER MOD Set 1.2: A 89 GLN : amide:sc= -1.44 K(o=-2.3,f=-3.5!) USER MOD Set 2.1: A 67 ASN :FLIP amide:sc= 0.0439 F(o=-5.9!,f=-2.5) USER MOD Set 2.2: A 80 HIS : no HE2:sc= -2.55! C(o=-2.5!,f=-11!) USER MOD Single : A 1 SER N :NH3+ 132:sc= 0.054 (180deg=0) USER MOD Single : A 1 SER OG : rot -150:sc= 0.00374 USER MOD Single : A 5 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 ASN :FLIP amide:sc= -0.841 F(o=-1.9,f=-0.84) USER MOD Single : A 9 SER OG : rot 180:sc= -0.328 USER MOD Single : A 10 ASN : amide:sc= -2.23! C(o=-2.2!,f=-4.4!) USER MOD Single : A 11 ASN : amide:sc= -3.59! C(o=-3.6!,f=-9.3!) USER MOD Single : A 14 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0548) USER MOD Single : A 16 MET CE :methyl -154:sc= -13.8! (180deg=-15.7!) USER MOD Single : A 18 GLN : amide:sc= -0.0316 K(o=-0.032,f=-1.4!) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 SER OG : rot 43:sc= 0.578 USER MOD Single : A 28 SER OG : rot 180:sc= -0.663 USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 ASN : amide:sc= 0.859 K(o=0.86,f=-1.1) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 TYR OH : rot 0:sc= -1.04 USER MOD Single : A 43 MET CE :methyl 160:sc= -0.0357 (180deg=-0.675) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ -119:sc= 0.145 (180deg=0) USER MOD Single : A 69 HIS : no HD1:sc= -3.2 X(o=-3.2,f=-2.9) USER MOD Single : A 70 HIS : no HE2:sc= -2.89! C(o=-2.9!,f=-3.7!) USER MOD Single : A 72 ASN : amide:sc= -0.0182 K(o=-0.018,f=-1.4!) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 MET CE :methyl -106:sc= -9.28! (180deg=-17!) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 95 HIS : no HD1:sc= -4.02! C(o=-4!,f=-4.1!) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 104 ASN : amide:sc= -1.54 K(o=-1.5,f=-2.4!) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 MET CE :methyl 165:sc= 0 (180deg=-0.207) USER MOD Single : A 110 LYS NZ :NH3+ 154:sc= -2.39! (180deg=-3.53!) USER MOD Single : A 111 THR OG1 : rot -129:sc= -0.5 USER MOD Single : A 116 MET CE :methyl -128:sc= -0.745 (180deg=-3.09!) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 HIS : no HE2:sc= -8.37! C(o=-8.4!,f=-14!) USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 ASN : amide:sc= -0.221 X(o=-0.22,f=-0.073) USER MOD Single : A 130 ASN : amide:sc= -0.0129 X(o=-0.013,f=-0.094) USER MOD Single : A 131 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 -9.267 -11.587 -17.915 1.00 0.00 N ATOM 2 CA SER A 1 -8.925 -10.409 -17.137 1.00 0.00 C ATOM 3 C SER A 1 -8.161 -10.818 -15.877 1.00 0.00 C ATOM 4 O SER A 1 -8.391 -11.895 -15.328 1.00 0.00 O ATOM 5 CB SER A 1 -10.178 -9.613 -16.764 1.00 0.00 C ATOM 6 OG SER A 1 -10.971 -9.300 -17.905 1.00 0.00 O ATOM 0 H1 SER A 1 -10.270 -11.545 -18.185 1.00 0.00 H new ATOM 0 H2 SER A 1 -8.679 -11.620 -18.772 1.00 0.00 H new ATOM 0 H3 SER A 1 -9.097 -12.440 -17.346 1.00 0.00 H new ATOM 0 HA SER A 1 -8.289 -9.768 -17.748 1.00 0.00 H new ATOM 0 HB2 SER A 1 -10.774 -10.187 -16.055 1.00 0.00 H new ATOM 0 HB3 SER A 1 -9.885 -8.691 -16.262 1.00 0.00 H new ATOM 0 HG SER A 1 -11.447 -8.457 -17.752 1.00 0.00 H new ATOM 12 N PRO A 2 -7.243 -9.912 -15.441 1.00 0.00 N ATOM 13 CA PRO A 2 -6.443 -10.168 -14.257 1.00 0.00 C ATOM 14 C PRO A 2 -7.275 -9.988 -12.985 1.00 0.00 C ATOM 15 O PRO A 2 -8.499 -9.899 -13.047 1.00 0.00 O ATOM 16 CB PRO A 2 -5.280 -9.195 -14.349 1.00 0.00 C ATOM 17 CG PRO A 2 -5.714 -8.119 -15.331 1.00 0.00 C ATOM 18 CD PRO A 2 -6.943 -8.628 -16.066 1.00 0.00 C ATOM 0 HA PRO A 2 -6.081 -11.195 -14.207 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -5.052 -8.765 -13.374 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -4.377 -9.698 -14.694 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -5.940 -7.191 -14.805 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -4.912 -7.899 -16.035 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -7.779 -7.935 -15.968 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -6.748 -8.743 -17.132 1.00 0.00 H new ATOM 26 N GLU A 3 -6.575 -9.937 -11.861 1.00 0.00 N ATOM 27 CA GLU A 3 -7.233 -9.768 -10.576 1.00 0.00 C ATOM 28 C GLU A 3 -8.093 -8.504 -10.583 1.00 0.00 C ATOM 29 O GLU A 3 -9.068 -8.407 -9.839 1.00 0.00 O ATOM 30 CB GLU A 3 -6.211 -9.730 -9.438 1.00 0.00 C ATOM 31 CG GLU A 3 -6.053 -11.112 -8.798 1.00 0.00 C ATOM 32 CD GLU A 3 -5.607 -12.147 -9.832 1.00 0.00 C ATOM 33 OE1 GLU A 3 -4.402 -12.139 -10.161 1.00 0.00 O ATOM 34 OE2 GLU A 3 -6.483 -12.924 -10.272 1.00 0.00 O ATOM 0 H GLU A 3 -5.559 -10.010 -11.813 1.00 0.00 H new ATOM 0 HA GLU A 3 -7.884 -10.626 -10.407 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -5.248 -9.390 -9.820 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -6.528 -9.010 -8.684 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -5.323 -11.061 -7.990 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -6.999 -11.421 -8.353 1.00 0.00 H new ATOM 41 N ILE A 4 -7.701 -7.564 -11.433 1.00 0.00 N ATOM 42 CA ILE A 4 -8.424 -6.309 -11.546 1.00 0.00 C ATOM 43 C ILE A 4 -9.914 -6.599 -11.735 1.00 0.00 C ATOM 44 O ILE A 4 -10.762 -5.918 -11.160 1.00 0.00 O ATOM 45 CB ILE A 4 -7.821 -5.442 -12.652 1.00 0.00 C ATOM 46 CG1 ILE A 4 -6.292 -5.466 -12.596 1.00 0.00 C ATOM 47 CG2 ILE A 4 -8.375 -4.015 -12.594 1.00 0.00 C ATOM 48 CD1 ILE A 4 -5.794 -5.283 -11.161 1.00 0.00 C ATOM 0 H ILE A 4 -6.892 -7.647 -12.049 1.00 0.00 H new ATOM 0 HA ILE A 4 -8.326 -5.729 -10.629 1.00 0.00 H new ATOM 0 HB ILE A 4 -8.114 -5.863 -13.614 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -5.925 -6.412 -12.995 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -5.889 -4.675 -13.229 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -7.930 -3.419 -13.391 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -9.457 -4.039 -12.720 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -8.132 -3.569 -11.629 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -4.704 -5.304 -11.149 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -6.143 -4.326 -10.774 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -6.179 -6.089 -10.537 1.00 0.00 H new ATOM 60 N MET A 5 -10.189 -7.612 -12.543 1.00 0.00 N ATOM 61 CA MET A 5 -11.563 -8.001 -12.816 1.00 0.00 C ATOM 62 C MET A 5 -12.293 -8.374 -11.525 1.00 0.00 C ATOM 63 O MET A 5 -13.518 -8.282 -11.451 1.00 0.00 O ATOM 64 CB MET A 5 -11.575 -9.195 -13.773 1.00 0.00 C ATOM 65 CG MET A 5 -12.716 -9.073 -14.787 1.00 0.00 C ATOM 66 SD MET A 5 -13.632 -10.602 -14.861 1.00 0.00 S ATOM 67 CE MET A 5 -15.178 -10.005 -15.525 1.00 0.00 C ATOM 0 H MET A 5 -9.484 -8.176 -13.018 1.00 0.00 H new ATOM 0 HA MET A 5 -12.077 -7.155 -13.271 1.00 0.00 H new ATOM 0 HB2 MET A 5 -10.622 -9.255 -14.298 1.00 0.00 H new ATOM 0 HB3 MET A 5 -11.685 -10.119 -13.206 1.00 0.00 H new ATOM 0 HG2 MET A 5 -13.379 -8.255 -14.504 1.00 0.00 H new ATOM 0 HG3 MET A 5 -12.315 -8.832 -15.771 1.00 0.00 H new ATOM 0 HE1 MET A 5 -15.872 -10.838 -15.636 1.00 0.00 H new ATOM 0 HE2 MET A 5 -15.604 -9.266 -14.847 1.00 0.00 H new ATOM 0 HE3 MET A 5 -15.003 -9.546 -16.498 1.00 0.00 H new ATOM 77 N LYS A 6 -11.511 -8.787 -10.538 1.00 0.00 N ATOM 78 CA LYS A 6 -12.069 -9.175 -9.253 1.00 0.00 C ATOM 79 C LYS A 6 -11.695 -8.126 -8.203 1.00 0.00 C ATOM 80 O LYS A 6 -10.534 -8.020 -7.812 1.00 0.00 O ATOM 81 CB LYS A 6 -11.633 -10.594 -8.886 1.00 0.00 C ATOM 82 CG LYS A 6 -12.780 -11.369 -8.234 1.00 0.00 C ATOM 83 CD LYS A 6 -12.506 -11.606 -6.748 1.00 0.00 C ATOM 84 CE LYS A 6 -13.157 -10.519 -5.890 1.00 0.00 C ATOM 85 NZ LYS A 6 -14.596 -10.803 -5.696 1.00 0.00 N ATOM 0 H LYS A 6 -10.496 -8.861 -10.602 1.00 0.00 H new ATOM 0 HA LYS A 6 -13.157 -9.204 -9.303 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -11.298 -11.118 -9.781 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -10.784 -10.552 -8.204 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -13.711 -10.815 -8.352 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -12.912 -12.325 -8.740 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -12.889 -12.583 -6.455 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -11.431 -11.619 -6.570 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -12.658 -10.464 -4.923 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -13.033 -9.547 -6.368 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -15.022 -10.055 -5.112 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -15.072 -10.833 -6.620 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -14.708 -11.721 -5.219 1.00 0.00 H new ATOM 99 N ASN A 7 -12.702 -7.378 -7.776 1.00 0.00 N ATOM 100 CA ASN A 7 -12.494 -6.342 -6.779 1.00 0.00 C ATOM 101 C ASN A 7 -13.277 -6.695 -5.512 1.00 0.00 C ATOM 102 O ASN A 7 -14.418 -7.145 -5.589 1.00 0.00 O ATOM 103 CB ASN A 7 -12.994 -4.987 -7.281 1.00 0.00 C ATOM 104 CG ASN A 7 -14.516 -4.882 -7.157 1.00 0.00 C ATOM 105 OD1 ASN A 7 -14.926 -4.156 -6.122 1.00 0.00 O flip ATOM 106 ND2 ASN A 7 -15.267 -5.427 -7.949 1.00 0.00 N flip ATOM 0 H ASN A 7 -13.664 -7.469 -8.102 1.00 0.00 H new ATOM 0 HA ASN A 7 -11.425 -6.279 -6.576 1.00 0.00 H new ATOM 0 HB2 ASN A 7 -12.523 -4.187 -6.709 1.00 0.00 H new ATOM 0 HB3 ASN A 7 -12.700 -4.850 -8.322 1.00 0.00 H new ATOM 0 HD21 ASN A 7 -14.885 -5.971 -8.723 1.00 0.00 H new ATOM 0 HD22 ASN A 7 -16.277 -5.339 -7.837 1.00 0.00 H new ATOM 113 N LEU A 8 -12.631 -6.476 -4.376 1.00 0.00 N ATOM 114 CA LEU A 8 -13.251 -6.766 -3.095 1.00 0.00 C ATOM 115 C LEU A 8 -14.339 -5.726 -2.814 1.00 0.00 C ATOM 116 O LEU A 8 -14.766 -5.009 -3.716 1.00 0.00 O ATOM 117 CB LEU A 8 -12.191 -6.860 -1.995 1.00 0.00 C ATOM 118 CG LEU A 8 -11.651 -5.529 -1.468 1.00 0.00 C ATOM 119 CD1 LEU A 8 -11.643 -4.466 -2.569 1.00 0.00 C ATOM 120 CD2 LEU A 8 -12.430 -5.071 -0.234 1.00 0.00 C ATOM 0 H LEU A 8 -11.684 -6.101 -4.316 1.00 0.00 H new ATOM 0 HA LEU A 8 -13.738 -7.741 -3.119 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -12.613 -7.415 -1.157 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -11.353 -7.445 -2.375 1.00 0.00 H new ATOM 0 HG LEU A 8 -10.617 -5.679 -1.158 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -11.255 -3.530 -2.168 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -11.010 -4.799 -3.391 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -12.659 -4.311 -2.933 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -12.026 -4.123 0.120 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -13.481 -4.943 -0.494 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -12.339 -5.820 0.552 1.00 0.00 H new ATOM 132 N SER A 9 -14.754 -5.677 -1.556 1.00 0.00 N ATOM 133 CA SER A 9 -15.783 -4.737 -1.145 1.00 0.00 C ATOM 134 C SER A 9 -15.400 -3.321 -1.576 1.00 0.00 C ATOM 135 O SER A 9 -15.496 -2.979 -2.754 1.00 0.00 O ATOM 136 CB SER A 9 -16.004 -4.790 0.368 1.00 0.00 C ATOM 137 OG SER A 9 -16.886 -3.764 0.815 1.00 0.00 O ATOM 0 H SER A 9 -14.397 -6.272 -0.809 1.00 0.00 H new ATOM 0 HA SER A 9 -16.717 -5.018 -1.632 1.00 0.00 H new ATOM 0 HB2 SER A 9 -16.412 -5.763 0.641 1.00 0.00 H new ATOM 0 HB3 SER A 9 -15.046 -4.692 0.878 1.00 0.00 H new ATOM 0 HG SER A 9 -17.003 -3.833 1.786 1.00 0.00 H new ATOM 143 N ASN A 10 -14.976 -2.533 -0.598 1.00 0.00 N ATOM 144 CA ASN A 10 -14.579 -1.160 -0.863 1.00 0.00 C ATOM 145 C ASN A 10 -13.210 -0.899 -0.229 1.00 0.00 C ATOM 146 O ASN A 10 -12.435 -0.087 -0.731 1.00 0.00 O ATOM 147 CB ASN A 10 -15.576 -0.171 -0.257 1.00 0.00 C ATOM 148 CG ASN A 10 -16.557 0.336 -1.316 1.00 0.00 C ATOM 149 OD1 ASN A 10 -16.521 -0.054 -2.471 1.00 0.00 O ATOM 150 ND2 ASN A 10 -17.435 1.225 -0.860 1.00 0.00 N ATOM 0 H ASN A 10 -14.899 -2.819 0.378 1.00 0.00 H new ATOM 0 HA ASN A 10 -14.545 -1.021 -1.944 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -16.125 -0.652 0.552 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -15.039 0.671 0.179 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -18.132 1.622 -1.490 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -17.411 1.509 0.119 1.00 0.00 H new ATOM 157 N ASN A 11 -12.956 -1.603 0.863 1.00 0.00 N ATOM 158 CA ASN A 11 -11.696 -1.458 1.570 1.00 0.00 C ATOM 159 C ASN A 11 -10.634 -0.921 0.608 1.00 0.00 C ATOM 160 O ASN A 11 -9.874 -0.019 0.956 1.00 0.00 O ATOM 161 CB ASN A 11 -11.207 -2.804 2.110 1.00 0.00 C ATOM 162 CG ASN A 11 -12.382 -3.668 2.571 1.00 0.00 C ATOM 163 OD1 ASN A 11 -13.508 -3.214 2.697 1.00 0.00 O ATOM 164 ND2 ASN A 11 -12.059 -4.935 2.817 1.00 0.00 N ATOM 0 H ASN A 11 -13.602 -2.276 1.276 1.00 0.00 H new ATOM 0 HA ASN A 11 -11.855 -0.772 2.402 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -10.647 -3.329 1.336 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -10.523 -2.639 2.943 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -12.773 -5.592 3.131 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -11.097 -5.250 2.691 1.00 0.00 H new ATOM 171 N PHE A 12 -10.616 -1.500 -0.584 1.00 0.00 N ATOM 172 CA PHE A 12 -9.661 -1.091 -1.601 1.00 0.00 C ATOM 173 C PHE A 12 -10.351 -0.312 -2.720 1.00 0.00 C ATOM 174 O PHE A 12 -10.058 0.864 -2.936 1.00 0.00 O ATOM 175 CB PHE A 12 -9.055 -2.368 -2.184 1.00 0.00 C ATOM 176 CG PHE A 12 -7.868 -2.915 -1.387 1.00 0.00 C ATOM 177 CD1 PHE A 12 -8.080 -3.561 -0.209 1.00 0.00 C ATOM 178 CD2 PHE A 12 -6.601 -2.755 -1.856 1.00 0.00 C ATOM 179 CE1 PHE A 12 -6.979 -4.069 0.530 1.00 0.00 C ATOM 180 CE2 PHE A 12 -5.501 -3.261 -1.117 1.00 0.00 C ATOM 181 CZ PHE A 12 -5.712 -3.908 0.060 1.00 0.00 C ATOM 0 H PHE A 12 -11.247 -2.249 -0.868 1.00 0.00 H new ATOM 0 HA PHE A 12 -8.902 -0.445 -1.160 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -9.829 -3.134 -2.236 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -8.733 -2.171 -3.206 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -9.086 -3.688 0.164 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -6.433 -2.242 -2.792 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -7.147 -4.583 1.465 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -4.495 -3.132 -1.489 1.00 0.00 H new ATOM 0 HZ PHE A 12 -4.874 -4.294 0.622 1.00 0.00 H new ATOM 191 N GLY A 13 -11.258 -0.995 -3.403 1.00 0.00 N ATOM 192 CA GLY A 13 -11.993 -0.380 -4.495 1.00 0.00 C ATOM 193 C GLY A 13 -12.401 1.052 -4.145 1.00 0.00 C ATOM 194 O GLY A 13 -12.476 1.912 -5.020 1.00 0.00 O ATOM 0 H GLY A 13 -11.501 -1.969 -3.221 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -11.378 -0.377 -5.395 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -12.882 -0.971 -4.718 1.00 0.00 H new ATOM 198 N LYS A 14 -12.653 1.264 -2.861 1.00 0.00 N ATOM 199 CA LYS A 14 -13.052 2.577 -2.384 1.00 0.00 C ATOM 200 C LYS A 14 -11.811 3.459 -2.235 1.00 0.00 C ATOM 201 O LYS A 14 -11.773 4.575 -2.747 1.00 0.00 O ATOM 202 CB LYS A 14 -13.875 2.452 -1.100 1.00 0.00 C ATOM 203 CG LYS A 14 -14.263 3.831 -0.561 1.00 0.00 C ATOM 204 CD LYS A 14 -13.461 4.176 0.695 1.00 0.00 C ATOM 205 CE LYS A 14 -14.123 3.592 1.944 1.00 0.00 C ATOM 206 NZ LYS A 14 -13.763 4.387 3.140 1.00 0.00 N ATOM 0 H LYS A 14 -12.588 0.548 -2.137 1.00 0.00 H new ATOM 0 HA LYS A 14 -13.705 3.064 -3.108 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -14.774 1.868 -1.296 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -13.301 1.912 -0.347 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -14.088 4.587 -1.327 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -15.329 3.849 -0.332 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -12.447 3.788 0.601 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -13.381 5.259 0.794 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -15.206 3.582 1.818 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -13.809 2.557 2.080 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -14.324 4.063 3.954 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -12.751 4.265 3.346 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -13.961 5.392 2.961 1.00 0.00 H new ATOM 220 N ALA A 15 -10.825 2.923 -1.531 1.00 0.00 N ATOM 221 CA ALA A 15 -9.584 3.649 -1.308 1.00 0.00 C ATOM 222 C ALA A 15 -8.924 3.945 -2.654 1.00 0.00 C ATOM 223 O ALA A 15 -8.464 5.061 -2.892 1.00 0.00 O ATOM 224 CB ALA A 15 -8.679 2.838 -0.379 1.00 0.00 C ATOM 0 H ALA A 15 -10.859 1.996 -1.108 1.00 0.00 H new ATOM 0 HA ALA A 15 -9.779 4.604 -0.820 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -7.749 3.381 -0.212 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -9.184 2.680 0.574 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -8.458 1.874 -0.837 1.00 0.00 H new ATOM 230 N MET A 16 -8.897 2.927 -3.503 1.00 0.00 N ATOM 231 CA MET A 16 -8.299 3.065 -4.820 1.00 0.00 C ATOM 232 C MET A 16 -9.088 4.057 -5.678 1.00 0.00 C ATOM 233 O MET A 16 -8.504 4.802 -6.464 1.00 0.00 O ATOM 234 CB MET A 16 -8.272 1.701 -5.514 1.00 0.00 C ATOM 235 CG MET A 16 -8.114 1.858 -7.027 1.00 0.00 C ATOM 236 SD MET A 16 -9.479 1.077 -7.870 1.00 0.00 S ATOM 237 CE MET A 16 -10.848 1.850 -7.022 1.00 0.00 C ATOM 0 H MET A 16 -9.280 2.003 -3.304 1.00 0.00 H new ATOM 0 HA MET A 16 -7.284 3.442 -4.700 1.00 0.00 H new ATOM 0 HB2 MET A 16 -7.450 1.104 -5.119 1.00 0.00 H new ATOM 0 HB3 MET A 16 -9.192 1.160 -5.295 1.00 0.00 H new ATOM 0 HG2 MET A 16 -8.072 2.915 -7.288 1.00 0.00 H new ATOM 0 HG3 MET A 16 -7.173 1.412 -7.351 1.00 0.00 H new ATOM 0 HE1 MET A 16 -11.719 1.195 -7.064 1.00 0.00 H new ATOM 0 HE2 MET A 16 -10.578 2.028 -5.981 1.00 0.00 H new ATOM 0 HE3 MET A 16 -11.084 2.799 -7.503 1.00 0.00 H new ATOM 247 N ASP A 17 -10.400 4.037 -5.496 1.00 0.00 N ATOM 248 CA ASP A 17 -11.273 4.927 -6.244 1.00 0.00 C ATOM 249 C ASP A 17 -11.078 6.360 -5.746 1.00 0.00 C ATOM 250 O ASP A 17 -10.891 7.278 -6.545 1.00 0.00 O ATOM 251 CB ASP A 17 -12.742 4.553 -6.043 1.00 0.00 C ATOM 252 CG ASP A 17 -13.745 5.477 -6.736 1.00 0.00 C ATOM 253 OD1 ASP A 17 -13.575 6.707 -6.595 1.00 0.00 O ATOM 254 OD2 ASP A 17 -14.659 4.932 -7.392 1.00 0.00 O ATOM 0 H ASP A 17 -10.880 3.419 -4.842 1.00 0.00 H new ATOM 0 HA ASP A 17 -11.020 4.840 -7.301 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -12.896 3.537 -6.406 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -12.956 4.545 -4.974 1.00 0.00 H new ATOM 259 N GLN A 18 -11.129 6.509 -4.431 1.00 0.00 N ATOM 260 CA GLN A 18 -10.962 7.815 -3.818 1.00 0.00 C ATOM 261 C GLN A 18 -9.521 8.303 -3.992 1.00 0.00 C ATOM 262 O GLN A 18 -9.276 9.504 -4.097 1.00 0.00 O ATOM 263 CB GLN A 18 -11.354 7.784 -2.340 1.00 0.00 C ATOM 264 CG GLN A 18 -12.810 8.210 -2.150 1.00 0.00 C ATOM 265 CD GLN A 18 -13.114 8.484 -0.676 1.00 0.00 C ATOM 266 OE1 GLN A 18 -12.228 8.695 0.138 1.00 0.00 O ATOM 267 NE2 GLN A 18 -14.410 8.469 -0.378 1.00 0.00 N ATOM 0 H GLN A 18 -11.284 5.746 -3.772 1.00 0.00 H new ATOM 0 HA GLN A 18 -11.627 8.517 -4.321 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -11.211 6.779 -1.943 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -10.700 8.447 -1.773 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -13.010 9.105 -2.739 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -13.473 7.429 -2.522 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -15.099 8.286 -1.108 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -14.715 8.641 0.580 1.00 0.00 H new ATOM 276 N CYS A 19 -8.605 7.346 -4.018 1.00 0.00 N ATOM 277 CA CYS A 19 -7.196 7.662 -4.179 1.00 0.00 C ATOM 278 C CYS A 19 -6.992 8.255 -5.574 1.00 0.00 C ATOM 279 O CYS A 19 -6.170 9.151 -5.757 1.00 0.00 O ATOM 280 CB CYS A 19 -6.311 6.435 -3.945 1.00 0.00 C ATOM 281 SG CYS A 19 -5.807 6.174 -2.205 1.00 0.00 S ATOM 0 H CYS A 19 -8.811 6.351 -3.930 1.00 0.00 H new ATOM 0 HA CYS A 19 -6.897 8.393 -3.428 1.00 0.00 H new ATOM 0 HB2 CYS A 19 -6.843 5.549 -4.291 1.00 0.00 H new ATOM 0 HB3 CYS A 19 -5.415 6.528 -4.558 1.00 0.00 H new ATOM 286 N LYS A 20 -7.756 7.731 -6.523 1.00 0.00 N ATOM 287 CA LYS A 20 -7.670 8.198 -7.895 1.00 0.00 C ATOM 288 C LYS A 20 -8.182 9.638 -7.974 1.00 0.00 C ATOM 289 O LYS A 20 -8.109 10.269 -9.027 1.00 0.00 O ATOM 290 CB LYS A 20 -8.396 7.234 -8.836 1.00 0.00 C ATOM 291 CG LYS A 20 -7.607 7.032 -10.131 1.00 0.00 C ATOM 292 CD LYS A 20 -8.468 6.351 -11.196 1.00 0.00 C ATOM 293 CE LYS A 20 -9.253 7.381 -12.010 1.00 0.00 C ATOM 294 NZ LYS A 20 -10.648 6.932 -12.208 1.00 0.00 N ATOM 0 H LYS A 20 -8.437 6.988 -6.367 1.00 0.00 H new ATOM 0 HA LYS A 20 -6.632 8.211 -8.228 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -8.539 6.274 -8.340 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -9.387 7.624 -9.067 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -7.257 7.995 -10.502 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -6.722 6.427 -9.932 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -7.834 5.764 -11.861 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -9.159 5.656 -10.720 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -9.244 8.342 -11.496 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -8.773 7.532 -12.977 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -11.166 7.643 -12.762 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -10.652 6.025 -12.718 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -11.108 6.811 -11.283 1.00 0.00 H new ATOM 308 N ASP A 21 -8.689 10.113 -6.846 1.00 0.00 N ATOM 309 CA ASP A 21 -9.213 11.467 -6.774 1.00 0.00 C ATOM 310 C ASP A 21 -8.308 12.312 -5.876 1.00 0.00 C ATOM 311 O ASP A 21 -7.623 13.215 -6.352 1.00 0.00 O ATOM 312 CB ASP A 21 -10.620 11.480 -6.174 1.00 0.00 C ATOM 313 CG ASP A 21 -11.709 12.041 -7.093 1.00 0.00 C ATOM 314 OD1 ASP A 21 -12.009 11.360 -8.098 1.00 0.00 O ATOM 315 OD2 ASP A 21 -12.215 13.136 -6.770 1.00 0.00 O ATOM 0 H ASP A 21 -8.748 9.585 -5.975 1.00 0.00 H new ATOM 0 HA ASP A 21 -9.248 11.870 -7.786 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -10.890 10.461 -5.896 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -10.602 12.067 -5.256 1.00 0.00 H new ATOM 320 N GLU A 22 -8.336 11.989 -4.590 1.00 0.00 N ATOM 321 CA GLU A 22 -7.527 12.707 -3.620 1.00 0.00 C ATOM 322 C GLU A 22 -6.085 12.828 -4.117 1.00 0.00 C ATOM 323 O GLU A 22 -5.469 13.885 -3.997 1.00 0.00 O ATOM 324 CB GLU A 22 -7.581 12.028 -2.250 1.00 0.00 C ATOM 325 CG GLU A 22 -7.379 10.517 -2.380 1.00 0.00 C ATOM 326 CD GLU A 22 -8.509 9.752 -1.688 1.00 0.00 C ATOM 327 OE1 GLU A 22 -9.610 10.335 -1.586 1.00 0.00 O ATOM 328 OE2 GLU A 22 -8.247 8.601 -1.277 1.00 0.00 O ATOM 0 H GLU A 22 -8.906 11.240 -4.198 1.00 0.00 H new ATOM 0 HA GLU A 22 -7.936 13.711 -3.507 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -6.812 12.447 -1.602 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -8.542 12.231 -1.777 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -7.340 10.241 -3.434 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -6.422 10.235 -1.941 1.00 0.00 H new ATOM 335 N LEU A 23 -5.588 11.727 -4.664 1.00 0.00 N ATOM 336 CA LEU A 23 -4.229 11.695 -5.179 1.00 0.00 C ATOM 337 C LEU A 23 -4.259 11.896 -6.695 1.00 0.00 C ATOM 338 O LEU A 23 -3.220 12.119 -7.315 1.00 0.00 O ATOM 339 CB LEU A 23 -3.520 10.412 -4.741 1.00 0.00 C ATOM 340 CG LEU A 23 -3.861 9.902 -3.341 1.00 0.00 C ATOM 341 CD1 LEU A 23 -3.585 8.401 -3.221 1.00 0.00 C ATOM 342 CD2 LEU A 23 -3.123 10.706 -2.269 1.00 0.00 C ATOM 0 H LEU A 23 -6.102 10.851 -4.762 1.00 0.00 H new ATOM 0 HA LEU A 23 -3.643 12.513 -4.760 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -3.756 9.627 -5.459 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -2.444 10.579 -4.793 1.00 0.00 H new ATOM 0 HG LEU A 23 -4.929 10.048 -3.176 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -3.836 8.064 -2.215 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -4.192 7.860 -3.947 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -2.530 8.208 -3.415 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -3.384 10.322 -1.283 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -2.048 10.614 -2.421 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -3.411 11.755 -2.338 1.00 0.00 H new ATOM 354 N SER A 24 -5.459 11.810 -7.249 1.00 0.00 N ATOM 355 CA SER A 24 -5.638 11.979 -8.680 1.00 0.00 C ATOM 356 C SER A 24 -4.659 11.081 -9.438 1.00 0.00 C ATOM 357 O SER A 24 -4.411 11.290 -10.625 1.00 0.00 O ATOM 358 CB SER A 24 -5.445 13.440 -9.090 1.00 0.00 C ATOM 359 OG SER A 24 -6.645 14.197 -8.951 1.00 0.00 O ATOM 0 H SER A 24 -6.318 11.625 -6.731 1.00 0.00 H new ATOM 0 HA SER A 24 -6.658 11.691 -8.934 1.00 0.00 H new ATOM 0 HB2 SER A 24 -4.661 13.888 -8.479 1.00 0.00 H new ATOM 0 HB3 SER A 24 -5.106 13.484 -10.125 1.00 0.00 H new ATOM 0 HG SER A 24 -7.084 13.962 -8.107 1.00 0.00 H new ATOM 365 N LEU A 25 -4.129 10.101 -8.722 1.00 0.00 N ATOM 366 CA LEU A 25 -3.182 9.170 -9.314 1.00 0.00 C ATOM 367 C LEU A 25 -3.947 8.083 -10.071 1.00 0.00 C ATOM 368 O LEU A 25 -5.161 7.955 -9.920 1.00 0.00 O ATOM 369 CB LEU A 25 -2.230 8.624 -8.248 1.00 0.00 C ATOM 370 CG LEU A 25 -2.731 7.413 -7.459 1.00 0.00 C ATOM 371 CD1 LEU A 25 -4.234 7.517 -7.191 1.00 0.00 C ATOM 372 CD2 LEU A 25 -2.365 6.106 -8.167 1.00 0.00 C ATOM 0 H LEU A 25 -4.337 9.931 -7.738 1.00 0.00 H new ATOM 0 HA LEU A 25 -2.550 9.680 -10.041 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -1.291 8.355 -8.731 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -2.007 9.425 -7.543 1.00 0.00 H new ATOM 0 HG LEU A 25 -2.230 7.406 -6.491 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -4.565 6.644 -6.629 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -4.439 8.419 -6.614 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -4.770 7.563 -8.139 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -2.733 5.261 -7.585 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -2.819 6.089 -9.158 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -1.282 6.036 -8.264 1.00 0.00 H new ATOM 384 N PRO A 26 -3.186 7.307 -10.889 1.00 0.00 N ATOM 385 CA PRO A 26 -3.780 6.235 -11.669 1.00 0.00 C ATOM 386 C PRO A 26 -4.114 5.033 -10.784 1.00 0.00 C ATOM 387 O PRO A 26 -3.226 4.445 -10.169 1.00 0.00 O ATOM 388 CB PRO A 26 -2.753 5.915 -12.743 1.00 0.00 C ATOM 389 CG PRO A 26 -1.437 6.490 -12.246 1.00 0.00 C ATOM 390 CD PRO A 26 -1.747 7.431 -11.092 1.00 0.00 C ATOM 0 HA PRO A 26 -4.732 6.519 -12.118 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -2.675 4.839 -12.900 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -3.036 6.357 -13.698 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -0.770 5.692 -11.919 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -0.926 7.024 -13.048 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -1.195 7.152 -10.194 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -1.468 8.457 -11.332 1.00 0.00 H new ATOM 398 N ASP A 27 -5.397 4.704 -10.747 1.00 0.00 N ATOM 399 CA ASP A 27 -5.860 3.583 -9.948 1.00 0.00 C ATOM 400 C ASP A 27 -5.344 2.278 -10.559 1.00 0.00 C ATOM 401 O ASP A 27 -5.621 1.196 -10.045 1.00 0.00 O ATOM 402 CB ASP A 27 -7.388 3.521 -9.918 1.00 0.00 C ATOM 403 CG ASP A 27 -8.049 3.238 -11.269 1.00 0.00 C ATOM 404 OD1 ASP A 27 -7.295 3.139 -12.261 1.00 0.00 O ATOM 405 OD2 ASP A 27 -9.295 3.125 -11.279 1.00 0.00 O ATOM 0 H ASP A 27 -6.131 5.195 -11.258 1.00 0.00 H new ATOM 0 HA ASP A 27 -5.485 3.715 -8.933 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -7.692 2.748 -9.212 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -7.768 4.468 -9.536 1.00 0.00 H new ATOM 410 N SER A 28 -4.606 2.424 -11.650 1.00 0.00 N ATOM 411 CA SER A 28 -4.050 1.272 -12.338 1.00 0.00 C ATOM 412 C SER A 28 -2.766 0.816 -11.639 1.00 0.00 C ATOM 413 O SER A 28 -2.523 -0.383 -11.503 1.00 0.00 O ATOM 414 CB SER A 28 -3.771 1.589 -13.807 1.00 0.00 C ATOM 415 OG SER A 28 -3.202 2.885 -13.975 1.00 0.00 O ATOM 0 H SER A 28 -4.380 3.324 -12.074 1.00 0.00 H new ATOM 0 HA SER A 28 -4.782 0.465 -12.302 1.00 0.00 H new ATOM 0 HB2 SER A 28 -3.094 0.840 -14.217 1.00 0.00 H new ATOM 0 HB3 SER A 28 -4.699 1.524 -14.374 1.00 0.00 H new ATOM 0 HG SER A 28 -3.037 3.049 -14.927 1.00 0.00 H new ATOM 421 N VAL A 29 -1.980 1.794 -11.218 1.00 0.00 N ATOM 422 CA VAL A 29 -0.728 1.507 -10.538 1.00 0.00 C ATOM 423 C VAL A 29 -1.023 0.809 -9.209 1.00 0.00 C ATOM 424 O VAL A 29 -0.286 -0.088 -8.798 1.00 0.00 O ATOM 425 CB VAL A 29 0.082 2.794 -10.370 1.00 0.00 C ATOM 426 CG1 VAL A 29 0.271 3.504 -11.712 1.00 0.00 C ATOM 427 CG2 VAL A 29 -0.572 3.724 -9.346 1.00 0.00 C ATOM 0 H VAL A 29 -2.185 2.786 -11.334 1.00 0.00 H new ATOM 0 HA VAL A 29 -0.117 0.828 -11.133 1.00 0.00 H new ATOM 0 HB VAL A 29 1.068 2.521 -9.994 1.00 0.00 H new ATOM 0 HG11 VAL A 29 0.850 4.415 -11.563 1.00 0.00 H new ATOM 0 HG12 VAL A 29 0.801 2.846 -12.400 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -0.703 3.757 -12.130 1.00 0.00 H new ATOM 0 HG21 VAL A 29 0.024 4.631 -9.246 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -1.576 3.985 -9.680 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -0.630 3.220 -8.381 1.00 0.00 H new ATOM 437 N VAL A 30 -2.100 1.244 -8.575 1.00 0.00 N ATOM 438 CA VAL A 30 -2.501 0.670 -7.301 1.00 0.00 C ATOM 439 C VAL A 30 -3.123 -0.707 -7.540 1.00 0.00 C ATOM 440 O VAL A 30 -3.000 -1.602 -6.703 1.00 0.00 O ATOM 441 CB VAL A 30 -3.440 1.631 -6.567 1.00 0.00 C ATOM 442 CG1 VAL A 30 -2.814 3.022 -6.446 1.00 0.00 C ATOM 443 CG2 VAL A 30 -4.802 1.701 -7.257 1.00 0.00 C ATOM 0 H VAL A 30 -2.708 1.987 -8.919 1.00 0.00 H new ATOM 0 HA VAL A 30 -1.634 0.527 -6.656 1.00 0.00 H new ATOM 0 HB VAL A 30 -3.595 1.244 -5.560 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -3.501 3.686 -5.921 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -1.879 2.953 -5.890 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -2.615 3.419 -7.441 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -5.449 2.391 -6.715 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -4.674 2.052 -8.281 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -5.256 0.710 -7.268 1.00 0.00 H new ATOM 453 N ALA A 31 -3.778 -0.835 -8.684 1.00 0.00 N ATOM 454 CA ALA A 31 -4.419 -2.088 -9.043 1.00 0.00 C ATOM 455 C ALA A 31 -3.347 -3.143 -9.322 1.00 0.00 C ATOM 456 O ALA A 31 -3.628 -4.341 -9.300 1.00 0.00 O ATOM 457 CB ALA A 31 -5.341 -1.865 -10.243 1.00 0.00 C ATOM 0 H ALA A 31 -3.879 -0.091 -9.375 1.00 0.00 H new ATOM 0 HA ALA A 31 -5.035 -2.452 -8.221 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -5.822 -2.805 -10.512 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -6.102 -1.129 -9.985 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -4.757 -1.501 -11.088 1.00 0.00 H new ATOM 463 N ASP A 32 -2.139 -2.661 -9.577 1.00 0.00 N ATOM 464 CA ASP A 32 -1.024 -3.548 -9.860 1.00 0.00 C ATOM 465 C ASP A 32 -0.645 -4.305 -8.585 1.00 0.00 C ATOM 466 O ASP A 32 -0.083 -5.398 -8.652 1.00 0.00 O ATOM 467 CB ASP A 32 0.203 -2.760 -10.323 1.00 0.00 C ATOM 468 CG ASP A 32 0.932 -3.350 -11.532 1.00 0.00 C ATOM 469 OD1 ASP A 32 0.664 -4.533 -11.834 1.00 0.00 O ATOM 470 OD2 ASP A 32 1.739 -2.604 -12.127 1.00 0.00 O ATOM 0 H ASP A 32 -1.909 -1.668 -9.593 1.00 0.00 H new ATOM 0 HA ASP A 32 -1.331 -4.235 -10.649 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -0.107 -1.743 -10.565 1.00 0.00 H new ATOM 0 HB3 ASP A 32 0.906 -2.690 -9.493 1.00 0.00 H new ATOM 475 N LEU A 33 -0.967 -3.694 -7.454 1.00 0.00 N ATOM 476 CA LEU A 33 -0.667 -4.298 -6.167 1.00 0.00 C ATOM 477 C LEU A 33 -1.336 -5.671 -6.082 1.00 0.00 C ATOM 478 O LEU A 33 -0.696 -6.657 -5.722 1.00 0.00 O ATOM 479 CB LEU A 33 -1.057 -3.353 -5.029 1.00 0.00 C ATOM 480 CG LEU A 33 -0.587 -3.756 -3.629 1.00 0.00 C ATOM 481 CD1 LEU A 33 -1.655 -3.446 -2.581 1.00 0.00 C ATOM 482 CD2 LEU A 33 -0.163 -5.227 -3.597 1.00 0.00 C ATOM 0 H LEU A 33 -1.432 -2.788 -7.402 1.00 0.00 H new ATOM 0 HA LEU A 33 0.406 -4.460 -6.064 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -0.659 -2.363 -5.253 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -2.143 -3.264 -5.014 1.00 0.00 H new ATOM 0 HG LEU A 33 0.291 -3.160 -3.379 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -1.295 -3.742 -1.596 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -1.868 -2.377 -2.583 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -2.566 -3.997 -2.815 1.00 0.00 H new ATOM 0 HD21 LEU A 33 0.167 -5.489 -2.592 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -1.008 -5.856 -3.877 1.00 0.00 H new ATOM 0 HD23 LEU A 33 0.655 -5.385 -4.300 1.00 0.00 H new ATOM 494 N TYR A 34 -2.618 -5.690 -6.422 1.00 0.00 N ATOM 495 CA TYR A 34 -3.381 -6.926 -6.389 1.00 0.00 C ATOM 496 C TYR A 34 -2.789 -7.961 -7.347 1.00 0.00 C ATOM 497 O TYR A 34 -3.027 -9.160 -7.197 1.00 0.00 O ATOM 498 CB TYR A 34 -4.791 -6.562 -6.858 1.00 0.00 C ATOM 499 CG TYR A 34 -5.905 -7.305 -6.116 1.00 0.00 C ATOM 500 CD1 TYR A 34 -5.964 -8.683 -6.162 1.00 0.00 C ATOM 501 CD2 TYR A 34 -6.849 -6.597 -5.402 1.00 0.00 C ATOM 502 CE1 TYR A 34 -7.011 -9.383 -5.464 1.00 0.00 C ATOM 503 CE2 TYR A 34 -7.897 -7.297 -4.704 1.00 0.00 C ATOM 504 CZ TYR A 34 -7.927 -8.655 -4.769 1.00 0.00 C ATOM 505 OH TYR A 34 -8.915 -9.315 -4.110 1.00 0.00 O ATOM 0 H TYR A 34 -3.146 -4.870 -6.721 1.00 0.00 H new ATOM 0 HA TYR A 34 -3.371 -7.357 -5.388 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -4.939 -5.489 -6.734 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -4.874 -6.774 -7.924 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -5.225 -9.237 -6.722 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -6.803 -5.519 -5.366 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -7.068 -10.461 -5.491 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -8.643 -6.755 -4.141 1.00 0.00 H new ATOM 0 HH TYR A 34 -9.495 -8.668 -3.657 1.00 0.00 H new ATOM 515 N ASN A 35 -2.030 -7.463 -8.312 1.00 0.00 N ATOM 516 CA ASN A 35 -1.403 -8.330 -9.295 1.00 0.00 C ATOM 517 C ASN A 35 -0.111 -8.903 -8.711 1.00 0.00 C ATOM 518 O ASN A 35 -0.046 -10.086 -8.380 1.00 0.00 O ATOM 519 CB ASN A 35 -1.046 -7.555 -10.565 1.00 0.00 C ATOM 520 CG ASN A 35 -2.054 -7.836 -11.681 1.00 0.00 C ATOM 521 OD1 ASN A 35 -3.054 -7.155 -11.836 1.00 0.00 O ATOM 522 ND2 ASN A 35 -1.735 -8.874 -12.449 1.00 0.00 N ATOM 0 H ASN A 35 -1.835 -6.469 -8.434 1.00 0.00 H new ATOM 0 HA ASN A 35 -2.107 -9.124 -9.544 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -1.025 -6.487 -10.350 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -0.045 -7.833 -10.896 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -2.343 -9.142 -13.223 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -0.882 -9.402 -12.264 1.00 0.00 H new ATOM 529 N PHE A 36 0.887 -8.038 -8.603 1.00 0.00 N ATOM 530 CA PHE A 36 2.174 -8.443 -8.064 1.00 0.00 C ATOM 531 C PHE A 36 3.272 -7.456 -8.464 1.00 0.00 C ATOM 532 O PHE A 36 4.380 -7.861 -8.810 1.00 0.00 O ATOM 533 CB PHE A 36 2.496 -9.815 -8.663 1.00 0.00 C ATOM 534 CG PHE A 36 2.025 -9.990 -10.107 1.00 0.00 C ATOM 535 CD1 PHE A 36 2.050 -8.934 -10.964 1.00 0.00 C ATOM 536 CD2 PHE A 36 1.582 -11.202 -10.536 1.00 0.00 C ATOM 537 CE1 PHE A 36 1.613 -9.096 -12.305 1.00 0.00 C ATOM 538 CE2 PHE A 36 1.143 -11.365 -11.877 1.00 0.00 C ATOM 539 CZ PHE A 36 1.168 -10.308 -12.734 1.00 0.00 C ATOM 0 H PHE A 36 0.830 -7.058 -8.880 1.00 0.00 H new ATOM 0 HA PHE A 36 2.129 -8.473 -6.975 1.00 0.00 H new ATOM 0 HB2 PHE A 36 3.574 -9.974 -8.621 1.00 0.00 H new ATOM 0 HB3 PHE A 36 2.036 -10.586 -8.046 1.00 0.00 H new ATOM 0 HD1 PHE A 36 2.403 -7.971 -10.624 1.00 0.00 H new ATOM 0 HD2 PHE A 36 1.564 -12.041 -9.857 1.00 0.00 H new ATOM 0 HE1 PHE A 36 1.634 -8.257 -12.985 1.00 0.00 H new ATOM 0 HE2 PHE A 36 0.789 -12.327 -12.216 1.00 0.00 H new ATOM 0 HZ PHE A 36 0.835 -10.431 -13.754 1.00 0.00 H new ATOM 549 N TRP A 37 2.924 -6.179 -8.405 1.00 0.00 N ATOM 550 CA TRP A 37 3.865 -5.130 -8.755 1.00 0.00 C ATOM 551 C TRP A 37 4.583 -4.691 -7.477 1.00 0.00 C ATOM 552 O TRP A 37 5.162 -3.606 -7.427 1.00 0.00 O ATOM 553 CB TRP A 37 3.159 -3.976 -9.471 1.00 0.00 C ATOM 554 CG TRP A 37 3.142 -2.669 -8.676 1.00 0.00 C ATOM 555 CD1 TRP A 37 3.401 -1.430 -9.118 1.00 0.00 C ATOM 556 CD2 TRP A 37 2.837 -2.519 -7.273 1.00 0.00 C ATOM 557 NE1 TRP A 37 3.286 -0.498 -8.108 1.00 0.00 N ATOM 558 CE2 TRP A 37 2.932 -1.181 -6.950 1.00 0.00 C ATOM 559 CE3 TRP A 37 2.493 -3.484 -6.310 1.00 0.00 C ATOM 560 CZ2 TRP A 37 2.697 -0.685 -5.662 1.00 0.00 C ATOM 561 CZ3 TRP A 37 2.261 -2.971 -5.027 1.00 0.00 C ATOM 562 CH2 TRP A 37 2.353 -1.627 -4.686 1.00 0.00 C ATOM 0 H TRP A 37 2.003 -5.847 -8.120 1.00 0.00 H new ATOM 0 HA TRP A 37 4.608 -5.500 -9.461 1.00 0.00 H new ATOM 0 HB2 TRP A 37 3.650 -3.801 -10.428 1.00 0.00 H new ATOM 0 HB3 TRP A 37 2.132 -4.271 -9.689 1.00 0.00 H new ATOM 0 HD1 TRP A 37 3.666 -1.192 -10.137 1.00 0.00 H new ATOM 0 HE1 TRP A 37 3.434 0.508 -8.195 1.00 0.00 H new ATOM 0 HE3 TRP A 37 2.414 -4.536 -6.541 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 2.777 0.368 -5.434 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 1.992 -3.669 -4.248 1.00 0.00 H new ATOM 0 HH2 TRP A 37 2.160 -1.311 -3.672 1.00 0.00 H new ATOM 573 N LYS A 38 4.522 -5.556 -6.476 1.00 0.00 N ATOM 574 CA LYS A 38 5.159 -5.271 -5.201 1.00 0.00 C ATOM 575 C LYS A 38 6.548 -4.680 -5.450 1.00 0.00 C ATOM 576 O LYS A 38 6.841 -3.569 -5.009 1.00 0.00 O ATOM 577 CB LYS A 38 5.172 -6.521 -4.318 1.00 0.00 C ATOM 578 CG LYS A 38 4.231 -6.358 -3.123 1.00 0.00 C ATOM 579 CD LYS A 38 2.791 -6.704 -3.509 1.00 0.00 C ATOM 580 CE LYS A 38 2.288 -7.914 -2.719 1.00 0.00 C ATOM 581 NZ LYS A 38 2.419 -9.149 -3.523 1.00 0.00 N ATOM 0 H LYS A 38 4.041 -6.455 -6.521 1.00 0.00 H new ATOM 0 HA LYS A 38 4.589 -4.524 -4.649 1.00 0.00 H new ATOM 0 HB2 LYS A 38 4.872 -7.389 -4.906 1.00 0.00 H new ATOM 0 HB3 LYS A 38 6.185 -6.710 -3.964 1.00 0.00 H new ATOM 0 HG2 LYS A 38 4.558 -7.003 -2.307 1.00 0.00 H new ATOM 0 HG3 LYS A 38 4.277 -5.333 -2.756 1.00 0.00 H new ATOM 0 HD2 LYS A 38 2.144 -5.847 -3.320 1.00 0.00 H new ATOM 0 HD3 LYS A 38 2.737 -6.915 -4.577 1.00 0.00 H new ATOM 0 HE2 LYS A 38 2.856 -8.013 -1.794 1.00 0.00 H new ATOM 0 HE3 LYS A 38 1.245 -7.765 -2.438 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 2.073 -9.960 -2.972 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 1.858 -9.057 -4.394 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 3.418 -9.299 -3.769 1.00 0.00 H new ATOM 595 N ASP A 39 7.365 -5.448 -6.156 1.00 0.00 N ATOM 596 CA ASP A 39 8.716 -5.013 -6.470 1.00 0.00 C ATOM 597 C ASP A 39 8.676 -3.577 -6.995 1.00 0.00 C ATOM 598 O ASP A 39 9.583 -2.789 -6.731 1.00 0.00 O ATOM 599 CB ASP A 39 9.341 -5.895 -7.553 1.00 0.00 C ATOM 600 CG ASP A 39 8.645 -5.837 -8.914 1.00 0.00 C ATOM 601 OD1 ASP A 39 7.431 -5.540 -8.919 1.00 0.00 O ATOM 602 OD2 ASP A 39 9.343 -6.094 -9.919 1.00 0.00 O ATOM 0 H ASP A 39 7.118 -6.368 -6.519 1.00 0.00 H new ATOM 0 HA ASP A 39 9.312 -5.082 -5.560 1.00 0.00 H new ATOM 0 HB2 ASP A 39 10.383 -5.603 -7.682 1.00 0.00 H new ATOM 0 HB3 ASP A 39 9.340 -6.928 -7.205 1.00 0.00 H new ATOM 607 N ASP A 40 7.613 -3.278 -7.729 1.00 0.00 N ATOM 608 CA ASP A 40 7.444 -1.950 -8.294 1.00 0.00 C ATOM 609 C ASP A 40 6.806 -1.034 -7.248 1.00 0.00 C ATOM 610 O ASP A 40 5.597 -0.814 -7.264 1.00 0.00 O ATOM 611 CB ASP A 40 6.523 -1.985 -9.516 1.00 0.00 C ATOM 612 CG ASP A 40 6.228 -0.620 -10.142 1.00 0.00 C ATOM 613 OD1 ASP A 40 6.081 0.343 -9.360 1.00 0.00 O ATOM 614 OD2 ASP A 40 6.157 -0.571 -11.389 1.00 0.00 O ATOM 0 H ASP A 40 6.861 -3.933 -7.945 1.00 0.00 H new ATOM 0 HA ASP A 40 8.426 -1.582 -8.592 1.00 0.00 H new ATOM 0 HB2 ASP A 40 6.974 -2.626 -10.274 1.00 0.00 H new ATOM 0 HB3 ASP A 40 5.579 -2.448 -9.228 1.00 0.00 H new ATOM 619 N TYR A 41 7.651 -0.523 -6.363 1.00 0.00 N ATOM 620 CA TYR A 41 7.185 0.365 -5.311 1.00 0.00 C ATOM 621 C TYR A 41 7.428 1.830 -5.681 1.00 0.00 C ATOM 622 O TYR A 41 7.831 2.130 -6.804 1.00 0.00 O ATOM 623 CB TYR A 41 8.014 0.021 -4.072 1.00 0.00 C ATOM 624 CG TYR A 41 7.736 -1.374 -3.505 1.00 0.00 C ATOM 625 CD1 TYR A 41 6.531 -1.642 -2.889 1.00 0.00 C ATOM 626 CD2 TYR A 41 8.692 -2.364 -3.611 1.00 0.00 C ATOM 627 CE1 TYR A 41 6.271 -2.954 -2.355 1.00 0.00 C ATOM 628 CE2 TYR A 41 8.432 -3.676 -3.079 1.00 0.00 C ATOM 629 CZ TYR A 41 7.234 -3.906 -2.478 1.00 0.00 C ATOM 630 OH TYR A 41 6.988 -5.145 -1.975 1.00 0.00 O ATOM 0 H TYR A 41 8.654 -0.707 -6.353 1.00 0.00 H new ATOM 0 HA TYR A 41 6.115 0.238 -5.148 1.00 0.00 H new ATOM 0 HB2 TYR A 41 9.072 0.096 -4.323 1.00 0.00 H new ATOM 0 HB3 TYR A 41 7.817 0.763 -3.298 1.00 0.00 H new ATOM 0 HD1 TYR A 41 5.783 -0.868 -2.807 1.00 0.00 H new ATOM 0 HD2 TYR A 41 9.635 -2.154 -4.093 1.00 0.00 H new ATOM 0 HE1 TYR A 41 5.333 -3.177 -1.868 1.00 0.00 H new ATOM 0 HE2 TYR A 41 9.171 -4.460 -3.155 1.00 0.00 H new ATOM 0 HH TYR A 41 6.094 -5.164 -1.574 1.00 0.00 H new ATOM 640 N VAL A 42 7.173 2.701 -4.717 1.00 0.00 N ATOM 641 CA VAL A 42 7.359 4.127 -4.928 1.00 0.00 C ATOM 642 C VAL A 42 8.576 4.350 -5.828 1.00 0.00 C ATOM 643 O VAL A 42 8.597 5.283 -6.628 1.00 0.00 O ATOM 644 CB VAL A 42 7.471 4.845 -3.583 1.00 0.00 C ATOM 645 CG1 VAL A 42 6.138 4.815 -2.831 1.00 0.00 C ATOM 646 CG2 VAL A 42 8.592 4.244 -2.732 1.00 0.00 C ATOM 0 H VAL A 42 6.839 2.447 -3.787 1.00 0.00 H new ATOM 0 HA VAL A 42 6.495 4.554 -5.437 1.00 0.00 H new ATOM 0 HB VAL A 42 7.721 5.887 -3.781 1.00 0.00 H new ATOM 0 HG11 VAL A 42 6.246 5.333 -1.878 1.00 0.00 H new ATOM 0 HG12 VAL A 42 5.372 5.310 -3.428 1.00 0.00 H new ATOM 0 HG13 VAL A 42 5.845 3.781 -2.651 1.00 0.00 H new ATOM 0 HG21 VAL A 42 8.650 4.773 -1.781 1.00 0.00 H new ATOM 0 HG22 VAL A 42 8.384 3.190 -2.549 1.00 0.00 H new ATOM 0 HG23 VAL A 42 9.541 4.341 -3.259 1.00 0.00 H new ATOM 656 N MET A 43 9.560 3.477 -5.666 1.00 0.00 N ATOM 657 CA MET A 43 10.778 3.567 -6.453 1.00 0.00 C ATOM 658 C MET A 43 10.464 3.923 -7.909 1.00 0.00 C ATOM 659 O MET A 43 11.301 4.498 -8.605 1.00 0.00 O ATOM 660 CB MET A 43 11.519 2.230 -6.402 1.00 0.00 C ATOM 661 CG MET A 43 10.641 1.095 -6.934 1.00 0.00 C ATOM 662 SD MET A 43 11.612 -0.004 -7.950 1.00 0.00 S ATOM 663 CE MET A 43 12.271 -1.087 -6.693 1.00 0.00 C ATOM 0 H MET A 43 9.538 2.704 -5.001 1.00 0.00 H new ATOM 0 HA MET A 43 11.403 4.354 -6.033 1.00 0.00 H new ATOM 0 HB2 MET A 43 12.433 2.294 -6.992 1.00 0.00 H new ATOM 0 HB3 MET A 43 11.816 2.014 -5.376 1.00 0.00 H new ATOM 0 HG2 MET A 43 10.203 0.543 -6.102 1.00 0.00 H new ATOM 0 HG3 MET A 43 9.815 1.505 -7.515 1.00 0.00 H new ATOM 0 HE1 MET A 43 12.598 -2.020 -7.152 1.00 0.00 H new ATOM 0 HE2 MET A 43 13.119 -0.605 -6.206 1.00 0.00 H new ATOM 0 HE3 MET A 43 11.499 -1.298 -5.953 1.00 0.00 H new ATOM 673 N THR A 44 9.258 3.566 -8.324 1.00 0.00 N ATOM 674 CA THR A 44 8.824 3.840 -9.683 1.00 0.00 C ATOM 675 C THR A 44 7.570 4.715 -9.677 1.00 0.00 C ATOM 676 O THR A 44 7.508 5.724 -10.378 1.00 0.00 O ATOM 677 CB THR A 44 8.627 2.501 -10.398 1.00 0.00 C ATOM 678 OG1 THR A 44 9.922 2.180 -10.899 1.00 0.00 O ATOM 679 CG2 THR A 44 7.761 2.626 -11.651 1.00 0.00 C ATOM 0 H THR A 44 8.568 3.090 -7.743 1.00 0.00 H new ATOM 0 HA THR A 44 9.576 4.408 -10.230 1.00 0.00 H new ATOM 0 HB THR A 44 8.169 1.789 -9.712 1.00 0.00 H new ATOM 0 HG1 THR A 44 9.886 1.325 -11.376 1.00 0.00 H new ATOM 0 HG21 THR A 44 7.654 1.647 -12.118 1.00 0.00 H new ATOM 0 HG22 THR A 44 6.777 3.007 -11.377 1.00 0.00 H new ATOM 0 HG23 THR A 44 8.233 3.313 -12.353 1.00 0.00 H new ATOM 687 N ASP A 45 6.600 4.296 -8.877 1.00 0.00 N ATOM 688 CA ASP A 45 5.350 5.029 -8.770 1.00 0.00 C ATOM 689 C ASP A 45 5.070 5.338 -7.297 1.00 0.00 C ATOM 690 O ASP A 45 4.580 4.483 -6.562 1.00 0.00 O ATOM 691 CB ASP A 45 4.180 4.206 -9.311 1.00 0.00 C ATOM 692 CG ASP A 45 3.089 5.016 -10.014 1.00 0.00 C ATOM 693 OD1 ASP A 45 3.337 5.415 -11.171 1.00 0.00 O ATOM 694 OD2 ASP A 45 2.032 5.217 -9.377 1.00 0.00 O ATOM 0 H ASP A 45 6.655 3.459 -8.297 1.00 0.00 H new ATOM 0 HA ASP A 45 5.446 5.945 -9.353 1.00 0.00 H new ATOM 0 HB2 ASP A 45 4.569 3.466 -10.010 1.00 0.00 H new ATOM 0 HB3 ASP A 45 3.728 3.658 -8.484 1.00 0.00 H new ATOM 699 N ARG A 46 5.393 6.564 -6.911 1.00 0.00 N ATOM 700 CA ARG A 46 5.182 6.997 -5.541 1.00 0.00 C ATOM 701 C ARG A 46 3.691 6.964 -5.197 1.00 0.00 C ATOM 702 O ARG A 46 3.309 6.511 -4.120 1.00 0.00 O ATOM 703 CB ARG A 46 5.719 8.412 -5.321 1.00 0.00 C ATOM 704 CG ARG A 46 5.284 8.958 -3.959 1.00 0.00 C ATOM 705 CD ARG A 46 4.529 10.279 -4.114 1.00 0.00 C ATOM 706 NE ARG A 46 4.037 10.738 -2.795 1.00 0.00 N ATOM 707 CZ ARG A 46 3.727 12.010 -2.511 1.00 0.00 C ATOM 708 NH1 ARG A 46 3.856 12.958 -3.449 1.00 0.00 N ATOM 709 NH2 ARG A 46 3.289 12.335 -1.286 1.00 0.00 N ATOM 0 H ARG A 46 5.799 7.271 -7.524 1.00 0.00 H new ATOM 0 HA ARG A 46 5.723 6.311 -4.890 1.00 0.00 H new ATOM 0 HB2 ARG A 46 6.807 8.406 -5.384 1.00 0.00 H new ATOM 0 HB3 ARG A 46 5.358 9.069 -6.112 1.00 0.00 H new ATOM 0 HG2 ARG A 46 4.649 8.229 -3.457 1.00 0.00 H new ATOM 0 HG3 ARG A 46 6.159 9.107 -3.327 1.00 0.00 H new ATOM 0 HD2 ARG A 46 5.184 11.033 -4.550 1.00 0.00 H new ATOM 0 HD3 ARG A 46 3.691 10.150 -4.799 1.00 0.00 H new ATOM 0 HE ARG A 46 3.927 10.043 -2.057 1.00 0.00 H new ATOM 0 HH11 ARG A 46 4.191 12.712 -4.381 1.00 0.00 H new ATOM 0 HH12 ARG A 46 3.620 13.926 -3.232 1.00 0.00 H new ATOM 0 HH21 ARG A 46 3.192 11.614 -0.571 1.00 0.00 H new ATOM 0 HH22 ARG A 46 3.053 13.303 -1.069 1.00 0.00 H new ATOM 723 N LEU A 47 2.891 7.453 -6.133 1.00 0.00 N ATOM 724 CA LEU A 47 1.450 7.486 -5.943 1.00 0.00 C ATOM 725 C LEU A 47 0.976 6.123 -5.433 1.00 0.00 C ATOM 726 O LEU A 47 0.154 6.049 -4.521 1.00 0.00 O ATOM 727 CB LEU A 47 0.752 7.939 -7.226 1.00 0.00 C ATOM 728 CG LEU A 47 1.410 9.100 -7.974 1.00 0.00 C ATOM 729 CD1 LEU A 47 2.046 10.090 -6.998 1.00 0.00 C ATOM 730 CD2 LEU A 47 2.415 8.585 -9.007 1.00 0.00 C ATOM 0 H LEU A 47 3.213 7.829 -7.025 1.00 0.00 H new ATOM 0 HA LEU A 47 1.182 8.221 -5.184 1.00 0.00 H new ATOM 0 HB2 LEU A 47 0.689 7.086 -7.902 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -0.270 8.225 -6.978 1.00 0.00 H new ATOM 0 HG LEU A 47 0.636 9.640 -8.519 1.00 0.00 H new ATOM 0 HD11 LEU A 47 2.507 10.905 -7.556 1.00 0.00 H new ATOM 0 HD12 LEU A 47 1.279 10.491 -6.335 1.00 0.00 H new ATOM 0 HD13 LEU A 47 2.806 9.580 -6.406 1.00 0.00 H new ATOM 0 HD21 LEU A 47 2.869 9.430 -9.525 1.00 0.00 H new ATOM 0 HD22 LEU A 47 3.191 8.008 -8.504 1.00 0.00 H new ATOM 0 HD23 LEU A 47 1.902 7.950 -9.729 1.00 0.00 H new ATOM 742 N ALA A 48 1.516 5.077 -6.043 1.00 0.00 N ATOM 743 CA ALA A 48 1.158 3.721 -5.662 1.00 0.00 C ATOM 744 C ALA A 48 1.423 3.530 -4.167 1.00 0.00 C ATOM 745 O ALA A 48 0.714 2.779 -3.499 1.00 0.00 O ATOM 746 CB ALA A 48 1.937 2.727 -6.524 1.00 0.00 C ATOM 0 H ALA A 48 2.199 5.142 -6.798 1.00 0.00 H new ATOM 0 HA ALA A 48 0.097 3.540 -5.834 1.00 0.00 H new ATOM 0 HB1 ALA A 48 1.669 1.710 -6.239 1.00 0.00 H new ATOM 0 HB2 ALA A 48 1.692 2.886 -7.574 1.00 0.00 H new ATOM 0 HB3 ALA A 48 3.006 2.876 -6.375 1.00 0.00 H new ATOM 752 N GLY A 49 2.445 4.223 -3.685 1.00 0.00 N ATOM 753 CA GLY A 49 2.811 4.138 -2.283 1.00 0.00 C ATOM 754 C GLY A 49 1.906 5.024 -1.424 1.00 0.00 C ATOM 755 O GLY A 49 1.643 4.711 -0.265 1.00 0.00 O ATOM 0 H GLY A 49 3.030 4.846 -4.242 1.00 0.00 H new ATOM 0 HA2 GLY A 49 2.738 3.104 -1.947 1.00 0.00 H new ATOM 0 HA3 GLY A 49 3.850 4.442 -2.156 1.00 0.00 H new ATOM 759 N CYS A 50 1.452 6.112 -2.028 1.00 0.00 N ATOM 760 CA CYS A 50 0.582 7.045 -1.335 1.00 0.00 C ATOM 761 C CYS A 50 -0.836 6.472 -1.338 1.00 0.00 C ATOM 762 O CYS A 50 -1.517 6.481 -0.314 1.00 0.00 O ATOM 763 CB CYS A 50 0.635 8.441 -1.959 1.00 0.00 C ATOM 764 SG CYS A 50 1.649 9.655 -1.038 1.00 0.00 S ATOM 0 H CYS A 50 1.671 6.368 -2.991 1.00 0.00 H new ATOM 0 HA CYS A 50 0.922 7.167 -0.307 1.00 0.00 H new ATOM 0 HB2 CYS A 50 1.027 8.356 -2.973 1.00 0.00 H new ATOM 0 HB3 CYS A 50 -0.382 8.826 -2.041 1.00 0.00 H new ATOM 769 N ALA A 51 -1.242 5.988 -2.503 1.00 0.00 N ATOM 770 CA ALA A 51 -2.567 5.411 -2.655 1.00 0.00 C ATOM 771 C ALA A 51 -2.744 4.277 -1.644 1.00 0.00 C ATOM 772 O ALA A 51 -3.752 4.217 -0.942 1.00 0.00 O ATOM 773 CB ALA A 51 -2.758 4.942 -4.098 1.00 0.00 C ATOM 0 H ALA A 51 -0.676 5.984 -3.351 1.00 0.00 H new ATOM 0 HA ALA A 51 -3.336 6.157 -2.451 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -3.752 4.509 -4.211 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -2.653 5.791 -4.773 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -2.006 4.191 -4.339 1.00 0.00 H new ATOM 779 N ILE A 52 -1.746 3.404 -1.603 1.00 0.00 N ATOM 780 CA ILE A 52 -1.780 2.275 -0.689 1.00 0.00 C ATOM 781 C ILE A 52 -1.955 2.785 0.741 1.00 0.00 C ATOM 782 O ILE A 52 -2.673 2.180 1.536 1.00 0.00 O ATOM 783 CB ILE A 52 -0.543 1.394 -0.881 1.00 0.00 C ATOM 784 CG1 ILE A 52 -0.909 -0.089 -0.821 1.00 0.00 C ATOM 785 CG2 ILE A 52 0.549 1.756 0.128 1.00 0.00 C ATOM 786 CD1 ILE A 52 -1.751 -0.396 0.418 1.00 0.00 C ATOM 0 H ILE A 52 -0.911 3.456 -2.187 1.00 0.00 H new ATOM 0 HA ILE A 52 -2.636 1.636 -0.905 1.00 0.00 H new ATOM 0 HB ILE A 52 -0.140 1.585 -1.876 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -1.461 -0.368 -1.719 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -0.001 -0.691 -0.806 1.00 0.00 H new ATOM 0 HG21 ILE A 52 1.417 1.116 -0.030 1.00 0.00 H new ATOM 0 HG22 ILE A 52 0.838 2.798 -0.007 1.00 0.00 H new ATOM 0 HG23 ILE A 52 0.171 1.612 1.140 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -1.998 -1.458 0.436 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -1.187 -0.139 1.314 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -2.670 0.190 0.388 1.00 0.00 H new ATOM 798 N ASN A 53 -1.288 3.894 1.026 1.00 0.00 N ATOM 799 CA ASN A 53 -1.361 4.493 2.348 1.00 0.00 C ATOM 800 C ASN A 53 -2.815 4.864 2.654 1.00 0.00 C ATOM 801 O ASN A 53 -3.310 4.591 3.747 1.00 0.00 O ATOM 802 CB ASN A 53 -0.523 5.770 2.421 1.00 0.00 C ATOM 803 CG ASN A 53 0.568 5.650 3.488 1.00 0.00 C ATOM 804 OD1 ASN A 53 1.564 4.967 3.320 1.00 0.00 O ATOM 805 ND2 ASN A 53 0.323 6.349 4.592 1.00 0.00 N ATOM 0 H ASN A 53 -0.694 4.393 0.364 1.00 0.00 H new ATOM 0 HA ASN A 53 -0.979 3.769 3.068 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -0.067 5.966 1.450 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -1.167 6.619 2.648 1.00 0.00 H new ATOM 0 HD21 ASN A 53 0.990 6.334 5.364 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -0.532 6.901 4.667 1.00 0.00 H new ATOM 812 N CYS A 54 -3.455 5.479 1.671 1.00 0.00 N ATOM 813 CA CYS A 54 -4.840 5.890 1.823 1.00 0.00 C ATOM 814 C CYS A 54 -5.694 4.636 2.023 1.00 0.00 C ATOM 815 O CYS A 54 -6.757 4.695 2.639 1.00 0.00 O ATOM 816 CB CYS A 54 -5.318 6.720 0.631 1.00 0.00 C ATOM 817 SG CYS A 54 -6.379 5.819 -0.558 1.00 0.00 S ATOM 0 H CYS A 54 -3.040 5.703 0.766 1.00 0.00 H new ATOM 0 HA CYS A 54 -4.936 6.537 2.695 1.00 0.00 H new ATOM 0 HB2 CYS A 54 -5.868 7.583 1.005 1.00 0.00 H new ATOM 0 HB3 CYS A 54 -4.446 7.103 0.100 1.00 0.00 H new ATOM 822 N LEU A 55 -5.197 3.529 1.490 1.00 0.00 N ATOM 823 CA LEU A 55 -5.901 2.262 1.603 1.00 0.00 C ATOM 824 C LEU A 55 -6.243 2.003 3.071 1.00 0.00 C ATOM 825 O LEU A 55 -7.291 1.435 3.377 1.00 0.00 O ATOM 826 CB LEU A 55 -5.090 1.140 0.952 1.00 0.00 C ATOM 827 CG LEU A 55 -5.891 -0.072 0.470 1.00 0.00 C ATOM 828 CD1 LEU A 55 -5.836 -0.195 -1.054 1.00 0.00 C ATOM 829 CD2 LEU A 55 -5.419 -1.352 1.167 1.00 0.00 C ATOM 0 H LEU A 55 -4.316 3.483 0.979 1.00 0.00 H new ATOM 0 HA LEU A 55 -6.844 2.299 1.058 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -4.550 1.555 0.101 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -4.343 0.796 1.667 1.00 0.00 H new ATOM 0 HG LEU A 55 -6.936 0.077 0.743 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -6.413 -1.064 -1.370 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -6.255 0.703 -1.507 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -4.800 -0.312 -1.372 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -6.004 -2.199 0.807 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -4.365 -1.519 0.946 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -5.552 -1.250 2.244 1.00 0.00 H new ATOM 841 N ALA A 56 -5.341 2.433 3.941 1.00 0.00 N ATOM 842 CA ALA A 56 -5.534 2.253 5.370 1.00 0.00 C ATOM 843 C ALA A 56 -6.693 3.135 5.838 1.00 0.00 C ATOM 844 O ALA A 56 -7.208 2.956 6.941 1.00 0.00 O ATOM 845 CB ALA A 56 -4.229 2.568 6.105 1.00 0.00 C ATOM 0 H ALA A 56 -4.474 2.906 3.684 1.00 0.00 H new ATOM 0 HA ALA A 56 -5.794 1.219 5.595 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -4.373 2.433 7.177 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -3.444 1.896 5.757 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -3.939 3.599 5.905 1.00 0.00 H new ATOM 851 N THR A 57 -7.072 4.066 4.975 1.00 0.00 N ATOM 852 CA THR A 57 -8.162 4.976 5.286 1.00 0.00 C ATOM 853 C THR A 57 -9.038 4.398 6.401 1.00 0.00 C ATOM 854 O THR A 57 -9.218 5.027 7.442 1.00 0.00 O ATOM 855 CB THR A 57 -8.929 5.254 3.992 1.00 0.00 C ATOM 856 OG1 THR A 57 -10.198 5.728 4.437 1.00 0.00 O ATOM 857 CG2 THR A 57 -9.258 3.975 3.220 1.00 0.00 C ATOM 0 H THR A 57 -6.644 4.210 4.060 1.00 0.00 H new ATOM 0 HA THR A 57 -7.788 5.925 5.669 1.00 0.00 H new ATOM 0 HB THR A 57 -8.343 5.919 3.358 1.00 0.00 H new ATOM 0 HG1 THR A 57 -10.760 5.934 3.661 1.00 0.00 H new ATOM 0 HG21 THR A 57 -9.802 4.229 2.310 1.00 0.00 H new ATOM 0 HG22 THR A 57 -8.334 3.460 2.958 1.00 0.00 H new ATOM 0 HG23 THR A 57 -9.873 3.323 3.841 1.00 0.00 H new ATOM 865 N LYS A 58 -9.558 3.207 6.141 1.00 0.00 N ATOM 866 CA LYS A 58 -10.410 2.538 7.109 1.00 0.00 C ATOM 867 C LYS A 58 -9.687 1.303 7.651 1.00 0.00 C ATOM 868 O LYS A 58 -9.844 0.204 7.119 1.00 0.00 O ATOM 869 CB LYS A 58 -11.778 2.229 6.496 1.00 0.00 C ATOM 870 CG LYS A 58 -12.731 3.416 6.660 1.00 0.00 C ATOM 871 CD LYS A 58 -13.480 3.336 7.992 1.00 0.00 C ATOM 872 CE LYS A 58 -13.698 4.731 8.582 1.00 0.00 C ATOM 873 NZ LYS A 58 -13.803 4.658 10.056 1.00 0.00 N ATOM 0 H LYS A 58 -9.406 2.689 5.275 1.00 0.00 H new ATOM 0 HA LYS A 58 -10.607 3.192 7.959 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -11.662 1.994 5.438 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -12.204 1.347 6.974 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -12.169 4.348 6.610 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -13.445 3.430 5.837 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -14.442 2.845 7.844 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -12.915 2.724 8.695 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -12.872 5.384 8.302 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -14.606 5.170 8.168 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -14.736 5.007 10.355 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -13.687 3.671 10.364 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -13.060 5.244 10.486 1.00 0.00 H new ATOM 887 N LEU A 59 -8.910 1.525 8.700 1.00 0.00 N ATOM 888 CA LEU A 59 -8.162 0.443 9.319 1.00 0.00 C ATOM 889 C LEU A 59 -9.124 -0.683 9.702 1.00 0.00 C ATOM 890 O LEU A 59 -8.702 -1.814 9.937 1.00 0.00 O ATOM 891 CB LEU A 59 -7.332 0.968 10.492 1.00 0.00 C ATOM 892 CG LEU A 59 -5.813 0.890 10.326 1.00 0.00 C ATOM 893 CD1 LEU A 59 -5.382 1.440 8.966 1.00 0.00 C ATOM 894 CD2 LEU A 59 -5.099 1.594 11.483 1.00 0.00 C ATOM 0 H LEU A 59 -8.782 2.437 9.137 1.00 0.00 H new ATOM 0 HA LEU A 59 -7.445 0.024 8.613 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -7.606 2.008 10.668 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -7.609 0.410 11.386 1.00 0.00 H new ATOM 0 HG LEU A 59 -5.518 -0.159 10.356 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -4.298 1.373 8.873 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -5.851 0.857 8.173 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -5.690 2.482 8.881 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -4.020 1.524 11.341 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -5.395 2.643 11.509 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -5.373 1.117 12.424 1.00 0.00 H new ATOM 906 N ASP A 60 -10.402 -0.335 9.755 1.00 0.00 N ATOM 907 CA ASP A 60 -11.429 -1.302 10.105 1.00 0.00 C ATOM 908 C ASP A 60 -11.532 -2.353 8.999 1.00 0.00 C ATOM 909 O ASP A 60 -11.994 -3.468 9.239 1.00 0.00 O ATOM 910 CB ASP A 60 -12.795 -0.628 10.246 1.00 0.00 C ATOM 911 CG ASP A 60 -12.849 0.521 11.256 1.00 0.00 C ATOM 912 OD1 ASP A 60 -12.283 0.335 12.355 1.00 0.00 O ATOM 913 OD2 ASP A 60 -13.455 1.556 10.906 1.00 0.00 O ATOM 0 H ASP A 60 -10.750 0.604 9.561 1.00 0.00 H new ATOM 0 HA ASP A 60 -11.152 -1.758 11.055 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -13.098 -0.248 9.270 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -13.527 -1.382 10.537 1.00 0.00 H new ATOM 918 N VAL A 61 -11.094 -1.962 7.811 1.00 0.00 N ATOM 919 CA VAL A 61 -11.131 -2.857 6.666 1.00 0.00 C ATOM 920 C VAL A 61 -9.946 -3.822 6.741 1.00 0.00 C ATOM 921 O VAL A 61 -10.093 -5.014 6.473 1.00 0.00 O ATOM 922 CB VAL A 61 -11.162 -2.047 5.369 1.00 0.00 C ATOM 923 CG1 VAL A 61 -12.059 -0.815 5.513 1.00 0.00 C ATOM 924 CG2 VAL A 61 -9.750 -1.649 4.937 1.00 0.00 C ATOM 0 H VAL A 61 -10.711 -1.037 7.616 1.00 0.00 H new ATOM 0 HA VAL A 61 -12.041 -3.457 6.679 1.00 0.00 H new ATOM 0 HB VAL A 61 -11.585 -2.680 4.589 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -12.063 -0.257 4.577 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -13.075 -1.130 5.752 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -11.679 -0.179 6.313 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -9.801 -1.074 4.012 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -9.288 -1.043 5.716 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -9.153 -2.546 4.774 1.00 0.00 H new ATOM 934 N VAL A 62 -8.798 -3.271 7.107 1.00 0.00 N ATOM 935 CA VAL A 62 -7.588 -4.069 7.219 1.00 0.00 C ATOM 936 C VAL A 62 -7.580 -4.786 8.570 1.00 0.00 C ATOM 937 O VAL A 62 -7.297 -5.982 8.642 1.00 0.00 O ATOM 938 CB VAL A 62 -6.359 -3.185 7.005 1.00 0.00 C ATOM 939 CG1 VAL A 62 -5.899 -3.230 5.546 1.00 0.00 C ATOM 940 CG2 VAL A 62 -6.630 -1.747 7.449 1.00 0.00 C ATOM 0 H VAL A 62 -8.680 -2.283 7.330 1.00 0.00 H new ATOM 0 HA VAL A 62 -7.561 -4.835 6.444 1.00 0.00 H new ATOM 0 HB VAL A 62 -5.553 -3.579 7.624 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -5.024 -2.593 5.421 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -5.644 -4.255 5.276 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -6.702 -2.874 4.900 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -5.739 -1.141 7.285 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -7.458 -1.338 6.871 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -6.887 -1.736 8.508 1.00 0.00 H new ATOM 950 N ASP A 63 -7.895 -4.028 9.609 1.00 0.00 N ATOM 951 CA ASP A 63 -7.928 -4.577 10.955 1.00 0.00 C ATOM 952 C ASP A 63 -9.304 -4.319 11.573 1.00 0.00 C ATOM 953 O ASP A 63 -9.648 -3.178 11.877 1.00 0.00 O ATOM 954 CB ASP A 63 -6.877 -3.913 11.847 1.00 0.00 C ATOM 955 CG ASP A 63 -6.511 -2.480 11.457 1.00 0.00 C ATOM 956 OD1 ASP A 63 -5.966 -2.318 10.342 1.00 0.00 O ATOM 957 OD2 ASP A 63 -6.782 -1.579 12.279 1.00 0.00 O ATOM 0 H ASP A 63 -8.130 -3.037 9.547 1.00 0.00 H new ATOM 0 HA ASP A 63 -7.721 -5.645 10.888 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -7.242 -3.912 12.874 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -5.972 -4.520 11.831 1.00 0.00 H new ATOM 962 N PRO A 64 -10.073 -5.427 11.746 1.00 0.00 N ATOM 963 CA PRO A 64 -11.403 -5.333 12.323 1.00 0.00 C ATOM 964 C PRO A 64 -11.330 -5.104 13.834 1.00 0.00 C ATOM 965 O PRO A 64 -12.096 -4.314 14.383 1.00 0.00 O ATOM 966 CB PRO A 64 -12.087 -6.637 11.951 1.00 0.00 C ATOM 967 CG PRO A 64 -10.971 -7.603 11.584 1.00 0.00 C ATOM 968 CD PRO A 64 -9.697 -6.795 11.398 1.00 0.00 C ATOM 0 HA PRO A 64 -11.967 -4.482 11.943 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -12.677 -7.020 12.784 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -12.771 -6.494 11.114 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -10.839 -8.349 12.368 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -11.218 -8.142 10.669 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -8.897 -7.162 12.042 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -9.334 -6.857 10.372 1.00 0.00 H new ATOM 976 N ASP A 65 -10.403 -5.811 14.463 1.00 0.00 N ATOM 977 CA ASP A 65 -10.221 -5.697 15.900 1.00 0.00 C ATOM 978 C ASP A 65 -8.880 -5.019 16.187 1.00 0.00 C ATOM 979 O ASP A 65 -8.489 -4.872 17.344 1.00 0.00 O ATOM 980 CB ASP A 65 -10.207 -7.075 16.565 1.00 0.00 C ATOM 981 CG ASP A 65 -10.786 -7.116 17.980 1.00 0.00 C ATOM 982 OD1 ASP A 65 -12.031 -7.066 18.086 1.00 0.00 O ATOM 983 OD2 ASP A 65 -9.971 -7.195 18.925 1.00 0.00 O ATOM 0 H ASP A 65 -9.770 -6.465 14.004 1.00 0.00 H new ATOM 0 HA ASP A 65 -11.050 -5.113 16.300 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -10.767 -7.769 15.939 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -9.179 -7.435 16.599 1.00 0.00 H new ATOM 988 N GLY A 66 -8.211 -4.625 15.114 1.00 0.00 N ATOM 989 CA GLY A 66 -6.922 -3.966 15.235 1.00 0.00 C ATOM 990 C GLY A 66 -5.778 -4.945 14.961 1.00 0.00 C ATOM 991 O GLY A 66 -4.798 -4.981 15.704 1.00 0.00 O ATOM 0 H GLY A 66 -8.538 -4.750 14.156 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -6.868 -3.133 14.534 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -6.816 -3.548 16.236 1.00 0.00 H new ATOM 995 N ASN A 67 -5.941 -5.714 13.896 1.00 0.00 N ATOM 996 CA ASN A 67 -4.935 -6.690 13.516 1.00 0.00 C ATOM 997 C ASN A 67 -3.574 -5.998 13.410 1.00 0.00 C ATOM 998 O ASN A 67 -2.548 -6.586 13.748 1.00 0.00 O ATOM 999 CB ASN A 67 -5.257 -7.311 12.155 1.00 0.00 C ATOM 1000 CG ASN A 67 -4.075 -8.133 11.634 1.00 0.00 C ATOM 1001 OD1 ASN A 67 -3.140 -7.409 11.026 1.00 0.00 O flip ATOM 1002 ND2 ASN A 67 -4.017 -9.343 11.776 1.00 0.00 N flip ATOM 0 H ASN A 67 -6.756 -5.681 13.283 1.00 0.00 H new ATOM 0 HA ASN A 67 -4.920 -7.472 14.275 1.00 0.00 H new ATOM 0 HB2 ASN A 67 -6.138 -7.948 12.241 1.00 0.00 H new ATOM 0 HB3 ASN A 67 -5.501 -6.524 11.441 1.00 0.00 H new ATOM 0 HD21 ASN A 67 -4.771 -9.837 12.253 1.00 0.00 H new ATOM 0 HD22 ASN A 67 -3.215 -9.861 11.417 1.00 0.00 H new ATOM 1009 N LEU A 68 -3.610 -4.761 12.941 1.00 0.00 N ATOM 1010 CA LEU A 68 -2.394 -3.983 12.786 1.00 0.00 C ATOM 1011 C LEU A 68 -2.757 -2.527 12.490 1.00 0.00 C ATOM 1012 O LEU A 68 -3.928 -2.154 12.535 1.00 0.00 O ATOM 1013 CB LEU A 68 -1.483 -4.615 11.731 1.00 0.00 C ATOM 1014 CG LEU A 68 -1.751 -4.205 10.281 1.00 0.00 C ATOM 1015 CD1 LEU A 68 -3.113 -3.521 10.148 1.00 0.00 C ATOM 1016 CD2 LEU A 68 -0.616 -3.332 9.740 1.00 0.00 C ATOM 0 H LEU A 68 -4.464 -4.277 12.663 1.00 0.00 H new ATOM 0 HA LEU A 68 -1.821 -3.987 13.713 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -0.450 -4.364 11.974 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -1.573 -5.699 11.804 1.00 0.00 H new ATOM 0 HG LEU A 68 -1.783 -5.107 9.671 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -3.279 -3.240 9.108 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -3.897 -4.207 10.468 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -3.134 -2.628 10.773 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -0.831 -3.054 8.708 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -0.529 -2.431 10.348 1.00 0.00 H new ATOM 0 HD23 LEU A 68 0.321 -3.888 9.779 1.00 0.00 H new ATOM 1028 N HIS A 69 -1.731 -1.742 12.196 1.00 0.00 N ATOM 1029 CA HIS A 69 -1.928 -0.334 11.894 1.00 0.00 C ATOM 1030 C HIS A 69 -0.950 0.098 10.800 1.00 0.00 C ATOM 1031 O HIS A 69 0.262 0.063 10.997 1.00 0.00 O ATOM 1032 CB HIS A 69 -1.813 0.515 13.161 1.00 0.00 C ATOM 1033 CG HIS A 69 -3.038 0.476 14.042 1.00 0.00 C ATOM 1034 ND1 HIS A 69 -3.821 1.591 14.289 1.00 0.00 N ATOM 1035 CD2 HIS A 69 -3.608 -0.555 14.730 1.00 0.00 C ATOM 1036 CE1 HIS A 69 -4.814 1.236 15.090 1.00 0.00 C ATOM 1037 NE2 HIS A 69 -4.680 -0.094 15.362 1.00 0.00 N ATOM 0 H HIS A 69 -0.761 -2.054 12.160 1.00 0.00 H new ATOM 0 HA HIS A 69 -2.937 -0.178 11.513 1.00 0.00 H new ATOM 0 HB2 HIS A 69 -0.953 0.174 13.737 1.00 0.00 H new ATOM 0 HB3 HIS A 69 -1.616 1.549 12.876 1.00 0.00 H new ATOM 0 HD2 HIS A 69 -3.248 -1.573 14.756 1.00 0.00 H new ATOM 0 HE1 HIS A 69 -5.593 1.885 15.462 1.00 0.00 H new ATOM 0 HE2 HIS A 69 -5.302 -0.644 15.954 1.00 0.00 H new ATOM 1046 N HIS A 70 -1.515 0.495 9.668 1.00 0.00 N ATOM 1047 CA HIS A 70 -0.708 0.931 8.542 1.00 0.00 C ATOM 1048 C HIS A 70 0.456 1.788 9.047 1.00 0.00 C ATOM 1049 O HIS A 70 0.293 2.580 9.974 1.00 0.00 O ATOM 1050 CB HIS A 70 -1.570 1.655 7.505 1.00 0.00 C ATOM 1051 CG HIS A 70 -1.129 1.434 6.079 1.00 0.00 C ATOM 1052 ND1 HIS A 70 -1.318 0.236 5.411 1.00 0.00 N ATOM 1053 CD2 HIS A 70 -0.504 2.271 5.199 1.00 0.00 C ATOM 1054 CE1 HIS A 70 -0.826 0.358 4.187 1.00 0.00 C ATOM 1055 NE2 HIS A 70 -0.323 1.619 4.056 1.00 0.00 N ATOM 0 H HIS A 70 -2.522 0.523 9.508 1.00 0.00 H new ATOM 0 HA HIS A 70 -0.284 0.064 8.036 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -2.603 1.323 7.611 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -1.555 2.724 7.718 1.00 0.00 H new ATOM 0 HD1 HIS A 70 -1.761 -0.598 5.796 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -0.207 3.290 5.399 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -0.824 -0.408 3.425 1.00 0.00 H new ATOM 1064 N GLY A 71 1.603 1.601 8.412 1.00 0.00 N ATOM 1065 CA GLY A 71 2.794 2.346 8.786 1.00 0.00 C ATOM 1066 C GLY A 71 3.473 1.720 10.005 1.00 0.00 C ATOM 1067 O GLY A 71 4.692 1.555 10.025 1.00 0.00 O ATOM 0 H GLY A 71 1.734 0.945 7.642 1.00 0.00 H new ATOM 0 HA2 GLY A 71 3.491 2.368 7.948 1.00 0.00 H new ATOM 0 HA3 GLY A 71 2.527 3.380 9.005 1.00 0.00 H new ATOM 1071 N ASN A 72 2.656 1.387 10.993 1.00 0.00 N ATOM 1072 CA ASN A 72 3.162 0.782 12.214 1.00 0.00 C ATOM 1073 C ASN A 72 2.371 -0.492 12.513 1.00 0.00 C ATOM 1074 O ASN A 72 1.431 -0.472 13.306 1.00 0.00 O ATOM 1075 CB ASN A 72 3.002 1.729 13.405 1.00 0.00 C ATOM 1076 CG ASN A 72 3.815 1.241 14.606 1.00 0.00 C ATOM 1077 OD1 ASN A 72 4.699 0.406 14.492 1.00 0.00 O ATOM 1078 ND2 ASN A 72 3.470 1.806 15.758 1.00 0.00 N ATOM 0 H ASN A 72 1.646 1.525 10.973 1.00 0.00 H new ATOM 0 HA ASN A 72 4.219 0.562 12.068 1.00 0.00 H new ATOM 0 HB2 ASN A 72 3.327 2.731 13.124 1.00 0.00 H new ATOM 0 HB3 ASN A 72 1.949 1.800 13.679 1.00 0.00 H new ATOM 0 HD21 ASN A 72 3.954 1.548 16.618 1.00 0.00 H new ATOM 0 HD22 ASN A 72 2.721 2.498 15.783 1.00 0.00 H new ATOM 1085 N ALA A 73 2.778 -1.571 11.861 1.00 0.00 N ATOM 1086 CA ALA A 73 2.118 -2.852 12.048 1.00 0.00 C ATOM 1087 C ALA A 73 2.336 -3.328 13.486 1.00 0.00 C ATOM 1088 O ALA A 73 3.463 -3.341 13.977 1.00 0.00 O ATOM 1089 CB ALA A 73 2.646 -3.853 11.018 1.00 0.00 C ATOM 0 H ALA A 73 3.557 -1.585 11.202 1.00 0.00 H new ATOM 0 HA ALA A 73 1.044 -2.757 11.891 1.00 0.00 H new ATOM 0 HB1 ALA A 73 2.151 -4.814 11.158 1.00 0.00 H new ATOM 0 HB2 ALA A 73 2.442 -3.483 10.013 1.00 0.00 H new ATOM 0 HB3 ALA A 73 3.721 -3.976 11.148 1.00 0.00 H new ATOM 1095 N LYS A 74 1.236 -3.706 14.122 1.00 0.00 N ATOM 1096 CA LYS A 74 1.290 -4.181 15.493 1.00 0.00 C ATOM 1097 C LYS A 74 2.154 -5.442 15.559 1.00 0.00 C ATOM 1098 O LYS A 74 2.552 -5.981 14.527 1.00 0.00 O ATOM 1099 CB LYS A 74 -0.122 -4.375 16.050 1.00 0.00 C ATOM 1100 CG LYS A 74 -0.212 -3.889 17.499 1.00 0.00 C ATOM 1101 CD LYS A 74 -0.893 -2.522 17.578 1.00 0.00 C ATOM 1102 CE LYS A 74 -0.196 -1.620 18.597 1.00 0.00 C ATOM 1103 NZ LYS A 74 -0.087 -0.238 18.078 1.00 0.00 N ATOM 0 H LYS A 74 0.302 -3.693 13.712 1.00 0.00 H new ATOM 0 HA LYS A 74 1.762 -3.436 16.134 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -0.838 -3.830 15.435 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -0.395 -5.429 15.999 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -0.770 -4.612 18.095 1.00 0.00 H new ATOM 0 HG3 LYS A 74 0.788 -3.826 17.928 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -0.878 -2.047 16.597 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -1.940 -2.649 17.855 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -0.754 -1.620 19.533 1.00 0.00 H new ATOM 0 HE3 LYS A 74 0.797 -2.011 18.818 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 0.389 0.361 18.783 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 0.465 -0.241 17.197 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -1.038 0.138 17.890 1.00 0.00 H new ATOM 1117 N ASP A 75 2.418 -5.877 16.782 1.00 0.00 N ATOM 1118 CA ASP A 75 3.229 -7.064 16.995 1.00 0.00 C ATOM 1119 C ASP A 75 2.433 -8.301 16.572 1.00 0.00 C ATOM 1120 O ASP A 75 2.917 -9.426 16.692 1.00 0.00 O ATOM 1121 CB ASP A 75 3.598 -7.223 18.471 1.00 0.00 C ATOM 1122 CG ASP A 75 4.688 -6.273 18.971 1.00 0.00 C ATOM 1123 OD1 ASP A 75 4.324 -5.138 19.349 1.00 0.00 O ATOM 1124 OD2 ASP A 75 5.863 -6.703 18.962 1.00 0.00 O ATOM 0 H ASP A 75 2.085 -5.429 17.636 1.00 0.00 H new ATOM 0 HA ASP A 75 4.140 -6.960 16.405 1.00 0.00 H new ATOM 0 HB2 ASP A 75 2.702 -7.072 19.072 1.00 0.00 H new ATOM 0 HB3 ASP A 75 3.926 -8.249 18.640 1.00 0.00 H new ATOM 1129 N PHE A 76 1.227 -8.052 16.084 1.00 0.00 N ATOM 1130 CA PHE A 76 0.361 -9.131 15.642 1.00 0.00 C ATOM 1131 C PHE A 76 0.562 -9.420 14.153 1.00 0.00 C ATOM 1132 O PHE A 76 0.643 -10.579 13.747 1.00 0.00 O ATOM 1133 CB PHE A 76 -1.080 -8.670 15.870 1.00 0.00 C ATOM 1134 CG PHE A 76 -1.326 -8.057 17.251 1.00 0.00 C ATOM 1135 CD1 PHE A 76 -0.820 -8.658 18.360 1.00 0.00 C ATOM 1136 CD2 PHE A 76 -2.051 -6.913 17.367 1.00 0.00 C ATOM 1137 CE1 PHE A 76 -1.048 -8.090 19.643 1.00 0.00 C ATOM 1138 CE2 PHE A 76 -2.280 -6.344 18.648 1.00 0.00 C ATOM 1139 CZ PHE A 76 -1.774 -6.945 19.759 1.00 0.00 C ATOM 0 H PHE A 76 0.829 -7.118 15.985 1.00 0.00 H new ATOM 0 HA PHE A 76 0.589 -10.042 16.196 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -1.341 -7.937 15.107 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -1.748 -9.521 15.737 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -0.245 -9.567 18.266 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -2.453 -6.437 16.485 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -0.646 -8.567 20.525 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -2.855 -5.435 18.740 1.00 0.00 H new ATOM 0 HZ PHE A 76 -1.949 -6.513 20.733 1.00 0.00 H new ATOM 1149 N ALA A 77 0.635 -8.347 13.378 1.00 0.00 N ATOM 1150 CA ALA A 77 0.824 -8.471 11.944 1.00 0.00 C ATOM 1151 C ALA A 77 2.157 -9.170 11.668 1.00 0.00 C ATOM 1152 O ALA A 77 2.190 -10.223 11.032 1.00 0.00 O ATOM 1153 CB ALA A 77 0.746 -7.086 11.297 1.00 0.00 C ATOM 0 H ALA A 77 0.566 -7.388 13.718 1.00 0.00 H new ATOM 0 HA ALA A 77 0.035 -9.081 11.504 1.00 0.00 H new ATOM 0 HB1 ALA A 77 0.888 -7.179 10.220 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -0.230 -6.645 11.498 1.00 0.00 H new ATOM 0 HB3 ALA A 77 1.525 -6.446 11.712 1.00 0.00 H new ATOM 1159 N MET A 78 3.223 -8.557 12.160 1.00 0.00 N ATOM 1160 CA MET A 78 4.555 -9.107 11.974 1.00 0.00 C ATOM 1161 C MET A 78 4.829 -10.230 12.978 1.00 0.00 C ATOM 1162 O MET A 78 5.934 -10.336 13.508 1.00 0.00 O ATOM 1163 CB MET A 78 5.594 -7.999 12.153 1.00 0.00 C ATOM 1164 CG MET A 78 5.446 -7.320 13.515 1.00 0.00 C ATOM 1165 SD MET A 78 6.678 -7.942 14.646 1.00 0.00 S ATOM 1166 CE MET A 78 5.623 -8.719 15.859 1.00 0.00 C ATOM 0 H MET A 78 3.192 -7.685 12.687 1.00 0.00 H new ATOM 0 HA MET A 78 4.620 -9.520 10.967 1.00 0.00 H new ATOM 0 HB2 MET A 78 6.596 -8.417 12.059 1.00 0.00 H new ATOM 0 HB3 MET A 78 5.482 -7.259 11.360 1.00 0.00 H new ATOM 0 HG2 MET A 78 5.553 -6.241 13.406 1.00 0.00 H new ATOM 0 HG3 MET A 78 4.449 -7.503 13.915 1.00 0.00 H new ATOM 0 HE1 MET A 78 5.597 -8.110 16.762 1.00 0.00 H new ATOM 0 HE2 MET A 78 4.615 -8.814 15.456 1.00 0.00 H new ATOM 0 HE3 MET A 78 6.013 -9.708 16.100 1.00 0.00 H new ATOM 1176 N LYS A 79 3.804 -11.040 13.205 1.00 0.00 N ATOM 1177 CA LYS A 79 3.922 -12.150 14.135 1.00 0.00 C ATOM 1178 C LYS A 79 2.919 -13.240 13.748 1.00 0.00 C ATOM 1179 O LYS A 79 3.296 -14.395 13.557 1.00 0.00 O ATOM 1180 CB LYS A 79 3.772 -11.660 15.576 1.00 0.00 C ATOM 1181 CG LYS A 79 4.244 -12.724 16.569 1.00 0.00 C ATOM 1182 CD LYS A 79 5.067 -12.097 17.695 1.00 0.00 C ATOM 1183 CE LYS A 79 5.760 -13.173 18.534 1.00 0.00 C ATOM 1184 NZ LYS A 79 6.011 -12.680 19.906 1.00 0.00 N ATOM 0 H LYS A 79 2.890 -10.949 12.761 1.00 0.00 H new ATOM 0 HA LYS A 79 4.916 -12.594 14.076 1.00 0.00 H new ATOM 0 HB2 LYS A 79 4.349 -10.746 15.715 1.00 0.00 H new ATOM 0 HB3 LYS A 79 2.729 -11.411 15.773 1.00 0.00 H new ATOM 0 HG2 LYS A 79 3.382 -13.242 16.989 1.00 0.00 H new ATOM 0 HG3 LYS A 79 4.843 -13.472 16.049 1.00 0.00 H new ATOM 0 HD2 LYS A 79 5.813 -11.424 17.273 1.00 0.00 H new ATOM 0 HD3 LYS A 79 4.419 -11.496 18.332 1.00 0.00 H new ATOM 0 HE2 LYS A 79 5.140 -14.069 18.571 1.00 0.00 H new ATOM 0 HE3 LYS A 79 6.702 -13.457 18.065 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 6.482 -13.423 20.461 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 6.621 -11.839 19.866 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 5.107 -12.432 20.356 1.00 0.00 H new ATOM 1198 N HIS A 80 1.663 -12.833 13.643 1.00 0.00 N ATOM 1199 CA HIS A 80 0.604 -13.760 13.283 1.00 0.00 C ATOM 1200 C HIS A 80 0.794 -14.219 11.836 1.00 0.00 C ATOM 1201 O HIS A 80 0.074 -15.096 11.360 1.00 0.00 O ATOM 1202 CB HIS A 80 -0.772 -13.139 13.533 1.00 0.00 C ATOM 1203 CG HIS A 80 -1.311 -12.354 12.361 1.00 0.00 C ATOM 1204 ND1 HIS A 80 -0.525 -11.507 11.599 1.00 0.00 N ATOM 1205 CD2 HIS A 80 -2.566 -12.296 11.828 1.00 0.00 C ATOM 1206 CE1 HIS A 80 -1.282 -10.969 10.654 1.00 0.00 C ATOM 1207 NE2 HIS A 80 -2.547 -11.460 10.799 1.00 0.00 N ATOM 0 H HIS A 80 1.355 -11.874 13.801 1.00 0.00 H new ATOM 0 HA HIS A 80 0.659 -14.644 13.918 1.00 0.00 H new ATOM 0 HB2 HIS A 80 -1.478 -13.932 13.782 1.00 0.00 H new ATOM 0 HB3 HIS A 80 -0.711 -12.482 14.401 1.00 0.00 H new ATOM 0 HD1 HIS A 80 0.469 -11.327 11.741 1.00 0.00 H new ATOM 0 HD2 HIS A 80 -3.429 -12.839 12.184 1.00 0.00 H new ATOM 0 HE1 HIS A 80 -0.956 -10.266 9.902 1.00 0.00 H new ATOM 1216 N GLY A 81 1.766 -13.607 11.178 1.00 0.00 N ATOM 1217 CA GLY A 81 2.060 -13.941 9.794 1.00 0.00 C ATOM 1218 C GLY A 81 3.522 -13.640 9.456 1.00 0.00 C ATOM 1219 O GLY A 81 3.859 -13.411 8.296 1.00 0.00 O ATOM 0 H GLY A 81 2.361 -12.881 11.577 1.00 0.00 H new ATOM 0 HA2 GLY A 81 1.852 -14.997 9.619 1.00 0.00 H new ATOM 0 HA3 GLY A 81 1.406 -13.373 9.132 1.00 0.00 H new ATOM 1223 N ALA A 82 4.350 -13.650 10.491 1.00 0.00 N ATOM 1224 CA ALA A 82 5.767 -13.381 10.317 1.00 0.00 C ATOM 1225 C ALA A 82 6.579 -14.463 11.032 1.00 0.00 C ATOM 1226 O ALA A 82 6.279 -14.818 12.171 1.00 0.00 O ATOM 1227 CB ALA A 82 6.087 -11.976 10.833 1.00 0.00 C ATOM 0 H ALA A 82 4.066 -13.840 11.452 1.00 0.00 H new ATOM 0 HA ALA A 82 6.036 -13.410 9.261 1.00 0.00 H new ATOM 0 HB1 ALA A 82 7.150 -11.774 10.703 1.00 0.00 H new ATOM 0 HB2 ALA A 82 5.507 -11.242 10.274 1.00 0.00 H new ATOM 0 HB3 ALA A 82 5.832 -11.910 11.891 1.00 0.00 H new ATOM 1233 N ASP A 83 7.589 -14.959 10.333 1.00 0.00 N ATOM 1234 CA ASP A 83 8.446 -15.994 10.887 1.00 0.00 C ATOM 1235 C ASP A 83 9.299 -15.397 12.008 1.00 0.00 C ATOM 1236 O ASP A 83 9.728 -14.247 11.921 1.00 0.00 O ATOM 1237 CB ASP A 83 9.388 -16.557 9.822 1.00 0.00 C ATOM 1238 CG ASP A 83 8.927 -17.863 9.174 1.00 0.00 C ATOM 1239 OD1 ASP A 83 8.507 -18.758 9.938 1.00 0.00 O ATOM 1240 OD2 ASP A 83 9.004 -17.937 7.929 1.00 0.00 O ATOM 0 H ASP A 83 7.833 -14.664 9.388 1.00 0.00 H new ATOM 0 HA ASP A 83 7.809 -16.795 11.263 1.00 0.00 H new ATOM 0 HB2 ASP A 83 9.518 -15.808 9.041 1.00 0.00 H new ATOM 0 HB3 ASP A 83 10.367 -16.719 10.274 1.00 0.00 H new ATOM 1245 N GLU A 84 9.522 -16.206 13.033 1.00 0.00 N ATOM 1246 CA GLU A 84 10.317 -15.773 14.169 1.00 0.00 C ATOM 1247 C GLU A 84 11.553 -15.007 13.692 1.00 0.00 C ATOM 1248 O GLU A 84 11.996 -14.066 14.347 1.00 0.00 O ATOM 1249 CB GLU A 84 10.714 -16.962 15.046 1.00 0.00 C ATOM 1250 CG GLU A 84 11.248 -18.117 14.196 1.00 0.00 C ATOM 1251 CD GLU A 84 12.047 -19.103 15.050 1.00 0.00 C ATOM 1252 OE1 GLU A 84 11.479 -19.565 16.064 1.00 0.00 O ATOM 1253 OE2 GLU A 84 13.205 -19.375 14.670 1.00 0.00 O ATOM 0 H GLU A 84 9.166 -17.159 13.100 1.00 0.00 H new ATOM 0 HA GLU A 84 9.710 -15.102 14.777 1.00 0.00 H new ATOM 0 HB2 GLU A 84 11.474 -16.652 15.763 1.00 0.00 H new ATOM 0 HB3 GLU A 84 9.851 -17.298 15.621 1.00 0.00 H new ATOM 0 HG2 GLU A 84 10.417 -18.635 13.717 1.00 0.00 H new ATOM 0 HG3 GLU A 84 11.880 -17.725 13.399 1.00 0.00 H new ATOM 1260 N THR A 85 12.074 -15.440 12.552 1.00 0.00 N ATOM 1261 CA THR A 85 13.249 -14.808 11.979 1.00 0.00 C ATOM 1262 C THR A 85 12.858 -13.530 11.232 1.00 0.00 C ATOM 1263 O THR A 85 13.526 -12.505 11.356 1.00 0.00 O ATOM 1264 CB THR A 85 13.956 -15.836 11.094 1.00 0.00 C ATOM 1265 OG1 THR A 85 15.221 -15.245 10.815 1.00 0.00 O ATOM 1266 CG2 THR A 85 13.299 -15.975 9.720 1.00 0.00 C ATOM 0 H THR A 85 11.703 -16.221 12.011 1.00 0.00 H new ATOM 0 HA THR A 85 13.946 -14.493 12.756 1.00 0.00 H new ATOM 0 HB THR A 85 13.959 -16.804 11.595 1.00 0.00 H new ATOM 0 HG1 THR A 85 15.745 -15.847 10.247 1.00 0.00 H new ATOM 0 HG21 THR A 85 13.839 -16.717 9.132 1.00 0.00 H new ATOM 0 HG22 THR A 85 12.264 -16.293 9.842 1.00 0.00 H new ATOM 0 HG23 THR A 85 13.325 -15.015 9.205 1.00 0.00 H new ATOM 1274 N MET A 86 11.776 -13.635 10.474 1.00 0.00 N ATOM 1275 CA MET A 86 11.287 -12.503 9.708 1.00 0.00 C ATOM 1276 C MET A 86 11.102 -11.274 10.603 1.00 0.00 C ATOM 1277 O MET A 86 11.465 -10.163 10.220 1.00 0.00 O ATOM 1278 CB MET A 86 9.952 -12.865 9.055 1.00 0.00 C ATOM 1279 CG MET A 86 9.074 -11.624 8.876 1.00 0.00 C ATOM 1280 SD MET A 86 7.714 -11.991 7.780 1.00 0.00 S ATOM 1281 CE MET A 86 8.481 -11.638 6.207 1.00 0.00 C ATOM 0 H MET A 86 11.225 -14.487 10.375 1.00 0.00 H new ATOM 0 HA MET A 86 12.023 -12.263 8.940 1.00 0.00 H new ATOM 0 HB2 MET A 86 10.132 -13.331 8.086 1.00 0.00 H new ATOM 0 HB3 MET A 86 9.430 -13.599 9.669 1.00 0.00 H new ATOM 0 HG2 MET A 86 8.694 -11.295 9.843 1.00 0.00 H new ATOM 0 HG3 MET A 86 9.667 -10.804 8.471 1.00 0.00 H new ATOM 0 HE1 MET A 86 7.765 -11.816 5.405 1.00 0.00 H new ATOM 0 HE2 MET A 86 8.800 -10.596 6.184 1.00 0.00 H new ATOM 0 HE3 MET A 86 9.347 -12.286 6.071 1.00 0.00 H new ATOM 1291 N ALA A 87 10.537 -11.516 11.776 1.00 0.00 N ATOM 1292 CA ALA A 87 10.299 -10.445 12.728 1.00 0.00 C ATOM 1293 C ALA A 87 11.599 -9.669 12.952 1.00 0.00 C ATOM 1294 O ALA A 87 11.605 -8.441 12.926 1.00 0.00 O ATOM 1295 CB ALA A 87 9.737 -11.030 14.025 1.00 0.00 C ATOM 0 H ALA A 87 10.237 -12.439 12.089 1.00 0.00 H new ATOM 0 HA ALA A 87 9.560 -9.744 12.340 1.00 0.00 H new ATOM 0 HB1 ALA A 87 9.558 -10.226 14.739 1.00 0.00 H new ATOM 0 HB2 ALA A 87 8.799 -11.544 13.816 1.00 0.00 H new ATOM 0 HB3 ALA A 87 10.452 -11.737 14.445 1.00 0.00 H new ATOM 1301 N GLN A 88 12.669 -10.421 13.167 1.00 0.00 N ATOM 1302 CA GLN A 88 13.972 -9.821 13.396 1.00 0.00 C ATOM 1303 C GLN A 88 14.547 -9.288 12.083 1.00 0.00 C ATOM 1304 O GLN A 88 15.097 -8.188 12.044 1.00 0.00 O ATOM 1305 CB GLN A 88 14.929 -10.819 14.050 1.00 0.00 C ATOM 1306 CG GLN A 88 16.342 -10.243 14.144 1.00 0.00 C ATOM 1307 CD GLN A 88 17.314 -11.024 13.257 1.00 0.00 C ATOM 1308 OE1 GLN A 88 17.336 -10.618 11.990 1.00 0.00 O flip ATOM 1309 NE2 GLN A 88 17.998 -11.935 13.694 1.00 0.00 N flip ATOM 0 H GLN A 88 12.660 -11.441 13.187 1.00 0.00 H new ATOM 0 HA GLN A 88 13.850 -8.984 14.083 1.00 0.00 H new ATOM 0 HB2 GLN A 88 14.569 -11.073 15.047 1.00 0.00 H new ATOM 0 HB3 GLN A 88 14.947 -11.743 13.472 1.00 0.00 H new ATOM 0 HG2 GLN A 88 16.332 -9.195 13.844 1.00 0.00 H new ATOM 0 HG3 GLN A 88 16.683 -10.275 15.179 1.00 0.00 H new ATOM 0 HE21 GLN A 88 17.932 -12.196 14.678 1.00 0.00 H new ATOM 0 HE22 GLN A 88 18.636 -12.436 13.075 1.00 0.00 H new ATOM 1318 N GLN A 89 14.403 -10.092 11.040 1.00 0.00 N ATOM 1319 CA GLN A 89 14.903 -9.715 9.729 1.00 0.00 C ATOM 1320 C GLN A 89 14.484 -8.282 9.394 1.00 0.00 C ATOM 1321 O GLN A 89 15.326 -7.444 9.077 1.00 0.00 O ATOM 1322 CB GLN A 89 14.421 -10.692 8.657 1.00 0.00 C ATOM 1323 CG GLN A 89 15.146 -12.035 8.772 1.00 0.00 C ATOM 1324 CD GLN A 89 16.662 -11.838 8.806 1.00 0.00 C ATOM 1325 OE1 GLN A 89 17.298 -11.895 9.846 1.00 0.00 O ATOM 1326 NE2 GLN A 89 17.204 -11.604 7.615 1.00 0.00 N ATOM 0 H GLN A 89 13.947 -11.004 11.076 1.00 0.00 H new ATOM 0 HA GLN A 89 15.992 -9.759 9.750 1.00 0.00 H new ATOM 0 HB2 GLN A 89 13.346 -10.845 8.756 1.00 0.00 H new ATOM 0 HB3 GLN A 89 14.592 -10.266 7.668 1.00 0.00 H new ATOM 0 HG2 GLN A 89 14.822 -12.551 9.676 1.00 0.00 H new ATOM 0 HG3 GLN A 89 14.877 -12.671 7.929 1.00 0.00 H new ATOM 0 HE21 GLN A 89 16.614 -11.569 6.784 1.00 0.00 H new ATOM 0 HE22 GLN A 89 18.210 -11.459 7.532 1.00 0.00 H new ATOM 1335 N LEU A 90 13.182 -8.046 9.475 1.00 0.00 N ATOM 1336 CA LEU A 90 12.642 -6.730 9.184 1.00 0.00 C ATOM 1337 C LEU A 90 13.480 -5.668 9.898 1.00 0.00 C ATOM 1338 O LEU A 90 13.872 -4.671 9.294 1.00 0.00 O ATOM 1339 CB LEU A 90 11.152 -6.673 9.530 1.00 0.00 C ATOM 1340 CG LEU A 90 10.266 -7.719 8.852 1.00 0.00 C ATOM 1341 CD1 LEU A 90 8.977 -7.945 9.646 1.00 0.00 C ATOM 1342 CD2 LEU A 90 9.982 -7.337 7.397 1.00 0.00 C ATOM 0 H LEU A 90 12.486 -8.744 9.738 1.00 0.00 H new ATOM 0 HA LEU A 90 12.706 -6.521 8.116 1.00 0.00 H new ATOM 0 HB2 LEU A 90 11.046 -6.780 10.609 1.00 0.00 H new ATOM 0 HB3 LEU A 90 10.776 -5.684 9.269 1.00 0.00 H new ATOM 0 HG LEU A 90 10.806 -8.666 8.838 1.00 0.00 H new ATOM 0 HD11 LEU A 90 8.366 -8.693 9.142 1.00 0.00 H new ATOM 0 HD12 LEU A 90 9.224 -8.294 10.649 1.00 0.00 H new ATOM 0 HD13 LEU A 90 8.423 -7.009 9.714 1.00 0.00 H new ATOM 0 HD21 LEU A 90 9.350 -8.097 6.938 1.00 0.00 H new ATOM 0 HD22 LEU A 90 9.472 -6.374 7.367 1.00 0.00 H new ATOM 0 HD23 LEU A 90 10.922 -7.267 6.849 1.00 0.00 H new ATOM 1354 N VAL A 91 13.730 -5.920 11.175 1.00 0.00 N ATOM 1355 CA VAL A 91 14.515 -4.998 11.979 1.00 0.00 C ATOM 1356 C VAL A 91 15.840 -4.711 11.270 1.00 0.00 C ATOM 1357 O VAL A 91 16.511 -3.726 11.574 1.00 0.00 O ATOM 1358 CB VAL A 91 14.701 -5.562 13.389 1.00 0.00 C ATOM 1359 CG1 VAL A 91 15.171 -4.473 14.357 1.00 0.00 C ATOM 1360 CG2 VAL A 91 13.416 -6.224 13.889 1.00 0.00 C ATOM 0 H VAL A 91 13.403 -6.748 11.672 1.00 0.00 H new ATOM 0 HA VAL A 91 13.993 -4.047 12.090 1.00 0.00 H new ATOM 0 HB VAL A 91 15.476 -6.328 13.345 1.00 0.00 H new ATOM 0 HG11 VAL A 91 15.296 -4.900 15.352 1.00 0.00 H new ATOM 0 HG12 VAL A 91 16.123 -4.068 14.014 1.00 0.00 H new ATOM 0 HG13 VAL A 91 14.429 -3.675 14.395 1.00 0.00 H new ATOM 0 HG21 VAL A 91 13.576 -6.616 14.893 1.00 0.00 H new ATOM 0 HG22 VAL A 91 12.612 -5.488 13.911 1.00 0.00 H new ATOM 0 HG23 VAL A 91 13.143 -7.040 13.220 1.00 0.00 H new ATOM 1370 N ASP A 92 16.179 -5.590 10.338 1.00 0.00 N ATOM 1371 CA ASP A 92 17.412 -5.443 9.584 1.00 0.00 C ATOM 1372 C ASP A 92 17.248 -4.317 8.561 1.00 0.00 C ATOM 1373 O ASP A 92 17.870 -3.263 8.687 1.00 0.00 O ATOM 1374 CB ASP A 92 17.748 -6.727 8.823 1.00 0.00 C ATOM 1375 CG ASP A 92 19.192 -6.825 8.325 1.00 0.00 C ATOM 1376 OD1 ASP A 92 20.055 -6.177 8.956 1.00 0.00 O ATOM 1377 OD2 ASP A 92 19.401 -7.547 7.327 1.00 0.00 O ATOM 0 H ASP A 92 15.621 -6.406 10.088 1.00 0.00 H new ATOM 0 HA ASP A 92 18.214 -5.220 10.288 1.00 0.00 H new ATOM 0 HB2 ASP A 92 17.545 -7.579 9.471 1.00 0.00 H new ATOM 0 HB3 ASP A 92 17.078 -6.810 7.967 1.00 0.00 H new ATOM 1382 N ILE A 93 16.408 -4.577 7.571 1.00 0.00 N ATOM 1383 CA ILE A 93 16.155 -3.599 6.526 1.00 0.00 C ATOM 1384 C ILE A 93 15.452 -2.383 7.133 1.00 0.00 C ATOM 1385 O ILE A 93 15.833 -1.244 6.866 1.00 0.00 O ATOM 1386 CB ILE A 93 15.387 -4.238 5.368 1.00 0.00 C ATOM 1387 CG1 ILE A 93 13.880 -4.012 5.517 1.00 0.00 C ATOM 1388 CG2 ILE A 93 15.732 -5.722 5.233 1.00 0.00 C ATOM 1389 CD1 ILE A 93 13.275 -4.998 6.519 1.00 0.00 C ATOM 0 H ILE A 93 15.893 -5.452 7.470 1.00 0.00 H new ATOM 0 HA ILE A 93 17.094 -3.246 6.099 1.00 0.00 H new ATOM 0 HB ILE A 93 15.696 -3.750 4.444 1.00 0.00 H new ATOM 0 HG12 ILE A 93 13.693 -2.990 5.848 1.00 0.00 H new ATOM 0 HG13 ILE A 93 13.394 -4.128 4.548 1.00 0.00 H new ATOM 0 HG21 ILE A 93 15.172 -6.152 4.402 1.00 0.00 H new ATOM 0 HG22 ILE A 93 16.800 -5.832 5.046 1.00 0.00 H new ATOM 0 HG23 ILE A 93 15.470 -6.242 6.155 1.00 0.00 H new ATOM 0 HD11 ILE A 93 12.204 -4.816 6.607 1.00 0.00 H new ATOM 0 HD12 ILE A 93 13.443 -6.018 6.173 1.00 0.00 H new ATOM 0 HD13 ILE A 93 13.747 -4.863 7.492 1.00 0.00 H new ATOM 1401 N ILE A 94 14.440 -2.666 7.939 1.00 0.00 N ATOM 1402 CA ILE A 94 13.679 -1.610 8.587 1.00 0.00 C ATOM 1403 C ILE A 94 14.642 -0.661 9.305 1.00 0.00 C ATOM 1404 O ILE A 94 14.323 0.506 9.522 1.00 0.00 O ATOM 1405 CB ILE A 94 12.606 -2.204 9.500 1.00 0.00 C ATOM 1406 CG1 ILE A 94 11.603 -3.037 8.699 1.00 0.00 C ATOM 1407 CG2 ILE A 94 11.917 -1.111 10.321 1.00 0.00 C ATOM 1408 CD1 ILE A 94 10.172 -2.781 9.179 1.00 0.00 C ATOM 0 H ILE A 94 14.128 -3.612 8.159 1.00 0.00 H new ATOM 0 HA ILE A 94 13.141 -1.019 7.846 1.00 0.00 H new ATOM 0 HB ILE A 94 13.093 -2.877 10.205 1.00 0.00 H new ATOM 0 HG12 ILE A 94 11.685 -2.792 7.640 1.00 0.00 H new ATOM 0 HG13 ILE A 94 11.841 -4.096 8.801 1.00 0.00 H new ATOM 0 HG21 ILE A 94 11.158 -1.561 10.962 1.00 0.00 H new ATOM 0 HG22 ILE A 94 12.656 -0.599 10.938 1.00 0.00 H new ATOM 0 HG23 ILE A 94 11.446 -0.394 9.649 1.00 0.00 H new ATOM 0 HD11 ILE A 94 9.478 -3.385 8.594 1.00 0.00 H new ATOM 0 HD12 ILE A 94 10.088 -3.050 10.232 1.00 0.00 H new ATOM 0 HD13 ILE A 94 9.929 -1.726 9.053 1.00 0.00 H new ATOM 1420 N HIS A 95 15.803 -1.199 9.652 1.00 0.00 N ATOM 1421 CA HIS A 95 16.815 -0.415 10.340 1.00 0.00 C ATOM 1422 C HIS A 95 17.507 0.516 9.344 1.00 0.00 C ATOM 1423 O HIS A 95 17.953 1.603 9.711 1.00 0.00 O ATOM 1424 CB HIS A 95 17.796 -1.326 11.082 1.00 0.00 C ATOM 1425 CG HIS A 95 17.506 -1.466 12.558 1.00 0.00 C ATOM 1426 ND1 HIS A 95 18.504 -1.477 13.518 1.00 0.00 N ATOM 1427 CD2 HIS A 95 16.325 -1.599 13.226 1.00 0.00 C ATOM 1428 CE1 HIS A 95 17.936 -1.613 14.707 1.00 0.00 C ATOM 1429 NE2 HIS A 95 16.586 -1.689 14.525 1.00 0.00 N ATOM 0 H HIS A 95 16.065 -2.168 9.470 1.00 0.00 H new ATOM 0 HA HIS A 95 16.344 0.209 11.100 1.00 0.00 H new ATOM 0 HB2 HIS A 95 17.777 -2.314 10.623 1.00 0.00 H new ATOM 0 HB3 HIS A 95 18.806 -0.935 10.956 1.00 0.00 H new ATOM 0 HD2 HIS A 95 15.344 -1.626 12.775 1.00 0.00 H new ATOM 0 HE1 HIS A 95 18.452 -1.656 15.655 1.00 0.00 H new ATOM 0 HE2 HIS A 95 15.892 -1.797 15.264 1.00 0.00 H new ATOM 1438 N GLY A 96 17.578 0.057 8.103 1.00 0.00 N ATOM 1439 CA GLY A 96 18.209 0.836 7.052 1.00 0.00 C ATOM 1440 C GLY A 96 17.205 1.785 6.394 1.00 0.00 C ATOM 1441 O GLY A 96 17.591 2.803 5.823 1.00 0.00 O ATOM 0 H GLY A 96 17.209 -0.845 7.802 1.00 0.00 H new ATOM 0 HA2 GLY A 96 19.038 1.409 7.467 1.00 0.00 H new ATOM 0 HA3 GLY A 96 18.629 0.167 6.301 1.00 0.00 H new ATOM 1445 N CYS A 97 15.937 1.418 6.496 1.00 0.00 N ATOM 1446 CA CYS A 97 14.875 2.224 5.919 1.00 0.00 C ATOM 1447 C CYS A 97 14.450 3.269 6.953 1.00 0.00 C ATOM 1448 O CYS A 97 14.597 4.469 6.723 1.00 0.00 O ATOM 1449 CB CYS A 97 13.696 1.362 5.461 1.00 0.00 C ATOM 1450 SG CYS A 97 13.564 1.143 3.649 1.00 0.00 S ATOM 0 H CYS A 97 15.620 0.572 6.970 1.00 0.00 H new ATOM 0 HA CYS A 97 15.242 2.727 5.024 1.00 0.00 H new ATOM 0 HB2 CYS A 97 13.780 0.380 5.926 1.00 0.00 H new ATOM 0 HB3 CYS A 97 12.772 1.810 5.827 1.00 0.00 H new ATOM 1455 N GLU A 98 13.932 2.777 8.067 1.00 0.00 N ATOM 1456 CA GLU A 98 13.485 3.654 9.136 1.00 0.00 C ATOM 1457 C GLU A 98 14.530 4.739 9.405 1.00 0.00 C ATOM 1458 O GLU A 98 14.184 5.875 9.722 1.00 0.00 O ATOM 1459 CB GLU A 98 13.180 2.859 10.407 1.00 0.00 C ATOM 1460 CG GLU A 98 12.242 3.639 11.330 1.00 0.00 C ATOM 1461 CD GLU A 98 12.989 4.147 12.566 1.00 0.00 C ATOM 1462 OE1 GLU A 98 14.133 4.618 12.386 1.00 0.00 O ATOM 1463 OE2 GLU A 98 12.398 4.052 13.664 1.00 0.00 O ATOM 0 H GLU A 98 13.811 1.782 8.254 1.00 0.00 H new ATOM 0 HA GLU A 98 12.561 4.138 8.820 1.00 0.00 H new ATOM 0 HB2 GLU A 98 12.725 1.904 10.143 1.00 0.00 H new ATOM 0 HB3 GLU A 98 14.109 2.635 10.932 1.00 0.00 H new ATOM 0 HG2 GLU A 98 11.811 4.481 10.789 1.00 0.00 H new ATOM 0 HG3 GLU A 98 11.414 3.000 11.638 1.00 0.00 H new ATOM 1470 N LYS A 99 15.789 4.348 9.270 1.00 0.00 N ATOM 1471 CA LYS A 99 16.888 5.272 9.494 1.00 0.00 C ATOM 1472 C LYS A 99 16.942 6.282 8.346 1.00 0.00 C ATOM 1473 O LYS A 99 17.341 7.430 8.541 1.00 0.00 O ATOM 1474 CB LYS A 99 18.197 4.508 9.704 1.00 0.00 C ATOM 1475 CG LYS A 99 18.736 3.971 8.377 1.00 0.00 C ATOM 1476 CD LYS A 99 20.241 3.708 8.463 1.00 0.00 C ATOM 1477 CE LYS A 99 20.845 3.521 7.070 1.00 0.00 C ATOM 1478 NZ LYS A 99 22.095 4.303 6.938 1.00 0.00 N ATOM 0 H LYS A 99 16.072 3.404 9.008 1.00 0.00 H new ATOM 0 HA LYS A 99 16.727 5.840 10.411 1.00 0.00 H new ATOM 0 HB2 LYS A 99 18.936 5.165 10.162 1.00 0.00 H new ATOM 0 HB3 LYS A 99 18.033 3.681 10.395 1.00 0.00 H new ATOM 0 HG2 LYS A 99 18.216 3.049 8.116 1.00 0.00 H new ATOM 0 HG3 LYS A 99 18.533 4.688 7.581 1.00 0.00 H new ATOM 0 HD2 LYS A 99 20.731 4.541 8.967 1.00 0.00 H new ATOM 0 HD3 LYS A 99 20.425 2.818 9.065 1.00 0.00 H new ATOM 0 HE2 LYS A 99 21.050 2.465 6.895 1.00 0.00 H new ATOM 0 HE3 LYS A 99 20.129 3.837 6.311 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 22.492 4.165 5.987 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 21.890 5.312 7.085 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 22.782 3.982 7.650 1.00 0.00 H new ATOM 1492 N SER A 100 16.535 5.819 7.173 1.00 0.00 N ATOM 1493 CA SER A 100 16.532 6.666 5.993 1.00 0.00 C ATOM 1494 C SER A 100 15.146 7.284 5.796 1.00 0.00 C ATOM 1495 O SER A 100 14.960 8.134 4.926 1.00 0.00 O ATOM 1496 CB SER A 100 16.944 5.878 4.748 1.00 0.00 C ATOM 1497 OG SER A 100 18.088 6.444 4.114 1.00 0.00 O ATOM 0 H SER A 100 16.205 4.867 7.015 1.00 0.00 H new ATOM 0 HA SER A 100 17.260 7.463 6.142 1.00 0.00 H new ATOM 0 HB2 SER A 100 17.157 4.846 5.026 1.00 0.00 H new ATOM 0 HB3 SER A 100 16.113 5.853 4.043 1.00 0.00 H new ATOM 0 HG SER A 100 18.321 5.912 3.325 1.00 0.00 H new ATOM 1503 N ALA A 101 14.210 6.834 6.618 1.00 0.00 N ATOM 1504 CA ALA A 101 12.847 7.332 6.544 1.00 0.00 C ATOM 1505 C ALA A 101 12.506 8.067 7.842 1.00 0.00 C ATOM 1506 O ALA A 101 11.928 7.483 8.758 1.00 0.00 O ATOM 1507 CB ALA A 101 11.893 6.169 6.266 1.00 0.00 C ATOM 0 H ALA A 101 14.368 6.130 7.339 1.00 0.00 H new ATOM 0 HA ALA A 101 12.742 8.043 5.725 1.00 0.00 H new ATOM 0 HB1 ALA A 101 10.870 6.542 6.210 1.00 0.00 H new ATOM 0 HB2 ALA A 101 12.159 5.698 5.320 1.00 0.00 H new ATOM 0 HB3 ALA A 101 11.969 5.436 7.070 1.00 0.00 H new ATOM 1513 N PRO A 102 12.892 9.370 7.883 1.00 0.00 N ATOM 1514 CA PRO A 102 12.634 10.191 9.054 1.00 0.00 C ATOM 1515 C PRO A 102 11.158 10.589 9.131 1.00 0.00 C ATOM 1516 O PRO A 102 10.380 10.278 8.230 1.00 0.00 O ATOM 1517 CB PRO A 102 13.564 11.384 8.911 1.00 0.00 C ATOM 1518 CG PRO A 102 13.967 11.424 7.446 1.00 0.00 C ATOM 1519 CD PRO A 102 13.580 10.095 6.818 1.00 0.00 C ATOM 0 HA PRO A 102 12.826 9.663 9.988 1.00 0.00 H new ATOM 0 HB2 PRO A 102 13.063 12.307 9.204 1.00 0.00 H new ATOM 0 HB3 PRO A 102 14.438 11.278 9.554 1.00 0.00 H new ATOM 0 HG2 PRO A 102 13.467 12.247 6.935 1.00 0.00 H new ATOM 0 HG3 PRO A 102 15.039 11.593 7.350 1.00 0.00 H new ATOM 0 HD2 PRO A 102 12.932 10.239 5.954 1.00 0.00 H new ATOM 0 HD3 PRO A 102 14.458 9.550 6.471 1.00 0.00 H new ATOM 1527 N PRO A 103 10.808 11.287 10.243 1.00 0.00 N ATOM 1528 CA PRO A 103 9.441 11.730 10.450 1.00 0.00 C ATOM 1529 C PRO A 103 9.109 12.925 9.553 1.00 0.00 C ATOM 1530 O PRO A 103 8.537 13.911 10.013 1.00 0.00 O ATOM 1531 CB PRO A 103 9.350 12.057 11.932 1.00 0.00 C ATOM 1532 CG PRO A 103 10.785 12.230 12.407 1.00 0.00 C ATOM 1533 CD PRO A 103 11.702 11.673 11.332 1.00 0.00 C ATOM 0 HA PRO A 103 8.709 10.969 10.179 1.00 0.00 H new ATOM 0 HB2 PRO A 103 8.771 12.966 12.097 1.00 0.00 H new ATOM 0 HB3 PRO A 103 8.851 11.257 12.479 1.00 0.00 H new ATOM 0 HG2 PRO A 103 11.003 13.283 12.587 1.00 0.00 H new ATOM 0 HG3 PRO A 103 10.941 11.706 13.350 1.00 0.00 H new ATOM 0 HD2 PRO A 103 12.426 12.419 11.004 1.00 0.00 H new ATOM 0 HD3 PRO A 103 12.269 10.818 11.700 1.00 0.00 H new ATOM 1541 N ASN A 104 9.484 12.797 8.289 1.00 0.00 N ATOM 1542 CA ASN A 104 9.235 13.854 7.323 1.00 0.00 C ATOM 1543 C ASN A 104 7.727 14.047 7.163 1.00 0.00 C ATOM 1544 O ASN A 104 6.966 13.079 7.193 1.00 0.00 O ATOM 1545 CB ASN A 104 9.815 13.498 5.954 1.00 0.00 C ATOM 1546 CG ASN A 104 10.639 14.656 5.388 1.00 0.00 C ATOM 1547 OD1 ASN A 104 10.126 15.710 5.050 1.00 0.00 O ATOM 1548 ND2 ASN A 104 11.943 14.403 5.305 1.00 0.00 N ATOM 0 H ASN A 104 9.959 11.977 7.911 1.00 0.00 H new ATOM 0 HA ASN A 104 9.711 14.764 7.689 1.00 0.00 H new ATOM 0 HB2 ASN A 104 10.441 12.610 6.040 1.00 0.00 H new ATOM 0 HB3 ASN A 104 9.006 13.252 5.266 1.00 0.00 H new ATOM 0 HD21 ASN A 104 12.578 15.113 4.941 1.00 0.00 H new ATOM 0 HD22 ASN A 104 12.307 13.499 5.606 1.00 0.00 H new ATOM 1555 N ASP A 105 7.336 15.302 6.995 1.00 0.00 N ATOM 1556 CA ASP A 105 5.931 15.633 6.830 1.00 0.00 C ATOM 1557 C ASP A 105 5.362 14.844 5.647 1.00 0.00 C ATOM 1558 O ASP A 105 4.148 14.678 5.536 1.00 0.00 O ATOM 1559 CB ASP A 105 5.748 17.124 6.534 1.00 0.00 C ATOM 1560 CG ASP A 105 5.400 17.985 7.749 1.00 0.00 C ATOM 1561 OD1 ASP A 105 6.253 18.053 8.660 1.00 0.00 O ATOM 1562 OD2 ASP A 105 4.288 18.555 7.741 1.00 0.00 O ATOM 0 H ASP A 105 7.968 16.102 6.970 1.00 0.00 H new ATOM 0 HA ASP A 105 5.414 15.382 7.756 1.00 0.00 H new ATOM 0 HB2 ASP A 105 6.666 17.506 6.088 1.00 0.00 H new ATOM 0 HB3 ASP A 105 4.960 17.237 5.789 1.00 0.00 H new ATOM 1567 N ASP A 106 6.264 14.378 4.797 1.00 0.00 N ATOM 1568 CA ASP A 106 5.867 13.610 3.630 1.00 0.00 C ATOM 1569 C ASP A 106 5.620 12.158 4.040 1.00 0.00 C ATOM 1570 O ASP A 106 5.837 11.240 3.250 1.00 0.00 O ATOM 1571 CB ASP A 106 6.965 13.622 2.565 1.00 0.00 C ATOM 1572 CG ASP A 106 7.888 14.841 2.599 1.00 0.00 C ATOM 1573 OD1 ASP A 106 7.429 15.913 2.152 1.00 0.00 O ATOM 1574 OD2 ASP A 106 9.033 14.673 3.073 1.00 0.00 O ATOM 0 H ASP A 106 7.270 14.518 4.893 1.00 0.00 H new ATOM 0 HA ASP A 106 4.963 14.060 3.221 1.00 0.00 H new ATOM 0 HB2 ASP A 106 7.571 12.723 2.680 1.00 0.00 H new ATOM 0 HB3 ASP A 106 6.497 13.567 1.582 1.00 0.00 H new ATOM 1579 N LYS A 107 5.171 11.992 5.275 1.00 0.00 N ATOM 1580 CA LYS A 107 4.892 10.667 5.800 1.00 0.00 C ATOM 1581 C LYS A 107 4.194 9.834 4.723 1.00 0.00 C ATOM 1582 O LYS A 107 4.278 8.605 4.731 1.00 0.00 O ATOM 1583 CB LYS A 107 4.106 10.763 7.109 1.00 0.00 C ATOM 1584 CG LYS A 107 5.049 10.903 8.306 1.00 0.00 C ATOM 1585 CD LYS A 107 4.691 12.131 9.145 1.00 0.00 C ATOM 1586 CE LYS A 107 3.718 11.764 10.267 1.00 0.00 C ATOM 1587 NZ LYS A 107 2.417 12.439 10.065 1.00 0.00 N ATOM 0 H LYS A 107 4.993 12.755 5.928 1.00 0.00 H new ATOM 0 HA LYS A 107 5.820 10.153 6.050 1.00 0.00 H new ATOM 0 HB2 LYS A 107 3.432 11.619 7.071 1.00 0.00 H new ATOM 0 HB3 LYS A 107 3.487 9.874 7.231 1.00 0.00 H new ATOM 0 HG2 LYS A 107 4.993 10.007 8.924 1.00 0.00 H new ATOM 0 HG3 LYS A 107 6.078 10.985 7.955 1.00 0.00 H new ATOM 0 HD2 LYS A 107 5.597 12.561 9.571 1.00 0.00 H new ATOM 0 HD3 LYS A 107 4.245 12.894 8.507 1.00 0.00 H new ATOM 0 HE2 LYS A 107 3.574 10.684 10.293 1.00 0.00 H new ATOM 0 HE3 LYS A 107 4.139 12.053 11.230 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 1.768 12.179 10.835 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 2.557 13.470 10.063 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 2.010 12.143 9.155 1.00 0.00 H new ATOM 1601 N CYS A 108 3.522 10.534 3.821 1.00 0.00 N ATOM 1602 CA CYS A 108 2.810 9.874 2.740 1.00 0.00 C ATOM 1603 C CYS A 108 3.827 9.104 1.894 1.00 0.00 C ATOM 1604 O CYS A 108 3.648 7.917 1.630 1.00 0.00 O ATOM 1605 CB CYS A 108 2.006 10.869 1.901 1.00 0.00 C ATOM 1606 SG CYS A 108 0.862 10.107 0.694 1.00 0.00 S ATOM 0 H CYS A 108 3.456 11.552 3.817 1.00 0.00 H new ATOM 0 HA CYS A 108 2.081 9.177 3.154 1.00 0.00 H new ATOM 0 HB2 CYS A 108 1.431 11.507 2.572 1.00 0.00 H new ATOM 0 HB3 CYS A 108 2.701 11.515 1.364 1.00 0.00 H new ATOM 1611 N MET A 109 4.874 9.813 1.494 1.00 0.00 N ATOM 1612 CA MET A 109 5.919 9.211 0.685 1.00 0.00 C ATOM 1613 C MET A 109 7.113 8.801 1.547 1.00 0.00 C ATOM 1614 O MET A 109 8.025 8.126 1.071 1.00 0.00 O ATOM 1615 CB MET A 109 6.376 10.210 -0.381 1.00 0.00 C ATOM 1616 CG MET A 109 6.682 11.575 0.241 1.00 0.00 C ATOM 1617 SD MET A 109 7.908 12.430 -0.733 1.00 0.00 S ATOM 1618 CE MET A 109 9.361 12.121 0.255 1.00 0.00 C ATOM 0 H MET A 109 5.020 10.798 1.716 1.00 0.00 H new ATOM 0 HA MET A 109 5.516 8.317 0.210 1.00 0.00 H new ATOM 0 HB2 MET A 109 7.264 9.829 -0.885 1.00 0.00 H new ATOM 0 HB3 MET A 109 5.601 10.318 -1.140 1.00 0.00 H new ATOM 0 HG2 MET A 109 5.771 12.170 0.297 1.00 0.00 H new ATOM 0 HG3 MET A 109 7.042 11.446 1.262 1.00 0.00 H new ATOM 0 HE1 MET A 109 10.253 12.349 -0.329 1.00 0.00 H new ATOM 0 HE2 MET A 109 9.338 12.752 1.143 1.00 0.00 H new ATOM 0 HE3 MET A 109 9.381 11.073 0.555 1.00 0.00 H new ATOM 1628 N LYS A 110 7.069 9.225 2.801 1.00 0.00 N ATOM 1629 CA LYS A 110 8.137 8.909 3.736 1.00 0.00 C ATOM 1630 C LYS A 110 7.834 7.573 4.418 1.00 0.00 C ATOM 1631 O LYS A 110 8.517 6.579 4.175 1.00 0.00 O ATOM 1632 CB LYS A 110 8.351 10.065 4.716 1.00 0.00 C ATOM 1633 CG LYS A 110 9.178 9.615 5.921 1.00 0.00 C ATOM 1634 CD LYS A 110 8.291 9.414 7.151 1.00 0.00 C ATOM 1635 CE LYS A 110 8.824 8.281 8.031 1.00 0.00 C ATOM 1636 NZ LYS A 110 8.687 8.630 9.463 1.00 0.00 N ATOM 0 H LYS A 110 6.311 9.785 3.192 1.00 0.00 H new ATOM 0 HA LYS A 110 9.083 8.790 3.207 1.00 0.00 H new ATOM 0 HB2 LYS A 110 8.857 10.887 4.210 1.00 0.00 H new ATOM 0 HB3 LYS A 110 7.386 10.444 5.053 1.00 0.00 H new ATOM 0 HG2 LYS A 110 9.695 8.685 5.685 1.00 0.00 H new ATOM 0 HG3 LYS A 110 9.944 10.359 6.139 1.00 0.00 H new ATOM 0 HD2 LYS A 110 8.248 10.338 7.728 1.00 0.00 H new ATOM 0 HD3 LYS A 110 7.272 9.187 6.836 1.00 0.00 H new ATOM 0 HE2 LYS A 110 8.278 7.361 7.821 1.00 0.00 H new ATOM 0 HE3 LYS A 110 9.871 8.091 7.795 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 8.622 7.759 10.028 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 9.516 9.179 9.767 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 7.826 9.197 9.601 1.00 0.00 H new ATOM 1650 N THR A 111 6.808 7.593 5.257 1.00 0.00 N ATOM 1651 CA THR A 111 6.407 6.395 5.975 1.00 0.00 C ATOM 1652 C THR A 111 6.282 5.213 5.012 1.00 0.00 C ATOM 1653 O THR A 111 6.727 4.107 5.319 1.00 0.00 O ATOM 1654 CB THR A 111 5.110 6.707 6.726 1.00 0.00 C ATOM 1655 OG1 THR A 111 5.352 7.979 7.321 1.00 0.00 O ATOM 1656 CG2 THR A 111 4.887 5.774 7.919 1.00 0.00 C ATOM 0 H THR A 111 6.243 8.419 5.455 1.00 0.00 H new ATOM 0 HA THR A 111 7.160 6.100 6.705 1.00 0.00 H new ATOM 0 HB THR A 111 4.265 6.630 6.041 1.00 0.00 H new ATOM 0 HG1 THR A 111 5.135 7.940 8.276 1.00 0.00 H new ATOM 0 HG21 THR A 111 3.954 6.037 8.417 1.00 0.00 H new ATOM 0 HG22 THR A 111 4.833 4.743 7.569 1.00 0.00 H new ATOM 0 HG23 THR A 111 5.715 5.877 8.621 1.00 0.00 H new ATOM 1664 N ILE A 112 5.675 5.484 3.867 1.00 0.00 N ATOM 1665 CA ILE A 112 5.485 4.457 2.856 1.00 0.00 C ATOM 1666 C ILE A 112 6.808 3.722 2.630 1.00 0.00 C ATOM 1667 O ILE A 112 6.841 2.492 2.602 1.00 0.00 O ATOM 1668 CB ILE A 112 4.890 5.061 1.583 1.00 0.00 C ATOM 1669 CG1 ILE A 112 4.207 3.986 0.734 1.00 0.00 C ATOM 1670 CG2 ILE A 112 5.954 5.827 0.792 1.00 0.00 C ATOM 1671 CD1 ILE A 112 5.185 2.863 0.381 1.00 0.00 C ATOM 0 H ILE A 112 5.307 6.402 3.616 1.00 0.00 H new ATOM 0 HA ILE A 112 4.761 3.716 3.195 1.00 0.00 H new ATOM 0 HB ILE A 112 4.122 5.780 1.871 1.00 0.00 H new ATOM 0 HG12 ILE A 112 3.356 3.575 1.277 1.00 0.00 H new ATOM 0 HG13 ILE A 112 3.816 4.433 -0.180 1.00 0.00 H new ATOM 0 HG21 ILE A 112 5.506 6.247 -0.109 1.00 0.00 H new ATOM 0 HG22 ILE A 112 6.355 6.633 1.407 1.00 0.00 H new ATOM 0 HG23 ILE A 112 6.760 5.148 0.514 1.00 0.00 H new ATOM 0 HD11 ILE A 112 4.675 2.112 -0.222 1.00 0.00 H new ATOM 0 HD12 ILE A 112 6.022 3.274 -0.183 1.00 0.00 H new ATOM 0 HD13 ILE A 112 5.555 2.402 1.297 1.00 0.00 H new ATOM 1683 N ASP A 113 7.864 4.505 2.474 1.00 0.00 N ATOM 1684 CA ASP A 113 9.186 3.944 2.252 1.00 0.00 C ATOM 1685 C ASP A 113 9.387 2.739 3.172 1.00 0.00 C ATOM 1686 O ASP A 113 9.734 1.653 2.714 1.00 0.00 O ATOM 1687 CB ASP A 113 10.280 4.967 2.565 1.00 0.00 C ATOM 1688 CG ASP A 113 11.464 4.964 1.598 1.00 0.00 C ATOM 1689 OD1 ASP A 113 11.676 3.910 0.961 1.00 0.00 O ATOM 1690 OD2 ASP A 113 12.132 6.018 1.516 1.00 0.00 O ATOM 0 H ASP A 113 7.832 5.524 2.497 1.00 0.00 H new ATOM 0 HA ASP A 113 9.255 3.653 1.204 1.00 0.00 H new ATOM 0 HB2 ASP A 113 9.835 5.962 2.568 1.00 0.00 H new ATOM 0 HB3 ASP A 113 10.653 4.781 3.572 1.00 0.00 H new ATOM 1695 N VAL A 114 9.159 2.973 4.456 1.00 0.00 N ATOM 1696 CA VAL A 114 9.310 1.920 5.447 1.00 0.00 C ATOM 1697 C VAL A 114 8.125 0.958 5.346 1.00 0.00 C ATOM 1698 O VAL A 114 8.311 -0.257 5.290 1.00 0.00 O ATOM 1699 CB VAL A 114 9.466 2.532 6.842 1.00 0.00 C ATOM 1700 CG1 VAL A 114 10.398 1.685 7.710 1.00 0.00 C ATOM 1701 CG2 VAL A 114 9.961 3.977 6.753 1.00 0.00 C ATOM 0 H VAL A 114 8.871 3.876 4.833 1.00 0.00 H new ATOM 0 HA VAL A 114 10.215 1.343 5.257 1.00 0.00 H new ATOM 0 HB VAL A 114 8.485 2.543 7.316 1.00 0.00 H new ATOM 0 HG11 VAL A 114 10.492 2.141 8.695 1.00 0.00 H new ATOM 0 HG12 VAL A 114 9.987 0.681 7.813 1.00 0.00 H new ATOM 0 HG13 VAL A 114 11.380 1.629 7.241 1.00 0.00 H new ATOM 0 HG21 VAL A 114 10.064 4.389 7.757 1.00 0.00 H new ATOM 0 HG22 VAL A 114 10.928 4.000 6.251 1.00 0.00 H new ATOM 0 HG23 VAL A 114 9.244 4.573 6.188 1.00 0.00 H new ATOM 1711 N ALA A 115 6.933 1.536 5.326 1.00 0.00 N ATOM 1712 CA ALA A 115 5.719 0.744 5.232 1.00 0.00 C ATOM 1713 C ALA A 115 5.849 -0.248 4.074 1.00 0.00 C ATOM 1714 O ALA A 115 5.161 -1.267 4.044 1.00 0.00 O ATOM 1715 CB ALA A 115 4.515 1.673 5.071 1.00 0.00 C ATOM 0 H ALA A 115 6.782 2.544 5.373 1.00 0.00 H new ATOM 0 HA ALA A 115 5.566 0.167 6.144 1.00 0.00 H new ATOM 0 HB1 ALA A 115 3.604 1.079 5.000 1.00 0.00 H new ATOM 0 HB2 ALA A 115 4.450 2.337 5.933 1.00 0.00 H new ATOM 0 HB3 ALA A 115 4.632 2.267 4.164 1.00 0.00 H new ATOM 1721 N MET A 116 6.738 0.086 3.149 1.00 0.00 N ATOM 1722 CA MET A 116 6.966 -0.764 1.993 1.00 0.00 C ATOM 1723 C MET A 116 8.266 -1.557 2.144 1.00 0.00 C ATOM 1724 O MET A 116 8.344 -2.713 1.733 1.00 0.00 O ATOM 1725 CB MET A 116 7.040 0.100 0.732 1.00 0.00 C ATOM 1726 CG MET A 116 5.922 -0.264 -0.248 1.00 0.00 C ATOM 1727 SD MET A 116 4.338 -0.164 0.569 1.00 0.00 S ATOM 1728 CE MET A 116 3.807 -1.863 0.423 1.00 0.00 C ATOM 0 H MET A 116 7.308 0.932 3.177 1.00 0.00 H new ATOM 0 HA MET A 116 6.139 -1.469 1.914 1.00 0.00 H new ATOM 0 HB2 MET A 116 6.962 1.153 1.003 1.00 0.00 H new ATOM 0 HB3 MET A 116 8.009 -0.035 0.251 1.00 0.00 H new ATOM 0 HG2 MET A 116 5.943 0.411 -1.103 1.00 0.00 H new ATOM 0 HG3 MET A 116 6.079 -1.271 -0.634 1.00 0.00 H new ATOM 0 HE1 MET A 116 2.808 -1.896 -0.011 1.00 0.00 H new ATOM 0 HE2 MET A 116 4.500 -2.407 -0.219 1.00 0.00 H new ATOM 0 HE3 MET A 116 3.789 -2.325 1.410 1.00 0.00 H new ATOM 1738 N CYS A 117 9.257 -0.903 2.734 1.00 0.00 N ATOM 1739 CA CYS A 117 10.549 -1.532 2.945 1.00 0.00 C ATOM 1740 C CYS A 117 10.312 -2.983 3.371 1.00 0.00 C ATOM 1741 O CYS A 117 10.959 -3.897 2.860 1.00 0.00 O ATOM 1742 CB CYS A 117 11.391 -0.767 3.967 1.00 0.00 C ATOM 1743 SG CYS A 117 13.199 -0.977 3.784 1.00 0.00 S ATOM 0 H CYS A 117 9.190 0.057 3.072 1.00 0.00 H new ATOM 0 HA CYS A 117 11.121 -1.515 2.017 1.00 0.00 H new ATOM 0 HB2 CYS A 117 11.153 0.294 3.891 1.00 0.00 H new ATOM 0 HB3 CYS A 117 11.102 -1.088 4.968 1.00 0.00 H new ATOM 1748 N PHE A 118 9.385 -3.150 4.303 1.00 0.00 N ATOM 1749 CA PHE A 118 9.056 -4.472 4.803 1.00 0.00 C ATOM 1750 C PHE A 118 8.395 -5.321 3.716 1.00 0.00 C ATOM 1751 O PHE A 118 8.814 -6.450 3.465 1.00 0.00 O ATOM 1752 CB PHE A 118 8.068 -4.282 5.955 1.00 0.00 C ATOM 1753 CG PHE A 118 7.072 -5.433 6.117 1.00 0.00 C ATOM 1754 CD1 PHE A 118 7.468 -6.713 5.886 1.00 0.00 C ATOM 1755 CD2 PHE A 118 5.791 -5.175 6.494 1.00 0.00 C ATOM 1756 CE1 PHE A 118 6.545 -7.780 6.037 1.00 0.00 C ATOM 1757 CE2 PHE A 118 4.867 -6.243 6.645 1.00 0.00 C ATOM 1758 CZ PHE A 118 5.264 -7.524 6.414 1.00 0.00 C ATOM 0 H PHE A 118 8.851 -2.390 4.725 1.00 0.00 H new ATOM 0 HA PHE A 118 9.963 -4.984 5.125 1.00 0.00 H new ATOM 0 HB2 PHE A 118 8.627 -4.165 6.884 1.00 0.00 H new ATOM 0 HB3 PHE A 118 7.515 -3.356 5.797 1.00 0.00 H new ATOM 0 HD1 PHE A 118 8.486 -6.918 5.587 1.00 0.00 H new ATOM 0 HD2 PHE A 118 5.476 -4.158 6.678 1.00 0.00 H new ATOM 0 HE1 PHE A 118 6.860 -8.796 5.852 1.00 0.00 H new ATOM 0 HE2 PHE A 118 3.849 -6.038 6.943 1.00 0.00 H new ATOM 0 HZ PHE A 118 4.562 -8.337 6.530 1.00 0.00 H new ATOM 1768 N LYS A 119 7.374 -4.746 3.099 1.00 0.00 N ATOM 1769 CA LYS A 119 6.651 -5.435 2.043 1.00 0.00 C ATOM 1770 C LYS A 119 7.604 -5.723 0.882 1.00 0.00 C ATOM 1771 O LYS A 119 7.437 -6.709 0.167 1.00 0.00 O ATOM 1772 CB LYS A 119 5.408 -4.640 1.636 1.00 0.00 C ATOM 1773 CG LYS A 119 4.214 -5.567 1.410 1.00 0.00 C ATOM 1774 CD LYS A 119 3.052 -5.202 2.336 1.00 0.00 C ATOM 1775 CE LYS A 119 2.550 -6.430 3.098 1.00 0.00 C ATOM 1776 NZ LYS A 119 1.636 -6.025 4.189 1.00 0.00 N ATOM 0 H LYS A 119 7.029 -3.809 3.310 1.00 0.00 H new ATOM 0 HA LYS A 119 6.283 -6.397 2.400 1.00 0.00 H new ATOM 0 HB2 LYS A 119 5.167 -3.913 2.412 1.00 0.00 H new ATOM 0 HB3 LYS A 119 5.614 -4.078 0.725 1.00 0.00 H new ATOM 0 HG2 LYS A 119 3.890 -5.502 0.371 1.00 0.00 H new ATOM 0 HG3 LYS A 119 4.513 -6.600 1.586 1.00 0.00 H new ATOM 0 HD2 LYS A 119 3.373 -4.437 3.043 1.00 0.00 H new ATOM 0 HD3 LYS A 119 2.237 -4.774 1.752 1.00 0.00 H new ATOM 0 HE2 LYS A 119 2.034 -7.104 2.414 1.00 0.00 H new ATOM 0 HE3 LYS A 119 3.396 -6.981 3.510 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 1.305 -6.870 4.696 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 2.140 -5.400 4.850 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 0.820 -5.519 3.789 1.00 0.00 H new ATOM 1790 N LYS A 120 8.584 -4.844 0.731 1.00 0.00 N ATOM 1791 CA LYS A 120 9.564 -4.991 -0.331 1.00 0.00 C ATOM 1792 C LYS A 120 10.285 -6.332 -0.172 1.00 0.00 C ATOM 1793 O LYS A 120 10.742 -6.916 -1.154 1.00 0.00 O ATOM 1794 CB LYS A 120 10.506 -3.786 -0.362 1.00 0.00 C ATOM 1795 CG LYS A 120 11.926 -4.189 0.044 1.00 0.00 C ATOM 1796 CD LYS A 120 12.905 -3.034 -0.168 1.00 0.00 C ATOM 1797 CE LYS A 120 13.923 -3.373 -1.259 1.00 0.00 C ATOM 1798 NZ LYS A 120 13.532 -2.755 -2.544 1.00 0.00 N ATOM 0 H LYS A 120 8.720 -4.027 1.327 1.00 0.00 H new ATOM 0 HA LYS A 120 9.072 -5.006 -1.304 1.00 0.00 H new ATOM 0 HB2 LYS A 120 10.519 -3.355 -1.363 1.00 0.00 H new ATOM 0 HB3 LYS A 120 10.136 -3.014 0.312 1.00 0.00 H new ATOM 0 HG2 LYS A 120 11.937 -4.492 1.091 1.00 0.00 H new ATOM 0 HG3 LYS A 120 12.244 -5.052 -0.541 1.00 0.00 H new ATOM 0 HD2 LYS A 120 12.357 -2.133 -0.444 1.00 0.00 H new ATOM 0 HD3 LYS A 120 13.425 -2.817 0.765 1.00 0.00 H new ATOM 0 HE2 LYS A 120 14.911 -3.019 -0.965 1.00 0.00 H new ATOM 0 HE3 LYS A 120 13.993 -4.454 -1.376 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 14.234 -2.996 -3.273 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 12.598 -3.112 -2.831 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 13.488 -1.722 -2.433 1.00 0.00 H new ATOM 1812 N GLU A 121 10.364 -6.779 1.073 1.00 0.00 N ATOM 1813 CA GLU A 121 11.022 -8.041 1.374 1.00 0.00 C ATOM 1814 C GLU A 121 10.321 -9.191 0.648 1.00 0.00 C ATOM 1815 O GLU A 121 10.953 -10.188 0.303 1.00 0.00 O ATOM 1816 CB GLU A 121 11.067 -8.289 2.882 1.00 0.00 C ATOM 1817 CG GLU A 121 11.712 -7.111 3.614 1.00 0.00 C ATOM 1818 CD GLU A 121 13.232 -7.118 3.432 1.00 0.00 C ATOM 1819 OE1 GLU A 121 13.875 -7.981 4.067 1.00 0.00 O ATOM 1820 OE2 GLU A 121 13.715 -6.261 2.661 1.00 0.00 O ATOM 0 H GLU A 121 9.984 -6.291 1.884 1.00 0.00 H new ATOM 0 HA GLU A 121 12.051 -7.987 1.018 1.00 0.00 H new ATOM 0 HB2 GLU A 121 10.056 -8.446 3.258 1.00 0.00 H new ATOM 0 HB3 GLU A 121 11.628 -9.200 3.087 1.00 0.00 H new ATOM 0 HG2 GLU A 121 11.301 -6.175 3.236 1.00 0.00 H new ATOM 0 HG3 GLU A 121 11.469 -7.161 4.675 1.00 0.00 H new ATOM 1827 N ILE A 122 9.025 -9.013 0.439 1.00 0.00 N ATOM 1828 CA ILE A 122 8.232 -10.025 -0.239 1.00 0.00 C ATOM 1829 C ILE A 122 8.523 -9.974 -1.741 1.00 0.00 C ATOM 1830 O ILE A 122 8.601 -11.012 -2.396 1.00 0.00 O ATOM 1831 CB ILE A 122 6.750 -9.863 0.105 1.00 0.00 C ATOM 1832 CG1 ILE A 122 6.572 -9.359 1.538 1.00 0.00 C ATOM 1833 CG2 ILE A 122 5.984 -11.163 -0.145 1.00 0.00 C ATOM 1834 CD1 ILE A 122 7.498 -10.106 2.501 1.00 0.00 C ATOM 0 H ILE A 122 8.504 -8.184 0.727 1.00 0.00 H new ATOM 0 HA ILE A 122 8.510 -11.021 0.107 1.00 0.00 H new ATOM 0 HB ILE A 122 6.326 -9.108 -0.557 1.00 0.00 H new ATOM 0 HG12 ILE A 122 6.783 -8.290 1.580 1.00 0.00 H new ATOM 0 HG13 ILE A 122 5.535 -9.492 1.848 1.00 0.00 H new ATOM 0 HG21 ILE A 122 4.933 -11.020 0.107 1.00 0.00 H new ATOM 0 HG22 ILE A 122 6.070 -11.440 -1.196 1.00 0.00 H new ATOM 0 HG23 ILE A 122 6.402 -11.956 0.475 1.00 0.00 H new ATOM 0 HD11 ILE A 122 7.352 -9.728 3.513 1.00 0.00 H new ATOM 0 HD12 ILE A 122 7.268 -11.171 2.474 1.00 0.00 H new ATOM 0 HD13 ILE A 122 8.535 -9.951 2.203 1.00 0.00 H new ATOM 1846 N HIS A 123 8.676 -8.756 -2.241 1.00 0.00 N ATOM 1847 CA HIS A 123 8.958 -8.557 -3.652 1.00 0.00 C ATOM 1848 C HIS A 123 10.095 -9.483 -4.085 1.00 0.00 C ATOM 1849 O HIS A 123 10.280 -9.732 -5.275 1.00 0.00 O ATOM 1850 CB HIS A 123 9.249 -7.083 -3.944 1.00 0.00 C ATOM 1851 CG HIS A 123 10.630 -6.828 -4.499 1.00 0.00 C ATOM 1852 ND1 HIS A 123 11.094 -7.425 -5.659 1.00 0.00 N ATOM 1853 CD2 HIS A 123 11.643 -6.037 -4.042 1.00 0.00 C ATOM 1854 CE1 HIS A 123 12.331 -7.004 -5.879 1.00 0.00 C ATOM 1855 NE2 HIS A 123 12.669 -6.144 -4.875 1.00 0.00 N ATOM 0 H HIS A 123 8.610 -7.898 -1.694 1.00 0.00 H new ATOM 0 HA HIS A 123 8.080 -8.819 -4.242 1.00 0.00 H new ATOM 0 HB2 HIS A 123 8.509 -6.711 -4.653 1.00 0.00 H new ATOM 0 HB3 HIS A 123 9.126 -6.510 -3.025 1.00 0.00 H new ATOM 0 HD1 HIS A 123 10.573 -8.078 -6.244 1.00 0.00 H new ATOM 0 HD2 HIS A 123 11.614 -5.426 -3.152 1.00 0.00 H new ATOM 0 HE1 HIS A 123 12.961 -7.291 -6.708 1.00 0.00 H new ATOM 1864 N LYS A 124 10.829 -9.970 -3.094 1.00 0.00 N ATOM 1865 CA LYS A 124 11.944 -10.864 -3.357 1.00 0.00 C ATOM 1866 C LYS A 124 11.477 -12.312 -3.203 1.00 0.00 C ATOM 1867 O LYS A 124 12.279 -13.199 -2.913 1.00 0.00 O ATOM 1868 CB LYS A 124 13.139 -10.505 -2.473 1.00 0.00 C ATOM 1869 CG LYS A 124 13.375 -8.993 -2.457 1.00 0.00 C ATOM 1870 CD LYS A 124 14.464 -8.620 -1.450 1.00 0.00 C ATOM 1871 CE LYS A 124 14.509 -7.105 -1.227 1.00 0.00 C ATOM 1872 NZ LYS A 124 15.878 -6.676 -0.863 1.00 0.00 N ATOM 0 H LYS A 124 10.673 -9.762 -2.108 1.00 0.00 H new ATOM 0 HA LYS A 124 12.292 -10.748 -4.384 1.00 0.00 H new ATOM 0 HB2 LYS A 124 12.964 -10.860 -1.457 1.00 0.00 H new ATOM 0 HB3 LYS A 124 14.032 -11.012 -2.839 1.00 0.00 H new ATOM 0 HG2 LYS A 124 13.664 -8.656 -3.452 1.00 0.00 H new ATOM 0 HG3 LYS A 124 12.448 -8.479 -2.203 1.00 0.00 H new ATOM 0 HD2 LYS A 124 14.277 -9.125 -0.503 1.00 0.00 H new ATOM 0 HD3 LYS A 124 15.432 -8.967 -1.811 1.00 0.00 H new ATOM 0 HE2 LYS A 124 14.188 -6.588 -2.132 1.00 0.00 H new ATOM 0 HE3 LYS A 124 13.812 -6.827 -0.437 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 15.891 -5.647 -0.715 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 16.171 -7.155 0.012 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 16.535 -6.924 -1.630 1.00 0.00 H new ATOM 1886 N LEU A 125 10.182 -12.509 -3.404 1.00 0.00 N ATOM 1887 CA LEU A 125 9.600 -13.834 -3.291 1.00 0.00 C ATOM 1888 C LEU A 125 10.505 -14.846 -3.996 1.00 0.00 C ATOM 1889 O LEU A 125 11.459 -15.350 -3.403 1.00 0.00 O ATOM 1890 CB LEU A 125 8.160 -13.834 -3.808 1.00 0.00 C ATOM 1891 CG LEU A 125 7.788 -12.689 -4.753 1.00 0.00 C ATOM 1892 CD1 LEU A 125 8.884 -12.459 -5.795 1.00 0.00 C ATOM 1893 CD2 LEU A 125 6.424 -12.935 -5.401 1.00 0.00 C ATOM 0 H LEU A 125 9.520 -11.772 -3.645 1.00 0.00 H new ATOM 0 HA LEU A 125 9.539 -14.134 -2.245 1.00 0.00 H new ATOM 0 HB2 LEU A 125 7.980 -14.777 -4.323 1.00 0.00 H new ATOM 0 HB3 LEU A 125 7.487 -13.805 -2.951 1.00 0.00 H new ATOM 0 HG LEU A 125 7.706 -11.775 -4.166 1.00 0.00 H new ATOM 0 HD11 LEU A 125 8.594 -11.640 -6.453 1.00 0.00 H new ATOM 0 HD12 LEU A 125 9.817 -12.207 -5.292 1.00 0.00 H new ATOM 0 HD13 LEU A 125 9.023 -13.366 -6.383 1.00 0.00 H new ATOM 0 HD21 LEU A 125 6.183 -12.107 -6.068 1.00 0.00 H new ATOM 0 HD22 LEU A 125 6.454 -13.863 -5.972 1.00 0.00 H new ATOM 0 HD23 LEU A 125 5.661 -13.010 -4.626 1.00 0.00 H new ATOM 1905 N ASN A 126 10.175 -15.116 -5.250 1.00 0.00 N ATOM 1906 CA ASN A 126 10.945 -16.059 -6.042 1.00 0.00 C ATOM 1907 C ASN A 126 11.963 -15.293 -6.890 1.00 0.00 C ATOM 1908 O ASN A 126 12.966 -15.858 -7.324 1.00 0.00 O ATOM 1909 CB ASN A 126 10.042 -16.853 -6.988 1.00 0.00 C ATOM 1910 CG ASN A 126 10.863 -17.804 -7.859 1.00 0.00 C ATOM 1911 OD1 ASN A 126 11.200 -18.911 -7.470 1.00 0.00 O ATOM 1912 ND2 ASN A 126 11.165 -17.315 -9.058 1.00 0.00 N ATOM 0 H ASN A 126 9.383 -14.697 -5.738 1.00 0.00 H new ATOM 0 HA ASN A 126 11.442 -16.747 -5.358 1.00 0.00 H new ATOM 0 HB2 ASN A 126 9.313 -17.421 -6.410 1.00 0.00 H new ATOM 0 HB3 ASN A 126 9.480 -16.167 -7.622 1.00 0.00 H new ATOM 0 HD21 ASN A 126 11.710 -17.874 -9.714 1.00 0.00 H new ATOM 0 HD22 ASN A 126 10.852 -16.381 -9.321 1.00 0.00 H new ATOM 1919 N TRP A 127 11.668 -14.019 -7.106 1.00 0.00 N ATOM 1920 CA TRP A 127 12.543 -13.171 -7.894 1.00 0.00 C ATOM 1921 C TRP A 127 13.545 -12.513 -6.945 1.00 0.00 C ATOM 1922 O TRP A 127 13.181 -12.084 -5.851 1.00 0.00 O ATOM 1923 CB TRP A 127 11.737 -12.158 -8.709 1.00 0.00 C ATOM 1924 CG TRP A 127 10.239 -12.460 -8.770 1.00 0.00 C ATOM 1925 CD1 TRP A 127 9.640 -13.657 -8.834 1.00 0.00 C ATOM 1926 CD2 TRP A 127 9.165 -11.495 -8.770 1.00 0.00 C ATOM 1927 NE1 TRP A 127 8.266 -13.536 -8.876 1.00 0.00 N ATOM 1928 CE2 TRP A 127 7.969 -12.177 -8.836 1.00 0.00 C ATOM 1929 CE3 TRP A 127 9.206 -10.090 -8.719 1.00 0.00 C ATOM 1930 CZ2 TRP A 127 6.722 -11.540 -8.855 1.00 0.00 C ATOM 1931 CZ3 TRP A 127 7.951 -9.469 -8.737 1.00 0.00 C ATOM 1932 CH2 TRP A 127 6.737 -10.142 -8.803 1.00 0.00 C ATOM 0 H TRP A 127 10.834 -13.554 -6.748 1.00 0.00 H new ATOM 0 HA TRP A 127 13.094 -13.761 -8.626 1.00 0.00 H new ATOM 0 HB2 TRP A 127 11.880 -11.166 -8.280 1.00 0.00 H new ATOM 0 HB3 TRP A 127 12.133 -12.127 -9.724 1.00 0.00 H new ATOM 0 HD1 TRP A 127 10.167 -14.599 -8.851 1.00 0.00 H new ATOM 0 HE1 TRP A 127 7.593 -14.301 -8.927 1.00 0.00 H new ATOM 0 HE3 TRP A 127 10.131 -9.535 -8.670 1.00 0.00 H new ATOM 0 HZ2 TRP A 127 5.799 -12.098 -8.907 1.00 0.00 H new ATOM 0 HZ3 TRP A 127 7.925 -8.390 -8.697 1.00 0.00 H new ATOM 0 HH2 TRP A 127 5.810 -9.589 -8.814 1.00 0.00 H new ATOM 1943 N VAL A 128 14.789 -12.452 -7.397 1.00 0.00 N ATOM 1944 CA VAL A 128 15.847 -11.853 -6.601 1.00 0.00 C ATOM 1945 C VAL A 128 16.470 -10.691 -7.379 1.00 0.00 C ATOM 1946 O VAL A 128 17.046 -10.893 -8.447 1.00 0.00 O ATOM 1947 CB VAL A 128 16.869 -12.919 -6.200 1.00 0.00 C ATOM 1948 CG1 VAL A 128 16.242 -13.951 -5.260 1.00 0.00 C ATOM 1949 CG2 VAL A 128 17.470 -13.595 -7.433 1.00 0.00 C ATOM 0 H VAL A 128 15.088 -12.808 -8.305 1.00 0.00 H new ATOM 0 HA VAL A 128 15.442 -11.445 -5.675 1.00 0.00 H new ATOM 0 HB VAL A 128 17.678 -12.423 -5.663 1.00 0.00 H new ATOM 0 HG11 VAL A 128 16.989 -14.698 -4.990 1.00 0.00 H new ATOM 0 HG12 VAL A 128 15.884 -13.453 -4.359 1.00 0.00 H new ATOM 0 HG13 VAL A 128 15.406 -14.439 -5.761 1.00 0.00 H new ATOM 0 HG21 VAL A 128 18.193 -14.348 -7.119 1.00 0.00 H new ATOM 0 HG22 VAL A 128 16.677 -14.071 -8.010 1.00 0.00 H new ATOM 0 HG23 VAL A 128 17.969 -12.848 -8.050 1.00 0.00 H new ATOM 1959 N PRO A 129 16.329 -9.470 -6.798 1.00 0.00 N ATOM 1960 CA PRO A 129 16.871 -8.277 -7.427 1.00 0.00 C ATOM 1961 C PRO A 129 18.391 -8.216 -7.268 1.00 0.00 C ATOM 1962 O PRO A 129 18.933 -7.204 -6.824 1.00 0.00 O ATOM 1963 CB PRO A 129 16.156 -7.117 -6.751 1.00 0.00 C ATOM 1964 CG PRO A 129 15.587 -7.677 -5.457 1.00 0.00 C ATOM 1965 CD PRO A 129 15.654 -9.193 -5.535 1.00 0.00 C ATOM 0 HA PRO A 129 16.705 -8.257 -8.504 1.00 0.00 H new ATOM 0 HB2 PRO A 129 16.845 -6.296 -6.552 1.00 0.00 H new ATOM 0 HB3 PRO A 129 15.364 -6.722 -7.387 1.00 0.00 H new ATOM 0 HG2 PRO A 129 16.156 -7.313 -4.601 1.00 0.00 H new ATOM 0 HG3 PRO A 129 14.557 -7.347 -5.319 1.00 0.00 H new ATOM 0 HD2 PRO A 129 16.206 -9.609 -4.692 1.00 0.00 H new ATOM 0 HD3 PRO A 129 14.658 -9.635 -5.513 1.00 0.00 H new ATOM 1973 N ASN A 130 19.037 -9.311 -7.639 1.00 0.00 N ATOM 1974 CA ASN A 130 20.485 -9.395 -7.543 1.00 0.00 C ATOM 1975 C ASN A 130 21.097 -8.051 -7.943 1.00 0.00 C ATOM 1976 O ASN A 130 22.148 -7.666 -7.431 1.00 0.00 O ATOM 1977 CB ASN A 130 21.038 -10.467 -8.484 1.00 0.00 C ATOM 1978 CG ASN A 130 22.133 -11.286 -7.799 1.00 0.00 C ATOM 1979 OD1 ASN A 130 21.947 -11.849 -6.732 1.00 0.00 O ATOM 1980 ND2 ASN A 130 23.281 -11.326 -8.470 1.00 0.00 N ATOM 0 H ASN A 130 18.585 -10.148 -8.007 1.00 0.00 H new ATOM 0 HA ASN A 130 20.741 -9.652 -6.515 1.00 0.00 H new ATOM 0 HB2 ASN A 130 20.231 -11.127 -8.803 1.00 0.00 H new ATOM 0 HB3 ASN A 130 21.439 -9.996 -9.382 1.00 0.00 H new ATOM 0 HD21 ASN A 130 24.072 -11.850 -8.096 1.00 0.00 H new ATOM 0 HD22 ASN A 130 23.370 -10.832 -9.358 1.00 0.00 H new ATOM 1987 N MET A 131 20.413 -7.374 -8.854 1.00 0.00 N ATOM 1988 CA MET A 131 20.877 -6.081 -9.329 1.00 0.00 C ATOM 1989 C MET A 131 20.053 -4.945 -8.719 1.00 0.00 C ATOM 1990 O MET A 131 18.945 -4.663 -9.171 1.00 0.00 O ATOM 1991 CB MET A 131 20.768 -6.029 -10.855 1.00 0.00 C ATOM 1992 CG MET A 131 22.136 -6.233 -11.509 1.00 0.00 C ATOM 1993 SD MET A 131 21.997 -6.057 -13.280 1.00 0.00 S ATOM 1994 CE MET A 131 23.450 -6.956 -13.796 1.00 0.00 C ATOM 0 H MET A 131 19.542 -7.696 -9.276 1.00 0.00 H new ATOM 0 HA MET A 131 21.916 -5.954 -9.025 1.00 0.00 H new ATOM 0 HB2 MET A 131 20.077 -6.798 -11.200 1.00 0.00 H new ATOM 0 HB3 MET A 131 20.354 -5.068 -11.161 1.00 0.00 H new ATOM 0 HG2 MET A 131 22.848 -5.506 -11.118 1.00 0.00 H new ATOM 0 HG3 MET A 131 22.522 -7.222 -11.263 1.00 0.00 H new ATOM 0 HE1 MET A 131 23.517 -6.945 -14.884 1.00 0.00 H new ATOM 0 HE2 MET A 131 24.338 -6.486 -13.373 1.00 0.00 H new ATOM 0 HE3 MET A 131 23.383 -7.986 -13.447 1.00 0.00 H new ATOM 2004 N ASP A 132 20.627 -4.324 -7.699 1.00 0.00 N ATOM 2005 CA ASP A 132 19.960 -3.225 -7.022 1.00 0.00 C ATOM 2006 C ASP A 132 20.928 -2.046 -6.895 1.00 0.00 C ATOM 2007 O ASP A 132 21.936 -2.139 -6.194 1.00 0.00 O ATOM 2008 CB ASP A 132 19.522 -3.630 -5.613 1.00 0.00 C ATOM 2009 CG ASP A 132 20.616 -4.266 -4.753 1.00 0.00 C ATOM 2010 OD1 ASP A 132 21.097 -5.348 -5.154 1.00 0.00 O ATOM 2011 OD2 ASP A 132 20.946 -3.656 -3.714 1.00 0.00 O ATOM 0 H ASP A 132 21.546 -4.561 -7.325 1.00 0.00 H new ATOM 0 HA ASP A 132 19.083 -2.952 -7.608 1.00 0.00 H new ATOM 0 HB2 ASP A 132 19.144 -2.747 -5.098 1.00 0.00 H new ATOM 0 HB3 ASP A 132 18.691 -4.331 -5.695 1.00 0.00 H new ATOM 2016 N LEU A 133 20.590 -0.966 -7.583 1.00 0.00 N ATOM 2017 CA LEU A 133 21.417 0.228 -7.555 1.00 0.00 C ATOM 2018 C LEU A 133 21.459 0.781 -6.129 1.00 0.00 C ATOM 2019 O LEU A 133 20.451 1.263 -5.615 1.00 0.00 O ATOM 2020 CB LEU A 133 20.930 1.241 -8.593 1.00 0.00 C ATOM 2021 CG LEU A 133 19.866 2.231 -8.116 1.00 0.00 C ATOM 2022 CD1 LEU A 133 18.684 1.498 -7.476 1.00 0.00 C ATOM 2023 CD2 LEU A 133 20.469 3.276 -7.177 1.00 0.00 C ATOM 0 H LEU A 133 19.754 -0.893 -8.163 1.00 0.00 H new ATOM 0 HA LEU A 133 22.443 -0.012 -7.834 1.00 0.00 H new ATOM 0 HB2 LEU A 133 21.790 1.807 -8.951 1.00 0.00 H new ATOM 0 HB3 LEU A 133 20.531 0.693 -9.447 1.00 0.00 H new ATOM 0 HG LEU A 133 19.482 2.765 -8.985 1.00 0.00 H new ATOM 0 HD11 LEU A 133 17.941 2.224 -7.145 1.00 0.00 H new ATOM 0 HD12 LEU A 133 18.234 0.826 -8.207 1.00 0.00 H new ATOM 0 HD13 LEU A 133 19.034 0.921 -6.620 1.00 0.00 H new ATOM 0 HD21 LEU A 133 19.690 3.967 -6.853 1.00 0.00 H new ATOM 0 HD22 LEU A 133 20.898 2.779 -6.307 1.00 0.00 H new ATOM 0 HD23 LEU A 133 21.249 3.828 -7.700 1.00 0.00 H new ATOM 2035 N VAL A 134 22.638 0.693 -5.529 1.00 0.00 N ATOM 2036 CA VAL A 134 22.824 1.179 -4.172 1.00 0.00 C ATOM 2037 C VAL A 134 23.821 2.340 -4.184 1.00 0.00 C ATOM 2038 O VAL A 134 23.970 3.045 -3.187 1.00 0.00 O ATOM 2039 CB VAL A 134 23.256 0.029 -3.260 1.00 0.00 C ATOM 2040 CG1 VAL A 134 24.720 -0.342 -3.502 1.00 0.00 C ATOM 2041 CG2 VAL A 134 23.014 0.375 -1.789 1.00 0.00 C ATOM 0 H VAL A 134 23.473 0.293 -5.957 1.00 0.00 H new ATOM 0 HA VAL A 134 21.885 1.560 -3.770 1.00 0.00 H new ATOM 0 HB VAL A 134 22.645 -0.840 -3.505 1.00 0.00 H new ATOM 0 HG11 VAL A 134 25.002 -1.162 -2.841 1.00 0.00 H new ATOM 0 HG12 VAL A 134 24.850 -0.651 -4.539 1.00 0.00 H new ATOM 0 HG13 VAL A 134 25.353 0.522 -3.298 1.00 0.00 H new ATOM 0 HG21 VAL A 134 23.330 -0.459 -1.162 1.00 0.00 H new ATOM 0 HG22 VAL A 134 23.587 1.264 -1.525 1.00 0.00 H new ATOM 0 HG23 VAL A 134 21.953 0.567 -1.630 1.00 0.00 H new ATOM 2051 N ILE A 135 24.479 2.502 -5.322 1.00 0.00 N ATOM 2052 CA ILE A 135 25.458 3.565 -5.475 1.00 0.00 C ATOM 2053 C ILE A 135 24.874 4.664 -6.365 1.00 0.00 C ATOM 2054 O ILE A 135 25.340 5.804 -6.337 1.00 0.00 O ATOM 2055 CB ILE A 135 26.785 3.002 -5.986 1.00 0.00 C ATOM 2056 CG1 ILE A 135 26.551 1.891 -7.013 1.00 0.00 C ATOM 2057 CG2 ILE A 135 27.665 2.533 -4.827 1.00 0.00 C ATOM 2058 CD1 ILE A 135 26.385 0.534 -6.325 1.00 0.00 C ATOM 0 H ILE A 135 24.354 1.915 -6.147 1.00 0.00 H new ATOM 0 HA ILE A 135 25.682 4.019 -4.510 1.00 0.00 H new ATOM 0 HB ILE A 135 27.322 3.803 -6.494 1.00 0.00 H new ATOM 0 HG12 ILE A 135 25.661 2.116 -7.601 1.00 0.00 H new ATOM 0 HG13 ILE A 135 27.390 1.850 -7.708 1.00 0.00 H new ATOM 0 HG21 ILE A 135 28.602 2.137 -5.219 1.00 0.00 H new ATOM 0 HG22 ILE A 135 27.874 3.374 -4.166 1.00 0.00 H new ATOM 0 HG23 ILE A 135 27.147 1.753 -4.269 1.00 0.00 H new ATOM 0 HD11 ILE A 135 26.220 -0.238 -7.077 1.00 0.00 H new ATOM 0 HD12 ILE A 135 27.286 0.301 -5.758 1.00 0.00 H new ATOM 0 HD13 ILE A 135 25.530 0.571 -5.649 1.00 0.00 H new ATOM 2070 N GLY A 136 23.861 4.287 -7.132 1.00 0.00 N ATOM 2071 CA GLY A 136 23.209 5.226 -8.027 1.00 0.00 C ATOM 2072 C GLY A 136 24.021 5.415 -9.310 1.00 0.00 C ATOM 2073 O GLY A 136 23.992 6.485 -9.916 1.00 0.00 O ATOM 0 H GLY A 136 23.476 3.343 -7.151 1.00 0.00 H new ATOM 0 HA2 GLY A 136 22.211 4.865 -8.274 1.00 0.00 H new ATOM 0 HA3 GLY A 136 23.086 6.186 -7.526 1.00 0.00 H new ATOM 2077 N GLU A 137 24.726 4.359 -9.687 1.00 0.00 N ATOM 2078 CA GLU A 137 25.544 4.395 -10.887 1.00 0.00 C ATOM 2079 C GLU A 137 25.099 3.306 -11.867 1.00 0.00 C ATOM 2080 O GLU A 137 24.316 2.428 -11.509 1.00 0.00 O ATOM 2081 CB GLU A 137 27.028 4.250 -10.544 1.00 0.00 C ATOM 2082 CG GLU A 137 27.559 5.513 -9.860 1.00 0.00 C ATOM 2083 CD GLU A 137 28.068 6.521 -10.891 1.00 0.00 C ATOM 2084 OE1 GLU A 137 29.101 6.213 -11.523 1.00 0.00 O ATOM 2085 OE2 GLU A 137 27.414 7.578 -11.021 1.00 0.00 O ATOM 0 H GLU A 137 24.748 3.473 -9.182 1.00 0.00 H new ATOM 0 HA GLU A 137 25.408 5.365 -11.366 1.00 0.00 H new ATOM 0 HB2 GLU A 137 27.171 3.390 -9.890 1.00 0.00 H new ATOM 0 HB3 GLU A 137 27.598 4.057 -11.453 1.00 0.00 H new ATOM 0 HG2 GLU A 137 26.769 5.967 -9.262 1.00 0.00 H new ATOM 0 HG3 GLU A 137 28.365 5.249 -9.176 1.00 0.00 H new ATOM 2092 N VAL A 138 25.619 3.400 -13.082 1.00 0.00 N ATOM 2093 CA VAL A 138 25.285 2.434 -14.115 1.00 0.00 C ATOM 2094 C VAL A 138 25.831 1.061 -13.719 1.00 0.00 C ATOM 2095 O VAL A 138 27.037 0.829 -13.777 1.00 0.00 O ATOM 2096 CB VAL A 138 25.805 2.916 -15.470 1.00 0.00 C ATOM 2097 CG1 VAL A 138 25.167 4.251 -15.859 1.00 0.00 C ATOM 2098 CG2 VAL A 138 27.331 3.019 -15.466 1.00 0.00 C ATOM 0 H VAL A 138 26.269 4.130 -13.374 1.00 0.00 H new ATOM 0 HA VAL A 138 24.204 2.338 -14.213 1.00 0.00 H new ATOM 0 HB VAL A 138 25.521 2.178 -16.220 1.00 0.00 H new ATOM 0 HG11 VAL A 138 25.554 4.571 -16.826 1.00 0.00 H new ATOM 0 HG12 VAL A 138 24.085 4.133 -15.922 1.00 0.00 H new ATOM 0 HG13 VAL A 138 25.406 5.002 -15.106 1.00 0.00 H new ATOM 0 HG21 VAL A 138 27.675 3.364 -16.441 1.00 0.00 H new ATOM 0 HG22 VAL A 138 27.646 3.727 -14.699 1.00 0.00 H new ATOM 0 HG23 VAL A 138 27.761 2.040 -15.255 1.00 0.00 H new ATOM 2108 N LEU A 139 24.917 0.187 -13.323 1.00 0.00 N ATOM 2109 CA LEU A 139 25.292 -1.156 -12.917 1.00 0.00 C ATOM 2110 C LEU A 139 24.029 -1.962 -12.607 1.00 0.00 C ATOM 2111 O LEU A 139 23.900 -3.110 -13.030 1.00 0.00 O ATOM 2112 CB LEU A 139 26.289 -1.107 -11.759 1.00 0.00 C ATOM 2113 CG LEU A 139 27.389 -2.171 -11.775 1.00 0.00 C ATOM 2114 CD1 LEU A 139 28.473 -1.856 -10.742 1.00 0.00 C ATOM 2115 CD2 LEU A 139 26.802 -3.570 -11.581 1.00 0.00 C ATOM 0 H LEU A 139 23.917 0.383 -13.275 1.00 0.00 H new ATOM 0 HA LEU A 139 25.807 -1.669 -13.729 1.00 0.00 H new ATOM 0 HB2 LEU A 139 26.761 -0.125 -11.754 1.00 0.00 H new ATOM 0 HB3 LEU A 139 25.735 -1.199 -10.825 1.00 0.00 H new ATOM 0 HG LEU A 139 27.865 -2.155 -12.756 1.00 0.00 H new ATOM 0 HD11 LEU A 139 29.242 -2.628 -10.775 1.00 0.00 H new ATOM 0 HD12 LEU A 139 28.920 -0.888 -10.968 1.00 0.00 H new ATOM 0 HD13 LEU A 139 28.030 -1.827 -9.747 1.00 0.00 H new ATOM 0 HD21 LEU A 139 27.605 -4.307 -11.596 1.00 0.00 H new ATOM 0 HD22 LEU A 139 26.284 -3.618 -10.623 1.00 0.00 H new ATOM 0 HD23 LEU A 139 26.098 -3.784 -12.385 1.00 0.00 H new ATOM 2127 N ALA A 140 23.128 -1.329 -11.869 1.00 0.00 N ATOM 2128 CA ALA A 140 21.880 -1.974 -11.498 1.00 0.00 C ATOM 2129 C ALA A 140 20.735 -1.365 -12.311 1.00 0.00 C ATOM 2130 O ALA A 140 20.892 -0.303 -12.912 1.00 0.00 O ATOM 2131 CB ALA A 140 21.662 -1.831 -9.990 1.00 0.00 C ATOM 0 H ALA A 140 23.238 -0.377 -11.519 1.00 0.00 H new ATOM 0 HA ALA A 140 21.916 -3.040 -11.725 1.00 0.00 H new ATOM 0 HB1 ALA A 140 20.726 -2.314 -9.710 1.00 0.00 H new ATOM 0 HB2 ALA A 140 22.487 -2.302 -9.457 1.00 0.00 H new ATOM 0 HB3 ALA A 140 21.617 -0.774 -9.727 1.00 0.00 H new ATOM 2137 N GLU A 141 19.610 -2.063 -12.304 1.00 0.00 N ATOM 2138 CA GLU A 141 18.439 -1.606 -13.034 1.00 0.00 C ATOM 2139 C GLU A 141 17.847 -0.365 -12.362 1.00 0.00 C ATOM 2140 O GLU A 141 17.003 -0.478 -11.474 1.00 0.00 O ATOM 2141 CB GLU A 141 17.395 -2.719 -13.149 1.00 0.00 C ATOM 2142 CG GLU A 141 17.363 -3.296 -14.564 1.00 0.00 C ATOM 2143 CD GLU A 141 16.907 -2.243 -15.576 1.00 0.00 C ATOM 2144 OE1 GLU A 141 15.943 -1.519 -15.248 1.00 0.00 O ATOM 2145 OE2 GLU A 141 17.535 -2.184 -16.657 1.00 0.00 O ATOM 0 H GLU A 141 19.484 -2.943 -11.804 1.00 0.00 H new ATOM 0 HA GLU A 141 18.746 -1.337 -14.045 1.00 0.00 H new ATOM 0 HB2 GLU A 141 17.622 -3.510 -12.435 1.00 0.00 H new ATOM 0 HB3 GLU A 141 16.411 -2.328 -12.890 1.00 0.00 H new ATOM 0 HG2 GLU A 141 18.354 -3.660 -14.834 1.00 0.00 H new ATOM 0 HG3 GLU A 141 16.689 -4.152 -14.596 1.00 0.00 H new ATOM 2152 N VAL A 142 18.314 0.791 -12.812 1.00 0.00 N ATOM 2153 CA VAL A 142 17.840 2.051 -12.265 1.00 0.00 C ATOM 2154 C VAL A 142 16.810 2.661 -13.219 1.00 0.00 C ATOM 2155 O VAL A 142 16.847 3.859 -13.496 1.00 0.00 O ATOM 2156 CB VAL A 142 19.024 2.981 -11.992 1.00 0.00 C ATOM 2157 CG1 VAL A 142 19.779 3.301 -13.284 1.00 0.00 C ATOM 2158 CG2 VAL A 142 18.567 4.262 -11.293 1.00 0.00 C ATOM 0 H VAL A 142 19.014 0.881 -13.548 1.00 0.00 H new ATOM 0 HA VAL A 142 17.343 1.889 -11.309 1.00 0.00 H new ATOM 0 HB VAL A 142 19.710 2.461 -11.323 1.00 0.00 H new ATOM 0 HG11 VAL A 142 20.616 3.964 -13.062 1.00 0.00 H new ATOM 0 HG12 VAL A 142 20.155 2.377 -13.724 1.00 0.00 H new ATOM 0 HG13 VAL A 142 19.105 3.790 -13.987 1.00 0.00 H new ATOM 0 HG21 VAL A 142 19.429 4.904 -11.111 1.00 0.00 H new ATOM 0 HG22 VAL A 142 17.851 4.786 -11.926 1.00 0.00 H new ATOM 0 HG23 VAL A 142 18.096 4.010 -10.343 1.00 0.00 H new TER 2168 VAL A 142