USER MOD reduce.3.24.130724 H: found=0, std=0, add=998, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 998 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 47 THR OG1 : rot 71:sc= 0.276 USER MOD Set 1.2: A 71 GLN : amide:sc= 0 X(o=0.28,f=0.27) USER MOD Set 2.1: A 41 GLN : amide:sc= 1.04 K(o=2.2,f=-6.5!) USER MOD Set 2.2: A 44 LYS NZ :NH3+ 171:sc= 1.17 (180deg=-0.0449) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 HIS : no HD1:sc= -0.639 X(o=-0.64,f=-0.3) USER MOD Single : A 4 HIS : no HD1:sc= -0.253 X(o=-0.25,f=-0.023) USER MOD Single : A 5 HIS : no HD1:sc= -0.148 X(o=-0.15,f=0) USER MOD Single : A 6 HIS : no HD1:sc= -0.0803 X(o=-0.08,f=-0.011) USER MOD Single : A 7 HIS :FLIP no HD1:sc= -1.07 F(o=-3.7!,f=-1.1) USER MOD Single : A 8 HIS : no HD1:sc= 0 X(o=0,f=-0.17) USER MOD Single : A 9 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 11 THR OG1 : rot 49:sc= 0.318 USER MOD Single : A 15 GLN : amide:sc= -0.0689 X(o=-0.069,f=-0.082) USER MOD Single : A 16 THR OG1 : rot 28:sc= 0.947 USER MOD Single : A 17 GLN : amide:sc= -2.37! C(o=-2.4!,f=-3.3!) USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 22 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 23 SER OG : rot 1:sc= 0.377 USER MOD Single : A 25 GLN : amide:sc= -0.346 K(o=-0.35,f=-5.6!) USER MOD Single : A 28 LYS NZ :NH3+ 164:sc= -0.0452 (180deg=-0.347) USER MOD Single : A 29 LYS NZ :NH3+ 167:sc= -0.0332 (180deg=-0.23) USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 THR OG1 : rot 39:sc= -1.05 USER MOD Single : A 39 LYS NZ :NH3+ 173:sc= 0.329 (180deg=0.253) USER MOD Single : A 45 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0167) USER MOD Single : A 49 HIS : +bothHN:sc= -2.68! C(o=-2.7!,f=-6.7!) USER MOD Single : A 50 TYR OH : rot 171:sc= 0.183 USER MOD Single : A 58 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0104) USER MOD Single : A 59 GLN : amide:sc= -1.38 K(o=-1.4,f=-4.5!) USER MOD Single : A 62 SER OG : rot 52:sc= 0.0983 USER MOD Single : A 63 SER OG : rot -5:sc= 0.746 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ -165:sc= -0.0807 (180deg=-0.282) USER MOD Single : A 73 THR OG1 : rot 180:sc= -0.468 USER MOD Single : A 81 LYS NZ :NH3+ -164:sc= 1.15 (180deg=0.837) USER MOD Single : A 85 GLN : amide:sc= 0 K(o=0,f=-0.71) USER MOD Single : A 89 THR OG1 : rot -33:sc= 0.184 USER MOD Single : A 90 MET CE :methyl -157:sc= -1.2 (180deg=-2.91) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : A 95 LYS NZ :NH3+ -141:sc= 2.26 (180deg=0.252) USER MOD Single : A 99 THR OG1 : rot 74:sc= 0.384 USER MOD Single : A 102 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 GLN : amide:sc= -0.676 K(o=-0.68,f=-1.4) USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 111 TYR OH : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 THR OG1 : rot 180:sc= -0.566 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 2.293 -4.370 0.915 1.00 3.40 N ATOM 2 CA MET A 1 2.597 -3.389 -0.153 1.00 10.21 C ATOM 3 C MET A 1 1.943 -3.829 -1.455 1.00 31.33 C ATOM 4 O MET A 1 2.208 -4.928 -1.947 1.00 3.30 O ATOM 5 CB MET A 1 4.115 -3.254 -0.350 1.00 73.31 C ATOM 6 CG MET A 1 4.509 -2.268 -1.446 1.00 65.15 C ATOM 7 SD MET A 1 3.969 -0.583 -1.092 1.00 4.42 S ATOM 8 CE MET A 1 4.565 0.281 -2.546 1.00 65.21 C ATOM 0 H1 MET A 1 2.741 -4.066 1.803 1.00 3.40 H new ATOM 0 H2 MET A 1 1.263 -4.429 1.049 1.00 3.40 H new ATOM 0 H3 MET A 1 2.661 -5.304 0.643 1.00 3.40 H new ATOM 0 HA MET A 1 2.200 -2.418 0.143 1.00 10.21 H new ATOM 0 HB2 MET A 1 4.567 -2.938 0.590 1.00 73.31 H new ATOM 0 HB3 MET A 1 4.529 -4.233 -0.589 1.00 73.31 H new ATOM 0 HG2 MET A 1 5.592 -2.280 -1.568 1.00 65.15 H new ATOM 0 HG3 MET A 1 4.078 -2.592 -2.393 1.00 65.15 H new ATOM 0 HE1 MET A 1 4.306 1.337 -2.473 1.00 65.21 H new ATOM 0 HE2 MET A 1 5.648 0.177 -2.613 1.00 65.21 H new ATOM 0 HE3 MET A 1 4.104 -0.145 -3.437 1.00 65.21 H new ATOM 20 N ALA A 2 1.095 -2.970 -2.010 1.00 11.55 N ATOM 21 CA ALA A 2 0.316 -3.317 -3.188 1.00 5.04 C ATOM 22 C ALA A 2 1.136 -3.179 -4.467 1.00 60.10 C ATOM 23 O ALA A 2 1.304 -2.081 -5.001 1.00 53.10 O ATOM 24 CB ALA A 2 -0.942 -2.463 -3.267 1.00 52.24 C ATOM 0 H ALA A 2 0.931 -2.026 -1.660 1.00 11.55 H new ATOM 0 HA ALA A 2 0.026 -4.363 -3.094 1.00 5.04 H new ATOM 0 HB1 ALA A 2 -1.512 -2.737 -4.155 1.00 52.24 H new ATOM 0 HB2 ALA A 2 -1.551 -2.630 -2.379 1.00 52.24 H new ATOM 0 HB3 ALA A 2 -0.664 -1.411 -3.324 1.00 52.24 H new ATOM 30 N HIS A 3 1.673 -4.298 -4.932 1.00 21.32 N ATOM 31 CA HIS A 3 2.278 -4.373 -6.256 1.00 71.41 C ATOM 32 C HIS A 3 1.351 -5.195 -7.147 1.00 74.23 C ATOM 33 O HIS A 3 1.237 -6.412 -6.992 1.00 21.43 O ATOM 34 CB HIS A 3 3.702 -4.965 -6.205 1.00 10.53 C ATOM 35 CG HIS A 3 3.790 -6.370 -5.687 1.00 12.00 C ATOM 36 ND1 HIS A 3 4.207 -7.431 -6.460 1.00 64.50 N ATOM 37 CD2 HIS A 3 3.538 -6.881 -4.460 1.00 70.35 C ATOM 38 CE1 HIS A 3 4.206 -8.530 -5.734 1.00 44.42 C ATOM 39 NE2 HIS A 3 3.805 -8.224 -4.516 1.00 50.14 N ATOM 0 H HIS A 3 1.702 -5.173 -4.408 1.00 21.32 H new ATOM 0 HA HIS A 3 2.393 -3.370 -6.668 1.00 71.41 H new ATOM 0 HB2 HIS A 3 4.126 -4.937 -7.209 1.00 10.53 H new ATOM 0 HB3 HIS A 3 4.323 -4.324 -5.579 1.00 10.53 H new ATOM 0 HD2 HIS A 3 3.191 -6.333 -3.597 1.00 70.35 H new ATOM 0 HE1 HIS A 3 4.486 -9.515 -6.078 1.00 44.42 H new ATOM 0 HE2 HIS A 3 3.709 -8.880 -3.741 1.00 50.14 H new ATOM 48 N HIS A 4 0.664 -4.504 -8.055 1.00 41.44 N ATOM 49 CA HIS A 4 -0.434 -5.094 -8.820 1.00 61.42 C ATOM 50 C HIS A 4 0.030 -6.325 -9.594 1.00 34.24 C ATOM 51 O HIS A 4 0.702 -6.210 -10.622 1.00 73.23 O ATOM 52 CB HIS A 4 -1.040 -4.059 -9.780 1.00 70.34 C ATOM 53 CG HIS A 4 -1.529 -2.812 -9.096 1.00 12.14 C ATOM 54 ND1 HIS A 4 -2.851 -2.598 -8.762 1.00 24.54 N ATOM 55 CD2 HIS A 4 -0.860 -1.706 -8.686 1.00 32.52 C ATOM 56 CE1 HIS A 4 -2.969 -1.419 -8.179 1.00 45.00 C ATOM 57 NE2 HIS A 4 -1.779 -0.863 -8.119 1.00 44.43 N ATOM 0 H HIS A 4 0.850 -3.527 -8.280 1.00 41.44 H new ATOM 0 HA HIS A 4 -1.201 -5.408 -8.112 1.00 61.42 H new ATOM 0 HB2 HIS A 4 -0.292 -3.785 -10.524 1.00 70.34 H new ATOM 0 HB3 HIS A 4 -1.870 -4.517 -10.317 1.00 70.34 H new ATOM 0 HD2 HIS A 4 0.200 -1.524 -8.788 1.00 32.52 H new ATOM 0 HE1 HIS A 4 -3.888 -0.985 -7.813 1.00 45.00 H new ATOM 0 HE2 HIS A 4 -1.573 0.050 -7.715 1.00 44.43 H new ATOM 66 N HIS A 5 -0.309 -7.502 -9.070 1.00 33.34 N ATOM 67 CA HIS A 5 -0.013 -8.764 -9.740 1.00 30.04 C ATOM 68 C HIS A 5 -0.841 -8.876 -11.018 1.00 71.42 C ATOM 69 O HIS A 5 -1.915 -9.482 -11.029 1.00 43.00 O ATOM 70 CB HIS A 5 -0.292 -9.952 -8.800 1.00 43.53 C ATOM 71 CG HIS A 5 -0.052 -11.301 -9.420 1.00 2.34 C ATOM 72 ND1 HIS A 5 1.165 -11.945 -9.374 1.00 73.32 N ATOM 73 CD2 HIS A 5 -0.885 -12.128 -10.100 1.00 13.00 C ATOM 74 CE1 HIS A 5 1.072 -13.104 -9.997 1.00 45.42 C ATOM 75 NE2 HIS A 5 -0.161 -13.240 -10.446 1.00 75.32 N ATOM 0 H HIS A 5 -0.792 -7.606 -8.178 1.00 33.34 H new ATOM 0 HA HIS A 5 1.044 -8.787 -10.005 1.00 30.04 H new ATOM 0 HB2 HIS A 5 0.336 -9.855 -7.915 1.00 43.53 H new ATOM 0 HB3 HIS A 5 -1.327 -9.899 -8.464 1.00 43.53 H new ATOM 0 HD2 HIS A 5 -1.925 -11.945 -10.327 1.00 13.00 H new ATOM 0 HE1 HIS A 5 1.871 -13.821 -10.119 1.00 45.42 H new ATOM 0 HE2 HIS A 5 -0.518 -14.042 -10.966 1.00 75.32 H new ATOM 84 N HIS A 6 -0.359 -8.244 -12.079 1.00 63.13 N ATOM 85 CA HIS A 6 -1.053 -8.250 -13.360 1.00 11.21 C ATOM 86 C HIS A 6 -0.525 -9.394 -14.218 1.00 65.13 C ATOM 87 O HIS A 6 0.681 -9.497 -14.448 1.00 22.35 O ATOM 88 CB HIS A 6 -0.859 -6.903 -14.077 1.00 13.32 C ATOM 89 CG HIS A 6 -1.789 -6.688 -15.237 1.00 73.33 C ATOM 90 ND1 HIS A 6 -2.753 -5.701 -15.254 1.00 11.11 N ATOM 91 CD2 HIS A 6 -1.899 -7.333 -16.425 1.00 2.41 C ATOM 92 CE1 HIS A 6 -3.411 -5.750 -16.397 1.00 15.55 C ATOM 93 NE2 HIS A 6 -2.914 -6.729 -17.124 1.00 40.03 N ATOM 0 H HIS A 6 0.515 -7.718 -12.078 1.00 63.13 H new ATOM 0 HA HIS A 6 -2.120 -8.395 -13.192 1.00 11.21 H new ATOM 0 HB2 HIS A 6 -1.000 -6.097 -13.357 1.00 13.32 H new ATOM 0 HB3 HIS A 6 0.169 -6.837 -14.432 1.00 13.32 H new ATOM 0 HD2 HIS A 6 -1.299 -8.167 -16.759 1.00 2.41 H new ATOM 0 HE1 HIS A 6 -4.221 -5.097 -16.687 1.00 15.55 H new ATOM 0 HE2 HIS A 6 -3.232 -6.995 -18.056 1.00 40.03 H new ATOM 102 N HIS A 7 -1.425 -10.255 -14.675 1.00 35.24 N ATOM 103 CA HIS A 7 -1.050 -11.411 -15.483 1.00 21.22 C ATOM 104 C HIS A 7 -2.247 -11.897 -16.295 1.00 62.14 C ATOM 105 O HIS A 7 -3.294 -12.235 -15.734 1.00 65.32 O ATOM 106 CB HIS A 7 -0.517 -12.542 -14.585 1.00 40.00 C ATOM 107 CG HIS A 7 -0.126 -13.788 -15.328 1.00 5.42 C ATOM 108 ND1 HIS A 7 0.678 -13.968 -16.403 1.00 32.01 N flip ATOM 109 CD2 HIS A 7 -0.556 -15.045 -14.963 1.00 63.42 C flip ATOM 110 CE1 HIS A 7 0.718 -15.316 -16.661 1.00 15.31 C flip ATOM 111 NE2 HIS A 7 -0.034 -15.941 -15.777 1.00 2.11 N flip ATOM 0 H HIS A 7 -2.426 -10.175 -14.499 1.00 35.24 H new ATOM 0 HA HIS A 7 -0.259 -11.114 -16.171 1.00 21.22 H new ATOM 0 HB2 HIS A 7 0.349 -12.175 -14.033 1.00 40.00 H new ATOM 0 HB3 HIS A 7 -1.280 -12.796 -13.849 1.00 40.00 H new ATOM 0 HD2 HIS A 7 -1.218 -15.263 -14.138 1.00 63.42 H new ATOM 0 HE1 HIS A 7 1.274 -15.787 -17.458 1.00 15.31 H new ATOM 0 HE2 HIS A 7 -0.186 -16.948 -15.731 1.00 2.11 H new ATOM 120 N HIS A 8 -2.090 -11.910 -17.615 1.00 54.52 N ATOM 121 CA HIS A 8 -3.124 -12.403 -18.520 1.00 71.42 C ATOM 122 C HIS A 8 -3.238 -13.924 -18.392 1.00 60.23 C ATOM 123 O HIS A 8 -2.685 -14.676 -19.196 1.00 64.12 O ATOM 124 CB HIS A 8 -2.795 -11.994 -19.965 1.00 2.44 C ATOM 125 CG HIS A 8 -3.825 -12.406 -20.975 1.00 43.31 C ATOM 126 ND1 HIS A 8 -3.704 -13.536 -21.750 1.00 41.21 N ATOM 127 CD2 HIS A 8 -4.984 -11.817 -21.354 1.00 73.24 C ATOM 128 CE1 HIS A 8 -4.740 -13.623 -22.562 1.00 22.34 C ATOM 129 NE2 HIS A 8 -5.534 -12.591 -22.346 1.00 54.34 N ATOM 0 H HIS A 8 -1.247 -11.581 -18.086 1.00 54.52 H new ATOM 0 HA HIS A 8 -4.084 -11.961 -18.252 1.00 71.42 H new ATOM 0 HB2 HIS A 8 -2.677 -10.911 -20.005 1.00 2.44 H new ATOM 0 HB3 HIS A 8 -1.836 -12.430 -20.244 1.00 2.44 H new ATOM 0 HD2 HIS A 8 -5.400 -10.906 -20.950 1.00 73.24 H new ATOM 0 HE1 HIS A 8 -4.910 -14.408 -23.284 1.00 22.34 H new ATOM 0 HE2 HIS A 8 -6.409 -12.400 -22.834 1.00 54.34 H new ATOM 138 N MET A 9 -3.928 -14.363 -17.345 1.00 34.13 N ATOM 139 CA MET A 9 -4.030 -15.779 -17.015 1.00 52.34 C ATOM 140 C MET A 9 -5.144 -16.433 -17.827 1.00 10.22 C ATOM 141 O MET A 9 -4.904 -17.359 -18.604 1.00 4.13 O ATOM 142 CB MET A 9 -4.301 -15.942 -15.511 1.00 35.21 C ATOM 143 CG MET A 9 -4.032 -17.342 -14.974 1.00 10.04 C ATOM 144 SD MET A 9 -2.277 -17.754 -14.978 1.00 4.34 S ATOM 145 CE MET A 9 -2.290 -19.331 -14.128 1.00 21.11 C ATOM 0 H MET A 9 -4.431 -13.749 -16.704 1.00 34.13 H new ATOM 0 HA MET A 9 -3.089 -16.270 -17.262 1.00 52.34 H new ATOM 0 HB2 MET A 9 -3.683 -15.230 -14.963 1.00 35.21 H new ATOM 0 HB3 MET A 9 -5.340 -15.682 -15.311 1.00 35.21 H new ATOM 0 HG2 MET A 9 -4.418 -17.419 -13.958 1.00 10.04 H new ATOM 0 HG3 MET A 9 -4.575 -18.070 -15.577 1.00 10.04 H new ATOM 0 HE1 MET A 9 -1.272 -19.713 -14.054 1.00 21.11 H new ATOM 0 HE2 MET A 9 -2.703 -19.202 -13.128 1.00 21.11 H new ATOM 0 HE3 MET A 9 -2.903 -20.039 -14.685 1.00 21.11 H new ATOM 155 N GLY A 10 -6.359 -15.928 -17.652 1.00 72.52 N ATOM 156 CA GLY A 10 -7.505 -16.464 -18.359 1.00 63.23 C ATOM 157 C GLY A 10 -8.727 -15.583 -18.213 1.00 1.24 C ATOM 158 O GLY A 10 -8.623 -14.437 -17.763 1.00 31.32 O ATOM 0 H GLY A 10 -6.571 -15.150 -17.027 1.00 72.52 H new ATOM 0 HA2 GLY A 10 -7.261 -16.572 -19.416 1.00 63.23 H new ATOM 0 HA3 GLY A 10 -7.730 -17.461 -17.981 1.00 63.23 H new ATOM 162 N THR A 11 -9.882 -16.113 -18.600 1.00 0.32 N ATOM 163 CA THR A 11 -11.146 -15.393 -18.502 1.00 22.11 C ATOM 164 C THR A 11 -12.231 -16.313 -17.945 1.00 23.13 C ATOM 165 O THR A 11 -12.641 -17.273 -18.608 1.00 3.55 O ATOM 166 CB THR A 11 -11.589 -14.847 -19.885 1.00 61.11 C ATOM 167 OG1 THR A 11 -11.541 -15.900 -20.861 1.00 12.15 O ATOM 168 CG2 THR A 11 -10.703 -13.688 -20.338 1.00 23.11 C ATOM 0 H THR A 11 -9.968 -17.052 -18.990 1.00 0.32 H new ATOM 0 HA THR A 11 -11.000 -14.549 -17.828 1.00 22.11 H new ATOM 0 HB THR A 11 -12.610 -14.477 -19.789 1.00 61.11 H new ATOM 0 HG1 THR A 11 -12.000 -16.692 -20.511 1.00 12.15 H new ATOM 0 HG21 THR A 11 -11.041 -13.330 -21.310 1.00 23.11 H new ATOM 0 HG22 THR A 11 -10.764 -12.878 -19.611 1.00 23.11 H new ATOM 0 HG23 THR A 11 -9.670 -14.028 -20.416 1.00 23.11 H new ATOM 176 N LEU A 12 -12.674 -16.037 -16.725 1.00 23.05 N ATOM 177 CA LEU A 12 -13.724 -16.832 -16.096 1.00 13.01 C ATOM 178 C LEU A 12 -15.031 -16.646 -16.859 1.00 72.23 C ATOM 179 O LEU A 12 -15.702 -17.614 -17.221 1.00 0.21 O ATOM 180 CB LEU A 12 -13.895 -16.427 -14.625 1.00 64.41 C ATOM 181 CG LEU A 12 -12.660 -16.648 -13.734 1.00 51.22 C ATOM 182 CD1 LEU A 12 -12.929 -16.167 -12.311 1.00 51.14 C ATOM 183 CD2 LEU A 12 -12.244 -18.119 -13.741 1.00 60.24 C ATOM 0 H LEU A 12 -12.324 -15.270 -16.151 1.00 23.05 H new ATOM 0 HA LEU A 12 -13.442 -17.885 -16.126 1.00 13.01 H new ATOM 0 HB2 LEU A 12 -14.167 -15.372 -14.585 1.00 64.41 H new ATOM 0 HB3 LEU A 12 -14.730 -16.988 -14.206 1.00 64.41 H new ATOM 0 HG LEU A 12 -11.836 -16.061 -14.141 1.00 51.22 H new ATOM 0 HD11 LEU A 12 -12.043 -16.332 -11.698 1.00 51.14 H new ATOM 0 HD12 LEU A 12 -13.167 -15.103 -12.325 1.00 51.14 H new ATOM 0 HD13 LEU A 12 -13.769 -16.721 -11.892 1.00 51.14 H new ATOM 0 HD21 LEU A 12 -11.369 -18.253 -13.105 1.00 60.24 H new ATOM 0 HD22 LEU A 12 -13.064 -18.731 -13.364 1.00 60.24 H new ATOM 0 HD23 LEU A 12 -12.002 -18.424 -14.759 1.00 60.24 H new ATOM 195 N GLU A 13 -15.364 -15.389 -17.118 1.00 22.00 N ATOM 196 CA GLU A 13 -16.534 -15.035 -17.909 1.00 22.14 C ATOM 197 C GLU A 13 -16.078 -14.410 -19.224 1.00 41.33 C ATOM 198 O GLU A 13 -15.456 -13.344 -19.235 1.00 42.24 O ATOM 199 CB GLU A 13 -17.431 -14.067 -17.128 1.00 43.13 C ATOM 200 CG GLU A 13 -17.980 -14.654 -15.829 1.00 63.33 C ATOM 201 CD GLU A 13 -18.809 -15.911 -16.053 1.00 30.35 C ATOM 202 OE1 GLU A 13 -19.929 -15.800 -16.601 1.00 14.15 O ATOM 203 OE2 GLU A 13 -18.350 -17.012 -15.684 1.00 43.21 O ATOM 0 H GLU A 13 -14.830 -14.586 -16.785 1.00 22.00 H new ATOM 0 HA GLU A 13 -17.116 -15.932 -18.123 1.00 22.14 H new ATOM 0 HB2 GLU A 13 -16.864 -13.165 -16.898 1.00 43.13 H new ATOM 0 HB3 GLU A 13 -18.265 -13.766 -17.762 1.00 43.13 H new ATOM 0 HG2 GLU A 13 -17.150 -14.886 -15.161 1.00 63.33 H new ATOM 0 HG3 GLU A 13 -18.593 -13.905 -15.328 1.00 63.33 H new ATOM 210 N ALA A 14 -16.363 -15.090 -20.326 1.00 14.03 N ATOM 211 CA ALA A 14 -15.886 -14.669 -21.637 1.00 33.23 C ATOM 212 C ALA A 14 -16.763 -13.567 -22.223 1.00 11.25 C ATOM 213 O ALA A 14 -16.263 -12.673 -22.909 1.00 22.03 O ATOM 214 CB ALA A 14 -15.828 -15.863 -22.579 1.00 1.45 C ATOM 0 H ALA A 14 -16.926 -15.941 -20.338 1.00 14.03 H new ATOM 0 HA ALA A 14 -14.882 -14.261 -21.517 1.00 33.23 H new ATOM 0 HB1 ALA A 14 -15.470 -15.538 -23.556 1.00 1.45 H new ATOM 0 HB2 ALA A 14 -15.148 -16.613 -22.175 1.00 1.45 H new ATOM 0 HB3 ALA A 14 -16.824 -16.294 -22.682 1.00 1.45 H new ATOM 220 N GLN A 15 -18.070 -13.641 -21.951 1.00 71.12 N ATOM 221 CA GLN A 15 -19.032 -12.686 -22.505 1.00 54.40 C ATOM 222 C GLN A 15 -18.886 -12.652 -24.029 1.00 43.42 C ATOM 223 O GLN A 15 -18.647 -11.599 -24.625 1.00 31.11 O ATOM 224 CB GLN A 15 -18.814 -11.288 -21.890 1.00 11.24 C ATOM 225 CG GLN A 15 -19.825 -10.230 -22.340 1.00 43.33 C ATOM 226 CD GLN A 15 -21.254 -10.568 -21.950 1.00 41.31 C ATOM 227 OE1 GLN A 15 -21.988 -11.205 -22.708 1.00 20.25 O ATOM 228 NE2 GLN A 15 -21.658 -10.141 -20.765 1.00 24.31 N ATOM 0 H GLN A 15 -18.485 -14.353 -21.350 1.00 71.12 H new ATOM 0 HA GLN A 15 -20.046 -12.999 -22.257 1.00 54.40 H new ATOM 0 HB2 GLN A 15 -18.855 -11.373 -20.804 1.00 11.24 H new ATOM 0 HB3 GLN A 15 -17.811 -10.945 -22.145 1.00 11.24 H new ATOM 0 HG2 GLN A 15 -19.554 -9.268 -21.905 1.00 43.33 H new ATOM 0 HG3 GLN A 15 -19.767 -10.118 -23.423 1.00 43.33 H new ATOM 0 HE21 GLN A 15 -21.019 -9.617 -20.167 1.00 24.31 H new ATOM 0 HE22 GLN A 15 -22.608 -10.336 -20.449 1.00 24.31 H new ATOM 237 N THR A 16 -19.021 -13.830 -24.643 1.00 0.12 N ATOM 238 CA THR A 16 -18.737 -14.024 -26.066 1.00 75.23 C ATOM 239 C THR A 16 -17.393 -13.395 -26.441 1.00 40.03 C ATOM 240 O THR A 16 -17.327 -12.267 -26.942 1.00 21.31 O ATOM 241 CB THR A 16 -19.873 -13.500 -26.993 1.00 75.20 C ATOM 242 OG1 THR A 16 -20.293 -12.181 -26.607 1.00 44.10 O ATOM 243 CG2 THR A 16 -21.072 -14.443 -26.971 1.00 2.15 C ATOM 0 H THR A 16 -19.331 -14.677 -24.166 1.00 0.12 H new ATOM 0 HA THR A 16 -18.681 -15.101 -26.227 1.00 75.23 H new ATOM 0 HB THR A 16 -19.471 -13.458 -28.005 1.00 75.20 H new ATOM 0 HG1 THR A 16 -19.546 -11.712 -26.179 1.00 44.10 H new ATOM 0 HG21 THR A 16 -21.852 -14.055 -27.626 1.00 2.15 H new ATOM 0 HG22 THR A 16 -20.765 -15.430 -27.317 1.00 2.15 H new ATOM 0 HG23 THR A 16 -21.457 -14.519 -25.954 1.00 2.15 H new ATOM 251 N GLN A 17 -16.323 -14.130 -26.146 1.00 23.22 N ATOM 252 CA GLN A 17 -14.959 -13.663 -26.377 1.00 3.02 C ATOM 253 C GLN A 17 -14.718 -13.377 -27.859 1.00 51.13 C ATOM 254 O GLN A 17 -15.208 -14.098 -28.735 1.00 53.23 O ATOM 255 CB GLN A 17 -13.927 -14.684 -25.851 1.00 70.42 C ATOM 256 CG GLN A 17 -13.946 -16.046 -26.553 1.00 72.33 C ATOM 257 CD GLN A 17 -15.239 -16.817 -26.328 1.00 71.23 C ATOM 258 OE1 GLN A 17 -16.187 -16.698 -27.103 1.00 71.31 O ATOM 259 NE2 GLN A 17 -15.294 -17.611 -25.270 1.00 44.13 N ATOM 0 H GLN A 17 -16.377 -15.064 -25.741 1.00 23.22 H new ATOM 0 HA GLN A 17 -14.832 -12.732 -25.825 1.00 3.02 H new ATOM 0 HB2 GLN A 17 -12.930 -14.255 -25.951 1.00 70.42 H new ATOM 0 HB3 GLN A 17 -14.102 -14.839 -24.786 1.00 70.42 H new ATOM 0 HG2 GLN A 17 -13.800 -15.898 -27.623 1.00 72.33 H new ATOM 0 HG3 GLN A 17 -13.107 -16.644 -26.196 1.00 72.33 H new ATOM 0 HE21 GLN A 17 -14.490 -17.687 -24.647 1.00 44.13 H new ATOM 0 HE22 GLN A 17 -16.140 -18.147 -25.078 1.00 44.13 H new ATOM 268 N GLY A 18 -13.967 -12.318 -28.127 1.00 10.21 N ATOM 269 CA GLY A 18 -13.674 -11.921 -29.488 1.00 61.13 C ATOM 270 C GLY A 18 -12.967 -10.581 -29.529 1.00 70.32 C ATOM 271 O GLY A 18 -12.293 -10.214 -28.565 1.00 74.25 O ATOM 0 H GLY A 18 -13.550 -11.719 -27.414 1.00 10.21 H new ATOM 0 HA2 GLY A 18 -13.051 -12.678 -29.964 1.00 61.13 H new ATOM 0 HA3 GLY A 18 -14.600 -11.864 -30.060 1.00 61.13 H new ATOM 275 N PRO A 19 -13.111 -9.818 -30.628 1.00 71.50 N ATOM 276 CA PRO A 19 -12.473 -8.500 -30.765 1.00 35.41 C ATOM 277 C PRO A 19 -13.163 -7.426 -29.915 1.00 54.13 C ATOM 278 O PRO A 19 -12.644 -6.319 -29.753 1.00 73.40 O ATOM 279 CB PRO A 19 -12.624 -8.196 -32.260 1.00 23.33 C ATOM 280 CG PRO A 19 -13.856 -8.933 -32.672 1.00 14.54 C ATOM 281 CD PRO A 19 -13.898 -10.182 -31.826 1.00 31.43 C ATOM 0 HA PRO A 19 -11.439 -8.503 -30.420 1.00 35.41 H new ATOM 0 HB2 PRO A 19 -12.724 -7.125 -32.439 1.00 23.33 H new ATOM 0 HB3 PRO A 19 -11.754 -8.533 -32.823 1.00 23.33 H new ATOM 0 HG2 PRO A 19 -14.746 -8.324 -32.513 1.00 14.54 H new ATOM 0 HG3 PRO A 19 -13.825 -9.181 -33.733 1.00 14.54 H new ATOM 0 HD2 PRO A 19 -14.921 -10.456 -31.566 1.00 31.43 H new ATOM 0 HD3 PRO A 19 -13.463 -11.034 -32.348 1.00 31.43 H new ATOM 289 N GLY A 20 -14.332 -7.765 -29.381 1.00 31.23 N ATOM 290 CA GLY A 20 -15.099 -6.833 -28.572 1.00 1.24 C ATOM 291 C GLY A 20 -16.585 -7.119 -28.651 1.00 25.15 C ATOM 292 O GLY A 20 -16.984 -8.232 -29.002 1.00 53.44 O ATOM 0 H GLY A 20 -14.767 -8.680 -29.496 1.00 31.23 H new ATOM 0 HA2 GLY A 20 -14.770 -6.895 -27.535 1.00 1.24 H new ATOM 0 HA3 GLY A 20 -14.905 -5.814 -28.907 1.00 1.24 H new ATOM 296 N SER A 21 -17.399 -6.113 -28.340 1.00 21.21 N ATOM 297 CA SER A 21 -18.854 -6.242 -28.376 1.00 53.15 C ATOM 298 C SER A 21 -19.337 -6.549 -29.797 1.00 14.20 C ATOM 299 O SER A 21 -18.923 -5.891 -30.753 1.00 73.52 O ATOM 300 CB SER A 21 -19.492 -4.948 -27.856 1.00 54.50 C ATOM 301 OG SER A 21 -19.010 -4.638 -26.556 1.00 2.55 O ATOM 0 H SER A 21 -17.071 -5.190 -28.057 1.00 21.21 H new ATOM 0 HA SER A 21 -19.154 -7.072 -27.736 1.00 53.15 H new ATOM 0 HB2 SER A 21 -19.269 -4.127 -28.537 1.00 54.50 H new ATOM 0 HB3 SER A 21 -20.576 -5.056 -27.831 1.00 54.50 H new ATOM 0 HG SER A 21 -19.427 -3.809 -26.242 1.00 2.55 H new ATOM 307 N MET A 22 -20.205 -7.552 -29.931 1.00 23.10 N ATOM 308 CA MET A 22 -20.692 -7.985 -31.242 1.00 1.00 C ATOM 309 C MET A 22 -21.596 -6.923 -31.868 1.00 72.15 C ATOM 310 O MET A 22 -22.823 -7.015 -31.813 1.00 54.32 O ATOM 311 CB MET A 22 -21.428 -9.328 -31.133 1.00 40.45 C ATOM 312 CG MET A 22 -20.552 -10.463 -30.613 1.00 23.11 C ATOM 313 SD MET A 22 -19.080 -10.732 -31.625 1.00 11.22 S ATOM 314 CE MET A 22 -18.272 -12.055 -30.721 1.00 2.32 C ATOM 0 H MET A 22 -20.586 -8.081 -29.147 1.00 23.10 H new ATOM 0 HA MET A 22 -19.829 -8.120 -31.893 1.00 1.00 H new ATOM 0 HB2 MET A 22 -22.286 -9.210 -30.471 1.00 40.45 H new ATOM 0 HB3 MET A 22 -21.817 -9.600 -32.114 1.00 40.45 H new ATOM 0 HG2 MET A 22 -20.248 -10.242 -29.590 1.00 23.11 H new ATOM 0 HG3 MET A 22 -21.137 -11.382 -30.580 1.00 23.11 H new ATOM 0 HE1 MET A 22 -17.346 -12.329 -31.227 1.00 2.32 H new ATOM 0 HE2 MET A 22 -18.046 -11.719 -29.709 1.00 2.32 H new ATOM 0 HE3 MET A 22 -18.932 -12.922 -30.677 1.00 2.32 H new ATOM 324 N SER A 23 -20.963 -5.900 -32.429 1.00 10.14 N ATOM 325 CA SER A 23 -21.651 -4.786 -33.073 1.00 32.11 C ATOM 326 C SER A 23 -20.699 -4.104 -34.059 1.00 62.52 C ATOM 327 O SER A 23 -19.698 -4.698 -34.472 1.00 32.10 O ATOM 328 CB SER A 23 -22.131 -3.776 -32.018 1.00 71.33 C ATOM 329 OG SER A 23 -23.062 -4.362 -31.118 1.00 5.30 O ATOM 0 H SER A 23 -19.946 -5.819 -32.450 1.00 10.14 H new ATOM 0 HA SER A 23 -22.521 -5.163 -33.611 1.00 32.11 H new ATOM 0 HB2 SER A 23 -21.275 -3.397 -31.461 1.00 71.33 H new ATOM 0 HB3 SER A 23 -22.592 -2.922 -32.514 1.00 71.33 H new ATOM 0 HG SER A 23 -23.192 -5.305 -31.350 1.00 5.30 H new ATOM 335 N ALA A 24 -21.011 -2.867 -34.440 1.00 60.44 N ATOM 336 CA ALA A 24 -20.141 -2.097 -35.320 1.00 54.02 C ATOM 337 C ALA A 24 -18.830 -1.747 -34.616 1.00 62.11 C ATOM 338 O ALA A 24 -18.729 -0.720 -33.937 1.00 62.02 O ATOM 339 CB ALA A 24 -20.845 -0.832 -35.804 1.00 34.21 C ATOM 0 H ALA A 24 -21.859 -2.379 -34.152 1.00 60.44 H new ATOM 0 HA ALA A 24 -19.908 -2.712 -36.189 1.00 54.02 H new ATOM 0 HB1 ALA A 24 -20.178 -0.272 -36.459 1.00 34.21 H new ATOM 0 HB2 ALA A 24 -21.747 -1.105 -36.352 1.00 34.21 H new ATOM 0 HB3 ALA A 24 -21.114 -0.215 -34.947 1.00 34.21 H new ATOM 345 N GLN A 25 -17.840 -2.624 -34.753 1.00 52.11 N ATOM 346 CA GLN A 25 -16.516 -2.397 -34.178 1.00 33.31 C ATOM 347 C GLN A 25 -15.620 -1.711 -35.198 1.00 11.54 C ATOM 348 O GLN A 25 -15.633 -2.063 -36.379 1.00 33.33 O ATOM 349 CB GLN A 25 -15.863 -3.721 -33.755 1.00 24.32 C ATOM 350 CG GLN A 25 -16.628 -4.486 -32.683 1.00 62.34 C ATOM 351 CD GLN A 25 -15.876 -5.719 -32.212 1.00 50.24 C ATOM 352 OE1 GLN A 25 -14.648 -5.746 -32.215 1.00 54.31 O ATOM 353 NE2 GLN A 25 -16.601 -6.747 -31.803 1.00 0.52 N ATOM 0 H GLN A 25 -17.930 -3.504 -35.260 1.00 52.11 H new ATOM 0 HA GLN A 25 -16.637 -1.765 -33.298 1.00 33.31 H new ATOM 0 HB2 GLN A 25 -15.759 -4.358 -34.634 1.00 24.32 H new ATOM 0 HB3 GLN A 25 -14.857 -3.515 -33.389 1.00 24.32 H new ATOM 0 HG2 GLN A 25 -16.814 -3.829 -31.833 1.00 62.34 H new ATOM 0 HG3 GLN A 25 -17.601 -4.783 -33.075 1.00 62.34 H new ATOM 0 HE21 GLN A 25 -17.619 -6.690 -31.814 1.00 0.52 H new ATOM 0 HE22 GLN A 25 -16.142 -7.597 -31.476 1.00 0.52 H new ATOM 362 N LEU A 26 -14.850 -0.730 -34.747 1.00 30.13 N ATOM 363 CA LEU A 26 -13.931 -0.021 -35.623 1.00 12.14 C ATOM 364 C LEU A 26 -12.667 0.388 -34.874 1.00 51.43 C ATOM 365 O LEU A 26 -12.671 1.356 -34.112 1.00 61.15 O ATOM 366 CB LEU A 26 -14.614 1.211 -36.233 1.00 71.53 C ATOM 367 CG LEU A 26 -13.722 2.062 -37.154 1.00 4.02 C ATOM 368 CD1 LEU A 26 -13.136 1.215 -38.278 1.00 1.33 C ATOM 369 CD2 LEU A 26 -14.505 3.242 -37.723 1.00 14.44 C ATOM 0 H LEU A 26 -14.844 -0.408 -33.779 1.00 30.13 H new ATOM 0 HA LEU A 26 -13.644 -0.696 -36.429 1.00 12.14 H new ATOM 0 HB2 LEU A 26 -15.485 0.881 -36.800 1.00 71.53 H new ATOM 0 HB3 LEU A 26 -14.981 1.842 -35.423 1.00 71.53 H new ATOM 0 HG LEU A 26 -12.897 2.453 -36.558 1.00 4.02 H new ATOM 0 HD11 LEU A 26 -12.509 1.839 -38.915 1.00 1.33 H new ATOM 0 HD12 LEU A 26 -12.534 0.412 -37.853 1.00 1.33 H new ATOM 0 HD13 LEU A 26 -13.945 0.788 -38.871 1.00 1.33 H new ATOM 0 HD21 LEU A 26 -13.856 3.831 -38.371 1.00 14.44 H new ATOM 0 HD22 LEU A 26 -15.354 2.872 -38.298 1.00 14.44 H new ATOM 0 HD23 LEU A 26 -14.865 3.867 -36.906 1.00 14.44 H new ATOM 381 N GLU A 27 -11.596 -0.366 -35.091 1.00 2.20 N ATOM 382 CA GLU A 27 -10.275 -0.015 -34.588 1.00 14.02 C ATOM 383 C GLU A 27 -9.362 0.295 -35.767 1.00 65.33 C ATOM 384 O GLU A 27 -9.438 -0.366 -36.810 1.00 60.33 O ATOM 385 CB GLU A 27 -9.680 -1.159 -33.752 1.00 53.11 C ATOM 386 CG GLU A 27 -10.443 -1.457 -32.466 1.00 1.14 C ATOM 387 CD GLU A 27 -10.499 -0.263 -31.530 1.00 4.22 C ATOM 388 OE1 GLU A 27 -9.449 0.089 -30.950 1.00 35.30 O ATOM 389 OE2 GLU A 27 -11.587 0.336 -31.373 1.00 43.34 O ATOM 0 H GLU A 27 -11.620 -1.237 -35.620 1.00 2.20 H new ATOM 0 HA GLU A 27 -10.364 0.860 -33.944 1.00 14.02 H new ATOM 0 HB2 GLU A 27 -9.651 -2.062 -34.361 1.00 53.11 H new ATOM 0 HB3 GLU A 27 -8.649 -0.911 -33.500 1.00 53.11 H new ATOM 0 HG2 GLU A 27 -11.458 -1.768 -32.714 1.00 1.14 H new ATOM 0 HG3 GLU A 27 -9.970 -2.294 -31.953 1.00 1.14 H new ATOM 396 N LYS A 28 -8.519 1.311 -35.611 1.00 20.23 N ATOM 397 CA LYS A 28 -7.584 1.709 -36.655 1.00 1.42 C ATOM 398 C LYS A 28 -6.167 1.799 -36.087 1.00 24.22 C ATOM 399 O LYS A 28 -5.871 2.648 -35.245 1.00 43.22 O ATOM 400 CB LYS A 28 -8.023 3.048 -37.283 1.00 13.42 C ATOM 401 CG LYS A 28 -8.051 4.229 -36.309 1.00 53.12 C ATOM 402 CD LYS A 28 -8.685 5.474 -36.928 1.00 50.34 C ATOM 403 CE LYS A 28 -10.187 5.303 -37.142 1.00 71.00 C ATOM 404 NZ LYS A 28 -10.906 5.074 -35.861 1.00 31.34 N ATOM 0 H LYS A 28 -8.465 1.877 -34.764 1.00 20.23 H new ATOM 0 HA LYS A 28 -7.584 0.954 -37.441 1.00 1.42 H new ATOM 0 HB2 LYS A 28 -7.348 3.288 -38.105 1.00 13.42 H new ATOM 0 HB3 LYS A 28 -9.017 2.924 -37.713 1.00 13.42 H new ATOM 0 HG2 LYS A 28 -8.607 3.947 -35.415 1.00 53.12 H new ATOM 0 HG3 LYS A 28 -7.034 4.461 -35.992 1.00 53.12 H new ATOM 0 HD2 LYS A 28 -8.506 6.332 -36.280 1.00 50.34 H new ATOM 0 HD3 LYS A 28 -8.205 5.689 -37.882 1.00 50.34 H new ATOM 0 HE2 LYS A 28 -10.588 6.192 -37.630 1.00 71.00 H new ATOM 0 HE3 LYS A 28 -10.365 4.463 -37.814 1.00 71.00 H new ATOM 0 HZ1 LYS A 28 -11.924 5.232 -36.002 1.00 31.34 H new ATOM 0 HZ2 LYS A 28 -10.747 4.096 -35.544 1.00 31.34 H new ATOM 0 HZ3 LYS A 28 -10.550 5.734 -35.140 1.00 31.34 H new ATOM 418 N LYS A 29 -5.302 0.891 -36.523 1.00 10.31 N ATOM 419 CA LYS A 29 -3.916 0.862 -36.056 1.00 4.51 C ATOM 420 C LYS A 29 -2.967 0.957 -37.244 1.00 32.22 C ATOM 421 O LYS A 29 -2.845 0.014 -38.018 1.00 50.14 O ATOM 422 CB LYS A 29 -3.648 -0.434 -35.276 1.00 34.44 C ATOM 423 CG LYS A 29 -4.633 -0.681 -34.136 1.00 63.44 C ATOM 424 CD LYS A 29 -4.320 -1.968 -33.379 1.00 73.32 C ATOM 425 CE LYS A 29 -2.986 -1.886 -32.643 1.00 34.34 C ATOM 426 NZ LYS A 29 -2.972 -0.794 -31.630 1.00 5.41 N ATOM 0 H LYS A 29 -5.533 0.164 -37.200 1.00 10.31 H new ATOM 0 HA LYS A 29 -3.748 1.713 -35.395 1.00 4.51 H new ATOM 0 HB2 LYS A 29 -3.686 -1.277 -35.966 1.00 34.44 H new ATOM 0 HB3 LYS A 29 -2.637 -0.400 -34.870 1.00 34.44 H new ATOM 0 HG2 LYS A 29 -4.606 0.162 -33.445 1.00 63.44 H new ATOM 0 HG3 LYS A 29 -5.645 -0.733 -34.537 1.00 63.44 H new ATOM 0 HD2 LYS A 29 -5.117 -2.171 -32.664 1.00 73.32 H new ATOM 0 HD3 LYS A 29 -4.298 -2.804 -34.078 1.00 73.32 H new ATOM 0 HE2 LYS A 29 -2.784 -2.838 -32.152 1.00 34.34 H new ATOM 0 HE3 LYS A 29 -2.184 -1.722 -33.363 1.00 34.34 H new ATOM 0 HZ1 LYS A 29 -2.147 -0.908 -31.008 1.00 5.41 H new ATOM 0 HZ2 LYS A 29 -2.917 0.126 -32.112 1.00 5.41 H new ATOM 0 HZ3 LYS A 29 -3.842 -0.836 -31.062 1.00 5.41 H new ATOM 440 N VAL A 30 -2.283 2.085 -37.375 1.00 1.11 N ATOM 441 CA VAL A 30 -1.428 2.331 -38.531 1.00 62.04 C ATOM 442 C VAL A 30 -0.170 1.460 -38.488 1.00 61.23 C ATOM 443 O VAL A 30 0.535 1.417 -37.477 1.00 52.32 O ATOM 444 CB VAL A 30 -1.043 3.831 -38.643 1.00 12.12 C ATOM 445 CG1 VAL A 30 -0.269 4.305 -37.416 1.00 33.10 C ATOM 446 CG2 VAL A 30 -0.255 4.100 -39.921 1.00 70.43 C ATOM 0 H VAL A 30 -2.303 2.845 -36.695 1.00 1.11 H new ATOM 0 HA VAL A 30 -2.001 2.060 -39.418 1.00 62.04 H new ATOM 0 HB VAL A 30 -1.970 4.403 -38.689 1.00 12.12 H new ATOM 0 HG11 VAL A 30 -0.017 5.359 -37.530 1.00 33.10 H new ATOM 0 HG12 VAL A 30 -0.883 4.173 -36.525 1.00 33.10 H new ATOM 0 HG13 VAL A 30 0.646 3.722 -37.315 1.00 33.10 H new ATOM 0 HG21 VAL A 30 0.002 5.158 -39.974 1.00 70.43 H new ATOM 0 HG22 VAL A 30 0.658 3.505 -39.918 1.00 70.43 H new ATOM 0 HG23 VAL A 30 -0.861 3.830 -40.786 1.00 70.43 H new ATOM 456 N LEU A 31 0.090 0.747 -39.585 1.00 3.31 N ATOM 457 CA LEU A 31 1.283 -0.090 -39.696 1.00 51.44 C ATOM 458 C LEU A 31 2.446 0.745 -40.212 1.00 63.53 C ATOM 459 O LEU A 31 3.588 0.574 -39.781 1.00 71.22 O ATOM 460 CB LEU A 31 1.051 -1.291 -40.637 1.00 73.13 C ATOM 461 CG LEU A 31 0.026 -2.341 -40.168 1.00 33.10 C ATOM 462 CD1 LEU A 31 0.318 -2.792 -38.739 1.00 41.32 C ATOM 463 CD2 LEU A 31 -1.397 -1.811 -40.300 1.00 61.33 C ATOM 0 H LEU A 31 -0.511 0.733 -40.409 1.00 3.31 H new ATOM 0 HA LEU A 31 1.513 -0.480 -38.704 1.00 51.44 H new ATOM 0 HB2 LEU A 31 0.729 -0.909 -41.606 1.00 73.13 H new ATOM 0 HB3 LEU A 31 2.006 -1.792 -40.793 1.00 73.13 H new ATOM 0 HG LEU A 31 0.117 -3.213 -40.816 1.00 33.10 H new ATOM 0 HD11 LEU A 31 -0.421 -3.533 -38.433 1.00 41.32 H new ATOM 0 HD12 LEU A 31 1.314 -3.232 -38.693 1.00 41.32 H new ATOM 0 HD13 LEU A 31 0.269 -1.933 -38.069 1.00 41.32 H new ATOM 0 HD21 LEU A 31 -2.101 -2.571 -39.962 1.00 61.33 H new ATOM 0 HD22 LEU A 31 -1.510 -0.915 -39.689 1.00 61.33 H new ATOM 0 HD23 LEU A 31 -1.599 -1.567 -41.343 1.00 61.33 H new ATOM 475 N THR A 32 2.147 1.649 -41.140 1.00 73.42 N ATOM 476 CA THR A 32 3.162 2.534 -41.704 1.00 63.14 C ATOM 477 C THR A 32 2.581 3.930 -41.924 1.00 74.03 C ATOM 478 O THR A 32 1.688 4.101 -42.752 1.00 24.43 O ATOM 479 CB THR A 32 3.704 1.982 -43.048 1.00 71.24 C ATOM 480 OG1 THR A 32 4.224 0.655 -42.862 1.00 42.12 O ATOM 481 CG2 THR A 32 4.801 2.880 -43.614 1.00 61.24 C ATOM 0 H THR A 32 1.210 1.788 -41.518 1.00 73.42 H new ATOM 0 HA THR A 32 3.987 2.589 -40.994 1.00 63.14 H new ATOM 0 HB THR A 32 2.876 1.958 -43.756 1.00 71.24 H new ATOM 0 HG1 THR A 32 4.563 0.314 -43.716 1.00 42.12 H new ATOM 0 HG21 THR A 32 5.160 2.466 -44.556 1.00 61.24 H new ATOM 0 HG22 THR A 32 4.401 3.879 -43.786 1.00 61.24 H new ATOM 0 HG23 THR A 32 5.627 2.937 -42.905 1.00 61.24 H new ATOM 489 N PRO A 33 3.056 4.939 -41.167 1.00 53.10 N ATOM 490 CA PRO A 33 2.584 6.324 -41.310 1.00 31.44 C ATOM 491 C PRO A 33 3.037 6.941 -42.637 1.00 3.51 C ATOM 492 O PRO A 33 4.129 6.638 -43.130 1.00 22.31 O ATOM 493 CB PRO A 33 3.225 7.045 -40.116 1.00 1.05 C ATOM 494 CG PRO A 33 4.446 6.244 -39.803 1.00 71.12 C ATOM 495 CD PRO A 33 4.092 4.814 -40.119 1.00 42.35 C ATOM 0 HA PRO A 33 1.496 6.397 -41.319 1.00 31.44 H new ATOM 0 HB2 PRO A 33 3.480 8.075 -40.365 1.00 1.05 H new ATOM 0 HB3 PRO A 33 2.546 7.082 -39.264 1.00 1.05 H new ATOM 0 HG2 PRO A 33 5.296 6.577 -40.399 1.00 71.12 H new ATOM 0 HG3 PRO A 33 4.728 6.355 -38.756 1.00 71.12 H new ATOM 0 HD2 PRO A 33 4.958 4.255 -40.475 1.00 42.35 H new ATOM 0 HD3 PRO A 33 3.714 4.291 -39.241 1.00 42.35 H new ATOM 503 N GLY A 34 2.198 7.804 -43.204 1.00 1.22 N ATOM 504 CA GLY A 34 2.496 8.412 -44.492 1.00 71.12 C ATOM 505 C GLY A 34 3.030 9.823 -44.363 1.00 51.22 C ATOM 506 O GLY A 34 3.431 10.244 -43.275 1.00 33.52 O ATOM 0 H GLY A 34 1.311 8.095 -42.792 1.00 1.22 H new ATOM 0 HA2 GLY A 34 3.227 7.798 -45.018 1.00 71.12 H new ATOM 0 HA3 GLY A 34 1.592 8.424 -45.101 1.00 71.12 H new ATOM 510 N ASP A 35 3.027 10.556 -45.477 1.00 1.32 N ATOM 511 CA ASP A 35 3.532 11.931 -45.514 1.00 65.45 C ATOM 512 C ASP A 35 2.876 12.784 -44.431 1.00 14.34 C ATOM 513 O ASP A 35 3.527 13.610 -43.791 1.00 32.43 O ATOM 514 CB ASP A 35 3.269 12.570 -46.887 1.00 64.24 C ATOM 515 CG ASP A 35 3.984 11.858 -48.024 1.00 72.41 C ATOM 516 OD1 ASP A 35 3.428 10.885 -48.565 1.00 4.21 O ATOM 517 OD2 ASP A 35 5.100 12.282 -48.394 1.00 51.11 O ATOM 0 H ASP A 35 2.677 10.218 -46.373 1.00 1.32 H new ATOM 0 HA ASP A 35 4.606 11.890 -45.334 1.00 65.45 H new ATOM 0 HB2 ASP A 35 2.197 12.568 -47.082 1.00 64.24 H new ATOM 0 HB3 ASP A 35 3.586 13.612 -46.863 1.00 64.24 H new ATOM 522 N GLY A 36 1.575 12.587 -44.251 1.00 33.03 N ATOM 523 CA GLY A 36 0.819 13.352 -43.269 1.00 42.44 C ATOM 524 C GLY A 36 0.429 14.730 -43.775 1.00 51.13 C ATOM 525 O GLY A 36 -0.620 15.263 -43.399 1.00 23.41 O ATOM 0 H GLY A 36 1.023 11.905 -44.772 1.00 33.03 H new ATOM 0 HA2 GLY A 36 -0.081 12.800 -42.999 1.00 42.44 H new ATOM 0 HA3 GLY A 36 1.413 13.457 -42.361 1.00 42.44 H new ATOM 529 N VAL A 37 1.265 15.301 -44.642 1.00 62.44 N ATOM 530 CA VAL A 37 0.983 16.595 -45.256 1.00 70.24 C ATOM 531 C VAL A 37 0.056 16.424 -46.459 1.00 51.32 C ATOM 532 O VAL A 37 -0.662 17.352 -46.847 1.00 73.24 O ATOM 533 CB VAL A 37 2.286 17.307 -45.706 1.00 11.24 C ATOM 534 CG1 VAL A 37 3.183 17.603 -44.507 1.00 11.54 C ATOM 535 CG2 VAL A 37 3.033 16.481 -46.753 1.00 52.31 C ATOM 0 H VAL A 37 2.148 14.883 -44.935 1.00 62.44 H new ATOM 0 HA VAL A 37 0.494 17.213 -44.503 1.00 70.24 H new ATOM 0 HB VAL A 37 2.008 18.255 -46.166 1.00 11.24 H new ATOM 0 HG11 VAL A 37 4.091 18.102 -44.846 1.00 11.54 H new ATOM 0 HG12 VAL A 37 2.653 18.249 -43.807 1.00 11.54 H new ATOM 0 HG13 VAL A 37 3.447 16.669 -44.010 1.00 11.54 H new ATOM 0 HG21 VAL A 37 3.942 17.005 -47.049 1.00 52.31 H new ATOM 0 HG22 VAL A 37 3.295 15.510 -46.332 1.00 52.31 H new ATOM 0 HG23 VAL A 37 2.396 16.338 -47.626 1.00 52.31 H new ATOM 545 N THR A 38 0.082 15.226 -47.038 1.00 10.01 N ATOM 546 CA THR A 38 -0.744 14.893 -48.187 1.00 12.05 C ATOM 547 C THR A 38 -2.196 14.680 -47.757 1.00 25.34 C ATOM 548 O THR A 38 -2.458 14.087 -46.707 1.00 54.22 O ATOM 549 CB THR A 38 -0.202 13.627 -48.890 1.00 44.23 C ATOM 550 OG1 THR A 38 0.095 12.612 -47.913 1.00 15.11 O ATOM 551 CG2 THR A 38 1.057 13.942 -49.694 1.00 33.03 C ATOM 0 H THR A 38 0.678 14.461 -46.721 1.00 10.01 H new ATOM 0 HA THR A 38 -0.709 15.725 -48.891 1.00 12.05 H new ATOM 0 HB THR A 38 -0.970 13.266 -49.574 1.00 44.23 H new ATOM 0 HG1 THR A 38 -0.589 12.623 -47.211 1.00 15.11 H new ATOM 0 HG21 THR A 38 1.417 13.034 -50.178 1.00 33.03 H new ATOM 0 HG22 THR A 38 0.827 14.690 -50.452 1.00 33.03 H new ATOM 0 HG23 THR A 38 1.828 14.327 -49.027 1.00 33.03 H new ATOM 559 N LYS A 39 -3.133 15.173 -48.564 1.00 43.31 N ATOM 560 CA LYS A 39 -4.550 15.151 -48.211 1.00 13.11 C ATOM 561 C LYS A 39 -5.378 14.492 -49.317 1.00 41.21 C ATOM 562 O LYS A 39 -5.463 15.021 -50.426 1.00 63.14 O ATOM 563 CB LYS A 39 -5.044 16.587 -47.970 1.00 22.03 C ATOM 564 CG LYS A 39 -4.247 17.336 -46.903 1.00 14.54 C ATOM 565 CD LYS A 39 -4.696 18.787 -46.764 1.00 41.50 C ATOM 566 CE LYS A 39 -3.880 19.530 -45.712 1.00 4.21 C ATOM 567 NZ LYS A 39 -2.428 19.543 -46.034 1.00 32.51 N ATOM 0 H LYS A 39 -2.934 15.595 -49.471 1.00 43.31 H new ATOM 0 HA LYS A 39 -4.672 14.566 -47.300 1.00 13.11 H new ATOM 0 HB2 LYS A 39 -4.993 17.142 -48.907 1.00 22.03 H new ATOM 0 HB3 LYS A 39 -6.093 16.557 -47.674 1.00 22.03 H new ATOM 0 HG2 LYS A 39 -4.359 16.829 -45.945 1.00 14.54 H new ATOM 0 HG3 LYS A 39 -3.187 17.308 -47.156 1.00 14.54 H new ATOM 0 HD2 LYS A 39 -4.598 19.292 -47.725 1.00 41.50 H new ATOM 0 HD3 LYS A 39 -5.752 18.817 -46.494 1.00 41.50 H new ATOM 0 HE2 LYS A 39 -4.242 20.555 -45.631 1.00 4.21 H new ATOM 0 HE3 LYS A 39 -4.031 19.061 -44.740 1.00 4.21 H new ATOM 0 HZ1 LYS A 39 -1.928 20.156 -45.359 1.00 32.51 H new ATOM 0 HZ2 LYS A 39 -2.049 18.577 -45.969 1.00 32.51 H new ATOM 0 HZ3 LYS A 39 -2.290 19.905 -46.999 1.00 32.51 H new ATOM 581 N PRO A 40 -5.984 13.321 -49.040 1.00 42.33 N ATOM 582 CA PRO A 40 -6.874 12.651 -49.994 1.00 34.02 C ATOM 583 C PRO A 40 -8.232 13.354 -50.082 1.00 15.53 C ATOM 584 O PRO A 40 -8.861 13.640 -49.059 1.00 20.24 O ATOM 585 CB PRO A 40 -7.018 11.240 -49.412 1.00 14.44 C ATOM 586 CG PRO A 40 -6.828 11.420 -47.943 1.00 71.04 C ATOM 587 CD PRO A 40 -5.846 12.557 -47.781 1.00 13.23 C ATOM 0 HA PRO A 40 -6.483 12.656 -51.011 1.00 34.02 H new ATOM 0 HB2 PRO A 40 -7.997 10.816 -49.637 1.00 14.44 H new ATOM 0 HB3 PRO A 40 -6.274 10.561 -49.828 1.00 14.44 H new ATOM 0 HG2 PRO A 40 -7.774 11.650 -47.453 1.00 71.04 H new ATOM 0 HG3 PRO A 40 -6.446 10.508 -47.485 1.00 71.04 H new ATOM 0 HD2 PRO A 40 -6.084 13.171 -46.912 1.00 13.23 H new ATOM 0 HD3 PRO A 40 -4.828 12.191 -47.644 1.00 13.23 H new ATOM 595 N GLN A 41 -8.679 13.625 -51.302 1.00 71.30 N ATOM 596 CA GLN A 41 -9.926 14.352 -51.530 1.00 74.23 C ATOM 597 C GLN A 41 -10.889 13.525 -52.382 1.00 54.51 C ATOM 598 O GLN A 41 -10.463 12.723 -53.219 1.00 73.51 O ATOM 599 CB GLN A 41 -9.629 15.700 -52.204 1.00 32.32 C ATOM 600 CG GLN A 41 -8.752 15.583 -53.444 1.00 20.14 C ATOM 601 CD GLN A 41 -8.452 16.927 -54.083 1.00 75.11 C ATOM 602 OE1 GLN A 41 -9.175 17.384 -54.969 1.00 42.13 O ATOM 603 NE2 GLN A 41 -7.385 17.572 -53.637 1.00 32.25 N ATOM 0 H GLN A 41 -8.194 13.351 -52.156 1.00 71.30 H new ATOM 0 HA GLN A 41 -10.403 14.536 -50.568 1.00 74.23 H new ATOM 0 HB2 GLN A 41 -10.571 16.174 -52.479 1.00 32.32 H new ATOM 0 HB3 GLN A 41 -9.140 16.356 -51.484 1.00 32.32 H new ATOM 0 HG2 GLN A 41 -7.814 15.096 -53.175 1.00 20.14 H new ATOM 0 HG3 GLN A 41 -9.246 14.942 -54.174 1.00 20.14 H new ATOM 0 HE21 GLN A 41 -6.811 17.160 -52.901 1.00 32.25 H new ATOM 0 HE22 GLN A 41 -7.137 18.481 -54.029 1.00 32.25 H new ATOM 612 N ALA A 42 -12.184 13.719 -52.157 1.00 32.14 N ATOM 613 CA ALA A 42 -13.215 12.987 -52.886 1.00 64.43 C ATOM 614 C ALA A 42 -13.283 13.438 -54.345 1.00 53.00 C ATOM 615 O ALA A 42 -12.728 14.477 -54.708 1.00 74.42 O ATOM 616 CB ALA A 42 -14.566 13.170 -52.204 1.00 22.33 C ATOM 0 H ALA A 42 -12.547 14.381 -51.471 1.00 32.14 H new ATOM 0 HA ALA A 42 -12.956 11.928 -52.877 1.00 64.43 H new ATOM 0 HB1 ALA A 42 -15.329 12.620 -52.755 1.00 22.33 H new ATOM 0 HB2 ALA A 42 -14.512 12.792 -51.183 1.00 22.33 H new ATOM 0 HB3 ALA A 42 -14.824 14.229 -52.186 1.00 22.33 H new ATOM 622 N GLY A 43 -13.946 12.639 -55.175 1.00 22.23 N ATOM 623 CA GLY A 43 -14.103 12.962 -56.583 1.00 40.21 C ATOM 624 C GLY A 43 -12.904 12.555 -57.414 1.00 65.14 C ATOM 625 O GLY A 43 -12.987 12.482 -58.642 1.00 43.04 O ATOM 0 H GLY A 43 -14.383 11.762 -54.893 1.00 22.23 H new ATOM 0 HA2 GLY A 43 -14.993 12.464 -56.969 1.00 40.21 H new ATOM 0 HA3 GLY A 43 -14.266 14.034 -56.689 1.00 40.21 H new ATOM 629 N LYS A 44 -11.790 12.270 -56.749 1.00 15.02 N ATOM 630 CA LYS A 44 -10.542 11.961 -57.438 1.00 4.12 C ATOM 631 C LYS A 44 -10.272 10.458 -57.465 1.00 2.42 C ATOM 632 O LYS A 44 -10.631 9.726 -56.536 1.00 21.32 O ATOM 633 CB LYS A 44 -9.375 12.703 -56.771 1.00 74.43 C ATOM 634 CG LYS A 44 -9.535 14.222 -56.779 1.00 13.21 C ATOM 635 CD LYS A 44 -9.662 14.769 -58.200 1.00 25.44 C ATOM 636 CE LYS A 44 -9.961 16.264 -58.214 1.00 74.31 C ATOM 637 NZ LYS A 44 -8.879 17.061 -57.581 1.00 24.40 N ATOM 0 H LYS A 44 -11.725 12.246 -55.731 1.00 15.02 H new ATOM 0 HA LYS A 44 -10.636 12.297 -58.471 1.00 4.12 H new ATOM 0 HB2 LYS A 44 -9.279 12.361 -55.740 1.00 74.43 H new ATOM 0 HB3 LYS A 44 -8.448 12.440 -57.282 1.00 74.43 H new ATOM 0 HG2 LYS A 44 -10.418 14.498 -56.202 1.00 13.21 H new ATOM 0 HG3 LYS A 44 -8.677 14.681 -56.288 1.00 13.21 H new ATOM 0 HD2 LYS A 44 -8.737 14.579 -58.745 1.00 25.44 H new ATOM 0 HD3 LYS A 44 -10.456 14.236 -58.724 1.00 25.44 H new ATOM 0 HE2 LYS A 44 -10.099 16.595 -59.243 1.00 74.31 H new ATOM 0 HE3 LYS A 44 -10.899 16.450 -57.691 1.00 74.31 H new ATOM 0 HZ1 LYS A 44 -9.050 18.073 -57.748 1.00 24.40 H new ATOM 0 HZ2 LYS A 44 -8.865 16.876 -56.558 1.00 24.40 H new ATOM 0 HZ3 LYS A 44 -7.963 16.792 -57.994 1.00 24.40 H new ATOM 651 N LYS A 45 -9.645 10.013 -58.549 1.00 31.54 N ATOM 652 CA LYS A 45 -9.260 8.619 -58.719 1.00 2.24 C ATOM 653 C LYS A 45 -8.011 8.337 -57.891 1.00 43.32 C ATOM 654 O LYS A 45 -6.937 8.848 -58.202 1.00 1.42 O ATOM 655 CB LYS A 45 -9.002 8.338 -60.212 1.00 23.45 C ATOM 656 CG LYS A 45 -8.645 6.890 -60.546 1.00 51.53 C ATOM 657 CD LYS A 45 -9.758 5.915 -60.170 1.00 61.23 C ATOM 658 CE LYS A 45 -11.092 6.275 -60.821 1.00 43.20 C ATOM 659 NZ LYS A 45 -11.022 6.268 -62.306 1.00 55.24 N ATOM 0 H LYS A 45 -9.390 10.611 -59.335 1.00 31.54 H new ATOM 0 HA LYS A 45 -10.061 7.964 -58.376 1.00 2.24 H new ATOM 0 HB2 LYS A 45 -9.891 8.616 -60.777 1.00 23.45 H new ATOM 0 HB3 LYS A 45 -8.193 8.984 -60.553 1.00 23.45 H new ATOM 0 HG2 LYS A 45 -8.438 6.807 -61.613 1.00 51.53 H new ATOM 0 HG3 LYS A 45 -7.731 6.614 -60.021 1.00 51.53 H new ATOM 0 HD2 LYS A 45 -9.471 4.907 -60.470 1.00 61.23 H new ATOM 0 HD3 LYS A 45 -9.877 5.904 -59.087 1.00 61.23 H new ATOM 0 HE2 LYS A 45 -11.855 5.569 -60.493 1.00 43.20 H new ATOM 0 HE3 LYS A 45 -11.404 7.262 -60.480 1.00 43.20 H new ATOM 0 HZ1 LYS A 45 -11.967 6.452 -62.699 1.00 55.24 H new ATOM 0 HZ2 LYS A 45 -10.364 7.007 -62.626 1.00 55.24 H new ATOM 0 HZ3 LYS A 45 -10.685 5.340 -62.633 1.00 55.24 H new ATOM 673 N VAL A 46 -8.158 7.542 -56.831 1.00 62.24 N ATOM 674 CA VAL A 46 -7.056 7.274 -55.909 1.00 12.10 C ATOM 675 C VAL A 46 -6.500 5.859 -56.089 1.00 64.05 C ATOM 676 O VAL A 46 -7.233 4.927 -56.459 1.00 45.11 O ATOM 677 CB VAL A 46 -7.483 7.478 -54.428 1.00 33.35 C ATOM 678 CG1 VAL A 46 -7.951 8.914 -54.193 1.00 13.43 C ATOM 679 CG2 VAL A 46 -8.572 6.480 -54.026 1.00 33.14 C ATOM 0 H VAL A 46 -9.031 7.072 -56.590 1.00 62.24 H new ATOM 0 HA VAL A 46 -6.272 7.992 -56.150 1.00 12.10 H new ATOM 0 HB VAL A 46 -6.612 7.295 -53.799 1.00 33.35 H new ATOM 0 HG11 VAL A 46 -8.245 9.035 -53.150 1.00 13.43 H new ATOM 0 HG12 VAL A 46 -7.139 9.604 -54.423 1.00 13.43 H new ATOM 0 HG13 VAL A 46 -8.803 9.129 -54.838 1.00 13.43 H new ATOM 0 HG21 VAL A 46 -8.851 6.646 -52.985 1.00 33.14 H new ATOM 0 HG22 VAL A 46 -9.446 6.619 -54.663 1.00 33.14 H new ATOM 0 HG23 VAL A 46 -8.195 5.464 -54.143 1.00 33.14 H new ATOM 689 N THR A 47 -5.194 5.727 -55.830 1.00 20.33 N ATOM 690 CA THR A 47 -4.475 4.460 -55.933 1.00 43.45 C ATOM 691 C THR A 47 -4.241 3.859 -54.539 1.00 3.34 C ATOM 692 O THR A 47 -3.397 4.353 -53.753 1.00 53.32 O ATOM 693 CB THR A 47 -3.118 4.664 -56.646 1.00 31.33 C ATOM 694 OG1 THR A 47 -3.317 5.379 -57.877 1.00 10.14 O ATOM 695 CG2 THR A 47 -2.433 3.332 -56.939 1.00 54.21 C ATOM 0 H THR A 47 -4.604 6.507 -55.540 1.00 20.33 H new ATOM 0 HA THR A 47 -5.084 3.771 -56.519 1.00 43.45 H new ATOM 0 HB THR A 47 -2.475 5.239 -55.980 1.00 31.33 H new ATOM 0 HG1 THR A 47 -3.549 6.311 -57.680 1.00 10.14 H new ATOM 0 HG21 THR A 47 -1.482 3.514 -57.440 1.00 54.21 H new ATOM 0 HG22 THR A 47 -2.254 2.801 -56.004 1.00 54.21 H new ATOM 0 HG23 THR A 47 -3.073 2.728 -57.582 1.00 54.21 H new ATOM 703 N VAL A 48 -4.983 2.781 -54.265 1.00 1.43 N ATOM 704 CA VAL A 48 -5.033 2.143 -52.951 1.00 41.03 C ATOM 705 C VAL A 48 -4.552 0.690 -53.002 1.00 2.14 C ATOM 706 O VAL A 48 -4.206 0.161 -54.059 1.00 5.01 O ATOM 707 CB VAL A 48 -6.477 2.154 -52.388 1.00 25.31 C ATOM 708 CG1 VAL A 48 -6.995 3.579 -52.240 1.00 2.44 C ATOM 709 CG2 VAL A 48 -7.405 1.326 -53.278 1.00 31.14 C ATOM 0 H VAL A 48 -5.572 2.323 -54.960 1.00 1.43 H new ATOM 0 HA VAL A 48 -4.370 2.717 -52.304 1.00 41.03 H new ATOM 0 HB VAL A 48 -6.459 1.702 -51.396 1.00 25.31 H new ATOM 0 HG11 VAL A 48 -8.010 3.558 -51.843 1.00 2.44 H new ATOM 0 HG12 VAL A 48 -6.350 4.132 -51.557 1.00 2.44 H new ATOM 0 HG13 VAL A 48 -6.996 4.069 -53.214 1.00 2.44 H new ATOM 0 HG21 VAL A 48 -8.415 1.345 -52.868 1.00 31.14 H new ATOM 0 HG22 VAL A 48 -7.414 1.746 -54.284 1.00 31.14 H new ATOM 0 HG23 VAL A 48 -7.048 0.297 -53.317 1.00 31.14 H new ATOM 719 N HIS A 49 -4.540 0.062 -51.833 1.00 0.12 N ATOM 720 CA HIS A 49 -4.122 -1.324 -51.666 1.00 21.40 C ATOM 721 C HIS A 49 -4.749 -1.860 -50.379 1.00 62.51 C ATOM 722 O HIS A 49 -4.952 -1.097 -49.436 1.00 12.42 O ATOM 723 CB HIS A 49 -2.590 -1.369 -51.587 1.00 65.53 C ATOM 724 CG HIS A 49 -1.964 -2.710 -51.810 1.00 3.22 C ATOM 725 ND1 HIS A 49 -0.606 -2.904 -51.734 1.00 4.14 N ATOM 726 CD2 HIS A 49 -2.495 -3.907 -52.149 1.00 44.34 C ATOM 727 CE1 HIS A 49 -0.325 -4.155 -52.019 1.00 71.41 C ATOM 728 NE2 HIS A 49 -1.453 -4.791 -52.276 1.00 60.41 N ATOM 0 H HIS A 49 -4.825 0.508 -50.961 1.00 0.12 H new ATOM 0 HA HIS A 49 -4.447 -1.939 -52.505 1.00 21.40 H new ATOM 0 HB2 HIS A 49 -2.187 -0.674 -52.324 1.00 65.53 H new ATOM 0 HB3 HIS A 49 -2.285 -1.006 -50.606 1.00 65.53 H new ATOM 0 HD1 HIS A 49 0.078 -2.187 -51.493 1.00 4.14 H new ATOM 0 HD2 HIS A 49 -3.543 -4.126 -52.293 1.00 44.34 H new ATOM 0 HE1 HIS A 49 0.663 -4.590 -52.040 1.00 71.41 H new ATOM 0 HE2 HIS A 49 -1.536 -5.776 -52.527 1.00 60.41 H new ATOM 737 N TYR A 50 -5.080 -3.149 -50.339 1.00 14.34 N ATOM 738 CA TYR A 50 -5.737 -3.733 -49.165 1.00 11.42 C ATOM 739 C TYR A 50 -5.074 -5.045 -48.751 1.00 70.24 C ATOM 740 O TYR A 50 -4.418 -5.700 -49.565 1.00 63.33 O ATOM 741 CB TYR A 50 -7.226 -3.993 -49.451 1.00 61.52 C ATOM 742 CG TYR A 50 -8.039 -2.748 -49.763 1.00 44.20 C ATOM 743 CD1 TYR A 50 -8.571 -1.966 -48.742 1.00 71.34 C ATOM 744 CD2 TYR A 50 -8.289 -2.366 -51.078 1.00 44.43 C ATOM 745 CE1 TYR A 50 -9.324 -0.841 -49.023 1.00 2.23 C ATOM 746 CE2 TYR A 50 -9.037 -1.242 -51.365 1.00 51.13 C ATOM 747 CZ TYR A 50 -9.553 -0.485 -50.335 1.00 62.13 C ATOM 748 OH TYR A 50 -10.305 0.631 -50.617 1.00 33.15 O ATOM 0 H TYR A 50 -4.907 -3.807 -51.099 1.00 14.34 H new ATOM 0 HA TYR A 50 -5.639 -3.016 -48.350 1.00 11.42 H new ATOM 0 HB2 TYR A 50 -7.306 -4.683 -50.291 1.00 61.52 H new ATOM 0 HB3 TYR A 50 -7.666 -4.491 -48.587 1.00 61.52 H new ATOM 0 HD1 TYR A 50 -8.393 -2.242 -47.713 1.00 71.34 H new ATOM 0 HD2 TYR A 50 -7.891 -2.959 -51.888 1.00 44.43 H new ATOM 0 HE1 TYR A 50 -9.730 -0.245 -48.219 1.00 2.23 H new ATOM 0 HE2 TYR A 50 -9.217 -0.957 -52.391 1.00 51.13 H new ATOM 0 HH TYR A 50 -10.256 0.825 -51.576 1.00 33.15 H new ATOM 758 N ASP A 51 -5.258 -5.411 -47.479 1.00 4.52 N ATOM 759 CA ASP A 51 -4.857 -6.731 -46.965 1.00 51.23 C ATOM 760 C ASP A 51 -5.966 -7.303 -46.080 1.00 52.23 C ATOM 761 O ASP A 51 -6.371 -6.675 -45.102 1.00 72.43 O ATOM 762 CB ASP A 51 -3.555 -6.664 -46.139 1.00 43.42 C ATOM 763 CG ASP A 51 -2.304 -6.412 -46.969 1.00 52.30 C ATOM 764 OD1 ASP A 51 -2.018 -7.221 -47.878 1.00 62.22 O ATOM 765 OD2 ASP A 51 -1.575 -5.431 -46.680 1.00 54.15 O ATOM 0 H ASP A 51 -5.686 -4.807 -46.777 1.00 4.52 H new ATOM 0 HA ASP A 51 -4.683 -7.371 -47.830 1.00 51.23 H new ATOM 0 HB2 ASP A 51 -3.650 -5.873 -45.395 1.00 43.42 H new ATOM 0 HB3 ASP A 51 -3.434 -7.601 -45.595 1.00 43.42 H new ATOM 770 N GLY A 52 -6.460 -8.486 -46.439 1.00 64.23 N ATOM 771 CA GLY A 52 -7.467 -9.162 -45.635 1.00 20.04 C ATOM 772 C GLY A 52 -6.862 -9.797 -44.398 1.00 41.33 C ATOM 773 O GLY A 52 -5.876 -10.536 -44.493 1.00 22.22 O ATOM 0 H GLY A 52 -6.179 -8.992 -47.279 1.00 64.23 H new ATOM 0 HA2 GLY A 52 -8.236 -8.448 -45.339 1.00 20.04 H new ATOM 0 HA3 GLY A 52 -7.958 -9.929 -46.235 1.00 20.04 H new ATOM 777 N ARG A 53 -7.452 -9.532 -43.239 1.00 44.32 N ATOM 778 CA ARG A 53 -6.872 -9.957 -41.970 1.00 1.42 C ATOM 779 C ARG A 53 -7.967 -10.243 -40.940 1.00 33.53 C ATOM 780 O ARG A 53 -8.998 -9.572 -40.913 1.00 63.13 O ATOM 781 CB ARG A 53 -5.926 -8.854 -41.472 1.00 71.31 C ATOM 782 CG ARG A 53 -5.029 -9.245 -40.304 1.00 52.10 C ATOM 783 CD ARG A 53 -4.021 -8.140 -40.007 1.00 42.02 C ATOM 784 NE ARG A 53 -3.066 -8.514 -38.963 1.00 21.24 N ATOM 785 CZ ARG A 53 -1.795 -8.104 -38.938 1.00 61.51 C ATOM 786 NH1 ARG A 53 -1.303 -7.379 -39.937 1.00 32.45 N ATOM 787 NH2 ARG A 53 -1.015 -8.434 -37.918 1.00 4.41 N ATOM 0 H ARG A 53 -8.332 -9.024 -43.151 1.00 44.32 H new ATOM 0 HA ARG A 53 -6.313 -10.882 -42.113 1.00 1.42 H new ATOM 0 HB2 ARG A 53 -5.296 -8.536 -42.303 1.00 71.31 H new ATOM 0 HB3 ARG A 53 -6.523 -7.991 -41.177 1.00 71.31 H new ATOM 0 HG2 ARG A 53 -5.637 -9.437 -39.420 1.00 52.10 H new ATOM 0 HG3 ARG A 53 -4.503 -10.171 -40.536 1.00 52.10 H new ATOM 0 HD2 ARG A 53 -3.478 -7.894 -40.920 1.00 42.02 H new ATOM 0 HD3 ARG A 53 -4.554 -7.240 -39.701 1.00 42.02 H new ATOM 0 HE ARG A 53 -3.390 -9.123 -38.211 1.00 21.24 H new ATOM 0 HH11 ARG A 53 -1.897 -7.132 -40.729 1.00 32.45 H new ATOM 0 HH12 ARG A 53 -0.332 -7.069 -39.912 1.00 32.45 H new ATOM 0 HH21 ARG A 53 -1.386 -9.000 -37.155 1.00 4.41 H new ATOM 0 HH22 ARG A 53 -0.044 -8.122 -37.897 1.00 4.41 H new ATOM 801 N PHE A 54 -7.749 -11.254 -40.105 1.00 54.13 N ATOM 802 CA PHE A 54 -8.694 -11.591 -39.045 1.00 71.03 C ATOM 803 C PHE A 54 -8.371 -10.789 -37.784 1.00 14.50 C ATOM 804 O PHE A 54 -7.204 -10.492 -37.522 1.00 62.12 O ATOM 805 CB PHE A 54 -8.651 -13.099 -38.750 1.00 75.12 C ATOM 806 CG PHE A 54 -9.113 -13.956 -39.905 1.00 4.21 C ATOM 807 CD1 PHE A 54 -10.464 -14.217 -40.096 1.00 43.03 C ATOM 808 CD2 PHE A 54 -8.199 -14.498 -40.800 1.00 10.32 C ATOM 809 CE1 PHE A 54 -10.892 -15.002 -41.150 1.00 64.24 C ATOM 810 CE2 PHE A 54 -8.624 -15.282 -41.856 1.00 10.31 C ATOM 811 CZ PHE A 54 -9.970 -15.536 -42.031 1.00 33.43 C ATOM 0 H PHE A 54 -6.926 -11.855 -40.142 1.00 54.13 H new ATOM 0 HA PHE A 54 -9.701 -11.335 -39.375 1.00 71.03 H new ATOM 0 HB2 PHE A 54 -7.632 -13.380 -38.486 1.00 75.12 H new ATOM 0 HB3 PHE A 54 -9.275 -13.308 -37.881 1.00 75.12 H new ATOM 0 HD1 PHE A 54 -11.189 -13.801 -39.412 1.00 43.03 H new ATOM 0 HD2 PHE A 54 -7.145 -14.305 -40.669 1.00 10.32 H new ATOM 0 HE1 PHE A 54 -11.945 -15.198 -41.285 1.00 64.24 H new ATOM 0 HE2 PHE A 54 -7.903 -15.696 -42.545 1.00 10.31 H new ATOM 0 HZ PHE A 54 -10.302 -16.151 -42.855 1.00 33.43 H new ATOM 821 N PRO A 55 -9.398 -10.427 -36.984 1.00 32.51 N ATOM 822 CA PRO A 55 -9.212 -9.651 -35.743 1.00 12.25 C ATOM 823 C PRO A 55 -8.262 -10.347 -34.767 1.00 74.21 C ATOM 824 O PRO A 55 -7.665 -9.709 -33.895 1.00 2.34 O ATOM 825 CB PRO A 55 -10.631 -9.554 -35.152 1.00 42.22 C ATOM 826 CG PRO A 55 -11.415 -10.622 -35.844 1.00 14.43 C ATOM 827 CD PRO A 55 -10.820 -10.739 -37.221 1.00 41.45 C ATOM 0 HA PRO A 55 -8.760 -8.678 -35.935 1.00 12.25 H new ATOM 0 HB2 PRO A 55 -10.620 -9.709 -34.073 1.00 42.22 H new ATOM 0 HB3 PRO A 55 -11.065 -8.570 -35.328 1.00 42.22 H new ATOM 0 HG2 PRO A 55 -11.347 -11.568 -35.307 1.00 14.43 H new ATOM 0 HG3 PRO A 55 -12.472 -10.360 -35.895 1.00 14.43 H new ATOM 0 HD2 PRO A 55 -10.952 -11.738 -37.636 1.00 41.45 H new ATOM 0 HD3 PRO A 55 -11.277 -10.040 -37.921 1.00 41.45 H new ATOM 835 N ASP A 56 -8.134 -11.660 -34.931 1.00 72.30 N ATOM 836 CA ASP A 56 -7.210 -12.468 -34.137 1.00 2.21 C ATOM 837 C ASP A 56 -5.769 -12.013 -34.353 1.00 31.10 C ATOM 838 O ASP A 56 -4.947 -12.042 -33.434 1.00 51.45 O ATOM 839 CB ASP A 56 -7.362 -13.948 -34.516 1.00 33.21 C ATOM 840 CG ASP A 56 -6.216 -14.819 -34.020 1.00 3.34 C ATOM 841 OD1 ASP A 56 -6.183 -15.146 -32.817 1.00 1.05 O ATOM 842 OD2 ASP A 56 -5.357 -15.203 -34.845 1.00 33.45 O ATOM 0 H ASP A 56 -8.667 -12.195 -35.617 1.00 72.30 H new ATOM 0 HA ASP A 56 -7.451 -12.340 -33.082 1.00 2.21 H new ATOM 0 HB2 ASP A 56 -8.299 -14.326 -34.107 1.00 33.21 H new ATOM 0 HB3 ASP A 56 -7.430 -14.033 -35.601 1.00 33.21 H new ATOM 847 N GLY A 57 -5.478 -11.579 -35.572 1.00 5.43 N ATOM 848 CA GLY A 57 -4.133 -11.167 -35.929 1.00 3.42 C ATOM 849 C GLY A 57 -3.651 -11.896 -37.162 1.00 52.54 C ATOM 850 O GLY A 57 -2.984 -11.314 -38.020 1.00 13.40 O ATOM 0 H GLY A 57 -6.158 -11.504 -36.329 1.00 5.43 H new ATOM 0 HA2 GLY A 57 -4.114 -10.092 -36.107 1.00 3.42 H new ATOM 0 HA3 GLY A 57 -3.456 -11.364 -35.098 1.00 3.42 H new ATOM 854 N LYS A 58 -4.007 -13.177 -37.247 1.00 22.23 N ATOM 855 CA LYS A 58 -3.656 -14.011 -38.391 1.00 64.14 C ATOM 856 C LYS A 58 -4.246 -13.427 -39.675 1.00 44.42 C ATOM 857 O LYS A 58 -5.457 -13.205 -39.770 1.00 32.12 O ATOM 858 CB LYS A 58 -4.155 -15.449 -38.164 1.00 2.04 C ATOM 859 CG LYS A 58 -3.784 -16.428 -39.278 1.00 64.13 C ATOM 860 CD LYS A 58 -4.059 -17.882 -38.883 1.00 2.12 C ATOM 861 CE LYS A 58 -5.540 -18.147 -38.617 1.00 51.22 C ATOM 862 NZ LYS A 58 -6.360 -18.060 -39.855 1.00 12.14 N ATOM 0 H LYS A 58 -4.544 -13.662 -36.528 1.00 22.23 H new ATOM 0 HA LYS A 58 -2.571 -14.033 -38.496 1.00 64.14 H new ATOM 0 HB2 LYS A 58 -3.748 -15.818 -37.222 1.00 2.04 H new ATOM 0 HB3 LYS A 58 -5.240 -15.432 -38.058 1.00 2.04 H new ATOM 0 HG2 LYS A 58 -4.349 -16.184 -40.177 1.00 64.13 H new ATOM 0 HG3 LYS A 58 -2.728 -16.313 -39.524 1.00 64.13 H new ATOM 0 HD2 LYS A 58 -3.712 -18.543 -39.678 1.00 2.12 H new ATOM 0 HD3 LYS A 58 -3.483 -18.128 -37.991 1.00 2.12 H new ATOM 0 HE2 LYS A 58 -5.656 -19.137 -38.176 1.00 51.22 H new ATOM 0 HE3 LYS A 58 -5.910 -17.427 -37.887 1.00 51.22 H new ATOM 0 HZ1 LYS A 58 -7.345 -18.313 -39.637 1.00 12.14 H new ATOM 0 HZ2 LYS A 58 -6.326 -17.089 -40.226 1.00 12.14 H new ATOM 0 HZ3 LYS A 58 -5.983 -18.717 -40.568 1.00 12.14 H new ATOM 876 N GLN A 59 -3.381 -13.156 -40.644 1.00 62.31 N ATOM 877 CA GLN A 59 -3.797 -12.559 -41.909 1.00 30.32 C ATOM 878 C GLN A 59 -4.487 -13.593 -42.800 1.00 0.55 C ATOM 879 O GLN A 59 -4.117 -14.772 -42.802 1.00 71.44 O ATOM 880 CB GLN A 59 -2.584 -11.954 -42.631 1.00 41.23 C ATOM 881 CG GLN A 59 -1.499 -12.970 -42.984 1.00 10.35 C ATOM 882 CD GLN A 59 -0.244 -12.322 -43.543 1.00 72.33 C ATOM 883 OE1 GLN A 59 0.099 -11.197 -43.185 1.00 24.21 O ATOM 884 NE2 GLN A 59 0.455 -13.028 -44.418 1.00 55.00 N ATOM 0 H GLN A 59 -2.380 -13.341 -40.578 1.00 62.31 H new ATOM 0 HA GLN A 59 -4.513 -11.765 -41.696 1.00 30.32 H new ATOM 0 HB2 GLN A 59 -2.924 -11.469 -43.546 1.00 41.23 H new ATOM 0 HB3 GLN A 59 -2.149 -11.178 -42.001 1.00 41.23 H new ATOM 0 HG2 GLN A 59 -1.241 -13.543 -42.093 1.00 10.35 H new ATOM 0 HG3 GLN A 59 -1.893 -13.677 -43.714 1.00 10.35 H new ATOM 0 HE21 GLN A 59 0.139 -13.959 -44.691 1.00 55.00 H new ATOM 0 HE22 GLN A 59 1.310 -12.641 -44.819 1.00 55.00 H new ATOM 893 N PHE A 60 -5.497 -13.148 -43.543 1.00 4.41 N ATOM 894 CA PHE A 60 -6.204 -14.007 -44.492 1.00 50.42 C ATOM 895 C PHE A 60 -5.314 -14.268 -45.705 1.00 13.13 C ATOM 896 O PHE A 60 -5.187 -15.401 -46.169 1.00 51.22 O ATOM 897 CB PHE A 60 -7.529 -13.349 -44.919 1.00 41.42 C ATOM 898 CG PHE A 60 -8.265 -14.083 -46.015 1.00 61.13 C ATOM 899 CD1 PHE A 60 -8.982 -15.239 -45.738 1.00 12.31 C ATOM 900 CD2 PHE A 60 -8.240 -13.613 -47.323 1.00 40.54 C ATOM 901 CE1 PHE A 60 -9.656 -15.910 -46.743 1.00 10.14 C ATOM 902 CE2 PHE A 60 -8.913 -14.281 -48.328 1.00 73.53 C ATOM 903 CZ PHE A 60 -9.621 -15.431 -48.038 1.00 13.11 C ATOM 0 H PHE A 60 -5.847 -12.191 -43.506 1.00 4.41 H new ATOM 0 HA PHE A 60 -6.436 -14.959 -44.015 1.00 50.42 H new ATOM 0 HB2 PHE A 60 -8.180 -13.273 -44.048 1.00 41.42 H new ATOM 0 HB3 PHE A 60 -7.324 -12.332 -45.253 1.00 41.42 H new ATOM 0 HD1 PHE A 60 -9.014 -15.619 -44.727 1.00 12.31 H new ATOM 0 HD2 PHE A 60 -7.688 -12.715 -47.557 1.00 40.54 H new ATOM 0 HE1 PHE A 60 -10.210 -16.809 -46.515 1.00 10.14 H new ATOM 0 HE2 PHE A 60 -8.885 -13.904 -49.340 1.00 73.53 H new ATOM 0 HZ PHE A 60 -10.146 -15.955 -48.823 1.00 13.11 H new ATOM 913 N ASP A 61 -4.697 -13.199 -46.195 1.00 72.13 N ATOM 914 CA ASP A 61 -3.765 -13.265 -47.318 1.00 21.25 C ATOM 915 C ASP A 61 -2.996 -11.956 -47.416 1.00 45.30 C ATOM 916 O ASP A 61 -3.592 -10.875 -47.368 1.00 20.32 O ATOM 917 CB ASP A 61 -4.504 -13.536 -48.643 1.00 71.44 C ATOM 918 CG ASP A 61 -3.606 -13.363 -49.867 1.00 31.53 C ATOM 919 OD1 ASP A 61 -2.897 -14.322 -50.241 1.00 42.41 O ATOM 920 OD2 ASP A 61 -3.603 -12.263 -50.461 1.00 45.10 O ATOM 0 H ASP A 61 -4.829 -12.258 -45.824 1.00 72.13 H new ATOM 0 HA ASP A 61 -3.074 -14.089 -47.142 1.00 21.25 H new ATOM 0 HB2 ASP A 61 -4.903 -14.550 -48.631 1.00 71.44 H new ATOM 0 HB3 ASP A 61 -5.355 -12.860 -48.724 1.00 71.44 H new ATOM 925 N SER A 62 -1.681 -12.052 -47.534 1.00 2.52 N ATOM 926 CA SER A 62 -0.848 -10.876 -47.709 1.00 22.13 C ATOM 927 C SER A 62 -0.912 -10.406 -49.161 1.00 22.13 C ATOM 928 O SER A 62 -0.076 -10.778 -49.993 1.00 25.20 O ATOM 929 CB SER A 62 0.597 -11.186 -47.286 1.00 73.41 C ATOM 930 OG SER A 62 1.040 -12.420 -47.836 1.00 51.41 O ATOM 0 H SER A 62 -1.169 -12.934 -47.512 1.00 2.52 H new ATOM 0 HA SER A 62 -1.219 -10.071 -47.075 1.00 22.13 H new ATOM 0 HB2 SER A 62 1.255 -10.381 -47.614 1.00 73.41 H new ATOM 0 HB3 SER A 62 0.660 -11.226 -46.199 1.00 73.41 H new ATOM 0 HG SER A 62 0.881 -12.423 -48.803 1.00 51.41 H new ATOM 936 N SER A 63 -1.924 -9.598 -49.464 1.00 2.54 N ATOM 937 CA SER A 63 -2.121 -9.081 -50.812 1.00 61.15 C ATOM 938 C SER A 63 -1.068 -8.020 -51.126 1.00 30.33 C ATOM 939 O SER A 63 -0.885 -7.615 -52.279 1.00 20.53 O ATOM 940 CB SER A 63 -3.539 -8.517 -50.959 1.00 5.12 C ATOM 941 OG SER A 63 -4.508 -9.539 -50.764 1.00 11.23 O ATOM 0 H SER A 63 -2.623 -9.287 -48.789 1.00 2.54 H new ATOM 0 HA SER A 63 -2.006 -9.894 -51.529 1.00 61.15 H new ATOM 0 HB2 SER A 63 -3.695 -7.718 -50.234 1.00 5.12 H new ATOM 0 HB3 SER A 63 -3.660 -8.078 -51.949 1.00 5.12 H new ATOM 0 HG SER A 63 -4.057 -10.403 -50.663 1.00 11.23 H new ATOM 947 N ARG A 64 -0.391 -7.563 -50.081 1.00 62.05 N ATOM 948 CA ARG A 64 0.769 -6.694 -50.220 1.00 51.31 C ATOM 949 C ARG A 64 1.905 -7.422 -50.929 1.00 11.31 C ATOM 950 O ARG A 64 2.623 -6.834 -51.737 1.00 41.21 O ATOM 951 CB ARG A 64 1.218 -6.183 -48.846 1.00 11.31 C ATOM 952 CG ARG A 64 1.370 -7.279 -47.797 1.00 31.34 C ATOM 953 CD ARG A 64 1.641 -6.697 -46.418 1.00 61.25 C ATOM 954 NE ARG A 64 1.558 -7.710 -45.367 1.00 63.21 N ATOM 955 CZ ARG A 64 0.596 -7.744 -44.442 1.00 44.35 C ATOM 956 NH1 ARG A 64 -0.439 -6.919 -44.523 1.00 70.45 N ATOM 957 NH2 ARG A 64 0.643 -8.641 -43.471 1.00 74.42 N ATOM 0 H ARG A 64 -0.630 -7.784 -49.114 1.00 62.05 H new ATOM 0 HA ARG A 64 0.489 -5.835 -50.830 1.00 51.31 H new ATOM 0 HB2 ARG A 64 2.171 -5.665 -48.956 1.00 11.31 H new ATOM 0 HB3 ARG A 64 0.495 -5.450 -48.488 1.00 11.31 H new ATOM 0 HG2 ARG A 64 0.463 -7.883 -47.766 1.00 31.34 H new ATOM 0 HG3 ARG A 64 2.186 -7.944 -48.079 1.00 31.34 H new ATOM 0 HD2 ARG A 64 2.632 -6.242 -46.405 1.00 61.25 H new ATOM 0 HD3 ARG A 64 0.923 -5.903 -46.213 1.00 61.25 H new ATOM 0 HE ARG A 64 2.277 -8.433 -45.339 1.00 63.21 H new ATOM 0 HH11 ARG A 64 -0.503 -6.255 -45.294 1.00 70.45 H new ATOM 0 HH12 ARG A 64 -1.172 -6.949 -43.814 1.00 70.45 H new ATOM 0 HH21 ARG A 64 1.414 -9.307 -43.429 1.00 74.42 H new ATOM 0 HH22 ARG A 64 -0.092 -8.667 -42.764 1.00 74.42 H new ATOM 971 N SER A 65 2.036 -8.716 -50.657 1.00 10.31 N ATOM 972 CA SER A 65 3.068 -9.531 -51.288 1.00 43.24 C ATOM 973 C SER A 65 2.757 -9.712 -52.778 1.00 30.11 C ATOM 974 O SER A 65 3.633 -10.056 -53.574 1.00 40.21 O ATOM 975 CB SER A 65 3.170 -10.891 -50.580 1.00 13.31 C ATOM 976 OG SER A 65 4.279 -11.640 -51.047 1.00 52.33 O ATOM 0 H SER A 65 1.440 -9.223 -50.003 1.00 10.31 H new ATOM 0 HA SER A 65 4.029 -9.025 -51.198 1.00 43.24 H new ATOM 0 HB2 SER A 65 3.261 -10.736 -49.505 1.00 13.31 H new ATOM 0 HB3 SER A 65 2.253 -11.457 -50.744 1.00 13.31 H new ATOM 0 HG SER A 65 4.316 -12.498 -50.576 1.00 52.33 H new ATOM 982 N ARG A 66 1.501 -9.462 -53.147 1.00 45.31 N ATOM 983 CA ARG A 66 1.062 -9.570 -54.538 1.00 14.00 C ATOM 984 C ARG A 66 1.411 -8.298 -55.312 1.00 1.23 C ATOM 985 O ARG A 66 1.354 -8.275 -56.544 1.00 33.32 O ATOM 986 CB ARG A 66 -0.448 -9.839 -54.598 1.00 41.14 C ATOM 987 CG ARG A 66 -0.873 -11.095 -53.837 1.00 42.33 C ATOM 988 CD ARG A 66 -2.372 -11.350 -53.937 1.00 1.51 C ATOM 989 NE ARG A 66 -2.772 -12.537 -53.178 1.00 14.23 N ATOM 990 CZ ARG A 66 -3.306 -13.635 -53.718 1.00 13.50 C ATOM 991 NH1 ARG A 66 -3.549 -13.685 -55.025 1.00 2.55 N ATOM 992 NH2 ARG A 66 -3.605 -14.674 -52.949 1.00 75.44 N ATOM 0 H ARG A 66 0.766 -9.182 -52.498 1.00 45.31 H new ATOM 0 HA ARG A 66 1.584 -10.407 -55.003 1.00 14.00 H new ATOM 0 HB2 ARG A 66 -0.979 -8.979 -54.190 1.00 41.14 H new ATOM 0 HB3 ARG A 66 -0.751 -9.935 -55.641 1.00 41.14 H new ATOM 0 HG2 ARG A 66 -0.333 -11.956 -54.230 1.00 42.33 H new ATOM 0 HG3 ARG A 66 -0.593 -10.995 -52.788 1.00 42.33 H new ATOM 0 HD2 ARG A 66 -2.914 -10.481 -53.565 1.00 1.51 H new ATOM 0 HD3 ARG A 66 -2.651 -11.476 -54.983 1.00 1.51 H new ATOM 0 HE ARG A 66 -2.633 -12.524 -52.168 1.00 14.23 H new ATOM 0 HH11 ARG A 66 -3.327 -12.884 -55.616 1.00 2.55 H new ATOM 0 HH12 ARG A 66 -3.957 -14.525 -55.436 1.00 2.55 H new ATOM 0 HH21 ARG A 66 -3.427 -14.634 -51.945 1.00 75.44 H new ATOM 0 HH22 ARG A 66 -4.013 -15.513 -53.361 1.00 75.44 H new ATOM 1006 N GLY A 67 1.756 -7.243 -54.571 1.00 34.51 N ATOM 1007 CA GLY A 67 2.189 -5.988 -55.171 1.00 34.10 C ATOM 1008 C GLY A 67 1.184 -5.404 -56.152 1.00 63.33 C ATOM 1009 O GLY A 67 1.568 -4.766 -57.136 1.00 1.24 O ATOM 0 H GLY A 67 1.742 -7.237 -53.551 1.00 34.51 H new ATOM 0 HA2 GLY A 67 2.376 -5.262 -54.380 1.00 34.10 H new ATOM 0 HA3 GLY A 67 3.136 -6.149 -55.686 1.00 34.10 H new ATOM 1013 N LYS A 68 -0.101 -5.619 -55.891 1.00 75.34 N ATOM 1014 CA LYS A 68 -1.158 -5.131 -56.773 1.00 45.14 C ATOM 1015 C LYS A 68 -1.885 -3.939 -56.149 1.00 23.21 C ATOM 1016 O LYS A 68 -2.598 -4.095 -55.156 1.00 4.34 O ATOM 1017 CB LYS A 68 -2.154 -6.257 -57.079 1.00 40.24 C ATOM 1018 CG LYS A 68 -3.272 -5.846 -58.036 1.00 60.33 C ATOM 1019 CD LYS A 68 -4.151 -7.030 -58.433 1.00 74.22 C ATOM 1020 CE LYS A 68 -3.364 -8.083 -59.208 1.00 64.14 C ATOM 1021 NZ LYS A 68 -2.703 -7.512 -60.413 1.00 71.10 N ATOM 0 H LYS A 68 -0.437 -6.129 -55.074 1.00 75.34 H new ATOM 0 HA LYS A 68 -0.698 -4.800 -57.704 1.00 45.14 H new ATOM 0 HB2 LYS A 68 -1.614 -7.101 -57.507 1.00 40.24 H new ATOM 0 HB3 LYS A 68 -2.596 -6.602 -56.145 1.00 40.24 H new ATOM 0 HG2 LYS A 68 -3.888 -5.079 -57.566 1.00 60.33 H new ATOM 0 HG3 LYS A 68 -2.837 -5.401 -58.931 1.00 60.33 H new ATOM 0 HD2 LYS A 68 -4.579 -7.481 -57.538 1.00 74.22 H new ATOM 0 HD3 LYS A 68 -4.984 -6.677 -59.042 1.00 74.22 H new ATOM 0 HE2 LYS A 68 -2.610 -8.524 -58.556 1.00 64.14 H new ATOM 0 HE3 LYS A 68 -4.035 -8.887 -59.510 1.00 64.14 H new ATOM 0 HZ1 LYS A 68 -2.399 -8.284 -61.040 1.00 71.10 H new ATOM 0 HZ2 LYS A 68 -3.373 -6.898 -60.919 1.00 71.10 H new ATOM 0 HZ3 LYS A 68 -1.874 -6.954 -60.123 1.00 71.10 H new ATOM 1035 N PRO A 69 -1.688 -2.728 -56.703 1.00 1.43 N ATOM 1036 CA PRO A 69 -2.402 -1.533 -56.271 1.00 41.05 C ATOM 1037 C PRO A 69 -3.702 -1.322 -57.059 1.00 63.34 C ATOM 1038 O PRO A 69 -3.698 -1.288 -58.293 1.00 73.21 O ATOM 1039 CB PRO A 69 -1.387 -0.427 -56.569 1.00 65.54 C ATOM 1040 CG PRO A 69 -0.650 -0.903 -57.784 1.00 33.42 C ATOM 1041 CD PRO A 69 -0.730 -2.418 -57.786 1.00 34.41 C ATOM 0 HA PRO A 69 -2.719 -1.575 -55.229 1.00 41.05 H new ATOM 0 HB2 PRO A 69 -1.883 0.526 -56.755 1.00 65.54 H new ATOM 0 HB3 PRO A 69 -0.709 -0.275 -55.729 1.00 65.54 H new ATOM 0 HG2 PRO A 69 -1.095 -0.492 -58.690 1.00 33.42 H new ATOM 0 HG3 PRO A 69 0.388 -0.572 -57.760 1.00 33.42 H new ATOM 0 HD2 PRO A 69 -1.077 -2.798 -58.747 1.00 34.41 H new ATOM 0 HD3 PRO A 69 0.244 -2.869 -57.598 1.00 34.41 H new ATOM 1049 N PHE A 70 -4.810 -1.190 -56.341 1.00 41.12 N ATOM 1050 CA PHE A 70 -6.116 -0.976 -56.959 1.00 52.04 C ATOM 1051 C PHE A 70 -6.381 0.527 -57.076 1.00 55.23 C ATOM 1052 O PHE A 70 -5.716 1.321 -56.417 1.00 31.10 O ATOM 1053 CB PHE A 70 -7.209 -1.661 -56.119 1.00 51.25 C ATOM 1054 CG PHE A 70 -8.582 -1.636 -56.747 1.00 44.01 C ATOM 1055 CD1 PHE A 70 -8.869 -2.436 -57.845 1.00 50.33 C ATOM 1056 CD2 PHE A 70 -9.586 -0.819 -56.241 1.00 54.02 C ATOM 1057 CE1 PHE A 70 -10.123 -2.419 -58.425 1.00 71.23 C ATOM 1058 CE2 PHE A 70 -10.842 -0.800 -56.818 1.00 42.20 C ATOM 1059 CZ PHE A 70 -11.111 -1.602 -57.911 1.00 20.44 C ATOM 0 H PHE A 70 -4.831 -1.228 -55.322 1.00 41.12 H new ATOM 0 HA PHE A 70 -6.128 -1.413 -57.958 1.00 52.04 H new ATOM 0 HB2 PHE A 70 -6.921 -2.698 -55.945 1.00 51.25 H new ATOM 0 HB3 PHE A 70 -7.259 -1.176 -55.144 1.00 51.25 H new ATOM 0 HD1 PHE A 70 -8.102 -3.080 -58.251 1.00 50.33 H new ATOM 0 HD2 PHE A 70 -9.382 -0.191 -55.386 1.00 54.02 H new ATOM 0 HE1 PHE A 70 -10.331 -3.045 -59.280 1.00 71.23 H new ATOM 0 HE2 PHE A 70 -11.612 -0.159 -56.415 1.00 42.20 H new ATOM 0 HZ PHE A 70 -12.092 -1.590 -58.362 1.00 20.44 H new ATOM 1069 N GLN A 71 -7.334 0.920 -57.915 1.00 45.33 N ATOM 1070 CA GLN A 71 -7.661 2.336 -58.098 1.00 52.35 C ATOM 1071 C GLN A 71 -9.172 2.541 -58.141 1.00 12.44 C ATOM 1072 O GLN A 71 -9.889 1.763 -58.777 1.00 73.44 O ATOM 1073 CB GLN A 71 -7.028 2.875 -59.391 1.00 41.45 C ATOM 1074 CG GLN A 71 -5.503 2.881 -59.378 1.00 24.22 C ATOM 1075 CD GLN A 71 -4.907 3.347 -60.695 1.00 52.53 C ATOM 1076 OE1 GLN A 71 -4.646 2.542 -61.591 1.00 33.44 O ATOM 1077 NE2 GLN A 71 -4.688 4.646 -60.822 1.00 75.03 N ATOM 0 H GLN A 71 -7.894 0.282 -58.480 1.00 45.33 H new ATOM 0 HA GLN A 71 -7.255 2.886 -57.249 1.00 52.35 H new ATOM 0 HB2 GLN A 71 -7.372 2.271 -60.231 1.00 41.45 H new ATOM 0 HB3 GLN A 71 -7.384 3.891 -59.562 1.00 41.45 H new ATOM 0 HG2 GLN A 71 -5.153 3.531 -58.576 1.00 24.22 H new ATOM 0 HG3 GLN A 71 -5.142 1.877 -59.156 1.00 24.22 H new ATOM 0 HE21 GLN A 71 -4.918 5.279 -60.056 1.00 75.03 H new ATOM 0 HE22 GLN A 71 -4.289 5.014 -61.686 1.00 75.03 H new ATOM 1086 N PHE A 72 -9.656 3.583 -57.466 1.00 73.33 N ATOM 1087 CA PHE A 72 -11.085 3.912 -57.498 1.00 2.55 C ATOM 1088 C PHE A 72 -11.310 5.369 -57.103 1.00 20.34 C ATOM 1089 O PHE A 72 -10.478 5.967 -56.425 1.00 61.22 O ATOM 1090 CB PHE A 72 -11.899 2.973 -56.582 1.00 25.13 C ATOM 1091 CG PHE A 72 -11.715 3.218 -55.102 1.00 43.44 C ATOM 1092 CD1 PHE A 72 -10.663 2.640 -54.410 1.00 1.40 C ATOM 1093 CD2 PHE A 72 -12.606 4.026 -54.404 1.00 73.40 C ATOM 1094 CE1 PHE A 72 -10.504 2.860 -53.055 1.00 5.31 C ATOM 1095 CE2 PHE A 72 -12.448 4.250 -53.050 1.00 1.11 C ATOM 1096 CZ PHE A 72 -11.395 3.667 -52.376 1.00 32.03 C ATOM 0 H PHE A 72 -9.088 4.210 -56.895 1.00 73.33 H new ATOM 0 HA PHE A 72 -11.435 3.769 -58.520 1.00 2.55 H new ATOM 0 HB2 PHE A 72 -12.956 3.078 -56.825 1.00 25.13 H new ATOM 0 HB3 PHE A 72 -11.622 1.942 -56.803 1.00 25.13 H new ATOM 0 HD1 PHE A 72 -9.960 2.011 -54.935 1.00 1.40 H new ATOM 0 HD2 PHE A 72 -13.432 4.484 -54.927 1.00 73.40 H new ATOM 0 HE1 PHE A 72 -9.682 2.400 -52.527 1.00 5.31 H new ATOM 0 HE2 PHE A 72 -13.147 4.880 -52.520 1.00 1.11 H new ATOM 0 HZ PHE A 72 -11.268 3.842 -51.318 1.00 32.03 H new ATOM 1106 N THR A 73 -12.420 5.940 -57.557 1.00 51.11 N ATOM 1107 CA THR A 73 -12.779 7.309 -57.215 1.00 1.20 C ATOM 1108 C THR A 73 -13.224 7.402 -55.756 1.00 62.13 C ATOM 1109 O THR A 73 -14.251 6.832 -55.373 1.00 74.23 O ATOM 1110 CB THR A 73 -13.905 7.837 -58.137 1.00 52.41 C ATOM 1111 OG1 THR A 73 -13.466 7.805 -59.503 1.00 54.54 O ATOM 1112 CG2 THR A 73 -14.311 9.262 -57.764 1.00 75.20 C ATOM 0 H THR A 73 -13.090 5.471 -58.167 1.00 51.11 H new ATOM 0 HA THR A 73 -11.893 7.927 -57.358 1.00 1.20 H new ATOM 0 HB THR A 73 -14.774 7.192 -58.010 1.00 52.41 H new ATOM 0 HG1 THR A 73 -14.181 8.138 -60.084 1.00 54.54 H new ATOM 0 HG21 THR A 73 -15.103 9.601 -58.431 1.00 75.20 H new ATOM 0 HG22 THR A 73 -14.670 9.280 -56.735 1.00 75.20 H new ATOM 0 HG23 THR A 73 -13.449 9.923 -57.859 1.00 75.20 H new ATOM 1120 N LEU A 74 -12.439 8.105 -54.946 1.00 41.42 N ATOM 1121 CA LEU A 74 -12.784 8.336 -53.550 1.00 2.01 C ATOM 1122 C LEU A 74 -14.088 9.125 -53.466 1.00 50.22 C ATOM 1123 O LEU A 74 -14.270 10.105 -54.187 1.00 44.43 O ATOM 1124 CB LEU A 74 -11.649 9.094 -52.842 1.00 4.02 C ATOM 1125 CG LEU A 74 -11.907 9.452 -51.367 1.00 75.13 C ATOM 1126 CD1 LEU A 74 -12.201 8.199 -50.546 1.00 51.31 C ATOM 1127 CD2 LEU A 74 -10.719 10.217 -50.783 1.00 40.31 C ATOM 0 H LEU A 74 -11.556 8.526 -55.235 1.00 41.42 H new ATOM 0 HA LEU A 74 -12.920 7.377 -53.051 1.00 2.01 H new ATOM 0 HB2 LEU A 74 -10.743 8.490 -52.898 1.00 4.02 H new ATOM 0 HB3 LEU A 74 -11.453 10.015 -53.392 1.00 4.02 H new ATOM 0 HG LEU A 74 -12.784 10.097 -51.322 1.00 75.13 H new ATOM 0 HD11 LEU A 74 -12.380 8.478 -49.508 1.00 51.31 H new ATOM 0 HD12 LEU A 74 -13.085 7.701 -50.945 1.00 51.31 H new ATOM 0 HD13 LEU A 74 -11.349 7.522 -50.598 1.00 51.31 H new ATOM 0 HD21 LEU A 74 -10.921 10.461 -49.740 1.00 40.31 H new ATOM 0 HD22 LEU A 74 -9.823 9.600 -50.845 1.00 40.31 H new ATOM 0 HD23 LEU A 74 -10.565 11.137 -51.348 1.00 40.31 H new ATOM 1139 N GLY A 75 -15.000 8.688 -52.607 1.00 21.12 N ATOM 1140 CA GLY A 75 -16.273 9.370 -52.466 1.00 51.53 C ATOM 1141 C GLY A 75 -17.368 8.751 -53.312 1.00 33.31 C ATOM 1142 O GLY A 75 -18.549 9.074 -53.142 1.00 41.10 O ATOM 0 H GLY A 75 -14.881 7.873 -52.005 1.00 21.12 H new ATOM 0 HA2 GLY A 75 -16.575 9.352 -51.419 1.00 51.53 H new ATOM 0 HA3 GLY A 75 -16.152 10.417 -52.745 1.00 51.53 H new ATOM 1146 N ALA A 76 -16.986 7.862 -54.223 1.00 23.41 N ATOM 1147 CA ALA A 76 -17.947 7.172 -55.082 1.00 10.02 C ATOM 1148 C ALA A 76 -18.368 5.845 -54.456 1.00 2.44 C ATOM 1149 O ALA A 76 -17.733 5.366 -53.511 1.00 74.43 O ATOM 1150 CB ALA A 76 -17.348 6.948 -56.468 1.00 13.12 C ATOM 0 H ALA A 76 -16.014 7.600 -54.387 1.00 23.41 H new ATOM 0 HA ALA A 76 -18.835 7.796 -55.185 1.00 10.02 H new ATOM 0 HB1 ALA A 76 -18.073 6.433 -57.099 1.00 13.12 H new ATOM 0 HB2 ALA A 76 -17.096 7.910 -56.915 1.00 13.12 H new ATOM 0 HB3 ALA A 76 -16.447 6.341 -56.381 1.00 13.12 H new ATOM 1156 N GLY A 77 -19.424 5.243 -55.000 1.00 45.30 N ATOM 1157 CA GLY A 77 -19.949 3.997 -54.462 1.00 54.35 C ATOM 1158 C GLY A 77 -19.210 2.778 -54.984 1.00 33.32 C ATOM 1159 O GLY A 77 -19.796 1.702 -55.132 1.00 54.41 O ATOM 0 H GLY A 77 -19.929 5.600 -55.811 1.00 45.30 H new ATOM 0 HA2 GLY A 77 -19.883 4.019 -53.374 1.00 54.35 H new ATOM 0 HA3 GLY A 77 -21.006 3.913 -54.716 1.00 54.35 H new ATOM 1163 N GLU A 78 -17.920 2.948 -55.258 1.00 32.55 N ATOM 1164 CA GLU A 78 -17.079 1.864 -55.760 1.00 75.44 C ATOM 1165 C GLU A 78 -16.967 0.747 -54.724 1.00 54.02 C ATOM 1166 O GLU A 78 -17.069 -0.442 -55.046 1.00 2.52 O ATOM 1167 CB GLU A 78 -15.680 2.402 -56.095 1.00 2.50 C ATOM 1168 CG GLU A 78 -15.672 3.483 -57.169 1.00 4.04 C ATOM 1169 CD GLU A 78 -16.113 2.959 -58.526 1.00 63.04 C ATOM 1170 OE1 GLU A 78 -15.273 2.365 -59.238 1.00 1.53 O ATOM 1171 OE2 GLU A 78 -17.296 3.129 -58.885 1.00 75.43 O ATOM 0 H GLU A 78 -17.430 3.835 -55.140 1.00 32.55 H new ATOM 0 HA GLU A 78 -17.538 1.459 -56.662 1.00 75.44 H new ATOM 0 HB2 GLU A 78 -15.229 2.803 -55.187 1.00 2.50 H new ATOM 0 HB3 GLU A 78 -15.052 1.573 -56.423 1.00 2.50 H new ATOM 0 HG2 GLU A 78 -16.331 4.297 -56.866 1.00 4.04 H new ATOM 0 HG3 GLU A 78 -14.668 3.900 -57.253 1.00 4.04 H new ATOM 1178 N VAL A 79 -16.770 1.151 -53.474 1.00 13.45 N ATOM 1179 CA VAL A 79 -16.575 0.224 -52.366 1.00 1.34 C ATOM 1180 C VAL A 79 -17.526 0.564 -51.223 1.00 20.50 C ATOM 1181 O VAL A 79 -18.287 1.529 -51.312 1.00 12.22 O ATOM 1182 CB VAL A 79 -15.111 0.268 -51.853 1.00 22.51 C ATOM 1183 CG1 VAL A 79 -14.142 -0.198 -52.939 1.00 2.53 C ATOM 1184 CG2 VAL A 79 -14.750 1.671 -51.366 1.00 32.01 C ATOM 0 H VAL A 79 -16.741 2.133 -53.200 1.00 13.45 H new ATOM 0 HA VAL A 79 -16.786 -0.782 -52.729 1.00 1.34 H new ATOM 0 HB VAL A 79 -15.026 -0.416 -51.008 1.00 22.51 H new ATOM 0 HG11 VAL A 79 -13.122 -0.159 -52.557 1.00 2.53 H new ATOM 0 HG12 VAL A 79 -14.383 -1.221 -53.227 1.00 2.53 H new ATOM 0 HG13 VAL A 79 -14.229 0.454 -53.808 1.00 2.53 H new ATOM 0 HG21 VAL A 79 -13.720 1.679 -51.011 1.00 32.01 H new ATOM 0 HG22 VAL A 79 -14.856 2.380 -52.187 1.00 32.01 H new ATOM 0 HG23 VAL A 79 -15.416 1.956 -50.552 1.00 32.01 H new ATOM 1194 N ILE A 80 -17.490 -0.233 -50.159 1.00 75.42 N ATOM 1195 CA ILE A 80 -18.313 0.026 -48.985 1.00 23.41 C ATOM 1196 C ILE A 80 -17.828 1.283 -48.261 1.00 60.52 C ATOM 1197 O ILE A 80 -16.640 1.635 -48.330 1.00 13.14 O ATOM 1198 CB ILE A 80 -18.307 -1.171 -47.998 1.00 73.33 C ATOM 1199 CG1 ILE A 80 -16.891 -1.419 -47.448 1.00 72.25 C ATOM 1200 CG2 ILE A 80 -18.851 -2.426 -48.680 1.00 24.01 C ATOM 1201 CD1 ILE A 80 -16.809 -2.545 -46.434 1.00 43.25 C ATOM 0 H ILE A 80 -16.900 -1.062 -50.087 1.00 75.42 H new ATOM 0 HA ILE A 80 -19.335 0.173 -49.335 1.00 23.41 H new ATOM 0 HB ILE A 80 -18.956 -0.927 -47.157 1.00 73.33 H new ATOM 0 HG12 ILE A 80 -16.224 -1.644 -48.280 1.00 72.25 H new ATOM 0 HG13 ILE A 80 -16.526 -0.501 -46.986 1.00 72.25 H new ATOM 0 HG21 ILE A 80 -18.840 -3.257 -47.975 1.00 24.01 H new ATOM 0 HG22 ILE A 80 -19.873 -2.245 -49.013 1.00 24.01 H new ATOM 0 HG23 ILE A 80 -18.228 -2.672 -49.540 1.00 24.01 H new ATOM 0 HD11 ILE A 80 -15.779 -2.656 -46.096 1.00 43.25 H new ATOM 0 HD12 ILE A 80 -17.448 -2.314 -45.582 1.00 43.25 H new ATOM 0 HD13 ILE A 80 -17.141 -3.475 -46.895 1.00 43.25 H new ATOM 1213 N LYS A 81 -18.746 1.946 -47.561 1.00 23.20 N ATOM 1214 CA LYS A 81 -18.435 3.188 -46.854 1.00 11.25 C ATOM 1215 C LYS A 81 -17.276 2.958 -45.879 1.00 2.21 C ATOM 1216 O LYS A 81 -16.504 3.870 -45.596 1.00 14.32 O ATOM 1217 CB LYS A 81 -19.687 3.708 -46.113 1.00 0.11 C ATOM 1218 CG LYS A 81 -19.782 5.237 -46.021 1.00 41.11 C ATOM 1219 CD LYS A 81 -18.708 5.846 -45.122 1.00 62.14 C ATOM 1220 CE LYS A 81 -18.749 7.370 -45.138 1.00 73.31 C ATOM 1221 NZ LYS A 81 -18.477 7.916 -46.493 1.00 30.33 N ATOM 0 H LYS A 81 -19.715 1.643 -47.468 1.00 23.20 H new ATOM 0 HA LYS A 81 -18.131 3.945 -47.577 1.00 11.25 H new ATOM 0 HB2 LYS A 81 -20.576 3.331 -46.619 1.00 0.11 H new ATOM 0 HB3 LYS A 81 -19.695 3.295 -45.104 1.00 0.11 H new ATOM 0 HG2 LYS A 81 -19.696 5.662 -47.021 1.00 41.11 H new ATOM 0 HG3 LYS A 81 -20.766 5.513 -45.641 1.00 41.11 H new ATOM 0 HD2 LYS A 81 -18.845 5.490 -44.101 1.00 62.14 H new ATOM 0 HD3 LYS A 81 -17.725 5.506 -45.449 1.00 62.14 H new ATOM 0 HE2 LYS A 81 -19.727 7.711 -44.799 1.00 73.31 H new ATOM 0 HE3 LYS A 81 -18.014 7.761 -44.435 1.00 73.31 H new ATOM 0 HZ1 LYS A 81 -18.246 8.927 -46.420 1.00 30.33 H new ATOM 0 HZ2 LYS A 81 -17.676 7.407 -46.918 1.00 30.33 H new ATOM 0 HZ3 LYS A 81 -19.319 7.796 -47.091 1.00 30.33 H new ATOM 1235 N GLY A 82 -17.159 1.726 -45.385 1.00 34.43 N ATOM 1236 CA GLY A 82 -16.061 1.372 -44.501 1.00 31.53 C ATOM 1237 C GLY A 82 -14.706 1.649 -45.134 1.00 11.44 C ATOM 1238 O GLY A 82 -13.885 2.375 -44.572 1.00 11.05 O ATOM 0 H GLY A 82 -17.808 0.965 -45.583 1.00 34.43 H new ATOM 0 HA2 GLY A 82 -16.148 1.935 -43.572 1.00 31.53 H new ATOM 0 HA3 GLY A 82 -16.131 0.316 -44.242 1.00 31.53 H new ATOM 1242 N TRP A 83 -14.486 1.093 -46.324 1.00 20.04 N ATOM 1243 CA TRP A 83 -13.224 1.281 -47.033 1.00 54.32 C ATOM 1244 C TRP A 83 -13.084 2.725 -47.501 1.00 71.34 C ATOM 1245 O TRP A 83 -11.994 3.294 -47.449 1.00 52.20 O ATOM 1246 CB TRP A 83 -13.111 0.312 -48.219 1.00 1.15 C ATOM 1247 CG TRP A 83 -13.003 -1.130 -47.805 1.00 60.24 C ATOM 1248 CD1 TRP A 83 -12.367 -1.617 -46.697 1.00 62.11 C ATOM 1249 CD2 TRP A 83 -13.524 -2.272 -48.500 1.00 23.23 C ATOM 1250 NE1 TRP A 83 -12.477 -2.984 -46.652 1.00 5.04 N ATOM 1251 CE2 TRP A 83 -13.180 -3.411 -47.748 1.00 4.34 C ATOM 1252 CE3 TRP A 83 -14.254 -2.442 -49.680 1.00 42.12 C ATOM 1253 CZ2 TRP A 83 -13.539 -4.699 -48.138 1.00 13.44 C ATOM 1254 CZ3 TRP A 83 -14.610 -3.720 -50.068 1.00 3.14 C ATOM 1255 CH2 TRP A 83 -14.254 -4.834 -49.298 1.00 54.32 C ATOM 0 H TRP A 83 -15.164 0.510 -46.815 1.00 20.04 H new ATOM 0 HA TRP A 83 -12.410 1.063 -46.342 1.00 54.32 H new ATOM 0 HB2 TRP A 83 -13.983 0.433 -48.862 1.00 1.15 H new ATOM 0 HB3 TRP A 83 -12.237 0.578 -48.814 1.00 1.15 H new ATOM 0 HD1 TRP A 83 -11.853 -1.013 -45.964 1.00 62.11 H new ATOM 0 HE1 TRP A 83 -12.097 -3.585 -45.921 1.00 5.04 H new ATOM 0 HE3 TRP A 83 -14.535 -1.588 -50.279 1.00 42.12 H new ATOM 0 HZ2 TRP A 83 -13.263 -5.560 -47.547 1.00 13.44 H new ATOM 0 HZ3 TRP A 83 -15.172 -3.862 -50.980 1.00 3.14 H new ATOM 0 HH2 TRP A 83 -14.549 -5.820 -49.626 1.00 54.32 H new ATOM 1266 N ASP A 84 -14.199 3.314 -47.940 1.00 72.43 N ATOM 1267 CA ASP A 84 -14.223 4.727 -48.334 1.00 32.24 C ATOM 1268 C ASP A 84 -13.695 5.605 -47.200 1.00 32.32 C ATOM 1269 O ASP A 84 -12.818 6.448 -47.400 1.00 11.55 O ATOM 1270 CB ASP A 84 -15.651 5.152 -48.711 1.00 51.14 C ATOM 1271 CG ASP A 84 -15.802 6.660 -48.895 1.00 24.20 C ATOM 1272 OD1 ASP A 84 -15.545 7.166 -50.013 1.00 41.55 O ATOM 1273 OD2 ASP A 84 -16.197 7.346 -47.925 1.00 3.24 O ATOM 0 H ASP A 84 -15.096 2.837 -48.032 1.00 72.43 H new ATOM 0 HA ASP A 84 -13.578 4.854 -49.204 1.00 32.24 H new ATOM 0 HB2 ASP A 84 -15.941 4.649 -49.634 1.00 51.14 H new ATOM 0 HB3 ASP A 84 -16.339 4.817 -47.935 1.00 51.14 H new ATOM 1278 N GLN A 85 -14.224 5.378 -46.003 1.00 53.44 N ATOM 1279 CA GLN A 85 -13.820 6.131 -44.823 1.00 73.31 C ATOM 1280 C GLN A 85 -12.358 5.845 -44.488 1.00 50.41 C ATOM 1281 O GLN A 85 -11.601 6.757 -44.148 1.00 43.23 O ATOM 1282 CB GLN A 85 -14.722 5.780 -43.630 1.00 11.22 C ATOM 1283 CG GLN A 85 -14.406 6.568 -42.363 1.00 25.14 C ATOM 1284 CD GLN A 85 -15.332 6.223 -41.211 1.00 22.14 C ATOM 1285 OE1 GLN A 85 -15.056 5.318 -40.422 1.00 20.15 O ATOM 1286 NE2 GLN A 85 -16.441 6.940 -41.108 1.00 2.41 N ATOM 0 H GLN A 85 -14.939 4.673 -45.824 1.00 53.44 H new ATOM 0 HA GLN A 85 -13.926 7.195 -45.035 1.00 73.31 H new ATOM 0 HB2 GLN A 85 -15.761 5.959 -43.908 1.00 11.22 H new ATOM 0 HB3 GLN A 85 -14.628 4.715 -43.417 1.00 11.22 H new ATOM 0 HG2 GLN A 85 -13.376 6.372 -42.066 1.00 25.14 H new ATOM 0 HG3 GLN A 85 -14.480 7.634 -42.576 1.00 25.14 H new ATOM 0 HE21 GLN A 85 -16.633 7.681 -41.782 1.00 2.41 H new ATOM 0 HE22 GLN A 85 -17.102 6.751 -40.355 1.00 2.41 H new ATOM 1295 N GLY A 86 -11.972 4.576 -44.603 1.00 70.40 N ATOM 1296 CA GLY A 86 -10.605 4.172 -44.325 1.00 62.34 C ATOM 1297 C GLY A 86 -9.592 4.948 -45.146 1.00 13.43 C ATOM 1298 O GLY A 86 -8.661 5.544 -44.599 1.00 1.43 O ATOM 0 H GLY A 86 -12.589 3.815 -44.887 1.00 70.40 H new ATOM 0 HA2 GLY A 86 -10.395 4.316 -43.265 1.00 62.34 H new ATOM 0 HA3 GLY A 86 -10.495 3.107 -44.530 1.00 62.34 H new ATOM 1302 N VAL A 87 -9.789 4.957 -46.459 1.00 54.13 N ATOM 1303 CA VAL A 87 -8.886 5.662 -47.365 1.00 50.24 C ATOM 1304 C VAL A 87 -9.039 7.181 -47.224 1.00 54.40 C ATOM 1305 O VAL A 87 -8.073 7.928 -47.387 1.00 10.11 O ATOM 1306 CB VAL A 87 -9.105 5.238 -48.844 1.00 55.44 C ATOM 1307 CG1 VAL A 87 -10.556 5.437 -49.262 1.00 34.31 C ATOM 1308 CG2 VAL A 87 -8.164 5.997 -49.782 1.00 62.31 C ATOM 0 H VAL A 87 -10.566 4.484 -46.922 1.00 54.13 H new ATOM 0 HA VAL A 87 -7.871 5.384 -47.082 1.00 50.24 H new ATOM 0 HB VAL A 87 -8.873 4.176 -48.920 1.00 55.44 H new ATOM 0 HG11 VAL A 87 -10.680 5.132 -50.301 1.00 34.31 H new ATOM 0 HG12 VAL A 87 -11.204 4.833 -48.627 1.00 34.31 H new ATOM 0 HG13 VAL A 87 -10.824 6.488 -49.158 1.00 34.31 H new ATOM 0 HG21 VAL A 87 -8.340 5.679 -50.810 1.00 62.31 H new ATOM 0 HG22 VAL A 87 -8.350 7.068 -49.696 1.00 62.31 H new ATOM 0 HG23 VAL A 87 -7.130 5.786 -49.509 1.00 62.31 H new ATOM 1318 N ALA A 88 -10.251 7.632 -46.905 1.00 43.42 N ATOM 1319 CA ALA A 88 -10.525 9.061 -46.756 1.00 63.54 C ATOM 1320 C ALA A 88 -9.865 9.635 -45.499 1.00 61.41 C ATOM 1321 O ALA A 88 -9.488 10.807 -45.469 1.00 62.12 O ATOM 1322 CB ALA A 88 -12.031 9.313 -46.731 1.00 72.34 C ATOM 0 H ALA A 88 -11.058 7.030 -46.745 1.00 43.42 H new ATOM 0 HA ALA A 88 -10.094 9.573 -47.617 1.00 63.54 H new ATOM 0 HB1 ALA A 88 -12.219 10.381 -46.620 1.00 72.34 H new ATOM 0 HB2 ALA A 88 -12.474 8.962 -47.663 1.00 72.34 H new ATOM 0 HB3 ALA A 88 -12.476 8.777 -45.893 1.00 72.34 H new ATOM 1328 N THR A 89 -9.723 8.811 -44.466 1.00 71.10 N ATOM 1329 CA THR A 89 -9.189 9.277 -43.187 1.00 21.14 C ATOM 1330 C THR A 89 -7.666 9.139 -43.119 1.00 72.32 C ATOM 1331 O THR A 89 -7.024 9.731 -42.251 1.00 61.43 O ATOM 1332 CB THR A 89 -9.833 8.521 -41.995 1.00 10.23 C ATOM 1333 OG1 THR A 89 -9.459 9.141 -40.754 1.00 70.41 O ATOM 1334 CG2 THR A 89 -9.420 7.051 -41.965 1.00 23.35 C ATOM 0 H THR A 89 -9.968 7.821 -44.487 1.00 71.10 H new ATOM 0 HA THR A 89 -9.442 10.335 -43.114 1.00 21.14 H new ATOM 0 HB THR A 89 -10.914 8.571 -42.127 1.00 10.23 H new ATOM 0 HG1 THR A 89 -8.555 9.511 -40.833 1.00 70.41 H new ATOM 0 HG21 THR A 89 -9.892 6.558 -41.116 1.00 23.35 H new ATOM 0 HG22 THR A 89 -9.736 6.565 -42.888 1.00 23.35 H new ATOM 0 HG23 THR A 89 -8.337 6.979 -41.870 1.00 23.35 H new ATOM 1342 N MET A 90 -7.091 8.357 -44.027 1.00 23.21 N ATOM 1343 CA MET A 90 -5.648 8.108 -44.021 1.00 52.35 C ATOM 1344 C MET A 90 -4.915 9.134 -44.889 1.00 34.44 C ATOM 1345 O MET A 90 -5.525 10.079 -45.393 1.00 64.34 O ATOM 1346 CB MET A 90 -5.351 6.682 -44.503 1.00 2.44 C ATOM 1347 CG MET A 90 -5.628 6.448 -45.982 1.00 20.52 C ATOM 1348 SD MET A 90 -5.585 4.699 -46.422 1.00 33.02 S ATOM 1349 CE MET A 90 -4.006 4.224 -45.729 1.00 71.33 C ATOM 0 H MET A 90 -7.598 7.885 -44.776 1.00 23.21 H new ATOM 0 HA MET A 90 -5.286 8.211 -42.998 1.00 52.35 H new ATOM 0 HB2 MET A 90 -4.304 6.454 -44.301 1.00 2.44 H new ATOM 0 HB3 MET A 90 -5.948 5.982 -43.919 1.00 2.44 H new ATOM 0 HG2 MET A 90 -6.605 6.860 -46.235 1.00 20.52 H new ATOM 0 HG3 MET A 90 -4.891 6.988 -46.577 1.00 20.52 H new ATOM 0 HE1 MET A 90 -3.638 3.333 -46.238 1.00 71.33 H new ATOM 0 HE2 MET A 90 -3.292 5.037 -45.859 1.00 71.33 H new ATOM 0 HE3 MET A 90 -4.124 4.012 -44.666 1.00 71.33 H new ATOM 1359 N THR A 91 -3.603 8.959 -45.043 1.00 54.53 N ATOM 1360 CA THR A 91 -2.788 9.864 -45.858 1.00 60.53 C ATOM 1361 C THR A 91 -1.984 9.089 -46.909 1.00 4.54 C ATOM 1362 O THR A 91 -2.013 7.857 -46.938 1.00 62.15 O ATOM 1363 CB THR A 91 -1.834 10.708 -44.975 1.00 2.34 C ATOM 1364 OG1 THR A 91 -1.119 9.859 -44.066 1.00 75.53 O ATOM 1365 CG2 THR A 91 -2.600 11.767 -44.185 1.00 54.53 C ATOM 0 H THR A 91 -3.079 8.197 -44.613 1.00 54.53 H new ATOM 0 HA THR A 91 -3.470 10.540 -46.373 1.00 60.53 H new ATOM 0 HB THR A 91 -1.130 11.212 -45.637 1.00 2.34 H new ATOM 0 HG1 THR A 91 -0.518 10.403 -43.514 1.00 75.53 H new ATOM 0 HG21 THR A 91 -1.902 12.342 -43.576 1.00 54.53 H new ATOM 0 HG22 THR A 91 -3.114 12.435 -44.876 1.00 54.53 H new ATOM 0 HG23 THR A 91 -3.331 11.281 -43.539 1.00 54.53 H new ATOM 1373 N LEU A 92 -1.276 9.815 -47.779 1.00 74.01 N ATOM 1374 CA LEU A 92 -0.510 9.195 -48.862 1.00 25.41 C ATOM 1375 C LEU A 92 0.747 8.527 -48.306 1.00 32.24 C ATOM 1376 O LEU A 92 1.419 9.079 -47.431 1.00 31.23 O ATOM 1377 CB LEU A 92 -0.161 10.252 -49.935 1.00 14.43 C ATOM 1378 CG LEU A 92 0.365 9.725 -51.289 1.00 74.12 C ATOM 1379 CD1 LEU A 92 0.206 10.790 -52.372 1.00 1.01 C ATOM 1380 CD2 LEU A 92 1.830 9.300 -51.194 1.00 24.41 C ATOM 0 H LEU A 92 -1.218 10.833 -47.754 1.00 74.01 H new ATOM 0 HA LEU A 92 -1.116 8.422 -49.334 1.00 25.41 H new ATOM 0 HB2 LEU A 92 -1.053 10.849 -50.126 1.00 14.43 H new ATOM 0 HB3 LEU A 92 0.589 10.924 -49.518 1.00 14.43 H new ATOM 0 HG LEU A 92 -0.227 8.849 -51.553 1.00 74.12 H new ATOM 0 HD11 LEU A 92 0.581 10.404 -53.320 1.00 1.01 H new ATOM 0 HD12 LEU A 92 -0.848 11.048 -52.477 1.00 1.01 H new ATOM 0 HD13 LEU A 92 0.771 11.679 -52.093 1.00 1.01 H new ATOM 0 HD21 LEU A 92 2.167 8.935 -52.164 1.00 24.41 H new ATOM 0 HD22 LEU A 92 2.438 10.154 -50.897 1.00 24.41 H new ATOM 0 HD23 LEU A 92 1.932 8.507 -50.453 1.00 24.41 H new ATOM 1392 N GLY A 93 1.040 7.326 -48.808 1.00 34.21 N ATOM 1393 CA GLY A 93 2.216 6.591 -48.374 1.00 5.55 C ATOM 1394 C GLY A 93 1.987 5.906 -47.046 1.00 72.25 C ATOM 1395 O GLY A 93 2.920 5.387 -46.431 1.00 64.11 O ATOM 0 H GLY A 93 0.478 6.848 -49.512 1.00 34.21 H new ATOM 0 HA2 GLY A 93 2.479 5.848 -49.127 1.00 5.55 H new ATOM 0 HA3 GLY A 93 3.062 7.273 -48.291 1.00 5.55 H new ATOM 1399 N GLU A 94 0.733 5.896 -46.615 1.00 71.34 N ATOM 1400 CA GLU A 94 0.360 5.360 -45.314 1.00 13.03 C ATOM 1401 C GLU A 94 -0.442 4.074 -45.473 1.00 35.11 C ATOM 1402 O GLU A 94 -1.140 3.890 -46.473 1.00 11.33 O ATOM 1403 CB GLU A 94 -0.456 6.416 -44.549 1.00 33.44 C ATOM 1404 CG GLU A 94 -0.929 5.987 -43.162 1.00 42.11 C ATOM 1405 CD GLU A 94 -1.439 7.158 -42.336 1.00 1.35 C ATOM 1406 OE1 GLU A 94 -2.532 7.682 -42.643 1.00 1.51 O ATOM 1407 OE2 GLU A 94 -0.731 7.583 -41.397 1.00 22.02 O ATOM 0 H GLU A 94 -0.052 6.258 -47.156 1.00 71.34 H new ATOM 0 HA GLU A 94 1.262 5.122 -44.750 1.00 13.03 H new ATOM 0 HB2 GLU A 94 0.149 7.317 -44.447 1.00 33.44 H new ATOM 0 HB3 GLU A 94 -1.327 6.683 -45.147 1.00 33.44 H new ATOM 0 HG2 GLU A 94 -1.721 5.246 -43.264 1.00 42.11 H new ATOM 0 HG3 GLU A 94 -0.107 5.504 -42.634 1.00 42.11 H new ATOM 1414 N LYS A 95 -0.322 3.177 -44.499 1.00 63.35 N ATOM 1415 CA LYS A 95 -1.171 1.998 -44.436 1.00 74.54 C ATOM 1416 C LYS A 95 -1.558 1.727 -42.988 1.00 2.34 C ATOM 1417 O LYS A 95 -0.702 1.754 -42.084 1.00 24.43 O ATOM 1418 CB LYS A 95 -0.503 0.757 -45.060 1.00 62.30 C ATOM 1419 CG LYS A 95 0.484 0.024 -44.150 1.00 64.33 C ATOM 1420 CD LYS A 95 0.780 -1.389 -44.654 1.00 65.41 C ATOM 1421 CE LYS A 95 -0.506 -2.191 -44.876 1.00 1.24 C ATOM 1422 NZ LYS A 95 -0.239 -3.624 -45.173 1.00 21.52 N ATOM 0 H LYS A 95 0.358 3.247 -43.742 1.00 63.35 H new ATOM 0 HA LYS A 95 -2.066 2.200 -45.025 1.00 74.54 H new ATOM 0 HB2 LYS A 95 -1.282 0.058 -45.362 1.00 62.30 H new ATOM 0 HB3 LYS A 95 0.020 1.062 -45.966 1.00 62.30 H new ATOM 0 HG2 LYS A 95 1.413 0.591 -44.091 1.00 64.33 H new ATOM 0 HG3 LYS A 95 0.077 -0.028 -43.140 1.00 64.33 H new ATOM 0 HD2 LYS A 95 1.340 -1.333 -45.588 1.00 65.41 H new ATOM 0 HD3 LYS A 95 1.413 -1.907 -43.934 1.00 65.41 H new ATOM 0 HE2 LYS A 95 -1.134 -2.118 -43.988 1.00 1.24 H new ATOM 0 HE3 LYS A 95 -1.067 -1.751 -45.700 1.00 1.24 H new ATOM 0 HZ1 LYS A 95 -0.902 -3.957 -45.902 1.00 21.52 H new ATOM 0 HZ2 LYS A 95 0.736 -3.731 -45.518 1.00 21.52 H new ATOM 0 HZ3 LYS A 95 -0.364 -4.187 -44.308 1.00 21.52 H new ATOM 1436 N ALA A 96 -2.843 1.470 -42.774 1.00 20.50 N ATOM 1437 CA ALA A 96 -3.388 1.269 -41.442 1.00 55.24 C ATOM 1438 C ALA A 96 -4.252 0.015 -41.388 1.00 22.35 C ATOM 1439 O ALA A 96 -4.768 -0.445 -42.404 1.00 52.31 O ATOM 1440 CB ALA A 96 -4.197 2.491 -41.015 1.00 14.21 C ATOM 0 H ALA A 96 -3.534 1.396 -43.520 1.00 20.50 H new ATOM 0 HA ALA A 96 -2.557 1.136 -40.750 1.00 55.24 H new ATOM 0 HB1 ALA A 96 -4.601 2.329 -40.015 1.00 14.21 H new ATOM 0 HB2 ALA A 96 -3.552 3.370 -41.008 1.00 14.21 H new ATOM 0 HB3 ALA A 96 -5.017 2.648 -41.716 1.00 14.21 H new ATOM 1446 N LEU A 97 -4.396 -0.523 -40.190 1.00 62.33 N ATOM 1447 CA LEU A 97 -5.227 -1.690 -39.934 1.00 4.54 C ATOM 1448 C LEU A 97 -6.626 -1.205 -39.582 1.00 23.15 C ATOM 1449 O LEU A 97 -6.835 -0.640 -38.509 1.00 2.53 O ATOM 1450 CB LEU A 97 -4.597 -2.519 -38.791 1.00 62.35 C ATOM 1451 CG LEU A 97 -5.363 -3.777 -38.327 1.00 23.42 C ATOM 1452 CD1 LEU A 97 -4.393 -4.827 -37.783 1.00 52.33 C ATOM 1453 CD2 LEU A 97 -6.404 -3.427 -37.258 1.00 12.41 C ATOM 0 H LEU A 97 -3.934 -0.159 -39.356 1.00 62.33 H new ATOM 0 HA LEU A 97 -5.292 -2.335 -40.811 1.00 4.54 H new ATOM 0 HB2 LEU A 97 -3.601 -2.828 -39.107 1.00 62.35 H new ATOM 0 HB3 LEU A 97 -4.469 -1.864 -37.929 1.00 62.35 H new ATOM 0 HG LEU A 97 -5.882 -4.187 -39.193 1.00 23.42 H new ATOM 0 HD11 LEU A 97 -4.951 -5.706 -37.461 1.00 52.33 H new ATOM 0 HD12 LEU A 97 -3.688 -5.111 -38.565 1.00 52.33 H new ATOM 0 HD13 LEU A 97 -3.847 -4.413 -36.935 1.00 52.33 H new ATOM 0 HD21 LEU A 97 -6.928 -4.332 -36.950 1.00 12.41 H new ATOM 0 HD22 LEU A 97 -5.905 -2.985 -36.395 1.00 12.41 H new ATOM 0 HD23 LEU A 97 -7.120 -2.715 -37.667 1.00 12.41 H new ATOM 1465 N PHE A 98 -7.564 -1.386 -40.507 1.00 33.43 N ATOM 1466 CA PHE A 98 -8.908 -0.833 -40.375 1.00 22.33 C ATOM 1467 C PHE A 98 -9.918 -1.965 -40.169 1.00 65.01 C ATOM 1468 O PHE A 98 -10.113 -2.804 -41.051 1.00 52.24 O ATOM 1469 CB PHE A 98 -9.239 -0.020 -41.639 1.00 14.23 C ATOM 1470 CG PHE A 98 -10.361 0.977 -41.478 1.00 54.22 C ATOM 1471 CD1 PHE A 98 -10.124 2.220 -40.904 1.00 54.43 C ATOM 1472 CD2 PHE A 98 -11.641 0.683 -41.920 1.00 1.45 C ATOM 1473 CE1 PHE A 98 -11.142 3.145 -40.776 1.00 53.50 C ATOM 1474 CE2 PHE A 98 -12.664 1.605 -41.791 1.00 61.40 C ATOM 1475 CZ PHE A 98 -12.413 2.837 -41.220 1.00 43.13 C ATOM 0 H PHE A 98 -7.415 -1.917 -41.365 1.00 33.43 H new ATOM 0 HA PHE A 98 -8.960 -0.175 -39.508 1.00 22.33 H new ATOM 0 HB2 PHE A 98 -8.342 0.512 -41.956 1.00 14.23 H new ATOM 0 HB3 PHE A 98 -9.499 -0.712 -42.440 1.00 14.23 H new ATOM 0 HD1 PHE A 98 -9.132 2.466 -40.554 1.00 54.43 H new ATOM 0 HD2 PHE A 98 -11.842 -0.278 -42.371 1.00 1.45 H new ATOM 0 HE1 PHE A 98 -10.944 4.108 -40.329 1.00 53.50 H new ATOM 0 HE2 PHE A 98 -13.658 1.362 -42.136 1.00 61.40 H new ATOM 0 HZ PHE A 98 -13.210 3.559 -41.121 1.00 43.13 H new ATOM 1485 N THR A 99 -10.538 -2.000 -38.994 1.00 0.52 N ATOM 1486 CA THR A 99 -11.502 -3.044 -38.662 1.00 41.40 C ATOM 1487 C THR A 99 -12.845 -2.783 -39.350 1.00 32.20 C ATOM 1488 O THR A 99 -13.479 -1.756 -39.110 1.00 23.33 O ATOM 1489 CB THR A 99 -11.719 -3.121 -37.136 1.00 71.14 C ATOM 1490 OG1 THR A 99 -10.450 -3.190 -36.468 1.00 32.31 O ATOM 1491 CG2 THR A 99 -12.567 -4.332 -36.758 1.00 45.34 C ATOM 0 H THR A 99 -10.390 -1.315 -38.253 1.00 0.52 H new ATOM 0 HA THR A 99 -11.097 -3.992 -39.016 1.00 41.40 H new ATOM 0 HB THR A 99 -12.251 -2.223 -36.823 1.00 71.14 H new ATOM 0 HG1 THR A 99 -10.017 -2.311 -36.497 1.00 32.31 H new ATOM 0 HG21 THR A 99 -12.702 -4.358 -35.677 1.00 45.34 H new ATOM 0 HG22 THR A 99 -13.540 -4.261 -37.244 1.00 45.34 H new ATOM 0 HG23 THR A 99 -12.065 -5.243 -37.083 1.00 45.34 H new ATOM 1499 N ILE A 100 -13.268 -3.705 -40.213 1.00 21.32 N ATOM 1500 CA ILE A 100 -14.543 -3.583 -40.909 1.00 55.40 C ATOM 1501 C ILE A 100 -15.598 -4.480 -40.253 1.00 14.24 C ATOM 1502 O ILE A 100 -15.509 -5.716 -40.321 1.00 1.33 O ATOM 1503 CB ILE A 100 -14.407 -3.952 -42.408 1.00 12.11 C ATOM 1504 CG1 ILE A 100 -13.426 -3.001 -43.117 1.00 60.11 C ATOM 1505 CG2 ILE A 100 -15.771 -3.922 -43.096 1.00 11.45 C ATOM 1506 CD1 ILE A 100 -13.899 -1.563 -43.174 1.00 2.12 C ATOM 0 H ILE A 100 -12.742 -4.547 -40.446 1.00 21.32 H new ATOM 0 HA ILE A 100 -14.857 -2.542 -40.838 1.00 55.40 H new ATOM 0 HB ILE A 100 -14.010 -4.965 -42.473 1.00 12.11 H new ATOM 0 HG12 ILE A 100 -12.465 -3.037 -42.604 1.00 60.11 H new ATOM 0 HG13 ILE A 100 -13.258 -3.359 -44.133 1.00 60.11 H new ATOM 0 HG21 ILE A 100 -15.654 -4.184 -44.148 1.00 11.45 H new ATOM 0 HG22 ILE A 100 -16.437 -4.639 -42.615 1.00 11.45 H new ATOM 0 HG23 ILE A 100 -16.197 -2.922 -43.016 1.00 11.45 H new ATOM 0 HD11 ILE A 100 -13.154 -0.955 -43.688 1.00 2.12 H new ATOM 0 HD12 ILE A 100 -14.845 -1.512 -43.714 1.00 2.12 H new ATOM 0 HD13 ILE A 100 -14.039 -1.186 -42.161 1.00 2.12 H new ATOM 1518 N PRO A 101 -16.603 -3.870 -39.593 1.00 5.44 N ATOM 1519 CA PRO A 101 -17.694 -4.611 -38.956 1.00 42.13 C ATOM 1520 C PRO A 101 -18.516 -5.405 -39.975 1.00 14.34 C ATOM 1521 O PRO A 101 -18.764 -4.940 -41.095 1.00 14.05 O ATOM 1522 CB PRO A 101 -18.544 -3.518 -38.286 1.00 51.24 C ATOM 1523 CG PRO A 101 -18.180 -2.255 -38.993 1.00 0.42 C ATOM 1524 CD PRO A 101 -16.744 -2.413 -39.408 1.00 24.24 C ATOM 0 HA PRO A 101 -17.327 -5.354 -38.248 1.00 42.13 H new ATOM 0 HB2 PRO A 101 -19.608 -3.731 -38.383 1.00 51.24 H new ATOM 0 HB3 PRO A 101 -18.329 -3.449 -37.220 1.00 51.24 H new ATOM 0 HG2 PRO A 101 -18.821 -2.094 -39.860 1.00 0.42 H new ATOM 0 HG3 PRO A 101 -18.305 -1.392 -38.339 1.00 0.42 H new ATOM 0 HD2 PRO A 101 -16.529 -1.868 -40.327 1.00 24.24 H new ATOM 0 HD3 PRO A 101 -16.061 -2.036 -38.646 1.00 24.24 H new ATOM 1532 N TYR A 102 -18.958 -6.589 -39.562 1.00 62.24 N ATOM 1533 CA TYR A 102 -19.664 -7.518 -40.443 1.00 42.32 C ATOM 1534 C TYR A 102 -20.871 -6.865 -41.113 1.00 55.45 C ATOM 1535 O TYR A 102 -21.203 -7.186 -42.252 1.00 63.25 O ATOM 1536 CB TYR A 102 -20.115 -8.753 -39.647 1.00 22.34 C ATOM 1537 CG TYR A 102 -21.032 -8.439 -38.470 1.00 74.23 C ATOM 1538 CD1 TYR A 102 -20.509 -8.006 -37.252 1.00 34.34 C ATOM 1539 CD2 TYR A 102 -22.414 -8.576 -38.574 1.00 52.43 C ATOM 1540 CE1 TYR A 102 -21.334 -7.718 -36.180 1.00 44.51 C ATOM 1541 CE2 TYR A 102 -23.244 -8.290 -37.506 1.00 11.43 C ATOM 1542 CZ TYR A 102 -22.698 -7.861 -36.312 1.00 3.53 C ATOM 1543 OH TYR A 102 -23.521 -7.574 -35.248 1.00 60.43 O ATOM 0 H TYR A 102 -18.838 -6.933 -38.609 1.00 62.24 H new ATOM 0 HA TYR A 102 -18.971 -7.817 -41.229 1.00 42.32 H new ATOM 0 HB2 TYR A 102 -20.630 -9.438 -40.321 1.00 22.34 H new ATOM 0 HB3 TYR A 102 -19.232 -9.274 -39.276 1.00 22.34 H new ATOM 0 HD1 TYR A 102 -19.440 -7.894 -37.144 1.00 34.34 H new ATOM 0 HD2 TYR A 102 -22.845 -8.912 -39.506 1.00 52.43 H new ATOM 0 HE1 TYR A 102 -20.911 -7.383 -35.244 1.00 44.51 H new ATOM 0 HE2 TYR A 102 -24.314 -8.401 -37.605 1.00 11.43 H new ATOM 0 HH TYR A 102 -24.454 -7.725 -35.506 1.00 60.43 H new ATOM 1553 N GLN A 103 -21.506 -5.935 -40.408 1.00 54.01 N ATOM 1554 CA GLN A 103 -22.737 -5.309 -40.890 1.00 73.14 C ATOM 1555 C GLN A 103 -22.494 -4.438 -42.125 1.00 73.11 C ATOM 1556 O GLN A 103 -23.418 -4.191 -42.901 1.00 64.20 O ATOM 1557 CB GLN A 103 -23.390 -4.473 -39.780 1.00 20.21 C ATOM 1558 CG GLN A 103 -22.495 -3.370 -39.222 1.00 52.32 C ATOM 1559 CD GLN A 103 -23.177 -2.558 -38.133 1.00 12.35 C ATOM 1560 OE1 GLN A 103 -23.102 -2.895 -36.952 1.00 44.32 O ATOM 1561 NE2 GLN A 103 -23.843 -1.481 -38.520 1.00 41.41 N ATOM 0 H GLN A 103 -21.190 -5.596 -39.499 1.00 54.01 H new ATOM 0 HA GLN A 103 -23.412 -6.114 -41.179 1.00 73.14 H new ATOM 0 HB2 GLN A 103 -24.304 -4.023 -40.169 1.00 20.21 H new ATOM 0 HB3 GLN A 103 -23.683 -5.136 -38.965 1.00 20.21 H new ATOM 0 HG2 GLN A 103 -21.584 -3.814 -38.822 1.00 52.32 H new ATOM 0 HG3 GLN A 103 -22.196 -2.705 -40.032 1.00 52.32 H new ATOM 0 HE21 GLN A 103 -23.883 -1.234 -39.509 1.00 41.41 H new ATOM 0 HE22 GLN A 103 -24.316 -0.899 -37.829 1.00 41.41 H new ATOM 1570 N LEU A 104 -21.257 -3.972 -42.308 1.00 62.14 N ATOM 1571 CA LEU A 104 -20.937 -3.069 -43.421 1.00 32.30 C ATOM 1572 C LEU A 104 -20.372 -3.832 -44.618 1.00 63.52 C ATOM 1573 O LEU A 104 -20.525 -3.406 -45.764 1.00 31.32 O ATOM 1574 CB LEU A 104 -19.941 -1.990 -42.975 1.00 72.14 C ATOM 1575 CG LEU A 104 -20.423 -1.070 -41.841 1.00 20.21 C ATOM 1576 CD1 LEU A 104 -19.393 0.021 -41.561 1.00 1.30 C ATOM 1577 CD2 LEU A 104 -21.780 -0.455 -42.179 1.00 71.42 C ATOM 0 H LEU A 104 -20.465 -4.201 -41.707 1.00 62.14 H new ATOM 0 HA LEU A 104 -21.867 -2.591 -43.729 1.00 32.30 H new ATOM 0 HB2 LEU A 104 -19.021 -2.480 -42.655 1.00 72.14 H new ATOM 0 HB3 LEU A 104 -19.691 -1.373 -43.838 1.00 72.14 H new ATOM 0 HG LEU A 104 -20.539 -1.673 -40.940 1.00 20.21 H new ATOM 0 HD11 LEU A 104 -19.752 0.662 -40.756 1.00 1.30 H new ATOM 0 HD12 LEU A 104 -18.449 -0.437 -41.267 1.00 1.30 H new ATOM 0 HD13 LEU A 104 -19.242 0.618 -42.460 1.00 1.30 H new ATOM 0 HD21 LEU A 104 -22.100 0.192 -41.362 1.00 71.42 H new ATOM 0 HD22 LEU A 104 -21.696 0.131 -43.094 1.00 71.42 H new ATOM 0 HD23 LEU A 104 -22.513 -1.248 -42.322 1.00 71.42 H new ATOM 1589 N ALA A 105 -19.725 -4.960 -44.350 1.00 62.01 N ATOM 1590 CA ALA A 105 -19.093 -5.753 -45.402 1.00 15.02 C ATOM 1591 C ALA A 105 -19.839 -7.062 -45.626 1.00 14.10 C ATOM 1592 O ALA A 105 -20.893 -7.301 -45.036 1.00 75.53 O ATOM 1593 CB ALA A 105 -17.637 -6.033 -45.048 1.00 53.05 C ATOM 0 H ALA A 105 -19.623 -5.348 -43.412 1.00 62.01 H new ATOM 0 HA ALA A 105 -19.131 -5.178 -46.327 1.00 15.02 H new ATOM 0 HB1 ALA A 105 -17.177 -6.625 -45.840 1.00 53.05 H new ATOM 0 HB2 ALA A 105 -17.101 -5.090 -44.942 1.00 53.05 H new ATOM 0 HB3 ALA A 105 -17.590 -6.585 -44.109 1.00 53.05 H new ATOM 1599 N TYR A 106 -19.277 -7.910 -46.482 1.00 54.43 N ATOM 1600 CA TYR A 106 -19.846 -9.227 -46.755 1.00 22.33 C ATOM 1601 C TYR A 106 -19.690 -10.155 -45.548 1.00 52.22 C ATOM 1602 O TYR A 106 -20.235 -11.255 -45.533 1.00 2.43 O ATOM 1603 CB TYR A 106 -19.182 -9.854 -47.994 1.00 62.33 C ATOM 1604 CG TYR A 106 -17.688 -10.114 -47.843 1.00 72.41 C ATOM 1605 CD1 TYR A 106 -16.759 -9.107 -48.084 1.00 61.54 C ATOM 1606 CD2 TYR A 106 -17.208 -11.365 -47.463 1.00 15.41 C ATOM 1607 CE1 TYR A 106 -15.403 -9.337 -47.952 1.00 50.11 C ATOM 1608 CE2 TYR A 106 -15.852 -11.601 -47.329 1.00 43.13 C ATOM 1609 CZ TYR A 106 -14.955 -10.583 -47.576 1.00 60.03 C ATOM 1610 OH TYR A 106 -13.602 -10.812 -47.444 1.00 3.12 O ATOM 0 H TYR A 106 -18.423 -7.707 -47.002 1.00 54.43 H new ATOM 0 HA TYR A 106 -20.910 -9.098 -46.952 1.00 22.33 H new ATOM 0 HB2 TYR A 106 -19.681 -10.796 -48.221 1.00 62.33 H new ATOM 0 HB3 TYR A 106 -19.339 -9.195 -48.848 1.00 62.33 H new ATOM 0 HD1 TYR A 106 -17.104 -8.127 -48.380 1.00 61.54 H new ATOM 0 HD2 TYR A 106 -17.907 -12.165 -47.270 1.00 15.41 H new ATOM 0 HE1 TYR A 106 -14.697 -8.542 -48.143 1.00 50.11 H new ATOM 0 HE2 TYR A 106 -15.497 -12.577 -47.033 1.00 43.13 H new ATOM 0 HH TYR A 106 -13.453 -11.741 -47.171 1.00 3.12 H new ATOM 1620 N GLY A 107 -18.949 -9.690 -44.536 1.00 75.14 N ATOM 1621 CA GLY A 107 -18.688 -10.487 -43.344 1.00 10.44 C ATOM 1622 C GLY A 107 -19.957 -10.979 -42.666 1.00 30.53 C ATOM 1623 O GLY A 107 -19.953 -12.024 -42.011 1.00 60.22 O ATOM 0 H GLY A 107 -18.521 -8.764 -44.524 1.00 75.14 H new ATOM 0 HA2 GLY A 107 -18.072 -11.345 -43.615 1.00 10.44 H new ATOM 0 HA3 GLY A 107 -18.112 -9.892 -42.635 1.00 10.44 H new ATOM 1627 N GLU A 108 -21.042 -10.218 -42.809 1.00 42.23 N ATOM 1628 CA GLU A 108 -22.340 -10.627 -42.281 1.00 2.53 C ATOM 1629 C GLU A 108 -22.804 -11.890 -43.001 1.00 1.12 C ATOM 1630 O GLU A 108 -23.170 -12.883 -42.369 1.00 70.21 O ATOM 1631 CB GLU A 108 -23.367 -9.489 -42.458 1.00 42.32 C ATOM 1632 CG GLU A 108 -24.682 -9.670 -41.689 1.00 4.21 C ATOM 1633 CD GLU A 108 -25.555 -10.806 -42.208 1.00 31.05 C ATOM 1634 OE1 GLU A 108 -25.767 -10.891 -43.432 1.00 42.51 O ATOM 1635 OE2 GLU A 108 -26.055 -11.607 -41.387 1.00 64.21 O ATOM 0 H GLU A 108 -21.046 -9.316 -43.286 1.00 42.23 H new ATOM 0 HA GLU A 108 -22.250 -10.840 -41.216 1.00 2.53 H new ATOM 0 HB2 GLU A 108 -22.906 -8.553 -42.142 1.00 42.32 H new ATOM 0 HB3 GLU A 108 -23.596 -9.390 -43.519 1.00 42.32 H new ATOM 0 HG2 GLU A 108 -24.454 -9.852 -40.639 1.00 4.21 H new ATOM 0 HG3 GLU A 108 -25.249 -8.740 -41.736 1.00 4.21 H new ATOM 1642 N ARG A 109 -22.751 -11.844 -44.328 1.00 41.24 N ATOM 1643 CA ARG A 109 -23.248 -12.930 -45.164 1.00 2.14 C ATOM 1644 C ARG A 109 -22.271 -14.106 -45.150 1.00 64.15 C ATOM 1645 O ARG A 109 -22.662 -15.260 -45.336 1.00 50.12 O ATOM 1646 CB ARG A 109 -23.448 -12.432 -46.606 1.00 42.44 C ATOM 1647 CG ARG A 109 -24.450 -13.256 -47.414 1.00 24.32 C ATOM 1648 CD ARG A 109 -25.882 -12.747 -47.246 1.00 60.10 C ATOM 1649 NE ARG A 109 -26.264 -12.560 -45.841 1.00 12.51 N ATOM 1650 CZ ARG A 109 -27.398 -13.009 -45.301 1.00 71.52 C ATOM 1651 NH1 ARG A 109 -28.265 -13.699 -46.031 1.00 63.01 N ATOM 1652 NH2 ARG A 109 -27.662 -12.758 -44.029 1.00 72.20 N ATOM 0 H ARG A 109 -22.365 -11.058 -44.851 1.00 41.24 H new ATOM 0 HA ARG A 109 -24.205 -13.267 -44.765 1.00 2.14 H new ATOM 0 HB2 ARG A 109 -23.784 -11.395 -46.578 1.00 42.44 H new ATOM 0 HB3 ARG A 109 -22.487 -12.442 -47.120 1.00 42.44 H new ATOM 0 HG2 ARG A 109 -24.176 -13.226 -48.469 1.00 24.32 H new ATOM 0 HG3 ARG A 109 -24.397 -14.299 -47.101 1.00 24.32 H new ATOM 0 HD2 ARG A 109 -25.989 -11.800 -47.775 1.00 60.10 H new ATOM 0 HD3 ARG A 109 -26.569 -13.452 -47.713 1.00 60.10 H new ATOM 0 HE ARG A 109 -25.618 -12.052 -45.236 1.00 12.51 H new ATOM 0 HH11 ARG A 109 -28.067 -13.890 -47.013 1.00 63.01 H new ATOM 0 HH12 ARG A 109 -29.130 -14.039 -45.610 1.00 63.01 H new ATOM 0 HH21 ARG A 109 -27.000 -12.224 -43.467 1.00 72.20 H new ATOM 0 HH22 ARG A 109 -28.528 -13.099 -43.611 1.00 72.20 H new ATOM 1666 N GLY A 110 -21.000 -13.794 -44.923 1.00 51.44 N ATOM 1667 CA GLY A 110 -19.958 -14.801 -44.935 1.00 74.31 C ATOM 1668 C GLY A 110 -19.528 -15.148 -46.346 1.00 44.44 C ATOM 1669 O GLY A 110 -18.565 -14.578 -46.854 1.00 52.23 O ATOM 0 H GLY A 110 -20.671 -12.848 -44.729 1.00 51.44 H new ATOM 0 HA2 GLY A 110 -19.098 -14.441 -44.371 1.00 74.31 H new ATOM 0 HA3 GLY A 110 -20.315 -15.700 -44.432 1.00 74.31 H new ATOM 1673 N TYR A 111 -20.300 -16.043 -46.976 1.00 14.34 N ATOM 1674 CA TYR A 111 -20.032 -16.606 -48.314 1.00 51.25 C ATOM 1675 C TYR A 111 -19.163 -17.887 -48.241 1.00 15.01 C ATOM 1676 O TYR A 111 -19.720 -18.983 -48.364 1.00 51.22 O ATOM 1677 CB TYR A 111 -19.484 -15.571 -49.322 1.00 51.01 C ATOM 1678 CG TYR A 111 -20.491 -14.508 -49.734 1.00 1.55 C ATOM 1679 CD1 TYR A 111 -21.643 -14.850 -50.437 1.00 14.33 C ATOM 1680 CD2 TYR A 111 -20.282 -13.165 -49.434 1.00 62.24 C ATOM 1681 CE1 TYR A 111 -22.555 -13.888 -50.826 1.00 51.32 C ATOM 1682 CE2 TYR A 111 -21.193 -12.200 -49.817 1.00 42.35 C ATOM 1683 CZ TYR A 111 -22.326 -12.565 -50.513 1.00 75.40 C ATOM 1684 OH TYR A 111 -23.228 -11.601 -50.905 1.00 34.13 O ATOM 0 H TYR A 111 -21.156 -16.409 -46.559 1.00 14.34 H new ATOM 0 HA TYR A 111 -21.002 -16.903 -48.712 1.00 51.25 H new ATOM 0 HB2 TYR A 111 -18.614 -15.081 -48.886 1.00 51.01 H new ATOM 0 HB3 TYR A 111 -19.141 -16.095 -50.214 1.00 51.01 H new ATOM 0 HD1 TYR A 111 -21.827 -15.886 -50.683 1.00 14.33 H new ATOM 0 HD2 TYR A 111 -19.394 -12.873 -48.893 1.00 62.24 H new ATOM 0 HE1 TYR A 111 -23.443 -14.171 -51.372 1.00 51.32 H new ATOM 0 HE2 TYR A 111 -21.018 -11.163 -49.572 1.00 42.35 H new ATOM 0 HH TYR A 111 -22.918 -10.721 -50.604 1.00 34.13 H new ATOM 1694 N PRO A 112 -17.813 -17.828 -48.040 1.00 71.14 N ATOM 1695 CA PRO A 112 -17.010 -19.043 -47.909 1.00 74.05 C ATOM 1696 C PRO A 112 -16.930 -19.514 -46.453 1.00 44.53 C ATOM 1697 O PRO A 112 -17.017 -18.704 -45.531 1.00 35.22 O ATOM 1698 CB PRO A 112 -15.640 -18.588 -48.418 1.00 3.14 C ATOM 1699 CG PRO A 112 -15.538 -17.166 -47.974 1.00 55.31 C ATOM 1700 CD PRO A 112 -16.953 -16.624 -47.929 1.00 34.32 C ATOM 0 HA PRO A 112 -17.422 -19.892 -48.455 1.00 74.05 H new ATOM 0 HB2 PRO A 112 -14.838 -19.195 -47.998 1.00 3.14 H new ATOM 0 HB3 PRO A 112 -15.570 -18.673 -49.502 1.00 3.14 H new ATOM 0 HG2 PRO A 112 -15.066 -17.099 -46.994 1.00 55.31 H new ATOM 0 HG3 PRO A 112 -14.923 -16.588 -48.664 1.00 55.31 H new ATOM 0 HD2 PRO A 112 -17.143 -16.084 -47.001 1.00 34.32 H new ATOM 0 HD3 PRO A 112 -17.138 -15.927 -48.746 1.00 34.32 H new ATOM 1708 N PRO A 113 -16.742 -20.829 -46.221 1.00 75.52 N ATOM 1709 CA PRO A 113 -16.670 -21.392 -44.861 1.00 14.13 C ATOM 1710 C PRO A 113 -15.473 -20.853 -44.069 1.00 51.33 C ATOM 1711 O PRO A 113 -15.332 -21.119 -42.871 1.00 50.55 O ATOM 1712 CB PRO A 113 -16.540 -22.907 -45.101 1.00 71.32 C ATOM 1713 CG PRO A 113 -16.008 -23.028 -46.490 1.00 43.15 C ATOM 1714 CD PRO A 113 -16.594 -21.873 -47.255 1.00 14.23 C ATOM 0 HA PRO A 113 -17.540 -21.125 -44.262 1.00 14.13 H new ATOM 0 HB2 PRO A 113 -15.866 -23.366 -44.378 1.00 71.32 H new ATOM 0 HB3 PRO A 113 -17.503 -23.408 -45.001 1.00 71.32 H new ATOM 0 HG2 PRO A 113 -14.919 -22.989 -46.496 1.00 43.15 H new ATOM 0 HG3 PRO A 113 -16.295 -23.979 -46.937 1.00 43.15 H new ATOM 0 HD2 PRO A 113 -15.938 -21.550 -48.063 1.00 14.23 H new ATOM 0 HD3 PRO A 113 -17.552 -22.132 -47.706 1.00 14.23 H new ATOM 1722 N VAL A 114 -14.606 -20.108 -44.751 1.00 63.42 N ATOM 1723 CA VAL A 114 -13.477 -19.448 -44.106 1.00 23.21 C ATOM 1724 C VAL A 114 -13.973 -18.275 -43.259 1.00 74.31 C ATOM 1725 O VAL A 114 -13.389 -17.947 -42.224 1.00 2.15 O ATOM 1726 CB VAL A 114 -12.452 -18.931 -45.148 1.00 34.22 C ATOM 1727 CG1 VAL A 114 -11.224 -18.333 -44.461 1.00 33.32 C ATOM 1728 CG2 VAL A 114 -12.050 -20.047 -46.113 1.00 53.14 C ATOM 0 H VAL A 114 -14.666 -19.947 -45.756 1.00 63.42 H new ATOM 0 HA VAL A 114 -12.981 -20.182 -43.471 1.00 23.21 H new ATOM 0 HB VAL A 114 -12.929 -18.139 -45.726 1.00 34.22 H new ATOM 0 HG11 VAL A 114 -10.522 -17.978 -45.215 1.00 33.32 H new ATOM 0 HG12 VAL A 114 -11.530 -17.499 -43.830 1.00 33.32 H new ATOM 0 HG13 VAL A 114 -10.743 -19.095 -43.847 1.00 33.32 H new ATOM 0 HG21 VAL A 114 -11.330 -19.662 -46.835 1.00 53.14 H new ATOM 0 HG22 VAL A 114 -11.599 -20.867 -45.554 1.00 53.14 H new ATOM 0 HG23 VAL A 114 -12.933 -20.409 -46.639 1.00 53.14 H new ATOM 1738 N ILE A 115 -15.065 -17.658 -43.706 1.00 51.04 N ATOM 1739 CA ILE A 115 -15.657 -16.518 -43.013 1.00 15.41 C ATOM 1740 C ILE A 115 -16.991 -16.927 -42.382 1.00 5.40 C ATOM 1741 O ILE A 115 -17.998 -17.053 -43.079 1.00 35.31 O ATOM 1742 CB ILE A 115 -15.889 -15.323 -43.979 1.00 64.33 C ATOM 1743 CG1 ILE A 115 -14.577 -14.929 -44.684 1.00 53.33 C ATOM 1744 CG2 ILE A 115 -16.482 -14.124 -43.232 1.00 50.30 C ATOM 1745 CD1 ILE A 115 -13.479 -14.468 -43.744 1.00 54.20 C ATOM 0 H ILE A 115 -15.561 -17.933 -44.554 1.00 51.04 H new ATOM 0 HA ILE A 115 -14.960 -16.201 -42.237 1.00 15.41 H new ATOM 0 HB ILE A 115 -16.605 -15.637 -44.739 1.00 64.33 H new ATOM 0 HG12 ILE A 115 -14.215 -15.783 -45.256 1.00 53.33 H new ATOM 0 HG13 ILE A 115 -14.787 -14.133 -45.398 1.00 53.33 H new ATOM 0 HG21 ILE A 115 -16.635 -13.300 -43.929 1.00 50.30 H new ATOM 0 HG22 ILE A 115 -17.437 -14.407 -42.789 1.00 50.30 H new ATOM 0 HG23 ILE A 115 -15.796 -13.810 -42.445 1.00 50.30 H new ATOM 0 HD11 ILE A 115 -12.591 -14.210 -44.321 1.00 54.20 H new ATOM 0 HD12 ILE A 115 -13.818 -13.593 -43.189 1.00 54.20 H new ATOM 0 HD13 ILE A 115 -13.238 -15.269 -43.046 1.00 54.20 H new ATOM 1757 N PRO A 116 -17.009 -17.172 -41.057 1.00 1.54 N ATOM 1758 CA PRO A 116 -18.237 -17.548 -40.347 1.00 4.42 C ATOM 1759 C PRO A 116 -19.245 -16.392 -40.322 1.00 1.54 C ATOM 1760 O PRO A 116 -18.946 -15.326 -39.789 1.00 44.24 O ATOM 1761 CB PRO A 116 -17.744 -17.887 -38.929 1.00 0.11 C ATOM 1762 CG PRO A 116 -16.463 -17.135 -38.780 1.00 2.34 C ATOM 1763 CD PRO A 116 -15.843 -17.099 -40.152 1.00 73.41 C ATOM 0 HA PRO A 116 -18.762 -18.376 -40.823 1.00 4.42 H new ATOM 0 HB2 PRO A 116 -18.470 -17.584 -38.175 1.00 0.11 H new ATOM 0 HB3 PRO A 116 -17.589 -18.959 -38.810 1.00 0.11 H new ATOM 0 HG2 PRO A 116 -16.643 -16.127 -38.406 1.00 2.34 H new ATOM 0 HG3 PRO A 116 -15.802 -17.626 -38.066 1.00 2.34 H new ATOM 0 HD2 PRO A 116 -15.269 -16.186 -40.310 1.00 73.41 H new ATOM 0 HD3 PRO A 116 -15.161 -17.935 -40.307 1.00 73.41 H new ATOM 1771 N PRO A 117 -20.452 -16.597 -40.902 1.00 32.11 N ATOM 1772 CA PRO A 117 -21.487 -15.559 -41.020 1.00 23.42 C ATOM 1773 C PRO A 117 -21.549 -14.621 -39.811 1.00 61.41 C ATOM 1774 O PRO A 117 -21.531 -15.073 -38.662 1.00 22.34 O ATOM 1775 CB PRO A 117 -22.766 -16.386 -41.136 1.00 44.33 C ATOM 1776 CG PRO A 117 -22.343 -17.602 -41.890 1.00 52.33 C ATOM 1777 CD PRO A 117 -20.905 -17.873 -41.494 1.00 32.41 C ATOM 0 HA PRO A 117 -21.303 -14.888 -41.859 1.00 23.42 H new ATOM 0 HB2 PRO A 117 -23.165 -16.644 -40.155 1.00 44.33 H new ATOM 0 HB3 PRO A 117 -23.547 -15.840 -41.665 1.00 44.33 H new ATOM 0 HG2 PRO A 117 -22.980 -18.452 -41.645 1.00 52.33 H new ATOM 0 HG3 PRO A 117 -22.426 -17.441 -42.965 1.00 52.33 H new ATOM 0 HD2 PRO A 117 -20.835 -18.692 -40.778 1.00 32.41 H new ATOM 0 HD3 PRO A 117 -20.299 -18.151 -42.356 1.00 32.41 H new ATOM 1785 N LYS A 118 -21.626 -13.318 -40.097 1.00 12.23 N ATOM 1786 CA LYS A 118 -21.630 -12.262 -39.080 1.00 22.13 C ATOM 1787 C LYS A 118 -20.241 -12.087 -38.461 1.00 41.51 C ATOM 1788 O LYS A 118 -20.110 -11.697 -37.299 1.00 20.11 O ATOM 1789 CB LYS A 118 -22.685 -12.524 -37.988 1.00 64.12 C ATOM 1790 CG LYS A 118 -24.118 -12.559 -38.514 1.00 0.22 C ATOM 1791 CD LYS A 118 -25.146 -12.576 -37.384 1.00 12.22 C ATOM 1792 CE LYS A 118 -25.037 -13.821 -36.514 1.00 54.44 C ATOM 1793 NZ LYS A 118 -26.069 -13.829 -35.442 1.00 73.32 N ATOM 0 H LYS A 118 -21.688 -12.963 -41.051 1.00 12.23 H new ATOM 0 HA LYS A 118 -21.900 -11.333 -39.582 1.00 22.13 H new ATOM 0 HB2 LYS A 118 -22.463 -13.474 -37.501 1.00 64.12 H new ATOM 0 HB3 LYS A 118 -22.606 -11.749 -37.226 1.00 64.12 H new ATOM 0 HG2 LYS A 118 -24.292 -11.690 -39.148 1.00 0.22 H new ATOM 0 HG3 LYS A 118 -24.253 -13.442 -39.139 1.00 0.22 H new ATOM 0 HD2 LYS A 118 -25.013 -11.690 -36.763 1.00 12.22 H new ATOM 0 HD3 LYS A 118 -26.148 -12.520 -37.808 1.00 12.22 H new ATOM 0 HE2 LYS A 118 -25.148 -14.710 -37.134 1.00 54.44 H new ATOM 0 HE3 LYS A 118 -24.045 -13.867 -36.066 1.00 54.44 H new ATOM 0 HZ1 LYS A 118 -25.967 -14.690 -34.868 1.00 73.32 H new ATOM 0 HZ2 LYS A 118 -25.947 -12.993 -34.836 1.00 73.32 H new ATOM 0 HZ3 LYS A 118 -27.016 -13.810 -35.872 1.00 73.32 H new ATOM 1807 N ALA A 119 -19.207 -12.336 -39.261 1.00 25.12 N ATOM 1808 CA ALA A 119 -17.825 -12.177 -38.809 1.00 55.24 C ATOM 1809 C ALA A 119 -17.293 -10.791 -39.163 1.00 12.24 C ATOM 1810 O ALA A 119 -17.320 -10.383 -40.326 1.00 74.12 O ATOM 1811 CB ALA A 119 -16.932 -13.247 -39.425 1.00 71.50 C ATOM 0 H ALA A 119 -19.299 -12.649 -40.227 1.00 25.12 H new ATOM 0 HA ALA A 119 -17.813 -12.289 -37.725 1.00 55.24 H new ATOM 0 HB1 ALA A 119 -15.908 -13.111 -39.076 1.00 71.50 H new ATOM 0 HB2 ALA A 119 -17.289 -14.233 -39.129 1.00 71.50 H new ATOM 0 HB3 ALA A 119 -16.959 -13.163 -40.511 1.00 71.50 H new ATOM 1817 N THR A 120 -16.830 -10.067 -38.151 1.00 51.12 N ATOM 1818 CA THR A 120 -16.155 -8.793 -38.357 1.00 71.23 C ATOM 1819 C THR A 120 -14.753 -9.049 -38.915 1.00 20.24 C ATOM 1820 O THR A 120 -13.984 -9.825 -38.340 1.00 3.02 O ATOM 1821 CB THR A 120 -16.070 -7.994 -37.035 1.00 65.31 C ATOM 1822 OG1 THR A 120 -17.395 -7.677 -36.580 1.00 65.31 O ATOM 1823 CG2 THR A 120 -15.267 -6.708 -37.203 1.00 44.33 C ATOM 0 H THR A 120 -16.911 -10.344 -37.173 1.00 51.12 H new ATOM 0 HA THR A 120 -16.728 -8.200 -39.070 1.00 71.23 H new ATOM 0 HB THR A 120 -15.558 -8.615 -36.300 1.00 65.31 H new ATOM 0 HG1 THR A 120 -17.341 -7.172 -35.742 1.00 65.31 H new ATOM 0 HG21 THR A 120 -15.230 -6.175 -36.253 1.00 44.33 H new ATOM 0 HG22 THR A 120 -14.254 -6.951 -37.522 1.00 44.33 H new ATOM 0 HG23 THR A 120 -15.743 -6.078 -37.954 1.00 44.33 H new ATOM 1831 N LEU A 121 -14.421 -8.396 -40.025 1.00 2.41 N ATOM 1832 CA LEU A 121 -13.192 -8.709 -40.752 1.00 73.03 C ATOM 1833 C LEU A 121 -12.314 -7.464 -40.830 1.00 70.13 C ATOM 1834 O LEU A 121 -12.804 -6.365 -41.082 1.00 70.31 O ATOM 1835 CB LEU A 121 -13.539 -9.241 -42.163 1.00 5.25 C ATOM 1836 CG LEU A 121 -12.503 -10.180 -42.824 1.00 44.23 C ATOM 1837 CD1 LEU A 121 -11.216 -9.444 -43.188 1.00 63.11 C ATOM 1838 CD2 LEU A 121 -12.199 -11.369 -41.916 1.00 11.54 C ATOM 0 H LEU A 121 -14.981 -7.651 -40.440 1.00 2.41 H new ATOM 0 HA LEU A 121 -12.638 -9.486 -40.225 1.00 73.03 H new ATOM 0 HB2 LEU A 121 -14.489 -9.771 -42.103 1.00 5.25 H new ATOM 0 HB3 LEU A 121 -13.692 -8.386 -42.821 1.00 5.25 H new ATOM 0 HG LEU A 121 -12.943 -10.547 -43.751 1.00 44.23 H new ATOM 0 HD11 LEU A 121 -10.516 -10.141 -43.649 1.00 63.11 H new ATOM 0 HD12 LEU A 121 -11.442 -8.640 -43.888 1.00 63.11 H new ATOM 0 HD13 LEU A 121 -10.769 -9.025 -42.286 1.00 63.11 H new ATOM 0 HD21 LEU A 121 -11.468 -12.018 -42.399 1.00 11.54 H new ATOM 0 HD22 LEU A 121 -11.796 -11.010 -40.969 1.00 11.54 H new ATOM 0 HD23 LEU A 121 -13.116 -11.929 -41.731 1.00 11.54 H new ATOM 1850 N VAL A 122 -11.019 -7.635 -40.610 1.00 31.41 N ATOM 1851 CA VAL A 122 -10.095 -6.513 -40.592 1.00 43.23 C ATOM 1852 C VAL A 122 -9.383 -6.390 -41.931 1.00 70.11 C ATOM 1853 O VAL A 122 -8.869 -7.373 -42.461 1.00 44.44 O ATOM 1854 CB VAL A 122 -9.045 -6.668 -39.468 1.00 61.11 C ATOM 1855 CG1 VAL A 122 -8.067 -5.500 -39.479 1.00 50.24 C ATOM 1856 CG2 VAL A 122 -9.725 -6.798 -38.107 1.00 74.23 C ATOM 0 H VAL A 122 -10.584 -8.542 -40.441 1.00 31.41 H new ATOM 0 HA VAL A 122 -10.678 -5.611 -40.404 1.00 43.23 H new ATOM 0 HB VAL A 122 -8.481 -7.582 -39.652 1.00 61.11 H new ATOM 0 HG11 VAL A 122 -7.337 -5.629 -38.680 1.00 50.24 H new ATOM 0 HG12 VAL A 122 -7.552 -5.466 -40.439 1.00 50.24 H new ATOM 0 HG13 VAL A 122 -8.611 -4.568 -39.326 1.00 50.24 H new ATOM 0 HG21 VAL A 122 -8.968 -6.906 -37.331 1.00 74.23 H new ATOM 0 HG22 VAL A 122 -10.321 -5.906 -37.911 1.00 74.23 H new ATOM 0 HG23 VAL A 122 -10.373 -7.675 -38.106 1.00 74.23 H new ATOM 1866 N PHE A 123 -9.360 -5.188 -42.481 1.00 33.02 N ATOM 1867 CA PHE A 123 -8.661 -4.930 -43.728 1.00 14.15 C ATOM 1868 C PHE A 123 -7.601 -3.858 -43.517 1.00 24.01 C ATOM 1869 O PHE A 123 -7.901 -2.759 -43.044 1.00 14.25 O ATOM 1870 CB PHE A 123 -9.642 -4.494 -44.827 1.00 30.11 C ATOM 1871 CG PHE A 123 -10.567 -5.593 -45.296 1.00 10.14 C ATOM 1872 CD1 PHE A 123 -10.189 -6.446 -46.325 1.00 52.10 C ATOM 1873 CD2 PHE A 123 -11.814 -5.770 -44.713 1.00 51.11 C ATOM 1874 CE1 PHE A 123 -11.034 -7.450 -46.761 1.00 34.12 C ATOM 1875 CE2 PHE A 123 -12.663 -6.772 -45.146 1.00 23.22 C ATOM 1876 CZ PHE A 123 -12.272 -7.613 -46.172 1.00 24.21 C ATOM 0 H PHE A 123 -9.821 -4.371 -42.080 1.00 33.02 H new ATOM 0 HA PHE A 123 -8.179 -5.853 -44.049 1.00 14.15 H new ATOM 0 HB2 PHE A 123 -10.241 -3.662 -44.456 1.00 30.11 H new ATOM 0 HB3 PHE A 123 -9.074 -4.122 -45.680 1.00 30.11 H new ATOM 0 HD1 PHE A 123 -9.222 -6.323 -46.791 1.00 52.10 H new ATOM 0 HD2 PHE A 123 -12.125 -5.117 -43.911 1.00 51.11 H new ATOM 0 HE1 PHE A 123 -10.726 -8.106 -47.562 1.00 34.12 H new ATOM 0 HE2 PHE A 123 -13.631 -6.898 -44.683 1.00 23.22 H new ATOM 0 HZ PHE A 123 -12.934 -8.396 -46.512 1.00 24.21 H new ATOM 1886 N GLU A 124 -6.359 -4.193 -43.832 1.00 64.31 N ATOM 1887 CA GLU A 124 -5.295 -3.207 -43.854 1.00 51.31 C ATOM 1888 C GLU A 124 -5.448 -2.358 -45.106 1.00 24.30 C ATOM 1889 O GLU A 124 -5.353 -2.873 -46.225 1.00 64.22 O ATOM 1890 CB GLU A 124 -3.913 -3.877 -43.831 1.00 15.04 C ATOM 1891 CG GLU A 124 -3.586 -4.592 -42.523 1.00 23.21 C ATOM 1892 CD GLU A 124 -2.242 -5.303 -42.564 1.00 12.02 C ATOM 1893 OE1 GLU A 124 -1.205 -4.628 -42.760 1.00 32.21 O ATOM 1894 OE2 GLU A 124 -2.209 -6.541 -42.396 1.00 21.31 O ATOM 0 H GLU A 124 -6.066 -5.139 -44.075 1.00 64.31 H new ATOM 0 HA GLU A 124 -5.369 -2.582 -42.964 1.00 51.31 H new ATOM 0 HB2 GLU A 124 -3.856 -4.595 -44.649 1.00 15.04 H new ATOM 0 HB3 GLU A 124 -3.151 -3.120 -44.018 1.00 15.04 H new ATOM 0 HG2 GLU A 124 -3.585 -3.868 -41.708 1.00 23.21 H new ATOM 0 HG3 GLU A 124 -4.370 -5.317 -42.304 1.00 23.21 H new ATOM 1901 N VAL A 125 -5.721 -1.075 -44.908 1.00 22.33 N ATOM 1902 CA VAL A 125 -5.885 -0.139 -46.008 1.00 0.42 C ATOM 1903 C VAL A 125 -4.567 0.585 -46.258 1.00 41.00 C ATOM 1904 O VAL A 125 -3.877 0.975 -45.317 1.00 20.15 O ATOM 1905 CB VAL A 125 -7.011 0.894 -45.722 1.00 20.05 C ATOM 1906 CG1 VAL A 125 -8.363 0.192 -45.584 1.00 34.15 C ATOM 1907 CG2 VAL A 125 -6.699 1.720 -44.470 1.00 11.44 C ATOM 0 H VAL A 125 -5.834 -0.657 -43.984 1.00 22.33 H new ATOM 0 HA VAL A 125 -6.174 -0.704 -46.894 1.00 0.42 H new ATOM 0 HB VAL A 125 -7.063 1.578 -46.569 1.00 20.05 H new ATOM 0 HG11 VAL A 125 -9.138 0.932 -45.384 1.00 34.15 H new ATOM 0 HG12 VAL A 125 -8.595 -0.336 -46.509 1.00 34.15 H new ATOM 0 HG13 VAL A 125 -8.321 -0.521 -44.760 1.00 34.15 H new ATOM 0 HG21 VAL A 125 -7.504 2.434 -44.295 1.00 11.44 H new ATOM 0 HG22 VAL A 125 -6.609 1.057 -43.610 1.00 11.44 H new ATOM 0 HG23 VAL A 125 -5.762 2.258 -44.613 1.00 11.44 H new ATOM 1917 N GLU A 126 -4.213 0.736 -47.524 1.00 43.13 N ATOM 1918 CA GLU A 126 -2.934 1.317 -47.912 1.00 63.02 C ATOM 1919 C GLU A 126 -3.145 2.296 -49.062 1.00 75.21 C ATOM 1920 O GLU A 126 -3.608 1.908 -50.129 1.00 73.13 O ATOM 1921 CB GLU A 126 -1.970 0.189 -48.322 1.00 51.44 C ATOM 1922 CG GLU A 126 -0.568 0.647 -48.708 1.00 43.20 C ATOM 1923 CD GLU A 126 0.340 -0.523 -49.070 1.00 3.30 C ATOM 1924 OE1 GLU A 126 0.847 -1.198 -48.149 1.00 33.31 O ATOM 1925 OE2 GLU A 126 0.542 -0.784 -50.277 1.00 32.43 O ATOM 0 H GLU A 126 -4.801 0.461 -48.311 1.00 43.13 H new ATOM 0 HA GLU A 126 -2.500 1.861 -47.073 1.00 63.02 H new ATOM 0 HB2 GLU A 126 -1.890 -0.518 -47.496 1.00 51.44 H new ATOM 0 HB3 GLU A 126 -2.404 -0.351 -49.164 1.00 51.44 H new ATOM 0 HG2 GLU A 126 -0.631 1.331 -49.554 1.00 43.20 H new ATOM 0 HG3 GLU A 126 -0.128 1.203 -47.880 1.00 43.20 H new ATOM 1932 N LEU A 127 -2.834 3.566 -48.839 1.00 44.31 N ATOM 1933 CA LEU A 127 -2.995 4.583 -49.872 1.00 71.21 C ATOM 1934 C LEU A 127 -1.638 4.850 -50.511 1.00 21.13 C ATOM 1935 O LEU A 127 -0.768 5.476 -49.899 1.00 72.31 O ATOM 1936 CB LEU A 127 -3.598 5.873 -49.271 1.00 2.35 C ATOM 1937 CG LEU A 127 -4.109 6.942 -50.272 1.00 62.44 C ATOM 1938 CD1 LEU A 127 -2.962 7.713 -50.920 1.00 31.13 C ATOM 1939 CD2 LEU A 127 -4.992 6.306 -51.343 1.00 41.12 C ATOM 0 H LEU A 127 -2.469 3.917 -47.954 1.00 44.31 H new ATOM 0 HA LEU A 127 -3.685 4.230 -50.638 1.00 71.21 H new ATOM 0 HB2 LEU A 127 -4.428 5.590 -48.624 1.00 2.35 H new ATOM 0 HB3 LEU A 127 -2.843 6.336 -48.636 1.00 2.35 H new ATOM 0 HG LEU A 127 -4.705 7.654 -49.702 1.00 62.44 H new ATOM 0 HD11 LEU A 127 -3.366 8.451 -51.613 1.00 31.13 H new ATOM 0 HD12 LEU A 127 -2.382 8.219 -50.148 1.00 31.13 H new ATOM 0 HD13 LEU A 127 -2.318 7.020 -51.462 1.00 31.13 H new ATOM 0 HD21 LEU A 127 -5.338 7.075 -52.033 1.00 41.12 H new ATOM 0 HD22 LEU A 127 -4.418 5.559 -51.891 1.00 41.12 H new ATOM 0 HD23 LEU A 127 -5.851 5.829 -50.871 1.00 41.12 H new ATOM 1951 N LEU A 128 -1.455 4.362 -51.735 1.00 14.43 N ATOM 1952 CA LEU A 128 -0.182 4.519 -52.430 1.00 30.41 C ATOM 1953 C LEU A 128 -0.083 5.922 -52.987 1.00 2.23 C ATOM 1954 O LEU A 128 0.938 6.595 -52.831 1.00 15.42 O ATOM 1955 CB LEU A 128 -0.023 3.492 -53.567 1.00 73.21 C ATOM 1956 CG LEU A 128 0.214 2.038 -53.127 1.00 25.15 C ATOM 1957 CD1 LEU A 128 1.449 1.937 -52.233 1.00 61.42 C ATOM 1958 CD2 LEU A 128 -1.017 1.475 -52.428 1.00 51.52 C ATOM 0 H LEU A 128 -2.167 3.858 -52.263 1.00 14.43 H new ATOM 0 HA LEU A 128 0.620 4.345 -51.713 1.00 30.41 H new ATOM 0 HB2 LEU A 128 -0.919 3.523 -54.187 1.00 73.21 H new ATOM 0 HB3 LEU A 128 0.811 3.802 -54.197 1.00 73.21 H new ATOM 0 HG LEU A 128 0.395 1.438 -54.019 1.00 25.15 H new ATOM 0 HD11 LEU A 128 1.598 0.900 -51.934 1.00 61.42 H new ATOM 0 HD12 LEU A 128 2.324 2.285 -52.781 1.00 61.42 H new ATOM 0 HD13 LEU A 128 1.307 2.554 -51.346 1.00 61.42 H new ATOM 0 HD21 LEU A 128 -0.825 0.445 -52.126 1.00 51.52 H new ATOM 0 HD22 LEU A 128 -1.242 2.076 -51.547 1.00 51.52 H new ATOM 0 HD23 LEU A 128 -1.867 1.501 -53.110 1.00 51.52 H new ATOM 1970 N ALA A 129 -1.163 6.365 -53.614 1.00 4.43 N ATOM 1971 CA ALA A 129 -1.195 7.682 -54.236 1.00 1.24 C ATOM 1972 C ALA A 129 -2.609 8.012 -54.675 1.00 55.22 C ATOM 1973 O ALA A 129 -3.545 7.280 -54.363 1.00 1.51 O ATOM 1974 CB ALA A 129 -0.233 7.736 -55.425 1.00 14.11 C ATOM 0 H ALA A 129 -2.028 5.833 -53.706 1.00 4.43 H new ATOM 0 HA ALA A 129 -0.874 8.425 -53.506 1.00 1.24 H new ATOM 0 HB1 ALA A 129 -0.270 8.727 -55.878 1.00 14.11 H new ATOM 0 HB2 ALA A 129 0.781 7.531 -55.082 1.00 14.11 H new ATOM 0 HB3 ALA A 129 -0.524 6.989 -56.163 1.00 14.11 H new ATOM 1980 N VAL A 130 -2.762 9.123 -55.373 1.00 71.35 N ATOM 1981 CA VAL A 130 -4.028 9.469 -55.994 1.00 3.33 C ATOM 1982 C VAL A 130 -3.878 9.347 -57.516 1.00 10.44 C ATOM 1983 O VAL A 130 -4.227 8.277 -58.058 1.00 70.32 O ATOM 1984 CB VAL A 130 -4.528 10.886 -55.561 1.00 20.24 C ATOM 1985 CG1 VAL A 130 -3.435 11.945 -55.699 1.00 51.34 C ATOM 1986 CG2 VAL A 130 -5.780 11.290 -56.343 1.00 32.12 C ATOM 1987 OXT VAL A 130 -3.342 10.278 -58.157 1.00 0.00 O ATOM 0 H VAL A 130 -2.019 9.806 -55.525 1.00 71.35 H new ATOM 0 HA VAL A 130 -4.796 8.774 -55.654 1.00 3.33 H new ATOM 0 HB VAL A 130 -4.789 10.825 -54.504 1.00 20.24 H new ATOM 0 HG11 VAL A 130 -3.826 12.914 -55.388 1.00 51.34 H new ATOM 0 HG12 VAL A 130 -2.587 11.676 -55.069 1.00 51.34 H new ATOM 0 HG13 VAL A 130 -3.112 12.001 -56.739 1.00 51.34 H new ATOM 0 HG21 VAL A 130 -6.106 12.279 -56.022 1.00 32.12 H new ATOM 0 HG22 VAL A 130 -5.552 11.311 -57.409 1.00 32.12 H new ATOM 0 HG23 VAL A 130 -6.575 10.568 -56.156 1.00 32.12 H new TER 1997 VAL A 130