USER MOD reduce.3.24.130724 H: found=0, std=0, add=1253, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1248 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 132 SER OG : rot -150:sc= 0.531 USER MOD Set 1.2: A 149 THR OG1 : rot 143:sc= 0.954 USER MOD Set 2.1: A 109 HIS : no HD1:sc= -0.117 X(o=-0.12,f=-0.094) USER MOD Set 2.2: A 116 SER OG : rot 170:sc= 0 USER MOD Set 3.1: A 86 GLN : amide:sc= 0.701 K(o=2.9,f=-3.1) USER MOD Set 3.2: A 88 LYS NZ :NH3+ 171:sc= 2.16 (180deg=1.26) USER MOD Set 4.1: A 76 CYS SG : rot 85:sc= 1.14 USER MOD Set 4.2: A 120 SER OG : rot 119:sc= 1.4 USER MOD Set 5.1: A 49 CYS SG : rot -110:sc= 0.9 USER MOD Set 5.2: A 96 TYR OH : rot -40:sc= 1.39 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -152:sc= 1.22 (180deg=0.51) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 THR OG1 : rot 91:sc= -0.22 USER MOD Single : A 11 GLN : amide:sc= -1.79! C(o=-1.8!,f=-2.6!) USER MOD Single : A 12 GLN : amide:sc= 0 K(o=0,f=-0.71) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 16 GLN : amide:sc= -0.222 K(o=-0.22,f=-1.2) USER MOD Single : A 19 ASN : amide:sc= -0.254 X(o=-0.25,f=0) USER MOD Single : A 20 HIS : no HE2:sc= 0.677 K(o=0.68,f=-2.1!) USER MOD Single : A 26 GLN : amide:sc= -0.415 X(o=-0.41,f=-0.53) USER MOD Single : A 28 GLN : amide:sc= -0.0539 K(o=-0.054,f=-3.2!) USER MOD Single : A 29 THR OG1 : rot 78:sc= 0.153 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 43 THR OG1 : rot 102:sc= 1.26 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 51 HIS : no HD1:sc= -0.495 K(o=-0.49,f=-2.1) USER MOD Single : A 54 THR OG1 : rot -34:sc= 0.0201 USER MOD Single : A 57 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.0029) USER MOD Single : A 61 ASN : amide:sc= -0.502 K(o=-0.5,f=-1.3) USER MOD Single : A 64 TYR OH : rot 180:sc= -0.401 USER MOD Single : A 68 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 71 ASN : amide:sc= 0.886 K(o=0.89,f=-0.08) USER MOD Single : A 73 CYS SG : rot 61:sc= -3.83! USER MOD Single : A 75 MET CE :methyl -172:sc= -0.0373 (180deg=-0.0653) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 84 THR OG1 : rot -17:sc= 0.46 USER MOD Single : A 90 LYS NZ :NH3+ -145:sc= 0.28 (180deg=-2.34) USER MOD Single : A 93 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 97 ASN : amide:sc= -0.0139 X(o=-0.014,f=0) USER MOD Single : A 98 GLN : amide:sc= -0.367 K(o=-0.37,f=-2!) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 108 TYR OH : rot 15:sc=-0.00748 USER MOD Single : A 110 SER OG : rot 180:sc=0.000355 USER MOD Single : A 111 GLN : amide:sc= -0.0632 X(o=-0.063,f=-0.063) USER MOD Single : A 112 SER OG : rot 162:sc= 1.17 USER MOD Single : A 115 ASN : amide:sc= -0.719 K(o=-0.72,f=-2.7!) USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 131 SER OG : rot -176:sc= 0.662 USER MOD Single : A 136 CYS SG : rot 180:sc= 0 USER MOD Single : A 141 THR OG1 : rot 180:sc= 0 USER MOD Single : A 142 GLN : amide:sc= -0.208 X(o=-0.21,f=0) USER MOD Single : A 146 LYS NZ :NH3+ -157:sc= -0.0808 (180deg=-0.404) USER MOD Single : A 148 ASN : amide:sc= -0.423 X(o=-0.42,f=0) USER MOD Single : A 150 THR OG1 : rot 180:sc=-0.00371 USER MOD Single : A 155 THR OG1 : rot 180:sc= 0 USER MOD Single : A 156 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -9.709 -4.044 10.585 1.00 0.00 N ATOM 2 CA MET A 1 -10.992 -3.329 10.743 1.00 0.00 C ATOM 3 C MET A 1 -10.821 -1.836 10.456 1.00 0.00 C ATOM 4 O MET A 1 -9.718 -1.399 10.107 1.00 0.00 O ATOM 5 CB MET A 1 -11.576 -3.573 12.148 1.00 0.00 C ATOM 6 CG MET A 1 -10.868 -2.914 13.336 1.00 0.00 C ATOM 7 SD MET A 1 -9.123 -3.308 13.598 1.00 0.00 S ATOM 8 CE MET A 1 -8.924 -2.511 15.220 1.00 0.00 C ATOM 0 H1 MET A 1 -9.893 -5.031 10.313 1.00 0.00 H new ATOM 0 H2 MET A 1 -9.142 -3.581 9.846 1.00 0.00 H new ATOM 0 H3 MET A 1 -9.188 -4.024 11.485 1.00 0.00 H new ATOM 0 HA MET A 1 -11.701 -3.722 10.015 1.00 0.00 H new ATOM 0 HB2 MET A 1 -12.612 -3.234 12.144 1.00 0.00 H new ATOM 0 HB3 MET A 1 -11.593 -4.649 12.322 1.00 0.00 H new ATOM 0 HG2 MET A 1 -10.954 -1.834 13.221 1.00 0.00 H new ATOM 0 HG3 MET A 1 -11.412 -3.182 14.242 1.00 0.00 H new ATOM 0 HE1 MET A 1 -7.899 -2.641 15.566 1.00 0.00 H new ATOM 0 HE2 MET A 1 -9.145 -1.447 15.132 1.00 0.00 H new ATOM 0 HE3 MET A 1 -9.609 -2.966 15.936 1.00 0.00 H new ATOM 18 N GLU A 2 -11.906 -1.051 10.495 1.00 0.00 N ATOM 19 CA GLU A 2 -11.850 0.397 10.277 1.00 0.00 C ATOM 20 C GLU A 2 -11.212 1.041 11.507 1.00 0.00 C ATOM 21 O GLU A 2 -11.210 0.451 12.587 1.00 0.00 O ATOM 22 CB GLU A 2 -13.267 0.978 10.105 1.00 0.00 C ATOM 23 CG GLU A 2 -13.765 0.939 8.652 1.00 0.00 C ATOM 24 CD GLU A 2 -13.070 1.974 7.750 1.00 0.00 C ATOM 25 OE1 GLU A 2 -12.097 2.629 8.187 1.00 0.00 O ATOM 26 OE2 GLU A 2 -13.485 2.133 6.582 1.00 0.00 O ATOM 0 H GLU A 2 -12.845 -1.403 10.679 1.00 0.00 H new ATOM 0 HA GLU A 2 -11.272 0.600 9.376 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -13.960 0.420 10.735 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -13.275 2.009 10.457 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -13.601 -0.058 8.244 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -14.840 1.116 8.637 1.00 0.00 H new ATOM 33 N LYS A 3 -10.669 2.255 11.383 1.00 0.00 N ATOM 34 CA LYS A 3 -10.070 2.924 12.547 1.00 0.00 C ATOM 35 C LYS A 3 -11.134 3.655 13.382 1.00 0.00 C ATOM 36 O LYS A 3 -10.791 4.241 14.407 1.00 0.00 O ATOM 37 CB LYS A 3 -8.911 3.829 12.115 1.00 0.00 C ATOM 38 CG LYS A 3 -7.840 4.020 13.205 1.00 0.00 C ATOM 39 CD LYS A 3 -6.749 2.940 13.228 1.00 0.00 C ATOM 40 CE LYS A 3 -5.683 3.179 12.153 1.00 0.00 C ATOM 41 NZ LYS A 3 -4.426 2.437 12.398 1.00 0.00 N ATOM 0 H LYS A 3 -10.630 2.786 10.513 1.00 0.00 H new ATOM 0 HA LYS A 3 -9.644 2.166 13.205 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -8.442 3.406 11.227 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -9.308 4.804 11.832 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -7.367 4.992 13.064 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -8.331 4.042 14.178 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -6.276 2.923 14.210 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -7.204 1.961 13.076 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -6.085 2.888 11.182 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -5.463 4.245 12.101 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -3.748 2.642 11.636 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -4.022 2.731 13.310 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -4.624 1.416 12.420 1.00 0.00 H new ATOM 55 N ALA A 4 -12.404 3.601 12.954 1.00 0.00 N ATOM 56 CA ALA A 4 -13.609 4.186 13.541 1.00 0.00 C ATOM 57 C ALA A 4 -13.813 5.637 13.104 1.00 0.00 C ATOM 58 O ALA A 4 -14.212 6.477 13.908 1.00 0.00 O ATOM 59 CB ALA A 4 -13.663 4.019 15.069 1.00 0.00 C ATOM 0 H ALA A 4 -12.631 3.093 12.099 1.00 0.00 H new ATOM 0 HA ALA A 4 -14.453 3.619 13.147 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -14.578 4.471 15.452 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -13.650 2.958 15.320 1.00 0.00 H new ATOM 0 HB3 ALA A 4 -12.800 4.509 15.519 1.00 0.00 H new ATOM 65 N LEU A 5 -13.510 5.958 11.847 1.00 0.00 N ATOM 66 CA LEU A 5 -13.653 7.294 11.277 1.00 0.00 C ATOM 67 C LEU A 5 -14.926 7.377 10.422 1.00 0.00 C ATOM 68 O LEU A 5 -15.537 6.353 10.103 1.00 0.00 O ATOM 69 CB LEU A 5 -12.376 7.706 10.528 1.00 0.00 C ATOM 70 CG LEU A 5 -12.076 6.821 9.301 1.00 0.00 C ATOM 71 CD1 LEU A 5 -11.312 7.631 8.260 1.00 0.00 C ATOM 72 CD2 LEU A 5 -11.214 5.599 9.657 1.00 0.00 C ATOM 0 H LEU A 5 -13.149 5.276 11.180 1.00 0.00 H new ATOM 0 HA LEU A 5 -13.776 8.022 12.079 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -12.471 8.743 10.205 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -11.530 7.662 11.214 1.00 0.00 H new ATOM 0 HG LEU A 5 -13.037 6.477 8.920 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -11.101 7.004 7.394 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -11.913 8.486 7.951 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -10.374 7.983 8.690 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -11.031 5.009 8.759 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -10.263 5.933 10.072 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -11.736 4.988 10.393 1.00 0.00 H new ATOM 84 N LYS A 6 -15.290 8.591 9.999 1.00 0.00 N ATOM 85 CA LYS A 6 -16.493 8.873 9.190 1.00 0.00 C ATOM 86 C LYS A 6 -16.319 9.930 8.106 1.00 0.00 C ATOM 87 O LYS A 6 -17.174 10.089 7.231 1.00 0.00 O ATOM 88 CB LYS A 6 -17.584 9.353 10.152 1.00 0.00 C ATOM 89 CG LYS A 6 -17.107 10.586 10.972 1.00 0.00 C ATOM 90 CD LYS A 6 -18.114 11.081 12.010 1.00 0.00 C ATOM 91 CE LYS A 6 -18.586 9.945 12.923 1.00 0.00 C ATOM 92 NZ LYS A 6 -20.056 9.840 12.953 1.00 0.00 N ATOM 0 H LYS A 6 -14.748 9.429 10.211 1.00 0.00 H new ATOM 0 HA LYS A 6 -16.738 7.950 8.665 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -18.481 9.612 9.589 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -17.856 8.544 10.831 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -16.176 10.332 11.479 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -16.883 11.401 10.283 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -17.660 11.868 12.612 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -18.972 11.522 11.504 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -18.161 9.002 12.579 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -18.213 10.112 13.933 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -20.336 9.060 13.582 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -20.461 10.731 13.306 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -20.410 9.655 11.993 1.00 0.00 H new ATOM 106 N ILE A 7 -15.255 10.713 8.234 1.00 0.00 N ATOM 107 CA ILE A 7 -14.854 11.785 7.342 1.00 0.00 C ATOM 108 C ILE A 7 -14.527 11.219 5.964 1.00 0.00 C ATOM 109 O ILE A 7 -14.799 11.882 4.968 1.00 0.00 O ATOM 110 CB ILE A 7 -13.633 12.515 7.945 1.00 0.00 C ATOM 111 CG1 ILE A 7 -12.699 11.583 8.758 1.00 0.00 C ATOM 112 CG2 ILE A 7 -14.104 13.678 8.827 1.00 0.00 C ATOM 113 CD1 ILE A 7 -11.236 12.019 8.821 1.00 0.00 C ATOM 0 H ILE A 7 -14.609 10.606 9.016 1.00 0.00 H new ATOM 0 HA ILE A 7 -15.670 12.499 7.228 1.00 0.00 H new ATOM 0 HB ILE A 7 -13.047 12.889 7.105 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -13.083 11.509 9.775 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -12.745 10.583 8.326 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -13.238 14.188 9.249 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -14.682 14.380 8.226 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -14.727 13.293 9.634 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -10.668 11.301 9.412 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -10.826 12.064 7.812 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -11.169 13.004 9.284 1.00 0.00 H new ATOM 125 N ASP A 8 -13.941 10.015 5.935 1.00 0.00 N ATOM 126 CA ASP A 8 -13.539 9.235 4.767 1.00 0.00 C ATOM 127 C ASP A 8 -12.719 10.075 3.772 1.00 0.00 C ATOM 128 O ASP A 8 -12.682 9.758 2.581 1.00 0.00 O ATOM 129 CB ASP A 8 -14.779 8.554 4.127 1.00 0.00 C ATOM 130 CG ASP A 8 -15.641 7.672 5.051 1.00 0.00 C ATOM 131 OD1 ASP A 8 -15.388 7.580 6.277 1.00 0.00 O ATOM 132 OD2 ASP A 8 -16.621 7.079 4.536 1.00 0.00 O ATOM 0 H ASP A 8 -13.720 9.525 6.802 1.00 0.00 H new ATOM 0 HA ASP A 8 -12.868 8.439 5.089 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -15.417 9.333 3.709 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -14.437 7.940 3.293 1.00 0.00 H new ATOM 137 N THR A 9 -12.061 11.143 4.223 1.00 0.00 N ATOM 138 CA THR A 9 -11.258 12.066 3.433 1.00 0.00 C ATOM 139 C THR A 9 -9.905 11.491 3.029 1.00 0.00 C ATOM 140 O THR A 9 -9.339 10.695 3.766 1.00 0.00 O ATOM 141 CB THR A 9 -11.008 13.345 4.263 1.00 0.00 C ATOM 142 OG1 THR A 9 -11.013 13.068 5.653 1.00 0.00 O ATOM 143 CG2 THR A 9 -12.143 14.325 3.994 1.00 0.00 C ATOM 0 H THR A 9 -12.078 11.399 5.210 1.00 0.00 H new ATOM 0 HA THR A 9 -11.816 12.271 2.520 1.00 0.00 H new ATOM 0 HB THR A 9 -10.037 13.750 3.978 1.00 0.00 H new ATOM 0 HG1 THR A 9 -10.102 12.859 5.948 1.00 0.00 H new ATOM 0 HG21 THR A 9 -11.983 15.235 4.572 1.00 0.00 H new ATOM 0 HG22 THR A 9 -12.168 14.570 2.932 1.00 0.00 H new ATOM 0 HG23 THR A 9 -13.091 13.872 4.285 1.00 0.00 H new ATOM 151 N PRO A 10 -9.339 11.922 1.894 1.00 0.00 N ATOM 152 CA PRO A 10 -8.039 11.458 1.447 1.00 0.00 C ATOM 153 C PRO A 10 -6.949 12.055 2.351 1.00 0.00 C ATOM 154 O PRO A 10 -6.980 13.255 2.643 1.00 0.00 O ATOM 155 CB PRO A 10 -7.926 11.985 0.009 1.00 0.00 C ATOM 156 CG PRO A 10 -8.848 13.191 -0.062 1.00 0.00 C ATOM 157 CD PRO A 10 -9.932 12.854 0.948 1.00 0.00 C ATOM 0 HA PRO A 10 -7.922 10.375 1.488 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -6.899 12.263 -0.226 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -8.223 11.223 -0.712 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -8.327 14.113 0.198 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -9.258 13.327 -1.063 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -10.282 13.753 1.456 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -10.797 12.409 0.455 1.00 0.00 H new ATOM 165 N GLN A 11 -5.976 11.238 2.769 1.00 0.00 N ATOM 166 CA GLN A 11 -4.861 11.669 3.601 1.00 0.00 C ATOM 167 C GLN A 11 -3.557 11.311 2.905 1.00 0.00 C ATOM 168 O GLN A 11 -3.324 10.134 2.640 1.00 0.00 O ATOM 169 CB GLN A 11 -4.931 11.130 5.040 1.00 0.00 C ATOM 170 CG GLN A 11 -5.441 9.695 5.280 1.00 0.00 C ATOM 171 CD GLN A 11 -6.928 9.536 5.596 1.00 0.00 C ATOM 172 OE1 GLN A 11 -7.431 8.416 5.639 1.00 0.00 O ATOM 173 NE2 GLN A 11 -7.662 10.591 5.897 1.00 0.00 N ATOM 0 H GLN A 11 -5.946 10.246 2.532 1.00 0.00 H new ATOM 0 HA GLN A 11 -4.918 12.751 3.716 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -3.930 11.198 5.465 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -5.567 11.805 5.613 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -5.217 9.102 4.393 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -4.871 9.265 6.103 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -7.252 11.524 5.864 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -8.640 10.473 6.163 1.00 0.00 H new ATOM 182 N GLN A 12 -2.707 12.297 2.604 1.00 0.00 N ATOM 183 CA GLN A 12 -1.440 12.080 1.913 1.00 0.00 C ATOM 184 C GLN A 12 -0.250 12.449 2.804 1.00 0.00 C ATOM 185 O GLN A 12 -0.283 13.487 3.472 1.00 0.00 O ATOM 186 CB GLN A 12 -1.384 12.955 0.642 1.00 0.00 C ATOM 187 CG GLN A 12 -2.546 12.710 -0.326 1.00 0.00 C ATOM 188 CD GLN A 12 -3.718 13.678 -0.171 1.00 0.00 C ATOM 189 OE1 GLN A 12 -4.672 13.404 0.548 1.00 0.00 O ATOM 190 NE2 GLN A 12 -3.693 14.802 -0.868 1.00 0.00 N ATOM 0 H GLN A 12 -2.883 13.274 2.836 1.00 0.00 H new ATOM 0 HA GLN A 12 -1.379 11.022 1.656 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -1.382 14.005 0.934 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -0.444 12.766 0.123 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -2.171 12.775 -1.347 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -2.911 11.693 -0.185 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -2.892 15.016 -1.462 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -4.475 15.455 -0.811 1.00 0.00 H new ATOM 199 N GLY A 13 0.814 11.643 2.831 1.00 0.00 N ATOM 200 CA GLY A 13 2.005 11.911 3.633 1.00 0.00 C ATOM 201 C GLY A 13 3.192 11.033 3.277 1.00 0.00 C ATOM 202 O GLY A 13 3.576 10.983 2.113 1.00 0.00 O ATOM 0 H GLY A 13 0.871 10.779 2.291 1.00 0.00 H new ATOM 0 HA2 GLY A 13 2.288 12.956 3.509 1.00 0.00 H new ATOM 0 HA3 GLY A 13 1.762 11.769 4.686 1.00 0.00 H new ATOM 206 N SER A 14 3.778 10.321 4.236 1.00 0.00 N ATOM 207 CA SER A 14 4.942 9.482 4.008 1.00 0.00 C ATOM 208 C SER A 14 5.017 8.307 4.979 1.00 0.00 C ATOM 209 O SER A 14 4.065 8.037 5.706 1.00 0.00 O ATOM 210 CB SER A 14 6.172 10.393 4.116 1.00 0.00 C ATOM 211 OG SER A 14 6.171 11.092 5.347 1.00 0.00 O ATOM 0 H SER A 14 3.451 10.313 5.202 1.00 0.00 H new ATOM 0 HA SER A 14 4.885 9.023 3.021 1.00 0.00 H new ATOM 0 HB2 SER A 14 7.081 9.797 4.031 1.00 0.00 H new ATOM 0 HB3 SER A 14 6.178 11.103 3.289 1.00 0.00 H new ATOM 0 HG SER A 14 6.964 11.666 5.398 1.00 0.00 H new ATOM 217 N ILE A 15 6.150 7.595 4.983 1.00 0.00 N ATOM 218 CA ILE A 15 6.424 6.426 5.817 1.00 0.00 C ATOM 219 C ILE A 15 7.942 6.312 6.133 1.00 0.00 C ATOM 220 O ILE A 15 8.391 5.307 6.684 1.00 0.00 O ATOM 221 CB ILE A 15 5.944 5.151 5.076 1.00 0.00 C ATOM 222 CG1 ILE A 15 4.834 5.283 4.020 1.00 0.00 C ATOM 223 CG2 ILE A 15 5.556 4.073 6.099 1.00 0.00 C ATOM 224 CD1 ILE A 15 4.532 4.011 3.217 1.00 0.00 C ATOM 0 H ILE A 15 6.935 7.832 4.376 1.00 0.00 H new ATOM 0 HA ILE A 15 5.889 6.533 6.760 1.00 0.00 H new ATOM 0 HB ILE A 15 6.814 4.881 4.478 1.00 0.00 H new ATOM 0 HG12 ILE A 15 3.919 5.603 4.518 1.00 0.00 H new ATOM 0 HG13 ILE A 15 5.111 6.074 3.323 1.00 0.00 H new ATOM 0 HG21 ILE A 15 5.219 3.179 5.575 1.00 0.00 H new ATOM 0 HG22 ILE A 15 6.421 3.828 6.716 1.00 0.00 H new ATOM 0 HG23 ILE A 15 4.752 4.446 6.734 1.00 0.00 H new ATOM 0 HD11 ILE A 15 3.735 4.213 2.501 1.00 0.00 H new ATOM 0 HD12 ILE A 15 5.429 3.697 2.683 1.00 0.00 H new ATOM 0 HD13 ILE A 15 4.217 3.218 3.896 1.00 0.00 H new ATOM 236 N GLN A 16 8.758 7.304 5.758 1.00 0.00 N ATOM 237 CA GLN A 16 10.203 7.306 5.987 1.00 0.00 C ATOM 238 C GLN A 16 10.514 7.207 7.475 1.00 0.00 C ATOM 239 O GLN A 16 11.280 6.334 7.880 1.00 0.00 O ATOM 240 CB GLN A 16 10.792 8.591 5.382 1.00 0.00 C ATOM 241 CG GLN A 16 12.225 8.965 5.826 1.00 0.00 C ATOM 242 CD GLN A 16 12.604 10.395 5.417 1.00 0.00 C ATOM 243 OE1 GLN A 16 11.755 11.281 5.377 1.00 0.00 O ATOM 244 NE2 GLN A 16 13.856 10.671 5.099 1.00 0.00 N ATOM 0 H GLN A 16 8.425 8.141 5.279 1.00 0.00 H new ATOM 0 HA GLN A 16 10.655 6.438 5.506 1.00 0.00 H new ATOM 0 HB2 GLN A 16 10.785 8.492 4.297 1.00 0.00 H new ATOM 0 HB3 GLN A 16 10.130 9.420 5.630 1.00 0.00 H new ATOM 0 HG2 GLN A 16 12.306 8.865 6.908 1.00 0.00 H new ATOM 0 HG3 GLN A 16 12.934 8.263 5.387 1.00 0.00 H new ATOM 0 HE21 GLN A 16 14.564 9.937 5.131 1.00 0.00 H new ATOM 0 HE22 GLN A 16 14.115 11.618 4.821 1.00 0.00 H new ATOM 253 N ASP A 17 9.866 8.082 8.251 1.00 0.00 N ATOM 254 CA ASP A 17 9.909 8.338 9.700 1.00 0.00 C ATOM 255 C ASP A 17 9.831 7.142 10.659 1.00 0.00 C ATOM 256 O ASP A 17 9.862 7.284 11.882 1.00 0.00 O ATOM 257 CB ASP A 17 8.786 9.333 10.006 1.00 0.00 C ATOM 258 CG ASP A 17 9.100 10.136 11.251 1.00 0.00 C ATOM 259 OD1 ASP A 17 8.354 10.013 12.246 1.00 0.00 O ATOM 260 OD2 ASP A 17 10.058 10.942 11.179 1.00 0.00 O ATOM 0 H ASP A 17 9.202 8.721 7.814 1.00 0.00 H new ATOM 0 HA ASP A 17 10.913 8.713 9.897 1.00 0.00 H new ATOM 0 HB2 ASP A 17 8.650 10.006 9.159 1.00 0.00 H new ATOM 0 HB3 ASP A 17 7.847 8.797 10.141 1.00 0.00 H new ATOM 265 N ILE A 18 9.726 5.956 10.091 1.00 0.00 N ATOM 266 CA ILE A 18 9.641 4.672 10.736 1.00 0.00 C ATOM 267 C ILE A 18 11.036 4.135 11.043 1.00 0.00 C ATOM 268 O ILE A 18 11.336 3.878 12.209 1.00 0.00 O ATOM 269 CB ILE A 18 8.763 3.794 9.832 1.00 0.00 C ATOM 270 CG1 ILE A 18 7.350 4.440 9.774 1.00 0.00 C ATOM 271 CG2 ILE A 18 8.725 2.374 10.370 1.00 0.00 C ATOM 272 CD1 ILE A 18 6.172 3.500 9.519 1.00 0.00 C ATOM 0 H ILE A 18 9.696 5.866 9.075 1.00 0.00 H new ATOM 0 HA ILE A 18 9.169 4.709 11.718 1.00 0.00 H new ATOM 0 HB ILE A 18 9.167 3.736 8.821 1.00 0.00 H new ATOM 0 HG12 ILE A 18 7.174 4.957 10.717 1.00 0.00 H new ATOM 0 HG13 ILE A 18 7.355 5.198 8.991 1.00 0.00 H new ATOM 0 HG21 ILE A 18 8.101 1.757 9.724 1.00 0.00 H new ATOM 0 HG22 ILE A 18 9.736 1.967 10.394 1.00 0.00 H new ATOM 0 HG23 ILE A 18 8.311 2.378 11.378 1.00 0.00 H new ATOM 0 HD11 ILE A 18 5.246 4.074 9.502 1.00 0.00 H new ATOM 0 HD12 ILE A 18 6.307 3.000 8.560 1.00 0.00 H new ATOM 0 HD13 ILE A 18 6.123 2.755 10.313 1.00 0.00 H new ATOM 284 N ASN A 19 11.858 3.932 10.012 1.00 0.00 N ATOM 285 CA ASN A 19 13.220 3.414 10.157 1.00 0.00 C ATOM 286 C ASN A 19 14.160 4.113 9.164 1.00 0.00 C ATOM 287 O ASN A 19 15.182 3.552 8.768 1.00 0.00 O ATOM 288 CB ASN A 19 13.198 1.879 10.014 1.00 0.00 C ATOM 289 CG ASN A 19 14.404 1.127 10.580 1.00 0.00 C ATOM 290 OD1 ASN A 19 14.407 -0.100 10.537 1.00 0.00 O ATOM 291 ND2 ASN A 19 15.428 1.745 11.139 1.00 0.00 N ATOM 0 H ASN A 19 11.595 4.124 9.045 1.00 0.00 H new ATOM 0 HA ASN A 19 13.613 3.635 11.149 1.00 0.00 H new ATOM 0 HB2 ASN A 19 12.300 1.503 10.504 1.00 0.00 H new ATOM 0 HB3 ASN A 19 13.109 1.635 8.955 1.00 0.00 H new ATOM 0 HD21 ASN A 19 16.202 1.204 11.525 1.00 0.00 H new ATOM 0 HD22 ASN A 19 15.445 2.764 11.185 1.00 0.00 H new ATOM 298 N HIS A 20 13.777 5.319 8.722 1.00 0.00 N ATOM 299 CA HIS A 20 14.474 6.214 7.785 1.00 0.00 C ATOM 300 C HIS A 20 14.451 5.730 6.321 1.00 0.00 C ATOM 301 O HIS A 20 15.167 6.241 5.464 1.00 0.00 O ATOM 302 CB HIS A 20 15.889 6.481 8.332 1.00 0.00 C ATOM 303 CG HIS A 20 16.564 7.766 7.933 1.00 0.00 C ATOM 304 ND1 HIS A 20 17.389 7.932 6.846 1.00 0.00 N ATOM 305 CD2 HIS A 20 16.636 8.907 8.688 1.00 0.00 C ATOM 306 CE1 HIS A 20 17.947 9.149 6.938 1.00 0.00 C ATOM 307 NE2 HIS A 20 17.517 9.786 8.043 1.00 0.00 N ATOM 0 H HIS A 20 12.898 5.729 9.037 1.00 0.00 H new ATOM 0 HA HIS A 20 13.932 7.158 7.731 1.00 0.00 H new ATOM 0 HB2 HIS A 20 15.838 6.453 9.420 1.00 0.00 H new ATOM 0 HB3 HIS A 20 16.530 5.656 8.022 1.00 0.00 H new ATOM 0 HD1 HIS A 20 17.548 7.252 6.103 1.00 0.00 H new ATOM 0 HD2 HIS A 20 16.110 9.095 9.612 1.00 0.00 H new ATOM 0 HE1 HIS A 20 18.645 9.561 6.224 1.00 0.00 H new ATOM 315 N ARG A 21 13.623 4.731 6.018 1.00 0.00 N ATOM 316 CA ARG A 21 13.436 4.100 4.710 1.00 0.00 C ATOM 317 C ARG A 21 12.499 4.884 3.796 1.00 0.00 C ATOM 318 O ARG A 21 11.281 4.758 3.924 1.00 0.00 O ATOM 319 CB ARG A 21 12.954 2.639 4.877 1.00 0.00 C ATOM 320 CG ARG A 21 11.992 2.358 6.056 1.00 0.00 C ATOM 321 CD ARG A 21 10.815 1.462 5.699 1.00 0.00 C ATOM 322 NE ARG A 21 9.838 2.156 4.857 1.00 0.00 N ATOM 323 CZ ARG A 21 8.529 2.248 5.096 1.00 0.00 C ATOM 324 NH1 ARG A 21 8.014 1.923 6.282 1.00 0.00 N ATOM 325 NH2 ARG A 21 7.735 2.621 4.102 1.00 0.00 N ATOM 0 H ARG A 21 13.023 4.312 6.728 1.00 0.00 H new ATOM 0 HA ARG A 21 14.409 4.099 4.219 1.00 0.00 H new ATOM 0 HB2 ARG A 21 12.460 2.336 3.954 1.00 0.00 H new ATOM 0 HB3 ARG A 21 13.831 2.002 4.993 1.00 0.00 H new ATOM 0 HG2 ARG A 21 12.554 1.895 6.867 1.00 0.00 H new ATOM 0 HG3 ARG A 21 11.611 3.307 6.434 1.00 0.00 H new ATOM 0 HD2 ARG A 21 11.178 0.575 5.179 1.00 0.00 H new ATOM 0 HD3 ARG A 21 10.329 1.119 6.613 1.00 0.00 H new ATOM 0 HE ARG A 21 10.190 2.609 4.013 1.00 0.00 H new ATOM 0 HH11 ARG A 21 8.624 1.596 7.031 1.00 0.00 H new ATOM 0 HH12 ARG A 21 7.010 2.002 6.441 1.00 0.00 H new ATOM 0 HH21 ARG A 21 8.130 2.829 3.185 1.00 0.00 H new ATOM 0 HH22 ARG A 21 6.730 2.700 4.255 1.00 0.00 H new ATOM 339 N VAL A 22 13.043 5.734 2.927 1.00 0.00 N ATOM 340 CA VAL A 22 12.256 6.514 1.973 1.00 0.00 C ATOM 341 C VAL A 22 11.937 5.533 0.839 1.00 0.00 C ATOM 342 O VAL A 22 12.604 4.508 0.710 1.00 0.00 O ATOM 343 CB VAL A 22 13.072 7.731 1.475 1.00 0.00 C ATOM 344 CG1 VAL A 22 12.385 8.528 0.357 1.00 0.00 C ATOM 345 CG2 VAL A 22 13.381 8.734 2.582 1.00 0.00 C ATOM 0 H VAL A 22 14.047 5.902 2.864 1.00 0.00 H new ATOM 0 HA VAL A 22 11.345 6.925 2.408 1.00 0.00 H new ATOM 0 HB VAL A 22 13.985 7.270 1.098 1.00 0.00 H new ATOM 0 HG11 VAL A 22 13.020 9.364 0.063 1.00 0.00 H new ATOM 0 HG12 VAL A 22 12.218 7.879 -0.503 1.00 0.00 H new ATOM 0 HG13 VAL A 22 11.428 8.908 0.716 1.00 0.00 H new ATOM 0 HG21 VAL A 22 13.955 9.564 2.171 1.00 0.00 H new ATOM 0 HG22 VAL A 22 12.449 9.110 3.003 1.00 0.00 H new ATOM 0 HG23 VAL A 22 13.961 8.245 3.365 1.00 0.00 H new ATOM 355 N TRP A 23 10.916 5.794 0.033 1.00 0.00 N ATOM 356 CA TRP A 23 10.520 4.959 -1.095 1.00 0.00 C ATOM 357 C TRP A 23 10.917 5.707 -2.369 1.00 0.00 C ATOM 358 O TRP A 23 10.765 6.922 -2.430 1.00 0.00 O ATOM 359 CB TRP A 23 9.005 4.734 -1.019 1.00 0.00 C ATOM 360 CG TRP A 23 8.513 3.649 -0.103 1.00 0.00 C ATOM 361 CD1 TRP A 23 9.250 2.876 0.733 1.00 0.00 C ATOM 362 CD2 TRP A 23 7.147 3.157 0.003 1.00 0.00 C ATOM 363 NE1 TRP A 23 8.446 1.899 1.291 1.00 0.00 N ATOM 364 CE2 TRP A 23 7.131 2.042 0.889 1.00 0.00 C ATOM 365 CE3 TRP A 23 5.927 3.521 -0.603 1.00 0.00 C ATOM 366 CZ2 TRP A 23 5.959 1.319 1.141 1.00 0.00 C ATOM 367 CZ3 TRP A 23 4.737 2.829 -0.316 1.00 0.00 C ATOM 368 CH2 TRP A 23 4.753 1.717 0.541 1.00 0.00 C ATOM 0 H TRP A 23 10.323 6.616 0.149 1.00 0.00 H new ATOM 0 HA TRP A 23 11.007 3.984 -1.085 1.00 0.00 H new ATOM 0 HB2 TRP A 23 8.540 5.671 -0.712 1.00 0.00 H new ATOM 0 HB3 TRP A 23 8.646 4.515 -2.025 1.00 0.00 H new ATOM 0 HD1 TRP A 23 10.304 3.004 0.932 1.00 0.00 H new ATOM 0 HE1 TRP A 23 8.780 1.167 1.918 1.00 0.00 H new ATOM 0 HE3 TRP A 23 5.906 4.346 -1.300 1.00 0.00 H new ATOM 0 HZ2 TRP A 23 5.982 0.459 1.794 1.00 0.00 H new ATOM 0 HZ3 TRP A 23 3.806 3.154 -0.757 1.00 0.00 H new ATOM 0 HH2 TRP A 23 3.843 1.170 0.738 1.00 0.00 H new ATOM 379 N VAL A 24 11.376 5.005 -3.403 1.00 0.00 N ATOM 380 CA VAL A 24 11.782 5.599 -4.673 1.00 0.00 C ATOM 381 C VAL A 24 11.286 4.757 -5.832 1.00 0.00 C ATOM 382 O VAL A 24 11.642 3.581 -5.933 1.00 0.00 O ATOM 383 CB VAL A 24 13.326 5.696 -4.764 1.00 0.00 C ATOM 384 CG1 VAL A 24 13.795 6.366 -6.060 1.00 0.00 C ATOM 385 CG2 VAL A 24 13.921 6.494 -3.601 1.00 0.00 C ATOM 0 H VAL A 24 11.478 3.990 -3.380 1.00 0.00 H new ATOM 0 HA VAL A 24 11.348 6.598 -4.725 1.00 0.00 H new ATOM 0 HB VAL A 24 13.674 4.663 -4.733 1.00 0.00 H new ATOM 0 HG11 VAL A 24 14.884 6.409 -6.074 1.00 0.00 H new ATOM 0 HG12 VAL A 24 13.444 5.789 -6.916 1.00 0.00 H new ATOM 0 HG13 VAL A 24 13.391 7.377 -6.114 1.00 0.00 H new ATOM 0 HG21 VAL A 24 15.005 6.536 -3.706 1.00 0.00 H new ATOM 0 HG22 VAL A 24 13.516 7.506 -3.609 1.00 0.00 H new ATOM 0 HG23 VAL A 24 13.666 6.009 -2.659 1.00 0.00 H new ATOM 395 N LEU A 25 10.452 5.338 -6.692 1.00 0.00 N ATOM 396 CA LEU A 25 9.960 4.630 -7.855 1.00 0.00 C ATOM 397 C LEU A 25 11.126 4.601 -8.850 1.00 0.00 C ATOM 398 O LEU A 25 11.579 5.656 -9.319 1.00 0.00 O ATOM 399 CB LEU A 25 8.742 5.335 -8.453 1.00 0.00 C ATOM 400 CG LEU A 25 8.079 4.607 -9.642 1.00 0.00 C ATOM 401 CD1 LEU A 25 6.760 3.961 -9.211 1.00 0.00 C ATOM 402 CD2 LEU A 25 7.759 5.615 -10.744 1.00 0.00 C ATOM 0 H LEU A 25 10.108 6.294 -6.600 1.00 0.00 H new ATOM 0 HA LEU A 25 9.631 3.623 -7.599 1.00 0.00 H new ATOM 0 HB2 LEU A 25 7.997 5.468 -7.668 1.00 0.00 H new ATOM 0 HB3 LEU A 25 9.042 6.331 -8.779 1.00 0.00 H new ATOM 0 HG LEU A 25 8.770 3.843 -9.998 1.00 0.00 H new ATOM 0 HD11 LEU A 25 6.308 3.453 -10.063 1.00 0.00 H new ATOM 0 HD12 LEU A 25 6.951 3.239 -8.417 1.00 0.00 H new ATOM 0 HD13 LEU A 25 6.080 4.731 -8.845 1.00 0.00 H new ATOM 0 HD21 LEU A 25 7.291 5.100 -11.583 1.00 0.00 H new ATOM 0 HD22 LEU A 25 7.078 6.373 -10.357 1.00 0.00 H new ATOM 0 HD23 LEU A 25 8.680 6.092 -11.079 1.00 0.00 H new ATOM 414 N GLN A 26 11.716 3.430 -9.026 1.00 0.00 N ATOM 415 CA GLN A 26 12.792 3.136 -9.951 1.00 0.00 C ATOM 416 C GLN A 26 12.077 2.591 -11.205 1.00 0.00 C ATOM 417 O GLN A 26 10.843 2.568 -11.264 1.00 0.00 O ATOM 418 CB GLN A 26 13.792 2.132 -9.326 1.00 0.00 C ATOM 419 CG GLN A 26 15.160 2.160 -10.025 1.00 0.00 C ATOM 420 CD GLN A 26 16.201 1.223 -9.424 1.00 0.00 C ATOM 421 OE1 GLN A 26 15.975 0.035 -9.215 1.00 0.00 O ATOM 422 NE2 GLN A 26 17.387 1.743 -9.155 1.00 0.00 N ATOM 0 H GLN A 26 11.436 2.608 -8.491 1.00 0.00 H new ATOM 0 HA GLN A 26 13.401 4.005 -10.200 1.00 0.00 H new ATOM 0 HB2 GLN A 26 13.922 2.363 -8.269 1.00 0.00 H new ATOM 0 HB3 GLN A 26 13.377 1.126 -9.384 1.00 0.00 H new ATOM 0 HG2 GLN A 26 15.022 1.902 -11.075 1.00 0.00 H new ATOM 0 HG3 GLN A 26 15.547 3.178 -9.995 1.00 0.00 H new ATOM 0 HE21 GLN A 26 17.563 2.732 -9.333 1.00 0.00 H new ATOM 0 HE22 GLN A 26 18.126 1.155 -8.769 1.00 0.00 H new ATOM 431 N ASP A 27 12.853 2.150 -12.192 1.00 0.00 N ATOM 432 CA ASP A 27 12.490 1.570 -13.484 1.00 0.00 C ATOM 433 C ASP A 27 11.396 0.518 -13.285 1.00 0.00 C ATOM 434 O ASP A 27 11.668 -0.659 -13.035 1.00 0.00 O ATOM 435 CB ASP A 27 13.760 0.969 -14.114 1.00 0.00 C ATOM 436 CG ASP A 27 13.869 1.166 -15.623 1.00 0.00 C ATOM 437 OD1 ASP A 27 12.836 1.164 -16.330 1.00 0.00 O ATOM 438 OD2 ASP A 27 15.036 1.318 -16.073 1.00 0.00 O ATOM 0 H ASP A 27 13.867 2.196 -12.095 1.00 0.00 H new ATOM 0 HA ASP A 27 12.091 2.328 -14.157 1.00 0.00 H new ATOM 0 HB2 ASP A 27 14.633 1.415 -13.638 1.00 0.00 H new ATOM 0 HB3 ASP A 27 13.789 -0.099 -13.896 1.00 0.00 H new ATOM 443 N GLN A 28 10.136 0.962 -13.353 1.00 0.00 N ATOM 444 CA GLN A 28 8.933 0.154 -13.167 1.00 0.00 C ATOM 445 C GLN A 28 9.071 -0.741 -11.918 1.00 0.00 C ATOM 446 O GLN A 28 8.558 -1.860 -11.897 1.00 0.00 O ATOM 447 CB GLN A 28 8.632 -0.629 -14.461 1.00 0.00 C ATOM 448 CG GLN A 28 8.422 0.320 -15.651 1.00 0.00 C ATOM 449 CD GLN A 28 8.144 -0.436 -16.945 1.00 0.00 C ATOM 450 OE1 GLN A 28 7.008 -0.804 -17.233 1.00 0.00 O ATOM 451 NE2 GLN A 28 9.156 -0.647 -17.772 1.00 0.00 N ATOM 0 H GLN A 28 9.921 1.940 -13.548 1.00 0.00 H new ATOM 0 HA GLN A 28 8.072 0.796 -12.979 1.00 0.00 H new ATOM 0 HB2 GLN A 28 9.456 -1.310 -14.677 1.00 0.00 H new ATOM 0 HB3 GLN A 28 7.741 -1.241 -14.319 1.00 0.00 H new ATOM 0 HG2 GLN A 28 7.589 0.990 -15.437 1.00 0.00 H new ATOM 0 HG3 GLN A 28 9.308 0.943 -15.778 1.00 0.00 H new ATOM 0 HE21 GLN A 28 10.094 -0.336 -17.520 1.00 0.00 H new ATOM 0 HE22 GLN A 28 8.998 -1.121 -18.661 1.00 0.00 H new ATOM 460 N THR A 29 9.775 -0.281 -10.873 1.00 0.00 N ATOM 461 CA THR A 29 9.990 -1.061 -9.655 1.00 0.00 C ATOM 462 C THR A 29 10.181 -0.085 -8.501 1.00 0.00 C ATOM 463 O THR A 29 10.890 0.895 -8.656 1.00 0.00 O ATOM 464 CB THR A 29 11.259 -1.929 -9.832 1.00 0.00 C ATOM 465 OG1 THR A 29 11.132 -2.853 -10.901 1.00 0.00 O ATOM 466 CG2 THR A 29 11.583 -2.740 -8.572 1.00 0.00 C ATOM 0 H THR A 29 10.209 0.642 -10.853 1.00 0.00 H new ATOM 0 HA THR A 29 9.141 -1.714 -9.453 1.00 0.00 H new ATOM 0 HB THR A 29 12.059 -1.219 -10.041 1.00 0.00 H new ATOM 0 HG1 THR A 29 11.264 -2.387 -11.753 1.00 0.00 H new ATOM 0 HG21 THR A 29 12.481 -3.334 -8.742 1.00 0.00 H new ATOM 0 HG22 THR A 29 11.750 -2.061 -7.735 1.00 0.00 H new ATOM 0 HG23 THR A 29 10.749 -3.402 -8.341 1.00 0.00 H new ATOM 474 N LEU A 30 9.557 -0.301 -7.346 1.00 0.00 N ATOM 475 CA LEU A 30 9.707 0.587 -6.193 1.00 0.00 C ATOM 476 C LEU A 30 10.773 0.008 -5.280 1.00 0.00 C ATOM 477 O LEU A 30 10.765 -1.204 -5.025 1.00 0.00 O ATOM 478 CB LEU A 30 8.370 0.746 -5.457 1.00 0.00 C ATOM 479 CG LEU A 30 7.829 2.167 -5.654 1.00 0.00 C ATOM 480 CD1 LEU A 30 6.381 2.303 -5.237 1.00 0.00 C ATOM 481 CD2 LEU A 30 8.578 3.162 -4.759 1.00 0.00 C ATOM 0 H LEU A 30 8.935 -1.093 -7.182 1.00 0.00 H new ATOM 0 HA LEU A 30 10.012 1.580 -6.522 1.00 0.00 H new ATOM 0 HB2 LEU A 30 7.650 0.019 -5.832 1.00 0.00 H new ATOM 0 HB3 LEU A 30 8.504 0.543 -4.394 1.00 0.00 H new ATOM 0 HG LEU A 30 7.954 2.370 -6.718 1.00 0.00 H new ATOM 0 HD11 LEU A 30 6.051 3.329 -5.398 1.00 0.00 H new ATOM 0 HD12 LEU A 30 5.766 1.627 -5.831 1.00 0.00 H new ATOM 0 HD13 LEU A 30 6.281 2.051 -4.181 1.00 0.00 H new ATOM 0 HD21 LEU A 30 8.178 4.164 -4.915 1.00 0.00 H new ATOM 0 HD22 LEU A 30 8.451 2.879 -3.714 1.00 0.00 H new ATOM 0 HD23 LEU A 30 9.638 3.151 -5.011 1.00 0.00 H new ATOM 493 N ILE A 31 11.646 0.865 -4.755 1.00 0.00 N ATOM 494 CA ILE A 31 12.738 0.472 -3.872 1.00 0.00 C ATOM 495 C ILE A 31 12.872 1.423 -2.686 1.00 0.00 C ATOM 496 O ILE A 31 12.582 2.611 -2.801 1.00 0.00 O ATOM 497 CB ILE A 31 14.059 0.394 -4.671 1.00 0.00 C ATOM 498 CG1 ILE A 31 14.384 1.727 -5.375 1.00 0.00 C ATOM 499 CG2 ILE A 31 14.035 -0.790 -5.660 1.00 0.00 C ATOM 500 CD1 ILE A 31 15.751 1.741 -6.049 1.00 0.00 C ATOM 0 H ILE A 31 11.612 1.868 -4.935 1.00 0.00 H new ATOM 0 HA ILE A 31 12.511 -0.514 -3.468 1.00 0.00 H new ATOM 0 HB ILE A 31 14.866 0.214 -3.961 1.00 0.00 H new ATOM 0 HG12 ILE A 31 13.617 1.930 -6.122 1.00 0.00 H new ATOM 0 HG13 ILE A 31 14.340 2.535 -4.645 1.00 0.00 H new ATOM 0 HG21 ILE A 31 14.975 -0.824 -6.210 1.00 0.00 H new ATOM 0 HG22 ILE A 31 13.903 -1.721 -5.109 1.00 0.00 H new ATOM 0 HG23 ILE A 31 13.209 -0.663 -6.360 1.00 0.00 H new ATOM 0 HD11 ILE A 31 15.913 2.709 -6.524 1.00 0.00 H new ATOM 0 HD12 ILE A 31 16.526 1.569 -5.303 1.00 0.00 H new ATOM 0 HD13 ILE A 31 15.793 0.955 -6.803 1.00 0.00 H new ATOM 512 N ALA A 32 13.372 0.904 -1.565 1.00 0.00 N ATOM 513 CA ALA A 32 13.573 1.672 -0.345 1.00 0.00 C ATOM 514 C ALA A 32 15.002 2.186 -0.277 1.00 0.00 C ATOM 515 O ALA A 32 15.946 1.462 -0.609 1.00 0.00 O ATOM 516 CB ALA A 32 13.283 0.782 0.857 1.00 0.00 C ATOM 0 H ALA A 32 13.651 -0.074 -1.482 1.00 0.00 H new ATOM 0 HA ALA A 32 12.897 2.527 -0.340 1.00 0.00 H new ATOM 0 HB1 ALA A 32 13.432 1.351 1.775 1.00 0.00 H new ATOM 0 HB2 ALA A 32 12.252 0.432 0.810 1.00 0.00 H new ATOM 0 HB3 ALA A 32 13.958 -0.074 0.847 1.00 0.00 H new ATOM 522 N VAL A 33 15.170 3.425 0.172 1.00 0.00 N ATOM 523 CA VAL A 33 16.469 4.064 0.326 1.00 0.00 C ATOM 524 C VAL A 33 16.599 4.522 1.790 1.00 0.00 C ATOM 525 O VAL A 33 15.901 5.452 2.186 1.00 0.00 O ATOM 526 CB VAL A 33 16.716 5.170 -0.724 1.00 0.00 C ATOM 527 CG1 VAL A 33 16.783 4.598 -2.147 1.00 0.00 C ATOM 528 CG2 VAL A 33 15.707 6.316 -0.697 1.00 0.00 C ATOM 0 H VAL A 33 14.391 4.024 0.444 1.00 0.00 H new ATOM 0 HA VAL A 33 17.270 3.354 0.121 1.00 0.00 H new ATOM 0 HB VAL A 33 17.681 5.590 -0.439 1.00 0.00 H new ATOM 0 HG11 VAL A 33 16.958 5.407 -2.856 1.00 0.00 H new ATOM 0 HG12 VAL A 33 17.598 3.877 -2.211 1.00 0.00 H new ATOM 0 HG13 VAL A 33 15.841 4.104 -2.385 1.00 0.00 H new ATOM 0 HG21 VAL A 33 15.961 7.043 -1.468 1.00 0.00 H new ATOM 0 HG22 VAL A 33 14.707 5.925 -0.883 1.00 0.00 H new ATOM 0 HG23 VAL A 33 15.732 6.800 0.280 1.00 0.00 H new ATOM 538 N PRO A 34 17.448 3.882 2.619 1.00 0.00 N ATOM 539 CA PRO A 34 17.620 4.278 4.014 1.00 0.00 C ATOM 540 C PRO A 34 18.366 5.622 4.115 1.00 0.00 C ATOM 541 O PRO A 34 17.767 6.684 4.254 1.00 0.00 O ATOM 542 CB PRO A 34 18.358 3.102 4.666 1.00 0.00 C ATOM 543 CG PRO A 34 19.150 2.457 3.522 1.00 0.00 C ATOM 544 CD PRO A 34 18.302 2.749 2.281 1.00 0.00 C ATOM 0 HA PRO A 34 16.678 4.462 4.530 1.00 0.00 H new ATOM 0 HB2 PRO A 34 19.019 3.442 5.463 1.00 0.00 H new ATOM 0 HB3 PRO A 34 17.659 2.394 5.112 1.00 0.00 H new ATOM 0 HG2 PRO A 34 20.148 2.886 3.435 1.00 0.00 H new ATOM 0 HG3 PRO A 34 19.276 1.386 3.677 1.00 0.00 H new ATOM 0 HD2 PRO A 34 18.935 2.982 1.425 1.00 0.00 H new ATOM 0 HD3 PRO A 34 17.703 1.880 2.007 1.00 0.00 H new ATOM 552 N ARG A 35 19.696 5.590 4.006 1.00 0.00 N ATOM 553 CA ARG A 35 20.587 6.751 4.082 1.00 0.00 C ATOM 554 C ARG A 35 21.299 7.030 2.755 1.00 0.00 C ATOM 555 O ARG A 35 22.193 7.874 2.722 1.00 0.00 O ATOM 556 CB ARG A 35 21.566 6.577 5.260 1.00 0.00 C ATOM 557 CG ARG A 35 22.461 5.329 5.185 1.00 0.00 C ATOM 558 CD ARG A 35 22.066 4.279 6.226 1.00 0.00 C ATOM 559 NE ARG A 35 22.734 2.996 5.958 1.00 0.00 N ATOM 560 CZ ARG A 35 23.007 2.052 6.864 1.00 0.00 C ATOM 561 NH1 ARG A 35 22.703 2.231 8.143 1.00 0.00 N ATOM 562 NH2 ARG A 35 23.587 0.922 6.483 1.00 0.00 N ATOM 0 H ARG A 35 20.203 4.718 3.856 1.00 0.00 H new ATOM 0 HA ARG A 35 19.983 7.638 4.271 1.00 0.00 H new ATOM 0 HB2 ARG A 35 22.203 7.459 5.316 1.00 0.00 H new ATOM 0 HB3 ARG A 35 20.993 6.539 6.186 1.00 0.00 H new ATOM 0 HG2 ARG A 35 22.394 4.894 4.188 1.00 0.00 H new ATOM 0 HG3 ARG A 35 23.501 5.618 5.338 1.00 0.00 H new ATOM 0 HD2 ARG A 35 22.333 4.631 7.223 1.00 0.00 H new ATOM 0 HD3 ARG A 35 20.985 4.140 6.216 1.00 0.00 H new ATOM 0 HE ARG A 35 23.014 2.810 4.995 1.00 0.00 H new ATOM 0 HH11 ARG A 35 22.256 3.097 8.445 1.00 0.00 H new ATOM 0 HH12 ARG A 35 22.917 1.503 8.825 1.00 0.00 H new ATOM 0 HH21 ARG A 35 23.823 0.776 5.502 1.00 0.00 H new ATOM 0 HH22 ARG A 35 23.797 0.199 7.171 1.00 0.00 H new ATOM 576 N LYS A 36 20.939 6.305 1.684 1.00 0.00 N ATOM 577 CA LYS A 36 21.525 6.449 0.351 1.00 0.00 C ATOM 578 C LYS A 36 21.452 7.918 -0.022 1.00 0.00 C ATOM 579 O LYS A 36 20.357 8.462 -0.110 1.00 0.00 O ATOM 580 CB LYS A 36 20.786 5.564 -0.667 1.00 0.00 C ATOM 581 CG LYS A 36 21.635 5.292 -1.916 1.00 0.00 C ATOM 582 CD LYS A 36 21.099 4.082 -2.698 1.00 0.00 C ATOM 583 CE LYS A 36 21.570 2.760 -2.067 1.00 0.00 C ATOM 584 NZ LYS A 36 21.048 1.573 -2.774 1.00 0.00 N ATOM 0 H LYS A 36 20.216 5.587 1.727 1.00 0.00 H new ATOM 0 HA LYS A 36 22.564 6.120 0.347 1.00 0.00 H new ATOM 0 HB2 LYS A 36 20.518 4.617 -0.197 1.00 0.00 H new ATOM 0 HB3 LYS A 36 19.855 6.049 -0.960 1.00 0.00 H new ATOM 0 HG2 LYS A 36 21.635 6.173 -2.558 1.00 0.00 H new ATOM 0 HG3 LYS A 36 22.669 5.111 -1.624 1.00 0.00 H new ATOM 0 HD2 LYS A 36 20.010 4.111 -2.717 1.00 0.00 H new ATOM 0 HD3 LYS A 36 21.437 4.135 -3.733 1.00 0.00 H new ATOM 0 HE2 LYS A 36 22.660 2.729 -2.069 1.00 0.00 H new ATOM 0 HE3 LYS A 36 21.252 2.726 -1.025 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 21.396 0.711 -2.308 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 20.008 1.584 -2.750 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 21.372 1.587 -3.762 1.00 0.00 H new ATOM 598 N ASP A 37 22.601 8.530 -0.272 1.00 0.00 N ATOM 599 CA ASP A 37 22.717 9.944 -0.616 1.00 0.00 C ATOM 600 C ASP A 37 21.917 10.285 -1.867 1.00 0.00 C ATOM 601 O ASP A 37 21.421 11.401 -1.998 1.00 0.00 O ATOM 602 CB ASP A 37 24.196 10.318 -0.784 1.00 0.00 C ATOM 603 CG ASP A 37 24.975 9.931 0.470 1.00 0.00 C ATOM 604 OD1 ASP A 37 24.824 10.594 1.522 1.00 0.00 O ATOM 605 OD2 ASP A 37 25.606 8.850 0.437 1.00 0.00 O ATOM 0 H ASP A 37 23.500 8.048 -0.241 1.00 0.00 H new ATOM 0 HA ASP A 37 22.296 10.532 0.199 1.00 0.00 H new ATOM 0 HB2 ASP A 37 24.612 9.809 -1.653 1.00 0.00 H new ATOM 0 HB3 ASP A 37 24.291 11.388 -0.966 1.00 0.00 H new ATOM 610 N ARG A 38 21.781 9.339 -2.800 1.00 0.00 N ATOM 611 CA ARG A 38 21.025 9.546 -4.023 1.00 0.00 C ATOM 612 C ARG A 38 19.586 9.117 -3.774 1.00 0.00 C ATOM 613 O ARG A 38 19.148 8.088 -4.289 1.00 0.00 O ATOM 614 CB ARG A 38 21.702 8.851 -5.218 1.00 0.00 C ATOM 615 CG ARG A 38 21.176 9.398 -6.561 1.00 0.00 C ATOM 616 CD ARG A 38 20.616 8.329 -7.511 1.00 0.00 C ATOM 617 NE ARG A 38 21.317 8.343 -8.801 1.00 0.00 N ATOM 618 CZ ARG A 38 20.871 7.848 -9.958 1.00 0.00 C ATOM 619 NH1 ARG A 38 19.654 7.323 -10.065 1.00 0.00 N ATOM 620 NH2 ARG A 38 21.678 7.885 -11.008 1.00 0.00 N ATOM 0 H ARG A 38 22.195 8.410 -2.722 1.00 0.00 H new ATOM 0 HA ARG A 38 21.007 10.600 -4.299 1.00 0.00 H new ATOM 0 HB2 ARG A 38 22.781 8.997 -5.162 1.00 0.00 H new ATOM 0 HB3 ARG A 38 21.522 7.777 -5.166 1.00 0.00 H new ATOM 0 HG2 ARG A 38 20.395 10.131 -6.359 1.00 0.00 H new ATOM 0 HG3 ARG A 38 21.985 9.926 -7.065 1.00 0.00 H new ATOM 0 HD2 ARG A 38 20.713 7.345 -7.052 1.00 0.00 H new ATOM 0 HD3 ARG A 38 19.552 8.503 -7.671 1.00 0.00 H new ATOM 0 HE ARG A 38 22.241 8.776 -8.815 1.00 0.00 H new ATOM 0 HH11 ARG A 38 19.039 7.292 -9.252 1.00 0.00 H new ATOM 0 HH12 ARG A 38 19.336 6.951 -10.960 1.00 0.00 H new ATOM 0 HH21 ARG A 38 22.612 8.284 -10.919 1.00 0.00 H new ATOM 0 HH22 ARG A 38 21.365 7.514 -11.905 1.00 0.00 H new ATOM 634 N MET A 39 18.878 9.855 -2.930 1.00 0.00 N ATOM 635 CA MET A 39 17.487 9.608 -2.582 1.00 0.00 C ATOM 636 C MET A 39 16.653 10.808 -3.004 1.00 0.00 C ATOM 637 O MET A 39 17.189 11.885 -3.281 1.00 0.00 O ATOM 638 CB MET A 39 17.338 9.291 -1.089 1.00 0.00 C ATOM 639 CG MET A 39 17.859 10.388 -0.162 1.00 0.00 C ATOM 640 SD MET A 39 17.559 10.008 1.584 1.00 0.00 S ATOM 641 CE MET A 39 19.106 10.596 2.331 1.00 0.00 C ATOM 0 H MET A 39 19.269 10.668 -2.454 1.00 0.00 H new ATOM 0 HA MET A 39 17.124 8.730 -3.116 1.00 0.00 H new ATOM 0 HB2 MET A 39 16.285 9.115 -0.870 1.00 0.00 H new ATOM 0 HB3 MET A 39 17.868 8.364 -0.871 1.00 0.00 H new ATOM 0 HG2 MET A 39 18.929 10.521 -0.325 1.00 0.00 H new ATOM 0 HG3 MET A 39 17.378 11.333 -0.414 1.00 0.00 H new ATOM 0 HE1 MET A 39 19.076 10.431 3.408 1.00 0.00 H new ATOM 0 HE2 MET A 39 19.947 10.050 1.904 1.00 0.00 H new ATOM 0 HE3 MET A 39 19.225 11.661 2.130 1.00 0.00 H new ATOM 651 N SER A 40 15.337 10.622 -3.052 1.00 0.00 N ATOM 652 CA SER A 40 14.397 11.653 -3.433 1.00 0.00 C ATOM 653 C SER A 40 13.163 11.510 -2.541 1.00 0.00 C ATOM 654 O SER A 40 12.719 10.378 -2.338 1.00 0.00 O ATOM 655 CB SER A 40 14.046 11.476 -4.910 1.00 0.00 C ATOM 656 OG SER A 40 13.627 12.707 -5.453 1.00 0.00 O ATOM 0 H SER A 40 14.894 9.733 -2.822 1.00 0.00 H new ATOM 0 HA SER A 40 14.815 12.651 -3.303 1.00 0.00 H new ATOM 0 HB2 SER A 40 14.912 11.103 -5.457 1.00 0.00 H new ATOM 0 HB3 SER A 40 13.256 10.733 -5.019 1.00 0.00 H new ATOM 0 HG SER A 40 13.405 12.588 -6.400 1.00 0.00 H new ATOM 662 N PRO A 41 12.620 12.608 -1.998 1.00 0.00 N ATOM 663 CA PRO A 41 11.450 12.583 -1.134 1.00 0.00 C ATOM 664 C PRO A 41 10.203 12.266 -1.967 1.00 0.00 C ATOM 665 O PRO A 41 9.989 12.851 -3.033 1.00 0.00 O ATOM 666 CB PRO A 41 11.384 13.996 -0.538 1.00 0.00 C ATOM 667 CG PRO A 41 12.011 14.873 -1.621 1.00 0.00 C ATOM 668 CD PRO A 41 13.095 13.969 -2.189 1.00 0.00 C ATOM 0 HA PRO A 41 11.504 11.823 -0.355 1.00 0.00 H new ATOM 0 HB2 PRO A 41 10.357 14.294 -0.326 1.00 0.00 H new ATOM 0 HB3 PRO A 41 11.935 14.062 0.400 1.00 0.00 H new ATOM 0 HG2 PRO A 41 11.284 15.162 -2.380 1.00 0.00 H new ATOM 0 HG3 PRO A 41 12.425 15.793 -1.209 1.00 0.00 H new ATOM 0 HD2 PRO A 41 13.265 14.179 -3.245 1.00 0.00 H new ATOM 0 HD3 PRO A 41 14.044 14.127 -1.676 1.00 0.00 H new ATOM 676 N VAL A 42 9.357 11.368 -1.477 1.00 0.00 N ATOM 677 CA VAL A 42 8.119 10.961 -2.132 1.00 0.00 C ATOM 678 C VAL A 42 6.993 11.083 -1.139 1.00 0.00 C ATOM 679 O VAL A 42 7.180 11.104 0.086 1.00 0.00 O ATOM 680 CB VAL A 42 8.196 9.569 -2.781 1.00 0.00 C ATOM 681 CG1 VAL A 42 9.389 9.491 -3.736 1.00 0.00 C ATOM 682 CG2 VAL A 42 8.212 8.416 -1.769 1.00 0.00 C ATOM 0 H VAL A 42 9.517 10.890 -0.590 1.00 0.00 H new ATOM 0 HA VAL A 42 7.934 11.629 -2.973 1.00 0.00 H new ATOM 0 HB VAL A 42 7.275 9.441 -3.350 1.00 0.00 H new ATOM 0 HG11 VAL A 42 9.430 8.500 -4.187 1.00 0.00 H new ATOM 0 HG12 VAL A 42 9.278 10.242 -4.519 1.00 0.00 H new ATOM 0 HG13 VAL A 42 10.310 9.676 -3.183 1.00 0.00 H new ATOM 0 HG21 VAL A 42 8.267 7.466 -2.301 1.00 0.00 H new ATOM 0 HG22 VAL A 42 9.079 8.517 -1.116 1.00 0.00 H new ATOM 0 HG23 VAL A 42 7.301 8.444 -1.171 1.00 0.00 H new ATOM 692 N THR A 43 5.808 11.154 -1.707 1.00 0.00 N ATOM 693 CA THR A 43 4.595 11.278 -0.946 1.00 0.00 C ATOM 694 C THR A 43 3.768 10.031 -1.193 1.00 0.00 C ATOM 695 O THR A 43 3.911 9.363 -2.217 1.00 0.00 O ATOM 696 CB THR A 43 3.836 12.564 -1.310 1.00 0.00 C ATOM 697 OG1 THR A 43 4.353 13.283 -2.426 1.00 0.00 O ATOM 698 CG2 THR A 43 3.745 13.539 -0.141 1.00 0.00 C ATOM 0 H THR A 43 5.664 11.127 -2.716 1.00 0.00 H new ATOM 0 HA THR A 43 4.818 11.360 0.118 1.00 0.00 H new ATOM 0 HB THR A 43 2.851 12.184 -1.582 1.00 0.00 H new ATOM 0 HG1 THR A 43 3.800 13.104 -3.215 1.00 0.00 H new ATOM 0 HG21 THR A 43 3.199 14.430 -0.452 1.00 0.00 H new ATOM 0 HG22 THR A 43 3.222 13.064 0.689 1.00 0.00 H new ATOM 0 HG23 THR A 43 4.749 13.821 0.177 1.00 0.00 H new ATOM 706 N ILE A 44 2.865 9.759 -0.268 1.00 0.00 N ATOM 707 CA ILE A 44 1.942 8.643 -0.265 1.00 0.00 C ATOM 708 C ILE A 44 0.558 9.267 -0.155 1.00 0.00 C ATOM 709 O ILE A 44 0.442 10.346 0.415 1.00 0.00 O ATOM 710 CB ILE A 44 2.255 7.756 0.955 1.00 0.00 C ATOM 711 CG1 ILE A 44 3.736 7.347 1.034 1.00 0.00 C ATOM 712 CG2 ILE A 44 1.383 6.498 1.022 1.00 0.00 C ATOM 713 CD1 ILE A 44 4.281 6.459 -0.079 1.00 0.00 C ATOM 0 H ILE A 44 2.751 10.352 0.554 1.00 0.00 H new ATOM 0 HA ILE A 44 2.013 8.018 -1.155 1.00 0.00 H new ATOM 0 HB ILE A 44 2.021 8.386 1.813 1.00 0.00 H new ATOM 0 HG12 ILE A 44 4.335 8.257 1.062 1.00 0.00 H new ATOM 0 HG13 ILE A 44 3.893 6.833 1.982 1.00 0.00 H new ATOM 0 HG21 ILE A 44 1.652 5.915 1.903 1.00 0.00 H new ATOM 0 HG22 ILE A 44 0.333 6.786 1.084 1.00 0.00 H new ATOM 0 HG23 ILE A 44 1.543 5.897 0.127 1.00 0.00 H new ATOM 0 HD11 ILE A 44 5.335 6.251 0.105 1.00 0.00 H new ATOM 0 HD12 ILE A 44 3.724 5.522 -0.102 1.00 0.00 H new ATOM 0 HD13 ILE A 44 4.174 6.969 -1.037 1.00 0.00 H new ATOM 725 N ALA A 45 -0.484 8.618 -0.649 1.00 0.00 N ATOM 726 CA ALA A 45 -1.857 9.082 -0.603 1.00 0.00 C ATOM 727 C ALA A 45 -2.709 7.883 -0.219 1.00 0.00 C ATOM 728 O ALA A 45 -2.593 6.844 -0.864 1.00 0.00 O ATOM 729 CB ALA A 45 -2.208 9.702 -1.952 1.00 0.00 C ATOM 0 H ALA A 45 -0.389 7.714 -1.113 1.00 0.00 H new ATOM 0 HA ALA A 45 -2.031 9.864 0.136 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -3.239 10.056 -1.933 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -1.540 10.540 -2.152 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -2.096 8.954 -2.737 1.00 0.00 H new ATOM 735 N LEU A 46 -3.514 8.001 0.840 1.00 0.00 N ATOM 736 CA LEU A 46 -4.370 6.936 1.355 1.00 0.00 C ATOM 737 C LEU A 46 -5.819 7.398 1.396 1.00 0.00 C ATOM 738 O LEU A 46 -6.073 8.557 1.736 1.00 0.00 O ATOM 739 CB LEU A 46 -3.898 6.597 2.783 1.00 0.00 C ATOM 740 CG LEU A 46 -4.691 5.445 3.434 1.00 0.00 C ATOM 741 CD1 LEU A 46 -3.776 4.537 4.266 1.00 0.00 C ATOM 742 CD2 LEU A 46 -5.792 5.970 4.359 1.00 0.00 C ATOM 0 H LEU A 46 -3.588 8.866 1.376 1.00 0.00 H new ATOM 0 HA LEU A 46 -4.305 6.061 0.709 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -2.842 6.330 2.755 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -3.985 7.486 3.407 1.00 0.00 H new ATOM 0 HG LEU A 46 -5.134 4.881 2.613 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -4.366 3.736 4.711 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -3.007 4.108 3.623 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -3.304 5.122 5.056 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -6.329 5.130 4.799 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -5.346 6.571 5.152 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -6.487 6.584 3.786 1.00 0.00 H new ATOM 754 N ILE A 47 -6.744 6.498 1.060 1.00 0.00 N ATOM 755 CA ILE A 47 -8.193 6.708 1.050 1.00 0.00 C ATOM 756 C ILE A 47 -8.876 5.367 1.354 1.00 0.00 C ATOM 757 O ILE A 47 -8.321 4.295 1.087 1.00 0.00 O ATOM 758 CB ILE A 47 -8.686 7.362 -0.288 1.00 0.00 C ATOM 759 CG1 ILE A 47 -7.707 8.354 -0.949 1.00 0.00 C ATOM 760 CG2 ILE A 47 -10.019 8.104 -0.051 1.00 0.00 C ATOM 761 CD1 ILE A 47 -8.227 8.991 -2.241 1.00 0.00 C ATOM 0 H ILE A 47 -6.490 5.553 0.772 1.00 0.00 H new ATOM 0 HA ILE A 47 -8.468 7.424 1.824 1.00 0.00 H new ATOM 0 HB ILE A 47 -8.788 6.522 -0.975 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -7.474 9.145 -0.236 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -6.773 7.835 -1.165 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -10.355 8.556 -0.984 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -10.771 7.398 0.302 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -9.874 8.883 0.697 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -7.476 9.674 -2.638 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -8.432 8.211 -2.974 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -9.144 9.542 -2.032 1.00 0.00 H new ATOM 773 N SER A 48 -10.079 5.425 1.926 1.00 0.00 N ATOM 774 CA SER A 48 -10.904 4.285 2.278 1.00 0.00 C ATOM 775 C SER A 48 -12.037 4.134 1.243 1.00 0.00 C ATOM 776 O SER A 48 -12.666 5.110 0.816 1.00 0.00 O ATOM 777 CB SER A 48 -11.345 4.404 3.735 1.00 0.00 C ATOM 778 OG SER A 48 -11.647 5.696 4.218 1.00 0.00 O ATOM 0 H SER A 48 -10.519 6.314 2.165 1.00 0.00 H new ATOM 0 HA SER A 48 -10.348 3.349 2.229 1.00 0.00 H new ATOM 0 HB2 SER A 48 -12.227 3.778 3.872 1.00 0.00 H new ATOM 0 HB3 SER A 48 -10.557 3.986 4.361 1.00 0.00 H new ATOM 0 HG SER A 48 -11.917 5.639 5.158 1.00 0.00 H new ATOM 784 N CYS A 49 -12.247 2.889 0.797 1.00 0.00 N ATOM 785 CA CYS A 49 -13.215 2.496 -0.219 1.00 0.00 C ATOM 786 C CYS A 49 -14.644 2.941 0.076 1.00 0.00 C ATOM 787 O CYS A 49 -15.304 2.411 0.966 1.00 0.00 O ATOM 788 CB CYS A 49 -13.168 0.977 -0.422 1.00 0.00 C ATOM 789 SG CYS A 49 -11.555 0.435 -1.043 1.00 0.00 S ATOM 0 H CYS A 49 -11.718 2.094 1.156 1.00 0.00 H new ATOM 0 HA CYS A 49 -12.923 3.014 -1.133 1.00 0.00 H new ATOM 0 HB2 CYS A 49 -13.381 0.477 0.523 1.00 0.00 H new ATOM 0 HB3 CYS A 49 -13.947 0.679 -1.124 1.00 0.00 H new ATOM 0 HG CYS A 49 -11.675 0.039 -2.276 1.00 0.00 H new ATOM 795 N ARG A 50 -15.143 3.909 -0.691 1.00 0.00 N ATOM 796 CA ARG A 50 -16.512 4.379 -0.503 1.00 0.00 C ATOM 797 C ARG A 50 -17.522 3.388 -1.074 1.00 0.00 C ATOM 798 O ARG A 50 -18.668 3.419 -0.632 1.00 0.00 O ATOM 799 CB ARG A 50 -16.731 5.748 -1.169 1.00 0.00 C ATOM 800 CG ARG A 50 -16.527 5.751 -2.696 1.00 0.00 C ATOM 801 CD ARG A 50 -16.803 7.112 -3.332 1.00 0.00 C ATOM 802 NE ARG A 50 -15.697 8.068 -3.134 1.00 0.00 N ATOM 803 CZ ARG A 50 -15.555 9.194 -3.845 1.00 0.00 C ATOM 804 NH1 ARG A 50 -16.485 9.553 -4.721 1.00 0.00 N ATOM 805 NH2 ARG A 50 -14.499 9.976 -3.644 1.00 0.00 N ATOM 0 H ARG A 50 -14.628 4.376 -1.437 1.00 0.00 H new ATOM 0 HA ARG A 50 -16.665 4.473 0.572 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -17.743 6.088 -0.949 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -16.048 6.470 -0.722 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -15.503 5.452 -2.921 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -17.183 5.006 -3.146 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -16.977 6.981 -4.400 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -17.717 7.528 -2.908 1.00 0.00 H new ATOM 0 HE ARG A 50 -15.003 7.860 -2.416 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -17.312 8.971 -4.855 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -16.373 10.411 -5.261 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -13.798 9.718 -2.949 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -14.389 10.834 -4.185 1.00 0.00 H new ATOM 819 N HIS A 51 -17.153 2.552 -2.054 1.00 0.00 N ATOM 820 CA HIS A 51 -18.043 1.586 -2.695 1.00 0.00 C ATOM 821 C HIS A 51 -17.855 0.202 -2.081 1.00 0.00 C ATOM 822 O HIS A 51 -17.645 -0.798 -2.769 1.00 0.00 O ATOM 823 CB HIS A 51 -17.854 1.595 -4.225 1.00 0.00 C ATOM 824 CG HIS A 51 -19.014 0.930 -4.949 1.00 0.00 C ATOM 825 ND1 HIS A 51 -18.909 -0.123 -5.830 1.00 0.00 N ATOM 826 CD2 HIS A 51 -20.355 1.201 -4.802 1.00 0.00 C ATOM 827 CE1 HIS A 51 -20.146 -0.470 -6.220 1.00 0.00 C ATOM 828 NE2 HIS A 51 -21.060 0.291 -5.602 1.00 0.00 N ATOM 0 H HIS A 51 -16.205 2.532 -2.429 1.00 0.00 H new ATOM 0 HA HIS A 51 -19.077 1.877 -2.512 1.00 0.00 H new ATOM 0 HB2 HIS A 51 -17.753 2.624 -4.571 1.00 0.00 H new ATOM 0 HB3 HIS A 51 -16.927 1.081 -4.478 1.00 0.00 H new ATOM 0 HD2 HIS A 51 -20.786 1.974 -4.183 1.00 0.00 H new ATOM 0 HE1 HIS A 51 -20.372 -1.251 -6.931 1.00 0.00 H new ATOM 0 HE2 HIS A 51 -22.073 0.221 -5.696 1.00 0.00 H new ATOM 836 N VAL A 52 -17.888 0.128 -0.754 1.00 0.00 N ATOM 837 CA VAL A 52 -17.737 -1.157 -0.074 1.00 0.00 C ATOM 838 C VAL A 52 -18.993 -2.028 -0.200 1.00 0.00 C ATOM 839 O VAL A 52 -18.960 -3.172 0.237 1.00 0.00 O ATOM 840 CB VAL A 52 -17.280 -1.007 1.385 1.00 0.00 C ATOM 841 CG1 VAL A 52 -15.764 -0.804 1.412 1.00 0.00 C ATOM 842 CG2 VAL A 52 -17.998 0.128 2.120 1.00 0.00 C ATOM 0 H VAL A 52 -18.016 0.928 -0.135 1.00 0.00 H new ATOM 0 HA VAL A 52 -16.934 -1.682 -0.591 1.00 0.00 H new ATOM 0 HB VAL A 52 -17.544 -1.921 1.917 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -15.430 -0.696 2.444 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -15.273 -1.666 0.960 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -15.507 0.095 0.852 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -17.634 0.185 3.146 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -17.801 1.072 1.612 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -19.071 -0.064 2.126 1.00 0.00 H new ATOM 852 N GLU A 53 -20.060 -1.549 -0.847 1.00 0.00 N ATOM 853 CA GLU A 53 -21.329 -2.246 -1.073 1.00 0.00 C ATOM 854 C GLU A 53 -21.170 -3.516 -1.940 1.00 0.00 C ATOM 855 O GLU A 53 -22.144 -4.209 -2.238 1.00 0.00 O ATOM 856 CB GLU A 53 -22.271 -1.220 -1.730 1.00 0.00 C ATOM 857 CG GLU A 53 -23.722 -1.675 -1.938 1.00 0.00 C ATOM 858 CD GLU A 53 -24.664 -0.475 -2.050 1.00 0.00 C ATOM 859 OE1 GLU A 53 -24.765 0.155 -3.124 1.00 0.00 O ATOM 860 OE2 GLU A 53 -25.263 -0.102 -1.018 1.00 0.00 O ATOM 0 H GLU A 53 -20.061 -0.612 -1.249 1.00 0.00 H new ATOM 0 HA GLU A 53 -21.734 -2.609 -0.128 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -22.278 -0.319 -1.117 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -21.855 -0.943 -2.699 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -23.791 -2.281 -2.842 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -24.031 -2.308 -1.106 1.00 0.00 H new ATOM 867 N THR A 54 -19.950 -3.814 -2.384 1.00 0.00 N ATOM 868 CA THR A 54 -19.599 -4.962 -3.201 1.00 0.00 C ATOM 869 C THR A 54 -18.354 -5.672 -2.644 1.00 0.00 C ATOM 870 O THR A 54 -17.887 -6.650 -3.232 1.00 0.00 O ATOM 871 CB THR A 54 -19.516 -4.464 -4.659 1.00 0.00 C ATOM 872 OG1 THR A 54 -19.462 -5.502 -5.618 1.00 0.00 O ATOM 873 CG2 THR A 54 -18.348 -3.519 -4.907 1.00 0.00 C ATOM 0 H THR A 54 -19.143 -3.228 -2.170 1.00 0.00 H new ATOM 0 HA THR A 54 -20.351 -5.750 -3.177 1.00 0.00 H new ATOM 0 HB THR A 54 -20.452 -3.921 -4.789 1.00 0.00 H new ATOM 0 HG1 THR A 54 -18.968 -6.263 -5.248 1.00 0.00 H new ATOM 0 HG21 THR A 54 -18.348 -3.207 -5.951 1.00 0.00 H new ATOM 0 HG22 THR A 54 -18.447 -2.643 -4.266 1.00 0.00 H new ATOM 0 HG23 THR A 54 -17.412 -4.030 -4.681 1.00 0.00 H new ATOM 881 N LEU A 55 -17.758 -5.169 -1.557 1.00 0.00 N ATOM 882 CA LEU A 55 -16.588 -5.753 -0.921 1.00 0.00 C ATOM 883 C LEU A 55 -16.985 -6.363 0.412 1.00 0.00 C ATOM 884 O LEU A 55 -18.054 -6.114 0.965 1.00 0.00 O ATOM 885 CB LEU A 55 -15.491 -4.705 -0.682 1.00 0.00 C ATOM 886 CG LEU A 55 -14.507 -4.468 -1.835 1.00 0.00 C ATOM 887 CD1 LEU A 55 -13.609 -5.691 -2.013 1.00 0.00 C ATOM 888 CD2 LEU A 55 -15.169 -4.173 -3.182 1.00 0.00 C ATOM 0 H LEU A 55 -18.089 -4.325 -1.090 1.00 0.00 H new ATOM 0 HA LEU A 55 -16.193 -6.518 -1.589 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -15.972 -3.756 -0.444 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -14.920 -5.003 0.198 1.00 0.00 H new ATOM 0 HG LEU A 55 -13.941 -3.581 -1.549 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -12.913 -5.515 -2.833 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -13.050 -5.868 -1.094 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -14.223 -6.563 -2.238 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -14.400 -4.019 -3.939 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -15.798 -5.015 -3.470 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -15.781 -3.275 -3.098 1.00 0.00 H new ATOM 900 N GLU A 56 -16.088 -7.208 0.898 1.00 0.00 N ATOM 901 CA GLU A 56 -16.266 -7.893 2.167 1.00 0.00 C ATOM 902 C GLU A 56 -15.845 -6.935 3.271 1.00 0.00 C ATOM 903 O GLU A 56 -14.967 -6.086 3.069 1.00 0.00 O ATOM 904 CB GLU A 56 -15.420 -9.168 2.224 1.00 0.00 C ATOM 905 CG GLU A 56 -15.908 -10.258 1.248 1.00 0.00 C ATOM 906 CD GLU A 56 -17.068 -11.130 1.726 1.00 0.00 C ATOM 907 OE1 GLU A 56 -17.929 -10.589 2.447 1.00 0.00 O ATOM 908 OE2 GLU A 56 -17.165 -12.286 1.235 1.00 0.00 O ATOM 0 H GLU A 56 -15.216 -7.437 0.422 1.00 0.00 H new ATOM 0 HA GLU A 56 -17.309 -8.187 2.288 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -14.383 -8.920 1.995 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -15.436 -9.563 3.240 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -16.205 -9.775 0.317 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -15.065 -10.909 1.014 1.00 0.00 H new ATOM 915 N LYS A 57 -16.434 -7.115 4.451 1.00 0.00 N ATOM 916 CA LYS A 57 -16.170 -6.298 5.641 1.00 0.00 C ATOM 917 C LYS A 57 -15.614 -7.146 6.775 1.00 0.00 C ATOM 918 O LYS A 57 -14.827 -6.660 7.584 1.00 0.00 O ATOM 919 CB LYS A 57 -17.482 -5.619 6.064 1.00 0.00 C ATOM 920 CG LYS A 57 -17.864 -4.509 5.076 1.00 0.00 C ATOM 921 CD LYS A 57 -19.367 -4.248 5.023 1.00 0.00 C ATOM 922 CE LYS A 57 -19.638 -3.087 4.053 1.00 0.00 C ATOM 923 NZ LYS A 57 -19.417 -1.759 4.684 1.00 0.00 N ATOM 0 H LYS A 57 -17.124 -7.848 4.614 1.00 0.00 H new ATOM 0 HA LYS A 57 -15.420 -5.543 5.405 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -18.281 -6.359 6.113 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -17.374 -5.200 7.065 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -17.351 -3.589 5.356 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -17.513 -4.780 4.080 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -19.894 -5.144 4.695 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -19.742 -4.004 6.017 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -18.989 -3.185 3.183 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -20.665 -3.149 3.694 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -19.645 -1.008 4.002 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -20.029 -1.665 5.519 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -18.422 -1.673 4.973 1.00 0.00 H new ATOM 937 N ASP A 58 -16.010 -8.417 6.796 1.00 0.00 N ATOM 938 CA ASP A 58 -15.621 -9.421 7.775 1.00 0.00 C ATOM 939 C ASP A 58 -14.138 -9.792 7.670 1.00 0.00 C ATOM 940 O ASP A 58 -13.471 -9.943 8.694 1.00 0.00 O ATOM 941 CB ASP A 58 -16.506 -10.667 7.585 1.00 0.00 C ATOM 942 CG ASP A 58 -15.995 -11.595 6.486 1.00 0.00 C ATOM 943 OD1 ASP A 58 -15.942 -11.136 5.325 1.00 0.00 O ATOM 944 OD2 ASP A 58 -15.637 -12.748 6.815 1.00 0.00 O ATOM 0 H ASP A 58 -16.645 -8.791 6.091 1.00 0.00 H new ATOM 0 HA ASP A 58 -15.766 -9.005 8.772 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -16.556 -11.218 8.524 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -17.522 -10.352 7.345 1.00 0.00 H new ATOM 949 N ARG A 59 -13.608 -9.877 6.446 1.00 0.00 N ATOM 950 CA ARG A 59 -12.220 -10.239 6.167 1.00 0.00 C ATOM 951 C ARG A 59 -11.229 -9.179 6.627 1.00 0.00 C ATOM 952 O ARG A 59 -10.089 -9.533 6.928 1.00 0.00 O ATOM 953 CB ARG A 59 -12.051 -10.501 4.665 1.00 0.00 C ATOM 954 CG ARG A 59 -12.626 -11.871 4.271 1.00 0.00 C ATOM 955 CD ARG A 59 -12.793 -11.948 2.755 1.00 0.00 C ATOM 956 NE ARG A 59 -13.400 -13.218 2.339 1.00 0.00 N ATOM 957 CZ ARG A 59 -13.702 -13.597 1.094 1.00 0.00 C ATOM 958 NH1 ARG A 59 -13.369 -12.846 0.047 1.00 0.00 N ATOM 959 NH2 ARG A 59 -14.315 -14.752 0.903 1.00 0.00 N ATOM 0 H ARG A 59 -14.149 -9.691 5.602 1.00 0.00 H new ATOM 0 HA ARG A 59 -12.000 -11.143 6.735 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -12.552 -9.717 4.098 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -10.994 -10.458 4.402 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -11.963 -12.666 4.613 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -13.588 -12.026 4.760 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -13.414 -11.119 2.415 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -11.821 -11.835 2.276 1.00 0.00 H new ATOM 0 HE ARG A 59 -13.615 -13.884 3.081 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -12.875 -11.965 0.188 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -13.608 -13.152 -0.896 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -14.552 -15.342 1.701 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -14.552 -15.054 -0.042 1.00 0.00 H new ATOM 973 N GLY A 60 -11.640 -7.918 6.716 1.00 0.00 N ATOM 974 CA GLY A 60 -10.813 -6.800 7.129 1.00 0.00 C ATOM 975 C GLY A 60 -11.383 -5.534 6.508 1.00 0.00 C ATOM 976 O GLY A 60 -12.506 -5.545 6.004 1.00 0.00 O ATOM 0 H GLY A 60 -12.596 -7.641 6.493 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -10.800 -6.718 8.216 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -9.782 -6.950 6.808 1.00 0.00 H new ATOM 980 N ASN A 61 -10.631 -4.431 6.554 1.00 0.00 N ATOM 981 CA ASN A 61 -11.070 -3.152 5.988 1.00 0.00 C ATOM 982 C ASN A 61 -10.377 -2.915 4.641 1.00 0.00 C ATOM 983 O ASN A 61 -9.217 -2.515 4.662 1.00 0.00 O ATOM 984 CB ASN A 61 -10.777 -2.004 6.963 1.00 0.00 C ATOM 985 CG ASN A 61 -11.137 -0.659 6.347 1.00 0.00 C ATOM 986 OD1 ASN A 61 -11.962 -0.580 5.446 1.00 0.00 O ATOM 987 ND2 ASN A 61 -10.558 0.413 6.855 1.00 0.00 N ATOM 0 H ASN A 61 -9.706 -4.399 6.982 1.00 0.00 H new ATOM 0 HA ASN A 61 -12.147 -3.187 5.825 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -11.343 -2.150 7.883 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -9.721 -2.013 7.234 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -10.795 1.338 6.497 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -9.874 0.316 7.605 1.00 0.00 H new ATOM 994 N PRO A 62 -10.993 -3.205 3.482 1.00 0.00 N ATOM 995 CA PRO A 62 -10.375 -3.003 2.177 1.00 0.00 C ATOM 996 C PRO A 62 -10.247 -1.502 1.888 1.00 0.00 C ATOM 997 O PRO A 62 -11.243 -0.779 1.857 1.00 0.00 O ATOM 998 CB PRO A 62 -11.289 -3.719 1.178 1.00 0.00 C ATOM 999 CG PRO A 62 -12.662 -3.639 1.833 1.00 0.00 C ATOM 1000 CD PRO A 62 -12.356 -3.680 3.329 1.00 0.00 C ATOM 0 HA PRO A 62 -9.364 -3.405 2.118 1.00 0.00 H new ATOM 0 HB2 PRO A 62 -11.280 -3.230 0.204 1.00 0.00 H new ATOM 0 HB3 PRO A 62 -10.979 -4.752 1.019 1.00 0.00 H new ATOM 0 HG2 PRO A 62 -13.184 -2.723 1.557 1.00 0.00 H new ATOM 0 HG3 PRO A 62 -13.298 -4.472 1.532 1.00 0.00 H new ATOM 0 HD2 PRO A 62 -13.051 -3.051 3.885 1.00 0.00 H new ATOM 0 HD3 PRO A 62 -12.460 -4.692 3.719 1.00 0.00 H new ATOM 1008 N ILE A 63 -9.029 -1.032 1.639 1.00 0.00 N ATOM 1009 CA ILE A 63 -8.723 0.365 1.348 1.00 0.00 C ATOM 1010 C ILE A 63 -7.840 0.454 0.101 1.00 0.00 C ATOM 1011 O ILE A 63 -7.549 -0.572 -0.536 1.00 0.00 O ATOM 1012 CB ILE A 63 -8.082 1.052 2.575 1.00 0.00 C ATOM 1013 CG1 ILE A 63 -6.667 0.518 2.912 1.00 0.00 C ATOM 1014 CG2 ILE A 63 -9.002 1.003 3.807 1.00 0.00 C ATOM 1015 CD1 ILE A 63 -5.669 1.662 3.118 1.00 0.00 C ATOM 0 H ILE A 63 -8.203 -1.630 1.634 1.00 0.00 H new ATOM 0 HA ILE A 63 -9.648 0.902 1.137 1.00 0.00 H new ATOM 0 HB ILE A 63 -7.955 2.096 2.290 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -6.713 -0.093 3.814 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -6.320 -0.129 2.106 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -8.513 1.497 4.646 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -9.939 1.513 3.582 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -9.207 -0.036 4.067 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -4.687 1.251 3.353 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -5.605 2.257 2.207 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -6.004 2.293 3.941 1.00 0.00 H new ATOM 1027 N TYR A 64 -7.438 1.681 -0.251 1.00 0.00 N ATOM 1028 CA TYR A 64 -6.588 1.949 -1.392 1.00 0.00 C ATOM 1029 C TYR A 64 -5.569 3.026 -1.027 1.00 0.00 C ATOM 1030 O TYR A 64 -5.851 3.978 -0.303 1.00 0.00 O ATOM 1031 CB TYR A 64 -7.449 2.319 -2.606 1.00 0.00 C ATOM 1032 CG TYR A 64 -6.803 2.118 -3.953 1.00 0.00 C ATOM 1033 CD1 TYR A 64 -6.964 3.076 -4.967 1.00 0.00 C ATOM 1034 CD2 TYR A 64 -6.096 0.939 -4.226 1.00 0.00 C ATOM 1035 CE1 TYR A 64 -6.366 2.876 -6.226 1.00 0.00 C ATOM 1036 CE2 TYR A 64 -5.412 0.794 -5.438 1.00 0.00 C ATOM 1037 CZ TYR A 64 -5.569 1.745 -6.452 1.00 0.00 C ATOM 1038 OH TYR A 64 -4.993 1.538 -7.657 1.00 0.00 O ATOM 0 H TYR A 64 -7.704 2.521 0.264 1.00 0.00 H new ATOM 0 HA TYR A 64 -6.025 1.058 -1.668 1.00 0.00 H new ATOM 0 HB2 TYR A 64 -8.365 1.729 -2.572 1.00 0.00 H new ATOM 0 HB3 TYR A 64 -7.740 3.366 -2.516 1.00 0.00 H new ATOM 0 HD1 TYR A 64 -7.547 3.966 -4.781 1.00 0.00 H new ATOM 0 HD2 TYR A 64 -6.079 0.140 -3.499 1.00 0.00 H new ATOM 0 HE1 TYR A 64 -6.521 3.594 -7.018 1.00 0.00 H new ATOM 0 HE2 TYR A 64 -4.761 -0.054 -5.591 1.00 0.00 H new ATOM 0 HH TYR A 64 -4.476 0.706 -7.634 1.00 0.00 H new ATOM 1048 N LEU A 65 -4.339 2.852 -1.497 1.00 0.00 N ATOM 1049 CA LEU A 65 -3.225 3.753 -1.254 1.00 0.00 C ATOM 1050 C LEU A 65 -2.272 3.736 -2.441 1.00 0.00 C ATOM 1051 O LEU A 65 -2.117 2.705 -3.111 1.00 0.00 O ATOM 1052 CB LEU A 65 -2.541 3.356 0.079 1.00 0.00 C ATOM 1053 CG LEU A 65 -1.146 3.960 0.355 1.00 0.00 C ATOM 1054 CD1 LEU A 65 -0.902 4.105 1.859 1.00 0.00 C ATOM 1055 CD2 LEU A 65 -0.026 3.069 -0.198 1.00 0.00 C ATOM 0 H LEU A 65 -4.084 2.052 -2.077 1.00 0.00 H new ATOM 0 HA LEU A 65 -3.573 4.781 -1.153 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -3.202 3.641 0.898 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -2.452 2.270 0.104 1.00 0.00 H new ATOM 0 HG LEU A 65 -1.131 4.933 -0.137 1.00 0.00 H new ATOM 0 HD11 LEU A 65 0.086 4.532 2.028 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -1.659 4.761 2.289 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -0.959 3.125 2.333 1.00 0.00 H new ATOM 0 HD21 LEU A 65 0.941 3.526 0.015 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -0.075 2.088 0.274 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -0.146 2.960 -1.276 1.00 0.00 H new ATOM 1067 N GLY A 66 -1.604 4.865 -2.657 1.00 0.00 N ATOM 1068 CA GLY A 66 -0.632 5.029 -3.725 1.00 0.00 C ATOM 1069 C GLY A 66 0.382 6.110 -3.392 1.00 0.00 C ATOM 1070 O GLY A 66 0.499 6.518 -2.236 1.00 0.00 O ATOM 0 H GLY A 66 -1.727 5.701 -2.086 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -0.116 4.085 -3.897 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -1.147 5.284 -4.651 1.00 0.00 H new ATOM 1074 N LEU A 67 1.214 6.460 -4.369 1.00 0.00 N ATOM 1075 CA LEU A 67 2.245 7.488 -4.269 1.00 0.00 C ATOM 1076 C LEU A 67 1.629 8.794 -4.785 1.00 0.00 C ATOM 1077 O LEU A 67 0.847 8.766 -5.731 1.00 0.00 O ATOM 1078 CB LEU A 67 3.480 7.147 -5.123 1.00 0.00 C ATOM 1079 CG LEU A 67 4.047 5.728 -5.063 1.00 0.00 C ATOM 1080 CD1 LEU A 67 5.330 5.700 -5.910 1.00 0.00 C ATOM 1081 CD2 LEU A 67 4.368 5.282 -3.626 1.00 0.00 C ATOM 0 H LEU A 67 1.187 6.018 -5.288 1.00 0.00 H new ATOM 0 HA LEU A 67 2.575 7.568 -3.233 1.00 0.00 H new ATOM 0 HB2 LEU A 67 3.231 7.360 -6.163 1.00 0.00 H new ATOM 0 HB3 LEU A 67 4.278 7.834 -4.839 1.00 0.00 H new ATOM 0 HG LEU A 67 3.297 5.036 -5.447 1.00 0.00 H new ATOM 0 HD11 LEU A 67 5.759 4.698 -5.887 1.00 0.00 H new ATOM 0 HD12 LEU A 67 5.093 5.970 -6.939 1.00 0.00 H new ATOM 0 HD13 LEU A 67 6.049 6.412 -5.505 1.00 0.00 H new ATOM 0 HD21 LEU A 67 4.767 4.268 -3.640 1.00 0.00 H new ATOM 0 HD22 LEU A 67 5.106 5.957 -3.192 1.00 0.00 H new ATOM 0 HD23 LEU A 67 3.458 5.305 -3.026 1.00 0.00 H new ATOM 1093 N ASN A 68 1.997 9.952 -4.235 1.00 0.00 N ATOM 1094 CA ASN A 68 1.423 11.229 -4.674 1.00 0.00 C ATOM 1095 C ASN A 68 2.517 11.988 -5.404 1.00 0.00 C ATOM 1096 O ASN A 68 3.491 12.373 -4.748 1.00 0.00 O ATOM 1097 CB ASN A 68 0.878 12.045 -3.490 1.00 0.00 C ATOM 1098 CG ASN A 68 -0.258 12.947 -3.937 1.00 0.00 C ATOM 1099 OD1 ASN A 68 -1.412 12.546 -3.906 1.00 0.00 O ATOM 1100 ND2 ASN A 68 0.007 14.176 -4.337 1.00 0.00 N ATOM 0 H ASN A 68 2.687 10.034 -3.488 1.00 0.00 H new ATOM 0 HA ASN A 68 0.574 11.049 -5.334 1.00 0.00 H new ATOM 0 HB2 ASN A 68 0.528 11.371 -2.708 1.00 0.00 H new ATOM 0 HB3 ASN A 68 1.678 12.646 -3.058 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -0.752 14.795 -4.622 1.00 0.00 H new ATOM 0 HD22 ASN A 68 0.971 14.508 -4.362 1.00 0.00 H new ATOM 1107 N GLY A 69 2.381 12.206 -6.711 1.00 0.00 N ATOM 1108 CA GLY A 69 3.389 12.904 -7.493 1.00 0.00 C ATOM 1109 C GLY A 69 3.340 12.587 -8.993 1.00 0.00 C ATOM 1110 O GLY A 69 3.391 13.520 -9.792 1.00 0.00 O ATOM 0 H GLY A 69 1.571 11.903 -7.252 1.00 0.00 H new ATOM 0 HA2 GLY A 69 3.264 13.978 -7.354 1.00 0.00 H new ATOM 0 HA3 GLY A 69 4.376 12.646 -7.109 1.00 0.00 H new ATOM 1114 N LEU A 70 3.182 11.316 -9.397 1.00 0.00 N ATOM 1115 CA LEU A 70 3.154 10.909 -10.816 1.00 0.00 C ATOM 1116 C LEU A 70 2.010 9.949 -11.186 1.00 0.00 C ATOM 1117 O LEU A 70 2.147 9.184 -12.136 1.00 0.00 O ATOM 1118 CB LEU A 70 4.535 10.355 -11.238 1.00 0.00 C ATOM 1119 CG LEU A 70 5.027 10.838 -12.616 1.00 0.00 C ATOM 1120 CD1 LEU A 70 6.394 10.203 -12.894 1.00 0.00 C ATOM 1121 CD2 LEU A 70 4.131 10.515 -13.819 1.00 0.00 C ATOM 0 H LEU A 70 3.069 10.537 -8.748 1.00 0.00 H new ATOM 0 HA LEU A 70 2.939 11.812 -11.388 1.00 0.00 H new ATOM 0 HB2 LEU A 70 5.271 10.638 -10.485 1.00 0.00 H new ATOM 0 HB3 LEU A 70 4.488 9.266 -11.245 1.00 0.00 H new ATOM 0 HG LEU A 70 5.040 11.925 -12.534 1.00 0.00 H new ATOM 0 HD11 LEU A 70 6.758 10.534 -13.867 1.00 0.00 H new ATOM 0 HD12 LEU A 70 7.100 10.505 -12.120 1.00 0.00 H new ATOM 0 HD13 LEU A 70 6.298 9.117 -12.893 1.00 0.00 H new ATOM 0 HD21 LEU A 70 4.587 10.907 -14.728 1.00 0.00 H new ATOM 0 HD22 LEU A 70 4.016 9.435 -13.908 1.00 0.00 H new ATOM 0 HD23 LEU A 70 3.152 10.973 -13.677 1.00 0.00 H new ATOM 1133 N ASN A 71 0.897 9.942 -10.443 1.00 0.00 N ATOM 1134 CA ASN A 71 -0.265 9.082 -10.733 1.00 0.00 C ATOM 1135 C ASN A 71 0.111 7.593 -10.698 1.00 0.00 C ATOM 1136 O ASN A 71 0.079 6.891 -11.715 1.00 0.00 O ATOM 1137 CB ASN A 71 -0.895 9.468 -12.092 1.00 0.00 C ATOM 1138 CG ASN A 71 -1.159 10.959 -12.246 1.00 0.00 C ATOM 1139 OD1 ASN A 71 -0.289 11.752 -12.614 1.00 0.00 O ATOM 1140 ND2 ASN A 71 -2.361 11.394 -11.935 1.00 0.00 N ATOM 0 H ASN A 71 0.773 10.533 -9.621 1.00 0.00 H new ATOM 0 HA ASN A 71 -1.007 9.244 -9.951 1.00 0.00 H new ATOM 0 HB2 ASN A 71 -0.234 9.141 -12.894 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -1.834 8.928 -12.213 1.00 0.00 H new ATOM 0 HD21 ASN A 71 -2.575 12.389 -11.998 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -3.079 10.736 -11.631 1.00 0.00 H new ATOM 1147 N LEU A 72 0.524 7.077 -9.532 1.00 0.00 N ATOM 1148 CA LEU A 72 0.924 5.670 -9.422 1.00 0.00 C ATOM 1149 C LEU A 72 0.535 5.116 -8.072 1.00 0.00 C ATOM 1150 O LEU A 72 0.812 5.726 -7.046 1.00 0.00 O ATOM 1151 CB LEU A 72 2.415 5.414 -9.739 1.00 0.00 C ATOM 1152 CG LEU A 72 3.277 6.608 -10.178 1.00 0.00 C ATOM 1153 CD1 LEU A 72 3.733 7.373 -8.945 1.00 0.00 C ATOM 1154 CD2 LEU A 72 4.466 6.208 -11.031 1.00 0.00 C ATOM 0 H LEU A 72 0.589 7.606 -8.662 1.00 0.00 H new ATOM 0 HA LEU A 72 0.376 5.132 -10.196 1.00 0.00 H new ATOM 0 HB2 LEU A 72 2.875 4.979 -8.851 1.00 0.00 H new ATOM 0 HB3 LEU A 72 2.464 4.660 -10.525 1.00 0.00 H new ATOM 0 HG LEU A 72 2.658 7.245 -10.810 1.00 0.00 H new ATOM 0 HD11 LEU A 72 4.345 8.222 -9.249 1.00 0.00 H new ATOM 0 HD12 LEU A 72 2.862 7.732 -8.397 1.00 0.00 H new ATOM 0 HD13 LEU A 72 4.319 6.714 -8.304 1.00 0.00 H new ATOM 0 HD21 LEU A 72 5.032 7.098 -11.306 1.00 0.00 H new ATOM 0 HD22 LEU A 72 5.107 5.530 -10.467 1.00 0.00 H new ATOM 0 HD23 LEU A 72 4.115 5.708 -11.933 1.00 0.00 H new ATOM 1166 N CYS A 73 -0.081 3.936 -8.081 1.00 0.00 N ATOM 1167 CA CYS A 73 -0.553 3.259 -6.865 1.00 0.00 C ATOM 1168 C CYS A 73 -0.239 1.770 -6.881 1.00 0.00 C ATOM 1169 O CYS A 73 0.216 1.248 -7.895 1.00 0.00 O ATOM 1170 CB CYS A 73 -2.072 3.425 -6.693 1.00 0.00 C ATOM 1171 SG CYS A 73 -2.615 5.128 -7.020 1.00 0.00 S ATOM 0 H CYS A 73 -0.270 3.415 -8.937 1.00 0.00 H new ATOM 0 HA CYS A 73 -0.026 3.728 -6.034 1.00 0.00 H new ATOM 0 HB2 CYS A 73 -2.589 2.744 -7.369 1.00 0.00 H new ATOM 0 HB3 CYS A 73 -2.354 3.143 -5.679 1.00 0.00 H new ATOM 0 HG CYS A 73 -2.329 5.447 -8.247 1.00 0.00 H new ATOM 1177 N LEU A 74 -0.494 1.097 -5.756 1.00 0.00 N ATOM 1178 CA LEU A 74 -0.262 -0.339 -5.593 1.00 0.00 C ATOM 1179 C LEU A 74 -1.114 -1.162 -6.558 1.00 0.00 C ATOM 1180 O LEU A 74 -2.179 -0.724 -6.985 1.00 0.00 O ATOM 1181 CB LEU A 74 -0.527 -0.751 -4.141 1.00 0.00 C ATOM 1182 CG LEU A 74 0.363 -0.073 -3.083 1.00 0.00 C ATOM 1183 CD1 LEU A 74 -0.373 -0.075 -1.744 1.00 0.00 C ATOM 1184 CD2 LEU A 74 1.694 -0.803 -2.888 1.00 0.00 C ATOM 0 H LEU A 74 -0.873 1.542 -4.920 1.00 0.00 H new ATOM 0 HA LEU A 74 0.782 -0.543 -5.833 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -1.569 -0.535 -3.905 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -0.399 -1.830 -4.059 1.00 0.00 H new ATOM 0 HG LEU A 74 0.572 0.938 -3.432 1.00 0.00 H new ATOM 0 HD11 LEU A 74 0.248 0.403 -0.987 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -1.310 0.473 -1.843 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -0.583 -1.102 -1.446 1.00 0.00 H new ATOM 0 HD21 LEU A 74 2.285 -0.286 -2.132 1.00 0.00 H new ATOM 0 HD22 LEU A 74 1.504 -1.826 -2.563 1.00 0.00 H new ATOM 0 HD23 LEU A 74 2.242 -0.818 -3.830 1.00 0.00 H new ATOM 1196 N MET A 75 -0.653 -2.372 -6.895 1.00 0.00 N ATOM 1197 CA MET A 75 -1.344 -3.263 -7.827 1.00 0.00 C ATOM 1198 C MET A 75 -0.748 -4.646 -7.656 1.00 0.00 C ATOM 1199 O MET A 75 0.440 -4.731 -7.344 1.00 0.00 O ATOM 1200 CB MET A 75 -1.034 -2.792 -9.251 1.00 0.00 C ATOM 1201 CG MET A 75 -2.158 -2.924 -10.276 1.00 0.00 C ATOM 1202 SD MET A 75 -2.627 -4.597 -10.791 1.00 0.00 S ATOM 1203 CE MET A 75 -1.364 -4.892 -12.059 1.00 0.00 C ATOM 0 H MET A 75 0.215 -2.760 -6.525 1.00 0.00 H new ATOM 0 HA MET A 75 -2.419 -3.267 -7.646 1.00 0.00 H new ATOM 0 HB2 MET A 75 -0.736 -1.745 -9.206 1.00 0.00 H new ATOM 0 HB3 MET A 75 -0.173 -3.353 -9.615 1.00 0.00 H new ATOM 0 HG2 MET A 75 -3.044 -2.437 -9.869 1.00 0.00 H new ATOM 0 HG3 MET A 75 -1.868 -2.366 -11.167 1.00 0.00 H new ATOM 0 HE1 MET A 75 -1.586 -5.821 -12.584 1.00 0.00 H new ATOM 0 HE2 MET A 75 -1.361 -4.065 -12.769 1.00 0.00 H new ATOM 0 HE3 MET A 75 -0.385 -4.968 -11.586 1.00 0.00 H new ATOM 1213 N CYS A 76 -1.518 -5.700 -7.908 1.00 0.00 N ATOM 1214 CA CYS A 76 -1.055 -7.077 -7.771 1.00 0.00 C ATOM 1215 C CYS A 76 -0.973 -7.731 -9.152 1.00 0.00 C ATOM 1216 O CYS A 76 -1.978 -7.759 -9.863 1.00 0.00 O ATOM 1217 CB CYS A 76 -2.014 -7.855 -6.853 1.00 0.00 C ATOM 1218 SG CYS A 76 -2.356 -6.944 -5.323 1.00 0.00 S ATOM 0 H CYS A 76 -2.488 -5.622 -8.215 1.00 0.00 H new ATOM 0 HA CYS A 76 -0.061 -7.089 -7.323 1.00 0.00 H new ATOM 0 HB2 CYS A 76 -2.949 -8.046 -7.380 1.00 0.00 H new ATOM 0 HB3 CYS A 76 -1.580 -8.825 -6.611 1.00 0.00 H new ATOM 0 HG CYS A 76 -3.322 -6.099 -5.528 1.00 0.00 H new ATOM 1224 N ALA A 77 0.196 -8.238 -9.551 1.00 0.00 N ATOM 1225 CA ALA A 77 0.408 -8.903 -10.834 1.00 0.00 C ATOM 1226 C ALA A 77 1.221 -10.177 -10.620 1.00 0.00 C ATOM 1227 O ALA A 77 2.009 -10.249 -9.674 1.00 0.00 O ATOM 1228 CB ALA A 77 1.138 -7.955 -11.786 1.00 0.00 C ATOM 0 H ALA A 77 1.038 -8.195 -8.977 1.00 0.00 H new ATOM 0 HA ALA A 77 -0.553 -9.170 -11.274 1.00 0.00 H new ATOM 0 HB1 ALA A 77 1.296 -8.451 -12.743 1.00 0.00 H new ATOM 0 HB2 ALA A 77 0.538 -7.058 -11.937 1.00 0.00 H new ATOM 0 HB3 ALA A 77 2.101 -7.679 -11.357 1.00 0.00 H new ATOM 1234 N LYS A 78 1.046 -11.189 -11.467 1.00 0.00 N ATOM 1235 CA LYS A 78 1.758 -12.450 -11.360 1.00 0.00 C ATOM 1236 C LYS A 78 3.076 -12.291 -12.109 1.00 0.00 C ATOM 1237 O LYS A 78 3.059 -11.835 -13.258 1.00 0.00 O ATOM 1238 CB LYS A 78 0.867 -13.573 -11.938 1.00 0.00 C ATOM 1239 CG LYS A 78 1.294 -14.935 -11.389 1.00 0.00 C ATOM 1240 CD LYS A 78 0.215 -16.020 -11.369 1.00 0.00 C ATOM 1241 CE LYS A 78 0.887 -17.389 -11.176 1.00 0.00 C ATOM 1242 NZ LYS A 78 -0.020 -18.549 -11.326 1.00 0.00 N ATOM 0 H LYS A 78 0.398 -11.151 -12.254 1.00 0.00 H new ATOM 0 HA LYS A 78 1.980 -12.721 -10.328 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -0.176 -13.384 -11.685 1.00 0.00 H new ATOM 0 HB3 LYS A 78 0.936 -13.576 -13.026 1.00 0.00 H new ATOM 0 HG2 LYS A 78 2.133 -15.297 -11.983 1.00 0.00 H new ATOM 0 HG3 LYS A 78 1.660 -14.796 -10.372 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -0.494 -15.831 -10.563 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -0.351 -16.006 -12.301 1.00 0.00 H new ATOM 0 HE2 LYS A 78 1.699 -17.485 -11.896 1.00 0.00 H new ATOM 0 HE3 LYS A 78 1.336 -17.422 -10.183 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 0.515 -19.429 -11.180 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -0.783 -18.487 -10.622 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -0.430 -18.548 -12.282 1.00 0.00 H new ATOM 1256 N VAL A 79 4.225 -12.546 -11.472 1.00 0.00 N ATOM 1257 CA VAL A 79 5.487 -12.406 -12.221 1.00 0.00 C ATOM 1258 C VAL A 79 5.840 -13.611 -13.132 1.00 0.00 C ATOM 1259 O VAL A 79 6.675 -13.508 -14.032 1.00 0.00 O ATOM 1260 CB VAL A 79 6.624 -12.011 -11.262 1.00 0.00 C ATOM 1261 CG1 VAL A 79 7.048 -13.143 -10.323 1.00 0.00 C ATOM 1262 CG2 VAL A 79 7.847 -11.438 -11.988 1.00 0.00 C ATOM 0 H VAL A 79 4.313 -12.834 -10.497 1.00 0.00 H new ATOM 0 HA VAL A 79 5.342 -11.597 -12.937 1.00 0.00 H new ATOM 0 HB VAL A 79 6.197 -11.219 -10.647 1.00 0.00 H new ATOM 0 HG11 VAL A 79 7.853 -12.796 -9.675 1.00 0.00 H new ATOM 0 HG12 VAL A 79 6.197 -13.448 -9.714 1.00 0.00 H new ATOM 0 HG13 VAL A 79 7.396 -13.992 -10.911 1.00 0.00 H new ATOM 0 HG21 VAL A 79 8.614 -11.178 -11.259 1.00 0.00 H new ATOM 0 HG22 VAL A 79 8.241 -12.182 -12.680 1.00 0.00 H new ATOM 0 HG23 VAL A 79 7.556 -10.546 -12.542 1.00 0.00 H new ATOM 1272 N GLY A 80 5.209 -14.753 -12.902 1.00 0.00 N ATOM 1273 CA GLY A 80 5.298 -16.077 -13.495 1.00 0.00 C ATOM 1274 C GLY A 80 4.804 -17.112 -12.456 1.00 0.00 C ATOM 1275 O GLY A 80 3.735 -17.690 -12.654 1.00 0.00 O ATOM 0 H GLY A 80 4.502 -14.768 -12.167 1.00 0.00 H new ATOM 0 HA2 GLY A 80 4.692 -16.129 -14.400 1.00 0.00 H new ATOM 0 HA3 GLY A 80 6.326 -16.293 -13.787 1.00 0.00 H new ATOM 1279 N ASP A 81 5.480 -17.280 -11.297 1.00 0.00 N ATOM 1280 CA ASP A 81 5.074 -18.265 -10.260 1.00 0.00 C ATOM 1281 C ASP A 81 4.357 -17.780 -8.984 1.00 0.00 C ATOM 1282 O ASP A 81 3.555 -18.505 -8.409 1.00 0.00 O ATOM 1283 CB ASP A 81 6.302 -19.058 -9.816 1.00 0.00 C ATOM 1284 CG ASP A 81 5.885 -20.369 -9.135 1.00 0.00 C ATOM 1285 OD1 ASP A 81 6.265 -20.553 -7.960 1.00 0.00 O ATOM 1286 OD2 ASP A 81 5.192 -21.201 -9.773 1.00 0.00 O ATOM 0 H ASP A 81 6.313 -16.745 -11.053 1.00 0.00 H new ATOM 0 HA ASP A 81 4.310 -18.837 -10.786 1.00 0.00 H new ATOM 0 HB2 ASP A 81 6.932 -19.275 -10.679 1.00 0.00 H new ATOM 0 HB3 ASP A 81 6.899 -18.459 -9.128 1.00 0.00 H new ATOM 1291 N GLN A 82 4.586 -16.540 -8.562 1.00 0.00 N ATOM 1292 CA GLN A 82 4.063 -15.830 -7.384 1.00 0.00 C ATOM 1293 C GLN A 82 3.536 -14.378 -7.643 1.00 0.00 C ATOM 1294 O GLN A 82 3.941 -13.678 -8.600 1.00 0.00 O ATOM 1295 CB GLN A 82 5.248 -15.746 -6.410 1.00 0.00 C ATOM 1296 CG GLN A 82 6.516 -15.278 -7.155 1.00 0.00 C ATOM 1297 CD GLN A 82 7.475 -14.513 -6.246 1.00 0.00 C ATOM 1298 OE1 GLN A 82 7.192 -13.387 -5.853 1.00 0.00 O ATOM 1299 NE2 GLN A 82 8.608 -15.086 -5.892 1.00 0.00 N ATOM 0 H GLN A 82 5.212 -15.935 -9.093 1.00 0.00 H new ATOM 0 HA GLN A 82 3.195 -16.379 -7.019 1.00 0.00 H new ATOM 0 HB2 GLN A 82 5.015 -15.053 -5.601 1.00 0.00 H new ATOM 0 HB3 GLN A 82 5.424 -16.720 -5.954 1.00 0.00 H new ATOM 0 HG2 GLN A 82 7.029 -16.144 -7.573 1.00 0.00 H new ATOM 0 HG3 GLN A 82 6.228 -14.642 -7.993 1.00 0.00 H new ATOM 0 HE21 GLN A 82 8.832 -16.024 -6.226 1.00 0.00 H new ATOM 0 HE22 GLN A 82 9.261 -14.592 -5.284 1.00 0.00 H new ATOM 1308 N PRO A 83 2.633 -13.878 -6.789 1.00 0.00 N ATOM 1309 CA PRO A 83 2.094 -12.538 -6.943 1.00 0.00 C ATOM 1310 C PRO A 83 3.161 -11.520 -6.522 1.00 0.00 C ATOM 1311 O PRO A 83 3.907 -11.740 -5.573 1.00 0.00 O ATOM 1312 CB PRO A 83 0.868 -12.510 -6.041 1.00 0.00 C ATOM 1313 CG PRO A 83 1.230 -13.466 -4.914 1.00 0.00 C ATOM 1314 CD PRO A 83 2.057 -14.538 -5.625 1.00 0.00 C ATOM 0 HA PRO A 83 1.819 -12.285 -7.967 1.00 0.00 H new ATOM 0 HB2 PRO A 83 0.669 -11.506 -5.666 1.00 0.00 H new ATOM 0 HB3 PRO A 83 -0.027 -12.836 -6.571 1.00 0.00 H new ATOM 0 HG2 PRO A 83 1.802 -12.968 -4.131 1.00 0.00 H new ATOM 0 HG3 PRO A 83 0.343 -13.888 -4.442 1.00 0.00 H new ATOM 0 HD2 PRO A 83 2.836 -14.930 -4.971 1.00 0.00 H new ATOM 0 HD3 PRO A 83 1.434 -15.382 -5.921 1.00 0.00 H new ATOM 1322 N THR A 84 3.203 -10.383 -7.207 1.00 0.00 N ATOM 1323 CA THR A 84 4.153 -9.301 -6.984 1.00 0.00 C ATOM 1324 C THR A 84 3.439 -7.951 -7.137 1.00 0.00 C ATOM 1325 O THR A 84 2.290 -7.889 -7.593 1.00 0.00 O ATOM 1326 CB THR A 84 5.294 -9.433 -8.019 1.00 0.00 C ATOM 1327 OG1 THR A 84 4.807 -9.462 -9.354 1.00 0.00 O ATOM 1328 CG2 THR A 84 6.170 -10.672 -7.828 1.00 0.00 C ATOM 0 H THR A 84 2.549 -10.182 -7.964 1.00 0.00 H new ATOM 0 HA THR A 84 4.567 -9.357 -5.977 1.00 0.00 H new ATOM 0 HB THR A 84 5.900 -8.544 -7.846 1.00 0.00 H new ATOM 0 HG1 THR A 84 3.847 -9.659 -9.348 1.00 0.00 H new ATOM 0 HG21 THR A 84 6.946 -10.691 -8.593 1.00 0.00 H new ATOM 0 HG22 THR A 84 6.634 -10.641 -6.842 1.00 0.00 H new ATOM 0 HG23 THR A 84 5.556 -11.568 -7.912 1.00 0.00 H new ATOM 1336 N LEU A 85 4.111 -6.858 -6.757 1.00 0.00 N ATOM 1337 CA LEU A 85 3.552 -5.508 -6.869 1.00 0.00 C ATOM 1338 C LEU A 85 3.890 -4.850 -8.207 1.00 0.00 C ATOM 1339 O LEU A 85 4.977 -5.087 -8.745 1.00 0.00 O ATOM 1340 CB LEU A 85 4.105 -4.597 -5.769 1.00 0.00 C ATOM 1341 CG LEU A 85 3.327 -4.709 -4.455 1.00 0.00 C ATOM 1342 CD1 LEU A 85 4.215 -4.272 -3.284 1.00 0.00 C ATOM 1343 CD2 LEU A 85 1.998 -3.950 -4.455 1.00 0.00 C ATOM 0 H LEU A 85 5.052 -6.885 -6.365 1.00 0.00 H new ATOM 0 HA LEU A 85 2.472 -5.625 -6.779 1.00 0.00 H new ATOM 0 HB2 LEU A 85 5.150 -4.847 -5.589 1.00 0.00 H new ATOM 0 HB3 LEU A 85 4.079 -3.563 -6.114 1.00 0.00 H new ATOM 0 HG LEU A 85 3.058 -5.759 -4.339 1.00 0.00 H new ATOM 0 HD11 LEU A 85 3.655 -4.354 -2.352 1.00 0.00 H new ATOM 0 HD12 LEU A 85 5.095 -4.913 -3.236 1.00 0.00 H new ATOM 0 HD13 LEU A 85 4.527 -3.238 -3.430 1.00 0.00 H new ATOM 0 HD21 LEU A 85 1.506 -4.077 -3.491 1.00 0.00 H new ATOM 0 HD22 LEU A 85 2.184 -2.890 -4.630 1.00 0.00 H new ATOM 0 HD23 LEU A 85 1.356 -4.341 -5.244 1.00 0.00 H new ATOM 1355 N GLN A 86 2.999 -3.965 -8.679 1.00 0.00 N ATOM 1356 CA GLN A 86 3.153 -3.207 -9.924 1.00 0.00 C ATOM 1357 C GLN A 86 2.660 -1.761 -9.751 1.00 0.00 C ATOM 1358 O GLN A 86 1.546 -1.412 -10.147 1.00 0.00 O ATOM 1359 CB GLN A 86 2.507 -3.930 -11.131 1.00 0.00 C ATOM 1360 CG GLN A 86 3.496 -4.783 -11.962 1.00 0.00 C ATOM 1361 CD GLN A 86 3.537 -4.452 -13.466 1.00 0.00 C ATOM 1362 OE1 GLN A 86 2.586 -3.954 -14.066 1.00 0.00 O ATOM 1363 NE2 GLN A 86 4.659 -4.698 -14.124 1.00 0.00 N ATOM 0 H GLN A 86 2.129 -3.753 -8.190 1.00 0.00 H new ATOM 0 HA GLN A 86 4.217 -3.152 -10.154 1.00 0.00 H new ATOM 0 HB2 GLN A 86 1.705 -4.573 -10.768 1.00 0.00 H new ATOM 0 HB3 GLN A 86 2.049 -3.186 -11.783 1.00 0.00 H new ATOM 0 HG2 GLN A 86 4.497 -4.656 -11.550 1.00 0.00 H new ATOM 0 HG3 GLN A 86 3.234 -5.834 -11.844 1.00 0.00 H new ATOM 0 HE21 GLN A 86 5.455 -5.111 -13.638 1.00 0.00 H new ATOM 0 HE22 GLN A 86 4.727 -4.475 -15.117 1.00 0.00 H new ATOM 1372 N LEU A 87 3.445 -0.916 -9.078 1.00 0.00 N ATOM 1373 CA LEU A 87 3.106 0.485 -8.863 1.00 0.00 C ATOM 1374 C LEU A 87 3.771 1.278 -9.957 1.00 0.00 C ATOM 1375 O LEU A 87 4.999 1.300 -9.994 1.00 0.00 O ATOM 1376 CB LEU A 87 3.571 1.104 -7.532 1.00 0.00 C ATOM 1377 CG LEU A 87 3.401 0.292 -6.250 1.00 0.00 C ATOM 1378 CD1 LEU A 87 4.479 -0.754 -5.950 1.00 0.00 C ATOM 1379 CD2 LEU A 87 3.202 1.269 -5.076 1.00 0.00 C ATOM 0 H LEU A 87 4.337 -1.190 -8.667 1.00 0.00 H new ATOM 0 HA LEU A 87 2.017 0.522 -8.852 1.00 0.00 H new ATOM 0 HB2 LEU A 87 4.629 1.348 -7.632 1.00 0.00 H new ATOM 0 HB3 LEU A 87 3.038 2.046 -7.401 1.00 0.00 H new ATOM 0 HG LEU A 87 2.519 -0.330 -6.402 1.00 0.00 H new ATOM 0 HD11 LEU A 87 4.243 -1.261 -5.014 1.00 0.00 H new ATOM 0 HD12 LEU A 87 4.514 -1.483 -6.759 1.00 0.00 H new ATOM 0 HD13 LEU A 87 5.448 -0.263 -5.862 1.00 0.00 H new ATOM 0 HD21 LEU A 87 3.079 0.706 -4.151 1.00 0.00 H new ATOM 0 HD22 LEU A 87 4.073 1.919 -4.992 1.00 0.00 H new ATOM 0 HD23 LEU A 87 2.313 1.875 -5.253 1.00 0.00 H new ATOM 1391 N LYS A 88 2.994 1.928 -10.822 1.00 0.00 N ATOM 1392 CA LYS A 88 3.589 2.729 -11.922 1.00 0.00 C ATOM 1393 C LYS A 88 2.586 3.476 -12.797 1.00 0.00 C ATOM 1394 O LYS A 88 2.960 4.402 -13.517 1.00 0.00 O ATOM 1395 CB LYS A 88 4.437 1.844 -12.837 1.00 0.00 C ATOM 1396 CG LYS A 88 3.687 0.667 -13.500 1.00 0.00 C ATOM 1397 CD LYS A 88 4.464 -0.656 -13.423 1.00 0.00 C ATOM 1398 CE LYS A 88 4.805 -1.264 -14.789 1.00 0.00 C ATOM 1399 NZ LYS A 88 3.615 -1.669 -15.563 1.00 0.00 N ATOM 0 H LYS A 88 1.974 1.926 -10.796 1.00 0.00 H new ATOM 0 HA LYS A 88 4.190 3.479 -11.408 1.00 0.00 H new ATOM 0 HB2 LYS A 88 4.866 2.467 -13.621 1.00 0.00 H new ATOM 0 HB3 LYS A 88 5.269 1.443 -12.258 1.00 0.00 H new ATOM 0 HG2 LYS A 88 2.718 0.542 -13.017 1.00 0.00 H new ATOM 0 HG3 LYS A 88 3.493 0.909 -14.545 1.00 0.00 H new ATOM 0 HD2 LYS A 88 5.389 -0.490 -12.871 1.00 0.00 H new ATOM 0 HD3 LYS A 88 3.877 -1.377 -12.853 1.00 0.00 H new ATOM 0 HE2 LYS A 88 5.377 -0.539 -15.368 1.00 0.00 H new ATOM 0 HE3 LYS A 88 5.447 -2.133 -14.642 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 3.901 -1.928 -16.529 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 3.164 -2.486 -15.104 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 2.941 -0.878 -15.602 1.00 0.00 H new ATOM 1413 N GLU A 89 1.314 3.126 -12.682 1.00 0.00 N ATOM 1414 CA GLU A 89 0.224 3.737 -13.435 1.00 0.00 C ATOM 1415 C GLU A 89 -1.093 3.499 -12.711 1.00 0.00 C ATOM 1416 O GLU A 89 -1.599 2.394 -12.805 1.00 0.00 O ATOM 1417 CB GLU A 89 0.229 3.095 -14.855 1.00 0.00 C ATOM 1418 CG GLU A 89 0.106 1.545 -14.911 1.00 0.00 C ATOM 1419 CD GLU A 89 0.676 0.918 -16.188 1.00 0.00 C ATOM 1420 OE1 GLU A 89 0.209 1.256 -17.298 1.00 0.00 O ATOM 1421 OE2 GLU A 89 1.497 -0.024 -16.071 1.00 0.00 O ATOM 0 H GLU A 89 1.001 2.391 -12.047 1.00 0.00 H new ATOM 0 HA GLU A 89 0.350 4.816 -13.523 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -0.593 3.524 -15.428 1.00 0.00 H new ATOM 0 HB3 GLU A 89 1.152 3.383 -15.358 1.00 0.00 H new ATOM 0 HG2 GLU A 89 0.620 1.119 -14.049 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -0.945 1.271 -14.823 1.00 0.00 H new ATOM 1428 N LYS A 90 -1.625 4.427 -11.912 1.00 0.00 N ATOM 1429 CA LYS A 90 -2.890 4.185 -11.201 1.00 0.00 C ATOM 1430 C LYS A 90 -3.367 5.482 -10.543 1.00 0.00 C ATOM 1431 O LYS A 90 -2.533 6.234 -10.042 1.00 0.00 O ATOM 1432 CB LYS A 90 -2.626 3.144 -10.110 1.00 0.00 C ATOM 1433 CG LYS A 90 -3.313 1.808 -10.388 1.00 0.00 C ATOM 1434 CD LYS A 90 -2.434 0.663 -9.878 1.00 0.00 C ATOM 1435 CE LYS A 90 -1.355 0.265 -10.901 1.00 0.00 C ATOM 1436 NZ LYS A 90 -1.963 -0.166 -12.179 1.00 0.00 N ATOM 0 H LYS A 90 -1.209 5.342 -11.740 1.00 0.00 H new ATOM 0 HA LYS A 90 -3.651 3.834 -11.898 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -1.552 2.983 -10.020 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -2.971 3.533 -9.152 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -4.286 1.779 -9.898 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -3.491 1.695 -11.457 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -1.956 0.961 -8.945 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -3.059 -0.202 -9.655 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -0.689 1.110 -11.079 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -0.745 -0.542 -10.495 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -1.392 -0.929 -12.595 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -2.928 -0.511 -12.005 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -1.997 0.639 -12.836 1.00 0.00 H new ATOM 1450 N ASP A 91 -4.675 5.685 -10.403 1.00 0.00 N ATOM 1451 CA ASP A 91 -5.259 6.879 -9.803 1.00 0.00 C ATOM 1452 C ASP A 91 -6.267 6.450 -8.722 1.00 0.00 C ATOM 1453 O ASP A 91 -7.309 5.863 -9.018 1.00 0.00 O ATOM 1454 CB ASP A 91 -5.975 7.734 -10.875 1.00 0.00 C ATOM 1455 CG ASP A 91 -5.079 8.412 -11.915 1.00 0.00 C ATOM 1456 OD1 ASP A 91 -5.196 8.136 -13.136 1.00 0.00 O ATOM 1457 OD2 ASP A 91 -4.297 9.303 -11.526 1.00 0.00 O ATOM 0 H ASP A 91 -5.373 5.008 -10.711 1.00 0.00 H new ATOM 0 HA ASP A 91 -4.466 7.481 -9.359 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -6.687 7.097 -11.400 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -6.553 8.506 -10.367 1.00 0.00 H new ATOM 1462 N ILE A 92 -5.996 6.758 -7.450 1.00 0.00 N ATOM 1463 CA ILE A 92 -6.887 6.418 -6.330 1.00 0.00 C ATOM 1464 C ILE A 92 -8.255 7.085 -6.437 1.00 0.00 C ATOM 1465 O ILE A 92 -9.280 6.439 -6.232 1.00 0.00 O ATOM 1466 CB ILE A 92 -6.193 6.698 -4.953 1.00 0.00 C ATOM 1467 CG1 ILE A 92 -5.968 8.213 -4.744 1.00 0.00 C ATOM 1468 CG2 ILE A 92 -4.875 5.936 -4.789 1.00 0.00 C ATOM 1469 CD1 ILE A 92 -5.072 8.598 -3.568 1.00 0.00 C ATOM 0 H ILE A 92 -5.150 7.252 -7.164 1.00 0.00 H new ATOM 0 HA ILE A 92 -7.079 5.347 -6.390 1.00 0.00 H new ATOM 0 HB ILE A 92 -6.873 6.331 -4.185 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -5.536 8.626 -5.656 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -6.939 8.690 -4.607 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -4.439 6.168 -3.817 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -5.064 4.864 -4.855 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -4.183 6.232 -5.577 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -4.985 9.683 -3.517 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -5.508 8.225 -2.641 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -4.083 8.161 -3.705 1.00 0.00 H new ATOM 1481 N MET A 93 -8.253 8.356 -6.816 1.00 0.00 N ATOM 1482 CA MET A 93 -9.429 9.183 -6.956 1.00 0.00 C ATOM 1483 C MET A 93 -10.302 8.752 -8.131 1.00 0.00 C ATOM 1484 O MET A 93 -11.447 9.184 -8.200 1.00 0.00 O ATOM 1485 CB MET A 93 -9.007 10.661 -7.068 1.00 0.00 C ATOM 1486 CG MET A 93 -9.827 11.514 -6.100 1.00 0.00 C ATOM 1487 SD MET A 93 -9.369 11.287 -4.362 1.00 0.00 S ATOM 1488 CE MET A 93 -10.797 12.039 -3.549 1.00 0.00 C ATOM 0 H MET A 93 -7.392 8.854 -7.042 1.00 0.00 H new ATOM 0 HA MET A 93 -10.045 9.059 -6.065 1.00 0.00 H new ATOM 0 HB2 MET A 93 -7.945 10.762 -6.845 1.00 0.00 H new ATOM 0 HB3 MET A 93 -9.153 11.013 -8.089 1.00 0.00 H new ATOM 0 HG2 MET A 93 -9.707 12.565 -6.364 1.00 0.00 H new ATOM 0 HG3 MET A 93 -10.883 11.273 -6.223 1.00 0.00 H new ATOM 0 HE1 MET A 93 -10.672 11.981 -2.468 1.00 0.00 H new ATOM 0 HE2 MET A 93 -10.879 13.083 -3.850 1.00 0.00 H new ATOM 0 HE3 MET A 93 -11.703 11.506 -3.838 1.00 0.00 H new ATOM 1498 N ASP A 94 -9.789 7.949 -9.065 1.00 0.00 N ATOM 1499 CA ASP A 94 -10.559 7.473 -10.216 1.00 0.00 C ATOM 1500 C ASP A 94 -11.446 6.314 -9.773 1.00 0.00 C ATOM 1501 O ASP A 94 -12.672 6.346 -9.937 1.00 0.00 O ATOM 1502 CB ASP A 94 -9.608 7.025 -11.325 1.00 0.00 C ATOM 1503 CG ASP A 94 -10.370 6.366 -12.472 1.00 0.00 C ATOM 1504 OD1 ASP A 94 -10.244 5.136 -12.630 1.00 0.00 O ATOM 1505 OD2 ASP A 94 -11.063 7.099 -13.212 1.00 0.00 O ATOM 0 H ASP A 94 -8.827 7.610 -9.045 1.00 0.00 H new ATOM 0 HA ASP A 94 -11.185 8.277 -10.603 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -9.052 7.884 -11.700 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -8.877 6.325 -10.920 1.00 0.00 H new ATOM 1510 N LEU A 95 -10.830 5.318 -9.125 1.00 0.00 N ATOM 1511 CA LEU A 95 -11.565 4.134 -8.650 1.00 0.00 C ATOM 1512 C LEU A 95 -12.551 4.490 -7.567 1.00 0.00 C ATOM 1513 O LEU A 95 -13.451 3.718 -7.249 1.00 0.00 O ATOM 1514 CB LEU A 95 -10.595 3.160 -8.016 1.00 0.00 C ATOM 1515 CG LEU A 95 -9.419 2.759 -8.908 1.00 0.00 C ATOM 1516 CD1 LEU A 95 -8.671 1.648 -8.182 1.00 0.00 C ATOM 1517 CD2 LEU A 95 -9.789 2.265 -10.305 1.00 0.00 C ATOM 0 H LEU A 95 -9.831 5.305 -8.917 1.00 0.00 H new ATOM 0 HA LEU A 95 -12.080 3.713 -9.514 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -10.204 3.602 -7.099 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -11.140 2.260 -7.729 1.00 0.00 H new ATOM 0 HG LEU A 95 -8.827 3.659 -9.073 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -7.820 1.329 -8.784 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -8.317 2.017 -7.219 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -9.340 0.803 -8.023 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -8.882 2.008 -10.852 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -10.425 1.384 -10.223 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -10.324 3.050 -10.839 1.00 0.00 H new ATOM 1529 N TYR A 96 -12.307 5.624 -6.935 1.00 0.00 N ATOM 1530 CA TYR A 96 -13.145 6.149 -5.889 1.00 0.00 C ATOM 1531 C TYR A 96 -14.185 7.053 -6.538 1.00 0.00 C ATOM 1532 O TYR A 96 -15.303 7.075 -6.046 1.00 0.00 O ATOM 1533 CB TYR A 96 -12.276 6.811 -4.827 1.00 0.00 C ATOM 1534 CG TYR A 96 -11.595 5.812 -3.897 1.00 0.00 C ATOM 1535 CD1 TYR A 96 -11.189 4.516 -4.293 1.00 0.00 C ATOM 1536 CD2 TYR A 96 -11.431 6.170 -2.560 1.00 0.00 C ATOM 1537 CE1 TYR A 96 -10.665 3.592 -3.380 1.00 0.00 C ATOM 1538 CE2 TYR A 96 -10.894 5.257 -1.647 1.00 0.00 C ATOM 1539 CZ TYR A 96 -10.515 3.966 -2.037 1.00 0.00 C ATOM 1540 OH TYR A 96 -10.044 3.085 -1.122 1.00 0.00 O ATOM 0 H TYR A 96 -11.501 6.213 -7.144 1.00 0.00 H new ATOM 0 HA TYR A 96 -13.694 5.373 -5.356 1.00 0.00 H new ATOM 0 HB2 TYR A 96 -11.515 7.418 -5.317 1.00 0.00 H new ATOM 0 HB3 TYR A 96 -12.891 7.488 -4.234 1.00 0.00 H new ATOM 0 HD1 TYR A 96 -11.286 4.231 -5.330 1.00 0.00 H new ATOM 0 HD2 TYR A 96 -11.720 7.156 -2.228 1.00 0.00 H new ATOM 0 HE1 TYR A 96 -10.380 2.603 -3.707 1.00 0.00 H new ATOM 0 HE2 TYR A 96 -10.768 5.554 -0.616 1.00 0.00 H new ATOM 0 HH TYR A 96 -10.430 2.200 -1.291 1.00 0.00 H new ATOM 1550 N ASN A 97 -13.872 7.782 -7.621 1.00 0.00 N ATOM 1551 CA ASN A 97 -14.863 8.626 -8.284 1.00 0.00 C ATOM 1552 C ASN A 97 -15.980 7.753 -8.842 1.00 0.00 C ATOM 1553 O ASN A 97 -17.132 8.181 -8.781 1.00 0.00 O ATOM 1554 CB ASN A 97 -14.252 9.451 -9.430 1.00 0.00 C ATOM 1555 CG ASN A 97 -15.285 10.194 -10.280 1.00 0.00 C ATOM 1556 OD1 ASN A 97 -15.199 10.244 -11.505 1.00 0.00 O ATOM 1557 ND2 ASN A 97 -16.258 10.850 -9.667 1.00 0.00 N ATOM 0 H ASN A 97 -12.946 7.800 -8.049 1.00 0.00 H new ATOM 0 HA ASN A 97 -15.251 9.322 -7.540 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -13.553 10.175 -9.011 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -13.675 8.788 -10.075 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -16.929 11.392 -10.211 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -16.336 10.814 -8.651 1.00 0.00 H new ATOM 1564 N GLN A 98 -15.665 6.556 -9.351 1.00 0.00 N ATOM 1565 CA GLN A 98 -16.702 5.664 -9.886 1.00 0.00 C ATOM 1566 C GLN A 98 -16.870 4.405 -9.037 1.00 0.00 C ATOM 1567 O GLN A 98 -15.916 4.011 -8.376 1.00 0.00 O ATOM 1568 CB GLN A 98 -16.425 5.374 -11.359 1.00 0.00 C ATOM 1569 CG GLN A 98 -15.029 4.819 -11.689 1.00 0.00 C ATOM 1570 CD GLN A 98 -14.245 5.664 -12.702 1.00 0.00 C ATOM 1571 OE1 GLN A 98 -14.614 6.786 -13.054 1.00 0.00 O ATOM 1572 NE2 GLN A 98 -13.129 5.149 -13.175 1.00 0.00 N ATOM 0 H GLN A 98 -14.716 6.186 -9.404 1.00 0.00 H new ATOM 0 HA GLN A 98 -17.667 6.169 -9.830 1.00 0.00 H new ATOM 0 HB2 GLN A 98 -17.170 4.662 -11.714 1.00 0.00 H new ATOM 0 HB3 GLN A 98 -16.570 6.295 -11.923 1.00 0.00 H new ATOM 0 HG2 GLN A 98 -14.451 4.746 -10.768 1.00 0.00 H new ATOM 0 HG3 GLN A 98 -15.135 3.807 -12.080 1.00 0.00 H new ATOM 0 HE21 GLN A 98 -12.830 4.220 -12.879 1.00 0.00 H new ATOM 0 HE22 GLN A 98 -12.563 5.679 -13.838 1.00 0.00 H new ATOM 1581 N PRO A 99 -18.034 3.729 -9.058 1.00 0.00 N ATOM 1582 CA PRO A 99 -18.284 2.517 -8.278 1.00 0.00 C ATOM 1583 C PRO A 99 -17.575 1.294 -8.903 1.00 0.00 C ATOM 1584 O PRO A 99 -18.205 0.285 -9.240 1.00 0.00 O ATOM 1585 CB PRO A 99 -19.815 2.413 -8.248 1.00 0.00 C ATOM 1586 CG PRO A 99 -20.252 3.007 -9.583 1.00 0.00 C ATOM 1587 CD PRO A 99 -19.233 4.119 -9.796 1.00 0.00 C ATOM 0 HA PRO A 99 -17.879 2.551 -7.267 1.00 0.00 H new ATOM 0 HB2 PRO A 99 -20.143 1.379 -8.145 1.00 0.00 H new ATOM 0 HB3 PRO A 99 -20.236 2.966 -7.408 1.00 0.00 H new ATOM 0 HG2 PRO A 99 -20.222 2.269 -10.385 1.00 0.00 H new ATOM 0 HG3 PRO A 99 -21.271 3.392 -9.542 1.00 0.00 H new ATOM 0 HD2 PRO A 99 -19.012 4.245 -10.856 1.00 0.00 H new ATOM 0 HD3 PRO A 99 -19.618 5.073 -9.435 1.00 0.00 H new ATOM 1595 N GLU A 100 -16.244 1.343 -9.028 1.00 0.00 N ATOM 1596 CA GLU A 100 -15.421 0.290 -9.623 1.00 0.00 C ATOM 1597 C GLU A 100 -14.251 -0.131 -8.696 1.00 0.00 C ATOM 1598 O GLU A 100 -13.079 0.046 -9.028 1.00 0.00 O ATOM 1599 CB GLU A 100 -15.034 0.721 -11.057 1.00 0.00 C ATOM 1600 CG GLU A 100 -16.298 0.952 -11.915 1.00 0.00 C ATOM 1601 CD GLU A 100 -16.031 1.120 -13.411 1.00 0.00 C ATOM 1602 OE1 GLU A 100 -16.276 0.142 -14.154 1.00 0.00 O ATOM 1603 OE2 GLU A 100 -15.707 2.233 -13.866 1.00 0.00 O ATOM 0 H GLU A 100 -15.696 2.141 -8.708 1.00 0.00 H new ATOM 0 HA GLU A 100 -15.985 -0.638 -9.721 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -14.441 1.635 -11.020 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -14.411 -0.046 -11.517 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -16.976 0.111 -11.773 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -16.812 1.841 -11.549 1.00 0.00 H new ATOM 1610 N PRO A 101 -14.541 -0.711 -7.512 1.00 0.00 N ATOM 1611 CA PRO A 101 -13.548 -1.175 -6.539 1.00 0.00 C ATOM 1612 C PRO A 101 -12.875 -2.466 -7.052 1.00 0.00 C ATOM 1613 O PRO A 101 -13.387 -3.570 -6.860 1.00 0.00 O ATOM 1614 CB PRO A 101 -14.353 -1.352 -5.241 1.00 0.00 C ATOM 1615 CG PRO A 101 -15.734 -1.755 -5.728 1.00 0.00 C ATOM 1616 CD PRO A 101 -15.885 -0.956 -7.012 1.00 0.00 C ATOM 0 HA PRO A 101 -12.719 -0.487 -6.374 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -13.915 -2.117 -4.599 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -14.386 -0.430 -4.661 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -15.802 -2.828 -5.909 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -16.508 -1.504 -5.002 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -16.476 -1.507 -7.744 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -16.405 -0.017 -6.825 1.00 0.00 H new ATOM 1624 N VAL A 102 -11.714 -2.350 -7.704 1.00 0.00 N ATOM 1625 CA VAL A 102 -10.994 -3.484 -8.277 1.00 0.00 C ATOM 1626 C VAL A 102 -10.130 -4.133 -7.211 1.00 0.00 C ATOM 1627 O VAL A 102 -9.069 -3.624 -6.839 1.00 0.00 O ATOM 1628 CB VAL A 102 -10.157 -3.074 -9.495 1.00 0.00 C ATOM 1629 CG1 VAL A 102 -9.485 -4.314 -10.106 1.00 0.00 C ATOM 1630 CG2 VAL A 102 -10.996 -2.385 -10.578 1.00 0.00 C ATOM 0 H VAL A 102 -11.246 -1.456 -7.849 1.00 0.00 H new ATOM 0 HA VAL A 102 -11.726 -4.210 -8.631 1.00 0.00 H new ATOM 0 HB VAL A 102 -9.410 -2.362 -9.142 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -8.892 -4.017 -10.971 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -8.837 -4.779 -9.364 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -10.249 -5.026 -10.417 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -10.356 -2.115 -11.418 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -11.777 -3.064 -10.921 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -11.453 -1.485 -10.167 1.00 0.00 H new ATOM 1640 N LYS A 103 -10.569 -5.301 -6.753 1.00 0.00 N ATOM 1641 CA LYS A 103 -9.924 -6.105 -5.722 1.00 0.00 C ATOM 1642 C LYS A 103 -8.451 -6.359 -5.993 1.00 0.00 C ATOM 1643 O LYS A 103 -7.686 -6.480 -5.042 1.00 0.00 O ATOM 1644 CB LYS A 103 -10.687 -7.426 -5.582 1.00 0.00 C ATOM 1645 CG LYS A 103 -12.178 -7.145 -5.355 1.00 0.00 C ATOM 1646 CD LYS A 103 -12.931 -8.334 -4.774 1.00 0.00 C ATOM 1647 CE LYS A 103 -14.425 -8.036 -4.954 1.00 0.00 C ATOM 1648 NZ LYS A 103 -15.306 -9.075 -4.409 1.00 0.00 N ATOM 0 H LYS A 103 -11.423 -5.732 -7.107 1.00 0.00 H new ATOM 0 HA LYS A 103 -9.958 -5.543 -4.789 1.00 0.00 H new ATOM 0 HB2 LYS A 103 -10.554 -8.030 -6.480 1.00 0.00 H new ATOM 0 HB3 LYS A 103 -10.285 -8.002 -4.748 1.00 0.00 H new ATOM 0 HG2 LYS A 103 -12.282 -6.293 -4.683 1.00 0.00 H new ATOM 0 HG3 LYS A 103 -12.636 -6.861 -6.302 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -12.655 -9.256 -5.287 1.00 0.00 H new ATOM 0 HD3 LYS A 103 -12.687 -8.470 -3.720 1.00 0.00 H new ATOM 0 HE2 LYS A 103 -14.657 -7.086 -4.472 1.00 0.00 H new ATOM 0 HE3 LYS A 103 -14.636 -7.914 -6.016 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 -16.298 -8.806 -4.566 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 -15.112 -9.979 -4.885 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 -15.133 -9.177 -3.389 1.00 0.00 H new ATOM 1662 N SER A 104 -8.041 -6.414 -7.261 1.00 0.00 N ATOM 1663 CA SER A 104 -6.652 -6.649 -7.634 1.00 0.00 C ATOM 1664 C SER A 104 -5.718 -5.498 -7.249 1.00 0.00 C ATOM 1665 O SER A 104 -4.496 -5.663 -7.312 1.00 0.00 O ATOM 1666 CB SER A 104 -6.585 -7.052 -9.111 1.00 0.00 C ATOM 1667 OG SER A 104 -7.208 -8.322 -9.214 1.00 0.00 O ATOM 0 H SER A 104 -8.667 -6.296 -8.058 1.00 0.00 H new ATOM 0 HA SER A 104 -6.267 -7.484 -7.048 1.00 0.00 H new ATOM 0 HB2 SER A 104 -7.095 -6.319 -9.736 1.00 0.00 H new ATOM 0 HB3 SER A 104 -5.551 -7.099 -9.453 1.00 0.00 H new ATOM 0 HG SER A 104 -7.190 -8.621 -10.147 1.00 0.00 H new ATOM 1673 N PHE A 105 -6.258 -4.349 -6.835 1.00 0.00 N ATOM 1674 CA PHE A 105 -5.476 -3.197 -6.415 1.00 0.00 C ATOM 1675 C PHE A 105 -5.816 -2.828 -4.953 1.00 0.00 C ATOM 1676 O PHE A 105 -5.058 -2.093 -4.327 1.00 0.00 O ATOM 1677 CB PHE A 105 -5.692 -2.006 -7.363 1.00 0.00 C ATOM 1678 CG PHE A 105 -6.121 -2.261 -8.802 1.00 0.00 C ATOM 1679 CD1 PHE A 105 -7.024 -1.363 -9.386 1.00 0.00 C ATOM 1680 CD2 PHE A 105 -5.605 -3.308 -9.589 1.00 0.00 C ATOM 1681 CE1 PHE A 105 -7.429 -1.502 -10.719 1.00 0.00 C ATOM 1682 CE2 PHE A 105 -6.032 -3.480 -10.918 1.00 0.00 C ATOM 1683 CZ PHE A 105 -6.942 -2.570 -11.485 1.00 0.00 C ATOM 0 H PHE A 105 -7.265 -4.197 -6.784 1.00 0.00 H new ATOM 0 HA PHE A 105 -4.419 -3.457 -6.463 1.00 0.00 H new ATOM 0 HB2 PHE A 105 -6.442 -1.359 -6.908 1.00 0.00 H new ATOM 0 HB3 PHE A 105 -4.760 -1.441 -7.395 1.00 0.00 H new ATOM 0 HD1 PHE A 105 -7.415 -0.547 -8.796 1.00 0.00 H new ATOM 0 HD2 PHE A 105 -4.875 -3.985 -9.169 1.00 0.00 H new ATOM 0 HE1 PHE A 105 -8.114 -0.790 -11.155 1.00 0.00 H new ATOM 0 HE2 PHE A 105 -5.662 -4.310 -11.502 1.00 0.00 H new ATOM 0 HZ PHE A 105 -7.265 -2.694 -12.508 1.00 0.00 H new ATOM 1693 N LEU A 106 -6.949 -3.294 -4.401 1.00 0.00 N ATOM 1694 CA LEU A 106 -7.383 -3.005 -3.033 1.00 0.00 C ATOM 1695 C LEU A 106 -6.638 -3.896 -2.038 1.00 0.00 C ATOM 1696 O LEU A 106 -6.266 -5.025 -2.373 1.00 0.00 O ATOM 1697 CB LEU A 106 -8.901 -3.231 -2.868 1.00 0.00 C ATOM 1698 CG LEU A 106 -9.858 -2.437 -3.783 1.00 0.00 C ATOM 1699 CD1 LEU A 106 -11.274 -2.524 -3.210 1.00 0.00 C ATOM 1700 CD2 LEU A 106 -9.454 -0.965 -3.939 1.00 0.00 C ATOM 0 H LEU A 106 -7.599 -3.894 -4.908 1.00 0.00 H new ATOM 0 HA LEU A 106 -7.157 -1.958 -2.833 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -9.099 -4.292 -3.020 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -9.162 -3.003 -1.835 1.00 0.00 H new ATOM 0 HG LEU A 106 -9.809 -2.883 -4.777 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -11.960 -1.967 -3.848 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -11.586 -3.568 -3.167 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -11.287 -2.100 -2.206 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -10.165 -0.460 -4.593 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -9.454 -0.482 -2.962 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -8.456 -0.906 -4.373 1.00 0.00 H new ATOM 1712 N PHE A 107 -6.497 -3.439 -0.789 1.00 0.00 N ATOM 1713 CA PHE A 107 -5.801 -4.180 0.262 1.00 0.00 C ATOM 1714 C PHE A 107 -6.528 -4.043 1.595 1.00 0.00 C ATOM 1715 O PHE A 107 -6.950 -2.943 1.950 1.00 0.00 O ATOM 1716 CB PHE A 107 -4.366 -3.667 0.411 1.00 0.00 C ATOM 1717 CG PHE A 107 -3.453 -3.964 -0.765 1.00 0.00 C ATOM 1718 CD1 PHE A 107 -3.415 -3.103 -1.876 1.00 0.00 C ATOM 1719 CD2 PHE A 107 -2.630 -5.105 -0.754 1.00 0.00 C ATOM 1720 CE1 PHE A 107 -2.581 -3.392 -2.971 1.00 0.00 C ATOM 1721 CE2 PHE A 107 -1.794 -5.390 -1.849 1.00 0.00 C ATOM 1722 CZ PHE A 107 -1.762 -4.531 -2.958 1.00 0.00 C ATOM 0 H PHE A 107 -6.865 -2.540 -0.480 1.00 0.00 H new ATOM 0 HA PHE A 107 -5.783 -5.232 -0.024 1.00 0.00 H new ATOM 0 HB2 PHE A 107 -4.396 -2.588 0.565 1.00 0.00 H new ATOM 0 HB3 PHE A 107 -3.931 -4.105 1.309 1.00 0.00 H new ATOM 0 HD1 PHE A 107 -4.030 -2.215 -1.889 1.00 0.00 H new ATOM 0 HD2 PHE A 107 -2.640 -5.766 0.100 1.00 0.00 H new ATOM 0 HE1 PHE A 107 -2.571 -2.733 -3.827 1.00 0.00 H new ATOM 0 HE2 PHE A 107 -1.174 -6.274 -1.836 1.00 0.00 H new ATOM 0 HZ PHE A 107 -1.113 -4.745 -3.794 1.00 0.00 H new ATOM 1732 N TYR A 108 -6.719 -5.155 2.309 1.00 0.00 N ATOM 1733 CA TYR A 108 -7.364 -5.178 3.609 1.00 0.00 C ATOM 1734 C TYR A 108 -6.360 -4.652 4.632 1.00 0.00 C ATOM 1735 O TYR A 108 -5.253 -5.178 4.759 1.00 0.00 O ATOM 1736 CB TYR A 108 -7.804 -6.587 4.030 1.00 0.00 C ATOM 1737 CG TYR A 108 -8.909 -7.237 3.224 1.00 0.00 C ATOM 1738 CD1 TYR A 108 -8.641 -8.391 2.466 1.00 0.00 C ATOM 1739 CD2 TYR A 108 -10.225 -6.748 3.303 1.00 0.00 C ATOM 1740 CE1 TYR A 108 -9.678 -9.044 1.779 1.00 0.00 C ATOM 1741 CE2 TYR A 108 -11.271 -7.394 2.621 1.00 0.00 C ATOM 1742 CZ TYR A 108 -10.997 -8.549 1.850 1.00 0.00 C ATOM 1743 OH TYR A 108 -11.994 -9.181 1.170 1.00 0.00 O ATOM 0 H TYR A 108 -6.422 -6.076 1.988 1.00 0.00 H new ATOM 0 HA TYR A 108 -8.263 -4.563 3.555 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -6.931 -7.239 3.993 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -8.126 -6.544 5.071 1.00 0.00 H new ATOM 0 HD1 TYR A 108 -7.634 -8.777 2.412 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -10.434 -5.868 3.893 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -9.465 -9.927 1.195 1.00 0.00 H new ATOM 0 HE2 TYR A 108 -12.279 -7.011 2.685 1.00 0.00 H new ATOM 0 HH TYR A 108 -11.687 -10.068 0.890 1.00 0.00 H new ATOM 1753 N HIS A 109 -6.753 -3.596 5.337 1.00 0.00 N ATOM 1754 CA HIS A 109 -6.002 -2.929 6.380 1.00 0.00 C ATOM 1755 C HIS A 109 -6.100 -3.834 7.601 1.00 0.00 C ATOM 1756 O HIS A 109 -7.168 -3.926 8.224 1.00 0.00 O ATOM 1757 CB HIS A 109 -6.632 -1.559 6.673 1.00 0.00 C ATOM 1758 CG HIS A 109 -5.701 -0.475 7.137 1.00 0.00 C ATOM 1759 ND1 HIS A 109 -4.786 -0.531 8.163 1.00 0.00 N ATOM 1760 CD2 HIS A 109 -5.740 0.815 6.689 1.00 0.00 C ATOM 1761 CE1 HIS A 109 -4.289 0.712 8.307 1.00 0.00 C ATOM 1762 NE2 HIS A 109 -4.839 1.567 7.431 1.00 0.00 N ATOM 0 H HIS A 109 -7.662 -3.161 5.181 1.00 0.00 H new ATOM 0 HA HIS A 109 -4.964 -2.759 6.095 1.00 0.00 H new ATOM 0 HB2 HIS A 109 -7.132 -1.214 5.768 1.00 0.00 H new ATOM 0 HB3 HIS A 109 -7.403 -1.694 7.432 1.00 0.00 H new ATOM 0 HD2 HIS A 109 -6.366 1.187 5.892 1.00 0.00 H new ATOM 0 HE1 HIS A 109 -3.541 0.987 9.036 1.00 0.00 H new ATOM 0 HE2 HIS A 109 -4.637 2.562 7.331 1.00 0.00 H new ATOM 1770 N SER A 110 -5.025 -4.556 7.878 1.00 0.00 N ATOM 1771 CA SER A 110 -4.921 -5.454 9.004 1.00 0.00 C ATOM 1772 C SER A 110 -4.126 -4.715 10.079 1.00 0.00 C ATOM 1773 O SER A 110 -3.726 -3.554 9.891 1.00 0.00 O ATOM 1774 CB SER A 110 -4.301 -6.777 8.542 1.00 0.00 C ATOM 1775 OG SER A 110 -4.404 -7.772 9.541 1.00 0.00 O ATOM 0 H SER A 110 -4.181 -4.528 7.306 1.00 0.00 H new ATOM 0 HA SER A 110 -5.886 -5.728 9.431 1.00 0.00 H new ATOM 0 HB2 SER A 110 -4.800 -7.117 7.635 1.00 0.00 H new ATOM 0 HB3 SER A 110 -3.252 -6.620 8.289 1.00 0.00 H new ATOM 0 HG SER A 110 -4.001 -8.604 9.216 1.00 0.00 H new ATOM 1781 N GLN A 111 -3.944 -5.355 11.230 1.00 0.00 N ATOM 1782 CA GLN A 111 -3.218 -4.791 12.351 1.00 0.00 C ATOM 1783 C GLN A 111 -2.547 -5.871 13.180 1.00 0.00 C ATOM 1784 O GLN A 111 -3.012 -7.009 13.212 1.00 0.00 O ATOM 1785 CB GLN A 111 -4.129 -3.888 13.206 1.00 0.00 C ATOM 1786 CG GLN A 111 -5.643 -4.171 13.195 1.00 0.00 C ATOM 1787 CD GLN A 111 -6.062 -5.596 13.563 1.00 0.00 C ATOM 1788 OE1 GLN A 111 -6.717 -6.275 12.772 1.00 0.00 O ATOM 1789 NE2 GLN A 111 -5.740 -6.068 14.754 1.00 0.00 N ATOM 0 H GLN A 111 -4.304 -6.293 11.408 1.00 0.00 H new ATOM 0 HA GLN A 111 -2.423 -4.161 11.950 1.00 0.00 H new ATOM 0 HB2 GLN A 111 -3.785 -3.949 14.239 1.00 0.00 H new ATOM 0 HB3 GLN A 111 -3.979 -2.859 12.880 1.00 0.00 H new ATOM 0 HG2 GLN A 111 -6.126 -3.481 13.887 1.00 0.00 H new ATOM 0 HG3 GLN A 111 -6.027 -3.946 12.200 1.00 0.00 H new ATOM 0 HE21 GLN A 111 -5.197 -5.495 15.400 1.00 0.00 H new ATOM 0 HE22 GLN A 111 -6.034 -7.005 15.028 1.00 0.00 H new ATOM 1798 N SER A 112 -1.500 -5.477 13.906 1.00 0.00 N ATOM 1799 CA SER A 112 -0.707 -6.365 14.747 1.00 0.00 C ATOM 1800 C SER A 112 -0.463 -5.801 16.156 1.00 0.00 C ATOM 1801 O SER A 112 0.651 -5.822 16.686 1.00 0.00 O ATOM 1802 CB SER A 112 0.563 -6.745 13.982 1.00 0.00 C ATOM 1803 OG SER A 112 1.335 -5.617 13.609 1.00 0.00 O ATOM 0 H SER A 112 -1.175 -4.510 13.924 1.00 0.00 H new ATOM 0 HA SER A 112 -1.265 -7.279 14.948 1.00 0.00 H new ATOM 0 HB2 SER A 112 1.170 -7.407 14.600 1.00 0.00 H new ATOM 0 HB3 SER A 112 0.290 -7.305 13.088 1.00 0.00 H new ATOM 0 HG SER A 112 2.249 -5.901 13.397 1.00 0.00 H new ATOM 1809 N GLY A 113 -1.487 -5.208 16.770 1.00 0.00 N ATOM 1810 CA GLY A 113 -1.392 -4.667 18.119 1.00 0.00 C ATOM 1811 C GLY A 113 -1.040 -3.193 18.154 1.00 0.00 C ATOM 1812 O GLY A 113 -1.773 -2.415 18.762 1.00 0.00 O ATOM 0 H GLY A 113 -2.406 -5.091 16.342 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -2.343 -4.818 18.631 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -0.639 -5.226 18.674 1.00 0.00 H new ATOM 1816 N ARG A 114 0.062 -2.784 17.525 1.00 0.00 N ATOM 1817 CA ARG A 114 0.482 -1.372 17.486 1.00 0.00 C ATOM 1818 C ARG A 114 0.827 -0.917 16.076 1.00 0.00 C ATOM 1819 O ARG A 114 1.241 0.228 15.881 1.00 0.00 O ATOM 1820 CB ARG A 114 1.656 -1.152 18.460 1.00 0.00 C ATOM 1821 CG ARG A 114 1.259 -0.305 19.686 1.00 0.00 C ATOM 1822 CD ARG A 114 2.010 -0.689 20.969 1.00 0.00 C ATOM 1823 NE ARG A 114 1.357 -1.822 21.641 1.00 0.00 N ATOM 1824 CZ ARG A 114 1.359 -2.108 22.947 1.00 0.00 C ATOM 1825 NH1 ARG A 114 2.100 -1.429 23.814 1.00 0.00 N ATOM 1826 NH2 ARG A 114 0.577 -3.083 23.381 1.00 0.00 N ATOM 0 H ARG A 114 0.691 -3.415 17.028 1.00 0.00 H new ATOM 0 HA ARG A 114 -0.358 -0.756 17.806 1.00 0.00 H new ATOM 0 HB2 ARG A 114 2.030 -2.119 18.797 1.00 0.00 H new ATOM 0 HB3 ARG A 114 2.473 -0.660 17.933 1.00 0.00 H new ATOM 0 HG2 ARG A 114 1.446 0.746 19.467 1.00 0.00 H new ATOM 0 HG3 ARG A 114 0.188 -0.409 19.857 1.00 0.00 H new ATOM 0 HD2 ARG A 114 3.041 -0.949 20.728 1.00 0.00 H new ATOM 0 HD3 ARG A 114 2.047 0.167 21.643 1.00 0.00 H new ATOM 0 HE ARG A 114 0.842 -2.465 21.040 1.00 0.00 H new ATOM 0 HH11 ARG A 114 2.691 -0.663 23.490 1.00 0.00 H new ATOM 0 HH12 ARG A 114 2.078 -1.673 24.804 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -0.009 -3.597 22.724 1.00 0.00 H new ATOM 0 HH22 ARG A 114 0.561 -3.320 24.373 1.00 0.00 H new ATOM 1840 N ASN A 115 0.668 -1.804 15.093 1.00 0.00 N ATOM 1841 CA ASN A 115 0.984 -1.516 13.712 1.00 0.00 C ATOM 1842 C ASN A 115 -0.123 -1.981 12.787 1.00 0.00 C ATOM 1843 O ASN A 115 -1.080 -2.627 13.221 1.00 0.00 O ATOM 1844 CB ASN A 115 2.339 -2.149 13.371 1.00 0.00 C ATOM 1845 CG ASN A 115 3.434 -1.392 14.097 1.00 0.00 C ATOM 1846 OD1 ASN A 115 3.807 -0.312 13.664 1.00 0.00 O ATOM 1847 ND2 ASN A 115 3.907 -1.880 15.227 1.00 0.00 N ATOM 0 H ASN A 115 0.313 -2.748 15.244 1.00 0.00 H new ATOM 0 HA ASN A 115 1.061 -0.438 13.568 1.00 0.00 H new ATOM 0 HB2 ASN A 115 2.349 -3.199 13.665 1.00 0.00 H new ATOM 0 HB3 ASN A 115 2.509 -2.117 12.295 1.00 0.00 H new ATOM 0 HD21 ASN A 115 4.599 -1.354 15.760 1.00 0.00 H new ATOM 0 HD22 ASN A 115 3.580 -2.784 15.568 1.00 0.00 H new ATOM 1854 N SER A 116 0.002 -1.646 11.506 1.00 0.00 N ATOM 1855 CA SER A 116 -0.930 -1.981 10.445 1.00 0.00 C ATOM 1856 C SER A 116 -0.243 -2.871 9.425 1.00 0.00 C ATOM 1857 O SER A 116 0.977 -2.792 9.272 1.00 0.00 O ATOM 1858 CB SER A 116 -1.343 -0.706 9.718 1.00 0.00 C ATOM 1859 OG SER A 116 -1.684 0.351 10.591 1.00 0.00 O ATOM 0 H SER A 116 0.798 -1.106 11.167 1.00 0.00 H new ATOM 0 HA SER A 116 -1.792 -2.484 10.882 1.00 0.00 H new ATOM 0 HB2 SER A 116 -0.527 -0.384 9.071 1.00 0.00 H new ATOM 0 HB3 SER A 116 -2.194 -0.924 9.073 1.00 0.00 H new ATOM 0 HG SER A 116 -1.782 1.180 10.078 1.00 0.00 H new ATOM 1865 N THR A 117 -1.015 -3.685 8.715 1.00 0.00 N ATOM 1866 CA THR A 117 -0.540 -4.596 7.674 1.00 0.00 C ATOM 1867 C THR A 117 -1.489 -4.424 6.490 1.00 0.00 C ATOM 1868 O THR A 117 -2.562 -3.829 6.644 1.00 0.00 O ATOM 1869 CB THR A 117 -0.488 -6.073 8.123 1.00 0.00 C ATOM 1870 OG1 THR A 117 -0.680 -6.242 9.520 1.00 0.00 O ATOM 1871 CG2 THR A 117 0.803 -6.773 7.695 1.00 0.00 C ATOM 0 H THR A 117 -2.025 -3.733 8.851 1.00 0.00 H new ATOM 0 HA THR A 117 0.490 -4.347 7.418 1.00 0.00 H new ATOM 0 HB THR A 117 -1.326 -6.544 7.610 1.00 0.00 H new ATOM 0 HG1 THR A 117 -0.638 -7.195 9.743 1.00 0.00 H new ATOM 0 HG21 THR A 117 0.786 -7.808 8.037 1.00 0.00 H new ATOM 0 HG22 THR A 117 0.886 -6.751 6.608 1.00 0.00 H new ATOM 0 HG23 THR A 117 1.658 -6.260 8.135 1.00 0.00 H new ATOM 1879 N PHE A 118 -1.125 -4.972 5.331 1.00 0.00 N ATOM 1880 CA PHE A 118 -1.935 -4.844 4.125 1.00 0.00 C ATOM 1881 C PHE A 118 -1.966 -6.169 3.375 1.00 0.00 C ATOM 1882 O PHE A 118 -0.938 -6.612 2.861 1.00 0.00 O ATOM 1883 CB PHE A 118 -1.381 -3.689 3.290 1.00 0.00 C ATOM 1884 CG PHE A 118 -1.328 -2.361 4.035 1.00 0.00 C ATOM 1885 CD1 PHE A 118 -2.516 -1.730 4.459 1.00 0.00 C ATOM 1886 CD2 PHE A 118 -0.083 -1.780 4.352 1.00 0.00 C ATOM 1887 CE1 PHE A 118 -2.453 -0.553 5.229 1.00 0.00 C ATOM 1888 CE2 PHE A 118 -0.029 -0.601 5.119 1.00 0.00 C ATOM 1889 CZ PHE A 118 -1.211 0.005 5.578 1.00 0.00 C ATOM 0 H PHE A 118 -0.269 -5.512 5.204 1.00 0.00 H new ATOM 0 HA PHE A 118 -2.971 -4.610 4.369 1.00 0.00 H new ATOM 0 HB2 PHE A 118 -0.377 -3.946 2.953 1.00 0.00 H new ATOM 0 HB3 PHE A 118 -1.996 -3.570 2.398 1.00 0.00 H new ATOM 0 HD1 PHE A 118 -3.475 -2.150 4.193 1.00 0.00 H new ATOM 0 HD2 PHE A 118 0.831 -2.240 4.006 1.00 0.00 H new ATOM 0 HE1 PHE A 118 -3.366 -0.075 5.554 1.00 0.00 H new ATOM 0 HE2 PHE A 118 0.927 -0.159 5.356 1.00 0.00 H new ATOM 0 HZ PHE A 118 -1.165 0.891 6.193 1.00 0.00 H new ATOM 1899 N GLU A 119 -3.134 -6.804 3.326 1.00 0.00 N ATOM 1900 CA GLU A 119 -3.403 -8.096 2.705 1.00 0.00 C ATOM 1901 C GLU A 119 -4.163 -7.888 1.392 1.00 0.00 C ATOM 1902 O GLU A 119 -5.250 -7.311 1.405 1.00 0.00 O ATOM 1903 CB GLU A 119 -4.206 -8.878 3.751 1.00 0.00 C ATOM 1904 CG GLU A 119 -4.629 -10.307 3.444 1.00 0.00 C ATOM 1905 CD GLU A 119 -5.518 -10.847 4.575 1.00 0.00 C ATOM 1906 OE1 GLU A 119 -6.732 -11.062 4.337 1.00 0.00 O ATOM 1907 OE2 GLU A 119 -5.017 -11.144 5.684 1.00 0.00 O ATOM 0 H GLU A 119 -3.972 -6.403 3.747 1.00 0.00 H new ATOM 0 HA GLU A 119 -2.502 -8.647 2.435 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -3.617 -8.900 4.668 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -5.109 -8.307 3.966 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -5.170 -10.340 2.498 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -3.748 -10.939 3.329 1.00 0.00 H new ATOM 1914 N SER A 120 -3.584 -8.288 0.254 1.00 0.00 N ATOM 1915 CA SER A 120 -4.217 -8.150 -1.065 1.00 0.00 C ATOM 1916 C SER A 120 -5.642 -8.725 -1.076 1.00 0.00 C ATOM 1917 O SER A 120 -5.840 -9.909 -0.808 1.00 0.00 O ATOM 1918 CB SER A 120 -3.331 -8.806 -2.126 1.00 0.00 C ATOM 1919 OG SER A 120 -3.932 -8.805 -3.409 1.00 0.00 O ATOM 0 H SER A 120 -2.660 -8.718 0.221 1.00 0.00 H new ATOM 0 HA SER A 120 -4.315 -7.090 -1.298 1.00 0.00 H new ATOM 0 HB2 SER A 120 -2.377 -8.280 -2.174 1.00 0.00 H new ATOM 0 HB3 SER A 120 -3.114 -9.833 -1.830 1.00 0.00 H new ATOM 0 HG SER A 120 -3.376 -8.290 -4.030 1.00 0.00 H new ATOM 1925 N VAL A 121 -6.642 -7.904 -1.420 1.00 0.00 N ATOM 1926 CA VAL A 121 -8.037 -8.345 -1.451 1.00 0.00 C ATOM 1927 C VAL A 121 -8.235 -9.414 -2.536 1.00 0.00 C ATOM 1928 O VAL A 121 -8.882 -10.436 -2.282 1.00 0.00 O ATOM 1929 CB VAL A 121 -8.958 -7.121 -1.645 1.00 0.00 C ATOM 1930 CG1 VAL A 121 -10.438 -7.487 -1.791 1.00 0.00 C ATOM 1931 CG2 VAL A 121 -8.876 -6.136 -0.469 1.00 0.00 C ATOM 0 H VAL A 121 -6.507 -6.927 -1.681 1.00 0.00 H new ATOM 0 HA VAL A 121 -8.304 -8.811 -0.502 1.00 0.00 H new ATOM 0 HB VAL A 121 -8.592 -6.669 -2.567 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -11.026 -6.579 -1.924 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -10.569 -8.134 -2.658 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -10.774 -8.009 -0.895 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -9.542 -5.293 -0.653 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -9.175 -6.640 0.450 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -7.853 -5.775 -0.368 1.00 0.00 H new ATOM 1941 N ALA A 122 -7.696 -9.203 -3.743 1.00 0.00 N ATOM 1942 CA ALA A 122 -7.852 -10.175 -4.820 1.00 0.00 C ATOM 1943 C ALA A 122 -7.114 -11.485 -4.534 1.00 0.00 C ATOM 1944 O ALA A 122 -7.604 -12.551 -4.919 1.00 0.00 O ATOM 1945 CB ALA A 122 -7.319 -9.667 -6.153 1.00 0.00 C ATOM 0 H ALA A 122 -7.154 -8.375 -3.992 1.00 0.00 H new ATOM 0 HA ALA A 122 -8.928 -10.340 -4.877 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -7.461 -10.431 -6.917 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -7.857 -8.763 -6.439 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -6.257 -9.442 -6.058 1.00 0.00 H new ATOM 1951 N PHE A 123 -5.922 -11.424 -3.936 1.00 0.00 N ATOM 1952 CA PHE A 123 -5.115 -12.602 -3.618 1.00 0.00 C ATOM 1953 C PHE A 123 -4.799 -12.600 -2.119 1.00 0.00 C ATOM 1954 O PHE A 123 -3.709 -12.171 -1.728 1.00 0.00 O ATOM 1955 CB PHE A 123 -3.889 -12.694 -4.534 1.00 0.00 C ATOM 1956 CG PHE A 123 -4.171 -13.439 -5.822 1.00 0.00 C ATOM 1957 CD1 PHE A 123 -4.285 -12.740 -7.039 1.00 0.00 C ATOM 1958 CD2 PHE A 123 -4.328 -14.842 -5.799 1.00 0.00 C ATOM 1959 CE1 PHE A 123 -4.556 -13.446 -8.223 1.00 0.00 C ATOM 1960 CE2 PHE A 123 -4.590 -15.539 -6.993 1.00 0.00 C ATOM 1961 CZ PHE A 123 -4.708 -14.843 -8.206 1.00 0.00 C ATOM 0 H PHE A 123 -5.486 -10.545 -3.656 1.00 0.00 H new ATOM 0 HA PHE A 123 -5.672 -13.517 -3.819 1.00 0.00 H new ATOM 0 HB2 PHE A 123 -3.542 -11.688 -4.770 1.00 0.00 H new ATOM 0 HB3 PHE A 123 -3.080 -13.193 -4.001 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -4.165 -11.667 -7.062 1.00 0.00 H new ATOM 0 HD2 PHE A 123 -4.247 -15.380 -4.866 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -4.648 -12.910 -9.156 1.00 0.00 H new ATOM 0 HE2 PHE A 123 -4.701 -16.613 -6.976 1.00 0.00 H new ATOM 0 HZ PHE A 123 -4.914 -15.378 -9.121 1.00 0.00 H new ATOM 1971 N PRO A 124 -5.755 -13.051 -1.285 1.00 0.00 N ATOM 1972 CA PRO A 124 -5.629 -13.102 0.168 1.00 0.00 C ATOM 1973 C PRO A 124 -4.562 -14.127 0.590 1.00 0.00 C ATOM 1974 O PRO A 124 -4.448 -15.198 -0.015 1.00 0.00 O ATOM 1975 CB PRO A 124 -7.020 -13.481 0.667 1.00 0.00 C ATOM 1976 CG PRO A 124 -7.613 -14.283 -0.480 1.00 0.00 C ATOM 1977 CD PRO A 124 -7.050 -13.578 -1.695 1.00 0.00 C ATOM 0 HA PRO A 124 -5.301 -12.154 0.593 1.00 0.00 H new ATOM 0 HB2 PRO A 124 -6.969 -14.070 1.583 1.00 0.00 H new ATOM 0 HB3 PRO A 124 -7.619 -12.598 0.889 1.00 0.00 H new ATOM 0 HG2 PRO A 124 -7.312 -15.330 -0.442 1.00 0.00 H new ATOM 0 HG3 PRO A 124 -8.703 -14.264 -0.468 1.00 0.00 H new ATOM 0 HD2 PRO A 124 -6.944 -14.267 -2.533 1.00 0.00 H new ATOM 0 HD3 PRO A 124 -7.712 -12.777 -2.023 1.00 0.00 H new ATOM 1985 N GLY A 125 -3.823 -13.799 1.648 1.00 0.00 N ATOM 1986 CA GLY A 125 -2.739 -14.562 2.275 1.00 0.00 C ATOM 1987 C GLY A 125 -1.368 -13.882 2.140 1.00 0.00 C ATOM 1988 O GLY A 125 -0.471 -14.137 2.936 1.00 0.00 O ATOM 0 H GLY A 125 -3.979 -12.915 2.133 1.00 0.00 H new ATOM 0 HA2 GLY A 125 -2.966 -14.703 3.332 1.00 0.00 H new ATOM 0 HA3 GLY A 125 -2.692 -15.553 1.824 1.00 0.00 H new ATOM 1992 N TRP A 126 -1.192 -12.999 1.152 1.00 0.00 N ATOM 1993 CA TRP A 126 0.039 -12.259 0.870 1.00 0.00 C ATOM 1994 C TRP A 126 -0.017 -10.843 1.431 1.00 0.00 C ATOM 1995 O TRP A 126 -0.967 -10.107 1.151 1.00 0.00 O ATOM 1996 CB TRP A 126 0.232 -12.196 -0.642 1.00 0.00 C ATOM 1997 CG TRP A 126 0.661 -13.481 -1.278 1.00 0.00 C ATOM 1998 CD1 TRP A 126 1.939 -13.872 -1.501 1.00 0.00 C ATOM 1999 CD2 TRP A 126 -0.183 -14.570 -1.760 1.00 0.00 C ATOM 2000 NE1 TRP A 126 1.938 -15.118 -2.097 1.00 0.00 N ATOM 2001 CE2 TRP A 126 0.656 -15.576 -2.315 1.00 0.00 C ATOM 2002 CE3 TRP A 126 -1.573 -14.814 -1.795 1.00 0.00 C ATOM 2003 CZ2 TRP A 126 0.132 -16.723 -2.926 1.00 0.00 C ATOM 2004 CZ3 TRP A 126 -2.109 -15.971 -2.393 1.00 0.00 C ATOM 2005 CH2 TRP A 126 -1.257 -16.926 -2.970 1.00 0.00 C ATOM 0 H TRP A 126 -1.940 -12.771 0.497 1.00 0.00 H new ATOM 0 HA TRP A 126 0.872 -12.775 1.347 1.00 0.00 H new ATOM 0 HB2 TRP A 126 -0.704 -11.876 -1.100 1.00 0.00 H new ATOM 0 HB3 TRP A 126 0.975 -11.431 -0.867 1.00 0.00 H new ATOM 0 HD1 TRP A 126 2.820 -13.299 -1.252 1.00 0.00 H new ATOM 0 HE1 TRP A 126 2.781 -15.635 -2.345 1.00 0.00 H new ATOM 0 HE3 TRP A 126 -2.244 -14.094 -1.351 1.00 0.00 H new ATOM 0 HZ2 TRP A 126 0.797 -17.452 -3.364 1.00 0.00 H new ATOM 0 HZ3 TRP A 126 -3.178 -16.124 -2.408 1.00 0.00 H new ATOM 0 HH2 TRP A 126 -1.665 -17.807 -3.443 1.00 0.00 H new ATOM 2016 N PHE A 127 1.022 -10.406 2.135 1.00 0.00 N ATOM 2017 CA PHE A 127 1.110 -9.085 2.738 1.00 0.00 C ATOM 2018 C PHE A 127 2.173 -8.244 2.036 1.00 0.00 C ATOM 2019 O PHE A 127 3.223 -8.755 1.651 1.00 0.00 O ATOM 2020 CB PHE A 127 1.412 -9.218 4.234 1.00 0.00 C ATOM 2021 CG PHE A 127 0.323 -9.943 4.999 1.00 0.00 C ATOM 2022 CD1 PHE A 127 0.296 -11.352 5.027 1.00 0.00 C ATOM 2023 CD2 PHE A 127 -0.697 -9.213 5.641 1.00 0.00 C ATOM 2024 CE1 PHE A 127 -0.735 -12.019 5.708 1.00 0.00 C ATOM 2025 CE2 PHE A 127 -1.709 -9.890 6.343 1.00 0.00 C ATOM 2026 CZ PHE A 127 -1.729 -11.292 6.386 1.00 0.00 C ATOM 0 H PHE A 127 1.848 -10.979 2.305 1.00 0.00 H new ATOM 0 HA PHE A 127 0.154 -8.575 2.621 1.00 0.00 H new ATOM 0 HB2 PHE A 127 2.354 -9.751 4.362 1.00 0.00 H new ATOM 0 HB3 PHE A 127 1.547 -8.224 4.661 1.00 0.00 H new ATOM 0 HD1 PHE A 127 1.067 -11.918 4.525 1.00 0.00 H new ATOM 0 HD2 PHE A 127 -0.701 -8.134 5.594 1.00 0.00 H new ATOM 0 HE1 PHE A 127 -0.765 -13.099 5.711 1.00 0.00 H new ATOM 0 HE2 PHE A 127 -2.477 -9.327 6.853 1.00 0.00 H new ATOM 0 HZ PHE A 127 -2.502 -11.809 6.936 1.00 0.00 H new ATOM 2036 N ILE A 128 1.905 -6.951 1.870 1.00 0.00 N ATOM 2037 CA ILE A 128 2.832 -6.023 1.229 1.00 0.00 C ATOM 2038 C ILE A 128 3.970 -5.749 2.197 1.00 0.00 C ATOM 2039 O ILE A 128 3.689 -5.473 3.365 1.00 0.00 O ATOM 2040 CB ILE A 128 2.188 -4.646 0.919 1.00 0.00 C ATOM 2041 CG1 ILE A 128 0.733 -4.685 0.418 1.00 0.00 C ATOM 2042 CG2 ILE A 128 3.017 -3.855 -0.102 1.00 0.00 C ATOM 2043 CD1 ILE A 128 0.163 -3.279 0.183 1.00 0.00 C ATOM 0 H ILE A 128 1.035 -6.516 2.178 1.00 0.00 H new ATOM 0 HA ILE A 128 3.153 -6.484 0.295 1.00 0.00 H new ATOM 0 HB ILE A 128 2.176 -4.157 1.893 1.00 0.00 H new ATOM 0 HG12 ILE A 128 0.685 -5.254 -0.510 1.00 0.00 H new ATOM 0 HG13 ILE A 128 0.114 -5.209 1.146 1.00 0.00 H new ATOM 0 HG21 ILE A 128 2.537 -2.896 -0.296 1.00 0.00 H new ATOM 0 HG22 ILE A 128 4.018 -3.686 0.295 1.00 0.00 H new ATOM 0 HG23 ILE A 128 3.086 -4.421 -1.031 1.00 0.00 H new ATOM 0 HD11 ILE A 128 -0.865 -3.358 -0.170 1.00 0.00 H new ATOM 0 HD12 ILE A 128 0.184 -2.717 1.117 1.00 0.00 H new ATOM 0 HD13 ILE A 128 0.765 -2.763 -0.565 1.00 0.00 H new ATOM 2055 N ALA A 129 5.222 -5.790 1.741 1.00 0.00 N ATOM 2056 CA ALA A 129 6.337 -5.462 2.623 1.00 0.00 C ATOM 2057 C ALA A 129 6.813 -4.042 2.266 1.00 0.00 C ATOM 2058 O ALA A 129 6.733 -3.637 1.106 1.00 0.00 O ATOM 2059 CB ALA A 129 7.424 -6.522 2.543 1.00 0.00 C ATOM 0 H ALA A 129 5.484 -6.041 0.788 1.00 0.00 H new ATOM 0 HA ALA A 129 6.031 -5.462 3.669 1.00 0.00 H new ATOM 0 HB1 ALA A 129 8.244 -6.254 3.210 1.00 0.00 H new ATOM 0 HB2 ALA A 129 7.014 -7.487 2.842 1.00 0.00 H new ATOM 0 HB3 ALA A 129 7.795 -6.586 1.520 1.00 0.00 H new ATOM 2065 N VAL A 130 7.312 -3.265 3.226 1.00 0.00 N ATOM 2066 CA VAL A 130 7.792 -1.886 3.042 1.00 0.00 C ATOM 2067 C VAL A 130 9.283 -1.768 2.732 1.00 0.00 C ATOM 2068 O VAL A 130 9.703 -0.705 2.259 1.00 0.00 O ATOM 2069 CB VAL A 130 7.583 -1.080 4.349 1.00 0.00 C ATOM 2070 CG1 VAL A 130 6.117 -0.712 4.598 1.00 0.00 C ATOM 2071 CG2 VAL A 130 8.129 -1.768 5.597 1.00 0.00 C ATOM 0 H VAL A 130 7.399 -3.585 4.191 1.00 0.00 H new ATOM 0 HA VAL A 130 7.221 -1.509 2.193 1.00 0.00 H new ATOM 0 HB VAL A 130 8.160 -0.171 4.179 1.00 0.00 H new ATOM 0 HG11 VAL A 130 6.036 -0.149 5.528 1.00 0.00 H new ATOM 0 HG12 VAL A 130 5.749 -0.103 3.772 1.00 0.00 H new ATOM 0 HG13 VAL A 130 5.521 -1.622 4.672 1.00 0.00 H new ATOM 0 HG21 VAL A 130 7.944 -1.141 6.469 1.00 0.00 H new ATOM 0 HG22 VAL A 130 7.632 -2.729 5.729 1.00 0.00 H new ATOM 0 HG23 VAL A 130 9.202 -1.926 5.485 1.00 0.00 H new ATOM 2081 N SER A 131 10.029 -2.844 3.010 1.00 0.00 N ATOM 2082 CA SER A 131 11.480 -2.953 2.865 1.00 0.00 C ATOM 2083 C SER A 131 12.106 -1.932 3.810 1.00 0.00 C ATOM 2084 O SER A 131 12.362 -0.785 3.435 1.00 0.00 O ATOM 2085 CB SER A 131 12.031 -2.767 1.445 1.00 0.00 C ATOM 2086 OG SER A 131 11.155 -3.168 0.414 1.00 0.00 O ATOM 0 H SER A 131 9.611 -3.706 3.361 1.00 0.00 H new ATOM 0 HA SER A 131 11.745 -3.981 3.111 1.00 0.00 H new ATOM 0 HB2 SER A 131 12.281 -1.716 1.302 1.00 0.00 H new ATOM 0 HB3 SER A 131 12.959 -3.331 1.354 1.00 0.00 H new ATOM 0 HG SER A 131 11.606 -3.079 -0.452 1.00 0.00 H new ATOM 2092 N SER A 132 12.391 -2.337 5.041 1.00 0.00 N ATOM 2093 CA SER A 132 13.000 -1.455 6.040 1.00 0.00 C ATOM 2094 C SER A 132 14.453 -1.816 6.306 1.00 0.00 C ATOM 2095 O SER A 132 15.082 -1.213 7.173 1.00 0.00 O ATOM 2096 CB SER A 132 12.133 -1.259 7.295 1.00 0.00 C ATOM 2097 OG SER A 132 10.888 -1.902 7.219 1.00 0.00 O ATOM 0 H SER A 132 12.209 -3.282 5.379 1.00 0.00 H new ATOM 0 HA SER A 132 13.034 -0.456 5.606 1.00 0.00 H new ATOM 0 HB2 SER A 132 12.675 -1.634 8.164 1.00 0.00 H new ATOM 0 HB3 SER A 132 11.974 -0.193 7.454 1.00 0.00 H new ATOM 0 HG SER A 132 10.229 -1.403 7.746 1.00 0.00 H new ATOM 2103 N GLU A 133 15.008 -2.735 5.513 1.00 0.00 N ATOM 2104 CA GLU A 133 16.368 -3.217 5.648 1.00 0.00 C ATOM 2105 C GLU A 133 17.025 -3.283 4.291 1.00 0.00 C ATOM 2106 O GLU A 133 16.331 -3.608 3.314 1.00 0.00 O ATOM 2107 CB GLU A 133 16.343 -4.633 6.199 1.00 0.00 C ATOM 2108 CG GLU A 133 15.699 -4.671 7.592 1.00 0.00 C ATOM 2109 CD GLU A 133 16.253 -5.774 8.481 1.00 0.00 C ATOM 2110 OE1 GLU A 133 15.482 -6.697 8.825 1.00 0.00 O ATOM 2111 OE2 GLU A 133 17.456 -5.692 8.826 1.00 0.00 O ATOM 0 H GLU A 133 14.503 -3.171 4.741 1.00 0.00 H new ATOM 0 HA GLU A 133 16.913 -2.543 6.309 1.00 0.00 H new ATOM 0 HB2 GLU A 133 15.788 -5.281 5.520 1.00 0.00 H new ATOM 0 HB3 GLU A 133 17.359 -5.024 6.254 1.00 0.00 H new ATOM 0 HG2 GLU A 133 15.851 -3.709 8.081 1.00 0.00 H new ATOM 0 HG3 GLU A 133 14.623 -4.807 7.484 1.00 0.00 H new ATOM 2118 N GLY A 134 18.328 -2.958 4.261 1.00 0.00 N ATOM 2119 CA GLY A 134 19.209 -2.947 3.090 1.00 0.00 C ATOM 2120 C GLY A 134 18.850 -1.940 1.994 1.00 0.00 C ATOM 2121 O GLY A 134 19.641 -1.060 1.646 1.00 0.00 O ATOM 0 H GLY A 134 18.821 -2.679 5.109 1.00 0.00 H new ATOM 0 HA2 GLY A 134 20.226 -2.742 3.426 1.00 0.00 H new ATOM 0 HA3 GLY A 134 19.213 -3.945 2.653 1.00 0.00 H new ATOM 2125 N GLY A 135 17.636 -2.060 1.470 1.00 0.00 N ATOM 2126 CA GLY A 135 17.007 -1.271 0.421 1.00 0.00 C ATOM 2127 C GLY A 135 16.379 -2.246 -0.566 1.00 0.00 C ATOM 2128 O GLY A 135 16.624 -2.113 -1.766 1.00 0.00 O ATOM 0 H GLY A 135 17.004 -2.788 1.805 1.00 0.00 H new ATOM 0 HA2 GLY A 135 16.250 -0.608 0.840 1.00 0.00 H new ATOM 0 HA3 GLY A 135 17.742 -0.640 -0.078 1.00 0.00 H new ATOM 2132 N CYS A 136 15.663 -3.275 -0.072 1.00 0.00 N ATOM 2133 CA CYS A 136 15.053 -4.270 -0.952 1.00 0.00 C ATOM 2134 C CYS A 136 13.859 -3.665 -1.699 1.00 0.00 C ATOM 2135 O CYS A 136 13.321 -2.639 -1.257 1.00 0.00 O ATOM 2136 CB CYS A 136 14.658 -5.487 -0.103 1.00 0.00 C ATOM 2137 SG CYS A 136 16.147 -6.251 0.582 1.00 0.00 S ATOM 0 H CYS A 136 15.498 -3.431 0.922 1.00 0.00 H new ATOM 0 HA CYS A 136 15.761 -4.593 -1.715 1.00 0.00 H new ATOM 0 HB2 CYS A 136 13.990 -5.181 0.702 1.00 0.00 H new ATOM 0 HB3 CYS A 136 14.114 -6.208 -0.713 1.00 0.00 H new ATOM 0 HG CYS A 136 15.814 -7.280 1.303 1.00 0.00 H new ATOM 2143 N PRO A 137 13.395 -4.287 -2.795 1.00 0.00 N ATOM 2144 CA PRO A 137 12.281 -3.743 -3.538 1.00 0.00 C ATOM 2145 C PRO A 137 10.951 -4.041 -2.854 1.00 0.00 C ATOM 2146 O PRO A 137 10.863 -4.915 -1.990 1.00 0.00 O ATOM 2147 CB PRO A 137 12.372 -4.402 -4.918 1.00 0.00 C ATOM 2148 CG PRO A 137 12.947 -5.783 -4.607 1.00 0.00 C ATOM 2149 CD PRO A 137 13.898 -5.495 -3.445 1.00 0.00 C ATOM 0 HA PRO A 137 12.327 -2.656 -3.605 1.00 0.00 H new ATOM 0 HB2 PRO A 137 11.395 -4.471 -5.397 1.00 0.00 H new ATOM 0 HB3 PRO A 137 13.018 -3.839 -5.592 1.00 0.00 H new ATOM 0 HG2 PRO A 137 12.168 -6.493 -4.327 1.00 0.00 H new ATOM 0 HG3 PRO A 137 13.471 -6.206 -5.464 1.00 0.00 H new ATOM 0 HD2 PRO A 137 13.923 -6.331 -2.746 1.00 0.00 H new ATOM 0 HD3 PRO A 137 14.917 -5.349 -3.803 1.00 0.00 H new ATOM 2157 N LEU A 138 9.914 -3.297 -3.233 1.00 0.00 N ATOM 2158 CA LEU A 138 8.566 -3.431 -2.711 1.00 0.00 C ATOM 2159 C LEU A 138 7.901 -4.628 -3.361 1.00 0.00 C ATOM 2160 O LEU A 138 7.681 -4.597 -4.573 1.00 0.00 O ATOM 2161 CB LEU A 138 7.738 -2.174 -2.986 1.00 0.00 C ATOM 2162 CG LEU A 138 8.125 -0.941 -2.158 1.00 0.00 C ATOM 2163 CD1 LEU A 138 6.994 0.090 -2.261 1.00 0.00 C ATOM 2164 CD2 LEU A 138 8.341 -1.248 -0.680 1.00 0.00 C ATOM 0 H LEU A 138 9.997 -2.562 -3.935 1.00 0.00 H new ATOM 0 HA LEU A 138 8.623 -3.569 -1.631 1.00 0.00 H new ATOM 0 HB2 LEU A 138 7.827 -1.924 -4.043 1.00 0.00 H new ATOM 0 HB3 LEU A 138 6.689 -2.402 -2.800 1.00 0.00 H new ATOM 0 HG LEU A 138 9.068 -0.571 -2.561 1.00 0.00 H new ATOM 0 HD11 LEU A 138 7.253 0.974 -1.678 1.00 0.00 H new ATOM 0 HD12 LEU A 138 6.853 0.372 -3.304 1.00 0.00 H new ATOM 0 HD13 LEU A 138 6.071 -0.342 -1.874 1.00 0.00 H new ATOM 0 HD21 LEU A 138 8.612 -0.333 -0.154 1.00 0.00 H new ATOM 0 HD22 LEU A 138 7.423 -1.653 -0.254 1.00 0.00 H new ATOM 0 HD23 LEU A 138 9.143 -1.978 -0.574 1.00 0.00 H new ATOM 2176 N ILE A 139 7.577 -5.663 -2.595 1.00 0.00 N ATOM 2177 CA ILE A 139 6.918 -6.859 -3.107 1.00 0.00 C ATOM 2178 C ILE A 139 5.972 -7.427 -2.040 1.00 0.00 C ATOM 2179 O ILE A 139 5.858 -6.869 -0.942 1.00 0.00 O ATOM 2180 CB ILE A 139 7.942 -7.903 -3.629 1.00 0.00 C ATOM 2181 CG1 ILE A 139 9.357 -7.877 -3.014 1.00 0.00 C ATOM 2182 CG2 ILE A 139 8.073 -7.800 -5.157 1.00 0.00 C ATOM 2183 CD1 ILE A 139 9.332 -8.249 -1.535 1.00 0.00 C ATOM 0 H ILE A 139 7.766 -5.696 -1.593 1.00 0.00 H new ATOM 0 HA ILE A 139 6.314 -6.588 -3.973 1.00 0.00 H new ATOM 0 HB ILE A 139 7.513 -8.851 -3.304 1.00 0.00 H new ATOM 0 HG12 ILE A 139 10.002 -8.571 -3.554 1.00 0.00 H new ATOM 0 HG13 ILE A 139 9.788 -6.883 -3.133 1.00 0.00 H new ATOM 0 HG21 ILE A 139 8.794 -8.537 -5.511 1.00 0.00 H new ATOM 0 HG22 ILE A 139 7.104 -7.989 -5.619 1.00 0.00 H new ATOM 0 HG23 ILE A 139 8.414 -6.800 -5.426 1.00 0.00 H new ATOM 0 HD11 ILE A 139 10.346 -8.220 -1.135 1.00 0.00 H new ATOM 0 HD12 ILE A 139 8.708 -7.540 -0.992 1.00 0.00 H new ATOM 0 HD13 ILE A 139 8.925 -9.253 -1.419 1.00 0.00 H new ATOM 2195 N LEU A 140 5.233 -8.485 -2.386 1.00 0.00 N ATOM 2196 CA LEU A 140 4.296 -9.148 -1.479 1.00 0.00 C ATOM 2197 C LEU A 140 4.940 -10.429 -0.934 1.00 0.00 C ATOM 2198 O LEU A 140 5.699 -11.088 -1.643 1.00 0.00 O ATOM 2199 CB LEU A 140 2.987 -9.542 -2.189 1.00 0.00 C ATOM 2200 CG LEU A 140 2.347 -8.445 -3.061 1.00 0.00 C ATOM 2201 CD1 LEU A 140 1.188 -9.021 -3.869 1.00 0.00 C ATOM 2202 CD2 LEU A 140 1.837 -7.271 -2.216 1.00 0.00 C ATOM 0 H LEU A 140 5.270 -8.908 -3.313 1.00 0.00 H new ATOM 0 HA LEU A 140 4.064 -8.445 -0.679 1.00 0.00 H new ATOM 0 HB2 LEU A 140 3.182 -10.412 -2.816 1.00 0.00 H new ATOM 0 HB3 LEU A 140 2.263 -9.849 -1.434 1.00 0.00 H new ATOM 0 HG LEU A 140 3.121 -8.074 -3.733 1.00 0.00 H new ATOM 0 HD11 LEU A 140 0.745 -8.235 -4.481 1.00 0.00 H new ATOM 0 HD12 LEU A 140 1.555 -9.819 -4.514 1.00 0.00 H new ATOM 0 HD13 LEU A 140 0.435 -9.421 -3.190 1.00 0.00 H new ATOM 0 HD21 LEU A 140 1.393 -6.519 -2.868 1.00 0.00 H new ATOM 0 HD22 LEU A 140 1.086 -7.629 -1.511 1.00 0.00 H new ATOM 0 HD23 LEU A 140 2.669 -6.829 -1.667 1.00 0.00 H new ATOM 2214 N THR A 141 4.583 -10.835 0.279 1.00 0.00 N ATOM 2215 CA THR A 141 5.100 -12.042 0.910 1.00 0.00 C ATOM 2216 C THR A 141 3.985 -12.669 1.737 1.00 0.00 C ATOM 2217 O THR A 141 3.278 -11.977 2.470 1.00 0.00 O ATOM 2218 CB THR A 141 6.373 -11.745 1.724 1.00 0.00 C ATOM 2219 OG1 THR A 141 6.882 -12.957 2.234 1.00 0.00 O ATOM 2220 CG2 THR A 141 6.167 -10.766 2.889 1.00 0.00 C ATOM 0 H THR A 141 3.916 -10.327 0.860 1.00 0.00 H new ATOM 0 HA THR A 141 5.408 -12.764 0.154 1.00 0.00 H new ATOM 0 HB THR A 141 7.069 -11.263 1.037 1.00 0.00 H new ATOM 0 HG1 THR A 141 7.694 -12.778 2.753 1.00 0.00 H new ATOM 0 HG21 THR A 141 7.113 -10.614 3.408 1.00 0.00 H new ATOM 0 HG22 THR A 141 5.807 -9.812 2.503 1.00 0.00 H new ATOM 0 HG23 THR A 141 5.434 -11.176 3.584 1.00 0.00 H new ATOM 2228 N GLN A 142 3.779 -13.973 1.578 1.00 0.00 N ATOM 2229 CA GLN A 142 2.752 -14.693 2.324 1.00 0.00 C ATOM 2230 C GLN A 142 3.249 -15.077 3.721 1.00 0.00 C ATOM 2231 O GLN A 142 2.436 -15.263 4.622 1.00 0.00 O ATOM 2232 CB GLN A 142 2.256 -15.931 1.547 1.00 0.00 C ATOM 2233 CG GLN A 142 3.395 -16.770 0.939 1.00 0.00 C ATOM 2234 CD GLN A 142 2.941 -18.148 0.455 1.00 0.00 C ATOM 2235 OE1 GLN A 142 2.598 -18.342 -0.712 1.00 0.00 O ATOM 2236 NE2 GLN A 142 2.980 -19.142 1.323 1.00 0.00 N ATOM 0 H GLN A 142 4.314 -14.556 0.934 1.00 0.00 H new ATOM 0 HA GLN A 142 1.903 -14.021 2.447 1.00 0.00 H new ATOM 0 HB2 GLN A 142 1.670 -16.560 2.217 1.00 0.00 H new ATOM 0 HB3 GLN A 142 1.588 -15.606 0.749 1.00 0.00 H new ATOM 0 HG2 GLN A 142 3.832 -16.225 0.102 1.00 0.00 H new ATOM 0 HG3 GLN A 142 4.182 -16.895 1.683 1.00 0.00 H new ATOM 0 HE21 GLN A 142 3.266 -18.967 2.286 1.00 0.00 H new ATOM 0 HE22 GLN A 142 2.724 -20.085 1.030 1.00 0.00 H new ATOM 2245 N GLU A 143 4.569 -15.198 3.902 1.00 0.00 N ATOM 2246 CA GLU A 143 5.212 -15.575 5.154 1.00 0.00 C ATOM 2247 C GLU A 143 6.705 -15.290 5.003 1.00 0.00 C ATOM 2248 O GLU A 143 7.457 -16.088 4.438 1.00 0.00 O ATOM 2249 CB GLU A 143 4.975 -17.061 5.518 1.00 0.00 C ATOM 2250 CG GLU A 143 4.878 -17.998 4.297 1.00 0.00 C ATOM 2251 CD GLU A 143 4.936 -19.480 4.670 1.00 0.00 C ATOM 2252 OE1 GLU A 143 3.942 -19.970 5.242 1.00 0.00 O ATOM 2253 OE2 GLU A 143 5.897 -20.192 4.292 1.00 0.00 O ATOM 0 H GLU A 143 5.238 -15.029 3.151 1.00 0.00 H new ATOM 0 HA GLU A 143 4.780 -14.995 5.969 1.00 0.00 H new ATOM 0 HB2 GLU A 143 5.787 -17.401 6.160 1.00 0.00 H new ATOM 0 HB3 GLU A 143 4.055 -17.140 6.098 1.00 0.00 H new ATOM 0 HG2 GLU A 143 3.946 -17.799 3.768 1.00 0.00 H new ATOM 0 HG3 GLU A 143 5.691 -17.771 3.607 1.00 0.00 H new ATOM 2260 N LEU A 144 7.140 -14.117 5.452 1.00 0.00 N ATOM 2261 CA LEU A 144 8.539 -13.698 5.404 1.00 0.00 C ATOM 2262 C LEU A 144 9.389 -14.458 6.418 1.00 0.00 C ATOM 2263 O LEU A 144 8.892 -15.243 7.230 1.00 0.00 O ATOM 2264 CB LEU A 144 8.643 -12.184 5.623 1.00 0.00 C ATOM 2265 CG LEU A 144 7.928 -11.644 6.883 1.00 0.00 C ATOM 2266 CD1 LEU A 144 8.840 -10.860 7.829 1.00 0.00 C ATOM 2267 CD2 LEU A 144 6.766 -10.769 6.422 1.00 0.00 C ATOM 0 H LEU A 144 6.522 -13.419 5.866 1.00 0.00 H new ATOM 0 HA LEU A 144 8.930 -13.936 4.415 1.00 0.00 H new ATOM 0 HB2 LEU A 144 9.698 -11.914 5.681 1.00 0.00 H new ATOM 0 HB3 LEU A 144 8.232 -11.679 4.749 1.00 0.00 H new ATOM 0 HG LEU A 144 7.583 -12.500 7.463 1.00 0.00 H new ATOM 0 HD11 LEU A 144 8.264 -10.515 8.688 1.00 0.00 H new ATOM 0 HD12 LEU A 144 9.650 -11.504 8.171 1.00 0.00 H new ATOM 0 HD13 LEU A 144 9.257 -10.001 7.303 1.00 0.00 H new ATOM 0 HD21 LEU A 144 6.241 -10.373 7.292 1.00 0.00 H new ATOM 0 HD22 LEU A 144 7.148 -9.943 5.822 1.00 0.00 H new ATOM 0 HD23 LEU A 144 6.077 -11.365 5.823 1.00 0.00 H new ATOM 2279 N GLY A 145 10.691 -14.200 6.373 1.00 0.00 N ATOM 2280 CA GLY A 145 11.707 -14.780 7.227 1.00 0.00 C ATOM 2281 C GLY A 145 12.460 -13.676 7.949 1.00 0.00 C ATOM 2282 O GLY A 145 13.682 -13.630 7.857 1.00 0.00 O ATOM 0 H GLY A 145 11.083 -13.542 5.699 1.00 0.00 H new ATOM 0 HA2 GLY A 145 11.247 -15.453 7.951 1.00 0.00 H new ATOM 0 HA3 GLY A 145 12.399 -15.376 6.632 1.00 0.00 H new ATOM 2286 N LYS A 146 11.730 -12.763 8.607 1.00 0.00 N ATOM 2287 CA LYS A 146 12.178 -11.606 9.398 1.00 0.00 C ATOM 2288 C LYS A 146 12.956 -10.552 8.599 1.00 0.00 C ATOM 2289 O LYS A 146 13.271 -9.490 9.132 1.00 0.00 O ATOM 2290 CB LYS A 146 12.952 -12.153 10.624 1.00 0.00 C ATOM 2291 CG LYS A 146 13.377 -11.139 11.696 1.00 0.00 C ATOM 2292 CD LYS A 146 12.226 -10.330 12.324 1.00 0.00 C ATOM 2293 CE LYS A 146 12.168 -8.861 11.894 1.00 0.00 C ATOM 2294 NZ LYS A 146 13.404 -8.134 12.247 1.00 0.00 N ATOM 0 H LYS A 146 10.712 -12.822 8.598 1.00 0.00 H new ATOM 0 HA LYS A 146 11.305 -11.044 9.730 1.00 0.00 H new ATOM 0 HB2 LYS A 146 12.333 -12.911 11.103 1.00 0.00 H new ATOM 0 HB3 LYS A 146 13.848 -12.656 10.261 1.00 0.00 H new ATOM 0 HG2 LYS A 146 13.901 -11.671 12.490 1.00 0.00 H new ATOM 0 HG3 LYS A 146 14.090 -10.443 11.254 1.00 0.00 H new ATOM 0 HD2 LYS A 146 11.281 -10.808 12.066 1.00 0.00 H new ATOM 0 HD3 LYS A 146 12.319 -10.374 13.409 1.00 0.00 H new ATOM 0 HE2 LYS A 146 12.008 -8.804 10.817 1.00 0.00 H new ATOM 0 HE3 LYS A 146 11.314 -8.377 12.369 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 13.202 -7.116 12.309 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 13.757 -8.474 13.164 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 14.125 -8.300 11.516 1.00 0.00 H new ATOM 2308 N ALA A 147 13.174 -10.758 7.305 1.00 0.00 N ATOM 2309 CA ALA A 147 13.929 -9.851 6.464 1.00 0.00 C ATOM 2310 C ALA A 147 13.133 -8.790 5.691 1.00 0.00 C ATOM 2311 O ALA A 147 13.726 -7.827 5.201 1.00 0.00 O ATOM 2312 CB ALA A 147 14.711 -10.729 5.486 1.00 0.00 C ATOM 0 H ALA A 147 12.823 -11.576 6.807 1.00 0.00 H new ATOM 0 HA ALA A 147 14.552 -9.251 7.127 1.00 0.00 H new ATOM 0 HB1 ALA A 147 15.302 -10.098 4.823 1.00 0.00 H new ATOM 0 HB2 ALA A 147 15.374 -11.392 6.042 1.00 0.00 H new ATOM 0 HB3 ALA A 147 14.015 -11.324 4.895 1.00 0.00 H new ATOM 2318 N ASN A 148 11.814 -8.927 5.561 1.00 0.00 N ATOM 2319 CA ASN A 148 10.962 -8.007 4.809 1.00 0.00 C ATOM 2320 C ASN A 148 9.806 -7.563 5.693 1.00 0.00 C ATOM 2321 O ASN A 148 8.854 -8.309 5.875 1.00 0.00 O ATOM 2322 CB ASN A 148 10.495 -8.709 3.515 1.00 0.00 C ATOM 2323 CG ASN A 148 11.602 -8.931 2.474 1.00 0.00 C ATOM 2324 OD1 ASN A 148 11.616 -9.925 1.756 1.00 0.00 O ATOM 2325 ND2 ASN A 148 12.589 -8.057 2.353 1.00 0.00 N ATOM 0 H ASN A 148 11.297 -9.697 5.985 1.00 0.00 H new ATOM 0 HA ASN A 148 11.506 -7.109 4.517 1.00 0.00 H new ATOM 0 HB2 ASN A 148 10.062 -9.674 3.777 1.00 0.00 H new ATOM 0 HB3 ASN A 148 9.701 -8.116 3.061 1.00 0.00 H new ATOM 0 HD21 ASN A 148 13.334 -8.220 1.676 1.00 0.00 H new ATOM 0 HD22 ASN A 148 12.604 -7.221 2.937 1.00 0.00 H new ATOM 2332 N THR A 149 9.904 -6.373 6.286 1.00 0.00 N ATOM 2333 CA THR A 149 8.907 -5.811 7.179 1.00 0.00 C ATOM 2334 C THR A 149 7.589 -5.635 6.439 1.00 0.00 C ATOM 2335 O THR A 149 7.566 -5.010 5.381 1.00 0.00 O ATOM 2336 CB THR A 149 9.429 -4.509 7.793 1.00 0.00 C ATOM 2337 OG1 THR A 149 10.844 -4.543 7.964 1.00 0.00 O ATOM 2338 CG2 THR A 149 8.772 -4.187 9.139 1.00 0.00 C ATOM 0 H THR A 149 10.707 -5.759 6.150 1.00 0.00 H new ATOM 0 HA THR A 149 8.716 -6.495 8.006 1.00 0.00 H new ATOM 0 HB THR A 149 9.165 -3.723 7.086 1.00 0.00 H new ATOM 0 HG1 THR A 149 11.218 -3.658 7.770 1.00 0.00 H new ATOM 0 HG21 THR A 149 9.179 -3.254 9.529 1.00 0.00 H new ATOM 0 HG22 THR A 149 7.695 -4.084 9.003 1.00 0.00 H new ATOM 0 HG23 THR A 149 8.973 -4.993 9.844 1.00 0.00 H new ATOM 2346 N THR A 150 6.503 -6.145 7.008 1.00 0.00 N ATOM 2347 CA THR A 150 5.160 -6.076 6.459 1.00 0.00 C ATOM 2348 C THR A 150 4.214 -5.245 7.311 1.00 0.00 C ATOM 2349 O THR A 150 3.210 -4.746 6.788 1.00 0.00 O ATOM 2350 CB THR A 150 4.579 -7.493 6.295 1.00 0.00 C ATOM 2351 OG1 THR A 150 4.791 -8.283 7.461 1.00 0.00 O ATOM 2352 CG2 THR A 150 5.133 -8.181 5.048 1.00 0.00 C ATOM 0 H THR A 150 6.539 -6.637 7.901 1.00 0.00 H new ATOM 0 HA THR A 150 5.247 -5.585 5.490 1.00 0.00 H new ATOM 0 HB THR A 150 3.502 -7.390 6.163 1.00 0.00 H new ATOM 0 HG1 THR A 150 4.409 -9.175 7.325 1.00 0.00 H new ATOM 0 HG21 THR A 150 4.703 -9.179 4.962 1.00 0.00 H new ATOM 0 HG22 THR A 150 4.874 -7.597 4.165 1.00 0.00 H new ATOM 0 HG23 THR A 150 6.217 -8.259 5.127 1.00 0.00 H new ATOM 2360 N ASP A 151 4.523 -5.081 8.603 1.00 0.00 N ATOM 2361 CA ASP A 151 3.699 -4.331 9.529 1.00 0.00 C ATOM 2362 C ASP A 151 4.431 -3.139 10.104 1.00 0.00 C ATOM 2363 O ASP A 151 5.579 -3.245 10.525 1.00 0.00 O ATOM 2364 CB ASP A 151 3.054 -5.201 10.605 1.00 0.00 C ATOM 2365 CG ASP A 151 3.993 -5.982 11.515 1.00 0.00 C ATOM 2366 OD1 ASP A 151 3.447 -6.539 12.486 1.00 0.00 O ATOM 2367 OD2 ASP A 151 5.212 -6.116 11.267 1.00 0.00 O ATOM 0 H ASP A 151 5.363 -5.473 9.029 1.00 0.00 H new ATOM 0 HA ASP A 151 2.869 -3.937 8.942 1.00 0.00 H new ATOM 0 HB2 ASP A 151 2.431 -4.561 11.230 1.00 0.00 H new ATOM 0 HB3 ASP A 151 2.389 -5.911 10.113 1.00 0.00 H new ATOM 2372 N PHE A 152 3.785 -1.974 10.024 1.00 0.00 N ATOM 2373 CA PHE A 152 4.264 -0.680 10.507 1.00 0.00 C ATOM 2374 C PHE A 152 3.127 0.349 10.433 1.00 0.00 C ATOM 2375 O PHE A 152 1.996 -0.020 10.107 1.00 0.00 O ATOM 2376 CB PHE A 152 5.513 -0.207 9.739 1.00 0.00 C ATOM 2377 CG PHE A 152 6.835 -0.423 10.451 1.00 0.00 C ATOM 2378 CD1 PHE A 152 6.984 -0.036 11.799 1.00 0.00 C ATOM 2379 CD2 PHE A 152 7.955 -0.890 9.734 1.00 0.00 C ATOM 2380 CE1 PHE A 152 8.238 -0.117 12.422 1.00 0.00 C ATOM 2381 CE2 PHE A 152 9.216 -0.936 10.358 1.00 0.00 C ATOM 2382 CZ PHE A 152 9.354 -0.564 11.704 1.00 0.00 C ATOM 0 H PHE A 152 2.862 -1.906 9.596 1.00 0.00 H new ATOM 0 HA PHE A 152 4.570 -0.789 11.548 1.00 0.00 H new ATOM 0 HB2 PHE A 152 5.547 -0.725 8.780 1.00 0.00 H new ATOM 0 HB3 PHE A 152 5.405 0.856 9.523 1.00 0.00 H new ATOM 0 HD1 PHE A 152 6.130 0.324 12.353 1.00 0.00 H new ATOM 0 HD2 PHE A 152 7.846 -1.212 8.709 1.00 0.00 H new ATOM 0 HE1 PHE A 152 8.343 0.166 13.459 1.00 0.00 H new ATOM 0 HE2 PHE A 152 10.081 -1.259 9.798 1.00 0.00 H new ATOM 0 HZ PHE A 152 10.319 -0.622 12.185 1.00 0.00 H new ATOM 2392 N GLY A 153 3.380 1.619 10.764 1.00 0.00 N ATOM 2393 CA GLY A 153 2.403 2.700 10.714 1.00 0.00 C ATOM 2394 C GLY A 153 2.583 3.460 9.402 1.00 0.00 C ATOM 2395 O GLY A 153 3.108 2.915 8.424 1.00 0.00 O ATOM 0 H GLY A 153 4.298 1.928 11.083 1.00 0.00 H new ATOM 0 HA2 GLY A 153 1.392 2.299 10.783 1.00 0.00 H new ATOM 0 HA3 GLY A 153 2.538 3.372 11.562 1.00 0.00 H new ATOM 2399 N LEU A 154 2.092 4.692 9.351 1.00 0.00 N ATOM 2400 CA LEU A 154 2.169 5.603 8.212 1.00 0.00 C ATOM 2401 C LEU A 154 2.259 7.009 8.810 1.00 0.00 C ATOM 2402 O LEU A 154 1.895 7.214 9.975 1.00 0.00 O ATOM 2403 CB LEU A 154 0.911 5.485 7.312 1.00 0.00 C ATOM 2404 CG LEU A 154 1.176 5.436 5.801 1.00 0.00 C ATOM 2405 CD1 LEU A 154 1.739 4.075 5.388 1.00 0.00 C ATOM 2406 CD2 LEU A 154 -0.121 5.649 5.018 1.00 0.00 C ATOM 0 H LEU A 154 1.603 5.106 10.145 1.00 0.00 H new ATOM 0 HA LEU A 154 3.028 5.370 7.582 1.00 0.00 H new ATOM 0 HB2 LEU A 154 0.367 4.584 7.596 1.00 0.00 H new ATOM 0 HB3 LEU A 154 0.257 6.332 7.520 1.00 0.00 H new ATOM 0 HG LEU A 154 1.893 6.226 5.578 1.00 0.00 H new ATOM 0 HD11 LEU A 154 1.918 4.066 4.313 1.00 0.00 H new ATOM 0 HD12 LEU A 154 2.677 3.895 5.913 1.00 0.00 H new ATOM 0 HD13 LEU A 154 1.024 3.293 5.643 1.00 0.00 H new ATOM 0 HD21 LEU A 154 0.089 5.611 3.949 1.00 0.00 H new ATOM 0 HD22 LEU A 154 -0.834 4.866 5.276 1.00 0.00 H new ATOM 0 HD23 LEU A 154 -0.543 6.622 5.270 1.00 0.00 H new ATOM 2418 N THR A 155 2.618 7.998 8.003 1.00 0.00 N ATOM 2419 CA THR A 155 2.737 9.395 8.394 1.00 0.00 C ATOM 2420 C THR A 155 1.934 10.233 7.397 1.00 0.00 C ATOM 2421 O THR A 155 2.451 11.145 6.755 1.00 0.00 O ATOM 2422 CB THR A 155 4.216 9.797 8.527 1.00 0.00 C ATOM 2423 OG1 THR A 155 4.940 8.788 9.208 1.00 0.00 O ATOM 2424 CG2 THR A 155 4.356 11.111 9.301 1.00 0.00 C ATOM 0 H THR A 155 2.843 7.843 7.020 1.00 0.00 H new ATOM 0 HA THR A 155 2.316 9.574 9.383 1.00 0.00 H new ATOM 0 HB THR A 155 4.617 9.926 7.522 1.00 0.00 H new ATOM 0 HG1 THR A 155 5.880 9.055 9.285 1.00 0.00 H new ATOM 0 HG21 THR A 155 5.410 11.375 9.382 1.00 0.00 H new ATOM 0 HG22 THR A 155 3.824 11.902 8.774 1.00 0.00 H new ATOM 0 HG23 THR A 155 3.934 10.992 10.299 1.00 0.00 H new ATOM 2432 N MET A 156 0.686 9.821 7.167 1.00 0.00 N ATOM 2433 CA MET A 156 -0.246 10.493 6.277 1.00 0.00 C ATOM 2434 C MET A 156 -0.746 11.751 6.984 1.00 0.00 C ATOM 2435 O MET A 156 -0.952 11.734 8.201 1.00 0.00 O ATOM 2436 CB MET A 156 -1.367 9.533 5.870 1.00 0.00 C ATOM 2437 CG MET A 156 -2.247 9.118 7.049 1.00 0.00 C ATOM 2438 SD MET A 156 -2.965 7.461 6.953 1.00 0.00 S ATOM 2439 CE MET A 156 -3.940 7.558 8.476 1.00 0.00 C ATOM 0 H MET A 156 0.292 8.990 7.608 1.00 0.00 H new ATOM 0 HA MET A 156 0.234 10.798 5.347 1.00 0.00 H new ATOM 0 HB2 MET A 156 -1.987 10.007 5.109 1.00 0.00 H new ATOM 0 HB3 MET A 156 -0.931 8.643 5.417 1.00 0.00 H new ATOM 0 HG2 MET A 156 -1.654 9.184 7.961 1.00 0.00 H new ATOM 0 HG3 MET A 156 -3.058 9.840 7.144 1.00 0.00 H new ATOM 0 HE1 MET A 156 -4.480 6.623 8.623 1.00 0.00 H new ATOM 0 HE2 MET A 156 -3.276 7.730 9.323 1.00 0.00 H new ATOM 0 HE3 MET A 156 -4.652 8.380 8.400 1.00 0.00 H new ATOM 2449 N LEU A 157 -0.908 12.839 6.239 1.00 0.00 N ATOM 2450 CA LEU A 157 -1.382 14.122 6.743 1.00 0.00 C ATOM 2451 C LEU A 157 -2.794 14.342 6.219 1.00 0.00 C ATOM 2452 O LEU A 157 -3.238 13.611 5.336 1.00 0.00 O ATOM 2453 CB LEU A 157 -0.452 15.265 6.304 1.00 0.00 C ATOM 2454 CG LEU A 157 1.055 15.009 6.485 1.00 0.00 C ATOM 2455 CD1 LEU A 157 1.836 16.243 6.040 1.00 0.00 C ATOM 2456 CD2 LEU A 157 1.435 14.665 7.930 1.00 0.00 C ATOM 0 H LEU A 157 -0.707 12.853 5.239 1.00 0.00 H new ATOM 0 HA LEU A 157 -1.385 14.113 7.833 1.00 0.00 H new ATOM 0 HB2 LEU A 157 -0.641 15.479 5.252 1.00 0.00 H new ATOM 0 HB3 LEU A 157 -0.719 16.161 6.864 1.00 0.00 H new ATOM 0 HG LEU A 157 1.308 14.145 5.871 1.00 0.00 H new ATOM 0 HD11 LEU A 157 2.904 16.063 6.168 1.00 0.00 H new ATOM 0 HD12 LEU A 157 1.625 16.448 4.990 1.00 0.00 H new ATOM 0 HD13 LEU A 157 1.538 17.100 6.644 1.00 0.00 H new ATOM 0 HD21 LEU A 157 2.510 14.496 7.993 1.00 0.00 H new ATOM 0 HD22 LEU A 157 1.159 15.491 8.585 1.00 0.00 H new ATOM 0 HD23 LEU A 157 0.907 13.763 8.240 1.00 0.00 H new ATOM 2468 N PHE A 158 -3.498 15.325 6.765 1.00 0.00 N ATOM 2469 CA PHE A 158 -4.860 15.712 6.434 1.00 0.00 C ATOM 2470 C PHE A 158 -5.006 17.187 6.821 1.00 0.00 C ATOM 2471 O PHE A 158 -6.153 17.687 6.818 1.00 0.00 O ATOM 2472 CB PHE A 158 -5.830 14.792 7.196 1.00 0.00 C ATOM 2473 CG PHE A 158 -5.591 14.669 8.690 1.00 0.00 C ATOM 2474 CD1 PHE A 158 -6.130 15.625 9.570 1.00 0.00 C ATOM 2475 CD2 PHE A 158 -4.853 13.586 9.209 1.00 0.00 C ATOM 2476 CE1 PHE A 158 -5.921 15.509 10.957 1.00 0.00 C ATOM 2477 CE2 PHE A 158 -4.650 13.473 10.597 1.00 0.00 C ATOM 2478 CZ PHE A 158 -5.177 14.434 11.477 1.00 0.00 C ATOM 0 H PHE A 158 -3.104 15.912 7.501 1.00 0.00 H new ATOM 0 HA PHE A 158 -5.089 15.605 5.374 1.00 0.00 H new ATOM 0 HB2 PHE A 158 -6.845 15.157 7.039 1.00 0.00 H new ATOM 0 HB3 PHE A 158 -5.777 13.796 6.756 1.00 0.00 H new ATOM 0 HD1 PHE A 158 -6.706 16.451 9.180 1.00 0.00 H new ATOM 0 HD2 PHE A 158 -4.443 12.843 8.541 1.00 0.00 H new ATOM 0 HE1 PHE A 158 -6.334 16.249 11.626 1.00 0.00 H new ATOM 0 HE2 PHE A 158 -4.084 12.641 10.989 1.00 0.00 H new ATOM 0 HZ PHE A 158 -5.013 14.348 12.541 1.00 0.00 H new TER 2488 PHE A 158