USER MOD reduce.3.24.130724 H: found=0, std=0, add=1064, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1058 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 5 HIS :FLIP no HE2:sc= -1.8! C(o=-7.9!,f=-5.2!) USER MOD Set 1.2: A 75 ASN : amide:sc= -3.35 K(o=-5.2,f=-8.4!) USER MOD Set 2.1: A 35 TYR OH : rot 112:sc= -1.52 USER MOD Set 2.2: A 38 HIS : no HE2:sc= -2.26 K(o=-3.8,f=-4.3) USER MOD Single : A 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 MET CE :methyl 160:sc= 0 (180deg=-0.287) USER MOD Single : A 3 THR OG1 : rot -23:sc= -2.46! USER MOD Single : A 4 TYR OH : rot -145:sc= -2.32 USER MOD Single : A 10 SER OG : rot -140:sc= -0.223 USER MOD Single : A 13 GLN : amide:sc= -0.408 K(o=-0.41,f=-2.8!) USER MOD Single : A 14 GLN : amide:sc= -0.289 K(o=-0.29,f=-5.8!) USER MOD Single : A 15 MET CE :methyl 139:sc= -5.4! (180deg=-7.31!) USER MOD Single : A 17 SER OG : rot 62:sc= 1.08 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 GLN : amide:sc= -0.406 X(o=-0.41,f=-0.41) USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 MET CE :methyl 166:sc= -0.568 (180deg=-0.992) USER MOD Single : A 54 LYS NZ :NH3+ 151:sc= 0.41 (180deg=0.111) USER MOD Single : A 55 GLN : amide:sc= -2.38! C(o=-2.4!,f=-2.5!) USER MOD Single : A 56 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 58 HIS :FLIP no HD1:sc= -2.34 F(o=-4.1!,f=-2.3) USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 72 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 77 THR OG1 : rot 180:sc= 0 USER MOD Single : A 82 THR OG1 : rot 150:sc= -2.15 USER MOD Single : A 87 GLN : amide:sc= -0.0331 K(o=-0.033,f=-1.9!) USER MOD Single : A 95 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 HIS : no HD1:sc= -0.404 X(o=-0.4,f=-0.23) USER MOD Single : A 106 SER OG : rot 43:sc= 1.01 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 130:sc= -0.076 USER MOD Single : A 109 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 114 TYR OH : rot 180:sc= 0 USER MOD Single : A 116 GLN : amide:sc= -0.073 K(o=-0.073,f=-0.58) USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 GLN : amide:sc= -2.97! C(o=-3!,f=-5.1!) USER MOD Single : A 134 THR OG1 : rot -43:sc= 1.05 USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 LYS NZ :NH3+ -153:sc= -0.0852 (180deg=-0.411) USER MOD Single : A 138 MET CE :methyl 156:sc= -0.181 (180deg=-1.11) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -25.082 -1.203 7.527 1.00 0.00 N ATOM 2 CA ALA A 1 -24.779 0.230 7.799 1.00 0.00 C ATOM 3 C ALA A 1 -23.265 0.415 7.923 1.00 0.00 C ATOM 4 O ALA A 1 -22.634 1.027 7.083 1.00 0.00 O ATOM 5 CB ALA A 1 -25.453 0.655 9.104 1.00 0.00 C ATOM 0 H1 ALA A 1 -26.111 -1.330 7.442 1.00 0.00 H new ATOM 0 H2 ALA A 1 -24.623 -1.492 6.640 1.00 0.00 H new ATOM 0 H3 ALA A 1 -24.724 -1.788 8.309 1.00 0.00 H new ATOM 0 HA ALA A 1 -25.155 0.843 6.980 1.00 0.00 H new ATOM 0 HB1 ALA A 1 -25.231 1.703 9.303 1.00 0.00 H new ATOM 0 HB2 ALA A 1 -26.531 0.522 9.017 1.00 0.00 H new ATOM 0 HB3 ALA A 1 -25.077 0.043 9.924 1.00 0.00 H new ATOM 13 N MET A 2 -22.678 -0.110 8.962 1.00 0.00 N ATOM 14 CA MET A 2 -21.206 0.033 9.140 1.00 0.00 C ATOM 15 C MET A 2 -20.494 -0.389 7.855 1.00 0.00 C ATOM 16 O MET A 2 -21.120 -0.830 6.916 1.00 0.00 O ATOM 17 CB MET A 2 -20.743 -0.861 10.291 1.00 0.00 C ATOM 18 CG MET A 2 -20.997 -2.328 9.933 1.00 0.00 C ATOM 19 SD MET A 2 -19.443 -3.251 10.037 1.00 0.00 S ATOM 20 CE MET A 2 -19.235 -3.142 11.830 1.00 0.00 C ATOM 0 H MET A 2 -23.155 -0.633 9.697 1.00 0.00 H new ATOM 0 HA MET A 2 -20.967 1.072 9.365 1.00 0.00 H new ATOM 0 HB2 MET A 2 -19.682 -0.702 10.485 1.00 0.00 H new ATOM 0 HB3 MET A 2 -21.277 -0.601 11.205 1.00 0.00 H new ATOM 0 HG2 MET A 2 -21.734 -2.757 10.612 1.00 0.00 H new ATOM 0 HG3 MET A 2 -21.410 -2.402 8.927 1.00 0.00 H new ATOM 0 HE1 MET A 2 -18.552 -3.923 12.165 1.00 0.00 H new ATOM 0 HE2 MET A 2 -18.826 -2.166 12.090 1.00 0.00 H new ATOM 0 HE3 MET A 2 -20.201 -3.272 12.317 1.00 0.00 H new ATOM 30 N THR A 3 -19.190 -0.256 7.822 1.00 0.00 N ATOM 31 CA THR A 3 -18.392 -0.646 6.614 1.00 0.00 C ATOM 32 C THR A 3 -18.953 0.007 5.350 1.00 0.00 C ATOM 33 O THR A 3 -20.129 -0.042 5.056 1.00 0.00 O ATOM 34 CB THR A 3 -18.370 -2.181 6.466 1.00 0.00 C ATOM 35 OG1 THR A 3 -17.352 -2.549 5.548 1.00 0.00 O ATOM 36 CG2 THR A 3 -19.719 -2.707 5.963 1.00 0.00 C ATOM 0 H THR A 3 -18.635 0.113 8.594 1.00 0.00 H new ATOM 0 HA THR A 3 -17.371 -0.290 6.749 1.00 0.00 H new ATOM 0 HB THR A 3 -18.173 -2.618 7.445 1.00 0.00 H new ATOM 0 HG1 THR A 3 -17.153 -1.791 4.960 1.00 0.00 H new ATOM 0 HG21 THR A 3 -19.674 -3.792 5.868 1.00 0.00 H new ATOM 0 HG22 THR A 3 -20.502 -2.437 6.672 1.00 0.00 H new ATOM 0 HG23 THR A 3 -19.942 -2.267 4.991 1.00 0.00 H new ATOM 44 N TYR A 4 -18.098 0.623 4.592 1.00 0.00 N ATOM 45 CA TYR A 4 -18.546 1.273 3.339 1.00 0.00 C ATOM 46 C TYR A 4 -17.980 0.481 2.164 1.00 0.00 C ATOM 47 O TYR A 4 -17.460 -0.604 2.332 1.00 0.00 O ATOM 48 CB TYR A 4 -18.022 2.707 3.295 1.00 0.00 C ATOM 49 CG TYR A 4 -16.524 2.706 3.496 1.00 0.00 C ATOM 50 CD1 TYR A 4 -15.682 2.207 2.494 1.00 0.00 C ATOM 51 CD2 TYR A 4 -15.975 3.212 4.682 1.00 0.00 C ATOM 52 CE1 TYR A 4 -14.298 2.215 2.674 1.00 0.00 C ATOM 53 CE2 TYR A 4 -14.587 3.220 4.863 1.00 0.00 C ATOM 54 CZ TYR A 4 -13.747 2.723 3.857 1.00 0.00 C ATOM 55 OH TYR A 4 -12.378 2.730 4.034 1.00 0.00 O ATOM 0 H TYR A 4 -17.100 0.704 4.789 1.00 0.00 H new ATOM 0 HA TYR A 4 -19.635 1.293 3.288 1.00 0.00 H new ATOM 0 HB2 TYR A 4 -18.270 3.166 2.338 1.00 0.00 H new ATOM 0 HB3 TYR A 4 -18.503 3.304 4.070 1.00 0.00 H new ATOM 0 HD1 TYR A 4 -16.105 1.815 1.580 1.00 0.00 H new ATOM 0 HD2 TYR A 4 -16.623 3.596 5.456 1.00 0.00 H new ATOM 0 HE1 TYR A 4 -13.651 1.829 1.900 1.00 0.00 H new ATOM 0 HE2 TYR A 4 -14.164 3.609 5.777 1.00 0.00 H new ATOM 0 HH TYR A 4 -12.169 2.562 4.977 1.00 0.00 H new ATOM 65 N HIS A 5 -18.061 1.011 0.982 1.00 0.00 N ATOM 66 CA HIS A 5 -17.510 0.283 -0.189 1.00 0.00 C ATOM 67 C HIS A 5 -16.281 1.035 -0.698 1.00 0.00 C ATOM 68 O HIS A 5 -16.291 2.243 -0.809 1.00 0.00 O ATOM 69 CB HIS A 5 -18.586 0.192 -1.291 1.00 0.00 C ATOM 70 CG HIS A 5 -17.944 0.264 -2.653 1.00 0.00 C ATOM 71 ND1 HIS A 5 -17.249 1.268 -3.271 1.00 0.00 N flip ATOM 72 CD2 HIS A 5 -17.942 -0.799 -3.540 1.00 0.00 C flip ATOM 73 CE1 HIS A 5 -16.817 0.845 -4.521 1.00 0.00 C flip ATOM 74 NE2 HIS A 5 -17.260 -0.409 -4.634 1.00 0.00 N flip ATOM 0 H HIS A 5 -18.484 1.916 0.775 1.00 0.00 H new ATOM 0 HA HIS A 5 -17.220 -0.729 0.095 1.00 0.00 H new ATOM 0 HB2 HIS A 5 -19.141 -0.741 -1.191 1.00 0.00 H new ATOM 0 HB3 HIS A 5 -19.304 1.004 -1.176 1.00 0.00 H new ATOM 0 HD1 HIS A 5 -17.074 2.190 -2.872 1.00 0.00 H new ATOM 0 HD2 HIS A 5 -18.402 -1.763 -3.384 1.00 0.00 H new ATOM 0 HE1 HIS A 5 -16.246 1.408 -5.245 1.00 0.00 H new ATOM 82 N LEU A 6 -15.236 0.334 -1.040 1.00 0.00 N ATOM 83 CA LEU A 6 -14.045 1.037 -1.575 1.00 0.00 C ATOM 84 C LEU A 6 -13.676 0.427 -2.933 1.00 0.00 C ATOM 85 O LEU A 6 -14.101 -0.663 -3.270 1.00 0.00 O ATOM 86 CB LEU A 6 -12.870 0.952 -0.583 1.00 0.00 C ATOM 87 CG LEU A 6 -12.012 -0.268 -0.883 1.00 0.00 C ATOM 88 CD1 LEU A 6 -11.098 0.029 -2.071 1.00 0.00 C ATOM 89 CD2 LEU A 6 -11.153 -0.612 0.326 1.00 0.00 C ATOM 0 H LEU A 6 -15.158 -0.681 -0.973 1.00 0.00 H new ATOM 0 HA LEU A 6 -14.273 2.094 -1.711 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -12.264 1.856 -0.648 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -13.250 0.896 0.437 1.00 0.00 H new ATOM 0 HG LEU A 6 -12.665 -1.109 -1.116 1.00 0.00 H new ATOM 0 HD11 LEU A 6 -10.484 -0.846 -2.285 1.00 0.00 H new ATOM 0 HD12 LEU A 6 -11.704 0.270 -2.945 1.00 0.00 H new ATOM 0 HD13 LEU A 6 -10.454 0.875 -1.832 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -10.542 -1.487 0.102 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -10.505 0.232 0.564 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -11.796 -0.828 1.180 1.00 0.00 H new ATOM 101 N ASP A 7 -12.889 1.117 -3.713 1.00 0.00 N ATOM 102 CA ASP A 7 -12.495 0.572 -5.042 1.00 0.00 C ATOM 103 C ASP A 7 -11.116 1.110 -5.433 1.00 0.00 C ATOM 104 O ASP A 7 -10.982 2.235 -5.876 1.00 0.00 O ATOM 105 CB ASP A 7 -13.525 0.995 -6.091 1.00 0.00 C ATOM 106 CG ASP A 7 -14.135 -0.250 -6.738 1.00 0.00 C ATOM 107 OD1 ASP A 7 -14.857 -0.955 -6.052 1.00 0.00 O ATOM 108 OD2 ASP A 7 -13.870 -0.477 -7.906 1.00 0.00 O ATOM 0 H ASP A 7 -12.503 2.034 -3.487 1.00 0.00 H new ATOM 0 HA ASP A 7 -12.454 -0.516 -4.989 1.00 0.00 H new ATOM 0 HB2 ASP A 7 -14.306 1.597 -5.627 1.00 0.00 H new ATOM 0 HB3 ASP A 7 -13.052 1.618 -6.850 1.00 0.00 H new ATOM 113 N VAL A 8 -10.091 0.318 -5.273 1.00 0.00 N ATOM 114 CA VAL A 8 -8.724 0.783 -5.637 1.00 0.00 C ATOM 115 C VAL A 8 -8.343 0.226 -7.011 1.00 0.00 C ATOM 116 O VAL A 8 -8.377 -0.967 -7.239 1.00 0.00 O ATOM 117 CB VAL A 8 -7.728 0.284 -4.589 1.00 0.00 C ATOM 118 CG1 VAL A 8 -7.824 -1.238 -4.478 1.00 0.00 C ATOM 119 CG2 VAL A 8 -6.311 0.673 -5.008 1.00 0.00 C ATOM 0 H VAL A 8 -10.142 -0.632 -4.905 1.00 0.00 H new ATOM 0 HA VAL A 8 -8.705 1.872 -5.672 1.00 0.00 H new ATOM 0 HB VAL A 8 -7.960 0.735 -3.624 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -7.114 -1.594 -3.731 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -8.835 -1.518 -4.181 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -7.592 -1.689 -5.443 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -5.600 0.318 -4.262 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -6.080 0.221 -5.973 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -6.240 1.758 -5.089 1.00 0.00 H new ATOM 129 N VAL A 9 -7.982 1.080 -7.932 1.00 0.00 N ATOM 130 CA VAL A 9 -7.601 0.595 -9.289 1.00 0.00 C ATOM 131 C VAL A 9 -6.352 1.340 -9.767 1.00 0.00 C ATOM 132 O VAL A 9 -6.147 2.496 -9.455 1.00 0.00 O ATOM 133 CB VAL A 9 -8.754 0.851 -10.264 1.00 0.00 C ATOM 134 CG1 VAL A 9 -8.625 -0.084 -11.468 1.00 0.00 C ATOM 135 CG2 VAL A 9 -10.085 0.589 -9.557 1.00 0.00 C ATOM 0 H VAL A 9 -7.935 2.091 -7.803 1.00 0.00 H new ATOM 0 HA VAL A 9 -7.391 -0.474 -9.247 1.00 0.00 H new ATOM 0 HB VAL A 9 -8.718 1.886 -10.604 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -9.446 0.099 -12.161 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -7.677 0.101 -11.972 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -8.660 -1.120 -11.130 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -10.907 0.771 -10.250 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -10.119 -0.446 -9.217 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -10.179 1.255 -8.700 1.00 0.00 H new ATOM 145 N SER A 10 -5.511 0.683 -10.521 1.00 0.00 N ATOM 146 CA SER A 10 -4.274 1.350 -11.014 1.00 0.00 C ATOM 147 C SER A 10 -4.226 1.280 -12.544 1.00 0.00 C ATOM 148 O SER A 10 -5.243 1.343 -13.207 1.00 0.00 O ATOM 149 CB SER A 10 -3.051 0.645 -10.426 1.00 0.00 C ATOM 150 OG SER A 10 -3.352 0.205 -9.109 1.00 0.00 O ATOM 0 H SER A 10 -5.628 -0.286 -10.816 1.00 0.00 H new ATOM 0 HA SER A 10 -4.275 2.395 -10.704 1.00 0.00 H new ATOM 0 HB2 SER A 10 -2.771 -0.203 -11.050 1.00 0.00 H new ATOM 0 HB3 SER A 10 -2.198 1.324 -10.409 1.00 0.00 H new ATOM 0 HG SER A 10 -2.575 0.351 -8.530 1.00 0.00 H new ATOM 156 N ALA A 11 -3.052 1.159 -13.107 1.00 0.00 N ATOM 157 CA ALA A 11 -2.929 1.092 -14.594 1.00 0.00 C ATOM 158 C ALA A 11 -4.058 0.236 -15.176 1.00 0.00 C ATOM 159 O ALA A 11 -5.009 0.746 -15.734 1.00 0.00 O ATOM 160 CB ALA A 11 -1.579 0.472 -14.964 1.00 0.00 C ATOM 0 H ALA A 11 -2.169 1.103 -12.599 1.00 0.00 H new ATOM 0 HA ALA A 11 -2.997 2.100 -15.004 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -1.487 0.422 -16.049 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -0.774 1.085 -14.559 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -1.514 -0.533 -14.548 1.00 0.00 H new ATOM 166 N GLU A 12 -3.963 -1.059 -15.051 1.00 0.00 N ATOM 167 CA GLU A 12 -5.032 -1.940 -15.600 1.00 0.00 C ATOM 168 C GLU A 12 -5.072 -3.248 -14.809 1.00 0.00 C ATOM 169 O GLU A 12 -4.792 -4.308 -15.330 1.00 0.00 O ATOM 170 CB GLU A 12 -4.742 -2.243 -17.072 1.00 0.00 C ATOM 171 CG GLU A 12 -5.187 -1.060 -17.934 1.00 0.00 C ATOM 172 CD GLU A 12 -5.098 -1.443 -19.412 1.00 0.00 C ATOM 173 OE1 GLU A 12 -5.463 -2.560 -19.738 1.00 0.00 O ATOM 174 OE2 GLU A 12 -4.665 -0.612 -20.194 1.00 0.00 O ATOM 0 H GLU A 12 -3.192 -1.545 -14.593 1.00 0.00 H new ATOM 0 HA GLU A 12 -5.994 -1.435 -15.517 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -3.677 -2.429 -17.213 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -5.267 -3.148 -17.378 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -6.209 -0.777 -17.682 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -4.557 -0.193 -17.734 1.00 0.00 H new ATOM 181 N GLN A 13 -5.419 -3.181 -13.553 1.00 0.00 N ATOM 182 CA GLN A 13 -5.477 -4.420 -12.728 1.00 0.00 C ATOM 183 C GLN A 13 -6.433 -4.204 -11.554 1.00 0.00 C ATOM 184 O GLN A 13 -6.445 -3.158 -10.936 1.00 0.00 O ATOM 185 CB GLN A 13 -4.080 -4.744 -12.194 1.00 0.00 C ATOM 186 CG GLN A 13 -4.059 -6.177 -11.658 1.00 0.00 C ATOM 187 CD GLN A 13 -3.090 -7.019 -12.490 1.00 0.00 C ATOM 188 OE1 GLN A 13 -2.228 -6.488 -13.163 1.00 0.00 O ATOM 189 NE2 GLN A 13 -3.196 -8.319 -12.474 1.00 0.00 N ATOM 0 H GLN A 13 -5.665 -2.321 -13.062 1.00 0.00 H new ATOM 0 HA GLN A 13 -5.833 -5.249 -13.341 1.00 0.00 H new ATOM 0 HB2 GLN A 13 -3.340 -4.630 -12.987 1.00 0.00 H new ATOM 0 HB3 GLN A 13 -3.810 -4.044 -11.403 1.00 0.00 H new ATOM 0 HG2 GLN A 13 -3.754 -6.181 -10.611 1.00 0.00 H new ATOM 0 HG3 GLN A 13 -5.060 -6.607 -11.700 1.00 0.00 H new ATOM 0 HE21 GLN A 13 -3.919 -8.765 -11.909 1.00 0.00 H new ATOM 0 HE22 GLN A 13 -2.556 -8.890 -13.026 1.00 0.00 H new ATOM 198 N GLN A 14 -7.235 -5.184 -11.241 1.00 0.00 N ATOM 199 CA GLN A 14 -8.189 -5.031 -10.107 1.00 0.00 C ATOM 200 C GLN A 14 -7.545 -5.557 -8.823 1.00 0.00 C ATOM 201 O GLN A 14 -6.894 -6.582 -8.817 1.00 0.00 O ATOM 202 CB GLN A 14 -9.462 -5.826 -10.403 1.00 0.00 C ATOM 203 CG GLN A 14 -10.270 -5.111 -11.488 1.00 0.00 C ATOM 204 CD GLN A 14 -10.065 -5.820 -12.828 1.00 0.00 C ATOM 205 OE1 GLN A 14 -8.946 -6.074 -13.229 1.00 0.00 O ATOM 206 NE2 GLN A 14 -11.105 -6.152 -13.543 1.00 0.00 N ATOM 0 H GLN A 14 -7.271 -6.083 -11.721 1.00 0.00 H new ATOM 0 HA GLN A 14 -8.439 -3.978 -9.981 1.00 0.00 H new ATOM 0 HB2 GLN A 14 -9.206 -6.834 -10.730 1.00 0.00 H new ATOM 0 HB3 GLN A 14 -10.059 -5.927 -9.497 1.00 0.00 H new ATOM 0 HG2 GLN A 14 -11.328 -5.107 -11.225 1.00 0.00 H new ATOM 0 HG3 GLN A 14 -9.956 -4.070 -11.564 1.00 0.00 H new ATOM 0 HE21 GLN A 14 -12.044 -5.939 -13.207 1.00 0.00 H new ATOM 0 HE22 GLN A 14 -10.979 -6.625 -14.438 1.00 0.00 H new ATOM 215 N MET A 15 -7.725 -4.862 -7.733 1.00 0.00 N ATOM 216 CA MET A 15 -7.126 -5.321 -6.449 1.00 0.00 C ATOM 217 C MET A 15 -8.224 -5.442 -5.392 1.00 0.00 C ATOM 218 O MET A 15 -8.471 -6.506 -4.859 1.00 0.00 O ATOM 219 CB MET A 15 -6.077 -4.308 -5.982 1.00 0.00 C ATOM 220 CG MET A 15 -4.922 -4.272 -6.984 1.00 0.00 C ATOM 221 SD MET A 15 -3.457 -5.035 -6.242 1.00 0.00 S ATOM 222 CE MET A 15 -2.243 -3.848 -6.869 1.00 0.00 C ATOM 0 H MET A 15 -8.261 -3.996 -7.677 1.00 0.00 H new ATOM 0 HA MET A 15 -6.652 -6.291 -6.595 1.00 0.00 H new ATOM 0 HB2 MET A 15 -6.526 -3.319 -5.892 1.00 0.00 H new ATOM 0 HB3 MET A 15 -5.707 -4.581 -4.994 1.00 0.00 H new ATOM 0 HG2 MET A 15 -5.200 -4.802 -7.895 1.00 0.00 H new ATOM 0 HG3 MET A 15 -4.705 -3.242 -7.268 1.00 0.00 H new ATOM 0 HE1 MET A 15 -1.515 -3.625 -6.089 1.00 0.00 H new ATOM 0 HE2 MET A 15 -1.731 -4.273 -7.732 1.00 0.00 H new ATOM 0 HE3 MET A 15 -2.751 -2.930 -7.164 1.00 0.00 H new ATOM 232 N PHE A 16 -8.888 -4.360 -5.085 1.00 0.00 N ATOM 233 CA PHE A 16 -9.972 -4.415 -4.064 1.00 0.00 C ATOM 234 C PHE A 16 -11.225 -3.729 -4.613 1.00 0.00 C ATOM 235 O PHE A 16 -11.162 -2.646 -5.160 1.00 0.00 O ATOM 236 CB PHE A 16 -9.519 -3.696 -2.791 1.00 0.00 C ATOM 237 CG PHE A 16 -10.506 -3.971 -1.680 1.00 0.00 C ATOM 238 CD1 PHE A 16 -10.372 -5.115 -0.884 1.00 0.00 C ATOM 239 CD2 PHE A 16 -11.558 -3.082 -1.448 1.00 0.00 C ATOM 240 CE1 PHE A 16 -11.293 -5.365 0.142 1.00 0.00 C ATOM 241 CE2 PHE A 16 -12.477 -3.329 -0.429 1.00 0.00 C ATOM 242 CZ PHE A 16 -12.347 -4.471 0.369 1.00 0.00 C ATOM 0 H PHE A 16 -8.726 -3.441 -5.497 1.00 0.00 H new ATOM 0 HA PHE A 16 -10.195 -5.456 -3.833 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -8.525 -4.037 -2.502 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -9.448 -2.623 -2.972 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -9.559 -5.804 -1.061 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -11.660 -2.199 -2.061 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -11.190 -6.247 0.757 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -13.289 -2.639 -0.256 1.00 0.00 H new ATOM 0 HZ PHE A 16 -13.058 -4.663 1.159 1.00 0.00 H new ATOM 252 N SER A 17 -12.364 -4.349 -4.468 1.00 0.00 N ATOM 253 CA SER A 17 -13.620 -3.729 -4.977 1.00 0.00 C ATOM 254 C SER A 17 -14.821 -4.417 -4.328 1.00 0.00 C ATOM 255 O SER A 17 -15.260 -5.464 -4.761 1.00 0.00 O ATOM 256 CB SER A 17 -13.696 -3.895 -6.496 1.00 0.00 C ATOM 257 OG SER A 17 -13.943 -5.259 -6.809 1.00 0.00 O ATOM 0 H SER A 17 -12.479 -5.258 -4.019 1.00 0.00 H new ATOM 0 HA SER A 17 -13.628 -2.667 -4.730 1.00 0.00 H new ATOM 0 HB2 SER A 17 -14.489 -3.268 -6.902 1.00 0.00 H new ATOM 0 HB3 SER A 17 -12.764 -3.568 -6.956 1.00 0.00 H new ATOM 0 HG SER A 17 -14.805 -5.531 -6.429 1.00 0.00 H new ATOM 263 N GLY A 18 -15.356 -3.837 -3.288 1.00 0.00 N ATOM 264 CA GLY A 18 -16.529 -4.460 -2.611 1.00 0.00 C ATOM 265 C GLY A 18 -16.729 -3.815 -1.240 1.00 0.00 C ATOM 266 O GLY A 18 -16.397 -2.665 -1.032 1.00 0.00 O ATOM 0 H GLY A 18 -15.032 -2.961 -2.879 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -17.424 -4.331 -3.219 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -16.371 -5.533 -2.500 1.00 0.00 H new ATOM 270 N LEU A 19 -17.269 -4.543 -0.301 1.00 0.00 N ATOM 271 CA LEU A 19 -17.485 -3.966 1.052 1.00 0.00 C ATOM 272 C LEU A 19 -16.141 -3.774 1.737 1.00 0.00 C ATOM 273 O LEU A 19 -15.138 -4.316 1.315 1.00 0.00 O ATOM 274 CB LEU A 19 -18.380 -4.898 1.863 1.00 0.00 C ATOM 275 CG LEU A 19 -19.701 -5.090 1.113 1.00 0.00 C ATOM 276 CD1 LEU A 19 -20.761 -5.622 2.075 1.00 0.00 C ATOM 277 CD2 LEU A 19 -20.165 -3.744 0.532 1.00 0.00 C ATOM 0 H LEU A 19 -17.569 -5.511 -0.414 1.00 0.00 H new ATOM 0 HA LEU A 19 -17.977 -2.996 0.972 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -17.888 -5.859 2.012 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -18.565 -4.478 2.852 1.00 0.00 H new ATOM 0 HG LEU A 19 -19.555 -5.803 0.302 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -21.701 -5.759 1.541 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -20.434 -6.578 2.484 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -20.905 -4.910 2.887 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -21.105 -3.883 -0.001 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -20.309 -3.029 1.342 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -19.410 -3.365 -0.157 1.00 0.00 H new ATOM 289 N VAL A 20 -16.091 -2.966 2.757 1.00 0.00 N ATOM 290 CA VAL A 20 -14.783 -2.707 3.415 1.00 0.00 C ATOM 291 C VAL A 20 -14.993 -1.757 4.603 1.00 0.00 C ATOM 292 O VAL A 20 -15.926 -0.984 4.626 1.00 0.00 O ATOM 293 CB VAL A 20 -13.837 -2.087 2.357 1.00 0.00 C ATOM 294 CG1 VAL A 20 -14.652 -1.479 1.210 1.00 0.00 C ATOM 295 CG2 VAL A 20 -12.983 -0.981 2.965 1.00 0.00 C ATOM 0 H VAL A 20 -16.891 -2.478 3.160 1.00 0.00 H new ATOM 0 HA VAL A 20 -14.341 -3.627 3.798 1.00 0.00 H new ATOM 0 HB VAL A 20 -13.193 -2.885 1.988 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -13.976 -1.046 0.473 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -15.253 -2.257 0.739 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -15.307 -0.701 1.602 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -12.329 -0.564 2.199 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -13.630 -0.196 3.357 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -12.379 -1.391 3.774 1.00 0.00 H new ATOM 305 N GLU A 21 -14.135 -1.807 5.592 1.00 0.00 N ATOM 306 CA GLU A 21 -14.309 -0.903 6.767 1.00 0.00 C ATOM 307 C GLU A 21 -12.958 -0.605 7.425 1.00 0.00 C ATOM 308 O GLU A 21 -12.734 0.480 7.923 1.00 0.00 O ATOM 309 CB GLU A 21 -15.226 -1.571 7.800 1.00 0.00 C ATOM 310 CG GLU A 21 -14.946 -3.074 7.852 1.00 0.00 C ATOM 311 CD GLU A 21 -13.689 -3.331 8.686 1.00 0.00 C ATOM 312 OE1 GLU A 21 -13.539 -2.686 9.710 1.00 0.00 O ATOM 313 OE2 GLU A 21 -12.899 -4.169 8.286 1.00 0.00 O ATOM 0 H GLU A 21 -13.328 -2.430 5.636 1.00 0.00 H new ATOM 0 HA GLU A 21 -14.751 0.031 6.419 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -15.064 -1.128 8.783 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -16.270 -1.396 7.539 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -15.797 -3.598 8.287 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -14.812 -3.465 6.843 1.00 0.00 H new ATOM 320 N LYS A 22 -12.064 -1.557 7.463 1.00 0.00 N ATOM 321 CA LYS A 22 -10.754 -1.306 8.123 1.00 0.00 C ATOM 322 C LYS A 22 -9.640 -1.161 7.086 1.00 0.00 C ATOM 323 O LYS A 22 -8.785 -2.013 6.967 1.00 0.00 O ATOM 324 CB LYS A 22 -10.429 -2.478 9.048 1.00 0.00 C ATOM 325 CG LYS A 22 -9.896 -1.941 10.371 1.00 0.00 C ATOM 326 CD LYS A 22 -11.025 -1.920 11.404 1.00 0.00 C ATOM 327 CE LYS A 22 -11.404 -3.355 11.774 1.00 0.00 C ATOM 328 NZ LYS A 22 -10.860 -3.680 13.124 1.00 0.00 N ATOM 0 H LYS A 22 -12.184 -2.490 7.068 1.00 0.00 H new ATOM 0 HA LYS A 22 -10.821 -0.379 8.692 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -11.322 -3.080 9.219 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -9.690 -3.130 8.582 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -9.076 -2.565 10.725 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -9.496 -0.937 10.233 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -10.708 -1.375 12.293 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -11.892 -1.396 11.001 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -12.488 -3.469 11.770 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -11.008 -4.050 11.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -11.117 -4.656 13.376 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -9.824 -3.587 13.113 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -11.259 -3.024 13.826 1.00 0.00 H new ATOM 342 N ILE A 23 -9.623 -0.080 6.351 1.00 0.00 N ATOM 343 CA ILE A 23 -8.535 0.111 5.344 1.00 0.00 C ATOM 344 C ILE A 23 -7.516 1.108 5.905 1.00 0.00 C ATOM 345 O ILE A 23 -7.872 2.064 6.563 1.00 0.00 O ATOM 346 CB ILE A 23 -9.121 0.647 4.031 1.00 0.00 C ATOM 347 CG1 ILE A 23 -9.422 2.142 4.156 1.00 0.00 C ATOM 348 CG2 ILE A 23 -10.411 -0.098 3.706 1.00 0.00 C ATOM 349 CD1 ILE A 23 -9.907 2.678 2.807 1.00 0.00 C ATOM 0 H ILE A 23 -10.309 0.674 6.402 1.00 0.00 H new ATOM 0 HA ILE A 23 -8.049 -0.843 5.142 1.00 0.00 H new ATOM 0 HB ILE A 23 -8.394 0.494 3.234 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -10.181 2.309 4.920 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -8.528 2.679 4.473 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -10.826 0.284 2.773 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -10.200 -1.162 3.601 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -11.130 0.051 4.511 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -10.122 3.743 2.895 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -9.133 2.525 2.055 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -10.812 2.149 2.509 1.00 0.00 H new ATOM 361 N GLN A 24 -6.253 0.895 5.656 1.00 0.00 N ATOM 362 CA GLN A 24 -5.230 1.841 6.185 1.00 0.00 C ATOM 363 C GLN A 24 -4.034 1.892 5.233 1.00 0.00 C ATOM 364 O GLN A 24 -3.456 0.881 4.887 1.00 0.00 O ATOM 365 CB GLN A 24 -4.770 1.377 7.570 1.00 0.00 C ATOM 366 CG GLN A 24 -4.026 0.045 7.450 1.00 0.00 C ATOM 367 CD GLN A 24 -3.585 -0.418 8.840 1.00 0.00 C ATOM 368 OE1 GLN A 24 -4.406 -0.670 9.699 1.00 0.00 O ATOM 369 NE2 GLN A 24 -2.312 -0.540 9.098 1.00 0.00 N ATOM 0 H GLN A 24 -5.887 0.113 5.113 1.00 0.00 H new ATOM 0 HA GLN A 24 -5.666 2.837 6.265 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -4.119 2.128 8.018 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -5.630 1.265 8.230 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -4.672 -0.705 6.993 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -3.158 0.158 6.800 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -1.623 -0.328 8.376 1.00 0.00 H new ATOM 0 HE22 GLN A 24 -2.006 -0.847 10.021 1.00 0.00 H new ATOM 378 N VAL A 25 -3.657 3.067 4.805 1.00 0.00 N ATOM 379 CA VAL A 25 -2.506 3.188 3.874 1.00 0.00 C ATOM 380 C VAL A 25 -1.257 3.576 4.663 1.00 0.00 C ATOM 381 O VAL A 25 -1.177 4.647 5.232 1.00 0.00 O ATOM 382 CB VAL A 25 -2.813 4.270 2.842 1.00 0.00 C ATOM 383 CG1 VAL A 25 -3.785 3.720 1.795 1.00 0.00 C ATOM 384 CG2 VAL A 25 -3.446 5.476 3.541 1.00 0.00 C ATOM 0 H VAL A 25 -4.100 3.949 5.063 1.00 0.00 H new ATOM 0 HA VAL A 25 -2.335 2.237 3.370 1.00 0.00 H new ATOM 0 HB VAL A 25 -1.888 4.576 2.352 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -4.003 4.494 1.059 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -3.335 2.861 1.296 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -4.710 3.413 2.283 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -3.666 6.249 2.805 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -4.370 5.169 4.031 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -2.754 5.870 4.285 1.00 0.00 H new ATOM 394 N THR A 26 -0.281 2.711 4.706 1.00 0.00 N ATOM 395 CA THR A 26 0.961 3.029 5.460 1.00 0.00 C ATOM 396 C THR A 26 2.043 3.497 4.487 1.00 0.00 C ATOM 397 O THR A 26 2.586 2.721 3.723 1.00 0.00 O ATOM 398 CB THR A 26 1.445 1.777 6.197 1.00 0.00 C ATOM 399 OG1 THR A 26 0.483 1.405 7.175 1.00 0.00 O ATOM 400 CG2 THR A 26 2.782 2.069 6.878 1.00 0.00 C ATOM 0 H THR A 26 -0.291 1.798 4.251 1.00 0.00 H new ATOM 0 HA THR A 26 0.755 3.819 6.182 1.00 0.00 H new ATOM 0 HB THR A 26 1.574 0.962 5.485 1.00 0.00 H new ATOM 0 HG1 THR A 26 0.790 0.603 7.647 1.00 0.00 H new ATOM 0 HG21 THR A 26 3.126 1.177 7.402 1.00 0.00 H new ATOM 0 HG22 THR A 26 3.518 2.355 6.127 1.00 0.00 H new ATOM 0 HG23 THR A 26 2.657 2.884 7.591 1.00 0.00 H new ATOM 408 N GLY A 27 2.359 4.763 4.508 1.00 0.00 N ATOM 409 CA GLY A 27 3.406 5.285 3.585 1.00 0.00 C ATOM 410 C GLY A 27 4.543 5.905 4.399 1.00 0.00 C ATOM 411 O GLY A 27 5.478 5.233 4.787 1.00 0.00 O ATOM 0 H GLY A 27 1.938 5.458 5.124 1.00 0.00 H new ATOM 0 HA2 GLY A 27 3.790 4.478 2.961 1.00 0.00 H new ATOM 0 HA3 GLY A 27 2.976 6.030 2.915 1.00 0.00 H new ATOM 415 N SER A 28 4.471 7.181 4.658 1.00 0.00 N ATOM 416 CA SER A 28 5.549 7.844 5.446 1.00 0.00 C ATOM 417 C SER A 28 4.922 8.768 6.490 1.00 0.00 C ATOM 418 O SER A 28 5.012 8.529 7.678 1.00 0.00 O ATOM 419 CB SER A 28 6.438 8.661 4.507 1.00 0.00 C ATOM 420 OG SER A 28 7.793 8.537 4.919 1.00 0.00 O ATOM 0 H SER A 28 3.713 7.794 4.358 1.00 0.00 H new ATOM 0 HA SER A 28 6.152 7.087 5.948 1.00 0.00 H new ATOM 0 HB2 SER A 28 6.324 8.310 3.482 1.00 0.00 H new ATOM 0 HB3 SER A 28 6.136 9.708 4.521 1.00 0.00 H new ATOM 0 HG SER A 28 8.366 9.058 4.319 1.00 0.00 H new ATOM 426 N GLU A 29 4.288 9.825 6.058 1.00 0.00 N ATOM 427 CA GLU A 29 3.656 10.761 7.028 1.00 0.00 C ATOM 428 C GLU A 29 2.244 10.272 7.359 1.00 0.00 C ATOM 429 O GLU A 29 1.470 9.943 6.482 1.00 0.00 O ATOM 430 CB GLU A 29 3.581 12.161 6.413 1.00 0.00 C ATOM 431 CG GLU A 29 4.563 13.088 7.134 1.00 0.00 C ATOM 432 CD GLU A 29 3.787 14.137 7.932 1.00 0.00 C ATOM 433 OE1 GLU A 29 3.048 14.891 7.320 1.00 0.00 O ATOM 434 OE2 GLU A 29 3.945 14.169 9.141 1.00 0.00 O ATOM 0 H GLU A 29 4.181 10.079 5.076 1.00 0.00 H new ATOM 0 HA GLU A 29 4.252 10.798 7.940 1.00 0.00 H new ATOM 0 HB2 GLU A 29 3.820 12.116 5.350 1.00 0.00 H new ATOM 0 HB3 GLU A 29 2.567 12.552 6.496 1.00 0.00 H new ATOM 0 HG2 GLU A 29 5.203 12.509 7.800 1.00 0.00 H new ATOM 0 HG3 GLU A 29 5.216 13.576 6.410 1.00 0.00 H new ATOM 441 N GLY A 30 1.904 10.220 8.618 1.00 0.00 N ATOM 442 CA GLY A 30 0.544 9.750 9.003 1.00 0.00 C ATOM 443 C GLY A 30 0.442 8.242 8.766 1.00 0.00 C ATOM 444 O GLY A 30 1.391 7.605 8.354 1.00 0.00 O ATOM 0 H GLY A 30 2.509 10.483 9.396 1.00 0.00 H new ATOM 0 HA2 GLY A 30 0.351 9.978 10.051 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -0.213 10.273 8.418 1.00 0.00 H new ATOM 448 N GLU A 31 -0.701 7.667 9.020 1.00 0.00 N ATOM 449 CA GLU A 31 -0.855 6.200 8.806 1.00 0.00 C ATOM 450 C GLU A 31 -2.312 5.796 9.048 1.00 0.00 C ATOM 451 O GLU A 31 -2.625 5.109 10.000 1.00 0.00 O ATOM 452 CB GLU A 31 0.051 5.444 9.781 1.00 0.00 C ATOM 453 CG GLU A 31 1.001 4.535 8.997 1.00 0.00 C ATOM 454 CD GLU A 31 2.371 5.207 8.879 1.00 0.00 C ATOM 455 OE1 GLU A 31 2.988 5.432 9.907 1.00 0.00 O ATOM 456 OE2 GLU A 31 2.778 5.486 7.763 1.00 0.00 O ATOM 0 H GLU A 31 -1.532 8.147 9.365 1.00 0.00 H new ATOM 0 HA GLU A 31 -0.575 5.953 7.782 1.00 0.00 H new ATOM 0 HB2 GLU A 31 0.622 6.149 10.385 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -0.552 4.851 10.469 1.00 0.00 H new ATOM 0 HG2 GLU A 31 1.098 3.573 9.500 1.00 0.00 H new ATOM 0 HG3 GLU A 31 0.595 4.336 8.005 1.00 0.00 H new ATOM 463 N LEU A 32 -3.203 6.210 8.190 1.00 0.00 N ATOM 464 CA LEU A 32 -4.638 5.840 8.371 1.00 0.00 C ATOM 465 C LEU A 32 -5.328 5.784 7.012 1.00 0.00 C ATOM 466 O LEU A 32 -5.062 6.581 6.134 1.00 0.00 O ATOM 467 CB LEU A 32 -5.349 6.882 9.237 1.00 0.00 C ATOM 468 CG LEU A 32 -5.196 6.514 10.714 1.00 0.00 C ATOM 469 CD1 LEU A 32 -5.566 7.718 11.581 1.00 0.00 C ATOM 470 CD2 LEU A 32 -6.127 5.345 11.045 1.00 0.00 C ATOM 0 H LEU A 32 -3.002 6.787 7.373 1.00 0.00 H new ATOM 0 HA LEU A 32 -4.686 4.866 8.858 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -4.928 7.871 9.053 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -6.405 6.930 8.972 1.00 0.00 H new ATOM 0 HG LEU A 32 -4.163 6.227 10.912 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -5.457 7.456 12.633 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -4.906 8.553 11.345 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -6.599 8.005 11.384 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -6.020 5.081 12.097 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -7.159 5.634 10.847 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -5.866 4.486 10.427 1.00 0.00 H new ATOM 482 N GLY A 33 -6.223 4.857 6.839 1.00 0.00 N ATOM 483 CA GLY A 33 -6.946 4.759 5.545 1.00 0.00 C ATOM 484 C GLY A 33 -8.334 5.369 5.719 1.00 0.00 C ATOM 485 O GLY A 33 -8.499 6.573 5.705 1.00 0.00 O ATOM 0 H GLY A 33 -6.486 4.162 7.538 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -6.397 5.284 4.763 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -7.026 3.717 5.234 1.00 0.00 H new ATOM 489 N ILE A 34 -9.329 4.549 5.907 1.00 0.00 N ATOM 490 CA ILE A 34 -10.704 5.076 6.101 1.00 0.00 C ATOM 491 C ILE A 34 -11.537 4.038 6.849 1.00 0.00 C ATOM 492 O ILE A 34 -11.435 2.847 6.616 1.00 0.00 O ATOM 493 CB ILE A 34 -11.336 5.402 4.736 1.00 0.00 C ATOM 494 CG1 ILE A 34 -10.773 6.728 4.238 1.00 0.00 C ATOM 495 CG2 ILE A 34 -12.857 5.552 4.865 1.00 0.00 C ATOM 496 CD1 ILE A 34 -11.018 7.785 5.312 1.00 0.00 C ATOM 0 H ILE A 34 -9.247 3.533 5.934 1.00 0.00 H new ATOM 0 HA ILE A 34 -10.670 5.993 6.689 1.00 0.00 H new ATOM 0 HB ILE A 34 -11.109 4.591 4.045 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -9.707 6.635 4.033 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -11.253 7.018 3.303 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -13.284 5.782 3.889 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -13.284 4.621 5.237 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -13.085 6.360 5.561 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -10.622 8.744 4.976 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -12.089 7.878 5.494 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -10.518 7.489 6.234 1.00 0.00 H new ATOM 508 N TYR A 35 -12.358 4.493 7.751 1.00 0.00 N ATOM 509 CA TYR A 35 -13.213 3.567 8.542 1.00 0.00 C ATOM 510 C TYR A 35 -14.658 4.063 8.457 1.00 0.00 C ATOM 511 O TYR A 35 -14.919 5.081 7.848 1.00 0.00 O ATOM 512 CB TYR A 35 -12.754 3.553 10.013 1.00 0.00 C ATOM 513 CG TYR A 35 -11.645 4.561 10.245 1.00 0.00 C ATOM 514 CD1 TYR A 35 -10.424 4.443 9.565 1.00 0.00 C ATOM 515 CD2 TYR A 35 -11.841 5.615 11.147 1.00 0.00 C ATOM 516 CE1 TYR A 35 -9.405 5.376 9.788 1.00 0.00 C ATOM 517 CE2 TYR A 35 -10.822 6.549 11.368 1.00 0.00 C ATOM 518 CZ TYR A 35 -9.604 6.429 10.688 1.00 0.00 C ATOM 519 OH TYR A 35 -8.598 7.348 10.907 1.00 0.00 O ATOM 0 H TYR A 35 -12.475 5.481 7.977 1.00 0.00 H new ATOM 0 HA TYR A 35 -13.135 2.555 8.145 1.00 0.00 H new ATOM 0 HB2 TYR A 35 -13.599 3.780 10.664 1.00 0.00 H new ATOM 0 HB3 TYR A 35 -12.405 2.555 10.280 1.00 0.00 H new ATOM 0 HD1 TYR A 35 -10.270 3.632 8.869 1.00 0.00 H new ATOM 0 HD2 TYR A 35 -12.780 5.707 11.673 1.00 0.00 H new ATOM 0 HE1 TYR A 35 -8.465 5.283 9.265 1.00 0.00 H new ATOM 0 HE2 TYR A 35 -10.975 7.362 12.063 1.00 0.00 H new ATOM 0 HH TYR A 35 -8.869 8.220 10.552 1.00 0.00 H new ATOM 529 N PRO A 36 -15.558 3.339 9.068 1.00 0.00 N ATOM 530 CA PRO A 36 -16.985 3.705 9.072 1.00 0.00 C ATOM 531 C PRO A 36 -17.229 4.870 10.037 1.00 0.00 C ATOM 532 O PRO A 36 -17.742 4.694 11.124 1.00 0.00 O ATOM 533 CB PRO A 36 -17.686 2.428 9.543 1.00 0.00 C ATOM 534 CG PRO A 36 -16.622 1.602 10.302 1.00 0.00 C ATOM 535 CD PRO A 36 -15.248 2.097 9.810 1.00 0.00 C ATOM 0 HA PRO A 36 -17.350 4.040 8.101 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -18.530 2.664 10.191 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -18.082 1.867 8.696 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -16.721 1.739 11.379 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -16.744 0.537 10.104 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -14.571 2.288 10.643 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -14.764 1.360 9.169 1.00 0.00 H new ATOM 543 N GLY A 37 -16.861 6.060 9.642 1.00 0.00 N ATOM 544 CA GLY A 37 -17.067 7.241 10.528 1.00 0.00 C ATOM 545 C GLY A 37 -15.904 8.223 10.355 1.00 0.00 C ATOM 546 O GLY A 37 -15.447 8.829 11.303 1.00 0.00 O ATOM 0 H GLY A 37 -16.426 6.265 8.742 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -18.009 7.731 10.284 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -17.134 6.921 11.568 1.00 0.00 H new ATOM 550 N HIS A 38 -15.422 8.388 9.151 1.00 0.00 N ATOM 551 CA HIS A 38 -14.291 9.334 8.926 1.00 0.00 C ATOM 552 C HIS A 38 -14.801 10.579 8.198 1.00 0.00 C ATOM 553 O HIS A 38 -15.951 10.658 7.812 1.00 0.00 O ATOM 554 CB HIS A 38 -13.212 8.662 8.073 1.00 0.00 C ATOM 555 CG HIS A 38 -11.858 9.162 8.498 1.00 0.00 C ATOM 556 ND1 HIS A 38 -10.985 9.775 7.613 1.00 0.00 N ATOM 557 CD2 HIS A 38 -11.218 9.152 9.712 1.00 0.00 C ATOM 558 CE1 HIS A 38 -9.878 10.106 8.304 1.00 0.00 C ATOM 559 NE2 HIS A 38 -9.968 9.749 9.587 1.00 0.00 N ATOM 0 H HIS A 38 -15.762 7.910 8.317 1.00 0.00 H new ATOM 0 HA HIS A 38 -13.868 9.617 9.890 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -13.265 7.579 8.187 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -13.378 8.880 7.018 1.00 0.00 H new ATOM 0 HD1 HIS A 38 -11.151 9.944 6.621 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -11.623 8.743 10.626 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -9.021 10.601 7.872 1.00 0.00 H new ATOM 567 N ALA A 39 -13.954 11.553 8.005 1.00 0.00 N ATOM 568 CA ALA A 39 -14.388 12.790 7.297 1.00 0.00 C ATOM 569 C ALA A 39 -14.079 12.652 5.802 1.00 0.00 C ATOM 570 O ALA A 39 -13.360 11.758 5.401 1.00 0.00 O ATOM 571 CB ALA A 39 -13.638 13.995 7.867 1.00 0.00 C ATOM 0 H ALA A 39 -12.980 11.545 8.307 1.00 0.00 H new ATOM 0 HA ALA A 39 -15.459 12.934 7.436 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -13.956 14.900 7.349 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -13.857 14.090 8.931 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -12.566 13.855 7.728 1.00 0.00 H new ATOM 577 N PRO A 40 -14.636 13.544 5.023 1.00 0.00 N ATOM 578 CA PRO A 40 -14.445 13.550 3.562 1.00 0.00 C ATOM 579 C PRO A 40 -13.085 14.157 3.201 1.00 0.00 C ATOM 580 O PRO A 40 -12.987 15.320 2.860 1.00 0.00 O ATOM 581 CB PRO A 40 -15.587 14.435 3.056 1.00 0.00 C ATOM 582 CG PRO A 40 -16.005 15.330 4.247 1.00 0.00 C ATOM 583 CD PRO A 40 -15.509 14.625 5.524 1.00 0.00 C ATOM 0 HA PRO A 40 -14.457 12.552 3.124 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -15.263 15.041 2.210 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -16.425 13.829 2.712 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -15.566 16.324 4.158 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -17.087 15.461 4.272 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -14.963 15.311 6.171 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -16.339 14.228 6.108 1.00 0.00 H new ATOM 591 N LEU A 41 -12.038 13.382 3.273 1.00 0.00 N ATOM 592 CA LEU A 41 -10.691 13.919 2.932 1.00 0.00 C ATOM 593 C LEU A 41 -10.415 13.713 1.440 1.00 0.00 C ATOM 594 O LEU A 41 -10.777 12.704 0.865 1.00 0.00 O ATOM 595 CB LEU A 41 -9.626 13.186 3.751 1.00 0.00 C ATOM 596 CG LEU A 41 -9.476 11.758 3.228 1.00 0.00 C ATOM 597 CD1 LEU A 41 -8.162 11.636 2.455 1.00 0.00 C ATOM 598 CD2 LEU A 41 -9.468 10.781 4.405 1.00 0.00 C ATOM 0 H LEU A 41 -12.057 12.401 3.553 1.00 0.00 H new ATOM 0 HA LEU A 41 -10.660 14.984 3.162 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -8.674 13.712 3.683 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -9.907 13.172 4.804 1.00 0.00 H new ATOM 0 HG LEU A 41 -10.311 11.523 2.568 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -8.053 10.618 2.081 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -8.167 12.332 1.616 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -7.328 11.871 3.116 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -9.361 9.763 4.032 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -8.634 11.015 5.066 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -10.404 10.869 4.957 1.00 0.00 H new ATOM 610 N LEU A 42 -9.774 14.660 0.814 1.00 0.00 N ATOM 611 CA LEU A 42 -9.467 14.524 -0.638 1.00 0.00 C ATOM 612 C LEU A 42 -7.974 14.775 -0.865 1.00 0.00 C ATOM 613 O LEU A 42 -7.583 15.776 -1.431 1.00 0.00 O ATOM 614 CB LEU A 42 -10.282 15.550 -1.430 1.00 0.00 C ATOM 615 CG LEU A 42 -11.585 14.908 -1.909 1.00 0.00 C ATOM 616 CD1 LEU A 42 -12.646 15.993 -2.107 1.00 0.00 C ATOM 617 CD2 LEU A 42 -11.341 14.187 -3.236 1.00 0.00 C ATOM 0 H LEU A 42 -9.448 15.525 1.246 1.00 0.00 H new ATOM 0 HA LEU A 42 -9.724 13.519 -0.973 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -10.499 16.417 -0.806 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -9.705 15.908 -2.283 1.00 0.00 H new ATOM 0 HG LEU A 42 -11.932 14.192 -1.164 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -13.575 15.536 -2.448 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -12.821 16.508 -1.162 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -12.299 16.709 -2.852 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -12.269 13.729 -3.578 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -10.994 14.903 -3.981 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -10.585 13.414 -3.096 1.00 0.00 H new ATOM 629 N THR A 43 -7.138 13.876 -0.424 1.00 0.00 N ATOM 630 CA THR A 43 -5.672 14.066 -0.611 1.00 0.00 C ATOM 631 C THR A 43 -5.148 13.052 -1.630 1.00 0.00 C ATOM 632 O THR A 43 -5.897 12.494 -2.407 1.00 0.00 O ATOM 633 CB THR A 43 -4.955 13.862 0.726 1.00 0.00 C ATOM 634 OG1 THR A 43 -4.995 12.486 1.077 1.00 0.00 O ATOM 635 CG2 THR A 43 -5.647 14.688 1.811 1.00 0.00 C ATOM 0 H THR A 43 -7.407 13.018 0.058 1.00 0.00 H new ATOM 0 HA THR A 43 -5.483 15.076 -0.975 1.00 0.00 H new ATOM 0 HB THR A 43 -3.918 14.185 0.635 1.00 0.00 H new ATOM 0 HG1 THR A 43 -4.535 12.353 1.932 1.00 0.00 H new ATOM 0 HG21 THR A 43 -5.135 14.541 2.762 1.00 0.00 H new ATOM 0 HG22 THR A 43 -5.615 15.743 1.541 1.00 0.00 H new ATOM 0 HG23 THR A 43 -6.685 14.369 1.905 1.00 0.00 H new ATOM 643 N ALA A 44 -3.866 12.809 -1.630 1.00 0.00 N ATOM 644 CA ALA A 44 -3.291 11.832 -2.597 1.00 0.00 C ATOM 645 C ALA A 44 -3.040 10.499 -1.890 1.00 0.00 C ATOM 646 O ALA A 44 -3.178 10.388 -0.688 1.00 0.00 O ATOM 647 CB ALA A 44 -1.971 12.377 -3.145 1.00 0.00 C ATOM 0 H ALA A 44 -3.191 13.245 -1.002 1.00 0.00 H new ATOM 0 HA ALA A 44 -3.991 11.679 -3.419 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -1.549 11.664 -3.853 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -2.151 13.326 -3.650 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -1.271 12.530 -2.323 1.00 0.00 H new ATOM 653 N ILE A 45 -2.673 9.486 -2.625 1.00 0.00 N ATOM 654 CA ILE A 45 -2.416 8.161 -1.994 1.00 0.00 C ATOM 655 C ILE A 45 -0.906 7.966 -1.810 1.00 0.00 C ATOM 656 O ILE A 45 -0.135 8.104 -2.738 1.00 0.00 O ATOM 657 CB ILE A 45 -2.989 7.053 -2.890 1.00 0.00 C ATOM 658 CG1 ILE A 45 -3.229 5.793 -2.053 1.00 0.00 C ATOM 659 CG2 ILE A 45 -2.013 6.735 -4.027 1.00 0.00 C ATOM 660 CD1 ILE A 45 -4.556 5.151 -2.467 1.00 0.00 C ATOM 0 H ILE A 45 -2.540 9.518 -3.636 1.00 0.00 H new ATOM 0 HA ILE A 45 -2.899 8.116 -1.018 1.00 0.00 H new ATOM 0 HB ILE A 45 -3.932 7.394 -3.318 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -2.411 5.087 -2.196 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -3.250 6.046 -0.993 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -2.430 5.948 -4.655 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -1.849 7.630 -4.627 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -1.064 6.400 -3.609 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -4.728 4.254 -1.872 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -5.369 5.858 -2.301 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -4.517 4.884 -3.523 1.00 0.00 H new ATOM 672 N LYS A 46 -0.477 7.652 -0.616 1.00 0.00 N ATOM 673 CA LYS A 46 0.981 7.455 -0.374 1.00 0.00 C ATOM 674 C LYS A 46 1.391 6.043 -0.806 1.00 0.00 C ATOM 675 O LYS A 46 0.572 5.147 -0.848 1.00 0.00 O ATOM 676 CB LYS A 46 1.279 7.634 1.115 1.00 0.00 C ATOM 677 CG LYS A 46 1.123 9.106 1.496 1.00 0.00 C ATOM 678 CD LYS A 46 -0.293 9.349 2.019 1.00 0.00 C ATOM 679 CE LYS A 46 -0.224 9.851 3.461 1.00 0.00 C ATOM 680 NZ LYS A 46 -1.545 9.653 4.120 1.00 0.00 N ATOM 0 H LYS A 46 -1.074 7.524 0.201 1.00 0.00 H new ATOM 0 HA LYS A 46 1.543 8.188 -0.952 1.00 0.00 H new ATOM 0 HB2 LYS A 46 0.601 7.021 1.708 1.00 0.00 H new ATOM 0 HB3 LYS A 46 2.291 7.296 1.337 1.00 0.00 H new ATOM 0 HG2 LYS A 46 1.855 9.375 2.258 1.00 0.00 H new ATOM 0 HG3 LYS A 46 1.316 9.739 0.630 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -0.803 10.080 1.392 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -0.873 8.428 1.971 1.00 0.00 H new ATOM 0 HE2 LYS A 46 0.551 9.314 4.008 1.00 0.00 H new ATOM 0 HE3 LYS A 46 0.048 10.906 3.477 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -1.498 9.995 5.101 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -2.274 10.185 3.603 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -1.786 8.641 4.117 1.00 0.00 H new ATOM 694 N PRO A 47 2.656 5.890 -1.109 1.00 0.00 N ATOM 695 CA PRO A 47 3.217 4.599 -1.539 1.00 0.00 C ATOM 696 C PRO A 47 3.435 3.685 -0.330 1.00 0.00 C ATOM 697 O PRO A 47 3.229 4.077 0.801 1.00 0.00 O ATOM 698 CB PRO A 47 4.553 4.984 -2.181 1.00 0.00 C ATOM 699 CG PRO A 47 4.941 6.360 -1.587 1.00 0.00 C ATOM 700 CD PRO A 47 3.640 6.991 -1.051 1.00 0.00 C ATOM 0 HA PRO A 47 2.565 4.052 -2.220 1.00 0.00 H new ATOM 0 HB2 PRO A 47 5.317 4.238 -1.965 1.00 0.00 H new ATOM 0 HB3 PRO A 47 4.461 5.041 -3.266 1.00 0.00 H new ATOM 0 HG2 PRO A 47 5.673 6.245 -0.788 1.00 0.00 H new ATOM 0 HG3 PRO A 47 5.396 6.996 -2.347 1.00 0.00 H new ATOM 0 HD2 PRO A 47 3.766 7.360 -0.033 1.00 0.00 H new ATOM 0 HD3 PRO A 47 3.327 7.838 -1.661 1.00 0.00 H new ATOM 708 N GLY A 48 3.849 2.469 -0.560 1.00 0.00 N ATOM 709 CA GLY A 48 4.077 1.533 0.578 1.00 0.00 C ATOM 710 C GLY A 48 3.068 0.386 0.504 1.00 0.00 C ATOM 711 O GLY A 48 2.857 -0.203 -0.538 1.00 0.00 O ATOM 0 H GLY A 48 4.039 2.083 -1.485 1.00 0.00 H new ATOM 0 HA2 GLY A 48 5.093 1.141 0.542 1.00 0.00 H new ATOM 0 HA3 GLY A 48 3.973 2.063 1.525 1.00 0.00 H new ATOM 715 N MET A 49 2.439 0.063 1.602 1.00 0.00 N ATOM 716 CA MET A 49 1.443 -1.046 1.589 1.00 0.00 C ATOM 717 C MET A 49 0.141 -0.569 2.231 1.00 0.00 C ATOM 718 O MET A 49 0.009 0.578 2.609 1.00 0.00 O ATOM 719 CB MET A 49 1.995 -2.238 2.374 1.00 0.00 C ATOM 720 CG MET A 49 2.014 -1.904 3.867 1.00 0.00 C ATOM 721 SD MET A 49 2.842 -3.234 4.772 1.00 0.00 S ATOM 722 CE MET A 49 1.390 -3.837 5.667 1.00 0.00 C ATOM 0 H MET A 49 2.572 0.518 2.505 1.00 0.00 H new ATOM 0 HA MET A 49 1.250 -1.349 0.560 1.00 0.00 H new ATOM 0 HB2 MET A 49 1.380 -3.120 2.196 1.00 0.00 H new ATOM 0 HB3 MET A 49 3.002 -2.477 2.032 1.00 0.00 H new ATOM 0 HG2 MET A 49 2.532 -0.959 4.033 1.00 0.00 H new ATOM 0 HG3 MET A 49 0.996 -1.778 4.235 1.00 0.00 H new ATOM 0 HE1 MET A 49 1.609 -4.812 6.101 1.00 0.00 H new ATOM 0 HE2 MET A 49 1.135 -3.135 6.461 1.00 0.00 H new ATOM 0 HE3 MET A 49 0.550 -3.927 4.979 1.00 0.00 H new ATOM 732 N ILE A 50 -0.828 -1.436 2.356 1.00 0.00 N ATOM 733 CA ILE A 50 -2.119 -1.020 2.969 1.00 0.00 C ATOM 734 C ILE A 50 -2.790 -2.225 3.634 1.00 0.00 C ATOM 735 O ILE A 50 -2.930 -3.275 3.042 1.00 0.00 O ATOM 736 CB ILE A 50 -3.038 -0.464 1.877 1.00 0.00 C ATOM 737 CG1 ILE A 50 -4.452 -0.273 2.437 1.00 0.00 C ATOM 738 CG2 ILE A 50 -3.090 -1.445 0.704 1.00 0.00 C ATOM 739 CD1 ILE A 50 -5.422 -0.014 1.285 1.00 0.00 C ATOM 0 H ILE A 50 -0.780 -2.411 2.061 1.00 0.00 H new ATOM 0 HA ILE A 50 -1.933 -0.254 3.721 1.00 0.00 H new ATOM 0 HB ILE A 50 -2.649 0.496 1.537 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -4.758 -1.159 2.993 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -4.469 0.563 3.136 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -3.744 -1.049 -0.073 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -2.087 -1.582 0.299 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -3.476 -2.404 1.049 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -6.429 0.122 1.681 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -5.118 0.885 0.749 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -5.412 -0.864 0.603 1.00 0.00 H new ATOM 751 N ARG A 51 -3.225 -2.071 4.855 1.00 0.00 N ATOM 752 CA ARG A 51 -3.911 -3.195 5.548 1.00 0.00 C ATOM 753 C ARG A 51 -5.414 -2.960 5.425 1.00 0.00 C ATOM 754 O ARG A 51 -5.905 -1.889 5.719 1.00 0.00 O ATOM 755 CB ARG A 51 -3.504 -3.224 7.024 1.00 0.00 C ATOM 756 CG ARG A 51 -3.369 -4.676 7.488 1.00 0.00 C ATOM 757 CD ARG A 51 -1.942 -4.926 7.977 1.00 0.00 C ATOM 758 NE ARG A 51 -1.971 -5.856 9.140 1.00 0.00 N ATOM 759 CZ ARG A 51 -0.865 -6.153 9.768 1.00 0.00 C ATOM 760 NH1 ARG A 51 0.034 -5.231 9.973 1.00 0.00 N ATOM 761 NH2 ARG A 51 -0.660 -7.371 10.187 1.00 0.00 N ATOM 0 H ARG A 51 -3.134 -1.215 5.402 1.00 0.00 H new ATOM 0 HA ARG A 51 -3.634 -4.150 5.100 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -2.560 -2.698 7.162 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -4.249 -2.706 7.628 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -4.080 -4.880 8.289 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -3.608 -5.354 6.669 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -1.340 -5.350 7.173 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -1.474 -3.984 8.263 1.00 0.00 H new ATOM 0 HE ARG A 51 -2.855 -6.261 9.446 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -0.127 -4.279 9.643 1.00 0.00 H new ATOM 0 HH12 ARG A 51 0.898 -5.461 10.463 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -1.363 -8.092 10.024 1.00 0.00 H new ATOM 0 HH22 ARG A 51 0.204 -7.603 10.677 1.00 0.00 H new ATOM 775 N ILE A 52 -6.146 -3.928 4.951 1.00 0.00 N ATOM 776 CA ILE A 52 -7.606 -3.711 4.768 1.00 0.00 C ATOM 777 C ILE A 52 -8.409 -4.904 5.306 1.00 0.00 C ATOM 778 O ILE A 52 -7.996 -6.042 5.205 1.00 0.00 O ATOM 779 CB ILE A 52 -7.859 -3.509 3.263 1.00 0.00 C ATOM 780 CG1 ILE A 52 -8.801 -2.339 3.043 1.00 0.00 C ATOM 781 CG2 ILE A 52 -8.473 -4.755 2.620 1.00 0.00 C ATOM 782 CD1 ILE A 52 -9.048 -2.205 1.545 1.00 0.00 C ATOM 0 H ILE A 52 -5.801 -4.850 4.685 1.00 0.00 H new ATOM 0 HA ILE A 52 -7.932 -2.834 5.327 1.00 0.00 H new ATOM 0 HB ILE A 52 -6.893 -3.312 2.798 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -9.741 -2.503 3.571 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -8.368 -1.421 3.441 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -8.637 -4.573 1.558 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -7.795 -5.600 2.743 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -9.425 -4.981 3.100 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -9.723 -1.369 1.361 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -8.102 -2.026 1.035 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -9.496 -3.124 1.166 1.00 0.00 H new ATOM 794 N VAL A 53 -9.564 -4.645 5.855 1.00 0.00 N ATOM 795 CA VAL A 53 -10.411 -5.748 6.379 1.00 0.00 C ATOM 796 C VAL A 53 -11.813 -5.618 5.778 1.00 0.00 C ATOM 797 O VAL A 53 -12.529 -4.671 6.047 1.00 0.00 O ATOM 798 CB VAL A 53 -10.495 -5.658 7.904 1.00 0.00 C ATOM 799 CG1 VAL A 53 -11.623 -6.559 8.407 1.00 0.00 C ATOM 800 CG2 VAL A 53 -9.170 -6.118 8.515 1.00 0.00 C ATOM 0 H VAL A 53 -9.958 -3.710 5.963 1.00 0.00 H new ATOM 0 HA VAL A 53 -9.976 -6.709 6.106 1.00 0.00 H new ATOM 0 HB VAL A 53 -10.694 -4.627 8.196 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -11.683 -6.495 9.493 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -12.569 -6.236 7.972 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -11.423 -7.590 8.115 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -9.229 -6.054 9.602 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -8.973 -7.149 8.222 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -8.363 -5.479 8.157 1.00 0.00 H new ATOM 810 N LYS A 54 -12.203 -6.556 4.960 1.00 0.00 N ATOM 811 CA LYS A 54 -13.552 -6.490 4.330 1.00 0.00 C ATOM 812 C LYS A 54 -14.634 -6.644 5.400 1.00 0.00 C ATOM 813 O LYS A 54 -14.401 -7.193 6.459 1.00 0.00 O ATOM 814 CB LYS A 54 -13.689 -7.620 3.309 1.00 0.00 C ATOM 815 CG LYS A 54 -12.687 -7.409 2.175 1.00 0.00 C ATOM 816 CD LYS A 54 -13.071 -8.292 0.988 1.00 0.00 C ATOM 817 CE LYS A 54 -11.934 -9.272 0.691 1.00 0.00 C ATOM 818 NZ LYS A 54 -12.098 -9.820 -0.686 1.00 0.00 N ATOM 0 H LYS A 54 -11.644 -7.368 4.700 1.00 0.00 H new ATOM 0 HA LYS A 54 -13.670 -5.526 3.834 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -13.512 -8.582 3.790 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -14.704 -7.644 2.912 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -12.676 -6.361 1.875 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -11.680 -7.654 2.514 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -13.988 -8.839 1.209 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -13.271 -7.675 0.112 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -10.972 -8.768 0.781 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -11.938 -10.083 1.420 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -11.165 -10.062 -1.077 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -12.691 -10.674 -0.652 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -12.552 -9.107 -1.292 1.00 0.00 H new ATOM 832 N GLN A 55 -15.818 -6.169 5.128 1.00 0.00 N ATOM 833 CA GLN A 55 -16.919 -6.293 6.126 1.00 0.00 C ATOM 834 C GLN A 55 -17.180 -7.773 6.419 1.00 0.00 C ATOM 835 O GLN A 55 -16.978 -8.243 7.520 1.00 0.00 O ATOM 836 CB GLN A 55 -18.190 -5.655 5.565 1.00 0.00 C ATOM 837 CG GLN A 55 -19.300 -5.719 6.616 1.00 0.00 C ATOM 838 CD GLN A 55 -20.658 -5.824 5.918 1.00 0.00 C ATOM 839 OE1 GLN A 55 -20.845 -6.650 5.047 1.00 0.00 O ATOM 840 NE2 GLN A 55 -21.620 -5.013 6.265 1.00 0.00 N ATOM 0 H GLN A 55 -16.071 -5.700 4.258 1.00 0.00 H new ATOM 0 HA GLN A 55 -16.632 -5.785 7.047 1.00 0.00 H new ATOM 0 HB2 GLN A 55 -17.997 -4.619 5.287 1.00 0.00 H new ATOM 0 HB3 GLN A 55 -18.502 -6.175 4.659 1.00 0.00 H new ATOM 0 HG2 GLN A 55 -19.148 -6.578 7.269 1.00 0.00 H new ATOM 0 HG3 GLN A 55 -19.271 -4.830 7.246 1.00 0.00 H new ATOM 0 HE21 GLN A 55 -21.463 -4.319 6.996 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -22.528 -5.073 5.805 1.00 0.00 H new ATOM 849 N HIS A 56 -17.632 -8.509 5.440 1.00 0.00 N ATOM 850 CA HIS A 56 -17.908 -9.957 5.661 1.00 0.00 C ATOM 851 C HIS A 56 -17.118 -10.788 4.648 1.00 0.00 C ATOM 852 O HIS A 56 -17.481 -10.884 3.493 1.00 0.00 O ATOM 853 CB HIS A 56 -19.404 -10.224 5.483 1.00 0.00 C ATOM 854 CG HIS A 56 -19.820 -11.372 6.361 1.00 0.00 C ATOM 855 ND1 HIS A 56 -20.816 -11.248 7.319 1.00 0.00 N ATOM 856 CD2 HIS A 56 -19.386 -12.672 6.440 1.00 0.00 C ATOM 857 CE1 HIS A 56 -20.945 -12.442 7.925 1.00 0.00 C ATOM 858 NE2 HIS A 56 -20.096 -13.345 7.428 1.00 0.00 N ATOM 0 H HIS A 56 -17.822 -8.170 4.497 1.00 0.00 H new ATOM 0 HA HIS A 56 -17.607 -10.234 6.671 1.00 0.00 H new ATOM 0 HB2 HIS A 56 -19.976 -9.332 5.739 1.00 0.00 H new ATOM 0 HB3 HIS A 56 -19.621 -10.454 4.440 1.00 0.00 H new ATOM 0 HD2 HIS A 56 -18.610 -13.106 5.827 1.00 0.00 H new ATOM 0 HE1 HIS A 56 -21.650 -12.646 8.718 1.00 0.00 H new ATOM 0 HE2 HIS A 56 -19.991 -14.319 7.712 1.00 0.00 H new ATOM 866 N GLY A 57 -16.039 -11.389 5.070 1.00 0.00 N ATOM 867 CA GLY A 57 -15.229 -12.211 4.129 1.00 0.00 C ATOM 868 C GLY A 57 -13.813 -12.374 4.680 1.00 0.00 C ATOM 869 O GLY A 57 -13.575 -13.149 5.586 1.00 0.00 O ATOM 0 H GLY A 57 -15.684 -11.346 6.025 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -15.692 -13.188 3.993 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -15.196 -11.734 3.149 1.00 0.00 H new ATOM 873 N HIS A 58 -12.867 -11.652 4.142 1.00 0.00 N ATOM 874 CA HIS A 58 -11.468 -11.772 4.638 1.00 0.00 C ATOM 875 C HIS A 58 -10.751 -10.426 4.492 1.00 0.00 C ATOM 876 O HIS A 58 -11.158 -9.573 3.729 1.00 0.00 O ATOM 877 CB HIS A 58 -10.728 -12.834 3.822 1.00 0.00 C ATOM 878 CG HIS A 58 -11.449 -14.149 3.940 1.00 0.00 C ATOM 879 ND1 HIS A 58 -12.604 -14.618 3.363 1.00 0.00 N flip ATOM 880 CD2 HIS A 58 -10.982 -15.179 4.741 1.00 0.00 C flip ATOM 881 CE1 HIS A 58 -12.850 -15.917 3.798 1.00 0.00 C flip ATOM 882 NE2 HIS A 58 -11.843 -16.206 4.626 1.00 0.00 N flip ATOM 0 H HIS A 58 -13.003 -10.986 3.382 1.00 0.00 H new ATOM 0 HA HIS A 58 -11.481 -12.062 5.689 1.00 0.00 H new ATOM 0 HB2 HIS A 58 -10.671 -12.531 2.777 1.00 0.00 H new ATOM 0 HB3 HIS A 58 -9.704 -12.935 4.181 1.00 0.00 H new ATOM 0 HD2 HIS A 58 -10.089 -15.160 5.348 1.00 0.00 H new ATOM 0 HE1 HIS A 58 -13.678 -16.555 3.525 1.00 0.00 H new ATOM 0 HE2 HIS A 58 -11.739 -17.097 5.112 1.00 0.00 H new ATOM 890 N GLU A 59 -9.686 -10.232 5.222 1.00 0.00 N ATOM 891 CA GLU A 59 -8.935 -8.946 5.131 1.00 0.00 C ATOM 892 C GLU A 59 -7.691 -9.147 4.263 1.00 0.00 C ATOM 893 O GLU A 59 -6.990 -10.132 4.391 1.00 0.00 O ATOM 894 CB GLU A 59 -8.512 -8.506 6.536 1.00 0.00 C ATOM 895 CG GLU A 59 -7.885 -9.691 7.274 1.00 0.00 C ATOM 896 CD GLU A 59 -6.895 -9.173 8.319 1.00 0.00 C ATOM 897 OE1 GLU A 59 -6.229 -8.189 8.040 1.00 0.00 O ATOM 898 OE2 GLU A 59 -6.820 -9.769 9.380 1.00 0.00 O ATOM 0 H GLU A 59 -9.302 -10.911 5.880 1.00 0.00 H new ATOM 0 HA GLU A 59 -9.570 -8.180 4.685 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -7.798 -7.685 6.472 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -9.376 -8.136 7.088 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -8.661 -10.285 7.756 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -7.375 -10.345 6.567 1.00 0.00 H new ATOM 905 N GLU A 60 -7.409 -8.229 3.376 1.00 0.00 N ATOM 906 CA GLU A 60 -6.210 -8.389 2.505 1.00 0.00 C ATOM 907 C GLU A 60 -5.424 -7.076 2.452 1.00 0.00 C ATOM 908 O GLU A 60 -5.979 -6.002 2.577 1.00 0.00 O ATOM 909 CB GLU A 60 -6.662 -8.771 1.095 1.00 0.00 C ATOM 910 CG GLU A 60 -7.843 -9.740 1.184 1.00 0.00 C ATOM 911 CD GLU A 60 -8.095 -10.369 -0.188 1.00 0.00 C ATOM 912 OE1 GLU A 60 -7.236 -11.102 -0.648 1.00 0.00 O ATOM 913 OE2 GLU A 60 -9.143 -10.104 -0.755 1.00 0.00 O ATOM 0 H GLU A 60 -7.954 -7.381 3.218 1.00 0.00 H new ATOM 0 HA GLU A 60 -5.569 -9.171 2.912 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -6.951 -7.879 0.540 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -5.839 -9.233 0.550 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -7.634 -10.517 1.919 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -8.735 -9.212 1.523 1.00 0.00 H new ATOM 920 N PHE A 61 -4.133 -7.156 2.266 1.00 0.00 N ATOM 921 CA PHE A 61 -3.306 -5.916 2.200 1.00 0.00 C ATOM 922 C PHE A 61 -2.826 -5.702 0.762 1.00 0.00 C ATOM 923 O PHE A 61 -2.309 -6.603 0.132 1.00 0.00 O ATOM 924 CB PHE A 61 -2.091 -6.053 3.124 1.00 0.00 C ATOM 925 CG PHE A 61 -1.667 -7.501 3.192 1.00 0.00 C ATOM 926 CD1 PHE A 61 -0.798 -8.018 2.226 1.00 0.00 C ATOM 927 CD2 PHE A 61 -2.143 -8.325 4.219 1.00 0.00 C ATOM 928 CE1 PHE A 61 -0.403 -9.359 2.285 1.00 0.00 C ATOM 929 CE2 PHE A 61 -1.749 -9.666 4.279 1.00 0.00 C ATOM 930 CZ PHE A 61 -0.878 -10.185 3.312 1.00 0.00 C ATOM 0 H PHE A 61 -3.615 -8.028 2.157 1.00 0.00 H new ATOM 0 HA PHE A 61 -3.908 -5.065 2.518 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -1.269 -5.440 2.754 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -2.337 -5.688 4.121 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -0.432 -7.382 1.434 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -2.814 -7.925 4.965 1.00 0.00 H new ATOM 0 HE1 PHE A 61 0.268 -9.757 1.539 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -2.116 -10.302 5.071 1.00 0.00 H new ATOM 0 HZ PHE A 61 -0.573 -11.220 3.358 1.00 0.00 H new ATOM 940 N ILE A 62 -2.990 -4.518 0.239 1.00 0.00 N ATOM 941 CA ILE A 62 -2.539 -4.254 -1.157 1.00 0.00 C ATOM 942 C ILE A 62 -1.213 -3.493 -1.128 1.00 0.00 C ATOM 943 O ILE A 62 -0.644 -3.256 -0.081 1.00 0.00 O ATOM 944 CB ILE A 62 -3.592 -3.421 -1.889 1.00 0.00 C ATOM 945 CG1 ILE A 62 -4.987 -3.827 -1.406 1.00 0.00 C ATOM 946 CG2 ILE A 62 -3.483 -3.669 -3.395 1.00 0.00 C ATOM 947 CD1 ILE A 62 -6.046 -3.226 -2.334 1.00 0.00 C ATOM 0 H ILE A 62 -3.416 -3.724 0.716 1.00 0.00 H new ATOM 0 HA ILE A 62 -2.403 -5.201 -1.679 1.00 0.00 H new ATOM 0 HB ILE A 62 -3.427 -2.364 -1.682 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -5.076 -4.913 -1.391 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -5.145 -3.480 -0.385 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -4.234 -3.075 -3.917 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -2.490 -3.382 -3.740 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -3.648 -4.726 -3.603 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -7.039 -3.516 -1.989 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -5.962 -2.139 -2.326 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -5.892 -3.595 -3.348 1.00 0.00 H new ATOM 959 N TYR A 63 -0.716 -3.110 -2.271 1.00 0.00 N ATOM 960 CA TYR A 63 0.574 -2.368 -2.313 1.00 0.00 C ATOM 961 C TYR A 63 0.596 -1.473 -3.555 1.00 0.00 C ATOM 962 O TYR A 63 0.201 -1.879 -4.630 1.00 0.00 O ATOM 963 CB TYR A 63 1.728 -3.374 -2.374 1.00 0.00 C ATOM 964 CG TYR A 63 2.999 -2.671 -2.786 1.00 0.00 C ATOM 965 CD1 TYR A 63 3.231 -2.385 -4.135 1.00 0.00 C ATOM 966 CD2 TYR A 63 3.942 -2.308 -1.818 1.00 0.00 C ATOM 967 CE1 TYR A 63 4.408 -1.734 -4.520 1.00 0.00 C ATOM 968 CE2 TYR A 63 5.120 -1.657 -2.202 1.00 0.00 C ATOM 969 CZ TYR A 63 5.353 -1.368 -3.553 1.00 0.00 C ATOM 970 OH TYR A 63 6.514 -0.726 -3.931 1.00 0.00 O ATOM 0 H TYR A 63 -1.149 -3.279 -3.179 1.00 0.00 H new ATOM 0 HA TYR A 63 0.681 -1.750 -1.422 1.00 0.00 H new ATOM 0 HB2 TYR A 63 1.862 -3.847 -1.401 1.00 0.00 H new ATOM 0 HB3 TYR A 63 1.494 -4.167 -3.084 1.00 0.00 H new ATOM 0 HD1 TYR A 63 2.501 -2.667 -4.880 1.00 0.00 H new ATOM 0 HD2 TYR A 63 3.761 -2.530 -0.777 1.00 0.00 H new ATOM 0 HE1 TYR A 63 4.588 -1.514 -5.562 1.00 0.00 H new ATOM 0 HE2 TYR A 63 5.850 -1.377 -1.457 1.00 0.00 H new ATOM 0 HH TYR A 63 7.059 -0.542 -3.138 1.00 0.00 H new ATOM 980 N LEU A 64 1.049 -0.256 -3.419 1.00 0.00 N ATOM 981 CA LEU A 64 1.084 0.655 -4.599 1.00 0.00 C ATOM 982 C LEU A 64 2.036 1.822 -4.328 1.00 0.00 C ATOM 983 O LEU A 64 2.638 1.916 -3.277 1.00 0.00 O ATOM 984 CB LEU A 64 -0.322 1.199 -4.865 1.00 0.00 C ATOM 985 CG LEU A 64 -1.036 1.445 -3.535 1.00 0.00 C ATOM 986 CD1 LEU A 64 -0.435 2.673 -2.851 1.00 0.00 C ATOM 987 CD2 LEU A 64 -2.526 1.684 -3.793 1.00 0.00 C ATOM 0 H LEU A 64 1.395 0.145 -2.547 1.00 0.00 H new ATOM 0 HA LEU A 64 1.434 0.100 -5.469 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -0.262 2.126 -5.435 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -0.889 0.490 -5.468 1.00 0.00 H new ATOM 0 HG LEU A 64 -0.912 0.574 -2.891 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -0.945 2.847 -1.903 1.00 0.00 H new ATOM 0 HD12 LEU A 64 0.626 2.504 -2.667 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -0.557 3.544 -3.494 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -3.036 1.859 -2.846 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -2.649 2.554 -4.438 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -2.956 0.809 -4.280 1.00 0.00 H new ATOM 999 N SER A 65 2.177 2.713 -5.273 1.00 0.00 N ATOM 1000 CA SER A 65 3.087 3.875 -5.081 1.00 0.00 C ATOM 1001 C SER A 65 2.730 4.973 -6.086 1.00 0.00 C ATOM 1002 O SER A 65 2.895 4.812 -7.279 1.00 0.00 O ATOM 1003 CB SER A 65 4.534 3.435 -5.304 1.00 0.00 C ATOM 1004 OG SER A 65 5.268 4.507 -5.881 1.00 0.00 O ATOM 0 H SER A 65 1.698 2.684 -6.173 1.00 0.00 H new ATOM 0 HA SER A 65 2.976 4.258 -4.066 1.00 0.00 H new ATOM 0 HB2 SER A 65 4.986 3.138 -4.358 1.00 0.00 H new ATOM 0 HB3 SER A 65 4.564 2.564 -5.959 1.00 0.00 H new ATOM 0 HG SER A 65 6.197 4.228 -6.024 1.00 0.00 H new ATOM 1010 N GLY A 66 2.239 6.087 -5.615 1.00 0.00 N ATOM 1011 CA GLY A 66 1.873 7.193 -6.545 1.00 0.00 C ATOM 1012 C GLY A 66 0.396 7.075 -6.926 1.00 0.00 C ATOM 1013 O GLY A 66 -0.085 6.013 -7.271 1.00 0.00 O ATOM 0 H GLY A 66 2.076 6.279 -4.627 1.00 0.00 H new ATOM 0 HA2 GLY A 66 2.061 8.157 -6.072 1.00 0.00 H new ATOM 0 HA3 GLY A 66 2.494 7.150 -7.440 1.00 0.00 H new ATOM 1017 N GLY A 67 -0.331 8.158 -6.868 1.00 0.00 N ATOM 1018 CA GLY A 67 -1.776 8.109 -7.228 1.00 0.00 C ATOM 1019 C GLY A 67 -2.558 9.082 -6.344 1.00 0.00 C ATOM 1020 O GLY A 67 -1.997 9.974 -5.740 1.00 0.00 O ATOM 0 H GLY A 67 0.014 9.075 -6.586 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -1.909 8.369 -8.278 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -2.159 7.097 -7.099 1.00 0.00 H new ATOM 1024 N ILE A 68 -3.850 8.916 -6.260 1.00 0.00 N ATOM 1025 CA ILE A 68 -4.666 9.832 -5.413 1.00 0.00 C ATOM 1026 C ILE A 68 -5.729 9.024 -4.669 1.00 0.00 C ATOM 1027 O ILE A 68 -6.286 8.080 -5.194 1.00 0.00 O ATOM 1028 CB ILE A 68 -5.349 10.877 -6.299 1.00 0.00 C ATOM 1029 CG1 ILE A 68 -4.286 11.690 -7.043 1.00 0.00 C ATOM 1030 CG2 ILE A 68 -6.186 11.816 -5.428 1.00 0.00 C ATOM 1031 CD1 ILE A 68 -4.951 12.506 -8.153 1.00 0.00 C ATOM 0 H ILE A 68 -4.376 8.186 -6.741 1.00 0.00 H new ATOM 0 HA ILE A 68 -4.019 10.334 -4.694 1.00 0.00 H new ATOM 0 HB ILE A 68 -5.994 10.374 -7.019 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -3.769 12.353 -6.350 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -3.535 11.024 -7.467 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -6.672 12.560 -6.059 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -6.943 11.240 -4.896 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -5.539 12.317 -4.708 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -4.194 13.085 -8.682 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -5.448 11.833 -8.852 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -5.686 13.183 -7.717 1.00 0.00 H new ATOM 1043 N LEU A 69 -6.020 9.386 -3.448 1.00 0.00 N ATOM 1044 CA LEU A 69 -7.050 8.635 -2.678 1.00 0.00 C ATOM 1045 C LEU A 69 -8.142 9.601 -2.209 1.00 0.00 C ATOM 1046 O LEU A 69 -7.866 10.703 -1.775 1.00 0.00 O ATOM 1047 CB LEU A 69 -6.392 7.953 -1.468 1.00 0.00 C ATOM 1048 CG LEU A 69 -6.234 8.950 -0.316 1.00 0.00 C ATOM 1049 CD1 LEU A 69 -7.489 8.920 0.558 1.00 0.00 C ATOM 1050 CD2 LEU A 69 -5.019 8.563 0.531 1.00 0.00 C ATOM 0 H LEU A 69 -5.590 10.167 -2.953 1.00 0.00 H new ATOM 0 HA LEU A 69 -7.499 7.872 -3.314 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -6.998 7.107 -1.145 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -5.417 7.557 -1.751 1.00 0.00 H new ATOM 0 HG LEU A 69 -6.093 9.952 -0.720 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -7.378 9.629 1.378 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -8.357 9.192 -0.042 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -7.627 7.917 0.962 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -4.906 9.272 1.351 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -5.162 7.561 0.935 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -4.123 8.580 -0.089 1.00 0.00 H new ATOM 1062 N GLU A 70 -9.380 9.197 -2.290 1.00 0.00 N ATOM 1063 CA GLU A 70 -10.487 10.091 -1.847 1.00 0.00 C ATOM 1064 C GLU A 70 -11.574 9.256 -1.169 1.00 0.00 C ATOM 1065 O GLU A 70 -11.771 8.101 -1.488 1.00 0.00 O ATOM 1066 CB GLU A 70 -11.079 10.816 -3.060 1.00 0.00 C ATOM 1067 CG GLU A 70 -11.722 9.799 -4.006 1.00 0.00 C ATOM 1068 CD GLU A 70 -12.879 10.460 -4.757 1.00 0.00 C ATOM 1069 OE1 GLU A 70 -12.626 11.049 -5.795 1.00 0.00 O ATOM 1070 OE2 GLU A 70 -13.998 10.367 -4.282 1.00 0.00 O ATOM 0 H GLU A 70 -9.673 8.286 -2.644 1.00 0.00 H new ATOM 0 HA GLU A 70 -10.100 10.826 -1.142 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -11.822 11.544 -2.734 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -10.298 11.369 -3.582 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -10.981 9.426 -4.713 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -12.085 8.940 -3.441 1.00 0.00 H new ATOM 1077 N VAL A 71 -12.277 9.829 -0.230 1.00 0.00 N ATOM 1078 CA VAL A 71 -13.346 9.061 0.470 1.00 0.00 C ATOM 1079 C VAL A 71 -14.720 9.592 0.056 1.00 0.00 C ATOM 1080 O VAL A 71 -14.956 10.784 0.030 1.00 0.00 O ATOM 1081 CB VAL A 71 -13.173 9.213 1.982 1.00 0.00 C ATOM 1082 CG1 VAL A 71 -13.113 10.697 2.343 1.00 0.00 C ATOM 1083 CG2 VAL A 71 -14.358 8.559 2.698 1.00 0.00 C ATOM 0 H VAL A 71 -12.158 10.793 0.082 1.00 0.00 H new ATOM 0 HA VAL A 71 -13.272 8.008 0.198 1.00 0.00 H new ATOM 0 HB VAL A 71 -12.248 8.728 2.293 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -12.990 10.805 3.421 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -12.269 11.162 1.833 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -14.037 11.185 2.033 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -14.236 8.666 3.776 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -15.283 9.044 2.387 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -14.399 7.500 2.441 1.00 0.00 H new ATOM 1093 N GLN A 72 -15.629 8.714 -0.268 1.00 0.00 N ATOM 1094 CA GLN A 72 -16.988 9.162 -0.681 1.00 0.00 C ATOM 1095 C GLN A 72 -17.960 8.987 0.491 1.00 0.00 C ATOM 1096 O GLN A 72 -17.593 8.463 1.523 1.00 0.00 O ATOM 1097 CB GLN A 72 -17.458 8.316 -1.867 1.00 0.00 C ATOM 1098 CG GLN A 72 -17.551 9.197 -3.115 1.00 0.00 C ATOM 1099 CD GLN A 72 -18.081 8.368 -4.287 1.00 0.00 C ATOM 1100 OE1 GLN A 72 -19.193 8.568 -4.734 1.00 0.00 O ATOM 1101 NE2 GLN A 72 -17.327 7.440 -4.807 1.00 0.00 N ATOM 0 H GLN A 72 -15.488 7.704 -0.264 1.00 0.00 H new ATOM 0 HA GLN A 72 -16.957 10.212 -0.971 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -16.763 7.494 -2.040 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -18.429 7.872 -1.649 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -18.211 10.044 -2.927 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -16.570 9.605 -3.359 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -16.393 7.272 -4.432 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -17.671 6.882 -5.589 1.00 0.00 H new ATOM 1110 N PRO A 73 -19.176 9.431 0.294 1.00 0.00 N ATOM 1111 CA PRO A 73 -20.231 9.338 1.318 1.00 0.00 C ATOM 1112 C PRO A 73 -20.773 7.908 1.390 1.00 0.00 C ATOM 1113 O PRO A 73 -21.833 7.608 0.876 1.00 0.00 O ATOM 1114 CB PRO A 73 -21.304 10.310 0.821 1.00 0.00 C ATOM 1115 CG PRO A 73 -21.074 10.470 -0.700 1.00 0.00 C ATOM 1116 CD PRO A 73 -19.612 10.065 -0.969 1.00 0.00 C ATOM 0 HA PRO A 73 -19.881 9.581 2.321 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -22.303 9.924 1.025 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -21.224 11.271 1.330 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -21.761 9.839 -1.264 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -21.255 11.498 -1.013 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -19.538 9.374 -1.809 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -18.997 10.931 -1.214 1.00 0.00 H new ATOM 1124 N GLY A 74 -20.049 7.024 2.017 1.00 0.00 N ATOM 1125 CA GLY A 74 -20.513 5.612 2.118 1.00 0.00 C ATOM 1126 C GLY A 74 -19.738 4.754 1.117 1.00 0.00 C ATOM 1127 O GLY A 74 -20.089 3.622 0.849 1.00 0.00 O ATOM 0 H GLY A 74 -19.154 7.219 2.465 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -20.360 5.238 3.130 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -21.582 5.553 1.914 1.00 0.00 H new ATOM 1131 N ASN A 75 -18.685 5.288 0.561 1.00 0.00 N ATOM 1132 CA ASN A 75 -17.882 4.510 -0.425 1.00 0.00 C ATOM 1133 C ASN A 75 -16.444 5.029 -0.429 1.00 0.00 C ATOM 1134 O ASN A 75 -16.066 5.843 0.390 1.00 0.00 O ATOM 1135 CB ASN A 75 -18.488 4.676 -1.821 1.00 0.00 C ATOM 1136 CG ASN A 75 -19.912 4.116 -1.831 1.00 0.00 C ATOM 1137 OD1 ASN A 75 -20.105 2.918 -1.821 1.00 0.00 O ATOM 1138 ND2 ASN A 75 -20.923 4.940 -1.852 1.00 0.00 N ATOM 0 H ASN A 75 -18.345 6.232 0.747 1.00 0.00 H new ATOM 0 HA ASN A 75 -17.889 3.455 -0.150 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -18.498 5.729 -2.101 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -17.876 4.156 -2.558 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -21.876 4.577 -1.860 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -20.760 5.947 -1.860 1.00 0.00 H new ATOM 1145 N VAL A 76 -15.635 4.567 -1.343 1.00 0.00 N ATOM 1146 CA VAL A 76 -14.226 5.032 -1.397 1.00 0.00 C ATOM 1147 C VAL A 76 -13.615 4.613 -2.739 1.00 0.00 C ATOM 1148 O VAL A 76 -13.984 3.609 -3.314 1.00 0.00 O ATOM 1149 CB VAL A 76 -13.447 4.398 -0.236 1.00 0.00 C ATOM 1150 CG1 VAL A 76 -11.955 4.338 -0.572 1.00 0.00 C ATOM 1151 CG2 VAL A 76 -13.647 5.240 1.026 1.00 0.00 C ATOM 0 H VAL A 76 -15.893 3.885 -2.056 1.00 0.00 H new ATOM 0 HA VAL A 76 -14.179 6.117 -1.307 1.00 0.00 H new ATOM 0 HB VAL A 76 -13.816 3.386 -0.070 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -11.413 3.886 0.259 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -11.808 3.738 -1.470 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -11.580 5.347 -0.744 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -13.095 4.793 1.853 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -13.281 6.252 0.850 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -14.708 5.276 1.275 1.00 0.00 H new ATOM 1161 N THR A 77 -12.681 5.373 -3.237 1.00 0.00 N ATOM 1162 CA THR A 77 -12.043 5.018 -4.535 1.00 0.00 C ATOM 1163 C THR A 77 -10.681 5.706 -4.634 1.00 0.00 C ATOM 1164 O THR A 77 -10.511 6.829 -4.204 1.00 0.00 O ATOM 1165 CB THR A 77 -12.937 5.478 -5.691 1.00 0.00 C ATOM 1166 OG1 THR A 77 -13.792 6.523 -5.239 1.00 0.00 O ATOM 1167 CG2 THR A 77 -13.775 4.296 -6.187 1.00 0.00 C ATOM 0 H THR A 77 -12.331 6.226 -2.801 1.00 0.00 H new ATOM 0 HA THR A 77 -11.911 3.938 -4.592 1.00 0.00 H new ATOM 0 HB THR A 77 -12.320 5.848 -6.510 1.00 0.00 H new ATOM 0 HG1 THR A 77 -14.364 6.820 -5.977 1.00 0.00 H new ATOM 0 HG21 THR A 77 -14.412 4.621 -7.010 1.00 0.00 H new ATOM 0 HG22 THR A 77 -13.114 3.501 -6.532 1.00 0.00 H new ATOM 0 HG23 THR A 77 -14.396 3.923 -5.373 1.00 0.00 H new ATOM 1175 N VAL A 78 -9.707 5.042 -5.193 1.00 0.00 N ATOM 1176 CA VAL A 78 -8.360 5.664 -5.310 1.00 0.00 C ATOM 1177 C VAL A 78 -7.635 5.105 -6.536 1.00 0.00 C ATOM 1178 O VAL A 78 -7.672 3.921 -6.806 1.00 0.00 O ATOM 1179 CB VAL A 78 -7.549 5.355 -4.048 1.00 0.00 C ATOM 1180 CG1 VAL A 78 -8.415 5.605 -2.813 1.00 0.00 C ATOM 1181 CG2 VAL A 78 -7.107 3.889 -4.069 1.00 0.00 C ATOM 0 H VAL A 78 -9.786 4.099 -5.572 1.00 0.00 H new ATOM 0 HA VAL A 78 -8.468 6.743 -5.421 1.00 0.00 H new ATOM 0 HB VAL A 78 -6.670 5.999 -4.015 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -7.839 5.385 -1.914 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -8.731 6.648 -2.795 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -9.293 4.960 -2.848 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -6.530 3.670 -3.171 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -7.985 3.245 -4.102 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -6.491 3.707 -4.949 1.00 0.00 H new ATOM 1191 N LEU A 79 -6.971 5.950 -7.277 1.00 0.00 N ATOM 1192 CA LEU A 79 -6.238 5.473 -8.482 1.00 0.00 C ATOM 1193 C LEU A 79 -4.735 5.490 -8.196 1.00 0.00 C ATOM 1194 O LEU A 79 -4.276 6.154 -7.288 1.00 0.00 O ATOM 1195 CB LEU A 79 -6.547 6.394 -9.664 1.00 0.00 C ATOM 1196 CG LEU A 79 -8.052 6.664 -9.719 1.00 0.00 C ATOM 1197 CD1 LEU A 79 -8.324 8.124 -9.352 1.00 0.00 C ATOM 1198 CD2 LEU A 79 -8.566 6.389 -11.134 1.00 0.00 C ATOM 0 H LEU A 79 -6.905 6.952 -7.099 1.00 0.00 H new ATOM 0 HA LEU A 79 -6.551 4.458 -8.725 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -6.002 7.332 -9.560 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -6.215 5.933 -10.594 1.00 0.00 H new ATOM 0 HG LEU A 79 -8.564 6.012 -9.012 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -9.396 8.315 -9.391 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -7.957 8.320 -8.345 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -7.813 8.778 -10.058 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -9.638 6.581 -11.175 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -8.053 7.042 -11.841 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -8.373 5.348 -11.395 1.00 0.00 H new ATOM 1210 N ALA A 80 -3.963 4.764 -8.957 1.00 0.00 N ATOM 1211 CA ALA A 80 -2.493 4.745 -8.713 1.00 0.00 C ATOM 1212 C ALA A 80 -1.750 4.512 -10.030 1.00 0.00 C ATOM 1213 O ALA A 80 -2.350 4.300 -11.065 1.00 0.00 O ATOM 1214 CB ALA A 80 -2.156 3.618 -7.734 1.00 0.00 C ATOM 0 H ALA A 80 -4.284 4.186 -9.733 1.00 0.00 H new ATOM 0 HA ALA A 80 -2.186 5.703 -8.292 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -1.081 3.602 -7.554 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -2.679 3.785 -6.793 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -2.467 2.663 -8.157 1.00 0.00 H new ATOM 1220 N ASP A 81 -0.445 4.551 -9.997 1.00 0.00 N ATOM 1221 CA ASP A 81 0.341 4.330 -11.241 1.00 0.00 C ATOM 1222 C ASP A 81 0.789 2.869 -11.305 1.00 0.00 C ATOM 1223 O ASP A 81 0.569 2.185 -12.285 1.00 0.00 O ATOM 1224 CB ASP A 81 1.571 5.243 -11.236 1.00 0.00 C ATOM 1225 CG ASP A 81 1.770 5.843 -12.629 1.00 0.00 C ATOM 1226 OD1 ASP A 81 0.976 6.687 -13.008 1.00 0.00 O ATOM 1227 OD2 ASP A 81 2.715 5.449 -13.293 1.00 0.00 O ATOM 0 H ASP A 81 0.110 4.727 -9.159 1.00 0.00 H new ATOM 0 HA ASP A 81 -0.277 4.559 -12.109 1.00 0.00 H new ATOM 0 HB2 ASP A 81 1.443 6.038 -10.501 1.00 0.00 H new ATOM 0 HB3 ASP A 81 2.455 4.677 -10.943 1.00 0.00 H new ATOM 1232 N THR A 82 1.410 2.382 -10.265 1.00 0.00 N ATOM 1233 CA THR A 82 1.866 0.962 -10.265 1.00 0.00 C ATOM 1234 C THR A 82 0.898 0.118 -9.432 1.00 0.00 C ATOM 1235 O THR A 82 -0.099 0.607 -8.940 1.00 0.00 O ATOM 1236 CB THR A 82 3.274 0.878 -9.667 1.00 0.00 C ATOM 1237 OG1 THR A 82 3.844 -0.386 -9.979 1.00 0.00 O ATOM 1238 CG2 THR A 82 3.203 1.046 -8.148 1.00 0.00 C ATOM 0 H THR A 82 1.621 2.906 -9.416 1.00 0.00 H new ATOM 0 HA THR A 82 1.887 0.584 -11.287 1.00 0.00 H new ATOM 0 HB THR A 82 3.892 1.672 -10.086 1.00 0.00 H new ATOM 0 HG1 THR A 82 4.817 -0.298 -10.049 1.00 0.00 H new ATOM 0 HG21 THR A 82 4.207 0.985 -7.728 1.00 0.00 H new ATOM 0 HG22 THR A 82 2.768 2.016 -7.909 1.00 0.00 H new ATOM 0 HG23 THR A 82 2.584 0.256 -7.723 1.00 0.00 H new ATOM 1246 N ALA A 83 1.183 -1.145 -9.269 1.00 0.00 N ATOM 1247 CA ALA A 83 0.274 -2.011 -8.466 1.00 0.00 C ATOM 1248 C ALA A 83 0.955 -3.351 -8.183 1.00 0.00 C ATOM 1249 O ALA A 83 0.701 -4.339 -8.844 1.00 0.00 O ATOM 1250 CB ALA A 83 -1.020 -2.255 -9.245 1.00 0.00 C ATOM 0 H ALA A 83 2.003 -1.613 -9.655 1.00 0.00 H new ATOM 0 HA ALA A 83 0.045 -1.514 -7.523 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -1.685 -2.888 -8.657 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -1.510 -1.302 -9.445 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -0.789 -2.749 -10.189 1.00 0.00 H new ATOM 1256 N ILE A 84 1.814 -3.396 -7.202 1.00 0.00 N ATOM 1257 CA ILE A 84 2.504 -4.672 -6.875 1.00 0.00 C ATOM 1258 C ILE A 84 1.954 -5.219 -5.554 1.00 0.00 C ATOM 1259 O ILE A 84 2.615 -5.183 -4.536 1.00 0.00 O ATOM 1260 CB ILE A 84 4.005 -4.415 -6.735 1.00 0.00 C ATOM 1261 CG1 ILE A 84 4.589 -4.048 -8.102 1.00 0.00 C ATOM 1262 CG2 ILE A 84 4.689 -5.678 -6.210 1.00 0.00 C ATOM 1263 CD1 ILE A 84 4.273 -2.584 -8.415 1.00 0.00 C ATOM 0 H ILE A 84 2.067 -2.602 -6.613 1.00 0.00 H new ATOM 0 HA ILE A 84 2.332 -5.397 -7.670 1.00 0.00 H new ATOM 0 HB ILE A 84 4.171 -3.594 -6.037 1.00 0.00 H new ATOM 0 HG12 ILE A 84 5.667 -4.207 -8.103 1.00 0.00 H new ATOM 0 HG13 ILE A 84 4.171 -4.694 -8.874 1.00 0.00 H new ATOM 0 HG21 ILE A 84 5.759 -5.497 -6.109 1.00 0.00 H new ATOM 0 HG22 ILE A 84 4.272 -5.940 -5.237 1.00 0.00 H new ATOM 0 HG23 ILE A 84 4.524 -6.498 -6.908 1.00 0.00 H new ATOM 0 HD11 ILE A 84 4.689 -2.322 -9.388 1.00 0.00 H new ATOM 0 HD12 ILE A 84 3.193 -2.440 -8.431 1.00 0.00 H new ATOM 0 HD13 ILE A 84 4.712 -1.945 -7.649 1.00 0.00 H new ATOM 1275 N ARG A 85 0.749 -5.724 -5.563 1.00 0.00 N ATOM 1276 CA ARG A 85 0.155 -6.270 -4.307 1.00 0.00 C ATOM 1277 C ARG A 85 1.205 -7.092 -3.559 1.00 0.00 C ATOM 1278 O ARG A 85 2.131 -7.617 -4.145 1.00 0.00 O ATOM 1279 CB ARG A 85 -1.040 -7.164 -4.649 1.00 0.00 C ATOM 1280 CG ARG A 85 -1.916 -7.348 -3.406 1.00 0.00 C ATOM 1281 CD ARG A 85 -3.075 -8.295 -3.732 1.00 0.00 C ATOM 1282 NE ARG A 85 -3.716 -8.754 -2.468 1.00 0.00 N ATOM 1283 CZ ARG A 85 -5.008 -8.944 -2.423 1.00 0.00 C ATOM 1284 NH1 ARG A 85 -5.592 -9.682 -3.329 1.00 0.00 N ATOM 1285 NH2 ARG A 85 -5.716 -8.399 -1.470 1.00 0.00 N ATOM 0 H ARG A 85 0.150 -5.782 -6.386 1.00 0.00 H new ATOM 0 HA ARG A 85 -0.177 -5.444 -3.678 1.00 0.00 H new ATOM 0 HB2 ARG A 85 -1.623 -6.717 -5.454 1.00 0.00 H new ATOM 0 HB3 ARG A 85 -0.692 -8.133 -5.008 1.00 0.00 H new ATOM 0 HG2 ARG A 85 -1.322 -7.752 -2.586 1.00 0.00 H new ATOM 0 HG3 ARG A 85 -2.302 -6.384 -3.075 1.00 0.00 H new ATOM 0 HD2 ARG A 85 -3.807 -7.787 -4.359 1.00 0.00 H new ATOM 0 HD3 ARG A 85 -2.710 -9.152 -4.298 1.00 0.00 H new ATOM 0 HE ARG A 85 -3.147 -8.920 -1.638 1.00 0.00 H new ATOM 0 HH11 ARG A 85 -5.039 -10.110 -4.072 1.00 0.00 H new ATOM 0 HH12 ARG A 85 -6.601 -9.830 -3.294 1.00 0.00 H new ATOM 0 HH21 ARG A 85 -5.260 -7.825 -0.761 1.00 0.00 H new ATOM 0 HH22 ARG A 85 -6.725 -8.548 -1.435 1.00 0.00 H new ATOM 1299 N GLY A 86 1.070 -7.206 -2.265 1.00 0.00 N ATOM 1300 CA GLY A 86 2.059 -7.994 -1.479 1.00 0.00 C ATOM 1301 C GLY A 86 2.332 -9.324 -2.184 1.00 0.00 C ATOM 1302 O GLY A 86 3.466 -9.689 -2.426 1.00 0.00 O ATOM 0 H GLY A 86 0.317 -6.787 -1.719 1.00 0.00 H new ATOM 0 HA2 GLY A 86 2.986 -7.430 -1.372 1.00 0.00 H new ATOM 0 HA3 GLY A 86 1.678 -8.175 -0.474 1.00 0.00 H new ATOM 1306 N GLN A 87 1.302 -10.052 -2.514 1.00 0.00 N ATOM 1307 CA GLN A 87 1.502 -11.359 -3.202 1.00 0.00 C ATOM 1308 C GLN A 87 1.103 -11.229 -4.674 1.00 0.00 C ATOM 1309 O GLN A 87 0.360 -12.034 -5.198 1.00 0.00 O ATOM 1310 CB GLN A 87 0.636 -12.426 -2.534 1.00 0.00 C ATOM 1311 CG GLN A 87 -0.713 -11.816 -2.144 1.00 0.00 C ATOM 1312 CD GLN A 87 -1.689 -12.932 -1.769 1.00 0.00 C ATOM 1313 OE1 GLN A 87 -1.550 -14.053 -2.214 1.00 0.00 O ATOM 1314 NE2 GLN A 87 -2.680 -12.668 -0.962 1.00 0.00 N ATOM 0 H GLN A 87 0.330 -9.799 -2.337 1.00 0.00 H new ATOM 0 HA GLN A 87 2.551 -11.646 -3.133 1.00 0.00 H new ATOM 0 HB2 GLN A 87 0.485 -13.265 -3.213 1.00 0.00 H new ATOM 0 HB3 GLN A 87 1.139 -12.818 -1.650 1.00 0.00 H new ATOM 0 HG2 GLN A 87 -0.586 -11.133 -1.304 1.00 0.00 H new ATOM 0 HG3 GLN A 87 -1.113 -11.232 -2.973 1.00 0.00 H new ATOM 0 HE21 GLN A 87 -2.796 -11.726 -0.588 1.00 0.00 H new ATOM 0 HE22 GLN A 87 -3.338 -13.404 -0.705 1.00 0.00 H new ATOM 1323 N ASP A 88 1.591 -10.223 -5.344 1.00 0.00 N ATOM 1324 CA ASP A 88 1.239 -10.045 -6.781 1.00 0.00 C ATOM 1325 C ASP A 88 2.352 -10.631 -7.650 1.00 0.00 C ATOM 1326 O ASP A 88 2.124 -11.061 -8.763 1.00 0.00 O ATOM 1327 CB ASP A 88 1.082 -8.555 -7.088 1.00 0.00 C ATOM 1328 CG ASP A 88 -0.171 -8.339 -7.937 1.00 0.00 C ATOM 1329 OD1 ASP A 88 -0.199 -8.828 -9.054 1.00 0.00 O ATOM 1330 OD2 ASP A 88 -1.084 -7.687 -7.456 1.00 0.00 O ATOM 0 H ASP A 88 2.218 -9.516 -4.959 1.00 0.00 H new ATOM 0 HA ASP A 88 0.301 -10.558 -6.993 1.00 0.00 H new ATOM 0 HB2 ASP A 88 1.008 -7.987 -6.160 1.00 0.00 H new ATOM 0 HB3 ASP A 88 1.961 -8.187 -7.617 1.00 0.00 H new ATOM 1335 N LEU A 89 3.555 -10.651 -7.149 1.00 0.00 N ATOM 1336 CA LEU A 89 4.684 -11.211 -7.941 1.00 0.00 C ATOM 1337 C LEU A 89 5.353 -12.332 -7.147 1.00 0.00 C ATOM 1338 O LEU A 89 4.902 -12.707 -6.081 1.00 0.00 O ATOM 1339 CB LEU A 89 5.706 -10.109 -8.223 1.00 0.00 C ATOM 1340 CG LEU A 89 5.299 -9.340 -9.480 1.00 0.00 C ATOM 1341 CD1 LEU A 89 5.787 -7.894 -9.373 1.00 0.00 C ATOM 1342 CD2 LEU A 89 5.930 -10.001 -10.707 1.00 0.00 C ATOM 0 H LEU A 89 3.805 -10.303 -6.223 1.00 0.00 H new ATOM 0 HA LEU A 89 4.306 -11.606 -8.884 1.00 0.00 H new ATOM 0 HB2 LEU A 89 5.767 -9.430 -7.373 1.00 0.00 H new ATOM 0 HB3 LEU A 89 6.697 -10.543 -8.355 1.00 0.00 H new ATOM 0 HG LEU A 89 4.213 -9.351 -9.578 1.00 0.00 H new ATOM 0 HD11 LEU A 89 5.497 -7.345 -10.269 1.00 0.00 H new ATOM 0 HD12 LEU A 89 5.339 -7.423 -8.498 1.00 0.00 H new ATOM 0 HD13 LEU A 89 6.873 -7.883 -9.276 1.00 0.00 H new ATOM 0 HD21 LEU A 89 5.641 -9.454 -11.604 1.00 0.00 H new ATOM 0 HD22 LEU A 89 7.016 -9.989 -10.609 1.00 0.00 H new ATOM 0 HD23 LEU A 89 5.584 -11.032 -10.783 1.00 0.00 H new ATOM 1354 N ASP A 90 6.428 -12.870 -7.652 1.00 0.00 N ATOM 1355 CA ASP A 90 7.127 -13.962 -6.922 1.00 0.00 C ATOM 1356 C ASP A 90 7.450 -13.496 -5.502 1.00 0.00 C ATOM 1357 O ASP A 90 7.153 -12.381 -5.120 1.00 0.00 O ATOM 1358 CB ASP A 90 8.424 -14.312 -7.654 1.00 0.00 C ATOM 1359 CG ASP A 90 8.839 -15.741 -7.301 1.00 0.00 C ATOM 1360 OD1 ASP A 90 8.059 -16.643 -7.559 1.00 0.00 O ATOM 1361 OD2 ASP A 90 9.929 -15.909 -6.778 1.00 0.00 O ATOM 0 H ASP A 90 6.852 -12.600 -8.539 1.00 0.00 H new ATOM 0 HA ASP A 90 6.486 -14.843 -6.878 1.00 0.00 H new ATOM 0 HB2 ASP A 90 8.283 -14.218 -8.731 1.00 0.00 H new ATOM 0 HB3 ASP A 90 9.212 -13.613 -7.374 1.00 0.00 H new ATOM 1366 N GLU A 91 8.057 -14.341 -4.713 1.00 0.00 N ATOM 1367 CA GLU A 91 8.398 -13.945 -3.317 1.00 0.00 C ATOM 1368 C GLU A 91 9.902 -13.688 -3.214 1.00 0.00 C ATOM 1369 O GLU A 91 10.345 -12.822 -2.486 1.00 0.00 O ATOM 1370 CB GLU A 91 8.004 -15.073 -2.361 1.00 0.00 C ATOM 1371 CG GLU A 91 6.564 -15.500 -2.641 1.00 0.00 C ATOM 1372 CD GLU A 91 6.105 -16.488 -1.567 1.00 0.00 C ATOM 1373 OE1 GLU A 91 6.606 -16.400 -0.459 1.00 0.00 O ATOM 1374 OE2 GLU A 91 5.262 -17.316 -1.872 1.00 0.00 O ATOM 0 H GLU A 91 8.331 -15.288 -4.975 1.00 0.00 H new ATOM 0 HA GLU A 91 7.857 -13.037 -3.051 1.00 0.00 H new ATOM 0 HB2 GLU A 91 8.677 -15.921 -2.486 1.00 0.00 H new ATOM 0 HB3 GLU A 91 8.101 -14.739 -1.328 1.00 0.00 H new ATOM 0 HG2 GLU A 91 5.910 -14.628 -2.651 1.00 0.00 H new ATOM 0 HG3 GLU A 91 6.495 -15.960 -3.627 1.00 0.00 H new ATOM 1381 N ALA A 92 10.691 -14.433 -3.939 1.00 0.00 N ATOM 1382 CA ALA A 92 12.167 -14.233 -3.885 1.00 0.00 C ATOM 1383 C ALA A 92 12.566 -13.121 -4.856 1.00 0.00 C ATOM 1384 O ALA A 92 13.579 -12.471 -4.687 1.00 0.00 O ATOM 1385 CB ALA A 92 12.872 -15.531 -4.279 1.00 0.00 C ATOM 0 H ALA A 92 10.377 -15.173 -4.567 1.00 0.00 H new ATOM 0 HA ALA A 92 12.459 -13.954 -2.873 1.00 0.00 H new ATOM 0 HB1 ALA A 92 13.951 -15.385 -4.240 1.00 0.00 H new ATOM 0 HB2 ALA A 92 12.588 -16.324 -3.587 1.00 0.00 H new ATOM 0 HB3 ALA A 92 12.580 -15.811 -5.291 1.00 0.00 H new ATOM 1391 N ARG A 93 11.779 -12.896 -5.873 1.00 0.00 N ATOM 1392 CA ARG A 93 12.116 -11.826 -6.853 1.00 0.00 C ATOM 1393 C ARG A 93 11.886 -10.456 -6.211 1.00 0.00 C ATOM 1394 O ARG A 93 12.224 -9.433 -6.772 1.00 0.00 O ATOM 1395 CB ARG A 93 11.223 -11.967 -8.087 1.00 0.00 C ATOM 1396 CG ARG A 93 12.061 -11.763 -9.351 1.00 0.00 C ATOM 1397 CD ARG A 93 11.792 -10.370 -9.923 1.00 0.00 C ATOM 1398 NE ARG A 93 12.135 -10.354 -11.373 1.00 0.00 N ATOM 1399 CZ ARG A 93 13.291 -9.887 -11.763 1.00 0.00 C ATOM 1400 NH1 ARG A 93 13.426 -8.616 -12.029 1.00 0.00 N ATOM 1401 NH2 ARG A 93 14.309 -10.693 -11.892 1.00 0.00 N ATOM 0 H ARG A 93 10.918 -13.407 -6.067 1.00 0.00 H new ATOM 0 HA ARG A 93 13.161 -11.918 -7.148 1.00 0.00 H new ATOM 0 HB2 ARG A 93 10.758 -12.953 -8.102 1.00 0.00 H new ATOM 0 HB3 ARG A 93 10.416 -11.235 -8.051 1.00 0.00 H new ATOM 0 HG2 ARG A 93 13.120 -11.874 -9.120 1.00 0.00 H new ATOM 0 HG3 ARG A 93 11.815 -12.525 -10.090 1.00 0.00 H new ATOM 0 HD2 ARG A 93 10.744 -10.104 -9.783 1.00 0.00 H new ATOM 0 HD3 ARG A 93 12.384 -9.626 -9.390 1.00 0.00 H new ATOM 0 HE ARG A 93 11.468 -10.707 -12.060 1.00 0.00 H new ATOM 0 HH11 ARG A 93 12.629 -7.987 -11.932 1.00 0.00 H new ATOM 0 HH12 ARG A 93 14.329 -8.252 -12.333 1.00 0.00 H new ATOM 0 HH21 ARG A 93 14.202 -11.687 -11.688 1.00 0.00 H new ATOM 0 HH22 ARG A 93 15.212 -10.329 -12.196 1.00 0.00 H new ATOM 1415 N ALA A 94 11.317 -10.427 -5.035 1.00 0.00 N ATOM 1416 CA ALA A 94 11.070 -9.124 -4.358 1.00 0.00 C ATOM 1417 C ALA A 94 12.277 -8.773 -3.489 1.00 0.00 C ATOM 1418 O ALA A 94 12.532 -7.621 -3.195 1.00 0.00 O ATOM 1419 CB ALA A 94 9.823 -9.234 -3.477 1.00 0.00 C ATOM 0 H ALA A 94 11.013 -11.250 -4.515 1.00 0.00 H new ATOM 0 HA ALA A 94 10.917 -8.346 -5.106 1.00 0.00 H new ATOM 0 HB1 ALA A 94 9.642 -8.280 -2.981 1.00 0.00 H new ATOM 0 HB2 ALA A 94 8.962 -9.491 -4.095 1.00 0.00 H new ATOM 0 HB3 ALA A 94 9.975 -10.010 -2.726 1.00 0.00 H new ATOM 1425 N MET A 95 13.021 -9.760 -3.076 1.00 0.00 N ATOM 1426 CA MET A 95 14.212 -9.494 -2.225 1.00 0.00 C ATOM 1427 C MET A 95 15.380 -9.047 -3.107 1.00 0.00 C ATOM 1428 O MET A 95 16.218 -8.270 -2.696 1.00 0.00 O ATOM 1429 CB MET A 95 14.593 -10.774 -1.480 1.00 0.00 C ATOM 1430 CG MET A 95 14.186 -10.652 -0.012 1.00 0.00 C ATOM 1431 SD MET A 95 15.067 -11.894 0.965 1.00 0.00 S ATOM 1432 CE MET A 95 15.227 -10.919 2.480 1.00 0.00 C ATOM 0 H MET A 95 12.854 -10.743 -3.292 1.00 0.00 H new ATOM 0 HA MET A 95 13.982 -8.707 -1.506 1.00 0.00 H new ATOM 0 HB2 MET A 95 14.099 -11.633 -1.935 1.00 0.00 H new ATOM 0 HB3 MET A 95 15.667 -10.946 -1.557 1.00 0.00 H new ATOM 0 HG2 MET A 95 14.416 -9.653 0.358 1.00 0.00 H new ATOM 0 HG3 MET A 95 13.110 -10.790 0.090 1.00 0.00 H new ATOM 0 HE1 MET A 95 15.752 -11.504 3.235 1.00 0.00 H new ATOM 0 HE2 MET A 95 15.790 -10.009 2.270 1.00 0.00 H new ATOM 0 HE3 MET A 95 14.236 -10.655 2.849 1.00 0.00 H new ATOM 1442 N GLU A 96 15.442 -9.533 -4.316 1.00 0.00 N ATOM 1443 CA GLU A 96 16.555 -9.137 -5.224 1.00 0.00 C ATOM 1444 C GLU A 96 16.383 -7.673 -5.639 1.00 0.00 C ATOM 1445 O GLU A 96 17.228 -7.102 -6.299 1.00 0.00 O ATOM 1446 CB GLU A 96 16.536 -10.026 -6.470 1.00 0.00 C ATOM 1447 CG GLU A 96 17.808 -10.874 -6.513 1.00 0.00 C ATOM 1448 CD GLU A 96 19.001 -9.988 -6.873 1.00 0.00 C ATOM 1449 OE1 GLU A 96 19.400 -9.196 -6.035 1.00 0.00 O ATOM 1450 OE2 GLU A 96 19.496 -10.115 -7.981 1.00 0.00 O ATOM 0 H GLU A 96 14.769 -10.188 -4.715 1.00 0.00 H new ATOM 0 HA GLU A 96 17.506 -9.256 -4.705 1.00 0.00 H new ATOM 0 HB2 GLU A 96 15.657 -10.671 -6.456 1.00 0.00 H new ATOM 0 HB3 GLU A 96 16.466 -9.411 -7.367 1.00 0.00 H new ATOM 0 HG2 GLU A 96 17.973 -11.349 -5.546 1.00 0.00 H new ATOM 0 HG3 GLU A 96 17.700 -11.673 -7.247 1.00 0.00 H new ATOM 1457 N ALA A 97 15.294 -7.060 -5.257 1.00 0.00 N ATOM 1458 CA ALA A 97 15.071 -5.635 -5.632 1.00 0.00 C ATOM 1459 C ALA A 97 15.872 -4.728 -4.695 1.00 0.00 C ATOM 1460 O ALA A 97 16.186 -3.601 -5.026 1.00 0.00 O ATOM 1461 CB ALA A 97 13.582 -5.304 -5.514 1.00 0.00 C ATOM 0 H ALA A 97 14.551 -7.485 -4.702 1.00 0.00 H new ATOM 0 HA ALA A 97 15.399 -5.474 -6.659 1.00 0.00 H new ATOM 0 HB1 ALA A 97 13.418 -4.262 -5.788 1.00 0.00 H new ATOM 0 HB2 ALA A 97 13.012 -5.949 -6.182 1.00 0.00 H new ATOM 0 HB3 ALA A 97 13.254 -5.465 -4.487 1.00 0.00 H new ATOM 1467 N LYS A 98 16.204 -5.208 -3.527 1.00 0.00 N ATOM 1468 CA LYS A 98 16.985 -4.369 -2.574 1.00 0.00 C ATOM 1469 C LYS A 98 18.471 -4.443 -2.929 1.00 0.00 C ATOM 1470 O LYS A 98 19.174 -3.452 -2.902 1.00 0.00 O ATOM 1471 CB LYS A 98 16.778 -4.888 -1.148 1.00 0.00 C ATOM 1472 CG LYS A 98 16.265 -3.750 -0.261 1.00 0.00 C ATOM 1473 CD LYS A 98 17.384 -3.288 0.677 1.00 0.00 C ATOM 1474 CE LYS A 98 16.844 -3.187 2.105 1.00 0.00 C ATOM 1475 NZ LYS A 98 16.839 -4.539 2.733 1.00 0.00 N ATOM 0 H LYS A 98 15.969 -6.142 -3.192 1.00 0.00 H new ATOM 0 HA LYS A 98 16.645 -3.335 -2.639 1.00 0.00 H new ATOM 0 HB2 LYS A 98 16.065 -5.712 -1.149 1.00 0.00 H new ATOM 0 HB3 LYS A 98 17.715 -5.278 -0.752 1.00 0.00 H new ATOM 0 HG2 LYS A 98 15.927 -2.918 -0.878 1.00 0.00 H new ATOM 0 HG3 LYS A 98 15.406 -4.086 0.319 1.00 0.00 H new ATOM 0 HD2 LYS A 98 18.217 -3.990 0.641 1.00 0.00 H new ATOM 0 HD3 LYS A 98 17.768 -2.321 0.353 1.00 0.00 H new ATOM 0 HE2 LYS A 98 17.460 -2.505 2.691 1.00 0.00 H new ATOM 0 HE3 LYS A 98 15.835 -2.776 2.095 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 16.472 -4.470 3.704 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 16.233 -5.177 2.178 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 17.808 -4.915 2.756 1.00 0.00 H new ATOM 1489 N ARG A 99 18.956 -5.607 -3.261 1.00 0.00 N ATOM 1490 CA ARG A 99 20.396 -5.742 -3.618 1.00 0.00 C ATOM 1491 C ARG A 99 20.702 -4.881 -4.845 1.00 0.00 C ATOM 1492 O ARG A 99 21.815 -4.433 -5.039 1.00 0.00 O ATOM 1493 CB ARG A 99 20.709 -7.207 -3.929 1.00 0.00 C ATOM 1494 CG ARG A 99 21.419 -7.842 -2.733 1.00 0.00 C ATOM 1495 CD ARG A 99 22.251 -9.035 -3.205 1.00 0.00 C ATOM 1496 NE ARG A 99 23.630 -8.580 -3.535 1.00 0.00 N ATOM 1497 CZ ARG A 99 24.009 -8.496 -4.781 1.00 0.00 C ATOM 1498 NH1 ARG A 99 23.761 -7.413 -5.465 1.00 0.00 N ATOM 1499 NH2 ARG A 99 24.634 -9.494 -5.343 1.00 0.00 N ATOM 0 H ARG A 99 18.417 -6.472 -3.301 1.00 0.00 H new ATOM 0 HA ARG A 99 21.010 -5.410 -2.781 1.00 0.00 H new ATOM 0 HB2 ARG A 99 19.788 -7.748 -4.148 1.00 0.00 H new ATOM 0 HB3 ARG A 99 21.338 -7.275 -4.817 1.00 0.00 H new ATOM 0 HG2 ARG A 99 22.061 -7.108 -2.246 1.00 0.00 H new ATOM 0 HG3 ARG A 99 20.687 -8.166 -1.993 1.00 0.00 H new ATOM 0 HD2 ARG A 99 22.285 -9.798 -2.428 1.00 0.00 H new ATOM 0 HD3 ARG A 99 21.788 -9.491 -4.080 1.00 0.00 H new ATOM 0 HE ARG A 99 24.278 -8.334 -2.787 1.00 0.00 H new ATOM 0 HH11 ARG A 99 23.271 -6.633 -5.026 1.00 0.00 H new ATOM 0 HH12 ARG A 99 24.057 -7.346 -6.439 1.00 0.00 H new ATOM 0 HH21 ARG A 99 24.827 -10.341 -4.808 1.00 0.00 H new ATOM 0 HH22 ARG A 99 24.930 -9.427 -6.317 1.00 0.00 H new ATOM 1513 N LYS A 100 19.723 -4.644 -5.677 1.00 0.00 N ATOM 1514 CA LYS A 100 19.963 -3.812 -6.889 1.00 0.00 C ATOM 1515 C LYS A 100 19.775 -2.334 -6.539 1.00 0.00 C ATOM 1516 O LYS A 100 20.279 -1.457 -7.213 1.00 0.00 O ATOM 1517 CB LYS A 100 18.973 -4.207 -7.986 1.00 0.00 C ATOM 1518 CG LYS A 100 17.543 -4.019 -7.477 1.00 0.00 C ATOM 1519 CD LYS A 100 16.566 -4.117 -8.649 1.00 0.00 C ATOM 1520 CE LYS A 100 16.882 -5.365 -9.475 1.00 0.00 C ATOM 1521 NZ LYS A 100 15.887 -5.497 -10.577 1.00 0.00 N ATOM 0 H LYS A 100 18.770 -4.990 -5.569 1.00 0.00 H new ATOM 0 HA LYS A 100 20.981 -3.975 -7.244 1.00 0.00 H new ATOM 0 HB2 LYS A 100 19.137 -3.597 -8.875 1.00 0.00 H new ATOM 0 HB3 LYS A 100 19.133 -5.245 -8.278 1.00 0.00 H new ATOM 0 HG2 LYS A 100 17.309 -4.778 -6.731 1.00 0.00 H new ATOM 0 HG3 LYS A 100 17.444 -3.050 -6.988 1.00 0.00 H new ATOM 0 HD2 LYS A 100 15.542 -4.163 -8.279 1.00 0.00 H new ATOM 0 HD3 LYS A 100 16.640 -3.227 -9.273 1.00 0.00 H new ATOM 0 HE2 LYS A 100 17.889 -5.296 -9.886 1.00 0.00 H new ATOM 0 HE3 LYS A 100 16.857 -6.250 -8.840 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 16.102 -6.345 -11.139 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 14.932 -5.581 -10.174 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 15.932 -4.657 -11.188 1.00 0.00 H new ATOM 1535 N ALA A 101 19.055 -2.051 -5.489 1.00 0.00 N ATOM 1536 CA ALA A 101 18.837 -0.631 -5.095 1.00 0.00 C ATOM 1537 C ALA A 101 20.045 -0.135 -4.298 1.00 0.00 C ATOM 1538 O ALA A 101 20.343 1.042 -4.272 1.00 0.00 O ATOM 1539 CB ALA A 101 17.578 -0.530 -4.232 1.00 0.00 C ATOM 0 H ALA A 101 18.608 -2.742 -4.887 1.00 0.00 H new ATOM 0 HA ALA A 101 18.714 -0.018 -5.988 1.00 0.00 H new ATOM 0 HB1 ALA A 101 17.417 0.509 -3.943 1.00 0.00 H new ATOM 0 HB2 ALA A 101 16.718 -0.886 -4.800 1.00 0.00 H new ATOM 0 HB3 ALA A 101 17.700 -1.141 -3.337 1.00 0.00 H new ATOM 1545 N GLU A 102 20.744 -1.027 -3.651 1.00 0.00 N ATOM 1546 CA GLU A 102 21.934 -0.608 -2.858 1.00 0.00 C ATOM 1547 C GLU A 102 22.961 0.039 -3.788 1.00 0.00 C ATOM 1548 O GLU A 102 23.709 0.911 -3.392 1.00 0.00 O ATOM 1549 CB GLU A 102 22.554 -1.833 -2.185 1.00 0.00 C ATOM 1550 CG GLU A 102 23.925 -1.464 -1.615 1.00 0.00 C ATOM 1551 CD GLU A 102 24.252 -2.376 -0.431 1.00 0.00 C ATOM 1552 OE1 GLU A 102 23.881 -3.538 -0.483 1.00 0.00 O ATOM 1553 OE2 GLU A 102 24.868 -1.899 0.506 1.00 0.00 O ATOM 0 H GLU A 102 20.543 -2.027 -3.637 1.00 0.00 H new ATOM 0 HA GLU A 102 21.631 0.110 -2.096 1.00 0.00 H new ATOM 0 HB2 GLU A 102 21.902 -2.192 -1.389 1.00 0.00 H new ATOM 0 HB3 GLU A 102 22.655 -2.645 -2.905 1.00 0.00 H new ATOM 0 HG2 GLU A 102 24.689 -1.564 -2.386 1.00 0.00 H new ATOM 0 HG3 GLU A 102 23.929 -0.422 -1.296 1.00 0.00 H new ATOM 1560 N GLU A 103 23.005 -0.380 -5.023 1.00 0.00 N ATOM 1561 CA GLU A 103 23.985 0.212 -5.977 1.00 0.00 C ATOM 1562 C GLU A 103 23.789 1.728 -6.031 1.00 0.00 C ATOM 1563 O GLU A 103 24.721 2.477 -6.249 1.00 0.00 O ATOM 1564 CB GLU A 103 23.761 -0.380 -7.370 1.00 0.00 C ATOM 1565 CG GLU A 103 24.100 -1.873 -7.352 1.00 0.00 C ATOM 1566 CD GLU A 103 24.009 -2.436 -8.771 1.00 0.00 C ATOM 1567 OE1 GLU A 103 24.027 -1.649 -9.703 1.00 0.00 O ATOM 1568 OE2 GLU A 103 23.922 -3.646 -8.902 1.00 0.00 O ATOM 0 H GLU A 103 22.405 -1.107 -5.413 1.00 0.00 H new ATOM 0 HA GLU A 103 24.998 -0.013 -5.645 1.00 0.00 H new ATOM 0 HB2 GLU A 103 22.725 -0.235 -7.676 1.00 0.00 H new ATOM 0 HB3 GLU A 103 24.384 0.136 -8.100 1.00 0.00 H new ATOM 0 HG2 GLU A 103 25.103 -2.024 -6.954 1.00 0.00 H new ATOM 0 HG3 GLU A 103 23.413 -2.405 -6.694 1.00 0.00 H new ATOM 1575 N HIS A 104 22.584 2.186 -5.833 1.00 0.00 N ATOM 1576 CA HIS A 104 22.327 3.653 -5.873 1.00 0.00 C ATOM 1577 C HIS A 104 22.516 4.244 -4.473 1.00 0.00 C ATOM 1578 O HIS A 104 23.174 5.249 -4.297 1.00 0.00 O ATOM 1579 CB HIS A 104 20.893 3.904 -6.346 1.00 0.00 C ATOM 1580 CG HIS A 104 20.826 5.214 -7.081 1.00 0.00 C ATOM 1581 ND1 HIS A 104 19.642 5.917 -7.229 1.00 0.00 N ATOM 1582 CD2 HIS A 104 21.788 5.961 -7.717 1.00 0.00 C ATOM 1583 CE1 HIS A 104 19.917 7.034 -7.929 1.00 0.00 C ATOM 1584 NE2 HIS A 104 21.211 7.110 -8.251 1.00 0.00 N ATOM 0 H HIS A 104 21.765 1.607 -5.645 1.00 0.00 H new ATOM 0 HA HIS A 104 23.026 4.127 -6.562 1.00 0.00 H new ATOM 0 HB2 HIS A 104 20.567 3.093 -6.997 1.00 0.00 H new ATOM 0 HB3 HIS A 104 20.215 3.919 -5.492 1.00 0.00 H new ATOM 0 HD2 HIS A 104 22.833 5.697 -7.791 1.00 0.00 H new ATOM 0 HE1 HIS A 104 19.181 7.778 -8.197 1.00 0.00 H new ATOM 0 HE2 HIS A 104 21.676 7.851 -8.775 1.00 0.00 H new ATOM 1592 N ILE A 105 21.940 3.629 -3.474 1.00 0.00 N ATOM 1593 CA ILE A 105 22.083 4.154 -2.088 1.00 0.00 C ATOM 1594 C ILE A 105 23.357 3.589 -1.453 1.00 0.00 C ATOM 1595 O ILE A 105 23.547 3.658 -0.255 1.00 0.00 O ATOM 1596 CB ILE A 105 20.868 3.729 -1.264 1.00 0.00 C ATOM 1597 CG1 ILE A 105 19.594 3.983 -2.073 1.00 0.00 C ATOM 1598 CG2 ILE A 105 20.820 4.541 0.029 1.00 0.00 C ATOM 1599 CD1 ILE A 105 18.369 3.652 -1.217 1.00 0.00 C ATOM 0 H ILE A 105 21.376 2.784 -3.560 1.00 0.00 H new ATOM 0 HA ILE A 105 22.147 5.242 -2.113 1.00 0.00 H new ATOM 0 HB ILE A 105 20.943 2.669 -1.023 1.00 0.00 H new ATOM 0 HG12 ILE A 105 19.556 5.024 -2.393 1.00 0.00 H new ATOM 0 HG13 ILE A 105 19.596 3.372 -2.975 1.00 0.00 H new ATOM 0 HG21 ILE A 105 19.954 4.238 0.617 1.00 0.00 H new ATOM 0 HG22 ILE A 105 21.729 4.363 0.604 1.00 0.00 H new ATOM 0 HG23 ILE A 105 20.743 5.602 -0.210 1.00 0.00 H new ATOM 0 HD11 ILE A 105 17.462 3.833 -1.794 1.00 0.00 H new ATOM 0 HD12 ILE A 105 18.406 2.604 -0.919 1.00 0.00 H new ATOM 0 HD13 ILE A 105 18.365 4.282 -0.328 1.00 0.00 H new ATOM 1611 N SER A 106 24.229 3.030 -2.246 1.00 0.00 N ATOM 1612 CA SER A 106 25.488 2.461 -1.689 1.00 0.00 C ATOM 1613 C SER A 106 26.142 3.482 -0.757 1.00 0.00 C ATOM 1614 O SER A 106 26.896 4.334 -1.183 1.00 0.00 O ATOM 1615 CB SER A 106 26.447 2.127 -2.832 1.00 0.00 C ATOM 1616 OG SER A 106 26.701 3.302 -3.591 1.00 0.00 O ATOM 0 H SER A 106 24.124 2.943 -3.257 1.00 0.00 H new ATOM 0 HA SER A 106 25.259 1.554 -1.130 1.00 0.00 H new ATOM 0 HB2 SER A 106 27.380 1.728 -2.434 1.00 0.00 H new ATOM 0 HB3 SER A 106 26.016 1.355 -3.469 1.00 0.00 H new ATOM 0 HG SER A 106 26.837 4.060 -2.985 1.00 0.00 H new ATOM 1622 N SER A 107 25.860 3.401 0.515 1.00 0.00 N ATOM 1623 CA SER A 107 26.463 4.363 1.480 1.00 0.00 C ATOM 1624 C SER A 107 25.739 5.708 1.383 1.00 0.00 C ATOM 1625 O SER A 107 24.975 5.947 0.468 1.00 0.00 O ATOM 1626 CB SER A 107 27.945 4.556 1.147 1.00 0.00 C ATOM 1627 OG SER A 107 28.691 4.632 2.355 1.00 0.00 O ATOM 0 H SER A 107 25.236 2.708 0.928 1.00 0.00 H new ATOM 0 HA SER A 107 26.365 3.971 2.492 1.00 0.00 H new ATOM 0 HB2 SER A 107 28.303 3.727 0.536 1.00 0.00 H new ATOM 0 HB3 SER A 107 28.083 5.466 0.563 1.00 0.00 H new ATOM 0 HG SER A 107 29.641 4.754 2.146 1.00 0.00 H new ATOM 1633 N SER A 108 25.970 6.587 2.319 1.00 0.00 N ATOM 1634 CA SER A 108 25.291 7.914 2.281 1.00 0.00 C ATOM 1635 C SER A 108 25.962 8.861 3.278 1.00 0.00 C ATOM 1636 O SER A 108 26.236 8.497 4.405 1.00 0.00 O ATOM 1637 CB SER A 108 23.818 7.742 2.653 1.00 0.00 C ATOM 1638 OG SER A 108 23.005 8.225 1.592 1.00 0.00 O ATOM 0 H SER A 108 26.600 6.444 3.109 1.00 0.00 H new ATOM 0 HA SER A 108 25.367 8.332 1.277 1.00 0.00 H new ATOM 0 HB2 SER A 108 23.600 6.691 2.844 1.00 0.00 H new ATOM 0 HB3 SER A 108 23.597 8.286 3.572 1.00 0.00 H new ATOM 0 HG SER A 108 22.333 7.550 1.362 1.00 0.00 H new ATOM 1644 N HIS A 109 26.230 10.073 2.873 1.00 0.00 N ATOM 1645 CA HIS A 109 26.884 11.040 3.800 1.00 0.00 C ATOM 1646 C HIS A 109 25.846 11.597 4.779 1.00 0.00 C ATOM 1647 O HIS A 109 25.640 11.062 5.850 1.00 0.00 O ATOM 1648 CB HIS A 109 27.492 12.190 2.993 1.00 0.00 C ATOM 1649 CG HIS A 109 28.988 12.035 2.946 1.00 0.00 C ATOM 1650 ND1 HIS A 109 29.827 12.702 3.825 1.00 0.00 N ATOM 1651 CD2 HIS A 109 29.810 11.292 2.135 1.00 0.00 C ATOM 1652 CE1 HIS A 109 31.091 12.352 3.523 1.00 0.00 C ATOM 1653 NE2 HIS A 109 31.137 11.495 2.500 1.00 0.00 N ATOM 0 H HIS A 109 26.025 10.435 1.942 1.00 0.00 H new ATOM 0 HA HIS A 109 27.670 10.530 4.357 1.00 0.00 H new ATOM 0 HB2 HIS A 109 27.084 12.194 1.982 1.00 0.00 H new ATOM 0 HB3 HIS A 109 27.229 13.146 3.447 1.00 0.00 H new ATOM 0 HD2 HIS A 109 29.477 10.648 1.335 1.00 0.00 H new ATOM 0 HE1 HIS A 109 31.962 12.720 4.045 1.00 0.00 H new ATOM 0 HE2 HIS A 109 31.967 11.079 2.077 1.00 0.00 H new ATOM 1661 N GLY A 110 25.191 12.668 4.420 1.00 0.00 N ATOM 1662 CA GLY A 110 24.169 13.256 5.332 1.00 0.00 C ATOM 1663 C GLY A 110 23.343 14.297 4.575 1.00 0.00 C ATOM 1664 O GLY A 110 23.623 14.616 3.437 1.00 0.00 O ATOM 0 H GLY A 110 25.319 13.160 3.536 1.00 0.00 H new ATOM 0 HA2 GLY A 110 23.518 12.472 5.719 1.00 0.00 H new ATOM 0 HA3 GLY A 110 24.656 13.718 6.191 1.00 0.00 H new ATOM 1668 N ASP A 111 22.326 14.832 5.196 1.00 0.00 N ATOM 1669 CA ASP A 111 21.485 15.851 4.507 1.00 0.00 C ATOM 1670 C ASP A 111 20.798 15.208 3.300 1.00 0.00 C ATOM 1671 O ASP A 111 21.418 14.952 2.288 1.00 0.00 O ATOM 1672 CB ASP A 111 22.370 17.008 4.035 1.00 0.00 C ATOM 1673 CG ASP A 111 23.486 17.245 5.054 1.00 0.00 C ATOM 1674 OD1 ASP A 111 23.202 17.191 6.239 1.00 0.00 O ATOM 1675 OD2 ASP A 111 24.607 17.477 4.631 1.00 0.00 O ATOM 0 H ASP A 111 22.042 14.607 6.150 1.00 0.00 H new ATOM 0 HA ASP A 111 20.731 16.230 5.197 1.00 0.00 H new ATOM 0 HB2 ASP A 111 22.797 16.778 3.059 1.00 0.00 H new ATOM 0 HB3 ASP A 111 21.773 17.912 3.917 1.00 0.00 H new ATOM 1680 N VAL A 112 19.522 14.942 3.404 1.00 0.00 N ATOM 1681 CA VAL A 112 18.784 14.311 2.267 1.00 0.00 C ATOM 1682 C VAL A 112 19.645 13.222 1.624 1.00 0.00 C ATOM 1683 O VAL A 112 19.497 12.906 0.461 1.00 0.00 O ATOM 1684 CB VAL A 112 18.452 15.374 1.220 1.00 0.00 C ATOM 1685 CG1 VAL A 112 17.702 16.531 1.884 1.00 0.00 C ATOM 1686 CG2 VAL A 112 19.751 15.894 0.599 1.00 0.00 C ATOM 0 H VAL A 112 18.956 15.135 4.230 1.00 0.00 H new ATOM 0 HA VAL A 112 17.864 13.866 2.645 1.00 0.00 H new ATOM 0 HB VAL A 112 17.825 14.938 0.443 1.00 0.00 H new ATOM 0 HG11 VAL A 112 17.466 17.288 1.136 1.00 0.00 H new ATOM 0 HG12 VAL A 112 16.779 16.159 2.328 1.00 0.00 H new ATOM 0 HG13 VAL A 112 18.327 16.971 2.661 1.00 0.00 H new ATOM 0 HG21 VAL A 112 19.519 16.653 -0.149 1.00 0.00 H new ATOM 0 HG22 VAL A 112 20.377 16.331 1.377 1.00 0.00 H new ATOM 0 HG23 VAL A 112 20.284 15.069 0.126 1.00 0.00 H new ATOM 1696 N ASP A 113 20.541 12.642 2.372 1.00 0.00 N ATOM 1697 CA ASP A 113 21.407 11.573 1.806 1.00 0.00 C ATOM 1698 C ASP A 113 20.732 10.219 2.029 1.00 0.00 C ATOM 1699 O ASP A 113 19.954 9.765 1.214 1.00 0.00 O ATOM 1700 CB ASP A 113 22.756 11.610 2.516 1.00 0.00 C ATOM 1701 CG ASP A 113 23.833 12.097 1.543 1.00 0.00 C ATOM 1702 OD1 ASP A 113 24.243 11.312 0.704 1.00 0.00 O ATOM 1703 OD2 ASP A 113 24.228 13.245 1.652 1.00 0.00 O ATOM 0 H ASP A 113 20.711 12.863 3.353 1.00 0.00 H new ATOM 0 HA ASP A 113 21.557 11.727 0.737 1.00 0.00 H new ATOM 0 HB2 ASP A 113 22.706 12.272 3.380 1.00 0.00 H new ATOM 0 HB3 ASP A 113 23.010 10.618 2.889 1.00 0.00 H new ATOM 1708 N TYR A 114 20.995 9.584 3.138 1.00 0.00 N ATOM 1709 CA TYR A 114 20.333 8.281 3.416 1.00 0.00 C ATOM 1710 C TYR A 114 18.882 8.576 3.783 1.00 0.00 C ATOM 1711 O TYR A 114 18.013 7.730 3.697 1.00 0.00 O ATOM 1712 CB TYR A 114 21.031 7.581 4.585 1.00 0.00 C ATOM 1713 CG TYR A 114 20.519 6.164 4.705 1.00 0.00 C ATOM 1714 CD1 TYR A 114 20.600 5.295 3.610 1.00 0.00 C ATOM 1715 CD2 TYR A 114 19.961 5.720 5.910 1.00 0.00 C ATOM 1716 CE1 TYR A 114 20.125 3.983 3.720 1.00 0.00 C ATOM 1717 CE2 TYR A 114 19.486 4.407 6.021 1.00 0.00 C ATOM 1718 CZ TYR A 114 19.568 3.539 4.926 1.00 0.00 C ATOM 1719 OH TYR A 114 19.099 2.245 5.035 1.00 0.00 O ATOM 0 H TYR A 114 21.637 9.910 3.860 1.00 0.00 H new ATOM 0 HA TYR A 114 20.387 7.628 2.545 1.00 0.00 H new ATOM 0 HB2 TYR A 114 22.110 7.577 4.428 1.00 0.00 H new ATOM 0 HB3 TYR A 114 20.846 8.125 5.511 1.00 0.00 H new ATOM 0 HD1 TYR A 114 21.029 5.637 2.680 1.00 0.00 H new ATOM 0 HD2 TYR A 114 19.897 6.390 6.754 1.00 0.00 H new ATOM 0 HE1 TYR A 114 20.188 3.313 2.875 1.00 0.00 H new ATOM 0 HE2 TYR A 114 19.057 4.065 6.951 1.00 0.00 H new ATOM 0 HH TYR A 114 18.746 2.100 5.938 1.00 0.00 H new ATOM 1729 N ALA A 115 18.624 9.791 4.184 1.00 0.00 N ATOM 1730 CA ALA A 115 17.244 10.194 4.555 1.00 0.00 C ATOM 1731 C ALA A 115 16.337 10.076 3.328 1.00 0.00 C ATOM 1732 O ALA A 115 15.306 9.436 3.362 1.00 0.00 O ATOM 1733 CB ALA A 115 17.275 11.647 5.031 1.00 0.00 C ATOM 0 H ALA A 115 19.323 10.529 4.270 1.00 0.00 H new ATOM 0 HA ALA A 115 16.862 9.550 5.347 1.00 0.00 H new ATOM 0 HB1 ALA A 115 16.269 11.961 5.308 1.00 0.00 H new ATOM 0 HB2 ALA A 115 17.933 11.733 5.896 1.00 0.00 H new ATOM 0 HB3 ALA A 115 17.646 12.285 4.229 1.00 0.00 H new ATOM 1739 N GLN A 116 16.721 10.691 2.242 1.00 0.00 N ATOM 1740 CA GLN A 116 15.890 10.617 1.008 1.00 0.00 C ATOM 1741 C GLN A 116 15.845 9.170 0.513 1.00 0.00 C ATOM 1742 O GLN A 116 14.824 8.687 0.067 1.00 0.00 O ATOM 1743 CB GLN A 116 16.508 11.506 -0.074 1.00 0.00 C ATOM 1744 CG GLN A 116 15.751 12.833 -0.146 1.00 0.00 C ATOM 1745 CD GLN A 116 16.099 13.547 -1.453 1.00 0.00 C ATOM 1746 OE1 GLN A 116 17.249 13.845 -1.708 1.00 0.00 O ATOM 1747 NE2 GLN A 116 15.147 13.836 -2.298 1.00 0.00 N ATOM 0 H GLN A 116 17.575 11.242 2.157 1.00 0.00 H new ATOM 0 HA GLN A 116 14.879 10.959 1.227 1.00 0.00 H new ATOM 0 HB2 GLN A 116 17.560 11.688 0.148 1.00 0.00 H new ATOM 0 HB3 GLN A 116 16.469 11.001 -1.039 1.00 0.00 H new ATOM 0 HG2 GLN A 116 14.677 12.655 -0.091 1.00 0.00 H new ATOM 0 HG3 GLN A 116 16.014 13.461 0.705 1.00 0.00 H new ATOM 0 HE21 GLN A 116 14.182 13.586 -2.084 1.00 0.00 H new ATOM 0 HE22 GLN A 116 15.368 14.312 -3.173 1.00 0.00 H new ATOM 1756 N ALA A 117 16.948 8.476 0.586 1.00 0.00 N ATOM 1757 CA ALA A 117 16.973 7.061 0.121 1.00 0.00 C ATOM 1758 C ALA A 117 16.101 6.203 1.041 1.00 0.00 C ATOM 1759 O ALA A 117 15.733 5.095 0.709 1.00 0.00 O ATOM 1760 CB ALA A 117 18.411 6.542 0.151 1.00 0.00 C ATOM 0 H ALA A 117 17.834 8.829 0.948 1.00 0.00 H new ATOM 0 HA ALA A 117 16.587 7.007 -0.897 1.00 0.00 H new ATOM 0 HB1 ALA A 117 18.431 5.507 -0.189 1.00 0.00 H new ATOM 0 HB2 ALA A 117 19.032 7.152 -0.506 1.00 0.00 H new ATOM 0 HB3 ALA A 117 18.797 6.597 1.169 1.00 0.00 H new ATOM 1766 N SER A 118 15.772 6.707 2.198 1.00 0.00 N ATOM 1767 CA SER A 118 14.927 5.923 3.141 1.00 0.00 C ATOM 1768 C SER A 118 13.477 5.914 2.649 1.00 0.00 C ATOM 1769 O SER A 118 12.702 5.046 2.991 1.00 0.00 O ATOM 1770 CB SER A 118 14.988 6.562 4.529 1.00 0.00 C ATOM 1771 OG SER A 118 15.125 5.544 5.512 1.00 0.00 O ATOM 0 H SER A 118 16.052 7.629 2.531 1.00 0.00 H new ATOM 0 HA SER A 118 15.298 4.899 3.192 1.00 0.00 H new ATOM 0 HB2 SER A 118 15.828 7.254 4.586 1.00 0.00 H new ATOM 0 HB3 SER A 118 14.084 7.142 4.714 1.00 0.00 H new ATOM 0 HG SER A 118 15.166 5.952 6.402 1.00 0.00 H new ATOM 1777 N ALA A 119 13.103 6.880 1.856 1.00 0.00 N ATOM 1778 CA ALA A 119 11.701 6.929 1.353 1.00 0.00 C ATOM 1779 C ALA A 119 11.593 6.166 0.029 1.00 0.00 C ATOM 1780 O ALA A 119 10.636 5.456 -0.211 1.00 0.00 O ATOM 1781 CB ALA A 119 11.291 8.386 1.131 1.00 0.00 C ATOM 0 H ALA A 119 13.707 7.637 1.535 1.00 0.00 H new ATOM 0 HA ALA A 119 11.042 6.468 2.088 1.00 0.00 H new ATOM 0 HB1 ALA A 119 10.266 8.423 0.763 1.00 0.00 H new ATOM 0 HB2 ALA A 119 11.359 8.931 2.073 1.00 0.00 H new ATOM 0 HB3 ALA A 119 11.956 8.844 0.399 1.00 0.00 H new ATOM 1787 N GLU A 120 12.557 6.314 -0.837 1.00 0.00 N ATOM 1788 CA GLU A 120 12.497 5.605 -2.147 1.00 0.00 C ATOM 1789 C GLU A 120 12.835 4.123 -1.958 1.00 0.00 C ATOM 1790 O GLU A 120 12.333 3.269 -2.663 1.00 0.00 O ATOM 1791 CB GLU A 120 13.501 6.236 -3.113 1.00 0.00 C ATOM 1792 CG GLU A 120 14.916 6.073 -2.557 1.00 0.00 C ATOM 1793 CD GLU A 120 15.808 7.198 -3.087 1.00 0.00 C ATOM 1794 OE1 GLU A 120 15.664 8.314 -2.616 1.00 0.00 O ATOM 1795 OE2 GLU A 120 16.622 6.923 -3.954 1.00 0.00 O ATOM 0 H GLU A 120 13.383 6.895 -0.695 1.00 0.00 H new ATOM 0 HA GLU A 120 11.490 5.692 -2.554 1.00 0.00 H new ATOM 0 HB2 GLU A 120 13.427 5.762 -4.092 1.00 0.00 H new ATOM 0 HB3 GLU A 120 13.273 7.293 -3.252 1.00 0.00 H new ATOM 0 HG2 GLU A 120 14.894 6.095 -1.467 1.00 0.00 H new ATOM 0 HG3 GLU A 120 15.323 5.105 -2.848 1.00 0.00 H new ATOM 1802 N LEU A 121 13.684 3.808 -1.019 1.00 0.00 N ATOM 1803 CA LEU A 121 14.052 2.380 -0.799 1.00 0.00 C ATOM 1804 C LEU A 121 13.050 1.733 0.162 1.00 0.00 C ATOM 1805 O LEU A 121 12.494 0.690 -0.118 1.00 0.00 O ATOM 1806 CB LEU A 121 15.457 2.303 -0.200 1.00 0.00 C ATOM 1807 CG LEU A 121 15.789 0.851 0.145 1.00 0.00 C ATOM 1808 CD1 LEU A 121 15.687 -0.011 -1.114 1.00 0.00 C ATOM 1809 CD2 LEU A 121 17.212 0.774 0.700 1.00 0.00 C ATOM 0 H LEU A 121 14.138 4.475 -0.396 1.00 0.00 H new ATOM 0 HA LEU A 121 14.033 1.850 -1.751 1.00 0.00 H new ATOM 0 HB2 LEU A 121 16.187 2.695 -0.908 1.00 0.00 H new ATOM 0 HB3 LEU A 121 15.516 2.923 0.695 1.00 0.00 H new ATOM 0 HG LEU A 121 15.085 0.485 0.892 1.00 0.00 H new ATOM 0 HD11 LEU A 121 15.924 -1.046 -0.867 1.00 0.00 H new ATOM 0 HD12 LEU A 121 14.674 0.044 -1.512 1.00 0.00 H new ATOM 0 HD13 LEU A 121 16.391 0.353 -1.862 1.00 0.00 H new ATOM 0 HD21 LEU A 121 17.451 -0.261 0.947 1.00 0.00 H new ATOM 0 HD22 LEU A 121 17.915 1.140 -0.048 1.00 0.00 H new ATOM 0 HD23 LEU A 121 17.286 1.387 1.598 1.00 0.00 H new ATOM 1821 N ALA A 122 12.822 2.340 1.293 1.00 0.00 N ATOM 1822 CA ALA A 122 11.860 1.758 2.271 1.00 0.00 C ATOM 1823 C ALA A 122 10.523 1.479 1.579 1.00 0.00 C ATOM 1824 O ALA A 122 9.881 0.478 1.826 1.00 0.00 O ATOM 1825 CB ALA A 122 11.640 2.748 3.417 1.00 0.00 C ATOM 0 H ALA A 122 13.260 3.214 1.583 1.00 0.00 H new ATOM 0 HA ALA A 122 12.265 0.825 2.663 1.00 0.00 H new ATOM 0 HB1 ALA A 122 10.937 2.324 4.134 1.00 0.00 H new ATOM 0 HB2 ALA A 122 12.590 2.946 3.914 1.00 0.00 H new ATOM 0 HB3 ALA A 122 11.237 3.680 3.020 1.00 0.00 H new ATOM 1831 N LYS A 123 10.095 2.362 0.717 1.00 0.00 N ATOM 1832 CA LYS A 123 8.796 2.153 0.015 1.00 0.00 C ATOM 1833 C LYS A 123 8.827 0.826 -0.748 1.00 0.00 C ATOM 1834 O LYS A 123 7.836 0.130 -0.841 1.00 0.00 O ATOM 1835 CB LYS A 123 8.556 3.302 -0.968 1.00 0.00 C ATOM 1836 CG LYS A 123 9.563 3.214 -2.116 1.00 0.00 C ATOM 1837 CD LYS A 123 9.015 2.292 -3.208 1.00 0.00 C ATOM 1838 CE LYS A 123 9.025 3.028 -4.550 1.00 0.00 C ATOM 1839 NZ LYS A 123 10.122 2.491 -5.403 1.00 0.00 N ATOM 0 H LYS A 123 10.589 3.219 0.469 1.00 0.00 H new ATOM 0 HA LYS A 123 7.991 2.127 0.749 1.00 0.00 H new ATOM 0 HB2 LYS A 123 7.539 3.254 -1.358 1.00 0.00 H new ATOM 0 HB3 LYS A 123 8.656 4.259 -0.456 1.00 0.00 H new ATOM 0 HG2 LYS A 123 9.752 4.207 -2.525 1.00 0.00 H new ATOM 0 HG3 LYS A 123 10.516 2.834 -1.749 1.00 0.00 H new ATOM 0 HD2 LYS A 123 9.620 1.388 -3.273 1.00 0.00 H new ATOM 0 HD3 LYS A 123 8.001 1.980 -2.960 1.00 0.00 H new ATOM 0 HE2 LYS A 123 8.066 2.904 -5.052 1.00 0.00 H new ATOM 0 HE3 LYS A 123 9.165 4.097 -4.390 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 10.129 2.991 -6.315 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 11.034 2.631 -4.924 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 9.969 1.475 -5.566 1.00 0.00 H new ATOM 1853 N ALA A 124 9.956 0.472 -1.298 1.00 0.00 N ATOM 1854 CA ALA A 124 10.045 -0.808 -2.056 1.00 0.00 C ATOM 1855 C ALA A 124 10.099 -1.982 -1.075 1.00 0.00 C ATOM 1856 O ALA A 124 9.770 -3.100 -1.414 1.00 0.00 O ATOM 1857 CB ALA A 124 11.310 -0.804 -2.916 1.00 0.00 C ATOM 0 H ALA A 124 10.820 1.013 -1.255 1.00 0.00 H new ATOM 0 HA ALA A 124 9.169 -0.911 -2.697 1.00 0.00 H new ATOM 0 HB1 ALA A 124 11.376 -1.740 -3.471 1.00 0.00 H new ATOM 0 HB2 ALA A 124 11.271 0.031 -3.616 1.00 0.00 H new ATOM 0 HB3 ALA A 124 12.185 -0.700 -2.275 1.00 0.00 H new ATOM 1863 N ILE A 125 10.509 -1.735 0.140 1.00 0.00 N ATOM 1864 CA ILE A 125 10.580 -2.838 1.139 1.00 0.00 C ATOM 1865 C ILE A 125 9.184 -3.111 1.703 1.00 0.00 C ATOM 1866 O ILE A 125 8.989 -4.016 2.489 1.00 0.00 O ATOM 1867 CB ILE A 125 11.518 -2.434 2.278 1.00 0.00 C ATOM 1868 CG1 ILE A 125 12.818 -1.876 1.695 1.00 0.00 C ATOM 1869 CG2 ILE A 125 11.833 -3.658 3.139 1.00 0.00 C ATOM 1870 CD1 ILE A 125 13.338 -2.816 0.606 1.00 0.00 C ATOM 0 H ILE A 125 10.797 -0.819 0.483 1.00 0.00 H new ATOM 0 HA ILE A 125 10.958 -3.739 0.656 1.00 0.00 H new ATOM 0 HB ILE A 125 11.036 -1.672 2.891 1.00 0.00 H new ATOM 0 HG12 ILE A 125 12.645 -0.883 1.280 1.00 0.00 H new ATOM 0 HG13 ILE A 125 13.564 -1.767 2.482 1.00 0.00 H new ATOM 0 HG21 ILE A 125 12.501 -3.370 3.950 1.00 0.00 H new ATOM 0 HG22 ILE A 125 10.908 -4.058 3.555 1.00 0.00 H new ATOM 0 HG23 ILE A 125 12.314 -4.420 2.526 1.00 0.00 H new ATOM 0 HD11 ILE A 125 14.264 -2.417 0.192 1.00 0.00 H new ATOM 0 HD12 ILE A 125 13.527 -3.800 1.035 1.00 0.00 H new ATOM 0 HD13 ILE A 125 12.594 -2.902 -0.186 1.00 0.00 H new ATOM 1882 N ALA A 126 8.212 -2.336 1.308 1.00 0.00 N ATOM 1883 CA ALA A 126 6.833 -2.553 1.824 1.00 0.00 C ATOM 1884 C ALA A 126 6.317 -3.912 1.345 1.00 0.00 C ATOM 1885 O ALA A 126 5.561 -4.575 2.027 1.00 0.00 O ATOM 1886 CB ALA A 126 5.913 -1.446 1.304 1.00 0.00 C ATOM 0 H ALA A 126 8.314 -1.563 0.651 1.00 0.00 H new ATOM 0 HA ALA A 126 6.846 -2.533 2.914 1.00 0.00 H new ATOM 0 HB1 ALA A 126 4.903 -1.605 1.682 1.00 0.00 H new ATOM 0 HB2 ALA A 126 6.280 -0.478 1.645 1.00 0.00 H new ATOM 0 HB3 ALA A 126 5.900 -1.466 0.214 1.00 0.00 H new ATOM 1892 N GLN A 127 6.720 -4.333 0.176 1.00 0.00 N ATOM 1893 CA GLN A 127 6.251 -5.650 -0.343 1.00 0.00 C ATOM 1894 C GLN A 127 6.868 -6.776 0.489 1.00 0.00 C ATOM 1895 O GLN A 127 6.389 -7.893 0.494 1.00 0.00 O ATOM 1896 CB GLN A 127 6.679 -5.805 -1.805 1.00 0.00 C ATOM 1897 CG GLN A 127 8.190 -6.034 -1.873 1.00 0.00 C ATOM 1898 CD GLN A 127 8.806 -5.089 -2.908 1.00 0.00 C ATOM 1899 OE1 GLN A 127 8.285 -4.019 -3.156 1.00 0.00 O ATOM 1900 NE2 GLN A 127 9.899 -5.442 -3.527 1.00 0.00 N ATOM 0 H GLN A 127 7.352 -3.823 -0.441 1.00 0.00 H new ATOM 0 HA GLN A 127 5.164 -5.700 -0.274 1.00 0.00 H new ATOM 0 HB2 GLN A 127 6.153 -6.643 -2.262 1.00 0.00 H new ATOM 0 HB3 GLN A 127 6.410 -4.913 -2.370 1.00 0.00 H new ATOM 0 HG2 GLN A 127 8.639 -5.861 -0.895 1.00 0.00 H new ATOM 0 HG3 GLN A 127 8.399 -7.070 -2.141 1.00 0.00 H new ATOM 0 HE21 GLN A 127 10.336 -6.340 -3.319 1.00 0.00 H new ATOM 0 HE22 GLN A 127 10.317 -4.820 -4.219 1.00 0.00 H new ATOM 1909 N LEU A 128 7.930 -6.493 1.192 1.00 0.00 N ATOM 1910 CA LEU A 128 8.581 -7.546 2.021 1.00 0.00 C ATOM 1911 C LEU A 128 7.869 -7.647 3.372 1.00 0.00 C ATOM 1912 O LEU A 128 8.005 -8.621 4.084 1.00 0.00 O ATOM 1913 CB LEU A 128 10.051 -7.181 2.247 1.00 0.00 C ATOM 1914 CG LEU A 128 10.802 -8.393 2.802 1.00 0.00 C ATOM 1915 CD1 LEU A 128 11.076 -9.387 1.672 1.00 0.00 C ATOM 1916 CD2 LEU A 128 12.132 -7.936 3.409 1.00 0.00 C ATOM 0 H LEU A 128 8.376 -5.576 1.228 1.00 0.00 H new ATOM 0 HA LEU A 128 8.518 -8.504 1.505 1.00 0.00 H new ATOM 0 HB2 LEU A 128 10.504 -6.858 1.310 1.00 0.00 H new ATOM 0 HB3 LEU A 128 10.126 -6.345 2.942 1.00 0.00 H new ATOM 0 HG LEU A 128 10.196 -8.873 3.570 1.00 0.00 H new ATOM 0 HD11 LEU A 128 11.611 -10.250 2.068 1.00 0.00 H new ATOM 0 HD12 LEU A 128 10.131 -9.714 1.238 1.00 0.00 H new ATOM 0 HD13 LEU A 128 11.681 -8.906 0.903 1.00 0.00 H new ATOM 0 HD21 LEU A 128 12.667 -8.799 3.804 1.00 0.00 H new ATOM 0 HD22 LEU A 128 12.737 -7.455 2.640 1.00 0.00 H new ATOM 0 HD23 LEU A 128 11.940 -7.228 4.215 1.00 0.00 H new ATOM 1928 N ARG A 129 7.111 -6.647 3.731 1.00 0.00 N ATOM 1929 CA ARG A 129 6.396 -6.689 5.037 1.00 0.00 C ATOM 1930 C ARG A 129 5.015 -7.322 4.850 1.00 0.00 C ATOM 1931 O ARG A 129 4.475 -7.928 5.755 1.00 0.00 O ATOM 1932 CB ARG A 129 6.240 -5.267 5.582 1.00 0.00 C ATOM 1933 CG ARG A 129 7.153 -5.088 6.798 1.00 0.00 C ATOM 1934 CD ARG A 129 7.283 -3.600 7.126 1.00 0.00 C ATOM 1935 NE ARG A 129 7.448 -2.825 5.864 1.00 0.00 N ATOM 1936 CZ ARG A 129 6.983 -1.609 5.780 1.00 0.00 C ATOM 1937 NH1 ARG A 129 7.505 -0.658 6.504 1.00 0.00 N ATOM 1938 NH2 ARG A 129 5.994 -1.344 4.970 1.00 0.00 N ATOM 0 H ARG A 129 6.956 -5.804 3.177 1.00 0.00 H new ATOM 0 HA ARG A 129 6.972 -7.286 5.744 1.00 0.00 H new ATOM 0 HB2 ARG A 129 6.495 -4.540 4.811 1.00 0.00 H new ATOM 0 HB3 ARG A 129 5.202 -5.084 5.862 1.00 0.00 H new ATOM 0 HG2 ARG A 129 6.745 -5.625 7.654 1.00 0.00 H new ATOM 0 HG3 ARG A 129 8.136 -5.513 6.594 1.00 0.00 H new ATOM 0 HD2 ARG A 129 6.399 -3.257 7.663 1.00 0.00 H new ATOM 0 HD3 ARG A 129 8.138 -3.435 7.781 1.00 0.00 H new ATOM 0 HE ARG A 129 7.924 -3.245 5.066 1.00 0.00 H new ATOM 0 HH11 ARG A 129 8.278 -0.865 7.137 1.00 0.00 H new ATOM 0 HH12 ARG A 129 7.140 0.292 6.437 1.00 0.00 H new ATOM 0 HH21 ARG A 129 5.586 -2.087 4.404 1.00 0.00 H new ATOM 0 HH22 ARG A 129 5.630 -0.394 4.904 1.00 0.00 H new ATOM 1952 N VAL A 130 4.435 -7.189 3.688 1.00 0.00 N ATOM 1953 CA VAL A 130 3.091 -7.790 3.458 1.00 0.00 C ATOM 1954 C VAL A 130 3.254 -9.223 2.948 1.00 0.00 C ATOM 1955 O VAL A 130 2.396 -10.062 3.142 1.00 0.00 O ATOM 1956 CB VAL A 130 2.322 -6.962 2.425 1.00 0.00 C ATOM 1957 CG1 VAL A 130 1.826 -5.670 3.073 1.00 0.00 C ATOM 1958 CG2 VAL A 130 3.242 -6.619 1.253 1.00 0.00 C ATOM 0 H VAL A 130 4.832 -6.692 2.891 1.00 0.00 H new ATOM 0 HA VAL A 130 2.535 -7.798 4.396 1.00 0.00 H new ATOM 0 HB VAL A 130 1.471 -7.539 2.062 1.00 0.00 H new ATOM 0 HG11 VAL A 130 1.279 -5.081 2.337 1.00 0.00 H new ATOM 0 HG12 VAL A 130 1.168 -5.911 3.908 1.00 0.00 H new ATOM 0 HG13 VAL A 130 2.678 -5.095 3.437 1.00 0.00 H new ATOM 0 HG21 VAL A 130 2.692 -6.030 0.519 1.00 0.00 H new ATOM 0 HG22 VAL A 130 4.094 -6.044 1.615 1.00 0.00 H new ATOM 0 HG23 VAL A 130 3.597 -7.539 0.788 1.00 0.00 H new ATOM 1968 N ILE A 131 4.350 -9.515 2.301 1.00 0.00 N ATOM 1969 CA ILE A 131 4.562 -10.899 1.788 1.00 0.00 C ATOM 1970 C ILE A 131 4.720 -11.857 2.969 1.00 0.00 C ATOM 1971 O ILE A 131 4.115 -12.910 3.012 1.00 0.00 O ATOM 1972 CB ILE A 131 5.825 -10.941 0.924 1.00 0.00 C ATOM 1973 CG1 ILE A 131 6.070 -12.378 0.457 1.00 0.00 C ATOM 1974 CG2 ILE A 131 7.025 -10.461 1.742 1.00 0.00 C ATOM 1975 CD1 ILE A 131 7.437 -12.468 -0.225 1.00 0.00 C ATOM 0 H ILE A 131 5.105 -8.858 2.106 1.00 0.00 H new ATOM 0 HA ILE A 131 3.704 -11.198 1.186 1.00 0.00 H new ATOM 0 HB ILE A 131 5.695 -10.290 0.059 1.00 0.00 H new ATOM 0 HG12 ILE A 131 6.030 -13.059 1.307 1.00 0.00 H new ATOM 0 HG13 ILE A 131 5.286 -12.685 -0.235 1.00 0.00 H new ATOM 0 HG21 ILE A 131 7.922 -10.492 1.124 1.00 0.00 H new ATOM 0 HG22 ILE A 131 6.851 -9.439 2.078 1.00 0.00 H new ATOM 0 HG23 ILE A 131 7.158 -11.110 2.608 1.00 0.00 H new ATOM 0 HD11 ILE A 131 7.611 -13.491 -0.557 1.00 0.00 H new ATOM 0 HD12 ILE A 131 7.459 -11.798 -1.085 1.00 0.00 H new ATOM 0 HD13 ILE A 131 8.216 -12.178 0.481 1.00 0.00 H new ATOM 1987 N GLU A 132 5.526 -11.500 3.931 1.00 0.00 N ATOM 1988 CA GLU A 132 5.718 -12.391 5.110 1.00 0.00 C ATOM 1989 C GLU A 132 4.352 -12.748 5.697 1.00 0.00 C ATOM 1990 O GLU A 132 4.183 -13.779 6.316 1.00 0.00 O ATOM 1991 CB GLU A 132 6.555 -11.667 6.168 1.00 0.00 C ATOM 1992 CG GLU A 132 8.023 -12.072 6.024 1.00 0.00 C ATOM 1993 CD GLU A 132 8.490 -12.763 7.306 1.00 0.00 C ATOM 1994 OE1 GLU A 132 7.857 -13.728 7.699 1.00 0.00 O ATOM 1995 OE2 GLU A 132 9.472 -12.314 7.873 1.00 0.00 O ATOM 0 H GLU A 132 6.059 -10.631 3.952 1.00 0.00 H new ATOM 0 HA GLU A 132 6.234 -13.300 4.802 1.00 0.00 H new ATOM 0 HB2 GLU A 132 6.452 -10.588 6.053 1.00 0.00 H new ATOM 0 HB3 GLU A 132 6.194 -11.917 7.166 1.00 0.00 H new ATOM 0 HG2 GLU A 132 8.145 -12.741 5.172 1.00 0.00 H new ATOM 0 HG3 GLU A 132 8.636 -11.192 5.828 1.00 0.00 H new ATOM 2002 N LEU A 133 3.376 -11.905 5.503 1.00 0.00 N ATOM 2003 CA LEU A 133 2.020 -12.198 6.045 1.00 0.00 C ATOM 2004 C LEU A 133 1.332 -13.235 5.157 1.00 0.00 C ATOM 2005 O LEU A 133 0.737 -14.181 5.634 1.00 0.00 O ATOM 2006 CB LEU A 133 1.189 -10.912 6.066 1.00 0.00 C ATOM 2007 CG LEU A 133 1.022 -10.435 7.510 1.00 0.00 C ATOM 2008 CD1 LEU A 133 1.671 -9.061 7.674 1.00 0.00 C ATOM 2009 CD2 LEU A 133 -0.469 -10.338 7.843 1.00 0.00 C ATOM 0 H LEU A 133 3.459 -11.026 4.993 1.00 0.00 H new ATOM 0 HA LEU A 133 2.110 -12.588 7.059 1.00 0.00 H new ATOM 0 HB2 LEU A 133 1.678 -10.141 5.471 1.00 0.00 H new ATOM 0 HB3 LEU A 133 0.213 -11.090 5.616 1.00 0.00 H new ATOM 0 HG LEU A 133 1.502 -11.144 8.185 1.00 0.00 H new ATOM 0 HD11 LEU A 133 1.551 -8.723 8.703 1.00 0.00 H new ATOM 0 HD12 LEU A 133 2.732 -9.129 7.436 1.00 0.00 H new ATOM 0 HD13 LEU A 133 1.193 -8.350 7.000 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -0.591 -9.998 8.872 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -0.947 -9.629 7.168 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -0.932 -11.318 7.727 1.00 0.00 H new ATOM 2021 N THR A 134 1.410 -13.065 3.865 1.00 0.00 N ATOM 2022 CA THR A 134 0.762 -14.040 2.943 1.00 0.00 C ATOM 2023 C THR A 134 1.378 -15.426 3.148 1.00 0.00 C ATOM 2024 O THR A 134 0.843 -16.424 2.710 1.00 0.00 O ATOM 2025 CB THR A 134 0.979 -13.596 1.495 1.00 0.00 C ATOM 2026 OG1 THR A 134 2.372 -13.546 1.219 1.00 0.00 O ATOM 2027 CG2 THR A 134 0.367 -12.210 1.287 1.00 0.00 C ATOM 0 H THR A 134 1.895 -12.293 3.408 1.00 0.00 H new ATOM 0 HA THR A 134 -0.306 -14.082 3.154 1.00 0.00 H new ATOM 0 HB THR A 134 0.500 -14.307 0.822 1.00 0.00 H new ATOM 0 HG1 THR A 134 2.841 -13.134 1.975 1.00 0.00 H new ATOM 0 HG21 THR A 134 0.522 -11.895 0.255 1.00 0.00 H new ATOM 0 HG22 THR A 134 -0.702 -12.249 1.498 1.00 0.00 H new ATOM 0 HG23 THR A 134 0.844 -11.497 1.960 1.00 0.00 H new ATOM 2035 N LYS A 135 2.501 -15.496 3.809 1.00 0.00 N ATOM 2036 CA LYS A 135 3.146 -16.820 4.036 1.00 0.00 C ATOM 2037 C LYS A 135 2.088 -17.829 4.489 1.00 0.00 C ATOM 2038 O LYS A 135 2.077 -18.966 4.059 1.00 0.00 O ATOM 2039 CB LYS A 135 4.221 -16.687 5.118 1.00 0.00 C ATOM 2040 CG LYS A 135 3.554 -16.498 6.482 1.00 0.00 C ATOM 2041 CD LYS A 135 4.620 -16.186 7.535 1.00 0.00 C ATOM 2042 CE LYS A 135 5.197 -17.492 8.084 1.00 0.00 C ATOM 2043 NZ LYS A 135 6.660 -17.544 7.807 1.00 0.00 N ATOM 0 H LYS A 135 2.998 -14.696 4.201 1.00 0.00 H new ATOM 0 HA LYS A 135 3.606 -17.164 3.110 1.00 0.00 H new ATOM 0 HB2 LYS A 135 4.851 -17.576 5.130 1.00 0.00 H new ATOM 0 HB3 LYS A 135 4.870 -15.839 4.898 1.00 0.00 H new ATOM 0 HG2 LYS A 135 2.828 -15.687 6.434 1.00 0.00 H new ATOM 0 HG3 LYS A 135 3.007 -17.399 6.759 1.00 0.00 H new ATOM 0 HD2 LYS A 135 5.414 -15.582 7.095 1.00 0.00 H new ATOM 0 HD3 LYS A 135 4.185 -15.600 8.345 1.00 0.00 H new ATOM 0 HE2 LYS A 135 5.017 -17.559 9.157 1.00 0.00 H new ATOM 0 HE3 LYS A 135 4.698 -18.345 7.623 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 7.053 -18.432 8.180 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 6.821 -17.499 6.781 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 7.129 -16.738 8.267 1.00 0.00 H new ATOM 2057 N LYS A 136 1.197 -17.422 5.351 1.00 0.00 N ATOM 2058 CA LYS A 136 0.141 -18.355 5.830 1.00 0.00 C ATOM 2059 C LYS A 136 -1.140 -18.134 5.022 1.00 0.00 C ATOM 2060 O LYS A 136 -1.813 -19.068 4.638 1.00 0.00 O ATOM 2061 CB LYS A 136 -0.136 -18.089 7.310 1.00 0.00 C ATOM 2062 CG LYS A 136 -1.070 -19.169 7.854 1.00 0.00 C ATOM 2063 CD LYS A 136 -0.438 -19.815 9.089 1.00 0.00 C ATOM 2064 CE LYS A 136 0.273 -21.107 8.681 1.00 0.00 C ATOM 2065 NZ LYS A 136 -0.739 -22.141 8.329 1.00 0.00 N ATOM 0 H LYS A 136 1.156 -16.482 5.744 1.00 0.00 H new ATOM 0 HA LYS A 136 0.477 -19.384 5.701 1.00 0.00 H new ATOM 0 HB2 LYS A 136 0.798 -18.085 7.871 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -0.588 -17.105 7.436 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -2.035 -18.734 8.112 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -1.255 -19.924 7.090 1.00 0.00 H new ATOM 0 HD2 LYS A 136 0.271 -19.127 9.550 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -1.205 -20.029 9.834 1.00 0.00 H new ATOM 0 HE2 LYS A 136 0.929 -20.921 7.831 1.00 0.00 H new ATOM 0 HE3 LYS A 136 0.902 -21.462 9.497 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -0.341 -23.087 8.496 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -1.586 -22.012 8.918 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -0.997 -22.047 7.326 1.00 0.00 H new ATOM 2079 N ALA A 137 -1.481 -16.901 4.762 1.00 0.00 N ATOM 2080 CA ALA A 137 -2.717 -16.619 3.978 1.00 0.00 C ATOM 2081 C ALA A 137 -2.794 -17.568 2.780 1.00 0.00 C ATOM 2082 O ALA A 137 -3.710 -18.357 2.657 1.00 0.00 O ATOM 2083 CB ALA A 137 -2.687 -15.172 3.483 1.00 0.00 C ATOM 0 H ALA A 137 -0.957 -16.077 5.058 1.00 0.00 H new ATOM 0 HA ALA A 137 -3.590 -16.768 4.613 1.00 0.00 H new ATOM 0 HB1 ALA A 137 -3.590 -14.965 2.910 1.00 0.00 H new ATOM 0 HB2 ALA A 137 -2.636 -14.496 4.337 1.00 0.00 H new ATOM 0 HB3 ALA A 137 -1.813 -15.022 2.849 1.00 0.00 H new ATOM 2089 N MET A 138 -1.840 -17.495 1.892 1.00 0.00 N ATOM 2090 CA MET A 138 -1.858 -18.389 0.700 1.00 0.00 C ATOM 2091 C MET A 138 -2.044 -19.840 1.148 1.00 0.00 C ATOM 2092 O MET A 138 -1.048 -20.533 1.273 1.00 0.00 O ATOM 2093 CB MET A 138 -0.535 -18.254 -0.058 1.00 0.00 C ATOM 2094 CG MET A 138 -0.821 -18.080 -1.550 1.00 0.00 C ATOM 2095 SD MET A 138 0.704 -17.617 -2.408 1.00 0.00 S ATOM 2096 CE MET A 138 1.634 -19.125 -2.043 1.00 0.00 C ATOM 2097 OXT MET A 138 -3.180 -20.234 1.354 1.00 0.00 O ATOM 0 H MET A 138 -1.048 -16.854 1.941 1.00 0.00 H new ATOM 0 HA MET A 138 -2.683 -18.105 0.047 1.00 0.00 H new ATOM 0 HB2 MET A 138 0.027 -17.399 0.318 1.00 0.00 H new ATOM 0 HB3 MET A 138 0.082 -19.138 0.105 1.00 0.00 H new ATOM 0 HG2 MET A 138 -1.217 -19.006 -1.965 1.00 0.00 H new ATOM 0 HG3 MET A 138 -1.581 -17.313 -1.698 1.00 0.00 H new ATOM 0 HE1 MET A 138 2.413 -19.263 -2.793 1.00 0.00 H new ATOM 0 HE2 MET A 138 2.091 -19.041 -1.057 1.00 0.00 H new ATOM 0 HE3 MET A 138 0.960 -19.981 -2.059 1.00 0.00 H new TER 2107 MET A 138