USER MOD reduce.3.24.130724 H: found=0, std=0, add=1227, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1229 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 14 THR OG1 : rot -61:sc= -8.55! USER MOD Set 1.2: B 27 SER OG : rot -172:sc= -1.75 USER MOD Set 2.1: A 35 THR OG1 : rot -127:sc= 1.15 USER MOD Set 2.2: B 1 MET CE :methyl 163:sc= -1.97 (180deg=-2.37) USER MOD Set 3.1: A 33 THR OG1 : rot 72:sc= -5.11! USER MOD Set 3.2: B 45 THR OG1 : rot -53:sc= 0.601 USER MOD Set 3.3: B 84 SER OG : rot -160:sc= 0.0864 USER MOD Set 4.1: A 1 MET CE :methyl 155:sc= -3.87! (180deg=-6.91!) USER MOD Set 4.2: B 35 THR OG1 : rot -130:sc= 0.519 USER MOD Single : A 1 MET N :NH3+ -144:sc= -0.0856 (180deg=-1.29!) USER MOD Single : A 2 ASN : amide:sc= -0.73 K(o=-0.73,f=-12!) USER MOD Single : A 3 LYS NZ :NH3+ 154:sc= -0.796 (180deg=-1.21) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 GLN :FLIP amide:sc=-0.00421 F(o=-0.62,f=-0.0042) USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 GLN : amide:sc= -0.13 K(o=-0.13,f=-2.2!) USER MOD Single : A 20 SER OG : rot -171:sc= -8.01! USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 MET CE :methyl -146:sc= -6.92! (180deg=-10.3!) USER MOD Single : A 27 SER OG : rot 89:sc= -1.93 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 LYS NZ :NH3+ 170:sc= 0.33 (180deg=0.242) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 45 THR OG1 : rot 180:sc= -0.0513 USER MOD Single : A 49 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 SER OG : rot 140:sc= 0.0174 USER MOD Single : A 86 LYS NZ :NH3+ -177:sc= 0.432 (180deg=0.385) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 LYS NZ :NH3+ -105:sc= -0.154 (180deg=-0.439) USER MOD Single : A 94 TYR OH : rot 180:sc= 0 USER MOD Single : B 1 MET N :NH3+ 175:sc= 0.931 (180deg=0.914) USER MOD Single : B 2 ASN : amide:sc= -4.25! C(o=-4.2!,f=-11!) USER MOD Single : B 3 LYS NZ :NH3+ -106:sc= -8.17! (180deg=-15.2!) USER MOD Single : B 4 THR OG1 : rot 180:sc= 0 USER MOD Single : B 8 LYS NZ :NH3+ -106:sc= -0.0509 (180deg=-0.718) USER MOD Single : B 12 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 14 THR OG1 : rot -72:sc= -8.28! USER MOD Single : B 17 THR OG1 : rot 180:sc= 0 USER MOD Single : B 18 GLN : amide:sc=-0.00801 X(o=-0.008,f=0) USER MOD Single : B 20 SER OG : rot -49:sc= -7.27! USER MOD Single : B 22 SER OG : rot 180:sc= -0.0342 USER MOD Single : B 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 24 MET CE :methyl -167:sc= -7.2! (180deg=-8.46!) USER MOD Single : B 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 33 THR OG1 : rot 147:sc= -5.29! USER MOD Single : B 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 43 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 49 ASN : amide:sc= -4.21! C(o=-4.2!,f=-18!) USER MOD Single : B 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 78 SER OG : rot 180:sc= 0 USER MOD Single : B 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 86 LYS NZ :NH3+ -161:sc= 0 (180deg=-0.281) USER MOD Single : B 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 93 LYS NZ :NH3+ -117:sc=-0.00023 (180deg=-0.234) USER MOD Single : B 94 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 4.833 3.733 10.052 1.00 0.00 N ATOM 2 CA MET A 1 4.089 5.021 9.922 1.00 0.00 C ATOM 3 C MET A 1 2.624 4.752 9.554 1.00 0.00 C ATOM 4 O MET A 1 2.245 3.624 9.305 1.00 0.00 O ATOM 5 CB MET A 1 4.803 5.780 8.798 1.00 0.00 C ATOM 6 CG MET A 1 5.812 6.765 9.396 1.00 0.00 C ATOM 7 SD MET A 1 7.103 7.123 8.185 1.00 0.00 S ATOM 8 CE MET A 1 6.018 7.787 6.900 1.00 0.00 C ATOM 0 H1 MET A 1 5.531 3.811 10.819 1.00 0.00 H new ATOM 0 H2 MET A 1 4.165 2.966 10.269 1.00 0.00 H new ATOM 0 H3 MET A 1 5.322 3.523 9.159 1.00 0.00 H new ATOM 0 HA MET A 1 4.079 5.590 10.851 1.00 0.00 H new ATOM 0 HB2 MET A 1 5.314 5.077 8.140 1.00 0.00 H new ATOM 0 HB3 MET A 1 4.075 6.316 8.189 1.00 0.00 H new ATOM 0 HG2 MET A 1 5.307 7.686 9.687 1.00 0.00 H new ATOM 0 HG3 MET A 1 6.254 6.345 10.299 1.00 0.00 H new ATOM 0 HE1 MET A 1 6.584 8.463 6.260 1.00 0.00 H new ATOM 0 HE2 MET A 1 5.620 6.968 6.301 1.00 0.00 H new ATOM 0 HE3 MET A 1 5.195 8.331 7.364 1.00 0.00 H new ATOM 20 N ASN A 2 1.788 5.769 9.515 1.00 0.00 N ATOM 21 CA ASN A 2 0.357 5.526 9.161 1.00 0.00 C ATOM 22 C ASN A 2 -0.406 6.829 8.887 1.00 0.00 C ATOM 23 O ASN A 2 0.174 7.851 8.583 1.00 0.00 O ATOM 24 CB ASN A 2 -0.233 4.791 10.368 1.00 0.00 C ATOM 25 CG ASN A 2 -0.149 5.681 11.610 1.00 0.00 C ATOM 26 OD1 ASN A 2 0.580 6.655 11.628 1.00 0.00 O ATOM 27 ND2 ASN A 2 -0.868 5.387 12.659 1.00 0.00 N ATOM 0 H ASN A 2 2.034 6.739 9.710 1.00 0.00 H new ATOM 0 HA ASN A 2 0.275 4.948 8.241 1.00 0.00 H new ATOM 0 HB2 ASN A 2 -1.271 4.524 10.171 1.00 0.00 H new ATOM 0 HB3 ASN A 2 0.309 3.861 10.539 1.00 0.00 H new ATOM 0 HD21 ASN A 2 -0.818 5.973 13.492 1.00 0.00 H new ATOM 0 HD22 ASN A 2 -1.480 4.571 12.646 1.00 0.00 H new ATOM 34 N LYS A 3 -1.718 6.785 8.986 1.00 0.00 N ATOM 35 CA LYS A 3 -2.555 8.003 8.724 1.00 0.00 C ATOM 36 C LYS A 3 -2.047 9.214 9.527 1.00 0.00 C ATOM 37 O LYS A 3 -2.472 10.329 9.302 1.00 0.00 O ATOM 38 CB LYS A 3 -3.977 7.613 9.162 1.00 0.00 C ATOM 39 CG LYS A 3 -5.007 8.168 8.163 1.00 0.00 C ATOM 40 CD LYS A 3 -6.175 7.177 8.003 1.00 0.00 C ATOM 41 CE LYS A 3 -7.289 7.795 7.135 1.00 0.00 C ATOM 42 NZ LYS A 3 -7.966 8.780 8.024 1.00 0.00 N ATOM 0 H LYS A 3 -2.247 5.951 9.239 1.00 0.00 H new ATOM 0 HA LYS A 3 -2.516 8.300 7.676 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -4.063 6.528 9.221 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -4.179 8.003 10.159 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -5.381 9.130 8.512 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -4.532 8.342 7.197 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -5.818 6.255 7.545 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -6.573 6.913 8.983 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -6.877 8.280 6.250 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -7.986 7.033 6.786 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -8.404 9.525 7.446 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -8.700 8.298 8.581 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -7.267 9.205 8.666 1.00 0.00 H new ATOM 56 N THR A 4 -1.137 9.012 10.449 1.00 0.00 N ATOM 57 CA THR A 4 -0.599 10.161 11.244 1.00 0.00 C ATOM 58 C THR A 4 0.916 10.268 11.031 1.00 0.00 C ATOM 59 O THR A 4 1.440 11.281 10.589 1.00 0.00 O ATOM 60 CB THR A 4 -0.924 9.819 12.705 1.00 0.00 C ATOM 61 OG1 THR A 4 -2.247 10.243 13.002 1.00 0.00 O ATOM 62 CG2 THR A 4 0.061 10.526 13.644 1.00 0.00 C ATOM 0 H THR A 4 -0.743 8.101 10.686 1.00 0.00 H new ATOM 0 HA THR A 4 -1.032 11.117 10.951 1.00 0.00 H new ATOM 0 HB THR A 4 -0.839 8.742 12.848 1.00 0.00 H new ATOM 0 HG1 THR A 4 -2.459 10.025 13.934 1.00 0.00 H new ATOM 0 HG21 THR A 4 -0.179 10.276 14.678 1.00 0.00 H new ATOM 0 HG22 THR A 4 1.076 10.200 13.418 1.00 0.00 H new ATOM 0 HG23 THR A 4 -0.014 11.604 13.504 1.00 0.00 H new ATOM 70 N GLU A 5 1.621 9.219 11.338 1.00 0.00 N ATOM 71 CA GLU A 5 3.097 9.232 11.154 1.00 0.00 C ATOM 72 C GLU A 5 3.424 9.766 9.759 1.00 0.00 C ATOM 73 O GLU A 5 4.334 10.549 9.576 1.00 0.00 O ATOM 74 CB GLU A 5 3.517 7.774 11.302 1.00 0.00 C ATOM 75 CG GLU A 5 4.826 7.683 12.091 1.00 0.00 C ATOM 76 CD GLU A 5 4.545 7.925 13.576 1.00 0.00 C ATOM 77 OE1 GLU A 5 3.692 8.745 13.872 1.00 0.00 O ATOM 78 OE2 GLU A 5 5.188 7.285 14.392 1.00 0.00 O ATOM 0 H GLU A 5 1.238 8.350 11.710 1.00 0.00 H new ATOM 0 HA GLU A 5 3.617 9.869 11.869 1.00 0.00 H new ATOM 0 HB2 GLU A 5 2.735 7.212 11.813 1.00 0.00 H new ATOM 0 HB3 GLU A 5 3.644 7.322 10.318 1.00 0.00 H new ATOM 0 HG2 GLU A 5 5.280 6.702 11.951 1.00 0.00 H new ATOM 0 HG3 GLU A 5 5.539 8.420 11.720 1.00 0.00 H new ATOM 85 N LEU A 6 2.667 9.367 8.774 1.00 0.00 N ATOM 86 CA LEU A 6 2.925 9.884 7.400 1.00 0.00 C ATOM 87 C LEU A 6 2.576 11.375 7.322 1.00 0.00 C ATOM 88 O LEU A 6 3.169 12.113 6.555 1.00 0.00 O ATOM 89 CB LEU A 6 2.020 9.068 6.477 1.00 0.00 C ATOM 90 CG LEU A 6 2.635 7.686 6.255 1.00 0.00 C ATOM 91 CD1 LEU A 6 1.524 6.643 6.117 1.00 0.00 C ATOM 92 CD2 LEU A 6 3.479 7.705 4.978 1.00 0.00 C ATOM 0 H LEU A 6 1.889 8.713 8.859 1.00 0.00 H new ATOM 0 HA LEU A 6 3.973 9.787 7.118 1.00 0.00 H new ATOM 0 HB2 LEU A 6 1.027 8.970 6.916 1.00 0.00 H new ATOM 0 HB3 LEU A 6 1.897 9.581 5.523 1.00 0.00 H new ATOM 0 HG LEU A 6 3.265 7.430 7.106 1.00 0.00 H new ATOM 0 HD11 LEU A 6 1.966 5.659 5.959 1.00 0.00 H new ATOM 0 HD12 LEU A 6 0.923 6.629 7.026 1.00 0.00 H new ATOM 0 HD13 LEU A 6 0.890 6.897 5.267 1.00 0.00 H new ATOM 0 HD21 LEU A 6 3.919 6.721 4.818 1.00 0.00 H new ATOM 0 HD22 LEU A 6 2.847 7.963 4.128 1.00 0.00 H new ATOM 0 HD23 LEU A 6 4.273 8.445 5.078 1.00 0.00 H new ATOM 104 N ILE A 7 1.629 11.843 8.106 1.00 0.00 N ATOM 105 CA ILE A 7 1.292 13.295 8.036 1.00 0.00 C ATOM 106 C ILE A 7 2.537 14.090 8.388 1.00 0.00 C ATOM 107 O ILE A 7 2.920 14.999 7.683 1.00 0.00 O ATOM 108 CB ILE A 7 0.116 13.565 9.005 1.00 0.00 C ATOM 109 CG1 ILE A 7 0.581 13.677 10.464 1.00 0.00 C ATOM 110 CG2 ILE A 7 -0.925 12.450 8.883 1.00 0.00 C ATOM 111 CD1 ILE A 7 0.759 15.152 10.832 1.00 0.00 C ATOM 0 H ILE A 7 1.089 11.294 8.775 1.00 0.00 H new ATOM 0 HA ILE A 7 0.977 13.598 7.038 1.00 0.00 H new ATOM 0 HB ILE A 7 -0.325 14.521 8.723 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -0.149 13.212 11.126 1.00 0.00 H new ATOM 0 HG13 ILE A 7 1.521 13.142 10.599 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -1.750 12.646 9.568 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -1.302 12.415 7.861 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -0.465 11.494 9.133 1.00 0.00 H new ATOM 0 HD11 ILE A 7 1.089 15.231 11.868 1.00 0.00 H new ATOM 0 HD12 ILE A 7 1.505 15.603 10.178 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -0.191 15.674 10.713 1.00 0.00 H new ATOM 123 N LYS A 8 3.209 13.718 9.439 1.00 0.00 N ATOM 124 CA LYS A 8 4.462 14.432 9.787 1.00 0.00 C ATOM 125 C LYS A 8 5.545 14.041 8.779 1.00 0.00 C ATOM 126 O LYS A 8 6.475 14.784 8.534 1.00 0.00 O ATOM 127 CB LYS A 8 4.825 13.990 11.206 1.00 0.00 C ATOM 128 CG LYS A 8 5.032 12.480 11.240 1.00 0.00 C ATOM 129 CD LYS A 8 5.874 12.105 12.456 1.00 0.00 C ATOM 130 CE LYS A 8 6.280 10.638 12.342 1.00 0.00 C ATOM 131 NZ LYS A 8 7.614 10.554 13.000 1.00 0.00 N ATOM 0 H LYS A 8 2.947 12.957 10.066 1.00 0.00 H new ATOM 0 HA LYS A 8 4.356 15.516 9.751 1.00 0.00 H new ATOM 0 HB2 LYS A 8 5.732 14.498 11.534 1.00 0.00 H new ATOM 0 HB3 LYS A 8 4.033 14.273 11.899 1.00 0.00 H new ATOM 0 HG2 LYS A 8 4.069 11.972 11.282 1.00 0.00 H new ATOM 0 HG3 LYS A 8 5.527 12.150 10.327 1.00 0.00 H new ATOM 0 HD2 LYS A 8 6.760 12.738 12.511 1.00 0.00 H new ATOM 0 HD3 LYS A 8 5.307 12.269 13.372 1.00 0.00 H new ATOM 0 HE2 LYS A 8 5.556 9.989 12.834 1.00 0.00 H new ATOM 0 HE3 LYS A 8 6.334 10.323 11.300 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 7.959 9.574 12.961 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 8.285 11.177 12.506 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 7.531 10.853 13.993 1.00 0.00 H new ATOM 145 N ALA A 9 5.417 12.883 8.168 1.00 0.00 N ATOM 146 CA ALA A 9 6.428 12.465 7.157 1.00 0.00 C ATOM 147 C ALA A 9 6.482 13.510 6.045 1.00 0.00 C ATOM 148 O ALA A 9 7.542 13.866 5.571 1.00 0.00 O ATOM 149 CB ALA A 9 5.929 11.132 6.613 1.00 0.00 C ATOM 0 H ALA A 9 4.660 12.218 8.328 1.00 0.00 H new ATOM 0 HA ALA A 9 7.430 12.372 7.577 1.00 0.00 H new ATOM 0 HB1 ALA A 9 6.626 10.762 5.861 1.00 0.00 H new ATOM 0 HB2 ALA A 9 5.857 10.411 7.427 1.00 0.00 H new ATOM 0 HB3 ALA A 9 4.946 11.268 6.161 1.00 0.00 H new ATOM 155 N ILE A 10 5.348 14.038 5.655 1.00 0.00 N ATOM 156 CA ILE A 10 5.345 15.087 4.617 1.00 0.00 C ATOM 157 C ILE A 10 5.407 16.420 5.349 1.00 0.00 C ATOM 158 O ILE A 10 6.017 17.367 4.905 1.00 0.00 O ATOM 159 CB ILE A 10 4.020 14.888 3.849 1.00 0.00 C ATOM 160 CG1 ILE A 10 4.310 14.601 2.375 1.00 0.00 C ATOM 161 CG2 ILE A 10 3.140 16.139 3.950 1.00 0.00 C ATOM 162 CD1 ILE A 10 5.160 13.333 2.258 1.00 0.00 C ATOM 0 H ILE A 10 4.430 13.781 6.017 1.00 0.00 H new ATOM 0 HA ILE A 10 6.178 15.050 3.915 1.00 0.00 H new ATOM 0 HB ILE A 10 3.493 14.045 4.295 1.00 0.00 H new ATOM 0 HG12 ILE A 10 3.376 14.477 1.827 1.00 0.00 H new ATOM 0 HG13 ILE A 10 4.833 15.445 1.926 1.00 0.00 H new ATOM 0 HG21 ILE A 10 2.212 15.976 3.402 1.00 0.00 H new ATOM 0 HG22 ILE A 10 2.913 16.340 4.997 1.00 0.00 H new ATOM 0 HG23 ILE A 10 3.669 16.991 3.523 1.00 0.00 H new ATOM 0 HD11 ILE A 10 5.366 13.129 1.207 1.00 0.00 H new ATOM 0 HD12 ILE A 10 6.100 13.475 2.792 1.00 0.00 H new ATOM 0 HD13 ILE A 10 4.620 12.492 2.692 1.00 0.00 H new ATOM 174 N ALA A 11 4.819 16.488 6.506 1.00 0.00 N ATOM 175 CA ALA A 11 4.891 17.754 7.271 1.00 0.00 C ATOM 176 C ALA A 11 6.360 18.073 7.569 1.00 0.00 C ATOM 177 O ALA A 11 6.704 19.176 7.943 1.00 0.00 O ATOM 178 CB ALA A 11 4.114 17.482 8.555 1.00 0.00 C ATOM 0 H ALA A 11 4.298 15.731 6.949 1.00 0.00 H new ATOM 0 HA ALA A 11 4.477 18.607 6.734 1.00 0.00 H new ATOM 0 HB1 ALA A 11 4.120 18.375 9.180 1.00 0.00 H new ATOM 0 HB2 ALA A 11 3.085 17.218 8.309 1.00 0.00 H new ATOM 0 HB3 ALA A 11 4.581 16.658 9.095 1.00 0.00 H new ATOM 184 N GLN A 12 7.234 17.111 7.391 1.00 0.00 N ATOM 185 CA GLN A 12 8.677 17.357 7.641 1.00 0.00 C ATOM 186 C GLN A 12 9.447 17.288 6.321 1.00 0.00 C ATOM 187 O GLN A 12 10.264 18.140 6.032 1.00 0.00 O ATOM 188 CB GLN A 12 9.119 16.249 8.598 1.00 0.00 C ATOM 189 CG GLN A 12 8.358 16.377 9.920 1.00 0.00 C ATOM 190 CD GLN A 12 9.246 17.061 10.962 1.00 0.00 C ATOM 191 OE1 GLN A 12 9.994 18.070 10.605 1.00 0.00 O flip ATOM 192 NE2 GLN A 12 9.261 16.674 12.114 1.00 0.00 N flip ATOM 0 H GLN A 12 7.003 16.167 7.083 1.00 0.00 H new ATOM 0 HA GLN A 12 8.866 18.342 8.068 1.00 0.00 H new ATOM 0 HB2 GLN A 12 8.930 15.273 8.152 1.00 0.00 H new ATOM 0 HB3 GLN A 12 10.192 16.316 8.777 1.00 0.00 H new ATOM 0 HG2 GLN A 12 7.445 16.954 9.771 1.00 0.00 H new ATOM 0 HG3 GLN A 12 8.058 15.391 10.275 1.00 0.00 H new ATOM 0 HE21 GLN A 12 8.677 15.886 12.395 1.00 0.00 H new ATOM 0 HE22 GLN A 12 9.857 17.137 12.800 1.00 0.00 H new ATOM 201 N ASP A 13 9.164 16.313 5.493 1.00 0.00 N ATOM 202 CA ASP A 13 9.862 16.254 4.174 1.00 0.00 C ATOM 203 C ASP A 13 9.406 17.471 3.389 1.00 0.00 C ATOM 204 O ASP A 13 10.167 18.139 2.716 1.00 0.00 O ATOM 205 CB ASP A 13 9.375 14.973 3.502 1.00 0.00 C ATOM 206 CG ASP A 13 10.214 13.791 3.986 1.00 0.00 C ATOM 207 OD1 ASP A 13 10.228 13.549 5.182 1.00 0.00 O ATOM 208 OD2 ASP A 13 10.832 13.147 3.154 1.00 0.00 O ATOM 0 H ASP A 13 8.491 15.567 5.670 1.00 0.00 H new ATOM 0 HA ASP A 13 10.949 16.252 4.248 1.00 0.00 H new ATOM 0 HB2 ASP A 13 8.323 14.805 3.735 1.00 0.00 H new ATOM 0 HB3 ASP A 13 9.451 15.067 2.419 1.00 0.00 H new ATOM 213 N THR A 14 8.150 17.769 3.531 1.00 0.00 N ATOM 214 CA THR A 14 7.555 18.951 2.878 1.00 0.00 C ATOM 215 C THR A 14 7.660 20.111 3.879 1.00 0.00 C ATOM 216 O THR A 14 8.454 21.017 3.720 1.00 0.00 O ATOM 217 CB THR A 14 6.098 18.529 2.624 1.00 0.00 C ATOM 218 OG1 THR A 14 5.944 17.149 2.926 1.00 0.00 O ATOM 219 CG2 THR A 14 5.739 18.718 1.167 1.00 0.00 C ATOM 0 H THR A 14 7.495 17.223 4.091 1.00 0.00 H new ATOM 0 HA THR A 14 8.030 19.271 1.950 1.00 0.00 H new ATOM 0 HB THR A 14 5.452 19.143 3.252 1.00 0.00 H new ATOM 0 HG1 THR A 14 6.528 16.620 2.343 1.00 0.00 H new ATOM 0 HG21 THR A 14 4.705 18.415 1.005 1.00 0.00 H new ATOM 0 HG22 THR A 14 5.856 19.767 0.897 1.00 0.00 H new ATOM 0 HG23 THR A 14 6.397 18.108 0.548 1.00 0.00 H new ATOM 227 N GLY A 15 6.895 20.050 4.939 1.00 0.00 N ATOM 228 CA GLY A 15 6.969 21.102 6.004 1.00 0.00 C ATOM 229 C GLY A 15 6.681 22.486 5.434 1.00 0.00 C ATOM 230 O GLY A 15 7.003 23.494 6.033 1.00 0.00 O ATOM 0 H GLY A 15 6.215 19.310 5.116 1.00 0.00 H new ATOM 0 HA2 GLY A 15 6.253 20.875 6.793 1.00 0.00 H new ATOM 0 HA3 GLY A 15 7.959 21.093 6.460 1.00 0.00 H new ATOM 234 N LEU A 16 6.069 22.543 4.296 1.00 0.00 N ATOM 235 CA LEU A 16 5.742 23.866 3.688 1.00 0.00 C ATOM 236 C LEU A 16 4.786 24.627 4.588 1.00 0.00 C ATOM 237 O LEU A 16 5.094 25.680 5.111 1.00 0.00 O ATOM 238 CB LEU A 16 5.043 23.539 2.377 1.00 0.00 C ATOM 239 CG LEU A 16 6.052 22.946 1.410 1.00 0.00 C ATOM 240 CD1 LEU A 16 5.890 21.430 1.367 1.00 0.00 C ATOM 241 CD2 LEU A 16 5.812 23.530 0.015 1.00 0.00 C ATOM 0 H LEU A 16 5.776 21.731 3.752 1.00 0.00 H new ATOM 0 HA LEU A 16 6.632 24.479 3.546 1.00 0.00 H new ATOM 0 HB2 LEU A 16 4.229 22.835 2.550 1.00 0.00 H new ATOM 0 HB3 LEU A 16 4.600 24.440 1.952 1.00 0.00 H new ATOM 0 HG LEU A 16 7.063 23.188 1.739 1.00 0.00 H new ATOM 0 HD11 LEU A 16 6.615 21.006 0.672 1.00 0.00 H new ATOM 0 HD12 LEU A 16 6.057 21.018 2.362 1.00 0.00 H new ATOM 0 HD13 LEU A 16 4.882 21.181 1.036 1.00 0.00 H new ATOM 0 HD21 LEU A 16 6.533 23.108 -0.685 1.00 0.00 H new ATOM 0 HD22 LEU A 16 4.802 23.285 -0.313 1.00 0.00 H new ATOM 0 HD23 LEU A 16 5.930 24.613 0.049 1.00 0.00 H new ATOM 253 N THR A 17 3.621 24.089 4.757 1.00 0.00 N ATOM 254 CA THR A 17 2.604 24.743 5.607 1.00 0.00 C ATOM 255 C THR A 17 1.903 23.692 6.459 1.00 0.00 C ATOM 256 O THR A 17 0.900 23.964 7.090 1.00 0.00 O ATOM 257 CB THR A 17 1.625 25.371 4.603 1.00 0.00 C ATOM 258 OG1 THR A 17 1.151 26.608 5.114 1.00 0.00 O ATOM 259 CG2 THR A 17 0.438 24.433 4.351 1.00 0.00 C ATOM 0 H THR A 17 3.325 23.209 4.335 1.00 0.00 H new ATOM 0 HA THR A 17 3.022 25.482 6.291 1.00 0.00 H new ATOM 0 HB THR A 17 2.147 25.536 3.661 1.00 0.00 H new ATOM 0 HG1 THR A 17 0.528 27.009 4.473 1.00 0.00 H new ATOM 0 HG21 THR A 17 -0.245 24.894 3.638 1.00 0.00 H new ATOM 0 HG22 THR A 17 0.801 23.488 3.947 1.00 0.00 H new ATOM 0 HG23 THR A 17 -0.086 24.250 5.289 1.00 0.00 H new ATOM 267 N GLN A 18 2.381 22.474 6.435 1.00 0.00 N ATOM 268 CA GLN A 18 1.679 21.401 7.183 1.00 0.00 C ATOM 269 C GLN A 18 0.255 21.352 6.628 1.00 0.00 C ATOM 270 O GLN A 18 -0.680 20.975 7.304 1.00 0.00 O ATOM 271 CB GLN A 18 1.692 21.818 8.658 1.00 0.00 C ATOM 272 CG GLN A 18 3.086 22.321 9.037 1.00 0.00 C ATOM 273 CD GLN A 18 3.255 22.271 10.557 1.00 0.00 C ATOM 274 OE1 GLN A 18 2.628 21.472 11.224 1.00 0.00 O ATOM 275 NE2 GLN A 18 4.083 23.097 11.137 1.00 0.00 N ATOM 0 H GLN A 18 3.220 22.183 5.933 1.00 0.00 H new ATOM 0 HA GLN A 18 2.139 20.417 7.086 1.00 0.00 H new ATOM 0 HB2 GLN A 18 0.953 22.600 8.832 1.00 0.00 H new ATOM 0 HB3 GLN A 18 1.416 20.972 9.288 1.00 0.00 H new ATOM 0 HG2 GLN A 18 3.848 21.708 8.556 1.00 0.00 H new ATOM 0 HG3 GLN A 18 3.225 23.341 8.679 1.00 0.00 H new ATOM 0 HE21 GLN A 18 4.610 23.768 10.578 1.00 0.00 H new ATOM 0 HE22 GLN A 18 4.203 23.071 12.150 1.00 0.00 H new ATOM 284 N VAL A 19 0.121 21.774 5.381 1.00 0.00 N ATOM 285 CA VAL A 19 -1.202 21.827 4.675 1.00 0.00 C ATOM 286 C VAL A 19 -2.264 21.033 5.435 1.00 0.00 C ATOM 287 O VAL A 19 -2.847 21.506 6.389 1.00 0.00 O ATOM 288 CB VAL A 19 -0.917 21.245 3.262 1.00 0.00 C ATOM 289 CG1 VAL A 19 -0.169 19.906 3.360 1.00 0.00 C ATOM 290 CG2 VAL A 19 -2.219 21.020 2.470 1.00 0.00 C ATOM 0 H VAL A 19 0.904 22.093 4.811 1.00 0.00 H new ATOM 0 HA VAL A 19 -1.605 22.838 4.611 1.00 0.00 H new ATOM 0 HB VAL A 19 -0.300 21.977 2.740 1.00 0.00 H new ATOM 0 HG11 VAL A 19 0.018 19.520 2.358 1.00 0.00 H new ATOM 0 HG12 VAL A 19 0.780 20.056 3.874 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -0.774 19.191 3.917 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -1.981 20.613 1.487 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -2.856 20.319 3.009 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -2.742 21.969 2.352 1.00 0.00 H new ATOM 300 N SER A 20 -2.485 19.833 5.040 1.00 0.00 N ATOM 301 CA SER A 20 -3.447 18.973 5.708 1.00 0.00 C ATOM 302 C SER A 20 -2.727 17.677 5.978 1.00 0.00 C ATOM 303 O SER A 20 -3.340 16.649 6.093 1.00 0.00 O ATOM 304 CB SER A 20 -4.589 18.785 4.712 1.00 0.00 C ATOM 305 OG SER A 20 -5.728 19.506 5.167 1.00 0.00 O ATOM 0 H SER A 20 -2.014 19.400 4.246 1.00 0.00 H new ATOM 0 HA SER A 20 -3.841 19.366 6.645 1.00 0.00 H new ATOM 0 HB2 SER A 20 -4.289 19.139 3.726 1.00 0.00 H new ATOM 0 HB3 SER A 20 -4.830 17.727 4.611 1.00 0.00 H new ATOM 0 HG SER A 20 -6.503 19.277 4.612 1.00 0.00 H new ATOM 311 N VAL A 21 -1.406 17.715 6.040 1.00 0.00 N ATOM 312 CA VAL A 21 -0.611 16.476 6.278 1.00 0.00 C ATOM 313 C VAL A 21 -1.474 15.463 6.998 1.00 0.00 C ATOM 314 O VAL A 21 -1.484 14.281 6.699 1.00 0.00 O ATOM 315 CB VAL A 21 0.555 16.925 7.158 1.00 0.00 C ATOM 316 CG1 VAL A 21 1.448 17.881 6.366 1.00 0.00 C ATOM 317 CG2 VAL A 21 0.030 17.641 8.407 1.00 0.00 C ATOM 0 H VAL A 21 -0.850 18.564 5.934 1.00 0.00 H new ATOM 0 HA VAL A 21 -0.260 16.007 5.359 1.00 0.00 H new ATOM 0 HB VAL A 21 1.127 16.049 7.464 1.00 0.00 H new ATOM 0 HG11 VAL A 21 2.281 18.203 6.991 1.00 0.00 H new ATOM 0 HG12 VAL A 21 1.833 17.371 5.483 1.00 0.00 H new ATOM 0 HG13 VAL A 21 0.867 18.751 6.059 1.00 0.00 H new ATOM 0 HG21 VAL A 21 0.870 17.956 9.026 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -0.549 18.515 8.109 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -0.605 16.962 8.976 1.00 0.00 H new ATOM 327 N SER A 22 -2.247 15.961 7.907 1.00 0.00 N ATOM 328 CA SER A 22 -3.182 15.083 8.660 1.00 0.00 C ATOM 329 C SER A 22 -4.447 14.871 7.835 1.00 0.00 C ATOM 330 O SER A 22 -5.035 13.814 7.845 1.00 0.00 O ATOM 331 CB SER A 22 -3.494 15.835 9.953 1.00 0.00 C ATOM 332 OG SER A 22 -4.395 15.066 10.737 1.00 0.00 O ATOM 0 H SER A 22 -2.276 16.947 8.167 1.00 0.00 H new ATOM 0 HA SER A 22 -2.760 14.100 8.869 1.00 0.00 H new ATOM 0 HB2 SER A 22 -2.576 16.020 10.510 1.00 0.00 H new ATOM 0 HB3 SER A 22 -3.930 16.808 9.725 1.00 0.00 H new ATOM 0 HG SER A 22 -4.596 15.545 11.568 1.00 0.00 H new ATOM 338 N LYS A 23 -4.857 15.875 7.114 1.00 0.00 N ATOM 339 CA LYS A 23 -6.072 15.751 6.274 1.00 0.00 C ATOM 340 C LYS A 23 -5.739 15.174 4.892 1.00 0.00 C ATOM 341 O LYS A 23 -6.509 14.407 4.355 1.00 0.00 O ATOM 342 CB LYS A 23 -6.619 17.170 6.165 1.00 0.00 C ATOM 343 CG LYS A 23 -7.828 17.327 7.087 1.00 0.00 C ATOM 344 CD LYS A 23 -8.039 18.809 7.410 1.00 0.00 C ATOM 345 CE LYS A 23 -6.795 19.367 8.110 1.00 0.00 C ATOM 346 NZ LYS A 23 -7.322 20.218 9.213 1.00 0.00 N ATOM 0 H LYS A 23 -4.396 16.784 7.072 1.00 0.00 H new ATOM 0 HA LYS A 23 -6.800 15.066 6.709 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -5.847 17.890 6.436 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -6.905 17.382 5.135 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -8.718 16.918 6.609 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -7.673 16.763 8.006 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -8.234 19.367 6.494 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -8.913 18.931 8.049 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -6.166 18.565 8.496 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -6.182 19.949 7.421 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -6.528 20.636 9.739 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -7.911 20.977 8.815 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -7.896 19.636 9.857 1.00 0.00 H new ATOM 360 N MET A 24 -4.611 15.505 4.300 1.00 0.00 N ATOM 361 CA MET A 24 -4.321 14.910 2.961 1.00 0.00 C ATOM 362 C MET A 24 -4.030 13.423 3.130 1.00 0.00 C ATOM 363 O MET A 24 -4.466 12.618 2.331 1.00 0.00 O ATOM 364 CB MET A 24 -3.118 15.631 2.317 1.00 0.00 C ATOM 365 CG MET A 24 -2.351 16.501 3.309 1.00 0.00 C ATOM 366 SD MET A 24 -0.601 16.339 2.956 1.00 0.00 S ATOM 367 CE MET A 24 -0.544 14.669 3.618 1.00 0.00 C ATOM 0 H MET A 24 -3.904 16.139 4.673 1.00 0.00 H new ATOM 0 HA MET A 24 -5.183 15.032 2.306 1.00 0.00 H new ATOM 0 HB2 MET A 24 -2.441 14.890 1.891 1.00 0.00 H new ATOM 0 HB3 MET A 24 -3.470 16.251 1.493 1.00 0.00 H new ATOM 0 HG2 MET A 24 -2.662 17.542 3.222 1.00 0.00 H new ATOM 0 HG3 MET A 24 -2.563 16.190 4.332 1.00 0.00 H new ATOM 0 HE1 MET A 24 0.423 14.498 4.091 1.00 0.00 H new ATOM 0 HE2 MET A 24 -1.336 14.543 4.356 1.00 0.00 H new ATOM 0 HE3 MET A 24 -0.684 13.952 2.809 1.00 0.00 H new ATOM 377 N LEU A 25 -3.323 13.026 4.165 1.00 0.00 N ATOM 378 CA LEU A 25 -3.076 11.569 4.329 1.00 0.00 C ATOM 379 C LEU A 25 -4.329 10.902 4.893 1.00 0.00 C ATOM 380 O LEU A 25 -4.758 9.873 4.410 1.00 0.00 O ATOM 381 CB LEU A 25 -1.897 11.449 5.276 1.00 0.00 C ATOM 382 CG LEU A 25 -0.620 11.513 4.444 1.00 0.00 C ATOM 383 CD1 LEU A 25 0.545 11.946 5.323 1.00 0.00 C ATOM 384 CD2 LEU A 25 -0.329 10.134 3.848 1.00 0.00 C ATOM 0 H LEU A 25 -2.920 13.632 4.880 1.00 0.00 H new ATOM 0 HA LEU A 25 -2.852 11.073 3.385 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -1.914 12.254 6.011 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -1.946 10.511 5.829 1.00 0.00 H new ATOM 0 HG LEU A 25 -0.750 12.236 3.639 1.00 0.00 H new ATOM 0 HD11 LEU A 25 1.455 11.990 4.725 1.00 0.00 H new ATOM 0 HD12 LEU A 25 0.338 12.931 5.742 1.00 0.00 H new ATOM 0 HD13 LEU A 25 0.677 11.227 6.132 1.00 0.00 H new ATOM 0 HD21 LEU A 25 0.583 10.180 3.253 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -0.202 9.409 4.652 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -1.161 9.829 3.213 1.00 0.00 H new ATOM 396 N ALA A 26 -4.950 11.491 5.885 1.00 0.00 N ATOM 397 CA ALA A 26 -6.200 10.880 6.421 1.00 0.00 C ATOM 398 C ALA A 26 -7.202 10.769 5.277 1.00 0.00 C ATOM 399 O ALA A 26 -7.985 9.839 5.198 1.00 0.00 O ATOM 400 CB ALA A 26 -6.712 11.837 7.496 1.00 0.00 C ATOM 0 H ALA A 26 -4.650 12.354 6.339 1.00 0.00 H new ATOM 0 HA ALA A 26 -6.041 9.886 6.840 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -7.631 11.441 7.928 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -5.960 11.942 8.278 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -6.911 12.812 7.051 1.00 0.00 H new ATOM 406 N SER A 27 -7.155 11.702 4.363 1.00 0.00 N ATOM 407 CA SER A 27 -8.072 11.643 3.202 1.00 0.00 C ATOM 408 C SER A 27 -7.448 10.757 2.128 1.00 0.00 C ATOM 409 O SER A 27 -8.139 10.083 1.404 1.00 0.00 O ATOM 410 CB SER A 27 -8.222 13.080 2.707 1.00 0.00 C ATOM 411 OG SER A 27 -7.076 13.441 1.948 1.00 0.00 O ATOM 0 H SER A 27 -6.519 12.500 4.376 1.00 0.00 H new ATOM 0 HA SER A 27 -9.045 11.224 3.457 1.00 0.00 H new ATOM 0 HB2 SER A 27 -9.120 13.174 2.097 1.00 0.00 H new ATOM 0 HB3 SER A 27 -8.339 13.757 3.553 1.00 0.00 H new ATOM 0 HG SER A 27 -7.214 13.194 1.010 1.00 0.00 H new ATOM 417 N PHE A 28 -6.138 10.732 2.041 1.00 0.00 N ATOM 418 CA PHE A 28 -5.475 9.855 1.026 1.00 0.00 C ATOM 419 C PHE A 28 -5.947 8.428 1.245 1.00 0.00 C ATOM 420 O PHE A 28 -6.145 7.677 0.326 1.00 0.00 O ATOM 421 CB PHE A 28 -3.969 9.984 1.280 1.00 0.00 C ATOM 422 CG PHE A 28 -3.298 8.618 1.350 1.00 0.00 C ATOM 423 CD1 PHE A 28 -2.780 8.016 0.192 1.00 0.00 C ATOM 424 CD2 PHE A 28 -3.153 7.971 2.584 1.00 0.00 C ATOM 425 CE1 PHE A 28 -2.133 6.783 0.275 1.00 0.00 C ATOM 426 CE2 PHE A 28 -2.498 6.749 2.664 1.00 0.00 C ATOM 427 CZ PHE A 28 -1.986 6.149 1.511 1.00 0.00 C ATOM 0 H PHE A 28 -5.504 11.277 2.625 1.00 0.00 H new ATOM 0 HA PHE A 28 -5.713 10.135 -0.000 1.00 0.00 H new ATOM 0 HB2 PHE A 28 -3.514 10.574 0.485 1.00 0.00 H new ATOM 0 HB3 PHE A 28 -3.801 10.522 2.213 1.00 0.00 H new ATOM 0 HD1 PHE A 28 -2.883 8.508 -0.764 1.00 0.00 H new ATOM 0 HD2 PHE A 28 -3.553 8.425 3.478 1.00 0.00 H new ATOM 0 HE1 PHE A 28 -1.745 6.317 -0.619 1.00 0.00 H new ATOM 0 HE2 PHE A 28 -2.384 6.261 3.621 1.00 0.00 H new ATOM 0 HZ PHE A 28 -1.478 5.198 1.575 1.00 0.00 H new ATOM 437 N GLU A 29 -6.168 8.074 2.464 1.00 0.00 N ATOM 438 CA GLU A 29 -6.660 6.726 2.765 1.00 0.00 C ATOM 439 C GLU A 29 -8.137 6.716 2.502 1.00 0.00 C ATOM 440 O GLU A 29 -8.685 5.791 1.942 1.00 0.00 O ATOM 441 CB GLU A 29 -6.345 6.552 4.236 1.00 0.00 C ATOM 442 CG GLU A 29 -5.054 5.773 4.330 1.00 0.00 C ATOM 443 CD GLU A 29 -4.205 6.293 5.492 1.00 0.00 C ATOM 444 OE1 GLU A 29 -3.707 7.401 5.388 1.00 0.00 O ATOM 445 OE2 GLU A 29 -4.066 5.572 6.465 1.00 0.00 O ATOM 0 H GLU A 29 -6.025 8.673 3.277 1.00 0.00 H new ATOM 0 HA GLU A 29 -6.218 5.925 2.172 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -6.245 7.521 4.725 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -7.152 6.021 4.742 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -5.270 4.714 4.473 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -4.499 5.862 3.396 1.00 0.00 H new ATOM 452 N LYS A 30 -8.777 7.780 2.858 1.00 0.00 N ATOM 453 CA LYS A 30 -10.220 7.878 2.586 1.00 0.00 C ATOM 454 C LYS A 30 -10.414 7.922 1.077 1.00 0.00 C ATOM 455 O LYS A 30 -11.406 7.485 0.582 1.00 0.00 O ATOM 456 CB LYS A 30 -10.687 9.184 3.223 1.00 0.00 C ATOM 457 CG LYS A 30 -12.181 9.363 2.950 1.00 0.00 C ATOM 458 CD LYS A 30 -12.672 10.657 3.604 1.00 0.00 C ATOM 459 CE LYS A 30 -12.652 10.499 5.126 1.00 0.00 C ATOM 460 NZ LYS A 30 -13.093 11.819 5.655 1.00 0.00 N ATOM 0 H LYS A 30 -8.362 8.586 3.326 1.00 0.00 H new ATOM 0 HA LYS A 30 -10.783 7.035 2.987 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -10.500 9.168 4.297 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -10.126 10.024 2.814 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -12.363 9.395 1.876 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -12.737 8.512 3.343 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -12.037 11.491 3.306 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -13.682 10.888 3.265 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -13.320 9.701 5.449 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -11.654 10.244 5.483 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -13.105 11.790 6.695 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -12.434 12.558 5.337 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -14.048 12.032 5.304 1.00 0.00 H new ATOM 474 N ILE A 31 -9.449 8.421 0.341 1.00 0.00 N ATOM 475 CA ILE A 31 -9.595 8.462 -1.141 1.00 0.00 C ATOM 476 C ILE A 31 -8.971 7.209 -1.733 1.00 0.00 C ATOM 477 O ILE A 31 -9.495 6.626 -2.657 1.00 0.00 O ATOM 478 CB ILE A 31 -8.883 9.725 -1.628 1.00 0.00 C ATOM 479 CG1 ILE A 31 -7.446 9.757 -1.148 1.00 0.00 C ATOM 480 CG2 ILE A 31 -9.620 10.968 -1.129 1.00 0.00 C ATOM 481 CD1 ILE A 31 -6.521 9.357 -2.297 1.00 0.00 C ATOM 0 H ILE A 31 -8.573 8.798 0.704 1.00 0.00 H new ATOM 0 HA ILE A 31 -10.640 8.490 -1.449 1.00 0.00 H new ATOM 0 HB ILE A 31 -8.884 9.715 -2.718 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -7.192 10.755 -0.792 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -7.316 9.076 -0.307 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -9.105 11.862 -1.481 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -10.641 10.963 -1.510 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -9.640 10.966 -0.039 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -5.486 9.379 -1.955 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -6.771 8.350 -2.632 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -6.645 10.056 -3.124 1.00 0.00 H new ATOM 493 N ILE A 32 -7.874 6.762 -1.183 1.00 0.00 N ATOM 494 CA ILE A 32 -7.263 5.510 -1.700 1.00 0.00 C ATOM 495 C ILE A 32 -8.294 4.413 -1.564 1.00 0.00 C ATOM 496 O ILE A 32 -8.625 3.720 -2.502 1.00 0.00 O ATOM 497 CB ILE A 32 -6.072 5.167 -0.809 1.00 0.00 C ATOM 498 CG1 ILE A 32 -4.945 6.182 -1.021 1.00 0.00 C ATOM 499 CG2 ILE A 32 -5.583 3.767 -1.199 1.00 0.00 C ATOM 500 CD1 ILE A 32 -3.813 5.576 -1.854 1.00 0.00 C ATOM 0 H ILE A 32 -7.382 7.205 -0.408 1.00 0.00 H new ATOM 0 HA ILE A 32 -6.945 5.620 -2.737 1.00 0.00 H new ATOM 0 HB ILE A 32 -6.367 5.194 0.240 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -5.337 7.067 -1.522 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -4.557 6.508 -0.056 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -4.730 3.493 -0.578 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -6.387 3.046 -1.050 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -5.284 3.765 -2.247 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -3.025 6.317 -1.990 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -3.408 4.706 -1.338 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -4.199 5.274 -2.827 1.00 0.00 H new ATOM 512 N THR A 33 -8.800 4.268 -0.374 1.00 0.00 N ATOM 513 CA THR A 33 -9.820 3.237 -0.118 1.00 0.00 C ATOM 514 C THR A 33 -11.123 3.649 -0.821 1.00 0.00 C ATOM 515 O THR A 33 -11.925 2.819 -1.205 1.00 0.00 O ATOM 516 CB THR A 33 -9.946 3.191 1.419 1.00 0.00 C ATOM 517 OG1 THR A 33 -9.591 1.906 1.892 1.00 0.00 O ATOM 518 CG2 THR A 33 -11.368 3.502 1.863 1.00 0.00 C ATOM 0 H THR A 33 -8.542 4.830 0.437 1.00 0.00 H new ATOM 0 HA THR A 33 -9.570 2.248 -0.503 1.00 0.00 H new ATOM 0 HB THR A 33 -9.274 3.944 1.832 1.00 0.00 H new ATOM 0 HG1 THR A 33 -8.621 1.785 1.815 1.00 0.00 H new ATOM 0 HG21 THR A 33 -11.426 3.462 2.951 1.00 0.00 H new ATOM 0 HG22 THR A 33 -11.646 4.499 1.521 1.00 0.00 H new ATOM 0 HG23 THR A 33 -12.051 2.768 1.436 1.00 0.00 H new ATOM 526 N GLU A 34 -11.334 4.930 -1.009 1.00 0.00 N ATOM 527 CA GLU A 34 -12.571 5.377 -1.706 1.00 0.00 C ATOM 528 C GLU A 34 -12.451 5.154 -3.220 1.00 0.00 C ATOM 529 O GLU A 34 -13.368 4.655 -3.829 1.00 0.00 O ATOM 530 CB GLU A 34 -12.708 6.859 -1.390 1.00 0.00 C ATOM 531 CG GLU A 34 -13.534 7.031 -0.104 1.00 0.00 C ATOM 532 CD GLU A 34 -15.017 6.818 -0.415 1.00 0.00 C ATOM 533 OE1 GLU A 34 -15.552 7.583 -1.200 1.00 0.00 O ATOM 534 OE2 GLU A 34 -15.591 5.893 0.136 1.00 0.00 O ATOM 0 H GLU A 34 -10.706 5.676 -0.711 1.00 0.00 H new ATOM 0 HA GLU A 34 -13.444 4.814 -1.375 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -11.723 7.309 -1.266 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -13.192 7.376 -2.219 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -13.204 6.317 0.651 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -13.378 8.027 0.310 1.00 0.00 H new ATOM 541 N THR A 35 -11.336 5.499 -3.843 1.00 0.00 N ATOM 542 CA THR A 35 -11.231 5.262 -5.323 1.00 0.00 C ATOM 543 C THR A 35 -11.350 3.779 -5.590 1.00 0.00 C ATOM 544 O THR A 35 -12.192 3.346 -6.351 1.00 0.00 O ATOM 545 CB THR A 35 -9.866 5.769 -5.771 1.00 0.00 C ATOM 546 OG1 THR A 35 -9.771 7.165 -5.518 1.00 0.00 O ATOM 547 CG2 THR A 35 -9.727 5.498 -7.272 1.00 0.00 C ATOM 0 H THR A 35 -10.519 5.922 -3.402 1.00 0.00 H new ATOM 0 HA THR A 35 -12.021 5.780 -5.867 1.00 0.00 H new ATOM 0 HB THR A 35 -9.071 5.261 -5.224 1.00 0.00 H new ATOM 0 HG1 THR A 35 -9.505 7.629 -6.339 1.00 0.00 H new ATOM 0 HG21 THR A 35 -8.756 5.853 -7.617 1.00 0.00 H new ATOM 0 HG22 THR A 35 -9.809 4.427 -7.457 1.00 0.00 H new ATOM 0 HG23 THR A 35 -10.517 6.021 -7.811 1.00 0.00 H new ATOM 555 N VAL A 36 -10.547 2.989 -4.942 1.00 0.00 N ATOM 556 CA VAL A 36 -10.668 1.519 -5.125 1.00 0.00 C ATOM 557 C VAL A 36 -12.139 1.155 -4.933 1.00 0.00 C ATOM 558 O VAL A 36 -12.683 0.293 -5.596 1.00 0.00 O ATOM 559 CB VAL A 36 -9.820 0.907 -4.012 1.00 0.00 C ATOM 560 CG1 VAL A 36 -8.340 1.161 -4.286 1.00 0.00 C ATOM 561 CG2 VAL A 36 -10.207 1.526 -2.674 1.00 0.00 C ATOM 0 H VAL A 36 -9.817 3.293 -4.298 1.00 0.00 H new ATOM 0 HA VAL A 36 -10.341 1.168 -6.104 1.00 0.00 H new ATOM 0 HB VAL A 36 -9.997 -0.168 -3.978 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -7.742 0.722 -3.488 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -8.063 0.708 -5.238 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -8.157 2.235 -4.328 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -9.601 1.088 -1.881 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -10.037 2.602 -2.708 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -11.261 1.331 -2.474 1.00 0.00 H new ATOM 571 N ALA A 37 -12.783 1.852 -4.034 1.00 0.00 N ATOM 572 CA ALA A 37 -14.228 1.619 -3.775 1.00 0.00 C ATOM 573 C ALA A 37 -15.082 2.549 -4.646 1.00 0.00 C ATOM 574 O ALA A 37 -16.296 2.524 -4.603 1.00 0.00 O ATOM 575 CB ALA A 37 -14.408 1.943 -2.307 1.00 0.00 C ATOM 0 H ALA A 37 -12.360 2.583 -3.462 1.00 0.00 H new ATOM 0 HA ALA A 37 -14.537 0.601 -4.012 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -15.451 1.797 -2.028 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -13.777 1.285 -1.709 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -14.125 2.980 -2.126 1.00 0.00 H new ATOM 581 N LYS A 38 -14.450 3.343 -5.456 1.00 0.00 N ATOM 582 CA LYS A 38 -15.197 4.242 -6.371 1.00 0.00 C ATOM 583 C LYS A 38 -15.167 3.594 -7.738 1.00 0.00 C ATOM 584 O LYS A 38 -16.107 3.672 -8.505 1.00 0.00 O ATOM 585 CB LYS A 38 -14.448 5.576 -6.377 1.00 0.00 C ATOM 586 CG LYS A 38 -15.449 6.723 -6.528 1.00 0.00 C ATOM 587 CD LYS A 38 -14.920 7.962 -5.801 1.00 0.00 C ATOM 588 CE LYS A 38 -14.851 7.685 -4.297 1.00 0.00 C ATOM 589 NZ LYS A 38 -14.781 9.032 -3.663 1.00 0.00 N ATOM 0 H LYS A 38 -13.434 3.409 -5.524 1.00 0.00 H new ATOM 0 HA LYS A 38 -16.232 4.408 -6.073 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -13.883 5.692 -5.452 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -13.728 5.597 -7.195 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -15.605 6.947 -7.583 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -16.416 6.432 -6.117 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -13.931 8.223 -6.179 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -15.571 8.815 -5.994 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -15.727 7.133 -3.956 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -13.977 7.084 -4.045 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -14.902 8.938 -2.634 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -13.857 9.463 -3.865 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -15.536 9.636 -4.046 1.00 0.00 H new ATOM 603 N GLY A 39 -14.094 2.910 -8.027 1.00 0.00 N ATOM 604 CA GLY A 39 -14.005 2.207 -9.315 1.00 0.00 C ATOM 605 C GLY A 39 -12.662 2.464 -10.005 1.00 0.00 C ATOM 606 O GLY A 39 -12.600 2.555 -11.216 1.00 0.00 O ATOM 0 H GLY A 39 -13.280 2.814 -7.419 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -14.134 1.136 -9.156 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -14.817 2.533 -9.965 1.00 0.00 H new ATOM 610 N ASP A 40 -11.584 2.574 -9.267 1.00 0.00 N ATOM 611 CA ASP A 40 -10.270 2.813 -9.941 1.00 0.00 C ATOM 612 C ASP A 40 -9.122 2.122 -9.191 1.00 0.00 C ATOM 613 O ASP A 40 -9.327 1.390 -8.244 1.00 0.00 O ATOM 614 CB ASP A 40 -10.085 4.333 -9.934 1.00 0.00 C ATOM 615 CG ASP A 40 -10.117 4.861 -11.369 1.00 0.00 C ATOM 616 OD1 ASP A 40 -10.953 4.403 -12.130 1.00 0.00 O ATOM 617 OD2 ASP A 40 -9.305 5.715 -11.683 1.00 0.00 O ATOM 0 H ASP A 40 -11.555 2.510 -8.249 1.00 0.00 H new ATOM 0 HA ASP A 40 -10.259 2.403 -10.951 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -10.873 4.803 -9.345 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -9.137 4.592 -9.462 1.00 0.00 H new ATOM 622 N LYS A 41 -7.914 2.365 -9.625 1.00 0.00 N ATOM 623 CA LYS A 41 -6.720 1.759 -8.981 1.00 0.00 C ATOM 624 C LYS A 41 -5.674 2.856 -8.807 1.00 0.00 C ATOM 625 O LYS A 41 -5.346 3.562 -9.741 1.00 0.00 O ATOM 626 CB LYS A 41 -6.226 0.696 -9.969 1.00 0.00 C ATOM 627 CG LYS A 41 -7.313 -0.364 -10.180 1.00 0.00 C ATOM 628 CD LYS A 41 -7.619 -0.492 -11.675 1.00 0.00 C ATOM 629 CE LYS A 41 -6.399 -1.069 -12.397 1.00 0.00 C ATOM 630 NZ LYS A 41 -6.397 -0.411 -13.734 1.00 0.00 N ATOM 0 H LYS A 41 -7.704 2.972 -10.417 1.00 0.00 H new ATOM 0 HA LYS A 41 -6.927 1.320 -8.005 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -5.970 1.162 -10.921 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -5.318 0.228 -9.589 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -6.982 -1.323 -9.782 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -8.216 -0.088 -9.636 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -8.484 -1.138 -11.826 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -7.873 0.483 -12.090 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -5.480 -0.857 -11.851 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -6.471 -2.153 -12.490 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -5.588 -0.756 -14.289 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -7.281 -0.637 -14.233 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -6.320 0.619 -13.614 1.00 0.00 H new ATOM 644 N VAL A 42 -5.164 3.024 -7.626 1.00 0.00 N ATOM 645 CA VAL A 42 -4.157 4.105 -7.408 1.00 0.00 C ATOM 646 C VAL A 42 -2.748 3.610 -7.750 1.00 0.00 C ATOM 647 O VAL A 42 -2.207 2.734 -7.104 1.00 0.00 O ATOM 648 CB VAL A 42 -4.285 4.486 -5.923 1.00 0.00 C ATOM 649 CG1 VAL A 42 -2.908 4.783 -5.319 1.00 0.00 C ATOM 650 CG2 VAL A 42 -5.164 5.734 -5.800 1.00 0.00 C ATOM 0 H VAL A 42 -5.395 2.467 -6.803 1.00 0.00 H new ATOM 0 HA VAL A 42 -4.332 4.967 -8.051 1.00 0.00 H new ATOM 0 HB VAL A 42 -4.732 3.651 -5.384 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -3.022 5.050 -4.268 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -2.276 3.899 -5.402 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -2.446 5.611 -5.856 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -5.259 6.010 -4.750 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -4.708 6.556 -6.351 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -6.152 5.525 -6.211 1.00 0.00 H new ATOM 660 N GLN A 43 -2.149 4.188 -8.756 1.00 0.00 N ATOM 661 CA GLN A 43 -0.767 3.788 -9.147 1.00 0.00 C ATOM 662 C GLN A 43 0.197 4.882 -8.696 1.00 0.00 C ATOM 663 O GLN A 43 0.321 5.907 -9.331 1.00 0.00 O ATOM 664 CB GLN A 43 -0.785 3.683 -10.676 1.00 0.00 C ATOM 665 CG GLN A 43 -2.025 2.909 -11.133 1.00 0.00 C ATOM 666 CD GLN A 43 -1.671 2.038 -12.340 1.00 0.00 C ATOM 667 OE1 GLN A 43 -1.721 0.827 -12.264 1.00 0.00 O ATOM 668 NE2 GLN A 43 -1.314 2.608 -13.458 1.00 0.00 N ATOM 0 H GLN A 43 -2.561 4.925 -9.328 1.00 0.00 H new ATOM 0 HA GLN A 43 -0.452 2.847 -8.696 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -0.785 4.680 -11.117 1.00 0.00 H new ATOM 0 HB3 GLN A 43 0.117 3.180 -11.025 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -2.398 2.287 -10.320 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -2.823 3.603 -11.395 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -1.272 3.625 -13.521 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -1.077 2.036 -14.269 1.00 0.00 H new ATOM 677 N LEU A 44 0.870 4.682 -7.598 1.00 0.00 N ATOM 678 CA LEU A 44 1.803 5.726 -7.104 1.00 0.00 C ATOM 679 C LEU A 44 3.041 5.803 -7.987 1.00 0.00 C ATOM 680 O LEU A 44 3.821 4.873 -8.043 1.00 0.00 O ATOM 681 CB LEU A 44 2.204 5.261 -5.712 1.00 0.00 C ATOM 682 CG LEU A 44 1.076 5.518 -4.714 1.00 0.00 C ATOM 683 CD1 LEU A 44 1.460 4.930 -3.353 1.00 0.00 C ATOM 684 CD2 LEU A 44 0.861 7.023 -4.567 1.00 0.00 C ATOM 0 H LEU A 44 0.813 3.841 -7.023 1.00 0.00 H new ATOM 0 HA LEU A 44 1.341 6.713 -7.106 1.00 0.00 H new ATOM 0 HB2 LEU A 44 2.443 4.198 -5.733 1.00 0.00 H new ATOM 0 HB3 LEU A 44 3.105 5.785 -5.393 1.00 0.00 H new ATOM 0 HG LEU A 44 0.159 5.050 -5.072 1.00 0.00 H new ATOM 0 HD11 LEU A 44 0.657 5.112 -2.639 1.00 0.00 H new ATOM 0 HD12 LEU A 44 1.621 3.857 -3.453 1.00 0.00 H new ATOM 0 HD13 LEU A 44 2.376 5.403 -2.998 1.00 0.00 H new ATOM 0 HD21 LEU A 44 0.056 7.208 -3.855 1.00 0.00 H new ATOM 0 HD22 LEU A 44 1.778 7.488 -4.206 1.00 0.00 H new ATOM 0 HD23 LEU A 44 0.594 7.449 -5.534 1.00 0.00 H new ATOM 696 N THR A 45 3.241 6.913 -8.659 1.00 0.00 N ATOM 697 CA THR A 45 4.451 7.071 -9.532 1.00 0.00 C ATOM 698 C THR A 45 4.918 5.702 -10.060 1.00 0.00 C ATOM 699 O THR A 45 4.193 5.029 -10.769 1.00 0.00 O ATOM 700 CB THR A 45 5.507 7.721 -8.620 1.00 0.00 C ATOM 701 OG1 THR A 45 6.767 7.711 -9.277 1.00 0.00 O ATOM 702 CG2 THR A 45 5.615 6.949 -7.295 1.00 0.00 C ATOM 0 H THR A 45 2.617 7.719 -8.641 1.00 0.00 H new ATOM 0 HA THR A 45 4.257 7.679 -10.416 1.00 0.00 H new ATOM 0 HB THR A 45 5.208 8.748 -8.407 1.00 0.00 H new ATOM 0 HG1 THR A 45 7.441 8.126 -8.699 1.00 0.00 H new ATOM 0 HG21 THR A 45 6.365 7.420 -6.660 1.00 0.00 H new ATOM 0 HG22 THR A 45 4.651 6.961 -6.787 1.00 0.00 H new ATOM 0 HG23 THR A 45 5.906 5.918 -7.497 1.00 0.00 H new ATOM 710 N GLY A 46 6.104 5.275 -9.713 1.00 0.00 N ATOM 711 CA GLY A 46 6.584 3.950 -10.183 1.00 0.00 C ATOM 712 C GLY A 46 7.043 3.128 -8.977 1.00 0.00 C ATOM 713 O GLY A 46 7.958 2.333 -9.076 1.00 0.00 O ATOM 0 H GLY A 46 6.759 5.790 -9.124 1.00 0.00 H new ATOM 0 HA2 GLY A 46 5.787 3.428 -10.713 1.00 0.00 H new ATOM 0 HA3 GLY A 46 7.406 4.076 -10.887 1.00 0.00 H new ATOM 717 N PHE A 47 6.422 3.310 -7.834 1.00 0.00 N ATOM 718 CA PHE A 47 6.849 2.526 -6.639 1.00 0.00 C ATOM 719 C PHE A 47 5.657 1.877 -5.924 1.00 0.00 C ATOM 720 O PHE A 47 5.805 0.826 -5.338 1.00 0.00 O ATOM 721 CB PHE A 47 7.677 3.499 -5.782 1.00 0.00 C ATOM 722 CG PHE A 47 6.862 4.189 -4.720 1.00 0.00 C ATOM 723 CD1 PHE A 47 5.646 4.801 -5.028 1.00 0.00 C ATOM 724 CD2 PHE A 47 7.353 4.236 -3.413 1.00 0.00 C ATOM 725 CE1 PHE A 47 4.930 5.449 -4.028 1.00 0.00 C ATOM 726 CE2 PHE A 47 6.635 4.880 -2.422 1.00 0.00 C ATOM 727 CZ PHE A 47 5.418 5.487 -2.733 1.00 0.00 C ATOM 0 H PHE A 47 5.650 3.959 -7.682 1.00 0.00 H new ATOM 0 HA PHE A 47 7.464 1.665 -6.899 1.00 0.00 H new ATOM 0 HB2 PHE A 47 8.493 2.953 -5.308 1.00 0.00 H new ATOM 0 HB3 PHE A 47 8.130 4.250 -6.430 1.00 0.00 H new ATOM 0 HD1 PHE A 47 5.263 4.771 -6.038 1.00 0.00 H new ATOM 0 HD2 PHE A 47 8.297 3.768 -3.176 1.00 0.00 H new ATOM 0 HE1 PHE A 47 3.989 5.925 -4.262 1.00 0.00 H new ATOM 0 HE2 PHE A 47 7.015 4.913 -1.412 1.00 0.00 H new ATOM 0 HZ PHE A 47 4.854 5.989 -1.960 1.00 0.00 H new ATOM 737 N LEU A 48 4.472 2.425 -5.988 1.00 0.00 N ATOM 738 CA LEU A 48 3.335 1.716 -5.337 1.00 0.00 C ATOM 739 C LEU A 48 2.173 1.549 -6.317 1.00 0.00 C ATOM 740 O LEU A 48 1.745 2.484 -6.961 1.00 0.00 O ATOM 741 CB LEU A 48 2.954 2.540 -4.120 1.00 0.00 C ATOM 742 CG LEU A 48 3.568 1.893 -2.874 1.00 0.00 C ATOM 743 CD1 LEU A 48 3.057 2.604 -1.627 1.00 0.00 C ATOM 744 CD2 LEU A 48 3.181 0.406 -2.815 1.00 0.00 C ATOM 0 H LEU A 48 4.247 3.307 -6.449 1.00 0.00 H new ATOM 0 HA LEU A 48 3.610 0.707 -5.030 1.00 0.00 H new ATOM 0 HB2 LEU A 48 3.313 3.563 -4.230 1.00 0.00 H new ATOM 0 HB3 LEU A 48 1.870 2.591 -4.023 1.00 0.00 H new ATOM 0 HG LEU A 48 4.654 1.979 -2.922 1.00 0.00 H new ATOM 0 HD11 LEU A 48 3.494 2.144 -0.741 1.00 0.00 H new ATOM 0 HD12 LEU A 48 3.340 3.656 -1.666 1.00 0.00 H new ATOM 0 HD13 LEU A 48 1.971 2.522 -1.581 1.00 0.00 H new ATOM 0 HD21 LEU A 48 3.620 -0.049 -1.927 1.00 0.00 H new ATOM 0 HD22 LEU A 48 2.096 0.314 -2.771 1.00 0.00 H new ATOM 0 HD23 LEU A 48 3.552 -0.102 -3.705 1.00 0.00 H new ATOM 756 N ASN A 49 1.678 0.345 -6.447 1.00 0.00 N ATOM 757 CA ASN A 49 0.560 0.078 -7.397 1.00 0.00 C ATOM 758 C ASN A 49 -0.561 -0.688 -6.698 1.00 0.00 C ATOM 759 O ASN A 49 -0.404 -1.838 -6.342 1.00 0.00 O ATOM 760 CB ASN A 49 1.179 -0.793 -8.492 1.00 0.00 C ATOM 761 CG ASN A 49 1.632 0.090 -9.655 1.00 0.00 C ATOM 762 OD1 ASN A 49 0.856 0.403 -10.535 1.00 0.00 O ATOM 763 ND2 ASN A 49 2.867 0.509 -9.697 1.00 0.00 N ATOM 0 H ASN A 49 2.005 -0.471 -5.930 1.00 0.00 H new ATOM 0 HA ASN A 49 0.126 0.998 -7.788 1.00 0.00 H new ATOM 0 HB2 ASN A 49 2.027 -1.349 -8.092 1.00 0.00 H new ATOM 0 HB3 ASN A 49 0.453 -1.527 -8.841 1.00 0.00 H new ATOM 0 HD21 ASN A 49 3.180 1.099 -10.468 1.00 0.00 H new ATOM 0 HD22 ASN A 49 3.520 0.247 -8.958 1.00 0.00 H new ATOM 770 N ILE A 50 -1.685 -0.061 -6.502 1.00 0.00 N ATOM 771 CA ILE A 50 -2.823 -0.755 -5.824 1.00 0.00 C ATOM 772 C ILE A 50 -3.974 -0.987 -6.815 1.00 0.00 C ATOM 773 O ILE A 50 -4.164 -0.213 -7.733 1.00 0.00 O ATOM 774 CB ILE A 50 -3.246 0.189 -4.688 1.00 0.00 C ATOM 775 CG1 ILE A 50 -3.963 1.417 -5.250 1.00 0.00 C ATOM 776 CG2 ILE A 50 -2.015 0.640 -3.896 1.00 0.00 C ATOM 777 CD1 ILE A 50 -5.446 1.337 -4.875 1.00 0.00 C ATOM 0 H ILE A 50 -1.869 0.903 -6.781 1.00 0.00 H new ATOM 0 HA ILE A 50 -2.544 -1.738 -5.444 1.00 0.00 H new ATOM 0 HB ILE A 50 -3.927 -0.350 -4.030 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -3.521 2.329 -4.849 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -3.849 1.458 -6.333 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -2.324 1.309 -3.093 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -1.516 -0.231 -3.471 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -1.327 1.164 -4.560 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -5.969 2.208 -5.270 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -5.880 0.431 -5.297 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -5.546 1.315 -3.790 1.00 0.00 H new ATOM 789 N LYS A 51 -4.747 -2.043 -6.654 1.00 0.00 N ATOM 790 CA LYS A 51 -5.866 -2.273 -7.622 1.00 0.00 C ATOM 791 C LYS A 51 -6.852 -3.317 -7.082 1.00 0.00 C ATOM 792 O LYS A 51 -6.491 -4.456 -6.869 1.00 0.00 O ATOM 793 CB LYS A 51 -5.197 -2.777 -8.906 1.00 0.00 C ATOM 794 CG LYS A 51 -4.145 -3.833 -8.565 1.00 0.00 C ATOM 795 CD LYS A 51 -4.079 -4.871 -9.687 1.00 0.00 C ATOM 796 CE LYS A 51 -5.292 -5.802 -9.596 1.00 0.00 C ATOM 797 NZ LYS A 51 -5.678 -6.070 -11.008 1.00 0.00 N ATOM 0 H LYS A 51 -4.653 -2.737 -5.913 1.00 0.00 H new ATOM 0 HA LYS A 51 -6.441 -1.363 -7.793 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -5.946 -3.200 -9.575 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -4.732 -1.945 -9.435 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -3.171 -3.362 -8.434 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -4.394 -4.318 -7.621 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -4.062 -4.373 -10.656 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -3.158 -5.448 -9.609 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -5.043 -6.725 -9.073 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -6.108 -5.334 -9.046 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -6.504 -6.702 -11.028 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -5.916 -5.174 -11.479 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -4.884 -6.522 -11.505 1.00 0.00 H new ATOM 811 N PRO A 52 -8.077 -2.891 -6.876 1.00 0.00 N ATOM 812 CA PRO A 52 -9.119 -3.804 -6.357 1.00 0.00 C ATOM 813 C PRO A 52 -9.727 -4.642 -7.478 1.00 0.00 C ATOM 814 O PRO A 52 -9.814 -4.216 -8.613 1.00 0.00 O ATOM 815 CB PRO A 52 -10.165 -2.858 -5.782 1.00 0.00 C ATOM 816 CG PRO A 52 -9.996 -1.572 -6.529 1.00 0.00 C ATOM 817 CD PRO A 52 -8.598 -1.537 -7.096 1.00 0.00 C ATOM 0 HA PRO A 52 -8.727 -4.513 -5.628 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -11.170 -3.258 -5.913 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -10.017 -2.713 -4.712 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -10.733 -1.497 -7.329 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -10.159 -0.723 -5.865 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -8.606 -1.282 -8.156 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -7.985 -0.789 -6.593 1.00 0.00 H new ATOM 825 N VAL A 53 -10.158 -5.833 -7.161 1.00 0.00 N ATOM 826 CA VAL A 53 -10.772 -6.705 -8.195 1.00 0.00 C ATOM 827 C VAL A 53 -12.079 -7.304 -7.677 1.00 0.00 C ATOM 828 O VAL A 53 -12.776 -6.704 -6.887 1.00 0.00 O ATOM 829 CB VAL A 53 -9.716 -7.776 -8.499 1.00 0.00 C ATOM 830 CG1 VAL A 53 -8.382 -7.094 -8.823 1.00 0.00 C ATOM 831 CG2 VAL A 53 -9.528 -8.690 -7.290 1.00 0.00 C ATOM 0 H VAL A 53 -10.110 -6.238 -6.226 1.00 0.00 H new ATOM 0 HA VAL A 53 -11.039 -6.161 -9.101 1.00 0.00 H new ATOM 0 HB VAL A 53 -10.049 -8.371 -9.349 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -7.629 -7.852 -9.040 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -8.506 -6.447 -9.691 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -8.061 -6.498 -7.969 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -8.776 -9.446 -7.518 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -9.200 -8.099 -6.435 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -10.473 -9.179 -7.053 1.00 0.00 H new ATOM 841 N ALA A 54 -12.427 -8.468 -8.127 1.00 0.00 N ATOM 842 CA ALA A 54 -13.706 -9.086 -7.665 1.00 0.00 C ATOM 843 C ALA A 54 -13.605 -10.613 -7.633 1.00 0.00 C ATOM 844 O ALA A 54 -13.627 -11.258 -8.660 1.00 0.00 O ATOM 845 CB ALA A 54 -14.742 -8.646 -8.698 1.00 0.00 C ATOM 0 H ALA A 54 -11.889 -9.023 -8.793 1.00 0.00 H new ATOM 0 HA ALA A 54 -13.962 -8.775 -6.652 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -15.716 -9.058 -8.434 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -14.800 -7.558 -8.714 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -14.450 -9.008 -9.684 1.00 0.00 H new ATOM 1164 N VAL A 75 -14.318 -7.582 -2.807 1.00 0.00 N ATOM 1165 CA VAL A 75 -13.379 -7.133 -3.888 1.00 0.00 C ATOM 1166 C VAL A 75 -11.967 -7.654 -3.609 1.00 0.00 C ATOM 1167 O VAL A 75 -11.655 -8.032 -2.496 1.00 0.00 O ATOM 1168 CB VAL A 75 -13.425 -5.606 -3.790 1.00 0.00 C ATOM 1169 CG1 VAL A 75 -12.861 -5.170 -2.432 1.00 0.00 C ATOM 1170 CG2 VAL A 75 -12.600 -4.960 -4.908 1.00 0.00 C ATOM 0 HA VAL A 75 -13.652 -7.499 -4.878 1.00 0.00 H new ATOM 0 HB VAL A 75 -14.461 -5.283 -3.892 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -12.892 -4.083 -2.357 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -13.460 -5.606 -1.632 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -11.830 -5.511 -2.340 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -12.649 -3.875 -4.816 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -11.562 -5.284 -4.828 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -13.001 -5.260 -5.876 1.00 0.00 H new ATOM 1180 N GLY A 76 -11.108 -7.670 -4.590 1.00 0.00 N ATOM 1181 CA GLY A 76 -9.729 -8.160 -4.329 1.00 0.00 C ATOM 1182 C GLY A 76 -8.772 -6.979 -4.400 1.00 0.00 C ATOM 1183 O GLY A 76 -8.210 -6.674 -5.433 1.00 0.00 O ATOM 0 H GLY A 76 -11.298 -7.370 -5.546 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -9.675 -8.632 -3.348 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -9.451 -8.917 -5.063 1.00 0.00 H new ATOM 1187 N VAL A 77 -8.604 -6.307 -3.304 1.00 0.00 N ATOM 1188 CA VAL A 77 -7.703 -5.124 -3.268 1.00 0.00 C ATOM 1189 C VAL A 77 -6.262 -5.537 -3.516 1.00 0.00 C ATOM 1190 O VAL A 77 -5.447 -5.567 -2.614 1.00 0.00 O ATOM 1191 CB VAL A 77 -7.883 -4.562 -1.857 1.00 0.00 C ATOM 1192 CG1 VAL A 77 -6.962 -3.361 -1.644 1.00 0.00 C ATOM 1193 CG2 VAL A 77 -9.340 -4.128 -1.672 1.00 0.00 C ATOM 0 H VAL A 77 -9.057 -6.527 -2.417 1.00 0.00 H new ATOM 0 HA VAL A 77 -7.939 -4.390 -4.039 1.00 0.00 H new ATOM 0 HB VAL A 77 -7.629 -5.333 -1.129 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -7.100 -2.971 -0.636 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -5.925 -3.670 -1.774 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -7.203 -2.584 -2.370 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -9.475 -3.726 -0.668 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -9.587 -3.361 -2.406 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -9.996 -4.987 -1.810 1.00 0.00 H new ATOM 1203 N SER A 78 -5.931 -5.829 -4.741 1.00 0.00 N ATOM 1204 CA SER A 78 -4.528 -6.201 -5.039 1.00 0.00 C ATOM 1205 C SER A 78 -3.648 -4.977 -4.786 1.00 0.00 C ATOM 1206 O SER A 78 -4.137 -3.926 -4.431 1.00 0.00 O ATOM 1207 CB SER A 78 -4.506 -6.599 -6.516 1.00 0.00 C ATOM 1208 OG SER A 78 -4.244 -7.992 -6.622 1.00 0.00 O ATOM 0 H SER A 78 -6.566 -5.826 -5.539 1.00 0.00 H new ATOM 0 HA SER A 78 -4.159 -7.019 -4.420 1.00 0.00 H new ATOM 0 HB2 SER A 78 -5.461 -6.360 -6.983 1.00 0.00 H new ATOM 0 HB3 SER A 78 -3.741 -6.032 -7.046 1.00 0.00 H new ATOM 0 HG SER A 78 -4.231 -8.251 -7.567 1.00 0.00 H new ATOM 1214 N VAL A 79 -2.368 -5.108 -4.969 1.00 0.00 N ATOM 1215 CA VAL A 79 -1.430 -3.961 -4.743 1.00 0.00 C ATOM 1216 C VAL A 79 -0.004 -4.418 -5.029 1.00 0.00 C ATOM 1217 O VAL A 79 0.239 -5.578 -5.298 1.00 0.00 O ATOM 1218 CB VAL A 79 -1.525 -3.582 -3.248 1.00 0.00 C ATOM 1219 CG1 VAL A 79 -2.515 -2.435 -3.038 1.00 0.00 C ATOM 1220 CG2 VAL A 79 -1.959 -4.796 -2.416 1.00 0.00 C ATOM 0 H VAL A 79 -1.918 -5.972 -5.270 1.00 0.00 H new ATOM 0 HA VAL A 79 -1.684 -3.120 -5.388 1.00 0.00 H new ATOM 0 HB VAL A 79 -0.538 -3.256 -2.921 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -2.564 -2.186 -1.978 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -2.185 -1.562 -3.600 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -3.502 -2.738 -3.386 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -2.021 -4.513 -1.365 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -2.935 -5.141 -2.758 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -1.229 -5.597 -2.533 1.00 0.00 H new ATOM 1230 N LYS A 80 0.949 -3.531 -4.919 1.00 0.00 N ATOM 1231 CA LYS A 80 2.360 -3.935 -5.123 1.00 0.00 C ATOM 1232 C LYS A 80 3.291 -2.728 -4.965 1.00 0.00 C ATOM 1233 O LYS A 80 2.855 -1.596 -4.929 1.00 0.00 O ATOM 1234 CB LYS A 80 2.422 -4.444 -6.568 1.00 0.00 C ATOM 1235 CG LYS A 80 2.798 -5.925 -6.587 1.00 0.00 C ATOM 1236 CD LYS A 80 2.580 -6.473 -7.997 1.00 0.00 C ATOM 1237 CE LYS A 80 2.972 -7.952 -8.040 1.00 0.00 C ATOM 1238 NZ LYS A 80 3.197 -8.248 -9.482 1.00 0.00 N ATOM 0 H LYS A 80 0.806 -2.546 -4.697 1.00 0.00 H new ATOM 0 HA LYS A 80 2.674 -4.687 -4.399 1.00 0.00 H new ATOM 0 HB2 LYS A 80 1.457 -4.299 -7.054 1.00 0.00 H new ATOM 0 HB3 LYS A 80 3.154 -3.868 -7.134 1.00 0.00 H new ATOM 0 HG2 LYS A 80 3.839 -6.054 -6.289 1.00 0.00 H new ATOM 0 HG3 LYS A 80 2.191 -6.477 -5.870 1.00 0.00 H new ATOM 0 HD2 LYS A 80 1.536 -6.355 -8.287 1.00 0.00 H new ATOM 0 HD3 LYS A 80 3.176 -5.908 -8.714 1.00 0.00 H new ATOM 0 HE2 LYS A 80 3.871 -8.139 -7.453 1.00 0.00 H new ATOM 0 HE3 LYS A 80 2.184 -8.582 -7.626 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 3.470 -9.245 -9.593 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 2.322 -8.067 -10.014 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 3.957 -7.639 -9.847 1.00 0.00 H new ATOM 1252 N PRO A 81 4.555 -3.032 -4.921 1.00 0.00 N ATOM 1253 CA PRO A 81 5.621 -2.034 -4.821 1.00 0.00 C ATOM 1254 C PRO A 81 6.403 -1.946 -6.137 1.00 0.00 C ATOM 1255 O PRO A 81 6.404 -2.860 -6.937 1.00 0.00 O ATOM 1256 CB PRO A 81 6.523 -2.677 -3.776 1.00 0.00 C ATOM 1257 CG PRO A 81 6.259 -4.164 -3.895 1.00 0.00 C ATOM 1258 CD PRO A 81 5.135 -4.348 -4.889 1.00 0.00 C ATOM 0 HA PRO A 81 5.263 -1.031 -4.591 1.00 0.00 H new ATOM 0 HB2 PRO A 81 7.572 -2.446 -3.963 1.00 0.00 H new ATOM 0 HB3 PRO A 81 6.290 -2.313 -2.775 1.00 0.00 H new ATOM 0 HG2 PRO A 81 7.155 -4.687 -4.229 1.00 0.00 H new ATOM 0 HG3 PRO A 81 5.987 -4.584 -2.927 1.00 0.00 H new ATOM 0 HD2 PRO A 81 5.501 -4.658 -5.868 1.00 0.00 H new ATOM 0 HD3 PRO A 81 4.420 -5.103 -4.563 1.00 0.00 H new ATOM 1266 N GLY A 82 7.108 -0.875 -6.328 1.00 0.00 N ATOM 1267 CA GLY A 82 7.954 -0.725 -7.548 1.00 0.00 C ATOM 1268 C GLY A 82 9.413 -0.916 -7.126 1.00 0.00 C ATOM 1269 O GLY A 82 9.695 -1.611 -6.170 1.00 0.00 O ATOM 0 H GLY A 82 7.139 -0.083 -5.686 1.00 0.00 H new ATOM 0 HA2 GLY A 82 7.674 -1.461 -8.301 1.00 0.00 H new ATOM 0 HA3 GLY A 82 7.810 0.259 -7.995 1.00 0.00 H new ATOM 1273 N GLU A 83 10.344 -0.298 -7.804 1.00 0.00 N ATOM 1274 CA GLU A 83 11.773 -0.451 -7.393 1.00 0.00 C ATOM 1275 C GLU A 83 12.224 0.771 -6.594 1.00 0.00 C ATOM 1276 O GLU A 83 13.261 0.758 -5.959 1.00 0.00 O ATOM 1277 CB GLU A 83 12.579 -0.561 -8.684 1.00 0.00 C ATOM 1278 CG GLU A 83 12.338 0.673 -9.558 1.00 0.00 C ATOM 1279 CD GLU A 83 11.392 0.313 -10.707 1.00 0.00 C ATOM 1280 OE1 GLU A 83 10.195 0.279 -10.473 1.00 0.00 O ATOM 1281 OE2 GLU A 83 11.880 0.079 -11.800 1.00 0.00 O ATOM 0 H GLU A 83 10.182 0.299 -8.615 1.00 0.00 H new ATOM 0 HA GLU A 83 11.913 -1.328 -6.761 1.00 0.00 H new ATOM 0 HB2 GLU A 83 13.640 -0.652 -8.453 1.00 0.00 H new ATOM 0 HB3 GLU A 83 12.292 -1.462 -9.226 1.00 0.00 H new ATOM 0 HG2 GLU A 83 11.910 1.477 -8.959 1.00 0.00 H new ATOM 0 HG3 GLU A 83 13.284 1.041 -9.955 1.00 0.00 H new ATOM 1288 N SER A 84 11.453 1.825 -6.614 1.00 0.00 N ATOM 1289 CA SER A 84 11.842 3.041 -5.846 1.00 0.00 C ATOM 1290 C SER A 84 12.002 2.671 -4.373 1.00 0.00 C ATOM 1291 O SER A 84 12.892 3.143 -3.690 1.00 0.00 O ATOM 1292 CB SER A 84 10.689 4.026 -6.039 1.00 0.00 C ATOM 1293 OG SER A 84 11.215 5.320 -6.302 1.00 0.00 O ATOM 0 H SER A 84 10.574 1.896 -7.127 1.00 0.00 H new ATOM 0 HA SER A 84 12.786 3.470 -6.181 1.00 0.00 H new ATOM 0 HB2 SER A 84 10.055 3.704 -6.865 1.00 0.00 H new ATOM 0 HB3 SER A 84 10.063 4.050 -5.147 1.00 0.00 H new ATOM 0 HG SER A 84 10.677 5.757 -6.995 1.00 0.00 H new ATOM 1299 N LEU A 85 11.150 1.811 -3.889 1.00 0.00 N ATOM 1300 CA LEU A 85 11.244 1.382 -2.468 1.00 0.00 C ATOM 1301 C LEU A 85 12.371 0.372 -2.315 1.00 0.00 C ATOM 1302 O LEU A 85 13.075 0.364 -1.330 1.00 0.00 O ATOM 1303 CB LEU A 85 9.913 0.700 -2.143 1.00 0.00 C ATOM 1304 CG LEU A 85 8.737 1.539 -2.650 1.00 0.00 C ATOM 1305 CD1 LEU A 85 7.872 0.696 -3.583 1.00 0.00 C ATOM 1306 CD2 LEU A 85 7.889 2.015 -1.466 1.00 0.00 C ATOM 0 H LEU A 85 10.390 1.386 -4.420 1.00 0.00 H new ATOM 0 HA LEU A 85 11.441 2.226 -1.807 1.00 0.00 H new ATOM 0 HB2 LEU A 85 9.884 -0.289 -2.600 1.00 0.00 H new ATOM 0 HB3 LEU A 85 9.826 0.556 -1.066 1.00 0.00 H new ATOM 0 HG LEU A 85 9.123 2.404 -3.190 1.00 0.00 H new ATOM 0 HD11 LEU A 85 7.035 1.294 -3.943 1.00 0.00 H new ATOM 0 HD12 LEU A 85 8.470 0.361 -4.431 1.00 0.00 H new ATOM 0 HD13 LEU A 85 7.492 -0.171 -3.043 1.00 0.00 H new ATOM 0 HD21 LEU A 85 7.054 2.611 -1.833 1.00 0.00 H new ATOM 0 HD22 LEU A 85 7.507 1.151 -0.922 1.00 0.00 H new ATOM 0 HD23 LEU A 85 8.502 2.621 -0.800 1.00 0.00 H new ATOM 1318 N LYS A 86 12.531 -0.494 -3.279 1.00 0.00 N ATOM 1319 CA LYS A 86 13.602 -1.525 -3.178 1.00 0.00 C ATOM 1320 C LYS A 86 14.975 -0.888 -3.291 1.00 0.00 C ATOM 1321 O LYS A 86 15.888 -1.226 -2.563 1.00 0.00 O ATOM 1322 CB LYS A 86 13.355 -2.495 -4.337 1.00 0.00 C ATOM 1323 CG LYS A 86 13.062 -3.894 -3.789 1.00 0.00 C ATOM 1324 CD LYS A 86 12.524 -4.783 -4.914 1.00 0.00 C ATOM 1325 CE LYS A 86 11.341 -5.606 -4.397 1.00 0.00 C ATOM 1326 NZ LYS A 86 11.916 -6.941 -4.072 1.00 0.00 N ATOM 0 H LYS A 86 11.968 -0.532 -4.129 1.00 0.00 H new ATOM 0 HA LYS A 86 13.576 -2.037 -2.216 1.00 0.00 H new ATOM 0 HB2 LYS A 86 12.517 -2.148 -4.941 1.00 0.00 H new ATOM 0 HB3 LYS A 86 14.227 -2.526 -4.990 1.00 0.00 H new ATOM 0 HG2 LYS A 86 13.969 -4.329 -3.370 1.00 0.00 H new ATOM 0 HG3 LYS A 86 12.334 -3.834 -2.980 1.00 0.00 H new ATOM 0 HD2 LYS A 86 12.211 -4.169 -5.759 1.00 0.00 H new ATOM 0 HD3 LYS A 86 13.311 -5.445 -5.275 1.00 0.00 H new ATOM 0 HE2 LYS A 86 10.893 -5.144 -3.517 1.00 0.00 H new ATOM 0 HE3 LYS A 86 10.557 -5.686 -5.150 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 11.157 -7.579 -3.759 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 12.374 -7.337 -4.918 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 12.619 -6.841 -3.312 1.00 0.00 H new ATOM 1340 N LYS A 87 15.129 0.042 -4.177 1.00 0.00 N ATOM 1341 CA LYS A 87 16.446 0.707 -4.305 1.00 0.00 C ATOM 1342 C LYS A 87 16.709 1.465 -3.008 1.00 0.00 C ATOM 1343 O LYS A 87 17.796 1.435 -2.441 1.00 0.00 O ATOM 1344 CB LYS A 87 16.302 1.646 -5.508 1.00 0.00 C ATOM 1345 CG LYS A 87 17.561 2.506 -5.650 1.00 0.00 C ATOM 1346 CD LYS A 87 17.563 3.193 -7.019 1.00 0.00 C ATOM 1347 CE LYS A 87 18.927 3.005 -7.686 1.00 0.00 C ATOM 1348 NZ LYS A 87 18.626 2.810 -9.131 1.00 0.00 N ATOM 0 H LYS A 87 14.405 0.371 -4.816 1.00 0.00 H new ATOM 0 HA LYS A 87 17.282 0.026 -4.462 1.00 0.00 H new ATOM 0 HB2 LYS A 87 16.143 1.066 -6.417 1.00 0.00 H new ATOM 0 HB3 LYS A 87 15.428 2.284 -5.380 1.00 0.00 H new ATOM 0 HG2 LYS A 87 17.594 3.253 -4.857 1.00 0.00 H new ATOM 0 HG3 LYS A 87 18.451 1.886 -5.542 1.00 0.00 H new ATOM 0 HD2 LYS A 87 16.778 2.774 -7.649 1.00 0.00 H new ATOM 0 HD3 LYS A 87 17.346 4.255 -6.904 1.00 0.00 H new ATOM 0 HE2 LYS A 87 19.566 3.874 -7.530 1.00 0.00 H new ATOM 0 HE3 LYS A 87 19.453 2.144 -7.273 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 19.514 2.674 -9.655 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 18.022 1.972 -9.250 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 18.131 3.648 -9.499 1.00 0.00 H new ATOM 1362 N ALA A 88 15.690 2.081 -2.487 1.00 0.00 N ATOM 1363 CA ALA A 88 15.858 2.779 -1.197 1.00 0.00 C ATOM 1364 C ALA A 88 15.965 1.707 -0.121 1.00 0.00 C ATOM 1365 O ALA A 88 16.642 1.863 0.880 1.00 0.00 O ATOM 1366 CB ALA A 88 14.591 3.617 -1.023 1.00 0.00 C ATOM 0 H ALA A 88 14.757 2.129 -2.897 1.00 0.00 H new ATOM 0 HA ALA A 88 16.741 3.416 -1.143 1.00 0.00 H new ATOM 0 HB1 ALA A 88 14.644 4.166 -0.083 1.00 0.00 H new ATOM 0 HB2 ALA A 88 14.504 4.322 -1.850 1.00 0.00 H new ATOM 0 HB3 ALA A 88 13.720 2.962 -1.012 1.00 0.00 H new ATOM 1372 N ALA A 89 15.312 0.595 -0.342 1.00 0.00 N ATOM 1373 CA ALA A 89 15.375 -0.506 0.647 1.00 0.00 C ATOM 1374 C ALA A 89 16.804 -1.015 0.716 1.00 0.00 C ATOM 1375 O ALA A 89 17.325 -1.281 1.781 1.00 0.00 O ATOM 1376 CB ALA A 89 14.412 -1.575 0.139 1.00 0.00 C ATOM 0 H ALA A 89 14.740 0.408 -1.166 1.00 0.00 H new ATOM 0 HA ALA A 89 15.093 -0.198 1.654 1.00 0.00 H new ATOM 0 HB1 ALA A 89 14.411 -2.420 0.827 1.00 0.00 H new ATOM 0 HB2 ALA A 89 13.407 -1.158 0.074 1.00 0.00 H new ATOM 0 HB3 ALA A 89 14.729 -1.911 -0.848 1.00 0.00 H new ATOM 1382 N GLU A 90 17.467 -1.095 -0.405 1.00 0.00 N ATOM 1383 CA GLU A 90 18.888 -1.522 -0.374 1.00 0.00 C ATOM 1384 C GLU A 90 19.621 -0.550 0.552 1.00 0.00 C ATOM 1385 O GLU A 90 20.544 -0.908 1.259 1.00 0.00 O ATOM 1386 CB GLU A 90 19.380 -1.426 -1.830 1.00 0.00 C ATOM 1387 CG GLU A 90 20.281 -0.199 -2.020 1.00 0.00 C ATOM 1388 CD GLU A 90 20.665 -0.073 -3.496 1.00 0.00 C ATOM 1389 OE1 GLU A 90 20.926 -1.095 -4.109 1.00 0.00 O ATOM 1390 OE2 GLU A 90 20.694 1.043 -3.987 1.00 0.00 O ATOM 0 H GLU A 90 17.089 -0.885 -1.329 1.00 0.00 H new ATOM 0 HA GLU A 90 19.051 -2.534 -0.003 1.00 0.00 H new ATOM 0 HB2 GLU A 90 19.929 -2.330 -2.094 1.00 0.00 H new ATOM 0 HB3 GLU A 90 18.526 -1.364 -2.504 1.00 0.00 H new ATOM 0 HG2 GLU A 90 19.762 0.701 -1.690 1.00 0.00 H new ATOM 0 HG3 GLU A 90 21.177 -0.294 -1.407 1.00 0.00 H new ATOM 1397 N GLY A 91 19.181 0.686 0.559 1.00 0.00 N ATOM 1398 CA GLY A 91 19.809 1.705 1.448 1.00 0.00 C ATOM 1399 C GLY A 91 19.389 1.473 2.914 1.00 0.00 C ATOM 1400 O GLY A 91 20.049 1.928 3.827 1.00 0.00 O ATOM 0 H GLY A 91 18.412 1.030 -0.016 1.00 0.00 H new ATOM 0 HA2 GLY A 91 20.894 1.653 1.362 1.00 0.00 H new ATOM 0 HA3 GLY A 91 19.512 2.705 1.132 1.00 0.00 H new ATOM 1404 N LEU A 92 18.297 0.775 3.156 1.00 0.00 N ATOM 1405 CA LEU A 92 17.852 0.532 4.569 1.00 0.00 C ATOM 1406 C LEU A 92 18.698 -0.557 5.239 1.00 0.00 C ATOM 1407 O LEU A 92 18.308 -1.119 6.242 1.00 0.00 O ATOM 1408 CB LEU A 92 16.382 0.080 4.446 1.00 0.00 C ATOM 1409 CG LEU A 92 16.266 -1.453 4.348 1.00 0.00 C ATOM 1410 CD1 LEU A 92 16.003 -2.039 5.741 1.00 0.00 C ATOM 1411 CD2 LEU A 92 15.099 -1.822 3.425 1.00 0.00 C ATOM 0 H LEU A 92 17.699 0.366 2.438 1.00 0.00 H new ATOM 0 HA LEU A 92 17.963 1.423 5.187 1.00 0.00 H new ATOM 0 HB2 LEU A 92 15.819 0.434 5.310 1.00 0.00 H new ATOM 0 HB3 LEU A 92 15.933 0.537 3.564 1.00 0.00 H new ATOM 0 HG LEU A 92 17.196 -1.857 3.947 1.00 0.00 H new ATOM 0 HD11 LEU A 92 15.921 -3.124 5.670 1.00 0.00 H new ATOM 0 HD12 LEU A 92 16.827 -1.780 6.406 1.00 0.00 H new ATOM 0 HD13 LEU A 92 15.074 -1.630 6.138 1.00 0.00 H new ATOM 0 HD21 LEU A 92 15.018 -2.907 3.357 1.00 0.00 H new ATOM 0 HD22 LEU A 92 14.173 -1.414 3.829 1.00 0.00 H new ATOM 0 HD23 LEU A 92 15.275 -1.408 2.432 1.00 0.00 H new ATOM 1423 N LYS A 93 19.833 -0.889 4.684 1.00 0.00 N ATOM 1424 CA LYS A 93 20.662 -1.982 5.279 1.00 0.00 C ATOM 1425 C LYS A 93 19.871 -3.279 5.147 1.00 0.00 C ATOM 1426 O LYS A 93 19.902 -4.158 5.994 1.00 0.00 O ATOM 1427 CB LYS A 93 20.883 -1.619 6.754 1.00 0.00 C ATOM 1428 CG LYS A 93 22.381 -1.463 7.027 1.00 0.00 C ATOM 1429 CD LYS A 93 22.882 -0.159 6.400 1.00 0.00 C ATOM 1430 CE LYS A 93 22.904 0.945 7.461 1.00 0.00 C ATOM 1431 NZ LYS A 93 21.684 1.758 7.198 1.00 0.00 N ATOM 0 H LYS A 93 20.222 -0.454 3.848 1.00 0.00 H new ATOM 0 HA LYS A 93 21.626 -2.103 4.785 1.00 0.00 H new ATOM 0 HB2 LYS A 93 20.361 -0.692 6.993 1.00 0.00 H new ATOM 0 HB3 LYS A 93 20.465 -2.394 7.396 1.00 0.00 H new ATOM 0 HG2 LYS A 93 22.567 -1.457 8.101 1.00 0.00 H new ATOM 0 HG3 LYS A 93 22.927 -2.311 6.613 1.00 0.00 H new ATOM 0 HD2 LYS A 93 23.881 -0.302 5.988 1.00 0.00 H new ATOM 0 HD3 LYS A 93 22.235 0.131 5.572 1.00 0.00 H new ATOM 0 HE2 LYS A 93 22.889 0.526 8.467 1.00 0.00 H new ATOM 0 HE3 LYS A 93 23.807 1.551 7.381 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 21.955 2.654 6.744 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 21.044 1.231 6.570 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 21.200 1.958 8.096 1.00 0.00 H new ATOM 1445 N TYR A 94 19.147 -3.386 4.070 1.00 0.00 N ATOM 1446 CA TYR A 94 18.324 -4.595 3.828 1.00 0.00 C ATOM 1447 C TYR A 94 19.182 -5.849 4.040 1.00 0.00 C ATOM 1448 O TYR A 94 18.684 -6.892 4.418 1.00 0.00 O ATOM 1449 CB TYR A 94 17.834 -4.446 2.382 1.00 0.00 C ATOM 1450 CG TYR A 94 18.167 -5.678 1.589 1.00 0.00 C ATOM 1451 CD1 TYR A 94 17.497 -6.873 1.853 1.00 0.00 C ATOM 1452 CD2 TYR A 94 19.156 -5.625 0.607 1.00 0.00 C ATOM 1453 CE1 TYR A 94 17.816 -8.027 1.130 1.00 0.00 C ATOM 1454 CE2 TYR A 94 19.481 -6.777 -0.116 1.00 0.00 C ATOM 1455 CZ TYR A 94 18.811 -7.980 0.146 1.00 0.00 C ATOM 1456 OH TYR A 94 19.131 -9.117 -0.567 1.00 0.00 O ATOM 0 H TYR A 94 19.092 -2.676 3.339 1.00 0.00 H new ATOM 0 HA TYR A 94 17.479 -4.696 4.509 1.00 0.00 H new ATOM 0 HB2 TYR A 94 16.757 -4.278 2.371 1.00 0.00 H new ATOM 0 HB3 TYR A 94 18.297 -3.573 1.922 1.00 0.00 H new ATOM 0 HD1 TYR A 94 16.733 -6.907 2.615 1.00 0.00 H new ATOM 0 HD2 TYR A 94 19.670 -4.697 0.405 1.00 0.00 H new ATOM 0 HE1 TYR A 94 17.296 -8.952 1.330 1.00 0.00 H new ATOM 0 HE2 TYR A 94 20.248 -6.740 -0.876 1.00 0.00 H new ATOM 0 HH TYR A 94 19.840 -8.911 -1.211 1.00 0.00 H new ATOM 1466 N GLU A 95 20.473 -5.749 3.831 1.00 0.00 N ATOM 1467 CA GLU A 95 21.345 -6.936 4.062 1.00 0.00 C ATOM 1468 C GLU A 95 21.160 -7.383 5.509 1.00 0.00 C ATOM 1469 O GLU A 95 21.041 -8.558 5.800 1.00 0.00 O ATOM 1470 CB GLU A 95 22.778 -6.468 3.804 1.00 0.00 C ATOM 1471 CG GLU A 95 23.138 -5.321 4.753 1.00 0.00 C ATOM 1472 CD GLU A 95 24.460 -4.690 4.312 1.00 0.00 C ATOM 1473 OE1 GLU A 95 24.553 -4.301 3.161 1.00 0.00 O ATOM 1474 OE2 GLU A 95 25.357 -4.608 5.135 1.00 0.00 O ATOM 0 H GLU A 95 20.953 -4.906 3.514 1.00 0.00 H new ATOM 0 HA GLU A 95 21.105 -7.778 3.412 1.00 0.00 H new ATOM 0 HB2 GLU A 95 23.470 -7.298 3.945 1.00 0.00 H new ATOM 0 HB3 GLU A 95 22.881 -6.140 2.770 1.00 0.00 H new ATOM 0 HG2 GLU A 95 22.347 -4.571 4.751 1.00 0.00 H new ATOM 0 HG3 GLU A 95 23.223 -5.693 5.774 1.00 0.00 H new ATOM 1547 N MET B 1 -5.647 6.193 -10.720 1.00 0.00 N ATOM 1548 CA MET B 1 -5.096 7.458 -10.153 1.00 0.00 C ATOM 1549 C MET B 1 -3.575 7.354 -10.007 1.00 0.00 C ATOM 1550 O MET B 1 -2.957 6.430 -10.499 1.00 0.00 O ATOM 1551 CB MET B 1 -5.760 7.601 -8.781 1.00 0.00 C ATOM 1552 CG MET B 1 -6.856 8.667 -8.852 1.00 0.00 C ATOM 1553 SD MET B 1 -8.082 8.358 -7.560 1.00 0.00 S ATOM 1554 CE MET B 1 -7.056 8.878 -6.166 1.00 0.00 C ATOM 0 H1 MET B 1 -6.686 6.243 -10.736 1.00 0.00 H new ATOM 0 H2 MET B 1 -5.292 6.063 -11.689 1.00 0.00 H new ATOM 0 H3 MET B 1 -5.348 5.389 -10.131 1.00 0.00 H new ATOM 0 HA MET B 1 -5.295 8.318 -10.792 1.00 0.00 H new ATOM 0 HB2 MET B 1 -6.186 6.647 -8.470 1.00 0.00 H new ATOM 0 HB3 MET B 1 -5.017 7.877 -8.033 1.00 0.00 H new ATOM 0 HG2 MET B 1 -6.422 9.659 -8.727 1.00 0.00 H new ATOM 0 HG3 MET B 1 -7.333 8.649 -9.832 1.00 0.00 H new ATOM 0 HE1 MET B 1 -7.688 9.061 -5.297 1.00 0.00 H new ATOM 0 HE2 MET B 1 -6.336 8.094 -5.932 1.00 0.00 H new ATOM 0 HE3 MET B 1 -6.524 9.793 -6.427 1.00 0.00 H new ATOM 1566 N ASN B 2 -2.968 8.299 -9.337 1.00 0.00 N ATOM 1567 CA ASN B 2 -1.485 8.263 -9.159 1.00 0.00 C ATOM 1568 C ASN B 2 -1.052 9.373 -8.204 1.00 0.00 C ATOM 1569 O ASN B 2 -1.811 10.273 -7.924 1.00 0.00 O ATOM 1570 CB ASN B 2 -0.916 8.503 -10.562 1.00 0.00 C ATOM 1571 CG ASN B 2 0.601 8.301 -10.561 1.00 0.00 C ATOM 1572 OD1 ASN B 2 1.324 9.025 -9.906 1.00 0.00 O ATOM 1573 ND2 ASN B 2 1.120 7.342 -11.280 1.00 0.00 N ATOM 0 H ASN B 2 -3.436 9.096 -8.905 1.00 0.00 H new ATOM 0 HA ASN B 2 -1.135 7.322 -8.735 1.00 0.00 H new ATOM 0 HB2 ASN B 2 -1.380 7.819 -11.272 1.00 0.00 H new ATOM 0 HB3 ASN B 2 -1.155 9.514 -10.891 1.00 0.00 H new ATOM 0 HD21 ASN B 2 2.130 7.202 -11.291 1.00 0.00 H new ATOM 0 HD22 ASN B 2 0.515 6.733 -11.831 1.00 0.00 H new ATOM 1580 N LYS B 3 0.164 9.333 -7.705 1.00 0.00 N ATOM 1581 CA LYS B 3 0.620 10.416 -6.779 1.00 0.00 C ATOM 1582 C LYS B 3 0.259 11.783 -7.383 1.00 0.00 C ATOM 1583 O LYS B 3 0.035 12.746 -6.678 1.00 0.00 O ATOM 1584 CB LYS B 3 2.140 10.240 -6.641 1.00 0.00 C ATOM 1585 CG LYS B 3 2.506 10.017 -5.159 1.00 0.00 C ATOM 1586 CD LYS B 3 3.447 8.807 -5.022 1.00 0.00 C ATOM 1587 CE LYS B 3 4.831 9.253 -4.518 1.00 0.00 C ATOM 1588 NZ LYS B 3 5.561 9.710 -5.738 1.00 0.00 N ATOM 0 H LYS B 3 0.852 8.605 -7.898 1.00 0.00 H new ATOM 0 HA LYS B 3 0.143 10.362 -5.801 1.00 0.00 H new ATOM 0 HB2 LYS B 3 2.473 9.392 -7.239 1.00 0.00 H new ATOM 0 HB3 LYS B 3 2.654 11.122 -7.024 1.00 0.00 H new ATOM 0 HG2 LYS B 3 2.987 10.909 -4.757 1.00 0.00 H new ATOM 0 HG3 LYS B 3 1.601 9.852 -4.574 1.00 0.00 H new ATOM 0 HD2 LYS B 3 3.018 8.082 -4.330 1.00 0.00 H new ATOM 0 HD3 LYS B 3 3.548 8.307 -5.985 1.00 0.00 H new ATOM 0 HE2 LYS B 3 4.744 10.056 -3.787 1.00 0.00 H new ATOM 0 HE3 LYS B 3 5.356 8.432 -4.029 1.00 0.00 H new ATOM 0 HZ1 LYS B 3 6.276 9.002 -6.001 1.00 0.00 H new ATOM 0 HZ2 LYS B 3 4.887 9.829 -6.521 1.00 0.00 H new ATOM 0 HZ3 LYS B 3 6.029 10.618 -5.543 1.00 0.00 H new ATOM 1602 N THR B 4 0.149 11.851 -8.691 1.00 0.00 N ATOM 1603 CA THR B 4 -0.257 13.130 -9.349 1.00 0.00 C ATOM 1604 C THR B 4 -1.777 13.263 -9.217 1.00 0.00 C ATOM 1605 O THR B 4 -2.299 14.217 -8.656 1.00 0.00 O ATOM 1606 CB THR B 4 0.156 12.979 -10.817 1.00 0.00 C ATOM 1607 OG1 THR B 4 1.571 13.050 -10.918 1.00 0.00 O ATOM 1608 CG2 THR B 4 -0.473 14.099 -11.651 1.00 0.00 C ATOM 0 H THR B 4 0.324 11.074 -9.328 1.00 0.00 H new ATOM 0 HA THR B 4 0.203 14.015 -8.909 1.00 0.00 H new ATOM 0 HB THR B 4 -0.190 12.016 -11.192 1.00 0.00 H new ATOM 0 HG1 THR B 4 1.837 12.952 -11.856 1.00 0.00 H new ATOM 0 HG21 THR B 4 -0.176 13.987 -12.694 1.00 0.00 H new ATOM 0 HG22 THR B 4 -1.559 14.043 -11.575 1.00 0.00 H new ATOM 0 HG23 THR B 4 -0.132 15.065 -11.279 1.00 0.00 H new ATOM 1616 N GLU B 5 -2.493 12.280 -9.689 1.00 0.00 N ATOM 1617 CA GLU B 5 -3.971 12.314 -9.544 1.00 0.00 C ATOM 1618 C GLU B 5 -4.268 12.417 -8.052 1.00 0.00 C ATOM 1619 O GLU B 5 -4.987 13.287 -7.601 1.00 0.00 O ATOM 1620 CB GLU B 5 -4.471 10.986 -10.121 1.00 0.00 C ATOM 1621 CG GLU B 5 -5.588 11.255 -11.133 1.00 0.00 C ATOM 1622 CD GLU B 5 -5.462 10.278 -12.304 1.00 0.00 C ATOM 1623 OE1 GLU B 5 -4.360 10.126 -12.806 1.00 0.00 O ATOM 1624 OE2 GLU B 5 -6.469 9.700 -12.678 1.00 0.00 O ATOM 0 H GLU B 5 -2.119 11.460 -10.166 1.00 0.00 H new ATOM 0 HA GLU B 5 -4.452 13.148 -10.055 1.00 0.00 H new ATOM 0 HB2 GLU B 5 -3.650 10.455 -10.603 1.00 0.00 H new ATOM 0 HB3 GLU B 5 -4.839 10.345 -9.320 1.00 0.00 H new ATOM 0 HG2 GLU B 5 -6.561 11.143 -10.655 1.00 0.00 H new ATOM 0 HG3 GLU B 5 -5.527 12.282 -11.494 1.00 0.00 H new ATOM 1631 N LEU B 6 -3.666 11.554 -7.279 1.00 0.00 N ATOM 1632 CA LEU B 6 -3.850 11.619 -5.806 1.00 0.00 C ATOM 1633 C LEU B 6 -3.336 12.969 -5.299 1.00 0.00 C ATOM 1634 O LEU B 6 -3.817 13.491 -4.311 1.00 0.00 O ATOM 1635 CB LEU B 6 -3.011 10.473 -5.240 1.00 0.00 C ATOM 1636 CG LEU B 6 -3.717 9.138 -5.503 1.00 0.00 C ATOM 1637 CD1 LEU B 6 -2.699 8.114 -6.017 1.00 0.00 C ATOM 1638 CD2 LEU B 6 -4.347 8.625 -4.202 1.00 0.00 C ATOM 0 H LEU B 6 -3.054 10.807 -7.607 1.00 0.00 H new ATOM 0 HA LEU B 6 -4.894 11.527 -5.506 1.00 0.00 H new ATOM 0 HB2 LEU B 6 -2.023 10.470 -5.701 1.00 0.00 H new ATOM 0 HB3 LEU B 6 -2.863 10.612 -4.169 1.00 0.00 H new ATOM 0 HG LEU B 6 -4.497 9.282 -6.251 1.00 0.00 H new ATOM 0 HD11 LEU B 6 -3.201 7.165 -6.204 1.00 0.00 H new ATOM 0 HD12 LEU B 6 -2.253 8.477 -6.943 1.00 0.00 H new ATOM 0 HD13 LEU B 6 -1.918 7.971 -5.270 1.00 0.00 H new ATOM 0 HD21 LEU B 6 -4.849 7.676 -4.390 1.00 0.00 H new ATOM 0 HD22 LEU B 6 -3.569 8.482 -3.453 1.00 0.00 H new ATOM 0 HD23 LEU B 6 -5.072 9.353 -3.837 1.00 0.00 H new ATOM 1650 N ILE B 7 -2.377 13.560 -5.985 1.00 0.00 N ATOM 1651 CA ILE B 7 -1.873 14.897 -5.547 1.00 0.00 C ATOM 1652 C ILE B 7 -3.079 15.818 -5.429 1.00 0.00 C ATOM 1653 O ILE B 7 -3.332 16.399 -4.398 1.00 0.00 O ATOM 1654 CB ILE B 7 -0.895 15.370 -6.646 1.00 0.00 C ATOM 1655 CG1 ILE B 7 0.500 15.545 -6.045 1.00 0.00 C ATOM 1656 CG2 ILE B 7 -1.346 16.711 -7.250 1.00 0.00 C ATOM 1657 CD1 ILE B 7 1.428 16.189 -7.082 1.00 0.00 C ATOM 0 H ILE B 7 -1.931 13.175 -6.818 1.00 0.00 H new ATOM 0 HA ILE B 7 -1.358 14.880 -4.586 1.00 0.00 H new ATOM 0 HB ILE B 7 -0.880 14.617 -7.434 1.00 0.00 H new ATOM 0 HG12 ILE B 7 0.447 16.168 -5.152 1.00 0.00 H new ATOM 0 HG13 ILE B 7 0.898 14.578 -5.736 1.00 0.00 H new ATOM 0 HG21 ILE B 7 -0.639 17.019 -8.020 1.00 0.00 H new ATOM 0 HG22 ILE B 7 -2.336 16.597 -7.691 1.00 0.00 H new ATOM 0 HG23 ILE B 7 -1.383 17.469 -6.467 1.00 0.00 H new ATOM 0 HD11 ILE B 7 2.422 16.313 -6.653 1.00 0.00 H new ATOM 0 HD12 ILE B 7 1.490 15.549 -7.962 1.00 0.00 H new ATOM 0 HD13 ILE B 7 1.032 17.163 -7.369 1.00 0.00 H new ATOM 1669 N LYS B 8 -3.840 15.915 -6.483 1.00 0.00 N ATOM 1670 CA LYS B 8 -5.059 16.759 -6.446 1.00 0.00 C ATOM 1671 C LYS B 8 -6.014 16.179 -5.403 1.00 0.00 C ATOM 1672 O LYS B 8 -6.722 16.895 -4.733 1.00 0.00 O ATOM 1673 CB LYS B 8 -5.646 16.698 -7.868 1.00 0.00 C ATOM 1674 CG LYS B 8 -6.858 15.758 -7.915 1.00 0.00 C ATOM 1675 CD LYS B 8 -7.307 15.574 -9.366 1.00 0.00 C ATOM 1676 CE LYS B 8 -6.724 14.273 -9.922 1.00 0.00 C ATOM 1677 NZ LYS B 8 -7.752 13.770 -10.875 1.00 0.00 N ATOM 0 H LYS B 8 -3.667 15.443 -7.370 1.00 0.00 H new ATOM 0 HA LYS B 8 -4.866 17.795 -6.167 1.00 0.00 H new ATOM 0 HB2 LYS B 8 -5.942 17.697 -8.188 1.00 0.00 H new ATOM 0 HB3 LYS B 8 -4.884 16.352 -8.567 1.00 0.00 H new ATOM 0 HG2 LYS B 8 -6.600 14.793 -7.478 1.00 0.00 H new ATOM 0 HG3 LYS B 8 -7.674 16.169 -7.320 1.00 0.00 H new ATOM 0 HD2 LYS B 8 -8.395 15.549 -9.420 1.00 0.00 H new ATOM 0 HD3 LYS B 8 -6.977 16.420 -9.970 1.00 0.00 H new ATOM 0 HE2 LYS B 8 -5.772 14.449 -10.424 1.00 0.00 H new ATOM 0 HE3 LYS B 8 -6.536 13.552 -9.126 1.00 0.00 H new ATOM 0 HZ1 LYS B 8 -8.246 12.957 -10.455 1.00 0.00 H new ATOM 0 HZ2 LYS B 8 -8.437 14.526 -11.077 1.00 0.00 H new ATOM 0 HZ3 LYS B 8 -7.291 13.476 -11.759 1.00 0.00 H new ATOM 1691 N ALA B 9 -6.008 14.879 -5.245 1.00 0.00 N ATOM 1692 CA ALA B 9 -6.889 14.254 -4.219 1.00 0.00 C ATOM 1693 C ALA B 9 -6.471 14.757 -2.845 1.00 0.00 C ATOM 1694 O ALA B 9 -7.277 14.888 -1.946 1.00 0.00 O ATOM 1695 CB ALA B 9 -6.630 12.761 -4.336 1.00 0.00 C ATOM 0 H ALA B 9 -5.433 14.229 -5.781 1.00 0.00 H new ATOM 0 HA ALA B 9 -7.944 14.490 -4.359 1.00 0.00 H new ATOM 0 HB1 ALA B 9 -7.244 12.227 -3.610 1.00 0.00 H new ATOM 0 HB2 ALA B 9 -6.883 12.426 -5.342 1.00 0.00 H new ATOM 0 HB3 ALA B 9 -5.577 12.558 -4.140 1.00 0.00 H new ATOM 1701 N ILE B 10 -5.215 15.079 -2.691 1.00 0.00 N ATOM 1702 CA ILE B 10 -4.735 15.611 -1.414 1.00 0.00 C ATOM 1703 C ILE B 10 -4.815 17.117 -1.537 1.00 0.00 C ATOM 1704 O ILE B 10 -5.161 17.798 -0.614 1.00 0.00 O ATOM 1705 CB ILE B 10 -3.286 15.094 -1.306 1.00 0.00 C ATOM 1706 CG1 ILE B 10 -3.217 13.995 -0.245 1.00 0.00 C ATOM 1707 CG2 ILE B 10 -2.318 16.221 -0.929 1.00 0.00 C ATOM 1708 CD1 ILE B 10 -3.514 12.638 -0.889 1.00 0.00 C ATOM 0 H ILE B 10 -4.502 14.989 -3.415 1.00 0.00 H new ATOM 0 HA ILE B 10 -5.296 15.313 -0.528 1.00 0.00 H new ATOM 0 HB ILE B 10 -2.992 14.700 -2.279 1.00 0.00 H new ATOM 0 HG12 ILE B 10 -2.229 13.982 0.215 1.00 0.00 H new ATOM 0 HG13 ILE B 10 -3.936 14.197 0.549 1.00 0.00 H new ATOM 0 HG21 ILE B 10 -1.305 15.823 -0.861 1.00 0.00 H new ATOM 0 HG22 ILE B 10 -2.352 17.000 -1.691 1.00 0.00 H new ATOM 0 HG23 ILE B 10 -2.608 16.643 0.034 1.00 0.00 H new ATOM 0 HD11 ILE B 10 -3.464 11.857 -0.131 1.00 0.00 H new ATOM 0 HD12 ILE B 10 -4.511 12.654 -1.328 1.00 0.00 H new ATOM 0 HD13 ILE B 10 -2.778 12.436 -1.667 1.00 0.00 H new ATOM 1720 N ALA B 11 -4.550 17.623 -2.711 1.00 0.00 N ATOM 1721 CA ALA B 11 -4.651 19.090 -2.935 1.00 0.00 C ATOM 1722 C ALA B 11 -6.103 19.514 -2.739 1.00 0.00 C ATOM 1723 O ALA B 11 -6.391 20.616 -2.318 1.00 0.00 O ATOM 1724 CB ALA B 11 -4.198 19.297 -4.376 1.00 0.00 C ATOM 0 H ALA B 11 -4.267 17.080 -3.527 1.00 0.00 H new ATOM 0 HA ALA B 11 -4.045 19.681 -2.248 1.00 0.00 H new ATOM 0 HB1 ALA B 11 -4.243 20.358 -4.623 1.00 0.00 H new ATOM 0 HB2 ALA B 11 -3.174 18.941 -4.490 1.00 0.00 H new ATOM 0 HB3 ALA B 11 -4.853 18.740 -5.047 1.00 0.00 H new ATOM 1730 N GLN B 12 -7.017 18.622 -3.008 1.00 0.00 N ATOM 1731 CA GLN B 12 -8.449 18.940 -2.802 1.00 0.00 C ATOM 1732 C GLN B 12 -8.813 18.546 -1.376 1.00 0.00 C ATOM 1733 O GLN B 12 -9.511 19.263 -0.686 1.00 0.00 O ATOM 1734 CB GLN B 12 -9.209 18.104 -3.847 1.00 0.00 C ATOM 1735 CG GLN B 12 -10.629 17.793 -3.360 1.00 0.00 C ATOM 1736 CD GLN B 12 -11.595 17.817 -4.546 1.00 0.00 C ATOM 1737 OE1 GLN B 12 -11.551 16.951 -5.398 1.00 0.00 O ATOM 1738 NE2 GLN B 12 -12.474 18.777 -4.638 1.00 0.00 N ATOM 0 H GLN B 12 -6.828 17.685 -3.363 1.00 0.00 H new ATOM 0 HA GLN B 12 -8.692 19.996 -2.924 1.00 0.00 H new ATOM 0 HB2 GLN B 12 -9.253 18.646 -4.792 1.00 0.00 H new ATOM 0 HB3 GLN B 12 -8.672 17.175 -4.037 1.00 0.00 H new ATOM 0 HG2 GLN B 12 -10.653 16.816 -2.878 1.00 0.00 H new ATOM 0 HG3 GLN B 12 -10.936 18.525 -2.613 1.00 0.00 H new ATOM 0 HE21 GLN B 12 -12.512 19.504 -3.924 1.00 0.00 H new ATOM 0 HE22 GLN B 12 -13.123 18.800 -5.424 1.00 0.00 H new ATOM 1747 N ASP B 13 -8.293 17.441 -0.902 1.00 0.00 N ATOM 1748 CA ASP B 13 -8.568 17.066 0.506 1.00 0.00 C ATOM 1749 C ASP B 13 -7.867 18.103 1.376 1.00 0.00 C ATOM 1750 O ASP B 13 -8.266 18.389 2.488 1.00 0.00 O ATOM 1751 CB ASP B 13 -7.963 15.678 0.696 1.00 0.00 C ATOM 1752 CG ASP B 13 -8.938 14.620 0.174 1.00 0.00 C ATOM 1753 OD1 ASP B 13 -10.130 14.883 0.180 1.00 0.00 O ATOM 1754 OD2 ASP B 13 -8.476 13.562 -0.223 1.00 0.00 O ATOM 0 H ASP B 13 -7.700 16.796 -1.424 1.00 0.00 H new ATOM 0 HA ASP B 13 -9.627 17.042 0.764 1.00 0.00 H new ATOM 0 HB2 ASP B 13 -7.014 15.607 0.164 1.00 0.00 H new ATOM 0 HB3 ASP B 13 -7.751 15.503 1.751 1.00 0.00 H new ATOM 1759 N THR B 14 -6.834 18.700 0.833 1.00 0.00 N ATOM 1760 CA THR B 14 -6.104 19.759 1.561 1.00 0.00 C ATOM 1761 C THR B 14 -6.764 21.093 1.250 1.00 0.00 C ATOM 1762 O THR B 14 -7.487 21.649 2.054 1.00 0.00 O ATOM 1763 CB THR B 14 -4.680 19.769 0.997 1.00 0.00 C ATOM 1764 OG1 THR B 14 -4.733 19.818 -0.411 1.00 0.00 O ATOM 1765 CG2 THR B 14 -3.917 18.532 1.450 1.00 0.00 C ATOM 0 H THR B 14 -6.469 18.489 -0.096 1.00 0.00 H new ATOM 0 HA THR B 14 -6.106 19.590 2.638 1.00 0.00 H new ATOM 0 HB THR B 14 -4.157 20.649 1.371 1.00 0.00 H new ATOM 0 HG1 THR B 14 -5.042 18.955 -0.757 1.00 0.00 H new ATOM 0 HG21 THR B 14 -2.908 18.557 1.040 1.00 0.00 H new ATOM 0 HG22 THR B 14 -3.866 18.515 2.539 1.00 0.00 H new ATOM 0 HG23 THR B 14 -4.431 17.638 1.097 1.00 0.00 H new ATOM 1773 N GLY B 15 -6.509 21.615 0.076 1.00 0.00 N ATOM 1774 CA GLY B 15 -7.114 22.927 -0.297 1.00 0.00 C ATOM 1775 C GLY B 15 -6.649 24.003 0.691 1.00 0.00 C ATOM 1776 O GLY B 15 -7.171 25.100 0.719 1.00 0.00 O ATOM 0 H GLY B 15 -5.912 21.192 -0.635 1.00 0.00 H new ATOM 0 HA2 GLY B 15 -6.822 23.199 -1.311 1.00 0.00 H new ATOM 0 HA3 GLY B 15 -8.202 22.854 -0.287 1.00 0.00 H new ATOM 1780 N LEU B 16 -5.659 23.698 1.490 1.00 0.00 N ATOM 1781 CA LEU B 16 -5.140 24.709 2.467 1.00 0.00 C ATOM 1782 C LEU B 16 -4.163 25.615 1.754 1.00 0.00 C ATOM 1783 O LEU B 16 -4.340 26.815 1.663 1.00 0.00 O ATOM 1784 CB LEU B 16 -4.387 23.929 3.553 1.00 0.00 C ATOM 1785 CG LEU B 16 -5.303 22.890 4.188 1.00 0.00 C ATOM 1786 CD1 LEU B 16 -5.009 21.525 3.588 1.00 0.00 C ATOM 1787 CD2 LEU B 16 -5.047 22.816 5.696 1.00 0.00 C ATOM 0 H LEU B 16 -5.186 22.794 1.510 1.00 0.00 H new ATOM 0 HA LEU B 16 -5.948 25.305 2.892 1.00 0.00 H new ATOM 0 HB2 LEU B 16 -3.515 23.439 3.120 1.00 0.00 H new ATOM 0 HB3 LEU B 16 -4.021 24.616 4.316 1.00 0.00 H new ATOM 0 HG LEU B 16 -6.338 23.175 4.002 1.00 0.00 H new ATOM 0 HD11 LEU B 16 -5.663 20.780 4.041 1.00 0.00 H new ATOM 0 HD12 LEU B 16 -5.183 21.555 2.512 1.00 0.00 H new ATOM 0 HD13 LEU B 16 -3.969 21.260 3.780 1.00 0.00 H new ATOM 0 HD21 LEU B 16 -5.706 22.071 6.141 1.00 0.00 H new ATOM 0 HD22 LEU B 16 -4.009 22.536 5.876 1.00 0.00 H new ATOM 0 HD23 LEU B 16 -5.243 23.789 6.147 1.00 0.00 H new ATOM 1799 N THR B 17 -3.124 25.030 1.251 1.00 0.00 N ATOM 1800 CA THR B 17 -2.096 25.810 0.538 1.00 0.00 C ATOM 1801 C THR B 17 -1.508 24.975 -0.599 1.00 0.00 C ATOM 1802 O THR B 17 -0.555 25.377 -1.237 1.00 0.00 O ATOM 1803 CB THR B 17 -1.034 26.096 1.612 1.00 0.00 C ATOM 1804 OG1 THR B 17 -0.618 27.451 1.518 1.00 0.00 O ATOM 1805 CG2 THR B 17 0.176 25.174 1.435 1.00 0.00 C ATOM 0 H THR B 17 -2.942 24.028 1.306 1.00 0.00 H new ATOM 0 HA THR B 17 -2.485 26.723 0.088 1.00 0.00 H new ATOM 0 HB THR B 17 -1.471 25.911 2.593 1.00 0.00 H new ATOM 0 HG1 THR B 17 0.058 27.634 2.204 1.00 0.00 H new ATOM 0 HG21 THR B 17 0.916 25.393 2.205 1.00 0.00 H new ATOM 0 HG22 THR B 17 -0.142 24.135 1.522 1.00 0.00 H new ATOM 0 HG23 THR B 17 0.617 25.337 0.452 1.00 0.00 H new ATOM 1813 N GLN B 18 -2.022 23.788 -0.823 1.00 0.00 N ATOM 1814 CA GLN B 18 -1.416 22.922 -1.869 1.00 0.00 C ATOM 1815 C GLN B 18 0.042 22.752 -1.492 1.00 0.00 C ATOM 1816 O GLN B 18 0.899 22.557 -2.330 1.00 0.00 O ATOM 1817 CB GLN B 18 -1.568 23.670 -3.200 1.00 0.00 C ATOM 1818 CG GLN B 18 -2.978 24.255 -3.301 1.00 0.00 C ATOM 1819 CD GLN B 18 -3.288 24.600 -4.758 1.00 0.00 C ATOM 1820 OE1 GLN B 18 -4.336 24.256 -5.267 1.00 0.00 O ATOM 1821 NE2 GLN B 18 -2.413 25.270 -5.457 1.00 0.00 N ATOM 0 H GLN B 18 -2.823 23.391 -0.332 1.00 0.00 H new ATOM 0 HA GLN B 18 -1.883 21.941 -1.956 1.00 0.00 H new ATOM 0 HB2 GLN B 18 -0.827 24.467 -3.268 1.00 0.00 H new ATOM 0 HB3 GLN B 18 -1.384 22.992 -4.033 1.00 0.00 H new ATOM 0 HG2 GLN B 18 -3.708 23.539 -2.923 1.00 0.00 H new ATOM 0 HG3 GLN B 18 -3.057 25.148 -2.681 1.00 0.00 H new ATOM 0 HE21 GLN B 18 -1.533 25.559 -5.030 1.00 0.00 H new ATOM 0 HE22 GLN B 18 -2.609 25.505 -6.430 1.00 0.00 H new ATOM 1830 N VAL B 19 0.302 22.839 -0.201 1.00 0.00 N ATOM 1831 CA VAL B 19 1.684 22.706 0.337 1.00 0.00 C ATOM 1832 C VAL B 19 2.663 22.612 -0.831 1.00 0.00 C ATOM 1833 O VAL B 19 3.003 23.605 -1.445 1.00 0.00 O ATOM 1834 CB VAL B 19 1.618 21.444 1.243 1.00 0.00 C ATOM 1835 CG1 VAL B 19 0.757 20.343 0.610 1.00 0.00 C ATOM 1836 CG2 VAL B 19 3.006 20.882 1.528 1.00 0.00 C ATOM 0 H VAL B 19 -0.410 23.001 0.511 1.00 0.00 H new ATOM 0 HA VAL B 19 2.040 23.553 0.924 1.00 0.00 H new ATOM 0 HB VAL B 19 1.163 21.763 2.181 1.00 0.00 H new ATOM 0 HG11 VAL B 19 0.733 19.476 1.270 1.00 0.00 H new ATOM 0 HG12 VAL B 19 -0.257 20.714 0.461 1.00 0.00 H new ATOM 0 HG13 VAL B 19 1.183 20.056 -0.351 1.00 0.00 H new ATOM 0 HG21 VAL B 19 2.918 20.001 2.164 1.00 0.00 H new ATOM 0 HG22 VAL B 19 3.486 20.606 0.589 1.00 0.00 H new ATOM 0 HG23 VAL B 19 3.607 21.637 2.035 1.00 0.00 H new ATOM 1846 N SER B 20 3.046 21.445 -1.190 1.00 0.00 N ATOM 1847 CA SER B 20 3.912 21.259 -2.357 1.00 0.00 C ATOM 1848 C SER B 20 3.310 20.135 -3.155 1.00 0.00 C ATOM 1849 O SER B 20 4.010 19.460 -3.852 1.00 0.00 O ATOM 1850 CB SER B 20 5.289 20.866 -1.845 1.00 0.00 C ATOM 1851 OG SER B 20 5.210 19.590 -1.232 1.00 0.00 O ATOM 0 H SER B 20 2.788 20.583 -0.709 1.00 0.00 H new ATOM 0 HA SER B 20 4.000 22.155 -2.972 1.00 0.00 H new ATOM 0 HB2 SER B 20 6.004 20.844 -2.668 1.00 0.00 H new ATOM 0 HB3 SER B 20 5.649 21.605 -1.129 1.00 0.00 H new ATOM 0 HG SER B 20 4.459 19.575 -0.602 1.00 0.00 H new ATOM 1857 N VAL B 21 2.019 19.889 -3.007 1.00 0.00 N ATOM 1858 CA VAL B 21 1.348 18.759 -3.719 1.00 0.00 C ATOM 1859 C VAL B 21 2.294 18.157 -4.736 1.00 0.00 C ATOM 1860 O VAL B 21 2.436 16.959 -4.859 1.00 0.00 O ATOM 1861 CB VAL B 21 0.130 19.382 -4.403 1.00 0.00 C ATOM 1862 CG1 VAL B 21 -0.847 19.886 -3.340 1.00 0.00 C ATOM 1863 CG2 VAL B 21 0.565 20.553 -5.290 1.00 0.00 C ATOM 0 H VAL B 21 1.400 20.438 -2.411 1.00 0.00 H new ATOM 0 HA VAL B 21 1.056 17.955 -3.044 1.00 0.00 H new ATOM 0 HB VAL B 21 -0.355 18.627 -5.022 1.00 0.00 H new ATOM 0 HG11 VAL B 21 -1.716 20.330 -3.826 1.00 0.00 H new ATOM 0 HG12 VAL B 21 -1.167 19.052 -2.716 1.00 0.00 H new ATOM 0 HG13 VAL B 21 -0.355 20.635 -2.720 1.00 0.00 H new ATOM 0 HG21 VAL B 21 -0.310 20.989 -5.772 1.00 0.00 H new ATOM 0 HG22 VAL B 21 1.057 21.309 -4.679 1.00 0.00 H new ATOM 0 HG23 VAL B 21 1.258 20.195 -6.051 1.00 0.00 H new ATOM 1873 N SER B 22 2.995 19.011 -5.400 1.00 0.00 N ATOM 1874 CA SER B 22 4.009 18.545 -6.390 1.00 0.00 C ATOM 1875 C SER B 22 5.150 17.855 -5.644 1.00 0.00 C ATOM 1876 O SER B 22 5.575 16.772 -5.999 1.00 0.00 O ATOM 1877 CB SER B 22 4.501 19.808 -7.094 1.00 0.00 C ATOM 1878 OG SER B 22 4.836 20.787 -6.119 1.00 0.00 O ATOM 0 H SER B 22 2.916 20.024 -5.306 1.00 0.00 H new ATOM 0 HA SER B 22 3.605 17.831 -7.108 1.00 0.00 H new ATOM 0 HB2 SER B 22 5.370 19.580 -7.711 1.00 0.00 H new ATOM 0 HB3 SER B 22 3.729 20.191 -7.761 1.00 0.00 H new ATOM 0 HG SER B 22 5.154 21.599 -6.566 1.00 0.00 H new ATOM 1884 N LYS B 23 5.627 18.465 -4.591 1.00 0.00 N ATOM 1885 CA LYS B 23 6.712 17.837 -3.800 1.00 0.00 C ATOM 1886 C LYS B 23 6.100 16.999 -2.677 1.00 0.00 C ATOM 1887 O LYS B 23 6.711 16.062 -2.212 1.00 0.00 O ATOM 1888 CB LYS B 23 7.563 18.978 -3.230 1.00 0.00 C ATOM 1889 CG LYS B 23 7.742 20.080 -4.280 1.00 0.00 C ATOM 1890 CD LYS B 23 8.776 21.093 -3.786 1.00 0.00 C ATOM 1891 CE LYS B 23 8.233 21.821 -2.554 1.00 0.00 C ATOM 1892 NZ LYS B 23 9.319 22.758 -2.150 1.00 0.00 N ATOM 0 H LYS B 23 5.308 19.371 -4.249 1.00 0.00 H new ATOM 0 HA LYS B 23 7.327 17.176 -4.411 1.00 0.00 H new ATOM 0 HB2 LYS B 23 7.086 19.388 -2.340 1.00 0.00 H new ATOM 0 HB3 LYS B 23 8.537 18.597 -2.923 1.00 0.00 H new ATOM 0 HG2 LYS B 23 8.066 19.646 -5.226 1.00 0.00 H new ATOM 0 HG3 LYS B 23 6.790 20.577 -4.466 1.00 0.00 H new ATOM 0 HD2 LYS B 23 9.708 20.585 -3.539 1.00 0.00 H new ATOM 0 HD3 LYS B 23 9.003 21.811 -4.575 1.00 0.00 H new ATOM 0 HE2 LYS B 23 7.314 22.359 -2.787 1.00 0.00 H new ATOM 0 HE3 LYS B 23 7.998 21.120 -1.753 1.00 0.00 H new ATOM 0 HZ1 LYS B 23 9.021 23.294 -1.310 1.00 0.00 H new ATOM 0 HZ2 LYS B 23 10.179 22.217 -1.928 1.00 0.00 H new ATOM 0 HZ3 LYS B 23 9.516 23.418 -2.929 1.00 0.00 H new ATOM 1906 N MET B 24 4.884 17.287 -2.245 1.00 0.00 N ATOM 1907 CA MET B 24 4.283 16.463 -1.200 1.00 0.00 C ATOM 1908 C MET B 24 4.120 15.050 -1.761 1.00 0.00 C ATOM 1909 O MET B 24 4.134 14.078 -1.031 1.00 0.00 O ATOM 1910 CB MET B 24 2.961 17.161 -0.928 1.00 0.00 C ATOM 1911 CG MET B 24 2.218 16.439 0.172 1.00 0.00 C ATOM 1912 SD MET B 24 1.279 15.044 -0.507 1.00 0.00 S ATOM 1913 CE MET B 24 0.845 15.815 -2.083 1.00 0.00 C ATOM 0 H MET B 24 4.307 18.056 -2.584 1.00 0.00 H new ATOM 0 HA MET B 24 4.858 16.362 -0.280 1.00 0.00 H new ATOM 0 HB2 MET B 24 3.139 18.197 -0.640 1.00 0.00 H new ATOM 0 HB3 MET B 24 2.357 17.181 -1.835 1.00 0.00 H new ATOM 0 HG2 MET B 24 2.924 16.080 0.921 1.00 0.00 H new ATOM 0 HG3 MET B 24 1.542 17.129 0.676 1.00 0.00 H new ATOM 0 HE1 MET B 24 0.072 15.226 -2.576 1.00 0.00 H new ATOM 0 HE2 MET B 24 0.474 16.824 -1.904 1.00 0.00 H new ATOM 0 HE3 MET B 24 1.728 15.861 -2.721 1.00 0.00 H new ATOM 1923 N LEU B 25 4.032 14.924 -3.068 1.00 0.00 N ATOM 1924 CA LEU B 25 3.949 13.570 -3.667 1.00 0.00 C ATOM 1925 C LEU B 25 5.380 13.102 -3.926 1.00 0.00 C ATOM 1926 O LEU B 25 5.758 11.999 -3.584 1.00 0.00 O ATOM 1927 CB LEU B 25 3.120 13.738 -4.953 1.00 0.00 C ATOM 1928 CG LEU B 25 3.985 13.665 -6.225 1.00 0.00 C ATOM 1929 CD1 LEU B 25 4.684 12.306 -6.325 1.00 0.00 C ATOM 1930 CD2 LEU B 25 3.089 13.838 -7.455 1.00 0.00 C ATOM 0 H LEU B 25 4.015 15.698 -3.732 1.00 0.00 H new ATOM 0 HA LEU B 25 3.473 12.819 -3.037 1.00 0.00 H new ATOM 0 HB2 LEU B 25 2.355 12.962 -4.992 1.00 0.00 H new ATOM 0 HB3 LEU B 25 2.601 14.696 -4.925 1.00 0.00 H new ATOM 0 HG LEU B 25 4.735 14.455 -6.179 1.00 0.00 H new ATOM 0 HD11 LEU B 25 5.290 12.274 -7.230 1.00 0.00 H new ATOM 0 HD12 LEU B 25 5.324 12.161 -5.455 1.00 0.00 H new ATOM 0 HD13 LEU B 25 3.936 11.514 -6.361 1.00 0.00 H new ATOM 0 HD21 LEU B 25 3.697 13.787 -8.358 1.00 0.00 H new ATOM 0 HD22 LEU B 25 2.342 13.045 -7.475 1.00 0.00 H new ATOM 0 HD23 LEU B 25 2.589 14.806 -7.408 1.00 0.00 H new ATOM 1942 N ALA B 26 6.196 13.952 -4.501 1.00 0.00 N ATOM 1943 CA ALA B 26 7.614 13.565 -4.743 1.00 0.00 C ATOM 1944 C ALA B 26 8.242 13.227 -3.394 1.00 0.00 C ATOM 1945 O ALA B 26 9.136 12.406 -3.289 1.00 0.00 O ATOM 1946 CB ALA B 26 8.275 14.800 -5.358 1.00 0.00 C ATOM 0 H ALA B 26 5.940 14.890 -4.810 1.00 0.00 H new ATOM 0 HA ALA B 26 7.724 12.703 -5.400 1.00 0.00 H new ATOM 0 HB1 ALA B 26 9.324 14.587 -5.563 1.00 0.00 H new ATOM 0 HB2 ALA B 26 7.769 15.059 -6.288 1.00 0.00 H new ATOM 0 HB3 ALA B 26 8.204 15.636 -4.662 1.00 0.00 H new ATOM 1952 N SER B 27 7.739 13.835 -2.352 1.00 0.00 N ATOM 1953 CA SER B 27 8.257 13.538 -0.991 1.00 0.00 C ATOM 1954 C SER B 27 7.495 12.333 -0.454 1.00 0.00 C ATOM 1955 O SER B 27 8.026 11.522 0.273 1.00 0.00 O ATOM 1956 CB SER B 27 7.982 14.787 -0.151 1.00 0.00 C ATOM 1957 OG SER B 27 6.621 14.798 0.259 1.00 0.00 O ATOM 0 H SER B 27 6.990 14.526 -2.389 1.00 0.00 H new ATOM 0 HA SER B 27 9.322 13.305 -0.976 1.00 0.00 H new ATOM 0 HB2 SER B 27 8.635 14.801 0.722 1.00 0.00 H new ATOM 0 HB3 SER B 27 8.205 15.683 -0.730 1.00 0.00 H new ATOM 0 HG SER B 27 6.415 15.655 0.687 1.00 0.00 H new ATOM 1963 N PHE B 28 6.252 12.195 -0.844 1.00 0.00 N ATOM 1964 CA PHE B 28 5.453 11.021 -0.398 1.00 0.00 C ATOM 1965 C PHE B 28 6.185 9.754 -0.835 1.00 0.00 C ATOM 1966 O PHE B 28 6.320 8.822 -0.081 1.00 0.00 O ATOM 1967 CB PHE B 28 4.105 11.191 -1.103 1.00 0.00 C ATOM 1968 CG PHE B 28 3.296 9.910 -1.109 1.00 0.00 C ATOM 1969 CD1 PHE B 28 3.709 8.798 -1.857 1.00 0.00 C ATOM 1970 CD2 PHE B 28 2.089 9.862 -0.412 1.00 0.00 C ATOM 1971 CE1 PHE B 28 2.918 7.651 -1.900 1.00 0.00 C ATOM 1972 CE2 PHE B 28 1.303 8.713 -0.446 1.00 0.00 C ATOM 1973 CZ PHE B 28 1.711 7.606 -1.193 1.00 0.00 C ATOM 0 H PHE B 28 5.759 12.848 -1.453 1.00 0.00 H new ATOM 0 HA PHE B 28 5.313 10.949 0.681 1.00 0.00 H new ATOM 0 HB2 PHE B 28 3.534 11.977 -0.608 1.00 0.00 H new ATOM 0 HB3 PHE B 28 4.272 11.518 -2.129 1.00 0.00 H new ATOM 0 HD1 PHE B 28 4.642 8.830 -2.401 1.00 0.00 H new ATOM 0 HD2 PHE B 28 1.762 10.720 0.157 1.00 0.00 H new ATOM 0 HE1 PHE B 28 3.237 6.797 -2.479 1.00 0.00 H new ATOM 0 HE2 PHE B 28 0.376 8.678 0.107 1.00 0.00 H new ATOM 0 HZ PHE B 28 1.097 6.718 -1.225 1.00 0.00 H new ATOM 1983 N GLU B 29 6.710 9.722 -2.029 1.00 0.00 N ATOM 1984 CA GLU B 29 7.471 8.514 -2.428 1.00 0.00 C ATOM 1985 C GLU B 29 8.751 8.517 -1.638 1.00 0.00 C ATOM 1986 O GLU B 29 9.178 7.523 -1.096 1.00 0.00 O ATOM 1987 CB GLU B 29 7.799 8.657 -3.903 1.00 0.00 C ATOM 1988 CG GLU B 29 7.772 7.267 -4.525 1.00 0.00 C ATOM 1989 CD GLU B 29 8.705 7.221 -5.739 1.00 0.00 C ATOM 1990 OE1 GLU B 29 9.642 8.002 -5.773 1.00 0.00 O ATOM 1991 OE2 GLU B 29 8.470 6.404 -6.613 1.00 0.00 O ATOM 0 H GLU B 29 6.646 10.462 -2.728 1.00 0.00 H new ATOM 0 HA GLU B 29 6.913 7.595 -2.249 1.00 0.00 H new ATOM 0 HB2 GLU B 29 7.076 9.309 -4.393 1.00 0.00 H new ATOM 0 HB3 GLU B 29 8.780 9.114 -4.033 1.00 0.00 H new ATOM 0 HG2 GLU B 29 8.081 6.524 -3.790 1.00 0.00 H new ATOM 0 HG3 GLU B 29 6.756 7.014 -4.827 1.00 0.00 H new ATOM 1998 N LYS B 30 9.351 9.662 -1.549 1.00 0.00 N ATOM 1999 CA LYS B 30 10.596 9.769 -0.776 1.00 0.00 C ATOM 2000 C LYS B 30 10.308 9.383 0.662 1.00 0.00 C ATOM 2001 O LYS B 30 11.198 9.011 1.378 1.00 0.00 O ATOM 2002 CB LYS B 30 11.020 11.231 -0.862 1.00 0.00 C ATOM 2003 CG LYS B 30 12.366 11.399 -0.156 1.00 0.00 C ATOM 2004 CD LYS B 30 13.103 12.604 -0.742 1.00 0.00 C ATOM 2005 CE LYS B 30 12.420 13.894 -0.283 1.00 0.00 C ATOM 2006 NZ LYS B 30 13.472 14.943 -0.380 1.00 0.00 N ATOM 0 H LYS B 30 9.028 10.528 -1.981 1.00 0.00 H new ATOM 0 HA LYS B 30 11.382 9.115 -1.155 1.00 0.00 H new ATOM 0 HB2 LYS B 30 11.100 11.540 -1.904 1.00 0.00 H new ATOM 0 HB3 LYS B 30 10.268 11.869 -0.397 1.00 0.00 H new ATOM 0 HG2 LYS B 30 12.212 11.539 0.914 1.00 0.00 H new ATOM 0 HG3 LYS B 30 12.967 10.498 -0.277 1.00 0.00 H new ATOM 0 HD2 LYS B 30 14.145 12.598 -0.421 1.00 0.00 H new ATOM 0 HD3 LYS B 30 13.104 12.548 -1.831 1.00 0.00 H new ATOM 0 HE2 LYS B 30 11.564 14.134 -0.914 1.00 0.00 H new ATOM 0 HE3 LYS B 30 12.047 13.802 0.737 1.00 0.00 H new ATOM 0 HZ1 LYS B 30 13.078 15.858 -0.081 1.00 0.00 H new ATOM 0 HZ2 LYS B 30 14.271 14.692 0.237 1.00 0.00 H new ATOM 0 HZ3 LYS B 30 13.803 15.013 -1.364 1.00 0.00 H new ATOM 2020 N ILE B 31 9.066 9.450 1.091 1.00 0.00 N ATOM 2021 CA ILE B 31 8.759 9.069 2.489 1.00 0.00 C ATOM 2022 C ILE B 31 8.134 7.678 2.531 1.00 0.00 C ATOM 2023 O ILE B 31 8.370 6.895 3.426 1.00 0.00 O ATOM 2024 CB ILE B 31 7.824 10.138 3.028 1.00 0.00 C ATOM 2025 CG1 ILE B 31 6.507 10.156 2.277 1.00 0.00 C ATOM 2026 CG2 ILE B 31 8.500 11.505 2.939 1.00 0.00 C ATOM 2027 CD1 ILE B 31 5.394 9.707 3.228 1.00 0.00 C ATOM 0 H ILE B 31 8.267 9.750 0.532 1.00 0.00 H new ATOM 0 HA ILE B 31 9.657 9.015 3.105 1.00 0.00 H new ATOM 0 HB ILE B 31 7.607 9.905 4.070 1.00 0.00 H new ATOM 0 HG12 ILE B 31 6.301 11.158 1.900 1.00 0.00 H new ATOM 0 HG13 ILE B 31 6.556 9.494 1.413 1.00 0.00 H new ATOM 0 HG21 ILE B 31 7.827 12.270 3.326 1.00 0.00 H new ATOM 0 HG22 ILE B 31 9.417 11.497 3.528 1.00 0.00 H new ATOM 0 HG23 ILE B 31 8.739 11.726 1.899 1.00 0.00 H new ATOM 0 HD11 ILE B 31 4.440 9.715 2.701 1.00 0.00 H new ATOM 0 HD12 ILE B 31 5.604 8.698 3.583 1.00 0.00 H new ATOM 0 HD13 ILE B 31 5.345 10.388 4.078 1.00 0.00 H new ATOM 2039 N ILE B 32 7.383 7.346 1.540 1.00 0.00 N ATOM 2040 CA ILE B 32 6.801 5.980 1.483 1.00 0.00 C ATOM 2041 C ILE B 32 7.938 5.044 1.167 1.00 0.00 C ATOM 2042 O ILE B 32 8.108 4.006 1.786 1.00 0.00 O ATOM 2043 CB ILE B 32 5.780 6.003 0.353 1.00 0.00 C ATOM 2044 CG1 ILE B 32 4.667 7.006 0.712 1.00 0.00 C ATOM 2045 CG2 ILE B 32 5.198 4.593 0.170 1.00 0.00 C ATOM 2046 CD1 ILE B 32 3.340 6.286 0.955 1.00 0.00 C ATOM 0 H ILE B 32 7.141 7.957 0.760 1.00 0.00 H new ATOM 0 HA ILE B 32 6.319 5.663 2.408 1.00 0.00 H new ATOM 0 HB ILE B 32 6.250 6.311 -0.581 1.00 0.00 H new ATOM 0 HG12 ILE B 32 4.950 7.566 1.604 1.00 0.00 H new ATOM 0 HG13 ILE B 32 4.550 7.730 -0.095 1.00 0.00 H new ATOM 0 HG21 ILE B 32 4.466 4.603 -0.638 1.00 0.00 H new ATOM 0 HG22 ILE B 32 6.000 3.897 -0.076 1.00 0.00 H new ATOM 0 HG23 ILE B 32 4.714 4.276 1.094 1.00 0.00 H new ATOM 0 HD11 ILE B 32 2.571 7.016 1.207 1.00 0.00 H new ATOM 0 HD12 ILE B 32 3.048 5.747 0.054 1.00 0.00 H new ATOM 0 HD13 ILE B 32 3.454 5.581 1.778 1.00 0.00 H new ATOM 2058 N THR B 33 8.759 5.437 0.239 1.00 0.00 N ATOM 2059 CA THR B 33 9.921 4.610 -0.081 1.00 0.00 C ATOM 2060 C THR B 33 10.963 4.837 1.029 1.00 0.00 C ATOM 2061 O THR B 33 11.771 3.978 1.317 1.00 0.00 O ATOM 2062 CB THR B 33 10.390 5.068 -1.475 1.00 0.00 C ATOM 2063 OG1 THR B 33 10.262 3.990 -2.383 1.00 0.00 O ATOM 2064 CG2 THR B 33 11.846 5.513 -1.444 1.00 0.00 C ATOM 0 H THR B 33 8.666 6.295 -0.304 1.00 0.00 H new ATOM 0 HA THR B 33 9.723 3.539 -0.118 1.00 0.00 H new ATOM 0 HB THR B 33 9.773 5.911 -1.787 1.00 0.00 H new ATOM 0 HG1 THR B 33 10.036 4.336 -3.272 1.00 0.00 H new ATOM 0 HG21 THR B 33 12.151 5.831 -2.441 1.00 0.00 H new ATOM 0 HG22 THR B 33 11.958 6.344 -0.748 1.00 0.00 H new ATOM 0 HG23 THR B 33 12.473 4.682 -1.121 1.00 0.00 H new ATOM 2072 N GLU B 34 10.930 5.987 1.677 1.00 0.00 N ATOM 2073 CA GLU B 34 11.894 6.239 2.786 1.00 0.00 C ATOM 2074 C GLU B 34 11.633 5.264 3.937 1.00 0.00 C ATOM 2075 O GLU B 34 12.557 4.709 4.486 1.00 0.00 O ATOM 2076 CB GLU B 34 11.666 7.700 3.216 1.00 0.00 C ATOM 2077 CG GLU B 34 10.655 7.818 4.361 1.00 0.00 C ATOM 2078 CD GLU B 34 11.344 7.562 5.703 1.00 0.00 C ATOM 2079 OE1 GLU B 34 12.158 8.383 6.093 1.00 0.00 O ATOM 2080 OE2 GLU B 34 11.045 6.553 6.318 1.00 0.00 O ATOM 0 H GLU B 34 10.281 6.749 1.482 1.00 0.00 H new ATOM 0 HA GLU B 34 12.928 6.086 2.478 1.00 0.00 H new ATOM 0 HB2 GLU B 34 12.615 8.138 3.526 1.00 0.00 H new ATOM 0 HB3 GLU B 34 11.313 8.277 2.361 1.00 0.00 H new ATOM 0 HG2 GLU B 34 10.206 8.811 4.358 1.00 0.00 H new ATOM 0 HG3 GLU B 34 9.846 7.102 4.217 1.00 0.00 H new ATOM 2087 N THR B 35 10.391 5.040 4.310 1.00 0.00 N ATOM 2088 CA THR B 35 10.135 4.091 5.432 1.00 0.00 C ATOM 2089 C THR B 35 10.510 2.699 5.000 1.00 0.00 C ATOM 2090 O THR B 35 11.321 2.049 5.629 1.00 0.00 O ATOM 2091 CB THR B 35 8.645 4.149 5.745 1.00 0.00 C ATOM 2092 OG1 THR B 35 8.320 5.431 6.258 1.00 0.00 O ATOM 2093 CG2 THR B 35 8.327 3.069 6.789 1.00 0.00 C ATOM 0 H THR B 35 9.563 5.466 3.893 1.00 0.00 H new ATOM 0 HA THR B 35 10.722 4.355 6.311 1.00 0.00 H new ATOM 0 HB THR B 35 8.060 3.974 4.842 1.00 0.00 H new ATOM 0 HG1 THR B 35 7.800 5.331 7.082 1.00 0.00 H new ATOM 0 HG21 THR B 35 7.264 3.095 7.027 1.00 0.00 H new ATOM 0 HG22 THR B 35 8.586 2.089 6.389 1.00 0.00 H new ATOM 0 HG23 THR B 35 8.905 3.256 7.694 1.00 0.00 H new ATOM 2101 N VAL B 36 9.944 2.225 3.928 1.00 0.00 N ATOM 2102 CA VAL B 36 10.325 0.857 3.478 1.00 0.00 C ATOM 2103 C VAL B 36 11.851 0.778 3.428 1.00 0.00 C ATOM 2104 O VAL B 36 12.453 -0.238 3.711 1.00 0.00 O ATOM 2105 CB VAL B 36 9.740 0.704 2.079 1.00 0.00 C ATOM 2106 CG1 VAL B 36 8.216 0.676 2.157 1.00 0.00 C ATOM 2107 CG2 VAL B 36 10.192 1.869 1.210 1.00 0.00 C ATOM 0 H VAL B 36 9.252 2.709 3.356 1.00 0.00 H new ATOM 0 HA VAL B 36 9.958 0.073 4.141 1.00 0.00 H new ATOM 0 HB VAL B 36 10.090 -0.230 1.640 1.00 0.00 H new ATOM 0 HG11 VAL B 36 7.802 0.567 1.155 1.00 0.00 H new ATOM 0 HG12 VAL B 36 7.899 -0.164 2.774 1.00 0.00 H new ATOM 0 HG13 VAL B 36 7.857 1.606 2.598 1.00 0.00 H new ATOM 0 HG21 VAL B 36 9.774 1.760 0.209 1.00 0.00 H new ATOM 0 HG22 VAL B 36 9.846 2.805 1.648 1.00 0.00 H new ATOM 0 HG23 VAL B 36 11.280 1.877 1.150 1.00 0.00 H new ATOM 2117 N ALA B 37 12.471 1.874 3.086 1.00 0.00 N ATOM 2118 CA ALA B 37 13.957 1.914 3.031 1.00 0.00 C ATOM 2119 C ALA B 37 14.530 2.414 4.362 1.00 0.00 C ATOM 2120 O ALA B 37 15.728 2.495 4.541 1.00 0.00 O ATOM 2121 CB ALA B 37 14.293 2.870 1.904 1.00 0.00 C ATOM 0 H ALA B 37 12.007 2.749 2.841 1.00 0.00 H new ATOM 0 HA ALA B 37 14.385 0.927 2.859 1.00 0.00 H new ATOM 0 HB1 ALA B 37 15.376 2.949 1.805 1.00 0.00 H new ATOM 0 HB2 ALA B 37 13.870 2.496 0.972 1.00 0.00 H new ATOM 0 HB3 ALA B 37 13.876 3.853 2.124 1.00 0.00 H new ATOM 2127 N LYS B 38 13.686 2.709 5.310 1.00 0.00 N ATOM 2128 CA LYS B 38 14.183 3.138 6.644 1.00 0.00 C ATOM 2129 C LYS B 38 14.011 1.953 7.574 1.00 0.00 C ATOM 2130 O LYS B 38 14.613 1.867 8.627 1.00 0.00 O ATOM 2131 CB LYS B 38 13.310 4.317 7.084 1.00 0.00 C ATOM 2132 CG LYS B 38 14.064 5.158 8.120 1.00 0.00 C ATOM 2133 CD LYS B 38 15.294 5.809 7.472 1.00 0.00 C ATOM 2134 CE LYS B 38 14.872 6.616 6.239 1.00 0.00 C ATOM 2135 NZ LYS B 38 16.064 7.438 5.891 1.00 0.00 N ATOM 0 H LYS B 38 12.671 2.671 5.217 1.00 0.00 H new ATOM 0 HA LYS B 38 15.228 3.447 6.640 1.00 0.00 H new ATOM 0 HB2 LYS B 38 13.050 4.931 6.222 1.00 0.00 H new ATOM 0 HB3 LYS B 38 12.375 3.951 7.509 1.00 0.00 H new ATOM 0 HG2 LYS B 38 13.406 5.927 8.525 1.00 0.00 H new ATOM 0 HG3 LYS B 38 14.372 4.530 8.956 1.00 0.00 H new ATOM 0 HD2 LYS B 38 15.792 6.461 8.190 1.00 0.00 H new ATOM 0 HD3 LYS B 38 16.013 5.042 7.186 1.00 0.00 H new ATOM 0 HE2 LYS B 38 14.591 5.960 5.415 1.00 0.00 H new ATOM 0 HE3 LYS B 38 14.008 7.245 6.455 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 15.853 8.019 5.055 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 16.304 8.057 6.691 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 16.868 6.812 5.683 1.00 0.00 H new ATOM 2149 N GLY B 39 13.206 1.016 7.156 1.00 0.00 N ATOM 2150 CA GLY B 39 12.995 -0.194 7.956 1.00 0.00 C ATOM 2151 C GLY B 39 11.681 -0.107 8.721 1.00 0.00 C ATOM 2152 O GLY B 39 11.639 -0.346 9.912 1.00 0.00 O ATOM 0 H GLY B 39 12.684 1.050 6.280 1.00 0.00 H new ATOM 0 HA2 GLY B 39 12.987 -1.069 7.307 1.00 0.00 H new ATOM 0 HA3 GLY B 39 13.821 -0.323 8.655 1.00 0.00 H new ATOM 2156 N ASP B 40 10.601 0.220 8.060 1.00 0.00 N ATOM 2157 CA ASP B 40 9.306 0.295 8.800 1.00 0.00 C ATOM 2158 C ASP B 40 8.138 -0.074 7.887 1.00 0.00 C ATOM 2159 O ASP B 40 8.102 0.280 6.725 1.00 0.00 O ATOM 2160 CB ASP B 40 9.194 1.743 9.282 1.00 0.00 C ATOM 2161 CG ASP B 40 9.435 1.801 10.792 1.00 0.00 C ATOM 2162 OD1 ASP B 40 8.509 1.506 11.531 1.00 0.00 O ATOM 2163 OD2 ASP B 40 10.540 2.137 11.183 1.00 0.00 O ATOM 0 H ASP B 40 10.558 0.434 7.064 1.00 0.00 H new ATOM 0 HA ASP B 40 9.274 -0.406 9.634 1.00 0.00 H new ATOM 0 HB2 ASP B 40 9.922 2.367 8.763 1.00 0.00 H new ATOM 0 HB3 ASP B 40 8.207 2.140 9.045 1.00 0.00 H new ATOM 2168 N LYS B 41 7.181 -0.788 8.415 1.00 0.00 N ATOM 2169 CA LYS B 41 6.003 -1.192 7.604 1.00 0.00 C ATOM 2170 C LYS B 41 4.915 -0.129 7.733 1.00 0.00 C ATOM 2171 O LYS B 41 4.107 -0.160 8.641 1.00 0.00 O ATOM 2172 CB LYS B 41 5.533 -2.518 8.209 1.00 0.00 C ATOM 2173 CG LYS B 41 6.688 -3.524 8.213 1.00 0.00 C ATOM 2174 CD LYS B 41 7.342 -3.546 9.597 1.00 0.00 C ATOM 2175 CE LYS B 41 7.824 -4.964 9.914 1.00 0.00 C ATOM 2176 NZ LYS B 41 7.983 -4.994 11.395 1.00 0.00 N ATOM 0 H LYS B 41 7.167 -1.110 9.383 1.00 0.00 H new ATOM 0 HA LYS B 41 6.237 -1.298 6.545 1.00 0.00 H new ATOM 0 HB2 LYS B 41 5.175 -2.358 9.226 1.00 0.00 H new ATOM 0 HB3 LYS B 41 4.696 -2.914 7.635 1.00 0.00 H new ATOM 0 HG2 LYS B 41 6.320 -4.518 7.957 1.00 0.00 H new ATOM 0 HG3 LYS B 41 7.424 -3.252 7.456 1.00 0.00 H new ATOM 0 HD2 LYS B 41 8.181 -2.851 9.625 1.00 0.00 H new ATOM 0 HD3 LYS B 41 6.629 -3.216 10.353 1.00 0.00 H new ATOM 0 HE2 LYS B 41 7.103 -5.710 9.579 1.00 0.00 H new ATOM 0 HE3 LYS B 41 8.766 -5.182 9.411 1.00 0.00 H new ATOM 0 HZ1 LYS B 41 8.312 -5.936 11.690 1.00 0.00 H new ATOM 0 HZ2 LYS B 41 8.680 -4.278 11.684 1.00 0.00 H new ATOM 0 HZ3 LYS B 41 7.069 -4.789 11.847 1.00 0.00 H new ATOM 2190 N VAL B 42 4.894 0.813 6.834 1.00 0.00 N ATOM 2191 CA VAL B 42 3.859 1.889 6.909 1.00 0.00 C ATOM 2192 C VAL B 42 2.461 1.275 6.844 1.00 0.00 C ATOM 2193 O VAL B 42 2.206 0.366 6.078 1.00 0.00 O ATOM 2194 CB VAL B 42 4.108 2.790 5.696 1.00 0.00 C ATOM 2195 CG1 VAL B 42 5.455 3.504 5.850 1.00 0.00 C ATOM 2196 CG2 VAL B 42 4.116 1.947 4.416 1.00 0.00 C ATOM 0 H VAL B 42 5.544 0.888 6.052 1.00 0.00 H new ATOM 0 HA VAL B 42 3.922 2.451 7.841 1.00 0.00 H new ATOM 0 HB VAL B 42 3.312 3.532 5.633 1.00 0.00 H new ATOM 0 HG11 VAL B 42 5.629 4.144 4.985 1.00 0.00 H new ATOM 0 HG12 VAL B 42 5.443 4.112 6.755 1.00 0.00 H new ATOM 0 HG13 VAL B 42 6.253 2.765 5.920 1.00 0.00 H new ATOM 0 HG21 VAL B 42 4.294 2.593 3.556 1.00 0.00 H new ATOM 0 HG22 VAL B 42 4.907 1.199 4.478 1.00 0.00 H new ATOM 0 HG23 VAL B 42 3.153 1.448 4.303 1.00 0.00 H new ATOM 2206 N GLN B 43 1.555 1.757 7.652 1.00 0.00 N ATOM 2207 CA GLN B 43 0.177 1.190 7.647 1.00 0.00 C ATOM 2208 C GLN B 43 -0.834 2.267 7.255 1.00 0.00 C ATOM 2209 O GLN B 43 -0.497 3.423 7.110 1.00 0.00 O ATOM 2210 CB GLN B 43 -0.082 0.725 9.085 1.00 0.00 C ATOM 2211 CG GLN B 43 1.169 0.041 9.648 1.00 0.00 C ATOM 2212 CD GLN B 43 0.762 -1.193 10.456 1.00 0.00 C ATOM 2213 OE1 GLN B 43 1.202 -2.289 10.175 1.00 0.00 O ATOM 2214 NE2 GLN B 43 -0.067 -1.059 11.455 1.00 0.00 N ATOM 0 H GLN B 43 1.710 2.517 8.314 1.00 0.00 H new ATOM 0 HA GLN B 43 0.078 0.373 6.932 1.00 0.00 H new ATOM 0 HB2 GLN B 43 -0.352 1.577 9.708 1.00 0.00 H new ATOM 0 HB3 GLN B 43 -0.925 0.034 9.106 1.00 0.00 H new ATOM 0 HG2 GLN B 43 1.834 -0.248 8.835 1.00 0.00 H new ATOM 0 HG3 GLN B 43 1.722 0.736 10.280 1.00 0.00 H new ATOM 0 HE21 GLN B 43 -0.437 -0.138 11.691 1.00 0.00 H new ATOM 0 HE22 GLN B 43 -0.345 -1.875 12.000 1.00 0.00 H new ATOM 2223 N LEU B 44 -2.070 1.893 7.078 1.00 0.00 N ATOM 2224 CA LEU B 44 -3.102 2.897 6.696 1.00 0.00 C ATOM 2225 C LEU B 44 -4.424 2.615 7.410 1.00 0.00 C ATOM 2226 O LEU B 44 -4.528 1.709 8.210 1.00 0.00 O ATOM 2227 CB LEU B 44 -3.296 2.755 5.191 1.00 0.00 C ATOM 2228 CG LEU B 44 -1.960 2.862 4.450 1.00 0.00 C ATOM 2229 CD1 LEU B 44 -2.164 2.458 2.988 1.00 0.00 C ATOM 2230 CD2 LEU B 44 -1.455 4.302 4.509 1.00 0.00 C ATOM 0 H LEU B 44 -2.410 0.937 7.181 1.00 0.00 H new ATOM 0 HA LEU B 44 -2.786 3.902 6.975 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -3.762 1.795 4.970 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -3.976 3.529 4.834 1.00 0.00 H new ATOM 0 HG LEU B 44 -1.229 2.203 4.918 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -1.216 2.532 2.454 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -2.527 1.431 2.942 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -2.894 3.123 2.525 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -0.504 4.376 3.981 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -2.183 4.963 4.039 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -1.316 4.597 5.549 1.00 0.00 H new ATOM 2242 N THR B 45 -5.426 3.404 7.119 1.00 0.00 N ATOM 2243 CA THR B 45 -6.773 3.228 7.757 1.00 0.00 C ATOM 2244 C THR B 45 -7.277 1.782 7.634 1.00 0.00 C ATOM 2245 O THR B 45 -8.229 1.512 6.932 1.00 0.00 O ATOM 2246 CB THR B 45 -7.702 4.172 6.979 1.00 0.00 C ATOM 2247 OG1 THR B 45 -9.048 3.931 7.365 1.00 0.00 O ATOM 2248 CG2 THR B 45 -7.552 3.934 5.467 1.00 0.00 C ATOM 0 H THR B 45 -5.370 4.177 6.456 1.00 0.00 H new ATOM 0 HA THR B 45 -6.736 3.449 8.824 1.00 0.00 H new ATOM 0 HB THR B 45 -7.433 5.204 7.204 1.00 0.00 H new ATOM 0 HG1 THR B 45 -9.251 2.977 7.267 1.00 0.00 H new ATOM 0 HG21 THR B 45 -8.215 4.608 4.925 1.00 0.00 H new ATOM 0 HG22 THR B 45 -6.520 4.123 5.170 1.00 0.00 H new ATOM 0 HG23 THR B 45 -7.814 2.902 5.233 1.00 0.00 H new ATOM 2256 N GLY B 46 -6.653 0.856 8.322 1.00 0.00 N ATOM 2257 CA GLY B 46 -7.092 -0.577 8.268 1.00 0.00 C ATOM 2258 C GLY B 46 -7.452 -0.985 6.835 1.00 0.00 C ATOM 2259 O GLY B 46 -8.291 -1.838 6.619 1.00 0.00 O ATOM 0 H GLY B 46 -5.850 1.033 8.925 1.00 0.00 H new ATOM 0 HA2 GLY B 46 -6.296 -1.220 8.644 1.00 0.00 H new ATOM 0 HA3 GLY B 46 -7.954 -0.722 8.919 1.00 0.00 H new ATOM 2263 N PHE B 47 -6.831 -0.385 5.856 1.00 0.00 N ATOM 2264 CA PHE B 47 -7.148 -0.741 4.441 1.00 0.00 C ATOM 2265 C PHE B 47 -5.899 -1.172 3.707 1.00 0.00 C ATOM 2266 O PHE B 47 -5.968 -1.945 2.770 1.00 0.00 O ATOM 2267 CB PHE B 47 -7.773 0.517 3.838 1.00 0.00 C ATOM 2268 CG PHE B 47 -6.758 1.279 3.027 1.00 0.00 C ATOM 2269 CD1 PHE B 47 -5.978 2.261 3.633 1.00 0.00 C ATOM 2270 CD2 PHE B 47 -6.613 1.020 1.662 1.00 0.00 C ATOM 2271 CE1 PHE B 47 -5.065 2.981 2.877 1.00 0.00 C ATOM 2272 CE2 PHE B 47 -5.691 1.740 0.915 1.00 0.00 C ATOM 2273 CZ PHE B 47 -4.920 2.724 1.533 1.00 0.00 C ATOM 0 H PHE B 47 -6.119 0.336 5.973 1.00 0.00 H new ATOM 0 HA PHE B 47 -7.833 -1.586 4.367 1.00 0.00 H new ATOM 0 HB2 PHE B 47 -8.618 0.243 3.207 1.00 0.00 H new ATOM 0 HB3 PHE B 47 -8.162 1.153 4.633 1.00 0.00 H new ATOM 0 HD1 PHE B 47 -6.084 2.461 4.689 1.00 0.00 H new ATOM 0 HD2 PHE B 47 -7.218 0.261 1.189 1.00 0.00 H new ATOM 0 HE1 PHE B 47 -4.465 3.747 3.345 1.00 0.00 H new ATOM 0 HE2 PHE B 47 -5.571 1.539 -0.139 1.00 0.00 H new ATOM 0 HZ PHE B 47 -4.204 3.288 0.953 1.00 0.00 H new ATOM 2283 N LEU B 48 -4.761 -0.697 4.097 1.00 0.00 N ATOM 2284 CA LEU B 48 -3.556 -1.117 3.378 1.00 0.00 C ATOM 2285 C LEU B 48 -2.289 -0.696 4.123 1.00 0.00 C ATOM 2286 O LEU B 48 -2.260 0.291 4.821 1.00 0.00 O ATOM 2287 CB LEU B 48 -3.722 -0.415 2.042 1.00 0.00 C ATOM 2288 CG LEU B 48 -2.393 -0.287 1.351 1.00 0.00 C ATOM 2289 CD1 LEU B 48 -1.830 -1.688 1.096 1.00 0.00 C ATOM 2290 CD2 LEU B 48 -2.613 0.445 0.034 1.00 0.00 C ATOM 0 H LEU B 48 -4.619 -0.047 4.870 1.00 0.00 H new ATOM 0 HA LEU B 48 -3.447 -2.197 3.274 1.00 0.00 H new ATOM 0 HB2 LEU B 48 -4.414 -0.975 1.413 1.00 0.00 H new ATOM 0 HB3 LEU B 48 -4.157 0.573 2.194 1.00 0.00 H new ATOM 0 HG LEU B 48 -1.684 0.270 1.964 1.00 0.00 H new ATOM 0 HD11 LEU B 48 -0.865 -1.607 0.595 1.00 0.00 H new ATOM 0 HD12 LEU B 48 -1.703 -2.207 2.046 1.00 0.00 H new ATOM 0 HD13 LEU B 48 -2.520 -2.248 0.466 1.00 0.00 H new ATOM 0 HD21 LEU B 48 -1.661 0.550 -0.487 1.00 0.00 H new ATOM 0 HD22 LEU B 48 -3.306 -0.123 -0.587 1.00 0.00 H new ATOM 0 HD23 LEU B 48 -3.030 1.433 0.232 1.00 0.00 H new ATOM 2302 N ASN B 49 -1.243 -1.457 3.976 1.00 0.00 N ATOM 2303 CA ASN B 49 0.033 -1.138 4.653 1.00 0.00 C ATOM 2304 C ASN B 49 1.176 -1.625 3.766 1.00 0.00 C ATOM 2305 O ASN B 49 0.961 -2.155 2.697 1.00 0.00 O ATOM 2306 CB ASN B 49 0.019 -1.916 5.977 1.00 0.00 C ATOM 2307 CG ASN B 49 -1.351 -1.797 6.655 1.00 0.00 C ATOM 2308 OD1 ASN B 49 -1.763 -0.720 7.038 1.00 0.00 O ATOM 2309 ND2 ASN B 49 -2.078 -2.868 6.819 1.00 0.00 N ATOM 0 H ASN B 49 -1.223 -2.301 3.404 1.00 0.00 H new ATOM 0 HA ASN B 49 0.159 -0.071 4.834 1.00 0.00 H new ATOM 0 HB2 ASN B 49 0.250 -2.965 5.792 1.00 0.00 H new ATOM 0 HB3 ASN B 49 0.794 -1.531 6.640 1.00 0.00 H new ATOM 0 HD21 ASN B 49 -2.991 -2.801 7.268 1.00 0.00 H new ATOM 0 HD22 ASN B 49 -1.733 -3.773 6.498 1.00 0.00 H new ATOM 2316 N ILE B 50 2.377 -1.453 4.201 1.00 0.00 N ATOM 2317 CA ILE B 50 3.543 -1.909 3.392 1.00 0.00 C ATOM 2318 C ILE B 50 4.639 -2.464 4.303 1.00 0.00 C ATOM 2319 O ILE B 50 4.608 -2.275 5.502 1.00 0.00 O ATOM 2320 CB ILE B 50 4.009 -0.651 2.652 1.00 0.00 C ATOM 2321 CG1 ILE B 50 3.914 -0.887 1.151 1.00 0.00 C ATOM 2322 CG2 ILE B 50 5.456 -0.304 3.013 1.00 0.00 C ATOM 2323 CD1 ILE B 50 3.625 0.440 0.469 1.00 0.00 C ATOM 0 H ILE B 50 2.614 -1.013 5.090 1.00 0.00 H new ATOM 0 HA ILE B 50 3.292 -2.714 2.702 1.00 0.00 H new ATOM 0 HB ILE B 50 3.368 0.179 2.948 1.00 0.00 H new ATOM 0 HG12 ILE B 50 4.845 -1.311 0.775 1.00 0.00 H new ATOM 0 HG13 ILE B 50 3.125 -1.606 0.930 1.00 0.00 H new ATOM 0 HG21 ILE B 50 5.761 0.593 2.474 1.00 0.00 H new ATOM 0 HG22 ILE B 50 5.531 -0.125 4.086 1.00 0.00 H new ATOM 0 HG23 ILE B 50 6.108 -1.132 2.737 1.00 0.00 H new ATOM 0 HD11 ILE B 50 3.554 0.288 -0.608 1.00 0.00 H new ATOM 0 HD12 ILE B 50 2.683 0.843 0.841 1.00 0.00 H new ATOM 0 HD13 ILE B 50 4.430 1.142 0.684 1.00 0.00 H new ATOM 2335 N LYS B 51 5.615 -3.137 3.745 1.00 0.00 N ATOM 2336 CA LYS B 51 6.711 -3.681 4.603 1.00 0.00 C ATOM 2337 C LYS B 51 7.854 -4.231 3.736 1.00 0.00 C ATOM 2338 O LYS B 51 7.618 -4.997 2.823 1.00 0.00 O ATOM 2339 CB LYS B 51 6.068 -4.808 5.419 1.00 0.00 C ATOM 2340 CG LYS B 51 5.530 -5.892 4.480 1.00 0.00 C ATOM 2341 CD LYS B 51 6.530 -7.050 4.397 1.00 0.00 C ATOM 2342 CE LYS B 51 6.644 -7.733 5.762 1.00 0.00 C ATOM 2343 NZ LYS B 51 5.716 -8.896 5.690 1.00 0.00 N ATOM 0 H LYS B 51 5.700 -3.331 2.747 1.00 0.00 H new ATOM 0 HA LYS B 51 7.143 -2.911 5.243 1.00 0.00 H new ATOM 0 HB2 LYS B 51 6.801 -5.238 6.102 1.00 0.00 H new ATOM 0 HB3 LYS B 51 5.258 -4.410 6.030 1.00 0.00 H new ATOM 0 HG2 LYS B 51 4.568 -6.255 4.842 1.00 0.00 H new ATOM 0 HG3 LYS B 51 5.360 -5.475 3.488 1.00 0.00 H new ATOM 0 HD2 LYS B 51 6.206 -7.770 3.646 1.00 0.00 H new ATOM 0 HD3 LYS B 51 7.506 -6.679 4.083 1.00 0.00 H new ATOM 0 HE2 LYS B 51 7.667 -8.056 5.958 1.00 0.00 H new ATOM 0 HE3 LYS B 51 6.364 -7.054 6.568 1.00 0.00 H new ATOM 0 HZ1 LYS B 51 5.739 -9.415 6.591 1.00 0.00 H new ATOM 0 HZ2 LYS B 51 4.749 -8.558 5.510 1.00 0.00 H new ATOM 0 HZ3 LYS B 51 6.011 -9.528 4.919 1.00 0.00 H new ATOM 2357 N PRO B 52 9.060 -3.820 4.047 1.00 0.00 N ATOM 2358 CA PRO B 52 10.236 -4.284 3.287 1.00 0.00 C ATOM 2359 C PRO B 52 10.816 -5.548 3.909 1.00 0.00 C ATOM 2360 O PRO B 52 10.856 -5.698 5.114 1.00 0.00 O ATOM 2361 CB PRO B 52 11.225 -3.141 3.447 1.00 0.00 C ATOM 2362 CG PRO B 52 10.853 -2.473 4.737 1.00 0.00 C ATOM 2363 CD PRO B 52 9.446 -2.887 5.106 1.00 0.00 C ATOM 0 HA PRO B 52 10.000 -4.523 2.250 1.00 0.00 H new ATOM 0 HB2 PRO B 52 12.250 -3.509 3.476 1.00 0.00 H new ATOM 0 HB3 PRO B 52 11.160 -2.445 2.611 1.00 0.00 H new ATOM 0 HG2 PRO B 52 11.550 -2.757 5.525 1.00 0.00 H new ATOM 0 HG3 PRO B 52 10.914 -1.390 4.633 1.00 0.00 H new ATOM 0 HD2 PRO B 52 9.414 -3.362 6.087 1.00 0.00 H new ATOM 0 HD3 PRO B 52 8.775 -2.029 5.145 1.00 0.00 H new ATOM 2371 N VAL B 53 11.286 -6.446 3.094 1.00 0.00 N ATOM 2372 CA VAL B 53 11.886 -7.689 3.633 1.00 0.00 C ATOM 2373 C VAL B 53 13.287 -7.890 3.061 1.00 0.00 C ATOM 2374 O VAL B 53 13.971 -6.944 2.720 1.00 0.00 O ATOM 2375 CB VAL B 53 10.921 -8.815 3.240 1.00 0.00 C ATOM 2376 CG1 VAL B 53 9.517 -8.471 3.746 1.00 0.00 C ATOM 2377 CG2 VAL B 53 10.876 -8.969 1.721 1.00 0.00 C ATOM 0 H VAL B 53 11.280 -6.371 2.077 1.00 0.00 H new ATOM 0 HA VAL B 53 12.012 -7.660 4.715 1.00 0.00 H new ATOM 0 HB VAL B 53 11.266 -9.749 3.684 1.00 0.00 H new ATOM 0 HG11 VAL B 53 8.826 -9.267 3.470 1.00 0.00 H new ATOM 0 HG12 VAL B 53 9.537 -8.367 4.831 1.00 0.00 H new ATOM 0 HG13 VAL B 53 9.188 -7.533 3.298 1.00 0.00 H new ATOM 0 HG21 VAL B 53 10.187 -9.772 1.457 1.00 0.00 H new ATOM 0 HG22 VAL B 53 10.536 -8.036 1.271 1.00 0.00 H new ATOM 0 HG23 VAL B 53 11.872 -9.209 1.350 1.00 0.00 H new ATOM 2387 N ALA B 54 13.724 -9.101 2.969 1.00 0.00 N ATOM 2388 CA ALA B 54 15.093 -9.360 2.432 1.00 0.00 C ATOM 2389 C ALA B 54 15.065 -10.513 1.426 1.00 0.00 C ATOM 2390 O ALA B 54 14.759 -11.641 1.763 1.00 0.00 O ATOM 2391 CB ALA B 54 15.940 -9.719 3.656 1.00 0.00 C ATOM 0 H ALA B 54 13.199 -9.932 3.240 1.00 0.00 H new ATOM 0 HA ALA B 54 15.497 -8.498 1.901 1.00 0.00 H new ATOM 0 HB1 ALA B 54 16.964 -9.924 3.343 1.00 0.00 H new ATOM 0 HB2 ALA B 54 15.936 -8.886 4.359 1.00 0.00 H new ATOM 0 HB3 ALA B 54 15.525 -10.603 4.139 1.00 0.00 H new ATOM 2710 N VAL B 75 15.881 -6.251 -1.274 1.00 0.00 N ATOM 2711 CA VAL B 75 14.904 -6.480 -0.157 1.00 0.00 C ATOM 2712 C VAL B 75 13.509 -6.606 -0.776 1.00 0.00 C ATOM 2713 O VAL B 75 13.345 -6.396 -1.962 1.00 0.00 O ATOM 2714 CB VAL B 75 15.018 -5.257 0.800 1.00 0.00 C ATOM 2715 CG1 VAL B 75 15.863 -4.146 0.169 1.00 0.00 C ATOM 2716 CG2 VAL B 75 13.630 -4.685 1.135 1.00 0.00 C ATOM 0 HA VAL B 75 15.103 -7.389 0.410 1.00 0.00 H new ATOM 0 HB VAL B 75 15.497 -5.609 1.714 1.00 0.00 H new ATOM 0 HG11 VAL B 75 15.928 -3.303 0.857 1.00 0.00 H new ATOM 0 HG12 VAL B 75 16.864 -4.523 -0.038 1.00 0.00 H new ATOM 0 HG13 VAL B 75 15.399 -3.820 -0.762 1.00 0.00 H new ATOM 0 HG21 VAL B 75 13.740 -3.832 1.805 1.00 0.00 H new ATOM 0 HG22 VAL B 75 13.137 -4.364 0.217 1.00 0.00 H new ATOM 0 HG23 VAL B 75 13.028 -5.453 1.621 1.00 0.00 H new ATOM 2726 N GLY B 76 12.504 -6.955 -0.014 1.00 0.00 N ATOM 2727 CA GLY B 76 11.155 -7.092 -0.633 1.00 0.00 C ATOM 2728 C GLY B 76 10.199 -6.045 -0.068 1.00 0.00 C ATOM 2729 O GLY B 76 9.484 -6.295 0.881 1.00 0.00 O ATOM 0 H GLY B 76 12.557 -7.147 0.986 1.00 0.00 H new ATOM 0 HA2 GLY B 76 11.231 -6.978 -1.714 1.00 0.00 H new ATOM 0 HA3 GLY B 76 10.762 -8.091 -0.445 1.00 0.00 H new ATOM 2733 N VAL B 77 10.158 -4.883 -0.662 1.00 0.00 N ATOM 2734 CA VAL B 77 9.216 -3.835 -0.176 1.00 0.00 C ATOM 2735 C VAL B 77 7.801 -4.276 -0.505 1.00 0.00 C ATOM 2736 O VAL B 77 7.138 -3.709 -1.347 1.00 0.00 O ATOM 2737 CB VAL B 77 9.583 -2.554 -0.934 1.00 0.00 C ATOM 2738 CG1 VAL B 77 9.569 -2.819 -2.443 1.00 0.00 C ATOM 2739 CG2 VAL B 77 8.567 -1.454 -0.598 1.00 0.00 C ATOM 0 H VAL B 77 10.734 -4.615 -1.460 1.00 0.00 H new ATOM 0 HA VAL B 77 9.279 -3.671 0.900 1.00 0.00 H new ATOM 0 HB VAL B 77 10.582 -2.234 -0.636 1.00 0.00 H new ATOM 0 HG11 VAL B 77 9.831 -1.905 -2.975 1.00 0.00 H new ATOM 0 HG12 VAL B 77 10.293 -3.598 -2.682 1.00 0.00 H new ATOM 0 HG13 VAL B 77 8.573 -3.143 -2.746 1.00 0.00 H new ATOM 0 HG21 VAL B 77 8.826 -0.542 -1.136 1.00 0.00 H new ATOM 0 HG22 VAL B 77 7.569 -1.778 -0.893 1.00 0.00 H new ATOM 0 HG23 VAL B 77 8.583 -1.259 0.474 1.00 0.00 H new ATOM 2749 N SER B 78 7.350 -5.301 0.150 1.00 0.00 N ATOM 2750 CA SER B 78 5.983 -5.818 -0.119 1.00 0.00 C ATOM 2751 C SER B 78 4.925 -4.741 0.156 1.00 0.00 C ATOM 2752 O SER B 78 5.183 -3.555 0.088 1.00 0.00 O ATOM 2753 CB SER B 78 5.817 -6.997 0.841 1.00 0.00 C ATOM 2754 OG SER B 78 5.129 -8.050 0.177 1.00 0.00 O ATOM 0 H SER B 78 7.871 -5.808 0.865 1.00 0.00 H new ATOM 0 HA SER B 78 5.854 -6.112 -1.161 1.00 0.00 H new ATOM 0 HB2 SER B 78 6.793 -7.343 1.183 1.00 0.00 H new ATOM 0 HB3 SER B 78 5.262 -6.685 1.726 1.00 0.00 H new ATOM 0 HG SER B 78 5.022 -8.808 0.789 1.00 0.00 H new ATOM 2760 N VAL B 79 3.741 -5.167 0.472 1.00 0.00 N ATOM 2761 CA VAL B 79 2.627 -4.229 0.767 1.00 0.00 C ATOM 2762 C VAL B 79 1.614 -4.988 1.624 1.00 0.00 C ATOM 2763 O VAL B 79 1.910 -6.072 2.091 1.00 0.00 O ATOM 2764 CB VAL B 79 2.063 -3.834 -0.608 1.00 0.00 C ATOM 2765 CG1 VAL B 79 1.133 -4.927 -1.141 1.00 0.00 C ATOM 2766 CG2 VAL B 79 1.293 -2.514 -0.487 1.00 0.00 C ATOM 0 H VAL B 79 3.490 -6.153 0.540 1.00 0.00 H new ATOM 0 HA VAL B 79 2.915 -3.332 1.315 1.00 0.00 H new ATOM 0 HB VAL B 79 2.892 -3.712 -1.305 1.00 0.00 H new ATOM 0 HG11 VAL B 79 0.743 -4.630 -2.115 1.00 0.00 H new ATOM 0 HG12 VAL B 79 1.688 -5.860 -1.241 1.00 0.00 H new ATOM 0 HG13 VAL B 79 0.305 -5.070 -0.447 1.00 0.00 H new ATOM 0 HG21 VAL B 79 0.894 -2.235 -1.462 1.00 0.00 H new ATOM 0 HG22 VAL B 79 0.472 -2.635 0.220 1.00 0.00 H new ATOM 0 HG23 VAL B 79 1.965 -1.732 -0.133 1.00 0.00 H new ATOM 2776 N LYS B 80 0.437 -4.470 1.859 1.00 0.00 N ATOM 2777 CA LYS B 80 -0.502 -5.249 2.703 1.00 0.00 C ATOM 2778 C LYS B 80 -1.951 -5.185 2.208 1.00 0.00 C ATOM 2779 O LYS B 80 -2.278 -4.499 1.260 1.00 0.00 O ATOM 2780 CB LYS B 80 -0.384 -4.631 4.095 1.00 0.00 C ATOM 2781 CG LYS B 80 0.655 -5.402 4.914 1.00 0.00 C ATOM 2782 CD LYS B 80 0.162 -5.558 6.354 1.00 0.00 C ATOM 2783 CE LYS B 80 0.849 -6.764 7.003 1.00 0.00 C ATOM 2784 NZ LYS B 80 1.663 -6.194 8.113 1.00 0.00 N ATOM 0 H LYS B 80 0.097 -3.572 1.515 1.00 0.00 H new ATOM 0 HA LYS B 80 -0.245 -6.308 2.682 1.00 0.00 H new ATOM 0 HB2 LYS B 80 -0.094 -3.583 4.015 1.00 0.00 H new ATOM 0 HB3 LYS B 80 -1.350 -4.657 4.598 1.00 0.00 H new ATOM 0 HG2 LYS B 80 0.828 -6.382 4.470 1.00 0.00 H new ATOM 0 HG3 LYS B 80 1.608 -4.873 4.901 1.00 0.00 H new ATOM 0 HD2 LYS B 80 0.378 -4.654 6.923 1.00 0.00 H new ATOM 0 HD3 LYS B 80 -0.920 -5.692 6.367 1.00 0.00 H new ATOM 0 HE2 LYS B 80 0.118 -7.480 7.378 1.00 0.00 H new ATOM 0 HE3 LYS B 80 1.476 -7.294 6.286 1.00 0.00 H new ATOM 0 HZ1 LYS B 80 2.164 -6.961 8.605 1.00 0.00 H new ATOM 0 HZ2 LYS B 80 2.355 -5.521 7.726 1.00 0.00 H new ATOM 0 HZ3 LYS B 80 1.039 -5.702 8.784 1.00 0.00 H new ATOM 2798 N PRO B 81 -2.754 -5.949 2.895 1.00 0.00 N ATOM 2799 CA PRO B 81 -4.193 -6.103 2.634 1.00 0.00 C ATOM 2800 C PRO B 81 -5.030 -5.485 3.761 1.00 0.00 C ATOM 2801 O PRO B 81 -4.949 -5.918 4.895 1.00 0.00 O ATOM 2802 CB PRO B 81 -4.330 -7.619 2.745 1.00 0.00 C ATOM 2803 CG PRO B 81 -3.205 -8.042 3.674 1.00 0.00 C ATOM 2804 CD PRO B 81 -2.392 -6.802 3.987 1.00 0.00 C ATOM 0 HA PRO B 81 -4.518 -5.643 1.701 1.00 0.00 H new ATOM 0 HB2 PRO B 81 -5.303 -7.900 3.148 1.00 0.00 H new ATOM 0 HB3 PRO B 81 -4.239 -8.097 1.770 1.00 0.00 H new ATOM 0 HG2 PRO B 81 -3.605 -8.480 4.588 1.00 0.00 H new ATOM 0 HG3 PRO B 81 -2.582 -8.802 3.202 1.00 0.00 H new ATOM 0 HD2 PRO B 81 -2.656 -6.370 4.952 1.00 0.00 H new ATOM 0 HD3 PRO B 81 -1.322 -7.007 4.012 1.00 0.00 H new ATOM 2812 N GLY B 82 -5.852 -4.521 3.477 1.00 0.00 N ATOM 2813 CA GLY B 82 -6.705 -3.945 4.561 1.00 0.00 C ATOM 2814 C GLY B 82 -8.173 -4.049 4.142 1.00 0.00 C ATOM 2815 O GLY B 82 -8.499 -3.935 2.976 1.00 0.00 O ATOM 0 H GLY B 82 -5.975 -4.106 2.553 1.00 0.00 H new ATOM 0 HA2 GLY B 82 -6.541 -4.481 5.496 1.00 0.00 H new ATOM 0 HA3 GLY B 82 -6.436 -2.904 4.739 1.00 0.00 H new ATOM 2819 N GLU B 83 -9.061 -4.288 5.073 1.00 0.00 N ATOM 2820 CA GLU B 83 -10.502 -4.422 4.703 1.00 0.00 C ATOM 2821 C GLU B 83 -11.195 -3.062 4.640 1.00 0.00 C ATOM 2822 O GLU B 83 -12.189 -2.910 3.961 1.00 0.00 O ATOM 2823 CB GLU B 83 -11.135 -5.291 5.786 1.00 0.00 C ATOM 2824 CG GLU B 83 -10.941 -4.643 7.160 1.00 0.00 C ATOM 2825 CD GLU B 83 -9.919 -5.445 7.968 1.00 0.00 C ATOM 2826 OE1 GLU B 83 -8.972 -5.931 7.371 1.00 0.00 O ATOM 2827 OE2 GLU B 83 -10.099 -5.559 9.169 1.00 0.00 O ATOM 0 H GLU B 83 -8.853 -4.395 6.066 1.00 0.00 H new ATOM 0 HA GLU B 83 -10.606 -4.866 3.713 1.00 0.00 H new ATOM 0 HB2 GLU B 83 -12.198 -5.421 5.584 1.00 0.00 H new ATOM 0 HB3 GLU B 83 -10.685 -6.284 5.776 1.00 0.00 H new ATOM 0 HG2 GLU B 83 -10.600 -3.614 7.043 1.00 0.00 H new ATOM 0 HG3 GLU B 83 -11.891 -4.605 7.693 1.00 0.00 H new ATOM 2834 N SER B 84 -10.686 -2.069 5.323 1.00 0.00 N ATOM 2835 CA SER B 84 -11.342 -0.724 5.261 1.00 0.00 C ATOM 2836 C SER B 84 -11.535 -0.348 3.792 1.00 0.00 C ATOM 2837 O SER B 84 -12.484 0.314 3.418 1.00 0.00 O ATOM 2838 CB SER B 84 -10.371 0.234 5.945 1.00 0.00 C ATOM 2839 OG SER B 84 -10.675 1.567 5.558 1.00 0.00 O ATOM 0 H SER B 84 -9.856 -2.127 5.914 1.00 0.00 H new ATOM 0 HA SER B 84 -12.318 -0.699 5.746 1.00 0.00 H new ATOM 0 HB2 SER B 84 -10.444 0.132 7.028 1.00 0.00 H new ATOM 0 HB3 SER B 84 -9.345 -0.012 5.670 1.00 0.00 H new ATOM 0 HG SER B 84 -9.895 2.139 5.716 1.00 0.00 H new ATOM 2845 N LEU B 85 -10.645 -0.811 2.960 1.00 0.00 N ATOM 2846 CA LEU B 85 -10.752 -0.545 1.505 1.00 0.00 C ATOM 2847 C LEU B 85 -11.628 -1.635 0.895 1.00 0.00 C ATOM 2848 O LEU B 85 -12.474 -1.368 0.062 1.00 0.00 O ATOM 2849 CB LEU B 85 -9.284 -0.570 1.018 1.00 0.00 C ATOM 2850 CG LEU B 85 -9.070 -1.231 -0.356 1.00 0.00 C ATOM 2851 CD1 LEU B 85 -10.254 -1.002 -1.295 1.00 0.00 C ATOM 2852 CD2 LEU B 85 -7.819 -0.616 -0.993 1.00 0.00 C ATOM 0 H LEU B 85 -9.837 -1.370 3.234 1.00 0.00 H new ATOM 0 HA LEU B 85 -11.217 0.401 1.228 1.00 0.00 H new ATOM 0 HB2 LEU B 85 -8.913 0.454 0.974 1.00 0.00 H new ATOM 0 HB3 LEU B 85 -8.680 -1.097 1.757 1.00 0.00 H new ATOM 0 HG LEU B 85 -8.963 -2.305 -0.205 1.00 0.00 H new ATOM 0 HD11 LEU B 85 -10.058 -1.486 -2.252 1.00 0.00 H new ATOM 0 HD12 LEU B 85 -11.156 -1.424 -0.852 1.00 0.00 H new ATOM 0 HD13 LEU B 85 -10.393 0.068 -1.451 1.00 0.00 H new ATOM 0 HD21 LEU B 85 -7.647 -1.070 -1.969 1.00 0.00 H new ATOM 0 HD22 LEU B 85 -7.962 0.458 -1.112 1.00 0.00 H new ATOM 0 HD23 LEU B 85 -6.957 -0.798 -0.351 1.00 0.00 H new ATOM 2864 N LYS B 86 -11.463 -2.859 1.323 1.00 0.00 N ATOM 2865 CA LYS B 86 -12.323 -3.941 0.769 1.00 0.00 C ATOM 2866 C LYS B 86 -13.769 -3.676 1.157 1.00 0.00 C ATOM 2867 O LYS B 86 -14.694 -4.065 0.470 1.00 0.00 O ATOM 2868 CB LYS B 86 -11.828 -5.249 1.397 1.00 0.00 C ATOM 2869 CG LYS B 86 -10.344 -5.452 1.086 1.00 0.00 C ATOM 2870 CD LYS B 86 -9.773 -6.548 1.993 1.00 0.00 C ATOM 2871 CE LYS B 86 -9.275 -7.718 1.140 1.00 0.00 C ATOM 2872 NZ LYS B 86 -7.826 -7.446 0.926 1.00 0.00 N ATOM 0 H LYS B 86 -10.780 -3.152 2.022 1.00 0.00 H new ATOM 0 HA LYS B 86 -12.270 -3.991 -0.319 1.00 0.00 H new ATOM 0 HB2 LYS B 86 -11.982 -5.225 2.476 1.00 0.00 H new ATOM 0 HB3 LYS B 86 -12.407 -6.089 1.012 1.00 0.00 H new ATOM 0 HG2 LYS B 86 -10.216 -5.729 0.040 1.00 0.00 H new ATOM 0 HG3 LYS B 86 -9.800 -4.520 1.238 1.00 0.00 H new ATOM 0 HD2 LYS B 86 -8.955 -6.148 2.592 1.00 0.00 H new ATOM 0 HD3 LYS B 86 -10.538 -6.893 2.689 1.00 0.00 H new ATOM 0 HE2 LYS B 86 -9.428 -8.670 1.648 1.00 0.00 H new ATOM 0 HE3 LYS B 86 -9.811 -7.773 0.192 1.00 0.00 H new ATOM 0 HZ1 LYS B 86 -7.486 -7.997 0.112 1.00 0.00 H new ATOM 0 HZ2 LYS B 86 -7.687 -6.432 0.740 1.00 0.00 H new ATOM 0 HZ3 LYS B 86 -7.292 -7.719 1.776 1.00 0.00 H new ATOM 2886 N LYS B 87 -13.966 -2.986 2.239 1.00 0.00 N ATOM 2887 CA LYS B 87 -15.340 -2.654 2.665 1.00 0.00 C ATOM 2888 C LYS B 87 -15.785 -1.445 1.860 1.00 0.00 C ATOM 2889 O LYS B 87 -16.921 -1.348 1.417 1.00 0.00 O ATOM 2890 CB LYS B 87 -15.236 -2.346 4.163 1.00 0.00 C ATOM 2891 CG LYS B 87 -16.581 -1.833 4.684 1.00 0.00 C ATOM 2892 CD LYS B 87 -16.392 -1.211 6.071 1.00 0.00 C ATOM 2893 CE LYS B 87 -17.115 -2.060 7.120 1.00 0.00 C ATOM 2894 NZ LYS B 87 -16.050 -2.896 7.740 1.00 0.00 N ATOM 0 H LYS B 87 -13.227 -2.637 2.849 1.00 0.00 H new ATOM 0 HA LYS B 87 -16.067 -3.449 2.501 1.00 0.00 H new ATOM 0 HB2 LYS B 87 -14.943 -3.243 4.708 1.00 0.00 H new ATOM 0 HB3 LYS B 87 -14.460 -1.600 4.337 1.00 0.00 H new ATOM 0 HG2 LYS B 87 -16.991 -1.094 3.996 1.00 0.00 H new ATOM 0 HG3 LYS B 87 -17.298 -2.652 4.736 1.00 0.00 H new ATOM 0 HD2 LYS B 87 -15.330 -1.147 6.310 1.00 0.00 H new ATOM 0 HD3 LYS B 87 -16.783 -0.194 6.080 1.00 0.00 H new ATOM 0 HE2 LYS B 87 -17.608 -1.433 7.863 1.00 0.00 H new ATOM 0 HE3 LYS B 87 -17.887 -2.679 6.663 1.00 0.00 H new ATOM 0 HZ1 LYS B 87 -16.469 -3.506 8.471 1.00 0.00 H new ATOM 0 HZ2 LYS B 87 -15.603 -3.487 7.010 1.00 0.00 H new ATOM 0 HZ3 LYS B 87 -15.333 -2.280 8.173 1.00 0.00 H new ATOM 2908 N ALA B 88 -14.873 -0.550 1.592 1.00 0.00 N ATOM 2909 CA ALA B 88 -15.240 0.604 0.752 1.00 0.00 C ATOM 2910 C ALA B 88 -15.542 0.050 -0.632 1.00 0.00 C ATOM 2911 O ALA B 88 -16.459 0.473 -1.316 1.00 0.00 O ATOM 2912 CB ALA B 88 -14.002 1.501 0.724 1.00 0.00 C ATOM 0 H ALA B 88 -13.906 -0.574 1.917 1.00 0.00 H new ATOM 0 HA ALA B 88 -16.102 1.166 1.111 1.00 0.00 H new ATOM 0 HB1 ALA B 88 -14.205 2.382 0.115 1.00 0.00 H new ATOM 0 HB2 ALA B 88 -13.754 1.811 1.739 1.00 0.00 H new ATOM 0 HB3 ALA B 88 -13.163 0.950 0.298 1.00 0.00 H new ATOM 2918 N ALA B 89 -14.775 -0.929 -1.036 1.00 0.00 N ATOM 2919 CA ALA B 89 -15.001 -1.542 -2.365 1.00 0.00 C ATOM 2920 C ALA B 89 -16.393 -2.148 -2.390 1.00 0.00 C ATOM 2921 O ALA B 89 -17.086 -2.090 -3.386 1.00 0.00 O ATOM 2922 CB ALA B 89 -13.916 -2.601 -2.526 1.00 0.00 C ATOM 0 H ALA B 89 -14.004 -1.326 -0.499 1.00 0.00 H new ATOM 0 HA ALA B 89 -14.946 -0.824 -3.184 1.00 0.00 H new ATOM 0 HB1 ALA B 89 -14.028 -3.093 -3.492 1.00 0.00 H new ATOM 0 HB2 ALA B 89 -12.935 -2.128 -2.471 1.00 0.00 H new ATOM 0 HB3 ALA B 89 -14.008 -3.340 -1.730 1.00 0.00 H new ATOM 2928 N GLU B 90 -16.837 -2.678 -1.280 1.00 0.00 N ATOM 2929 CA GLU B 90 -18.222 -3.218 -1.237 1.00 0.00 C ATOM 2930 C GLU B 90 -19.150 -2.072 -1.650 1.00 0.00 C ATOM 2931 O GLU B 90 -20.165 -2.265 -2.290 1.00 0.00 O ATOM 2932 CB GLU B 90 -18.446 -3.658 0.223 1.00 0.00 C ATOM 2933 CG GLU B 90 -19.412 -2.704 0.937 1.00 0.00 C ATOM 2934 CD GLU B 90 -19.520 -3.097 2.412 1.00 0.00 C ATOM 2935 OE1 GLU B 90 -19.518 -4.285 2.689 1.00 0.00 O ATOM 2936 OE2 GLU B 90 -19.603 -2.205 3.239 1.00 0.00 O ATOM 0 H GLU B 90 -16.306 -2.759 -0.413 1.00 0.00 H new ATOM 0 HA GLU B 90 -18.406 -4.063 -1.901 1.00 0.00 H new ATOM 0 HB2 GLU B 90 -18.846 -4.672 0.245 1.00 0.00 H new ATOM 0 HB3 GLU B 90 -17.493 -3.680 0.751 1.00 0.00 H new ATOM 0 HG2 GLU B 90 -19.058 -1.677 0.848 1.00 0.00 H new ATOM 0 HG3 GLU B 90 -20.394 -2.744 0.466 1.00 0.00 H new ATOM 2943 N GLY B 91 -18.765 -0.868 -1.302 1.00 0.00 N ATOM 2944 CA GLY B 91 -19.572 0.324 -1.685 1.00 0.00 C ATOM 2945 C GLY B 91 -19.539 0.492 -3.212 1.00 0.00 C ATOM 2946 O GLY B 91 -20.523 0.868 -3.818 1.00 0.00 O ATOM 0 H GLY B 91 -17.922 -0.663 -0.766 1.00 0.00 H new ATOM 0 HA2 GLY B 91 -20.600 0.206 -1.343 1.00 0.00 H new ATOM 0 HA3 GLY B 91 -19.175 1.216 -1.201 1.00 0.00 H new ATOM 2950 N LEU B 92 -18.418 0.211 -3.848 1.00 0.00 N ATOM 2951 CA LEU B 92 -18.345 0.351 -5.335 1.00 0.00 C ATOM 2952 C LEU B 92 -19.195 -0.727 -6.023 1.00 0.00 C ATOM 2953 O LEU B 92 -19.138 -0.891 -7.226 1.00 0.00 O ATOM 2954 CB LEU B 92 -16.851 0.165 -5.670 1.00 0.00 C ATOM 2955 CG LEU B 92 -16.542 -1.301 -6.017 1.00 0.00 C ATOM 2956 CD1 LEU B 92 -16.609 -1.499 -7.535 1.00 0.00 C ATOM 2957 CD2 LEU B 92 -15.137 -1.662 -5.523 1.00 0.00 C ATOM 0 H LEU B 92 -17.559 -0.107 -3.400 1.00 0.00 H new ATOM 0 HA LEU B 92 -18.729 1.311 -5.680 1.00 0.00 H new ATOM 0 HB2 LEU B 92 -16.580 0.806 -6.509 1.00 0.00 H new ATOM 0 HB3 LEU B 92 -16.243 0.477 -4.821 1.00 0.00 H new ATOM 0 HG LEU B 92 -17.277 -1.944 -5.533 1.00 0.00 H new ATOM 0 HD11 LEU B 92 -16.389 -2.539 -7.776 1.00 0.00 H new ATOM 0 HD12 LEU B 92 -17.608 -1.247 -7.891 1.00 0.00 H new ATOM 0 HD13 LEU B 92 -15.877 -0.852 -8.019 1.00 0.00 H new ATOM 0 HD21 LEU B 92 -14.920 -2.701 -5.770 1.00 0.00 H new ATOM 0 HD22 LEU B 92 -14.404 -1.014 -6.005 1.00 0.00 H new ATOM 0 HD23 LEU B 92 -15.086 -1.528 -4.443 1.00 0.00 H new ATOM 2969 N LYS B 93 -19.949 -1.491 -5.269 1.00 0.00 N ATOM 2970 CA LYS B 93 -20.759 -2.588 -5.873 1.00 0.00 C ATOM 2971 C LYS B 93 -19.799 -3.705 -6.274 1.00 0.00 C ATOM 2972 O LYS B 93 -19.890 -4.272 -7.345 1.00 0.00 O ATOM 2973 CB LYS B 93 -21.464 -1.993 -7.098 1.00 0.00 C ATOM 2974 CG LYS B 93 -22.885 -2.554 -7.193 1.00 0.00 C ATOM 2975 CD LYS B 93 -23.759 -1.920 -6.108 1.00 0.00 C ATOM 2976 CE LYS B 93 -25.155 -2.547 -6.145 1.00 0.00 C ATOM 2977 NZ LYS B 93 -25.828 -1.917 -7.315 1.00 0.00 N ATOM 0 H LYS B 93 -20.036 -1.399 -4.257 1.00 0.00 H new ATOM 0 HA LYS B 93 -21.502 -2.997 -5.188 1.00 0.00 H new ATOM 0 HB2 LYS B 93 -21.495 -0.906 -7.020 1.00 0.00 H new ATOM 0 HB3 LYS B 93 -20.906 -2.232 -8.003 1.00 0.00 H new ATOM 0 HG2 LYS B 93 -23.303 -2.348 -8.178 1.00 0.00 H new ATOM 0 HG3 LYS B 93 -22.868 -3.637 -7.074 1.00 0.00 H new ATOM 0 HD2 LYS B 93 -23.307 -2.071 -5.128 1.00 0.00 H new ATOM 0 HD3 LYS B 93 -23.828 -0.844 -6.265 1.00 0.00 H new ATOM 0 HE2 LYS B 93 -25.099 -3.630 -6.258 1.00 0.00 H new ATOM 0 HE3 LYS B 93 -25.701 -2.350 -5.222 1.00 0.00 H new ATOM 0 HZ1 LYS B 93 -26.651 -1.371 -6.990 1.00 0.00 H new ATOM 0 HZ2 LYS B 93 -25.161 -1.282 -7.799 1.00 0.00 H new ATOM 0 HZ3 LYS B 93 -26.142 -2.657 -7.975 1.00 0.00 H new ATOM 2991 N TYR B 94 -18.865 -4.004 -5.404 1.00 0.00 N ATOM 2992 CA TYR B 94 -17.858 -5.072 -5.683 1.00 0.00 C ATOM 2993 C TYR B 94 -18.530 -6.281 -6.350 1.00 0.00 C ATOM 2994 O TYR B 94 -17.942 -6.946 -7.181 1.00 0.00 O ATOM 2995 CB TYR B 94 -17.288 -5.426 -4.302 1.00 0.00 C ATOM 2996 CG TYR B 94 -17.042 -6.908 -4.207 1.00 0.00 C ATOM 2997 CD1 TYR B 94 -16.065 -7.511 -5.006 1.00 0.00 C ATOM 2998 CD2 TYR B 94 -17.806 -7.676 -3.333 1.00 0.00 C ATOM 2999 CE1 TYR B 94 -15.853 -8.898 -4.924 1.00 0.00 C ATOM 3000 CE2 TYR B 94 -17.601 -9.057 -3.256 1.00 0.00 C ATOM 3001 CZ TYR B 94 -16.624 -9.667 -4.049 1.00 0.00 C ATOM 3002 OH TYR B 94 -16.425 -11.031 -3.972 1.00 0.00 O ATOM 0 H TYR B 94 -18.758 -3.545 -4.499 1.00 0.00 H new ATOM 0 HA TYR B 94 -17.076 -4.752 -6.372 1.00 0.00 H new ATOM 0 HB2 TYR B 94 -16.357 -4.884 -4.134 1.00 0.00 H new ATOM 0 HB3 TYR B 94 -17.983 -5.114 -3.522 1.00 0.00 H new ATOM 0 HD1 TYR B 94 -15.475 -6.912 -5.684 1.00 0.00 H new ATOM 0 HD2 TYR B 94 -18.556 -7.206 -2.715 1.00 0.00 H new ATOM 0 HE1 TYR B 94 -15.097 -9.368 -5.535 1.00 0.00 H new ATOM 0 HE2 TYR B 94 -18.198 -9.654 -2.583 1.00 0.00 H new ATOM 0 HH TYR B 94 -17.042 -11.415 -3.315 1.00 0.00 H new ATOM 3012 N GLU B 95 -19.759 -6.562 -6.004 1.00 0.00 N ATOM 3013 CA GLU B 95 -20.460 -7.719 -6.637 1.00 0.00 C ATOM 3014 C GLU B 95 -20.569 -7.482 -8.142 1.00 0.00 C ATOM 3015 O GLU B 95 -20.308 -8.364 -8.938 1.00 0.00 O ATOM 3016 CB GLU B 95 -21.843 -7.787 -5.986 1.00 0.00 C ATOM 3017 CG GLU B 95 -22.602 -6.478 -6.219 1.00 0.00 C ATOM 3018 CD GLU B 95 -23.748 -6.368 -5.211 1.00 0.00 C ATOM 3019 OE1 GLU B 95 -23.528 -6.695 -4.056 1.00 0.00 O ATOM 3020 OE2 GLU B 95 -24.825 -5.960 -5.612 1.00 0.00 O ATOM 0 H GLU B 95 -20.305 -6.045 -5.315 1.00 0.00 H new ATOM 0 HA GLU B 95 -19.924 -8.657 -6.493 1.00 0.00 H new ATOM 0 HB2 GLU B 95 -22.408 -8.622 -6.401 1.00 0.00 H new ATOM 0 HB3 GLU B 95 -21.741 -7.971 -4.917 1.00 0.00 H new ATOM 0 HG2 GLU B 95 -21.926 -5.629 -6.112 1.00 0.00 H new ATOM 0 HG3 GLU B 95 -22.993 -6.448 -7.236 1.00 0.00 H new ATOM 3027 N ASP B 96 -20.910 -6.285 -8.541 1.00 0.00 N ATOM 3028 CA ASP B 96 -20.983 -5.984 -9.999 1.00 0.00 C ATOM 3029 C ASP B 96 -19.601 -6.243 -10.591 1.00 0.00 C ATOM 3030 O ASP B 96 -19.453 -6.755 -11.682 1.00 0.00 O ATOM 3031 CB ASP B 96 -21.344 -4.500 -10.096 1.00 0.00 C ATOM 3032 CG ASP B 96 -22.778 -4.353 -10.610 1.00 0.00 C ATOM 3033 OD1 ASP B 96 -23.636 -5.070 -10.125 1.00 0.00 O ATOM 3034 OD2 ASP B 96 -22.992 -3.525 -11.482 1.00 0.00 O ATOM 0 H ASP B 96 -21.140 -5.507 -7.923 1.00 0.00 H new ATOM 0 HA ASP B 96 -21.713 -6.591 -10.534 1.00 0.00 H new ATOM 0 HB2 ASP B 96 -21.247 -4.027 -9.119 1.00 0.00 H new ATOM 0 HB3 ASP B 96 -20.652 -3.990 -10.767 1.00 0.00 H new ATOM 3039 N PHE B 97 -18.589 -5.921 -9.833 1.00 0.00 N ATOM 3040 CA PHE B 97 -17.192 -6.168 -10.282 1.00 0.00 C ATOM 3041 C PHE B 97 -16.988 -7.680 -10.432 1.00 0.00 C ATOM 3042 O PHE B 97 -16.193 -8.141 -11.227 1.00 0.00 O ATOM 3043 CB PHE B 97 -16.319 -5.618 -9.148 1.00 0.00 C ATOM 3044 CG PHE B 97 -15.273 -4.682 -9.700 1.00 0.00 C ATOM 3045 CD1 PHE B 97 -15.656 -3.544 -10.419 1.00 0.00 C ATOM 3046 CD2 PHE B 97 -13.918 -4.948 -9.478 1.00 0.00 C ATOM 3047 CE1 PHE B 97 -14.681 -2.674 -10.919 1.00 0.00 C ATOM 3048 CE2 PHE B 97 -12.943 -4.078 -9.976 1.00 0.00 C ATOM 3049 CZ PHE B 97 -13.323 -2.940 -10.698 1.00 0.00 C ATOM 0 H PHE B 97 -18.673 -5.492 -8.911 1.00 0.00 H new ATOM 0 HA PHE B 97 -16.953 -5.701 -11.237 1.00 0.00 H new ATOM 0 HB2 PHE B 97 -16.941 -5.093 -8.423 1.00 0.00 H new ATOM 0 HB3 PHE B 97 -15.838 -6.440 -8.619 1.00 0.00 H new ATOM 0 HD1 PHE B 97 -16.703 -3.338 -10.588 1.00 0.00 H new ATOM 0 HD2 PHE B 97 -13.624 -5.826 -8.922 1.00 0.00 H new ATOM 0 HE1 PHE B 97 -14.975 -1.797 -11.476 1.00 0.00 H new ATOM 0 HE2 PHE B 97 -11.897 -4.284 -9.804 1.00 0.00 H new ATOM 0 HZ PHE B 97 -12.571 -2.268 -11.084 1.00 0.00 H new