USER MOD reduce.3.24.130724 H: found=0, std=0, add=875, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 867 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 32 ASN : amide:sc= -2.29 K(o=-2.2,f=-4.1!) USER MOD Set 1.2: A 64 THR OG1 : rot 180:sc= 0.0471 USER MOD Set 2.1: A 2 SER OG : rot -160:sc= 0.603 USER MOD Set 2.2: A 5 THR OG1 : rot 143:sc= 1.17 USER MOD Single : A 1 MET CE :methyl 177:sc= 0 (180deg=-0.0084) USER MOD Single : A 1 MET N :NH3+ -116:sc= 0.331 (180deg=-0.084) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 GLN : amide:sc= -1.03 K(o=-1,f=-8.6!) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 THR OG1 : rot 180:sc= -0.305 USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 41 GLN : amide:sc= -1.33 K(o=-1.3,f=-2!) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=-0.071) USER MOD Single : A 50 LYS NZ :NH3+ 154:sc= -0.193 (180deg=-0.743) USER MOD Single : A 53 GLN : amide:sc= -1.93 K(o=-1.9,f=-3.5!) USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 MET CE :methyl -144:sc= -0.489 (180deg=-1.89) USER MOD Single : A 74 SER OG : rot -71:sc= -2.72! USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 GLN : amide:sc= -0.265 K(o=-0.27,f=-3.1) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 HIS : no HD1:sc= -0.212 X(o=-0.21,f=-0.37) USER MOD Single : A 107 HIS : no HE2:sc= 0.132 K(o=0.13,f=-1.8) USER MOD Single : A 108 HIS : no HD1:sc= -0.357 X(o=-0.36,f=-0.81) USER MOD Single : A 109 HIS : no HD1:sc= -0.445 X(o=-0.44,f=-0.25) USER MOD Single : A 110 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 111 HIS : no HD1:sc= 0 X(o=0,f=-0.012) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.347 -0.857 -2.770 1.00 0.00 N ATOM 2 CA MET A 1 0.820 0.213 -1.931 1.00 0.00 C ATOM 3 C MET A 1 1.732 1.436 -1.973 1.00 0.00 C ATOM 4 O MET A 1 2.756 1.435 -2.656 1.00 0.00 O ATOM 5 CB MET A 1 0.663 -0.271 -0.489 1.00 0.00 C ATOM 6 CG MET A 1 1.932 -0.871 0.093 1.00 0.00 C ATOM 7 SD MET A 1 1.926 -2.674 0.062 1.00 0.00 S ATOM 8 CE MET A 1 1.937 -3.042 1.815 1.00 0.00 C ATOM 0 H1 MET A 1 0.685 -1.045 -3.549 1.00 0.00 H new ATOM 0 H2 MET A 1 2.268 -0.571 -3.160 1.00 0.00 H new ATOM 0 H3 MET A 1 1.465 -1.719 -2.200 1.00 0.00 H new ATOM 0 HA MET A 1 -0.158 0.497 -2.319 1.00 0.00 H new ATOM 0 HB2 MET A 1 0.348 0.566 0.134 1.00 0.00 H new ATOM 0 HB3 MET A 1 -0.132 -1.015 -0.449 1.00 0.00 H new ATOM 0 HG2 MET A 1 2.792 -0.505 -0.467 1.00 0.00 H new ATOM 0 HG3 MET A 1 2.052 -0.530 1.121 1.00 0.00 H new ATOM 0 HE1 MET A 1 1.881 -4.121 1.961 1.00 0.00 H new ATOM 0 HE2 MET A 1 2.857 -2.663 2.261 1.00 0.00 H new ATOM 0 HE3 MET A 1 1.080 -2.566 2.292 1.00 0.00 H new ATOM 18 N SER A 2 1.352 2.477 -1.239 1.00 0.00 N ATOM 19 CA SER A 2 2.134 3.707 -1.196 1.00 0.00 C ATOM 20 C SER A 2 1.499 4.721 -0.249 1.00 0.00 C ATOM 21 O SER A 2 0.422 5.251 -0.520 1.00 0.00 O ATOM 22 CB SER A 2 2.255 4.308 -2.598 1.00 0.00 C ATOM 23 OG SER A 2 1.294 3.751 -3.477 1.00 0.00 O ATOM 0 H SER A 2 0.508 2.493 -0.666 1.00 0.00 H new ATOM 0 HA SER A 2 3.130 3.463 -0.825 1.00 0.00 H new ATOM 0 HB2 SER A 2 2.122 5.389 -2.546 1.00 0.00 H new ATOM 0 HB3 SER A 2 3.257 4.129 -2.989 1.00 0.00 H new ATOM 0 HG SER A 2 1.577 3.894 -4.404 1.00 0.00 H new ATOM 29 N VAL A 3 2.176 4.986 0.864 1.00 0.00 N ATOM 30 CA VAL A 3 1.680 5.937 1.852 1.00 0.00 C ATOM 31 C VAL A 3 1.318 7.267 1.201 1.00 0.00 C ATOM 32 O VAL A 3 0.341 7.910 1.583 1.00 0.00 O ATOM 33 CB VAL A 3 2.719 6.186 2.961 1.00 0.00 C ATOM 34 CG1 VAL A 3 2.229 7.260 3.920 1.00 0.00 C ATOM 35 CG2 VAL A 3 3.024 4.895 3.705 1.00 0.00 C ATOM 0 H VAL A 3 3.069 4.556 1.104 1.00 0.00 H new ATOM 0 HA VAL A 3 0.786 5.498 2.294 1.00 0.00 H new ATOM 0 HB VAL A 3 3.641 6.538 2.498 1.00 0.00 H new ATOM 0 HG11 VAL A 3 2.976 7.422 4.697 1.00 0.00 H new ATOM 0 HG12 VAL A 3 2.066 8.189 3.373 1.00 0.00 H new ATOM 0 HG13 VAL A 3 1.293 6.939 4.378 1.00 0.00 H new ATOM 0 HG21 VAL A 3 3.760 5.090 4.485 1.00 0.00 H new ATOM 0 HG22 VAL A 3 2.110 4.511 4.157 1.00 0.00 H new ATOM 0 HG23 VAL A 3 3.421 4.158 3.007 1.00 0.00 H new ATOM 45 N GLU A 4 2.113 7.673 0.216 1.00 0.00 N ATOM 46 CA GLU A 4 1.876 8.928 -0.488 1.00 0.00 C ATOM 47 C GLU A 4 0.517 8.914 -1.182 1.00 0.00 C ATOM 48 O GLU A 4 -0.206 9.911 -1.177 1.00 0.00 O ATOM 49 CB GLU A 4 2.982 9.180 -1.514 1.00 0.00 C ATOM 50 CG GLU A 4 3.635 10.546 -1.382 1.00 0.00 C ATOM 51 CD GLU A 4 4.633 10.608 -0.242 1.00 0.00 C ATOM 52 OE1 GLU A 4 5.015 11.730 0.151 1.00 0.00 O ATOM 53 OE2 GLU A 4 5.032 9.535 0.257 1.00 0.00 O ATOM 0 H GLU A 4 2.926 7.152 -0.112 1.00 0.00 H new ATOM 0 HA GLU A 4 1.882 9.733 0.246 1.00 0.00 H new ATOM 0 HB2 GLU A 4 3.746 8.410 -1.409 1.00 0.00 H new ATOM 0 HB3 GLU A 4 2.566 9.081 -2.516 1.00 0.00 H new ATOM 0 HG2 GLU A 4 4.140 10.795 -2.316 1.00 0.00 H new ATOM 0 HG3 GLU A 4 2.863 11.300 -1.226 1.00 0.00 H new ATOM 60 N THR A 5 0.176 7.776 -1.779 1.00 0.00 N ATOM 61 CA THR A 5 -1.094 7.632 -2.479 1.00 0.00 C ATOM 62 C THR A 5 -2.269 7.719 -1.511 1.00 0.00 C ATOM 63 O THR A 5 -3.416 7.887 -1.926 1.00 0.00 O ATOM 64 CB THR A 5 -1.168 6.293 -3.238 1.00 0.00 C ATOM 65 OG1 THR A 5 0.071 6.043 -3.911 1.00 0.00 O ATOM 66 CG2 THR A 5 -2.306 6.306 -4.247 1.00 0.00 C ATOM 0 H THR A 5 0.762 6.941 -1.792 1.00 0.00 H new ATOM 0 HA THR A 5 -1.155 8.452 -3.195 1.00 0.00 H new ATOM 0 HB THR A 5 -1.354 5.499 -2.514 1.00 0.00 H new ATOM 0 HG1 THR A 5 0.273 5.085 -3.879 1.00 0.00 H new ATOM 0 HG21 THR A 5 -2.339 5.351 -4.771 1.00 0.00 H new ATOM 0 HG22 THR A 5 -3.251 6.468 -3.728 1.00 0.00 H new ATOM 0 HG23 THR A 5 -2.145 7.109 -4.967 1.00 0.00 H new ATOM 74 N ILE A 6 -1.975 7.605 -0.220 1.00 0.00 N ATOM 75 CA ILE A 6 -3.007 7.674 0.807 1.00 0.00 C ATOM 76 C ILE A 6 -3.317 9.120 1.180 1.00 0.00 C ATOM 77 O ILE A 6 -4.469 9.551 1.133 1.00 0.00 O ATOM 78 CB ILE A 6 -2.592 6.906 2.075 1.00 0.00 C ATOM 79 CG1 ILE A 6 -1.756 5.679 1.704 1.00 0.00 C ATOM 80 CG2 ILE A 6 -3.821 6.496 2.873 1.00 0.00 C ATOM 81 CD1 ILE A 6 -2.450 4.747 0.735 1.00 0.00 C ATOM 0 H ILE A 6 -1.031 7.464 0.139 1.00 0.00 H new ATOM 0 HA ILE A 6 -3.900 7.211 0.388 1.00 0.00 H new ATOM 0 HB ILE A 6 -1.983 7.563 2.696 1.00 0.00 H new ATOM 0 HG12 ILE A 6 -0.814 6.010 1.266 1.00 0.00 H new ATOM 0 HG13 ILE A 6 -1.510 5.129 2.612 1.00 0.00 H new ATOM 0 HG21 ILE A 6 -3.511 5.954 3.766 1.00 0.00 H new ATOM 0 HG22 ILE A 6 -4.379 7.386 3.164 1.00 0.00 H new ATOM 0 HG23 ILE A 6 -4.455 5.854 2.261 1.00 0.00 H new ATOM 0 HD11 ILE A 6 -1.800 3.900 0.516 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -3.379 4.387 1.178 1.00 0.00 H new ATOM 0 HD13 ILE A 6 -2.672 5.282 -0.188 1.00 0.00 H new ATOM 93 N ILE A 7 -2.280 9.865 1.548 1.00 0.00 N ATOM 94 CA ILE A 7 -2.440 11.263 1.926 1.00 0.00 C ATOM 95 C ILE A 7 -2.721 12.134 0.706 1.00 0.00 C ATOM 96 O ILE A 7 -3.428 13.136 0.797 1.00 0.00 O ATOM 97 CB ILE A 7 -1.190 11.798 2.648 1.00 0.00 C ATOM 98 CG1 ILE A 7 -1.012 11.095 3.995 1.00 0.00 C ATOM 99 CG2 ILE A 7 -1.293 13.304 2.840 1.00 0.00 C ATOM 100 CD1 ILE A 7 -2.048 11.490 5.024 1.00 0.00 C ATOM 0 H ILE A 7 -1.320 9.523 1.592 1.00 0.00 H new ATOM 0 HA ILE A 7 -3.290 11.310 2.607 1.00 0.00 H new ATOM 0 HB ILE A 7 -0.315 11.589 2.032 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -1.057 10.017 3.842 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -0.020 11.321 4.385 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -0.402 13.667 3.352 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -1.377 13.790 1.868 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -2.174 13.535 3.438 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -1.860 10.953 5.954 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -1.989 12.563 5.206 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -3.042 11.239 4.654 1.00 0.00 H new ATOM 112 N GLU A 8 -2.162 11.742 -0.435 1.00 0.00 N ATOM 113 CA GLU A 8 -2.353 12.487 -1.674 1.00 0.00 C ATOM 114 C GLU A 8 -3.829 12.806 -1.894 1.00 0.00 C ATOM 115 O GLU A 8 -4.184 13.923 -2.270 1.00 0.00 O ATOM 116 CB GLU A 8 -1.809 11.691 -2.862 1.00 0.00 C ATOM 117 CG GLU A 8 -0.386 12.062 -3.242 1.00 0.00 C ATOM 118 CD GLU A 8 -0.260 12.485 -4.693 1.00 0.00 C ATOM 119 OE1 GLU A 8 0.768 12.153 -5.320 1.00 0.00 O ATOM 120 OE2 GLU A 8 -1.189 13.147 -5.201 1.00 0.00 O ATOM 0 H GLU A 8 -1.574 10.914 -0.527 1.00 0.00 H new ATOM 0 HA GLU A 8 -1.804 13.425 -1.593 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -1.847 10.628 -2.624 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -2.459 11.849 -3.723 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -0.042 12.873 -2.600 1.00 0.00 H new ATOM 0 HG3 GLU A 8 0.269 11.210 -3.058 1.00 0.00 H new ATOM 127 N ARG A 9 -4.684 11.816 -1.659 1.00 0.00 N ATOM 128 CA ARG A 9 -6.121 11.990 -1.833 1.00 0.00 C ATOM 129 C ARG A 9 -6.671 13.006 -0.836 1.00 0.00 C ATOM 130 O ARG A 9 -7.603 13.750 -1.142 1.00 0.00 O ATOM 131 CB ARG A 9 -6.843 10.652 -1.664 1.00 0.00 C ATOM 132 CG ARG A 9 -6.684 9.720 -2.854 1.00 0.00 C ATOM 133 CD ARG A 9 -6.839 8.264 -2.446 1.00 0.00 C ATOM 134 NE ARG A 9 -7.108 7.399 -3.592 1.00 0.00 N ATOM 135 CZ ARG A 9 -8.250 7.412 -4.270 1.00 0.00 C ATOM 136 NH1 ARG A 9 -9.224 8.241 -3.920 1.00 0.00 N ATOM 137 NH2 ARG A 9 -8.419 6.595 -5.302 1.00 0.00 N ATOM 0 H ARG A 9 -4.406 10.885 -1.348 1.00 0.00 H new ATOM 0 HA ARG A 9 -6.296 12.365 -2.841 1.00 0.00 H new ATOM 0 HB2 ARG A 9 -6.465 10.155 -0.771 1.00 0.00 H new ATOM 0 HB3 ARG A 9 -7.904 10.840 -1.499 1.00 0.00 H new ATOM 0 HG2 ARG A 9 -7.426 9.967 -3.613 1.00 0.00 H new ATOM 0 HG3 ARG A 9 -5.704 9.870 -3.306 1.00 0.00 H new ATOM 0 HD2 ARG A 9 -5.931 7.929 -1.945 1.00 0.00 H new ATOM 0 HD3 ARG A 9 -7.652 8.174 -1.726 1.00 0.00 H new ATOM 0 HE ARG A 9 -6.379 6.750 -3.888 1.00 0.00 H new ATOM 0 HH11 ARG A 9 -9.097 8.871 -3.128 1.00 0.00 H new ATOM 0 HH12 ARG A 9 -10.100 8.249 -4.443 1.00 0.00 H new ATOM 0 HH21 ARG A 9 -7.672 5.957 -5.575 1.00 0.00 H new ATOM 0 HH22 ARG A 9 -9.296 6.605 -5.822 1.00 0.00 H new ATOM 151 N ILE A 10 -6.087 13.031 0.358 1.00 0.00 N ATOM 152 CA ILE A 10 -6.518 13.955 1.399 1.00 0.00 C ATOM 153 C ILE A 10 -6.218 15.399 1.011 1.00 0.00 C ATOM 154 O ILE A 10 -7.084 16.270 1.098 1.00 0.00 O ATOM 155 CB ILE A 10 -5.836 13.645 2.745 1.00 0.00 C ATOM 156 CG1 ILE A 10 -6.389 12.345 3.333 1.00 0.00 C ATOM 157 CG2 ILE A 10 -6.034 14.798 3.717 1.00 0.00 C ATOM 158 CD1 ILE A 10 -5.637 11.868 4.556 1.00 0.00 C ATOM 0 H ILE A 10 -5.315 12.422 0.628 1.00 0.00 H new ATOM 0 HA ILE A 10 -7.595 13.827 1.508 1.00 0.00 H new ATOM 0 HB ILE A 10 -4.767 13.519 2.574 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -7.437 12.491 3.595 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -6.356 11.567 2.570 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -5.546 14.564 4.663 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -5.598 15.705 3.299 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -7.100 14.952 3.886 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -6.083 10.942 4.919 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -4.594 11.690 4.295 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -5.691 12.628 5.336 1.00 0.00 H new ATOM 170 N LYS A 11 -4.985 15.646 0.581 1.00 0.00 N ATOM 171 CA LYS A 11 -4.570 16.984 0.176 1.00 0.00 C ATOM 172 C LYS A 11 -5.365 17.457 -1.036 1.00 0.00 C ATOM 173 O LYS A 11 -5.793 18.609 -1.099 1.00 0.00 O ATOM 174 CB LYS A 11 -3.073 17.000 -0.145 1.00 0.00 C ATOM 175 CG LYS A 11 -2.238 16.164 0.810 1.00 0.00 C ATOM 176 CD LYS A 11 -0.755 16.454 0.652 1.00 0.00 C ATOM 177 CE LYS A 11 0.010 15.220 0.199 1.00 0.00 C ATOM 178 NZ LYS A 11 0.947 15.527 -0.917 1.00 0.00 N ATOM 0 H LYS A 11 -4.256 14.937 0.504 1.00 0.00 H new ATOM 0 HA LYS A 11 -4.766 17.664 1.005 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -2.924 16.634 -1.161 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -2.716 18.029 -0.121 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -2.543 16.369 1.836 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -2.424 15.106 0.627 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -0.615 17.256 -0.073 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -0.349 16.807 1.600 1.00 0.00 H new ATOM 0 HE2 LYS A 11 0.569 14.810 1.040 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -0.695 14.452 -0.120 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 1.449 14.660 -1.197 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 0.411 15.894 -1.729 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 1.636 16.241 -0.605 1.00 0.00 H new ATOM 192 N ALA A 12 -5.561 16.560 -1.997 1.00 0.00 N ATOM 193 CA ALA A 12 -6.308 16.885 -3.206 1.00 0.00 C ATOM 194 C ALA A 12 -7.764 17.204 -2.882 1.00 0.00 C ATOM 195 O ALA A 12 -8.393 18.022 -3.552 1.00 0.00 O ATOM 196 CB ALA A 12 -6.226 15.737 -4.201 1.00 0.00 C ATOM 0 H ALA A 12 -5.213 15.602 -1.962 1.00 0.00 H new ATOM 0 HA ALA A 12 -5.860 17.772 -3.654 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -6.788 15.993 -5.099 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -5.184 15.557 -4.464 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -6.647 14.837 -3.754 1.00 0.00 H new ATOM 202 N ARG A 13 -8.292 16.553 -1.851 1.00 0.00 N ATOM 203 CA ARG A 13 -9.674 16.767 -1.439 1.00 0.00 C ATOM 204 C ARG A 13 -9.805 18.042 -0.612 1.00 0.00 C ATOM 205 O ARG A 13 -10.597 18.927 -0.937 1.00 0.00 O ATOM 206 CB ARG A 13 -10.180 15.569 -0.633 1.00 0.00 C ATOM 207 CG ARG A 13 -11.592 15.747 -0.099 1.00 0.00 C ATOM 208 CD ARG A 13 -12.585 15.995 -1.223 1.00 0.00 C ATOM 209 NE ARG A 13 -13.760 15.135 -1.115 1.00 0.00 N ATOM 210 CZ ARG A 13 -14.799 15.203 -1.940 1.00 0.00 C ATOM 211 NH1 ARG A 13 -14.809 16.087 -2.927 1.00 0.00 N ATOM 212 NH2 ARG A 13 -15.832 14.385 -1.777 1.00 0.00 N ATOM 0 H ARG A 13 -7.784 15.873 -1.286 1.00 0.00 H new ATOM 0 HA ARG A 13 -10.281 16.874 -2.338 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -10.148 14.679 -1.262 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -9.504 15.393 0.204 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -11.886 14.858 0.458 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -11.615 16.583 0.600 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -12.897 17.039 -1.207 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -12.097 15.823 -2.182 1.00 0.00 H new ATOM 0 HE ARG A 13 -13.784 14.444 -0.365 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -14.018 16.718 -3.055 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -15.608 16.137 -3.559 1.00 0.00 H new ATOM 0 HH21 ARG A 13 -15.828 13.704 -1.018 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -16.629 14.438 -2.411 1.00 0.00 H new ATOM 226 N VAL A 14 -9.022 18.129 0.459 1.00 0.00 N ATOM 227 CA VAL A 14 -9.049 19.296 1.332 1.00 0.00 C ATOM 228 C VAL A 14 -8.876 20.584 0.535 1.00 0.00 C ATOM 229 O VAL A 14 -9.593 21.561 0.750 1.00 0.00 O ATOM 230 CB VAL A 14 -7.947 19.219 2.406 1.00 0.00 C ATOM 231 CG1 VAL A 14 -8.310 18.194 3.470 1.00 0.00 C ATOM 232 CG2 VAL A 14 -6.606 18.888 1.770 1.00 0.00 C ATOM 0 H VAL A 14 -8.362 17.405 0.742 1.00 0.00 H new ATOM 0 HA VAL A 14 -10.023 19.303 1.820 1.00 0.00 H new ATOM 0 HB VAL A 14 -7.864 20.193 2.888 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -7.520 18.153 4.220 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -9.248 18.480 3.946 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -8.422 17.213 3.007 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -5.839 18.838 2.543 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -6.672 17.926 1.261 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -6.344 19.663 1.049 1.00 0.00 H new ATOM 242 N GLY A 15 -7.919 20.578 -0.388 1.00 0.00 N ATOM 243 CA GLY A 15 -7.670 21.752 -1.205 1.00 0.00 C ATOM 244 C GLY A 15 -8.788 22.020 -2.192 1.00 0.00 C ATOM 245 O GLY A 15 -8.854 23.094 -2.789 1.00 0.00 O ATOM 0 H GLY A 15 -7.312 19.782 -0.585 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -7.545 22.621 -0.559 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -6.734 21.621 -1.748 1.00 0.00 H new ATOM 249 N ALA A 16 -9.669 21.040 -2.366 1.00 0.00 N ATOM 250 CA ALA A 16 -10.790 21.176 -3.288 1.00 0.00 C ATOM 251 C ALA A 16 -12.076 21.514 -2.542 1.00 0.00 C ATOM 252 O ALA A 16 -12.942 22.218 -3.064 1.00 0.00 O ATOM 253 CB ALA A 16 -10.967 19.898 -4.095 1.00 0.00 C ATOM 0 H ALA A 16 -9.628 20.144 -1.881 1.00 0.00 H new ATOM 0 HA ALA A 16 -10.570 21.997 -3.970 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -11.807 20.013 -4.779 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -10.059 19.699 -4.665 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -11.161 19.065 -3.419 1.00 0.00 H new ATOM 259 N VAL A 17 -12.196 21.009 -1.318 1.00 0.00 N ATOM 260 CA VAL A 17 -13.377 21.259 -0.500 1.00 0.00 C ATOM 261 C VAL A 17 -13.685 22.749 -0.421 1.00 0.00 C ATOM 262 O VAL A 17 -12.786 23.586 -0.512 1.00 0.00 O ATOM 263 CB VAL A 17 -13.198 20.706 0.926 1.00 0.00 C ATOM 264 CG1 VAL A 17 -14.472 20.895 1.736 1.00 0.00 C ATOM 265 CG2 VAL A 17 -12.797 19.240 0.883 1.00 0.00 C ATOM 0 H VAL A 17 -11.490 20.424 -0.871 1.00 0.00 H new ATOM 0 HA VAL A 17 -14.210 20.744 -0.980 1.00 0.00 H new ATOM 0 HB VAL A 17 -12.399 21.263 1.415 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -14.327 20.498 2.741 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -14.711 21.957 1.796 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -15.293 20.365 1.252 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -12.675 18.866 1.900 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -13.572 18.666 0.376 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -11.856 19.136 0.343 1.00 0.00 H new ATOM 275 N ASP A 18 -14.962 23.075 -0.251 1.00 0.00 N ATOM 276 CA ASP A 18 -15.390 24.466 -0.157 1.00 0.00 C ATOM 277 C ASP A 18 -14.569 25.219 0.885 1.00 0.00 C ATOM 278 O ASP A 18 -13.993 24.631 1.800 1.00 0.00 O ATOM 279 CB ASP A 18 -16.877 24.542 0.195 1.00 0.00 C ATOM 280 CG ASP A 18 -17.707 25.136 -0.926 1.00 0.00 C ATOM 281 OD1 ASP A 18 -17.431 24.819 -2.102 1.00 0.00 O ATOM 282 OD2 ASP A 18 -18.634 25.917 -0.626 1.00 0.00 O ATOM 0 H ASP A 18 -15.718 22.395 -0.176 1.00 0.00 H new ATOM 0 HA ASP A 18 -15.230 24.935 -1.128 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -17.245 23.542 0.425 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -17.004 25.143 1.095 1.00 0.00 H new ATOM 287 N PRO A 19 -14.511 26.552 0.744 1.00 0.00 N ATOM 288 CA PRO A 19 -13.762 27.413 1.663 1.00 0.00 C ATOM 289 C PRO A 19 -14.408 27.489 3.042 1.00 0.00 C ATOM 290 O PRO A 19 -13.718 27.553 4.058 1.00 0.00 O ATOM 291 CB PRO A 19 -13.801 28.782 0.978 1.00 0.00 C ATOM 292 CG PRO A 19 -15.025 28.746 0.130 1.00 0.00 C ATOM 293 CD PRO A 19 -15.173 27.320 -0.324 1.00 0.00 C ATOM 0 HA PRO A 19 -12.754 27.039 1.842 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -13.849 29.589 1.709 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -12.907 28.949 0.377 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -15.900 29.069 0.694 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -14.929 29.419 -0.722 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -16.221 27.039 -0.431 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -14.698 27.155 -1.291 1.00 0.00 H new ATOM 301 N ASN A 20 -15.737 27.481 3.069 1.00 0.00 N ATOM 302 CA ASN A 20 -16.476 27.549 4.325 1.00 0.00 C ATOM 303 C ASN A 20 -16.281 26.275 5.141 1.00 0.00 C ATOM 304 O ASN A 20 -16.405 26.285 6.365 1.00 0.00 O ATOM 305 CB ASN A 20 -17.966 27.770 4.052 1.00 0.00 C ATOM 306 CG ASN A 20 -18.377 29.219 4.225 1.00 0.00 C ATOM 307 OD1 ASN A 20 -19.123 29.559 5.144 1.00 0.00 O ATOM 308 ND2 ASN A 20 -17.891 30.082 3.340 1.00 0.00 N ATOM 0 H ASN A 20 -16.324 27.428 2.236 1.00 0.00 H new ATOM 0 HA ASN A 20 -16.089 28.390 4.900 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -18.198 27.448 3.037 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -18.553 27.146 4.726 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -18.133 31.071 3.406 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -17.276 29.756 2.594 1.00 0.00 H new ATOM 315 N GLY A 21 -15.972 25.180 4.454 1.00 0.00 N ATOM 316 CA GLY A 21 -15.763 23.913 5.131 1.00 0.00 C ATOM 317 C GLY A 21 -16.853 23.609 6.139 1.00 0.00 C ATOM 318 O GLY A 21 -16.705 23.849 7.338 1.00 0.00 O ATOM 0 H GLY A 21 -15.863 25.147 3.440 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -15.721 23.112 4.393 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -14.798 23.930 5.638 1.00 0.00 H new ATOM 322 N PRO A 22 -17.980 23.068 5.653 1.00 0.00 N ATOM 323 CA PRO A 22 -19.122 22.719 6.503 1.00 0.00 C ATOM 324 C PRO A 22 -18.827 21.530 7.411 1.00 0.00 C ATOM 325 O PRO A 22 -19.319 20.425 7.182 1.00 0.00 O ATOM 326 CB PRO A 22 -20.219 22.364 5.496 1.00 0.00 C ATOM 327 CG PRO A 22 -19.485 21.933 4.273 1.00 0.00 C ATOM 328 CD PRO A 22 -18.226 22.754 4.235 1.00 0.00 C ATOM 0 HA PRO A 22 -19.391 23.532 7.178 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -20.861 21.568 5.874 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -20.861 23.221 5.291 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -19.255 20.868 4.311 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -20.086 22.098 3.379 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -17.397 22.198 3.797 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -18.354 23.658 3.640 1.00 0.00 H new ATOM 336 N ARG A 23 -18.022 21.764 8.443 1.00 0.00 N ATOM 337 CA ARG A 23 -17.662 20.712 9.385 1.00 0.00 C ATOM 338 C ARG A 23 -17.230 21.305 10.723 1.00 0.00 C ATOM 339 O ARG A 23 -16.300 22.109 10.787 1.00 0.00 O ATOM 340 CB ARG A 23 -16.537 19.848 8.811 1.00 0.00 C ATOM 341 CG ARG A 23 -17.008 18.856 7.760 1.00 0.00 C ATOM 342 CD ARG A 23 -16.358 17.494 7.949 1.00 0.00 C ATOM 343 NE ARG A 23 -15.591 17.086 6.775 1.00 0.00 N ATOM 344 CZ ARG A 23 -14.403 17.590 6.461 1.00 0.00 C ATOM 345 NH1 ARG A 23 -13.849 18.517 7.230 1.00 0.00 N ATOM 346 NH2 ARG A 23 -13.767 17.168 5.376 1.00 0.00 N ATOM 0 H ARG A 23 -17.607 22.673 8.647 1.00 0.00 H new ATOM 0 HA ARG A 23 -18.541 20.090 9.550 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -15.779 20.497 8.372 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -16.058 19.303 9.624 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -18.092 18.754 7.814 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -16.773 19.238 6.766 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -15.702 17.523 8.819 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -17.128 16.750 8.155 1.00 0.00 H new ATOM 0 HE ARG A 23 -15.990 16.375 6.162 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -14.335 18.845 8.065 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -12.937 18.903 6.987 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -14.190 16.455 4.781 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -12.855 17.556 5.136 1.00 0.00 H new ATOM 360 N LYS A 24 -17.912 20.902 11.790 1.00 0.00 N ATOM 361 CA LYS A 24 -17.600 21.392 13.128 1.00 0.00 C ATOM 362 C LYS A 24 -16.250 20.861 13.600 1.00 0.00 C ATOM 363 O LYS A 24 -16.179 19.845 14.292 1.00 0.00 O ATOM 364 CB LYS A 24 -18.695 20.978 14.113 1.00 0.00 C ATOM 365 CG LYS A 24 -18.840 21.924 15.293 1.00 0.00 C ATOM 366 CD LYS A 24 -18.879 21.168 16.611 1.00 0.00 C ATOM 367 CE LYS A 24 -20.154 20.351 16.747 1.00 0.00 C ATOM 368 NZ LYS A 24 -20.906 20.698 17.985 1.00 0.00 N ATOM 0 H LYS A 24 -18.685 20.237 11.754 1.00 0.00 H new ATOM 0 HA LYS A 24 -17.549 22.480 13.087 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -19.646 20.922 13.584 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -18.478 19.977 14.485 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -18.008 22.628 15.301 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -19.752 22.510 15.181 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -18.014 20.508 16.679 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -18.808 21.874 17.439 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -20.789 20.521 15.877 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -19.906 19.290 16.758 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -21.768 20.120 18.041 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -20.310 20.512 18.817 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -21.165 21.705 17.963 1.00 0.00 H new ATOM 382 N VAL A 25 -15.181 21.555 13.223 1.00 0.00 N ATOM 383 CA VAL A 25 -13.833 21.155 13.610 1.00 0.00 C ATOM 384 C VAL A 25 -12.897 22.357 13.661 1.00 0.00 C ATOM 385 O VAL A 25 -13.158 23.389 13.041 1.00 0.00 O ATOM 386 CB VAL A 25 -13.257 20.109 12.637 1.00 0.00 C ATOM 387 CG1 VAL A 25 -14.202 18.924 12.506 1.00 0.00 C ATOM 388 CG2 VAL A 25 -12.985 20.738 11.279 1.00 0.00 C ATOM 0 H VAL A 25 -15.222 22.398 12.650 1.00 0.00 H new ATOM 0 HA VAL A 25 -13.906 20.713 14.604 1.00 0.00 H new ATOM 0 HB VAL A 25 -12.311 19.746 13.039 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -13.778 18.196 11.815 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -14.341 18.460 13.482 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -15.165 19.267 12.127 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -12.578 19.985 10.604 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -13.915 21.130 10.867 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -12.267 21.550 11.391 1.00 0.00 H new ATOM 398 N LEU A 26 -11.803 22.216 14.402 1.00 0.00 N ATOM 399 CA LEU A 26 -10.825 23.291 14.533 1.00 0.00 C ATOM 400 C LEU A 26 -9.615 22.830 15.340 1.00 0.00 C ATOM 401 O LEU A 26 -9.720 22.561 16.536 1.00 0.00 O ATOM 402 CB LEU A 26 -11.464 24.510 15.201 1.00 0.00 C ATOM 403 CG LEU A 26 -12.017 24.290 16.610 1.00 0.00 C ATOM 404 CD1 LEU A 26 -11.328 25.213 17.603 1.00 0.00 C ATOM 405 CD2 LEU A 26 -13.523 24.509 16.632 1.00 0.00 C ATOM 0 H LEU A 26 -11.571 21.369 14.921 1.00 0.00 H new ATOM 0 HA LEU A 26 -10.489 23.567 13.534 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -10.721 25.307 15.244 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -12.275 24.864 14.565 1.00 0.00 H new ATOM 0 HG LEU A 26 -11.816 23.259 16.902 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -11.734 25.043 18.600 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -10.257 25.009 17.607 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -11.498 26.250 17.314 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -13.899 24.348 17.642 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -13.747 25.529 16.319 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -14.003 23.807 15.950 1.00 0.00 H new ATOM 417 N GLY A 27 -8.466 22.743 14.677 1.00 0.00 N ATOM 418 CA GLY A 27 -7.252 22.317 15.349 1.00 0.00 C ATOM 419 C GLY A 27 -6.289 21.614 14.414 1.00 0.00 C ATOM 420 O GLY A 27 -6.293 21.858 13.207 1.00 0.00 O ATOM 0 H GLY A 27 -8.354 22.960 13.687 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -6.760 23.185 15.788 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -7.510 21.648 16.170 1.00 0.00 H new ATOM 424 N VAL A 28 -5.458 20.739 14.972 1.00 0.00 N ATOM 425 CA VAL A 28 -4.483 19.998 14.180 1.00 0.00 C ATOM 426 C VAL A 28 -4.293 18.586 14.722 1.00 0.00 C ATOM 427 O VAL A 28 -4.340 18.362 15.932 1.00 0.00 O ATOM 428 CB VAL A 28 -3.119 20.714 14.155 1.00 0.00 C ATOM 429 CG1 VAL A 28 -2.245 20.160 13.041 1.00 0.00 C ATOM 430 CG2 VAL A 28 -3.309 22.215 13.998 1.00 0.00 C ATOM 0 H VAL A 28 -5.440 20.526 15.969 1.00 0.00 H new ATOM 0 HA VAL A 28 -4.876 19.944 13.165 1.00 0.00 H new ATOM 0 HB VAL A 28 -2.615 20.531 15.104 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -1.286 20.678 13.039 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -2.082 19.094 13.202 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -2.740 20.310 12.082 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -2.336 22.705 13.982 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -3.834 22.420 13.065 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -3.894 22.597 14.834 1.00 0.00 H new ATOM 440 N PHE A 29 -4.078 17.635 13.819 1.00 0.00 N ATOM 441 CA PHE A 29 -3.881 16.243 14.206 1.00 0.00 C ATOM 442 C PHE A 29 -2.528 15.730 13.721 1.00 0.00 C ATOM 443 O PHE A 29 -1.907 16.324 12.840 1.00 0.00 O ATOM 444 CB PHE A 29 -5.003 15.371 13.640 1.00 0.00 C ATOM 445 CG PHE A 29 -6.361 15.716 14.180 1.00 0.00 C ATOM 446 CD1 PHE A 29 -6.498 16.284 15.436 1.00 0.00 C ATOM 447 CD2 PHE A 29 -7.501 15.471 13.432 1.00 0.00 C ATOM 448 CE1 PHE A 29 -7.747 16.603 15.936 1.00 0.00 C ATOM 449 CE2 PHE A 29 -8.752 15.788 13.926 1.00 0.00 C ATOM 450 CZ PHE A 29 -8.875 16.354 15.180 1.00 0.00 C ATOM 0 H PHE A 29 -4.036 17.803 12.814 1.00 0.00 H new ATOM 0 HA PHE A 29 -3.901 16.188 15.294 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -5.017 15.470 12.555 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -4.787 14.326 13.862 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -5.619 16.480 16.032 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -7.411 15.027 12.452 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -7.840 17.046 16.916 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -9.633 15.593 13.332 1.00 0.00 H new ATOM 0 HZ PHE A 29 -9.852 16.601 15.568 1.00 0.00 H new ATOM 460 N GLN A 30 -2.078 14.623 14.304 1.00 0.00 N ATOM 461 CA GLN A 30 -0.799 14.031 13.933 1.00 0.00 C ATOM 462 C GLN A 30 -0.972 12.571 13.527 1.00 0.00 C ATOM 463 O GLN A 30 -1.090 11.689 14.379 1.00 0.00 O ATOM 464 CB GLN A 30 0.192 14.136 15.094 1.00 0.00 C ATOM 465 CG GLN A 30 1.615 13.761 14.714 1.00 0.00 C ATOM 466 CD GLN A 30 2.035 14.342 13.378 1.00 0.00 C ATOM 467 OE1 GLN A 30 1.704 15.482 13.052 1.00 0.00 O ATOM 468 NE2 GLN A 30 2.769 13.559 12.596 1.00 0.00 N ATOM 0 H GLN A 30 -2.580 14.119 15.035 1.00 0.00 H new ATOM 0 HA GLN A 30 -0.406 14.583 13.079 1.00 0.00 H new ATOM 0 HB2 GLN A 30 0.184 15.157 15.477 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -0.141 13.489 15.905 1.00 0.00 H new ATOM 0 HG2 GLN A 30 2.298 14.110 15.489 1.00 0.00 H new ATOM 0 HG3 GLN A 30 1.703 12.675 14.677 1.00 0.00 H new ATOM 0 HE21 GLN A 30 3.021 12.620 12.906 1.00 0.00 H new ATOM 0 HE22 GLN A 30 3.081 13.896 11.685 1.00 0.00 H new ATOM 477 N LEU A 31 -0.988 12.323 12.222 1.00 0.00 N ATOM 478 CA LEU A 31 -1.148 10.969 11.703 1.00 0.00 C ATOM 479 C LEU A 31 0.194 10.245 11.647 1.00 0.00 C ATOM 480 O LEU A 31 1.234 10.863 11.426 1.00 0.00 O ATOM 481 CB LEU A 31 -1.779 11.007 10.310 1.00 0.00 C ATOM 482 CG LEU A 31 -3.300 10.865 10.257 1.00 0.00 C ATOM 483 CD1 LEU A 31 -3.718 9.456 10.649 1.00 0.00 C ATOM 484 CD2 LEU A 31 -3.963 11.891 11.164 1.00 0.00 C ATOM 0 H LEU A 31 -0.892 13.041 11.504 1.00 0.00 H new ATOM 0 HA LEU A 31 -1.806 10.423 12.378 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -1.506 11.949 9.835 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -1.339 10.209 9.712 1.00 0.00 H new ATOM 0 HG LEU A 31 -3.628 11.048 9.234 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -4.804 9.373 10.606 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -3.272 8.739 9.960 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -3.378 9.244 11.663 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -5.046 11.775 11.114 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -3.629 11.739 12.190 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -3.690 12.895 10.839 1.00 0.00 H new ATOM 496 N ASN A 32 0.160 8.932 11.845 1.00 0.00 N ATOM 497 CA ASN A 32 1.374 8.123 11.815 1.00 0.00 C ATOM 498 C ASN A 32 1.096 6.747 11.218 1.00 0.00 C ATOM 499 O ASN A 32 0.215 6.023 11.684 1.00 0.00 O ATOM 500 CB ASN A 32 1.946 7.973 13.226 1.00 0.00 C ATOM 501 CG ASN A 32 1.553 9.121 14.135 1.00 0.00 C ATOM 502 OD1 ASN A 32 1.884 10.277 13.872 1.00 0.00 O ATOM 503 ND2 ASN A 32 0.842 8.806 15.212 1.00 0.00 N ATOM 0 H ASN A 32 -0.694 8.405 12.028 1.00 0.00 H new ATOM 0 HA ASN A 32 2.105 8.631 11.186 1.00 0.00 H new ATOM 0 HB2 ASN A 32 1.597 7.035 13.658 1.00 0.00 H new ATOM 0 HB3 ASN A 32 3.033 7.913 13.170 1.00 0.00 H new ATOM 0 HD21 ASN A 32 0.548 9.536 15.861 1.00 0.00 H new ATOM 0 HD22 ASN A 32 0.590 7.834 15.390 1.00 0.00 H new ATOM 510 N ILE A 33 1.853 6.393 10.185 1.00 0.00 N ATOM 511 CA ILE A 33 1.689 5.104 9.525 1.00 0.00 C ATOM 512 C ILE A 33 2.534 4.029 10.201 1.00 0.00 C ATOM 513 O ILE A 33 3.595 4.315 10.756 1.00 0.00 O ATOM 514 CB ILE A 33 2.073 5.181 8.035 1.00 0.00 C ATOM 515 CG1 ILE A 33 1.467 6.431 7.394 1.00 0.00 C ATOM 516 CG2 ILE A 33 1.613 3.928 7.304 1.00 0.00 C ATOM 517 CD1 ILE A 33 -0.043 6.399 7.317 1.00 0.00 C ATOM 0 H ILE A 33 2.586 6.981 9.787 1.00 0.00 H new ATOM 0 HA ILE A 33 0.635 4.840 9.607 1.00 0.00 H new ATOM 0 HB ILE A 33 3.158 5.245 7.957 1.00 0.00 H new ATOM 0 HG12 ILE A 33 1.775 7.307 7.964 1.00 0.00 H new ATOM 0 HG13 ILE A 33 1.872 6.546 6.388 1.00 0.00 H new ATOM 0 HG21 ILE A 33 1.891 3.997 6.252 1.00 0.00 H new ATOM 0 HG22 ILE A 33 2.087 3.053 7.748 1.00 0.00 H new ATOM 0 HG23 ILE A 33 0.530 3.835 7.387 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -0.403 7.317 6.852 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -0.359 5.542 6.722 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -0.457 6.315 8.322 1.00 0.00 H new ATOM 529 N LYS A 34 2.057 2.790 10.150 1.00 0.00 N ATOM 530 CA LYS A 34 2.769 1.670 10.754 1.00 0.00 C ATOM 531 C LYS A 34 3.151 0.636 9.700 1.00 0.00 C ATOM 532 O LYS A 34 2.332 -0.194 9.303 1.00 0.00 O ATOM 533 CB LYS A 34 1.907 1.016 11.837 1.00 0.00 C ATOM 534 CG LYS A 34 2.328 -0.404 12.174 1.00 0.00 C ATOM 535 CD LYS A 34 2.039 -0.740 13.627 1.00 0.00 C ATOM 536 CE LYS A 34 3.285 -1.240 14.342 1.00 0.00 C ATOM 537 NZ LYS A 34 3.048 -1.438 15.799 1.00 0.00 N ATOM 0 H LYS A 34 1.180 2.536 9.696 1.00 0.00 H new ATOM 0 HA LYS A 34 3.682 2.054 11.208 1.00 0.00 H new ATOM 0 HB2 LYS A 34 1.951 1.623 12.741 1.00 0.00 H new ATOM 0 HB3 LYS A 34 0.868 1.010 11.508 1.00 0.00 H new ATOM 0 HG2 LYS A 34 1.801 -1.104 11.526 1.00 0.00 H new ATOM 0 HG3 LYS A 34 3.393 -0.526 11.976 1.00 0.00 H new ATOM 0 HD2 LYS A 34 1.656 0.144 14.137 1.00 0.00 H new ATOM 0 HD3 LYS A 34 1.259 -1.500 13.678 1.00 0.00 H new ATOM 0 HE2 LYS A 34 3.607 -2.181 13.895 1.00 0.00 H new ATOM 0 HE3 LYS A 34 4.096 -0.526 14.200 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 3.921 -1.779 16.250 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 2.766 -0.535 16.231 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 2.292 -2.138 15.936 1.00 0.00 H new ATOM 551 N THR A 35 4.401 0.689 9.251 1.00 0.00 N ATOM 552 CA THR A 35 4.892 -0.243 8.243 1.00 0.00 C ATOM 553 C THR A 35 6.214 -0.868 8.671 1.00 0.00 C ATOM 554 O THR A 35 6.875 -0.380 9.587 1.00 0.00 O ATOM 555 CB THR A 35 5.081 0.451 6.881 1.00 0.00 C ATOM 556 OG1 THR A 35 5.613 -0.477 5.929 1.00 0.00 O ATOM 557 CG2 THR A 35 6.013 1.646 7.008 1.00 0.00 C ATOM 0 H THR A 35 5.092 1.368 9.570 1.00 0.00 H new ATOM 0 HA THR A 35 4.140 -1.025 8.142 1.00 0.00 H new ATOM 0 HB THR A 35 4.108 0.804 6.539 1.00 0.00 H new ATOM 0 HG1 THR A 35 5.729 -0.029 5.065 1.00 0.00 H new ATOM 0 HG21 THR A 35 6.131 2.120 6.034 1.00 0.00 H new ATOM 0 HG22 THR A 35 5.591 2.363 7.712 1.00 0.00 H new ATOM 0 HG23 THR A 35 6.986 1.312 7.370 1.00 0.00 H new ATOM 565 N ALA A 36 6.595 -1.951 8.001 1.00 0.00 N ATOM 566 CA ALA A 36 7.841 -2.641 8.311 1.00 0.00 C ATOM 567 C ALA A 36 9.043 -1.725 8.104 1.00 0.00 C ATOM 568 O ALA A 36 10.065 -1.865 8.774 1.00 0.00 O ATOM 569 CB ALA A 36 7.977 -3.894 7.457 1.00 0.00 C ATOM 0 H ALA A 36 6.059 -2.369 7.241 1.00 0.00 H new ATOM 0 HA ALA A 36 7.815 -2.931 9.361 1.00 0.00 H new ATOM 0 HB1 ALA A 36 8.912 -4.399 7.699 1.00 0.00 H new ATOM 0 HB2 ALA A 36 7.140 -4.563 7.657 1.00 0.00 H new ATOM 0 HB3 ALA A 36 7.976 -3.618 6.403 1.00 0.00 H new ATOM 575 N SER A 37 8.912 -0.787 7.171 1.00 0.00 N ATOM 576 CA SER A 37 9.989 0.150 6.873 1.00 0.00 C ATOM 577 C SER A 37 10.138 1.179 7.989 1.00 0.00 C ATOM 578 O SER A 37 11.160 1.856 8.091 1.00 0.00 O ATOM 579 CB SER A 37 9.724 0.857 5.542 1.00 0.00 C ATOM 580 OG SER A 37 9.306 -0.063 4.550 1.00 0.00 O ATOM 0 H SER A 37 8.071 -0.656 6.609 1.00 0.00 H new ATOM 0 HA SER A 37 10.919 -0.414 6.797 1.00 0.00 H new ATOM 0 HB2 SER A 37 8.959 1.621 5.679 1.00 0.00 H new ATOM 0 HB3 SER A 37 10.629 1.367 5.211 1.00 0.00 H new ATOM 0 HG SER A 37 9.142 0.414 3.710 1.00 0.00 H new ATOM 586 N GLY A 38 9.109 1.291 8.823 1.00 0.00 N ATOM 587 CA GLY A 38 9.144 2.240 9.921 1.00 0.00 C ATOM 588 C GLY A 38 7.787 2.855 10.199 1.00 0.00 C ATOM 589 O GLY A 38 6.798 2.142 10.372 1.00 0.00 O ATOM 0 H GLY A 38 8.252 0.742 8.758 1.00 0.00 H new ATOM 0 HA2 GLY A 38 9.503 1.738 10.820 1.00 0.00 H new ATOM 0 HA3 GLY A 38 9.858 3.031 9.691 1.00 0.00 H new ATOM 593 N VAL A 39 7.738 4.183 10.244 1.00 0.00 N ATOM 594 CA VAL A 39 6.492 4.894 10.505 1.00 0.00 C ATOM 595 C VAL A 39 6.483 6.255 9.818 1.00 0.00 C ATOM 596 O VAL A 39 7.295 7.124 10.132 1.00 0.00 O ATOM 597 CB VAL A 39 6.264 5.091 12.015 1.00 0.00 C ATOM 598 CG1 VAL A 39 5.230 6.180 12.261 1.00 0.00 C ATOM 599 CG2 VAL A 39 5.837 3.783 12.664 1.00 0.00 C ATOM 0 H VAL A 39 8.547 4.788 10.103 1.00 0.00 H new ATOM 0 HA VAL A 39 5.686 4.281 10.101 1.00 0.00 H new ATOM 0 HB VAL A 39 7.204 5.406 12.469 1.00 0.00 H new ATOM 0 HG11 VAL A 39 5.082 6.305 13.334 1.00 0.00 H new ATOM 0 HG12 VAL A 39 5.580 7.118 11.831 1.00 0.00 H new ATOM 0 HG13 VAL A 39 4.286 5.897 11.795 1.00 0.00 H new ATOM 0 HG21 VAL A 39 5.680 3.940 13.731 1.00 0.00 H new ATOM 0 HG22 VAL A 39 4.910 3.436 12.208 1.00 0.00 H new ATOM 0 HG23 VAL A 39 6.615 3.034 12.518 1.00 0.00 H new ATOM 609 N GLU A 40 5.557 6.432 8.880 1.00 0.00 N ATOM 610 CA GLU A 40 5.443 7.689 8.149 1.00 0.00 C ATOM 611 C GLU A 40 4.544 8.672 8.894 1.00 0.00 C ATOM 612 O GLU A 40 3.338 8.457 9.014 1.00 0.00 O ATOM 613 CB GLU A 40 4.889 7.439 6.745 1.00 0.00 C ATOM 614 CG GLU A 40 5.966 7.204 5.699 1.00 0.00 C ATOM 615 CD GLU A 40 5.946 8.245 4.597 1.00 0.00 C ATOM 616 OE1 GLU A 40 6.227 9.425 4.892 1.00 0.00 O ATOM 617 OE2 GLU A 40 5.649 7.879 3.440 1.00 0.00 O ATOM 0 H GLU A 40 4.876 5.722 8.609 1.00 0.00 H new ATOM 0 HA GLU A 40 6.439 8.124 8.067 1.00 0.00 H new ATOM 0 HB2 GLU A 40 4.227 6.574 6.774 1.00 0.00 H new ATOM 0 HB3 GLU A 40 4.283 8.294 6.445 1.00 0.00 H new ATOM 0 HG2 GLU A 40 6.943 7.210 6.182 1.00 0.00 H new ATOM 0 HG3 GLU A 40 5.833 6.215 5.261 1.00 0.00 H new ATOM 624 N GLN A 41 5.141 9.749 9.393 1.00 0.00 N ATOM 625 CA GLN A 41 4.395 10.764 10.128 1.00 0.00 C ATOM 626 C GLN A 41 3.797 11.795 9.176 1.00 0.00 C ATOM 627 O GLN A 41 4.441 12.213 8.214 1.00 0.00 O ATOM 628 CB GLN A 41 5.303 11.458 11.145 1.00 0.00 C ATOM 629 CG GLN A 41 6.137 10.494 11.973 1.00 0.00 C ATOM 630 CD GLN A 41 5.863 10.614 13.460 1.00 0.00 C ATOM 631 OE1 GLN A 41 6.439 11.462 14.142 1.00 0.00 O ATOM 632 NE2 GLN A 41 4.979 9.765 13.970 1.00 0.00 N ATOM 0 H GLN A 41 6.139 9.942 9.302 1.00 0.00 H new ATOM 0 HA GLN A 41 3.581 10.269 10.657 1.00 0.00 H new ATOM 0 HB2 GLN A 41 5.969 12.141 10.618 1.00 0.00 H new ATOM 0 HB3 GLN A 41 4.690 12.062 11.814 1.00 0.00 H new ATOM 0 HG2 GLN A 41 5.932 9.473 11.651 1.00 0.00 H new ATOM 0 HG3 GLN A 41 7.194 10.681 11.786 1.00 0.00 H new ATOM 0 HE21 GLN A 41 4.525 9.078 13.368 1.00 0.00 H new ATOM 0 HE22 GLN A 41 4.753 9.800 14.964 1.00 0.00 H new ATOM 641 N TRP A 42 2.562 12.200 9.451 1.00 0.00 N ATOM 642 CA TRP A 42 1.877 13.182 8.619 1.00 0.00 C ATOM 643 C TRP A 42 1.139 14.203 9.477 1.00 0.00 C ATOM 644 O TRP A 42 0.585 13.863 10.523 1.00 0.00 O ATOM 645 CB TRP A 42 0.894 12.485 7.676 1.00 0.00 C ATOM 646 CG TRP A 42 1.547 11.916 6.453 1.00 0.00 C ATOM 647 CD1 TRP A 42 1.883 10.610 6.234 1.00 0.00 C ATOM 648 CD2 TRP A 42 1.945 12.636 5.280 1.00 0.00 C ATOM 649 NE1 TRP A 42 2.465 10.475 4.997 1.00 0.00 N ATOM 650 CE2 TRP A 42 2.514 11.703 4.392 1.00 0.00 C ATOM 651 CE3 TRP A 42 1.873 13.977 4.894 1.00 0.00 C ATOM 652 CZ2 TRP A 42 3.008 12.070 3.143 1.00 0.00 C ATOM 653 CZ3 TRP A 42 2.365 14.340 3.655 1.00 0.00 C ATOM 654 CH2 TRP A 42 2.926 13.390 2.791 1.00 0.00 C ATOM 0 H TRP A 42 2.015 11.863 10.243 1.00 0.00 H new ATOM 0 HA TRP A 42 2.628 13.707 8.028 1.00 0.00 H new ATOM 0 HB2 TRP A 42 0.390 11.684 8.216 1.00 0.00 H new ATOM 0 HB3 TRP A 42 0.127 13.197 7.372 1.00 0.00 H new ATOM 0 HD1 TRP A 42 1.716 9.802 6.931 1.00 0.00 H new ATOM 0 HE1 TRP A 42 2.805 9.602 4.594 1.00 0.00 H new ATOM 0 HE3 TRP A 42 1.441 14.716 5.552 1.00 0.00 H new ATOM 0 HZ2 TRP A 42 3.440 11.339 2.476 1.00 0.00 H new ATOM 0 HZ3 TRP A 42 2.316 15.374 3.347 1.00 0.00 H new ATOM 0 HH2 TRP A 42 3.301 13.706 1.829 1.00 0.00 H new ATOM 665 N ILE A 43 1.136 15.454 9.030 1.00 0.00 N ATOM 666 CA ILE A 43 0.464 16.524 9.757 1.00 0.00 C ATOM 667 C ILE A 43 -0.749 17.034 8.988 1.00 0.00 C ATOM 668 O ILE A 43 -0.687 17.243 7.776 1.00 0.00 O ATOM 669 CB ILE A 43 1.417 17.702 10.032 1.00 0.00 C ATOM 670 CG1 ILE A 43 2.639 17.225 10.819 1.00 0.00 C ATOM 671 CG2 ILE A 43 0.691 18.805 10.788 1.00 0.00 C ATOM 672 CD1 ILE A 43 3.944 17.807 10.321 1.00 0.00 C ATOM 0 H ILE A 43 1.592 15.752 8.167 1.00 0.00 H new ATOM 0 HA ILE A 43 0.137 16.103 10.708 1.00 0.00 H new ATOM 0 HB ILE A 43 1.757 18.105 9.078 1.00 0.00 H new ATOM 0 HG12 ILE A 43 2.510 17.488 11.869 1.00 0.00 H new ATOM 0 HG13 ILE A 43 2.692 16.138 10.767 1.00 0.00 H new ATOM 0 HG21 ILE A 43 1.378 19.631 10.975 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -0.151 19.160 10.193 1.00 0.00 H new ATOM 0 HG23 ILE A 43 0.325 18.415 11.738 1.00 0.00 H new ATOM 0 HD11 ILE A 43 4.767 17.425 10.925 1.00 0.00 H new ATOM 0 HD12 ILE A 43 4.096 17.522 9.280 1.00 0.00 H new ATOM 0 HD13 ILE A 43 3.911 18.894 10.399 1.00 0.00 H new ATOM 684 N VAL A 44 -1.853 17.235 9.700 1.00 0.00 N ATOM 685 CA VAL A 44 -3.081 17.725 9.086 1.00 0.00 C ATOM 686 C VAL A 44 -3.745 18.788 9.954 1.00 0.00 C ATOM 687 O VAL A 44 -3.799 18.661 11.177 1.00 0.00 O ATOM 688 CB VAL A 44 -4.082 16.580 8.842 1.00 0.00 C ATOM 689 CG1 VAL A 44 -4.850 16.261 10.115 1.00 0.00 C ATOM 690 CG2 VAL A 44 -5.035 16.937 7.711 1.00 0.00 C ATOM 0 H VAL A 44 -1.922 17.066 10.704 1.00 0.00 H new ATOM 0 HA VAL A 44 -2.801 18.165 8.129 1.00 0.00 H new ATOM 0 HB VAL A 44 -3.524 15.690 8.550 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -5.552 15.450 9.923 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -4.151 15.959 10.895 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -5.398 17.145 10.441 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -5.735 16.117 7.552 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -5.587 17.840 7.972 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -4.467 17.111 6.797 1.00 0.00 H new ATOM 700 N ASP A 45 -4.248 19.837 9.313 1.00 0.00 N ATOM 701 CA ASP A 45 -4.910 20.924 10.026 1.00 0.00 C ATOM 702 C ASP A 45 -6.410 20.920 9.751 1.00 0.00 C ATOM 703 O ASP A 45 -6.841 20.842 8.600 1.00 0.00 O ATOM 704 CB ASP A 45 -4.308 22.270 9.621 1.00 0.00 C ATOM 705 CG ASP A 45 -4.439 23.315 10.712 1.00 0.00 C ATOM 706 OD1 ASP A 45 -3.406 23.898 11.102 1.00 0.00 O ATOM 707 OD2 ASP A 45 -5.575 23.549 11.174 1.00 0.00 O ATOM 0 H ASP A 45 -4.210 19.958 8.301 1.00 0.00 H new ATOM 0 HA ASP A 45 -4.754 20.772 11.094 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -3.254 22.135 9.376 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -4.802 22.628 8.718 1.00 0.00 H new ATOM 712 N LEU A 46 -7.202 21.004 10.815 1.00 0.00 N ATOM 713 CA LEU A 46 -8.655 21.010 10.688 1.00 0.00 C ATOM 714 C LEU A 46 -9.154 22.366 10.199 1.00 0.00 C ATOM 715 O LEU A 46 -9.825 22.459 9.171 1.00 0.00 O ATOM 716 CB LEU A 46 -9.305 20.668 12.030 1.00 0.00 C ATOM 717 CG LEU A 46 -9.166 19.218 12.493 1.00 0.00 C ATOM 718 CD1 LEU A 46 -7.702 18.864 12.707 1.00 0.00 C ATOM 719 CD2 LEU A 46 -9.963 18.986 13.768 1.00 0.00 C ATOM 0 H LEU A 46 -6.862 21.069 11.775 1.00 0.00 H new ATOM 0 HA LEU A 46 -8.934 20.255 9.953 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -8.875 21.315 12.794 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -10.366 20.909 11.969 1.00 0.00 H new ATOM 0 HG LEU A 46 -9.566 18.569 11.714 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -7.623 17.828 13.036 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -7.157 18.990 11.772 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -7.276 19.520 13.466 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -9.852 17.948 14.083 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -9.593 19.645 14.553 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -11.016 19.198 13.583 1.00 0.00 H new ATOM 731 N LYS A 47 -8.820 23.416 10.941 1.00 0.00 N ATOM 732 CA LYS A 47 -9.230 24.768 10.583 1.00 0.00 C ATOM 733 C LYS A 47 -9.084 25.002 9.083 1.00 0.00 C ATOM 734 O LYS A 47 -10.074 25.177 8.374 1.00 0.00 O ATOM 735 CB LYS A 47 -8.399 25.797 11.353 1.00 0.00 C ATOM 736 CG LYS A 47 -8.215 25.453 12.821 1.00 0.00 C ATOM 737 CD LYS A 47 -8.429 26.667 13.709 1.00 0.00 C ATOM 738 CE LYS A 47 -7.419 26.712 14.846 1.00 0.00 C ATOM 739 NZ LYS A 47 -6.839 28.073 15.018 1.00 0.00 N ATOM 0 H LYS A 47 -8.266 23.356 11.795 1.00 0.00 H new ATOM 0 HA LYS A 47 -10.280 24.884 10.851 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -7.419 25.885 10.883 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -8.879 26.772 11.274 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -8.916 24.667 13.102 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -7.212 25.057 12.980 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -8.346 27.575 13.112 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -9.439 26.646 14.119 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -7.902 26.403 15.773 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -6.619 25.998 14.650 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -6.156 28.063 15.802 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -6.357 28.358 14.142 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -7.599 28.750 15.230 1.00 0.00 H new ATOM 753 N GLN A 48 -7.843 25.000 8.606 1.00 0.00 N ATOM 754 CA GLN A 48 -7.568 25.211 7.190 1.00 0.00 C ATOM 755 C GLN A 48 -7.488 23.882 6.447 1.00 0.00 C ATOM 756 O GLN A 48 -7.541 22.813 7.058 1.00 0.00 O ATOM 757 CB GLN A 48 -6.263 25.988 7.012 1.00 0.00 C ATOM 758 CG GLN A 48 -6.234 27.310 7.763 1.00 0.00 C ATOM 759 CD GLN A 48 -4.998 28.130 7.453 1.00 0.00 C ATOM 760 OE1 GLN A 48 -3.883 27.608 7.423 1.00 0.00 O ATOM 761 NE2 GLN A 48 -5.188 29.424 7.220 1.00 0.00 N ATOM 0 H GLN A 48 -7.012 24.855 9.180 1.00 0.00 H new ATOM 0 HA GLN A 48 -8.388 25.792 6.769 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -5.432 25.369 7.351 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -6.106 26.179 5.950 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -7.122 27.888 7.508 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -6.277 27.116 8.835 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -6.129 29.816 7.255 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -4.393 30.026 7.006 1.00 0.00 H new ATOM 770 N LEU A 49 -7.361 23.955 5.127 1.00 0.00 N ATOM 771 CA LEU A 49 -7.273 22.756 4.300 1.00 0.00 C ATOM 772 C LEU A 49 -5.858 22.567 3.763 1.00 0.00 C ATOM 773 O LEU A 49 -5.612 22.711 2.565 1.00 0.00 O ATOM 774 CB LEU A 49 -8.264 22.841 3.138 1.00 0.00 C ATOM 775 CG LEU A 49 -9.743 22.721 3.506 1.00 0.00 C ATOM 776 CD1 LEU A 49 -9.983 21.483 4.356 1.00 0.00 C ATOM 777 CD2 LEU A 49 -10.214 23.970 4.237 1.00 0.00 C ATOM 0 H LEU A 49 -7.317 24.831 4.606 1.00 0.00 H new ATOM 0 HA LEU A 49 -7.523 21.897 4.922 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -8.113 23.792 2.627 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -8.023 22.054 2.423 1.00 0.00 H new ATOM 0 HG LEU A 49 -10.319 22.623 2.586 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -11.041 21.414 4.608 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -9.685 20.595 3.798 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -9.396 21.551 5.272 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -11.269 23.867 4.491 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -9.632 24.099 5.150 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -10.079 24.840 3.595 1.00 0.00 H new ATOM 789 N LYS A 50 -4.930 22.241 4.657 1.00 0.00 N ATOM 790 CA LYS A 50 -3.540 22.028 4.275 1.00 0.00 C ATOM 791 C LYS A 50 -3.027 20.695 4.809 1.00 0.00 C ATOM 792 O LYS A 50 -3.643 20.087 5.685 1.00 0.00 O ATOM 793 CB LYS A 50 -2.665 23.170 4.798 1.00 0.00 C ATOM 794 CG LYS A 50 -2.638 23.270 6.313 1.00 0.00 C ATOM 795 CD LYS A 50 -1.479 22.485 6.904 1.00 0.00 C ATOM 796 CE LYS A 50 -0.414 23.407 7.475 1.00 0.00 C ATOM 797 NZ LYS A 50 -0.962 24.300 8.534 1.00 0.00 N ATOM 0 H LYS A 50 -5.117 22.119 5.652 1.00 0.00 H new ATOM 0 HA LYS A 50 -3.488 22.007 3.186 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -1.647 23.033 4.433 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -3.027 24.112 4.386 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -2.558 24.316 6.608 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -3.577 22.895 6.720 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -1.848 21.825 7.689 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -1.038 21.851 6.135 1.00 0.00 H new ATOM 0 HE2 LYS A 50 0.399 22.810 7.888 1.00 0.00 H new ATOM 0 HE3 LYS A 50 0.010 24.012 6.674 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -0.199 24.577 9.184 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -1.369 25.150 8.095 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -1.702 23.797 9.064 1.00 0.00 H new ATOM 811 N VAL A 51 -1.895 20.245 4.277 1.00 0.00 N ATOM 812 CA VAL A 51 -1.298 18.985 4.702 1.00 0.00 C ATOM 813 C VAL A 51 0.225 19.058 4.665 1.00 0.00 C ATOM 814 O VAL A 51 0.812 19.491 3.673 1.00 0.00 O ATOM 815 CB VAL A 51 -1.766 17.815 3.817 1.00 0.00 C ATOM 816 CG1 VAL A 51 -0.963 16.559 4.121 1.00 0.00 C ATOM 817 CG2 VAL A 51 -3.255 17.565 4.009 1.00 0.00 C ATOM 0 H VAL A 51 -1.373 20.735 3.550 1.00 0.00 H new ATOM 0 HA VAL A 51 -1.626 18.810 5.727 1.00 0.00 H new ATOM 0 HB VAL A 51 -1.596 18.081 2.774 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -1.309 15.744 3.486 1.00 0.00 H new ATOM 0 HG12 VAL A 51 0.093 16.747 3.928 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -1.098 16.286 5.168 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -3.569 16.735 3.376 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -3.451 17.320 5.053 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -3.813 18.461 3.736 1.00 0.00 H new ATOM 827 N ASP A 52 0.859 18.630 5.751 1.00 0.00 N ATOM 828 CA ASP A 52 2.314 18.645 5.842 1.00 0.00 C ATOM 829 C ASP A 52 2.852 17.257 6.176 1.00 0.00 C ATOM 830 O ASP A 52 2.142 16.426 6.742 1.00 0.00 O ATOM 831 CB ASP A 52 2.769 19.649 6.902 1.00 0.00 C ATOM 832 CG ASP A 52 1.765 20.766 7.111 1.00 0.00 C ATOM 833 OD1 ASP A 52 1.966 21.859 6.540 1.00 0.00 O ATOM 834 OD2 ASP A 52 0.779 20.546 7.844 1.00 0.00 O ATOM 0 H ASP A 52 0.388 18.268 6.580 1.00 0.00 H new ATOM 0 HA ASP A 52 2.711 18.946 4.872 1.00 0.00 H new ATOM 0 HB2 ASP A 52 2.930 19.128 7.846 1.00 0.00 H new ATOM 0 HB3 ASP A 52 3.727 20.076 6.606 1.00 0.00 H new ATOM 839 N GLN A 53 4.109 17.013 5.819 1.00 0.00 N ATOM 840 CA GLN A 53 4.740 15.725 6.079 1.00 0.00 C ATOM 841 C GLN A 53 5.677 15.810 7.279 1.00 0.00 C ATOM 842 O GLN A 53 6.485 16.732 7.385 1.00 0.00 O ATOM 843 CB GLN A 53 5.513 15.254 4.846 1.00 0.00 C ATOM 844 CG GLN A 53 5.509 13.745 4.665 1.00 0.00 C ATOM 845 CD GLN A 53 5.968 13.321 3.284 1.00 0.00 C ATOM 846 OE1 GLN A 53 6.031 14.135 2.361 1.00 0.00 O ATOM 847 NE2 GLN A 53 6.292 12.042 3.133 1.00 0.00 N ATOM 0 H GLN A 53 4.710 17.690 5.349 1.00 0.00 H new ATOM 0 HA GLN A 53 3.955 15.003 6.305 1.00 0.00 H new ATOM 0 HB2 GLN A 53 5.083 15.719 3.959 1.00 0.00 H new ATOM 0 HB3 GLN A 53 6.544 15.600 4.920 1.00 0.00 H new ATOM 0 HG2 GLN A 53 6.158 13.291 5.414 1.00 0.00 H new ATOM 0 HG3 GLN A 53 4.503 13.364 4.842 1.00 0.00 H new ATOM 0 HE21 GLN A 53 6.225 11.402 3.924 1.00 0.00 H new ATOM 0 HE22 GLN A 53 6.608 11.700 2.226 1.00 0.00 H new ATOM 856 N GLY A 54 5.564 14.841 8.183 1.00 0.00 N ATOM 857 CA GLY A 54 6.406 14.826 9.364 1.00 0.00 C ATOM 858 C GLY A 54 5.605 14.901 10.649 1.00 0.00 C ATOM 859 O GLY A 54 4.439 14.510 10.685 1.00 0.00 O ATOM 0 H GLY A 54 4.904 14.066 8.118 1.00 0.00 H new ATOM 0 HA2 GLY A 54 7.007 13.916 9.367 1.00 0.00 H new ATOM 0 HA3 GLY A 54 7.100 15.666 9.322 1.00 0.00 H new ATOM 863 N VAL A 55 6.233 15.404 11.707 1.00 0.00 N ATOM 864 CA VAL A 55 5.572 15.528 13.001 1.00 0.00 C ATOM 865 C VAL A 55 5.434 16.991 13.409 1.00 0.00 C ATOM 866 O VAL A 55 6.427 17.708 13.531 1.00 0.00 O ATOM 867 CB VAL A 55 6.340 14.770 14.099 1.00 0.00 C ATOM 868 CG1 VAL A 55 7.770 15.278 14.199 1.00 0.00 C ATOM 869 CG2 VAL A 55 5.624 14.900 15.436 1.00 0.00 C ATOM 0 H VAL A 55 7.199 15.732 11.694 1.00 0.00 H new ATOM 0 HA VAL A 55 4.580 15.088 12.893 1.00 0.00 H new ATOM 0 HB VAL A 55 6.374 13.714 13.832 1.00 0.00 H new ATOM 0 HG11 VAL A 55 8.297 14.730 14.980 1.00 0.00 H new ATOM 0 HG12 VAL A 55 8.277 15.128 13.246 1.00 0.00 H new ATOM 0 HG13 VAL A 55 7.763 16.340 14.443 1.00 0.00 H new ATOM 0 HG21 VAL A 55 6.180 14.358 16.201 1.00 0.00 H new ATOM 0 HG22 VAL A 55 5.558 15.952 15.712 1.00 0.00 H new ATOM 0 HG23 VAL A 55 4.620 14.483 15.353 1.00 0.00 H new ATOM 879 N PHE A 56 4.196 17.426 13.620 1.00 0.00 N ATOM 880 CA PHE A 56 3.928 18.804 14.015 1.00 0.00 C ATOM 881 C PHE A 56 4.707 19.171 15.275 1.00 0.00 C ATOM 882 O PHE A 56 4.920 18.333 16.151 1.00 0.00 O ATOM 883 CB PHE A 56 2.430 19.007 14.250 1.00 0.00 C ATOM 884 CG PHE A 56 1.976 20.424 14.041 1.00 0.00 C ATOM 885 CD1 PHE A 56 2.331 21.116 12.895 1.00 0.00 C ATOM 886 CD2 PHE A 56 1.196 21.063 14.992 1.00 0.00 C ATOM 887 CE1 PHE A 56 1.915 22.420 12.699 1.00 0.00 C ATOM 888 CE2 PHE A 56 0.777 22.366 14.801 1.00 0.00 C ATOM 889 CZ PHE A 56 1.138 23.046 13.654 1.00 0.00 C ATOM 0 H PHE A 56 3.363 16.845 13.524 1.00 0.00 H new ATOM 0 HA PHE A 56 4.254 19.457 13.206 1.00 0.00 H new ATOM 0 HB2 PHE A 56 1.873 18.353 13.579 1.00 0.00 H new ATOM 0 HB3 PHE A 56 2.186 18.702 15.268 1.00 0.00 H new ATOM 0 HD1 PHE A 56 2.940 20.632 12.146 1.00 0.00 H new ATOM 0 HD2 PHE A 56 0.913 20.537 15.892 1.00 0.00 H new ATOM 0 HE1 PHE A 56 2.197 22.948 11.800 1.00 0.00 H new ATOM 0 HE2 PHE A 56 0.168 22.852 15.548 1.00 0.00 H new ATOM 0 HZ PHE A 56 0.813 24.065 13.504 1.00 0.00 H new ATOM 899 N ALA A 57 5.129 20.428 15.358 1.00 0.00 N ATOM 900 CA ALA A 57 5.882 20.907 16.510 1.00 0.00 C ATOM 901 C ALA A 57 5.064 20.784 17.791 1.00 0.00 C ATOM 902 O ALA A 57 5.617 20.675 18.884 1.00 0.00 O ATOM 903 CB ALA A 57 6.316 22.349 16.295 1.00 0.00 C ATOM 0 H ALA A 57 4.962 21.134 14.641 1.00 0.00 H new ATOM 0 HA ALA A 57 6.770 20.284 16.616 1.00 0.00 H new ATOM 0 HB1 ALA A 57 6.877 22.693 17.164 1.00 0.00 H new ATOM 0 HB2 ALA A 57 6.946 22.411 15.408 1.00 0.00 H new ATOM 0 HB3 ALA A 57 5.436 22.978 16.159 1.00 0.00 H new ATOM 909 N SER A 58 3.742 20.802 17.647 1.00 0.00 N ATOM 910 CA SER A 58 2.847 20.698 18.793 1.00 0.00 C ATOM 911 C SER A 58 1.412 20.444 18.341 1.00 0.00 C ATOM 912 O SER A 58 0.560 21.332 18.369 1.00 0.00 O ATOM 913 CB SER A 58 2.911 21.974 19.635 1.00 0.00 C ATOM 914 OG SER A 58 2.476 21.732 20.962 1.00 0.00 O ATOM 0 H SER A 58 3.268 20.888 16.748 1.00 0.00 H new ATOM 0 HA SER A 58 3.172 19.854 19.401 1.00 0.00 H new ATOM 0 HB2 SER A 58 3.932 22.354 19.647 1.00 0.00 H new ATOM 0 HB3 SER A 58 2.289 22.745 19.180 1.00 0.00 H new ATOM 0 HG SER A 58 2.528 22.562 21.480 1.00 0.00 H new ATOM 920 N PRO A 59 1.138 19.203 17.913 1.00 0.00 N ATOM 921 CA PRO A 59 -0.192 18.802 17.447 1.00 0.00 C ATOM 922 C PRO A 59 -1.210 18.742 18.581 1.00 0.00 C ATOM 923 O PRO A 59 -0.844 18.641 19.752 1.00 0.00 O ATOM 924 CB PRO A 59 0.042 17.407 16.863 1.00 0.00 C ATOM 925 CG PRO A 59 1.244 16.894 17.578 1.00 0.00 C ATOM 926 CD PRO A 59 2.106 18.095 17.853 1.00 0.00 C ATOM 0 HA PRO A 59 -0.605 19.514 16.732 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -0.821 16.760 17.024 1.00 0.00 H new ATOM 0 HB3 PRO A 59 0.210 17.451 15.787 1.00 0.00 H new ATOM 0 HG2 PRO A 59 0.963 16.395 18.505 1.00 0.00 H new ATOM 0 HG3 PRO A 59 1.777 16.162 16.971 1.00 0.00 H new ATOM 0 HD2 PRO A 59 2.655 17.990 18.789 1.00 0.00 H new ATOM 0 HD3 PRO A 59 2.844 18.249 17.066 1.00 0.00 H new ATOM 934 N ASP A 60 -2.489 18.804 18.225 1.00 0.00 N ATOM 935 CA ASP A 60 -3.560 18.754 19.214 1.00 0.00 C ATOM 936 C ASP A 60 -3.931 17.311 19.541 1.00 0.00 C ATOM 937 O ASP A 60 -4.381 17.011 20.647 1.00 0.00 O ATOM 938 CB ASP A 60 -4.790 19.507 18.702 1.00 0.00 C ATOM 939 CG ASP A 60 -4.443 20.876 18.152 1.00 0.00 C ATOM 940 OD1 ASP A 60 -4.854 21.884 18.765 1.00 0.00 O ATOM 941 OD2 ASP A 60 -3.760 20.941 17.109 1.00 0.00 O ATOM 0 H ASP A 60 -2.809 18.889 17.260 1.00 0.00 H new ATOM 0 HA ASP A 60 -3.203 19.233 20.126 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -5.275 18.918 17.923 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -5.509 19.616 19.514 1.00 0.00 H new ATOM 946 N VAL A 61 -3.740 16.422 18.571 1.00 0.00 N ATOM 947 CA VAL A 61 -4.055 15.010 18.756 1.00 0.00 C ATOM 948 C VAL A 61 -3.081 14.125 17.987 1.00 0.00 C ATOM 949 O VAL A 61 -2.526 14.533 16.966 1.00 0.00 O ATOM 950 CB VAL A 61 -5.491 14.691 18.300 1.00 0.00 C ATOM 951 CG1 VAL A 61 -5.888 13.287 18.730 1.00 0.00 C ATOM 952 CG2 VAL A 61 -6.466 15.721 18.851 1.00 0.00 C ATOM 0 H VAL A 61 -3.369 16.654 17.650 1.00 0.00 H new ATOM 0 HA VAL A 61 -3.966 14.803 19.822 1.00 0.00 H new ATOM 0 HB VAL A 61 -5.526 14.736 17.212 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -6.906 13.079 18.399 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -5.206 12.563 18.283 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -5.837 13.211 19.816 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -7.476 15.480 18.519 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -6.430 15.710 19.940 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -6.192 16.712 18.489 1.00 0.00 H new ATOM 962 N THR A 62 -2.877 12.909 18.484 1.00 0.00 N ATOM 963 CA THR A 62 -1.969 11.965 17.844 1.00 0.00 C ATOM 964 C THR A 62 -2.641 10.614 17.631 1.00 0.00 C ATOM 965 O THR A 62 -2.894 9.877 18.585 1.00 0.00 O ATOM 966 CB THR A 62 -0.689 11.763 18.678 1.00 0.00 C ATOM 967 OG1 THR A 62 -0.133 13.033 19.036 1.00 0.00 O ATOM 968 CG2 THR A 62 0.339 10.952 17.904 1.00 0.00 C ATOM 0 H THR A 62 -3.328 12.555 19.327 1.00 0.00 H new ATOM 0 HA THR A 62 -1.701 12.391 16.877 1.00 0.00 H new ATOM 0 HB THR A 62 -0.953 11.215 19.582 1.00 0.00 H new ATOM 0 HG1 THR A 62 0.679 12.897 19.567 1.00 0.00 H new ATOM 0 HG21 THR A 62 1.234 10.823 18.513 1.00 0.00 H new ATOM 0 HG22 THR A 62 -0.078 9.975 17.659 1.00 0.00 H new ATOM 0 HG23 THR A 62 0.599 11.476 16.984 1.00 0.00 H new ATOM 976 N VAL A 63 -2.929 10.293 16.374 1.00 0.00 N ATOM 977 CA VAL A 63 -3.571 9.028 16.035 1.00 0.00 C ATOM 978 C VAL A 63 -2.629 8.128 15.244 1.00 0.00 C ATOM 979 O VAL A 63 -1.828 8.603 14.438 1.00 0.00 O ATOM 980 CB VAL A 63 -4.857 9.253 15.217 1.00 0.00 C ATOM 981 CG1 VAL A 63 -4.525 9.453 13.746 1.00 0.00 C ATOM 982 CG2 VAL A 63 -5.816 8.087 15.402 1.00 0.00 C ATOM 0 H VAL A 63 -2.728 10.892 15.573 1.00 0.00 H new ATOM 0 HA VAL A 63 -3.828 8.541 16.976 1.00 0.00 H new ATOM 0 HB VAL A 63 -5.346 10.157 15.581 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -5.445 9.610 13.183 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -3.878 10.323 13.634 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -4.014 8.569 13.365 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -6.719 8.262 14.817 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -5.339 7.167 15.066 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -6.078 7.995 16.456 1.00 0.00 H new ATOM 992 N THR A 64 -2.729 6.823 15.479 1.00 0.00 N ATOM 993 CA THR A 64 -1.886 5.855 14.789 1.00 0.00 C ATOM 994 C THR A 64 -2.727 4.814 14.060 1.00 0.00 C ATOM 995 O THR A 64 -3.717 4.315 14.596 1.00 0.00 O ATOM 996 CB THR A 64 -0.937 5.139 15.768 1.00 0.00 C ATOM 997 OG1 THR A 64 -0.270 6.099 16.595 1.00 0.00 O ATOM 998 CG2 THR A 64 0.092 4.309 15.015 1.00 0.00 C ATOM 0 H THR A 64 -3.386 6.412 16.142 1.00 0.00 H new ATOM 0 HA THR A 64 -1.294 6.412 14.063 1.00 0.00 H new ATOM 0 HB THR A 64 -1.531 4.472 16.393 1.00 0.00 H new ATOM 0 HG1 THR A 64 0.330 5.635 17.216 1.00 0.00 H new ATOM 0 HG21 THR A 64 0.751 3.813 15.727 1.00 0.00 H new ATOM 0 HG22 THR A 64 -0.418 3.560 14.409 1.00 0.00 H new ATOM 0 HG23 THR A 64 0.681 4.959 14.368 1.00 0.00 H new ATOM 1006 N VAL A 65 -2.327 4.488 12.835 1.00 0.00 N ATOM 1007 CA VAL A 65 -3.043 3.504 12.033 1.00 0.00 C ATOM 1008 C VAL A 65 -2.101 2.784 11.076 1.00 0.00 C ATOM 1009 O VAL A 65 -1.099 3.345 10.634 1.00 0.00 O ATOM 1010 CB VAL A 65 -4.178 4.159 11.223 1.00 0.00 C ATOM 1011 CG1 VAL A 65 -3.632 5.275 10.345 1.00 0.00 C ATOM 1012 CG2 VAL A 65 -4.904 3.117 10.385 1.00 0.00 C ATOM 0 H VAL A 65 -1.510 4.892 12.376 1.00 0.00 H new ATOM 0 HA VAL A 65 -3.472 2.782 12.728 1.00 0.00 H new ATOM 0 HB VAL A 65 -4.894 4.595 11.920 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -4.448 5.726 9.780 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -3.161 6.033 10.971 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -2.895 4.867 9.654 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -5.703 3.597 9.819 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -4.201 2.650 9.695 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -5.330 2.356 11.039 1.00 0.00 H new ATOM 1022 N GLY A 66 -2.429 1.535 10.758 1.00 0.00 N ATOM 1023 CA GLY A 66 -1.601 0.757 9.854 1.00 0.00 C ATOM 1024 C GLY A 66 -1.639 1.286 8.434 1.00 0.00 C ATOM 1025 O GLY A 66 -2.617 1.911 8.022 1.00 0.00 O ATOM 0 H GLY A 66 -3.253 1.048 11.110 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -0.572 0.762 10.213 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -1.936 -0.280 9.861 1.00 0.00 H new ATOM 1029 N LEU A 67 -0.571 1.038 7.684 1.00 0.00 N ATOM 1030 CA LEU A 67 -0.485 1.495 6.301 1.00 0.00 C ATOM 1031 C LEU A 67 -1.529 0.801 5.432 1.00 0.00 C ATOM 1032 O LEU A 67 -2.071 1.398 4.502 1.00 0.00 O ATOM 1033 CB LEU A 67 0.915 1.232 5.743 1.00 0.00 C ATOM 1034 CG LEU A 67 1.209 -0.207 5.317 1.00 0.00 C ATOM 1035 CD1 LEU A 67 2.459 -0.263 4.452 1.00 0.00 C ATOM 1036 CD2 LEU A 67 1.362 -1.104 6.537 1.00 0.00 C ATOM 0 H LEU A 67 0.247 0.523 8.010 1.00 0.00 H new ATOM 0 HA LEU A 67 -0.681 2.567 6.286 1.00 0.00 H new ATOM 0 HB2 LEU A 67 1.069 1.883 4.883 1.00 0.00 H new ATOM 0 HB3 LEU A 67 1.646 1.523 6.498 1.00 0.00 H new ATOM 0 HG LEU A 67 0.367 -0.570 4.727 1.00 0.00 H new ATOM 0 HD11 LEU A 67 2.652 -1.295 4.158 1.00 0.00 H new ATOM 0 HD12 LEU A 67 2.312 0.346 3.560 1.00 0.00 H new ATOM 0 HD13 LEU A 67 3.310 0.119 5.017 1.00 0.00 H new ATOM 0 HD21 LEU A 67 1.571 -2.124 6.215 1.00 0.00 H new ATOM 0 HD22 LEU A 67 2.185 -0.743 7.153 1.00 0.00 H new ATOM 0 HD23 LEU A 67 0.440 -1.089 7.118 1.00 0.00 H new ATOM 1048 N GLU A 68 -1.807 -0.461 5.744 1.00 0.00 N ATOM 1049 CA GLU A 68 -2.788 -1.234 4.992 1.00 0.00 C ATOM 1050 C GLU A 68 -4.205 -0.746 5.282 1.00 0.00 C ATOM 1051 O GLU A 68 -5.022 -0.602 4.373 1.00 0.00 O ATOM 1052 CB GLU A 68 -2.669 -2.721 5.333 1.00 0.00 C ATOM 1053 CG GLU A 68 -1.288 -3.297 5.070 1.00 0.00 C ATOM 1054 CD GLU A 68 -1.337 -4.736 4.594 1.00 0.00 C ATOM 1055 OE1 GLU A 68 -0.661 -5.051 3.592 1.00 0.00 O ATOM 1056 OE2 GLU A 68 -2.051 -5.545 5.222 1.00 0.00 O ATOM 0 H GLU A 68 -1.367 -0.969 6.511 1.00 0.00 H new ATOM 0 HA GLU A 68 -2.585 -1.095 3.930 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -2.919 -2.865 6.384 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -3.403 -3.278 4.751 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -0.781 -2.688 4.322 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -0.695 -3.240 5.983 1.00 0.00 H new ATOM 1063 N ASP A 69 -4.487 -0.494 6.555 1.00 0.00 N ATOM 1064 CA ASP A 69 -5.804 -0.022 6.967 1.00 0.00 C ATOM 1065 C ASP A 69 -6.219 1.205 6.160 1.00 0.00 C ATOM 1066 O ASP A 69 -7.261 1.206 5.506 1.00 0.00 O ATOM 1067 CB ASP A 69 -5.807 0.311 8.460 1.00 0.00 C ATOM 1068 CG ASP A 69 -6.691 -0.626 9.260 1.00 0.00 C ATOM 1069 OD1 ASP A 69 -7.857 -0.263 9.521 1.00 0.00 O ATOM 1070 OD2 ASP A 69 -6.216 -1.721 9.626 1.00 0.00 O ATOM 0 H ASP A 69 -3.822 -0.609 7.320 1.00 0.00 H new ATOM 0 HA ASP A 69 -6.523 -0.820 6.779 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -4.788 0.260 8.843 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -6.149 1.336 8.600 1.00 0.00 H new ATOM 1075 N MET A 70 -5.396 2.247 6.212 1.00 0.00 N ATOM 1076 CA MET A 70 -5.678 3.479 5.485 1.00 0.00 C ATOM 1077 C MET A 70 -5.810 3.210 3.989 1.00 0.00 C ATOM 1078 O MET A 70 -6.535 3.913 3.284 1.00 0.00 O ATOM 1079 CB MET A 70 -4.572 4.507 5.734 1.00 0.00 C ATOM 1080 CG MET A 70 -4.582 5.081 7.142 1.00 0.00 C ATOM 1081 SD MET A 70 -5.840 6.354 7.364 1.00 0.00 S ATOM 1082 CE MET A 70 -4.832 7.736 7.896 1.00 0.00 C ATOM 0 H MET A 70 -4.529 2.263 6.749 1.00 0.00 H new ATOM 0 HA MET A 70 -6.625 3.878 5.849 1.00 0.00 H new ATOM 0 HB2 MET A 70 -3.605 4.040 5.547 1.00 0.00 H new ATOM 0 HB3 MET A 70 -4.676 5.322 5.017 1.00 0.00 H new ATOM 0 HG2 MET A 70 -4.755 4.277 7.857 1.00 0.00 H new ATOM 0 HG3 MET A 70 -3.602 5.502 7.366 1.00 0.00 H new ATOM 0 HE1 MET A 70 -5.378 8.321 8.636 1.00 0.00 H new ATOM 0 HE2 MET A 70 -3.908 7.363 8.338 1.00 0.00 H new ATOM 0 HE3 MET A 70 -4.596 8.366 7.038 1.00 0.00 H new ATOM 1092 N LEU A 71 -5.107 2.190 3.512 1.00 0.00 N ATOM 1093 CA LEU A 71 -5.146 1.828 2.099 1.00 0.00 C ATOM 1094 C LEU A 71 -6.576 1.552 1.647 1.00 0.00 C ATOM 1095 O LEU A 71 -7.048 2.122 0.663 1.00 0.00 O ATOM 1096 CB LEU A 71 -4.272 0.599 1.842 1.00 0.00 C ATOM 1097 CG LEU A 71 -3.740 0.440 0.418 1.00 0.00 C ATOM 1098 CD1 LEU A 71 -4.885 0.225 -0.559 1.00 0.00 C ATOM 1099 CD2 LEU A 71 -2.916 1.655 0.017 1.00 0.00 C ATOM 0 H LEU A 71 -4.503 1.598 4.082 1.00 0.00 H new ATOM 0 HA LEU A 71 -4.758 2.669 1.524 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -3.422 0.633 2.524 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -4.848 -0.291 2.095 1.00 0.00 H new ATOM 0 HG LEU A 71 -3.094 -0.438 0.388 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -4.487 0.114 -1.568 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -5.433 -0.676 -0.284 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -5.557 1.083 -0.527 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -2.546 1.524 -1.000 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -3.539 2.548 0.064 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -2.073 1.764 0.699 1.00 0.00 H new ATOM 1111 N ALA A 72 -7.262 0.676 2.374 1.00 0.00 N ATOM 1112 CA ALA A 72 -8.640 0.328 2.050 1.00 0.00 C ATOM 1113 C ALA A 72 -9.539 1.560 2.078 1.00 0.00 C ATOM 1114 O ALA A 72 -10.530 1.633 1.351 1.00 0.00 O ATOM 1115 CB ALA A 72 -9.159 -0.727 3.016 1.00 0.00 C ATOM 0 H ALA A 72 -6.886 0.195 3.191 1.00 0.00 H new ATOM 0 HA ALA A 72 -8.657 -0.080 1.039 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -10.189 -0.977 2.762 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -8.540 -1.621 2.945 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -9.120 -0.339 4.034 1.00 0.00 H new ATOM 1121 N ILE A 73 -9.186 2.525 2.920 1.00 0.00 N ATOM 1122 CA ILE A 73 -9.961 3.754 3.041 1.00 0.00 C ATOM 1123 C ILE A 73 -9.703 4.685 1.861 1.00 0.00 C ATOM 1124 O ILE A 73 -10.616 5.008 1.102 1.00 0.00 O ATOM 1125 CB ILE A 73 -9.634 4.499 4.349 1.00 0.00 C ATOM 1126 CG1 ILE A 73 -9.603 3.520 5.525 1.00 0.00 C ATOM 1127 CG2 ILE A 73 -10.651 5.602 4.598 1.00 0.00 C ATOM 1128 CD1 ILE A 73 -9.175 4.156 6.829 1.00 0.00 C ATOM 0 H ILE A 73 -8.369 2.480 3.528 1.00 0.00 H new ATOM 0 HA ILE A 73 -11.012 3.465 3.050 1.00 0.00 H new ATOM 0 HB ILE A 73 -8.648 4.955 4.254 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -10.594 3.084 5.651 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -8.923 2.702 5.288 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -10.407 6.119 5.526 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -10.629 6.311 3.770 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -11.647 5.167 4.677 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -9.176 3.404 7.618 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -8.171 4.567 6.721 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -9.869 4.955 7.089 1.00 0.00 H new ATOM 1140 N SER A 74 -8.453 5.111 1.713 1.00 0.00 N ATOM 1141 CA SER A 74 -8.075 6.007 0.626 1.00 0.00 C ATOM 1142 C SER A 74 -8.443 5.406 -0.726 1.00 0.00 C ATOM 1143 O SER A 74 -8.690 6.127 -1.692 1.00 0.00 O ATOM 1144 CB SER A 74 -6.573 6.298 0.676 1.00 0.00 C ATOM 1145 OG SER A 74 -5.848 5.162 1.116 1.00 0.00 O ATOM 0 H SER A 74 -7.685 4.850 2.332 1.00 0.00 H new ATOM 0 HA SER A 74 -8.623 6.941 0.750 1.00 0.00 H new ATOM 0 HB2 SER A 74 -6.224 6.596 -0.313 1.00 0.00 H new ATOM 0 HB3 SER A 74 -6.384 7.136 1.347 1.00 0.00 H new ATOM 0 HG SER A 74 -6.019 5.014 2.070 1.00 0.00 H new ATOM 1151 N GLY A 75 -8.479 4.078 -0.787 1.00 0.00 N ATOM 1152 CA GLY A 75 -8.818 3.401 -2.025 1.00 0.00 C ATOM 1153 C GLY A 75 -10.314 3.323 -2.252 1.00 0.00 C ATOM 1154 O GLY A 75 -10.773 2.718 -3.222 1.00 0.00 O ATOM 0 H GLY A 75 -8.279 3.459 -0.001 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -8.354 3.925 -2.861 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -8.403 2.393 -2.010 1.00 0.00 H new ATOM 1158 N LYS A 76 -11.080 3.935 -1.355 1.00 0.00 N ATOM 1159 CA LYS A 76 -12.534 3.933 -1.461 1.00 0.00 C ATOM 1160 C LYS A 76 -13.086 2.515 -1.345 1.00 0.00 C ATOM 1161 O LYS A 76 -13.793 2.038 -2.234 1.00 0.00 O ATOM 1162 CB LYS A 76 -12.970 4.555 -2.789 1.00 0.00 C ATOM 1163 CG LYS A 76 -14.315 5.257 -2.719 1.00 0.00 C ATOM 1164 CD LYS A 76 -15.057 5.175 -4.043 1.00 0.00 C ATOM 1165 CE LYS A 76 -14.894 6.452 -4.853 1.00 0.00 C ATOM 1166 NZ LYS A 76 -16.081 7.342 -4.730 1.00 0.00 N ATOM 0 H LYS A 76 -10.717 4.439 -0.546 1.00 0.00 H new ATOM 0 HA LYS A 76 -12.934 4.528 -0.640 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -12.213 5.270 -3.112 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -13.016 3.774 -3.548 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -14.921 4.807 -1.933 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -14.167 6.302 -2.448 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -14.684 4.328 -4.618 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -16.116 4.993 -3.857 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -14.004 6.984 -4.516 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -14.737 6.199 -5.902 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -15.931 8.201 -5.296 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -16.926 6.843 -5.075 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -16.217 7.604 -3.733 1.00 0.00 H new ATOM 1180 N THR A 77 -12.761 1.846 -0.244 1.00 0.00 N ATOM 1181 CA THR A 77 -13.224 0.484 -0.012 1.00 0.00 C ATOM 1182 C THR A 77 -13.806 0.331 1.388 1.00 0.00 C ATOM 1183 O THR A 77 -14.981 0.000 1.550 1.00 0.00 O ATOM 1184 CB THR A 77 -12.084 -0.536 -0.196 1.00 0.00 C ATOM 1185 OG1 THR A 77 -11.417 -0.306 -1.442 1.00 0.00 O ATOM 1186 CG2 THR A 77 -12.619 -1.959 -0.156 1.00 0.00 C ATOM 0 H THR A 77 -12.178 2.226 0.502 1.00 0.00 H new ATOM 0 HA THR A 77 -14.002 0.286 -0.749 1.00 0.00 H new ATOM 0 HB THR A 77 -11.376 -0.408 0.623 1.00 0.00 H new ATOM 0 HG1 THR A 77 -10.693 -0.957 -1.550 1.00 0.00 H new ATOM 0 HG21 THR A 77 -11.796 -2.661 -0.288 1.00 0.00 H new ATOM 0 HG22 THR A 77 -13.100 -2.140 0.805 1.00 0.00 H new ATOM 0 HG23 THR A 77 -13.346 -2.097 -0.957 1.00 0.00 H new ATOM 1194 N LEU A 78 -12.978 0.576 2.398 1.00 0.00 N ATOM 1195 CA LEU A 78 -13.411 0.466 3.787 1.00 0.00 C ATOM 1196 C LEU A 78 -13.909 1.810 4.309 1.00 0.00 C ATOM 1197 O LEU A 78 -13.736 2.844 3.662 1.00 0.00 O ATOM 1198 CB LEU A 78 -12.263 -0.040 4.661 1.00 0.00 C ATOM 1199 CG LEU A 78 -12.349 -1.502 5.101 1.00 0.00 C ATOM 1200 CD1 LEU A 78 -11.029 -1.956 5.705 1.00 0.00 C ATOM 1201 CD2 LEU A 78 -13.487 -1.695 6.092 1.00 0.00 C ATOM 0 H LEU A 78 -12.003 0.852 2.281 1.00 0.00 H new ATOM 0 HA LEU A 78 -14.234 -0.248 3.831 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -11.329 0.100 4.117 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -12.209 0.584 5.553 1.00 0.00 H new ATOM 0 HG LEU A 78 -12.552 -2.115 4.223 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -11.109 -2.999 6.012 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -10.236 -1.856 4.964 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -10.794 -1.339 6.572 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -13.533 -2.741 6.394 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -13.315 -1.071 6.969 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -14.429 -1.411 5.624 1.00 0.00 H new ATOM 1213 N THR A 79 -14.527 1.790 5.486 1.00 0.00 N ATOM 1214 CA THR A 79 -15.049 3.006 6.097 1.00 0.00 C ATOM 1215 C THR A 79 -14.446 3.230 7.479 1.00 0.00 C ATOM 1216 O THR A 79 -14.033 2.283 8.148 1.00 0.00 O ATOM 1217 CB THR A 79 -16.583 2.958 6.220 1.00 0.00 C ATOM 1218 OG1 THR A 79 -16.966 1.987 7.200 1.00 0.00 O ATOM 1219 CG2 THR A 79 -17.224 2.617 4.883 1.00 0.00 C ATOM 0 H THR A 79 -14.678 0.944 6.035 1.00 0.00 H new ATOM 0 HA THR A 79 -14.770 3.833 5.444 1.00 0.00 H new ATOM 0 HB THR A 79 -16.931 3.943 6.530 1.00 0.00 H new ATOM 0 HG1 THR A 79 -17.943 1.964 7.273 1.00 0.00 H new ATOM 0 HG21 THR A 79 -18.308 2.589 4.996 1.00 0.00 H new ATOM 0 HG22 THR A 79 -16.955 3.375 4.147 1.00 0.00 H new ATOM 0 HG23 THR A 79 -16.869 1.643 4.547 1.00 0.00 H new ATOM 1227 N VAL A 80 -14.398 4.489 7.901 1.00 0.00 N ATOM 1228 CA VAL A 80 -13.847 4.838 9.205 1.00 0.00 C ATOM 1229 C VAL A 80 -14.484 4.005 10.312 1.00 0.00 C ATOM 1230 O VAL A 80 -13.803 3.538 11.223 1.00 0.00 O ATOM 1231 CB VAL A 80 -14.051 6.332 9.520 1.00 0.00 C ATOM 1232 CG1 VAL A 80 -13.154 7.190 8.642 1.00 0.00 C ATOM 1233 CG2 VAL A 80 -15.512 6.718 9.343 1.00 0.00 C ATOM 0 H VAL A 80 -14.734 5.285 7.359 1.00 0.00 H new ATOM 0 HA VAL A 80 -12.779 4.626 9.163 1.00 0.00 H new ATOM 0 HB VAL A 80 -13.776 6.508 10.560 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -13.312 8.242 8.879 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -12.111 6.930 8.823 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -13.395 7.014 7.594 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -15.639 7.777 9.570 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -15.816 6.528 8.314 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -16.129 6.126 10.019 1.00 0.00 H new ATOM 1243 N GLY A 81 -15.799 3.821 10.225 1.00 0.00 N ATOM 1244 CA GLY A 81 -16.507 3.044 11.225 1.00 0.00 C ATOM 1245 C GLY A 81 -15.990 1.623 11.328 1.00 0.00 C ATOM 1246 O GLY A 81 -15.866 1.078 12.425 1.00 0.00 O ATOM 0 H GLY A 81 -16.386 4.196 9.480 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -16.412 3.533 12.195 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -17.569 3.024 10.980 1.00 0.00 H new ATOM 1250 N ASP A 82 -15.689 1.020 10.183 1.00 0.00 N ATOM 1251 CA ASP A 82 -15.183 -0.347 10.149 1.00 0.00 C ATOM 1252 C ASP A 82 -13.842 -0.449 10.869 1.00 0.00 C ATOM 1253 O ASP A 82 -13.673 -1.265 11.774 1.00 0.00 O ATOM 1254 CB ASP A 82 -15.036 -0.823 8.703 1.00 0.00 C ATOM 1255 CG ASP A 82 -15.943 -1.996 8.384 1.00 0.00 C ATOM 1256 OD1 ASP A 82 -15.423 -3.052 7.966 1.00 0.00 O ATOM 1257 OD2 ASP A 82 -17.172 -1.858 8.554 1.00 0.00 O ATOM 0 H ASP A 82 -15.787 1.456 9.266 1.00 0.00 H new ATOM 0 HA ASP A 82 -15.901 -0.986 10.663 1.00 0.00 H new ATOM 0 HB2 ASP A 82 -15.262 0.002 8.027 1.00 0.00 H new ATOM 0 HB3 ASP A 82 -14.000 -1.109 8.521 1.00 0.00 H new ATOM 1262 N ALA A 83 -12.892 0.386 10.461 1.00 0.00 N ATOM 1263 CA ALA A 83 -11.567 0.391 11.068 1.00 0.00 C ATOM 1264 C ALA A 83 -11.650 0.664 12.565 1.00 0.00 C ATOM 1265 O ALA A 83 -10.856 0.140 13.348 1.00 0.00 O ATOM 1266 CB ALA A 83 -10.679 1.424 10.389 1.00 0.00 C ATOM 0 H ALA A 83 -13.016 1.068 9.712 1.00 0.00 H new ATOM 0 HA ALA A 83 -11.127 -0.597 10.930 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -9.692 1.417 10.853 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -10.584 1.183 9.330 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -11.123 2.413 10.497 1.00 0.00 H new ATOM 1272 N LEU A 84 -12.614 1.488 12.959 1.00 0.00 N ATOM 1273 CA LEU A 84 -12.801 1.832 14.364 1.00 0.00 C ATOM 1274 C LEU A 84 -13.301 0.629 15.157 1.00 0.00 C ATOM 1275 O LEU A 84 -12.760 0.299 16.213 1.00 0.00 O ATOM 1276 CB LEU A 84 -13.788 2.993 14.499 1.00 0.00 C ATOM 1277 CG LEU A 84 -13.517 3.977 15.638 1.00 0.00 C ATOM 1278 CD1 LEU A 84 -12.144 4.612 15.478 1.00 0.00 C ATOM 1279 CD2 LEU A 84 -14.599 5.045 15.689 1.00 0.00 C ATOM 0 H LEU A 84 -13.279 1.931 12.325 1.00 0.00 H new ATOM 0 HA LEU A 84 -11.836 2.136 14.770 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -13.796 3.548 13.561 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -14.788 2.580 14.633 1.00 0.00 H new ATOM 0 HG LEU A 84 -13.533 3.428 16.579 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -11.968 5.309 16.297 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -11.380 3.835 15.492 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -12.099 5.147 14.530 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -14.390 5.736 16.505 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -14.616 5.592 14.746 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -15.568 4.574 15.852 1.00 0.00 H new ATOM 1291 N LYS A 85 -14.337 -0.024 14.641 1.00 0.00 N ATOM 1292 CA LYS A 85 -14.909 -1.194 15.298 1.00 0.00 C ATOM 1293 C LYS A 85 -13.859 -2.286 15.476 1.00 0.00 C ATOM 1294 O LYS A 85 -13.809 -2.947 16.513 1.00 0.00 O ATOM 1295 CB LYS A 85 -16.089 -1.734 14.486 1.00 0.00 C ATOM 1296 CG LYS A 85 -16.576 -3.094 14.953 1.00 0.00 C ATOM 1297 CD LYS A 85 -16.122 -4.201 14.016 1.00 0.00 C ATOM 1298 CE LYS A 85 -17.111 -4.408 12.879 1.00 0.00 C ATOM 1299 NZ LYS A 85 -16.561 -3.946 11.575 1.00 0.00 N ATOM 0 H LYS A 85 -14.798 0.237 13.769 1.00 0.00 H new ATOM 0 HA LYS A 85 -15.262 -0.890 16.283 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -16.913 -1.023 14.542 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -15.797 -1.802 13.438 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -16.202 -3.290 15.958 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -17.664 -3.091 15.013 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -15.142 -3.954 13.607 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -16.009 -5.130 14.576 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -17.369 -5.465 12.810 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -18.033 -3.868 13.096 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -17.265 -4.104 10.826 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -16.338 -2.932 11.632 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -15.696 -4.479 11.355 1.00 0.00 H new ATOM 1313 N GLN A 86 -13.021 -2.467 14.460 1.00 0.00 N ATOM 1314 CA GLN A 86 -11.972 -3.478 14.507 1.00 0.00 C ATOM 1315 C GLN A 86 -10.902 -3.106 15.527 1.00 0.00 C ATOM 1316 O GLN A 86 -10.409 -3.958 16.264 1.00 0.00 O ATOM 1317 CB GLN A 86 -11.339 -3.650 13.125 1.00 0.00 C ATOM 1318 CG GLN A 86 -12.303 -4.179 12.076 1.00 0.00 C ATOM 1319 CD GLN A 86 -11.621 -4.479 10.755 1.00 0.00 C ATOM 1320 OE1 GLN A 86 -10.411 -4.700 10.705 1.00 0.00 O ATOM 1321 NE2 GLN A 86 -12.396 -4.488 9.677 1.00 0.00 N ATOM 0 H GLN A 86 -13.048 -1.927 13.595 1.00 0.00 H new ATOM 0 HA GLN A 86 -12.425 -4.421 14.812 1.00 0.00 H new ATOM 0 HB2 GLN A 86 -10.945 -2.689 12.793 1.00 0.00 H new ATOM 0 HB3 GLN A 86 -10.492 -4.332 13.205 1.00 0.00 H new ATOM 0 HG2 GLN A 86 -12.778 -5.086 12.449 1.00 0.00 H new ATOM 0 HG3 GLN A 86 -13.095 -3.448 11.914 1.00 0.00 H new ATOM 0 HE21 GLN A 86 -13.395 -4.299 9.765 1.00 0.00 H new ATOM 0 HE22 GLN A 86 -11.993 -4.684 8.761 1.00 0.00 H new ATOM 1330 N GLY A 87 -10.546 -1.825 15.564 1.00 0.00 N ATOM 1331 CA GLY A 87 -9.536 -1.362 16.497 1.00 0.00 C ATOM 1332 C GLY A 87 -8.180 -1.183 15.843 1.00 0.00 C ATOM 1333 O GLY A 87 -7.145 -1.311 16.496 1.00 0.00 O ATOM 0 H GLY A 87 -10.939 -1.100 14.964 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -9.854 -0.414 16.931 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -9.449 -2.075 17.317 1.00 0.00 H new ATOM 1337 N LYS A 88 -8.185 -0.888 14.547 1.00 0.00 N ATOM 1338 CA LYS A 88 -6.947 -0.692 13.802 1.00 0.00 C ATOM 1339 C LYS A 88 -6.344 0.677 14.101 1.00 0.00 C ATOM 1340 O LYS A 88 -5.123 0.836 14.120 1.00 0.00 O ATOM 1341 CB LYS A 88 -7.204 -0.832 12.300 1.00 0.00 C ATOM 1342 CG LYS A 88 -8.069 -2.027 11.940 1.00 0.00 C ATOM 1343 CD LYS A 88 -7.507 -3.316 12.515 1.00 0.00 C ATOM 1344 CE LYS A 88 -7.497 -4.431 11.481 1.00 0.00 C ATOM 1345 NZ LYS A 88 -6.113 -4.791 11.066 1.00 0.00 N ATOM 0 H LYS A 88 -9.033 -0.779 13.991 1.00 0.00 H new ATOM 0 HA LYS A 88 -6.238 -1.458 14.115 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -7.684 0.076 11.936 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -6.248 -0.917 11.783 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -9.081 -1.871 12.315 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -8.140 -2.112 10.856 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -6.493 -3.143 12.875 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -8.102 -3.622 13.375 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -7.993 -5.311 11.891 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -8.069 -4.120 10.607 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -6.150 -5.554 10.361 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -5.647 -3.959 10.652 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -5.574 -5.112 11.896 1.00 0.00 H new ATOM 1359 N ILE A 89 -7.206 1.660 14.334 1.00 0.00 N ATOM 1360 CA ILE A 89 -6.758 3.014 14.634 1.00 0.00 C ATOM 1361 C ILE A 89 -6.624 3.229 16.138 1.00 0.00 C ATOM 1362 O ILE A 89 -7.582 3.046 16.887 1.00 0.00 O ATOM 1363 CB ILE A 89 -7.724 4.067 14.060 1.00 0.00 C ATOM 1364 CG1 ILE A 89 -8.320 3.578 12.738 1.00 0.00 C ATOM 1365 CG2 ILE A 89 -7.005 5.394 13.864 1.00 0.00 C ATOM 1366 CD1 ILE A 89 -9.238 4.584 12.081 1.00 0.00 C ATOM 0 H ILE A 89 -8.219 1.544 14.321 1.00 0.00 H new ATOM 0 HA ILE A 89 -5.782 3.134 14.164 1.00 0.00 H new ATOM 0 HB ILE A 89 -8.537 4.217 14.770 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -7.509 3.335 12.051 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -8.873 2.656 12.917 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -7.701 6.128 13.458 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -6.624 5.747 14.823 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -6.174 5.259 13.171 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -9.624 4.170 11.149 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -10.069 4.809 12.750 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -8.684 5.499 11.870 1.00 0.00 H new ATOM 1378 N GLU A 90 -5.429 3.620 16.570 1.00 0.00 N ATOM 1379 CA GLU A 90 -5.172 3.860 17.985 1.00 0.00 C ATOM 1380 C GLU A 90 -5.419 5.323 18.342 1.00 0.00 C ATOM 1381 O GLU A 90 -5.231 6.216 17.515 1.00 0.00 O ATOM 1382 CB GLU A 90 -3.733 3.474 18.337 1.00 0.00 C ATOM 1383 CG GLU A 90 -3.574 2.015 18.733 1.00 0.00 C ATOM 1384 CD GLU A 90 -2.578 1.279 17.858 1.00 0.00 C ATOM 1385 OE1 GLU A 90 -2.548 1.548 16.639 1.00 0.00 O ATOM 1386 OE2 GLU A 90 -1.830 0.434 18.392 1.00 0.00 O ATOM 0 H GLU A 90 -4.625 3.777 15.962 1.00 0.00 H new ATOM 0 HA GLU A 90 -5.859 3.242 18.563 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -3.090 3.682 17.481 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -3.387 4.104 19.156 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -3.251 1.958 19.772 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -4.542 1.518 18.672 1.00 0.00 H new ATOM 1393 N LEU A 91 -5.841 5.561 19.579 1.00 0.00 N ATOM 1394 CA LEU A 91 -6.115 6.915 20.047 1.00 0.00 C ATOM 1395 C LEU A 91 -5.086 7.351 21.085 1.00 0.00 C ATOM 1396 O LEU A 91 -4.548 6.526 21.824 1.00 0.00 O ATOM 1397 CB LEU A 91 -7.522 6.995 20.642 1.00 0.00 C ATOM 1398 CG LEU A 91 -8.618 7.509 19.707 1.00 0.00 C ATOM 1399 CD1 LEU A 91 -9.994 7.174 20.262 1.00 0.00 C ATOM 1400 CD2 LEU A 91 -8.477 9.009 19.495 1.00 0.00 C ATOM 0 H LEU A 91 -6.001 4.834 20.276 1.00 0.00 H new ATOM 0 HA LEU A 91 -6.050 7.589 19.193 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -7.805 6.001 20.989 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -7.488 7.641 21.519 1.00 0.00 H new ATOM 0 HG LEU A 91 -8.508 7.014 18.742 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -10.761 7.548 19.583 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -10.093 6.093 20.362 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -10.116 7.641 21.239 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -9.265 9.358 18.827 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -8.560 9.521 20.453 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -7.505 9.224 19.052 1.00 0.00 H new ATOM 1412 N SER A 92 -4.820 8.652 21.137 1.00 0.00 N ATOM 1413 CA SER A 92 -3.855 9.198 22.084 1.00 0.00 C ATOM 1414 C SER A 92 -3.862 10.723 22.049 1.00 0.00 C ATOM 1415 O SER A 92 -3.929 11.330 20.982 1.00 0.00 O ATOM 1416 CB SER A 92 -2.451 8.676 21.771 1.00 0.00 C ATOM 1417 OG SER A 92 -1.533 9.039 22.788 1.00 0.00 O ATOM 0 H SER A 92 -5.259 9.348 20.534 1.00 0.00 H new ATOM 0 HA SER A 92 -4.141 8.874 23.084 1.00 0.00 H new ATOM 0 HB2 SER A 92 -2.477 7.591 21.671 1.00 0.00 H new ATOM 0 HB3 SER A 92 -2.116 9.076 20.814 1.00 0.00 H new ATOM 0 HG SER A 92 -0.644 8.692 22.565 1.00 0.00 H new ATOM 1423 N GLY A 93 -3.793 11.336 23.227 1.00 0.00 N ATOM 1424 CA GLY A 93 -3.793 12.785 23.310 1.00 0.00 C ATOM 1425 C GLY A 93 -5.144 13.342 23.711 1.00 0.00 C ATOM 1426 O GLY A 93 -5.536 13.261 24.876 1.00 0.00 O ATOM 0 H GLY A 93 -3.737 10.855 24.125 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -3.042 13.105 24.033 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -3.504 13.201 22.345 1.00 0.00 H new ATOM 1430 N ASP A 94 -5.858 13.911 22.746 1.00 0.00 N ATOM 1431 CA ASP A 94 -7.173 14.485 23.004 1.00 0.00 C ATOM 1432 C ASP A 94 -8.255 13.733 22.234 1.00 0.00 C ATOM 1433 O ASP A 94 -8.741 14.205 21.207 1.00 0.00 O ATOM 1434 CB ASP A 94 -7.192 15.965 22.620 1.00 0.00 C ATOM 1435 CG ASP A 94 -6.908 16.873 23.800 1.00 0.00 C ATOM 1436 OD1 ASP A 94 -5.784 16.809 24.341 1.00 0.00 O ATOM 1437 OD2 ASP A 94 -7.809 17.649 24.181 1.00 0.00 O ATOM 0 H ASP A 94 -5.548 13.987 21.777 1.00 0.00 H new ATOM 0 HA ASP A 94 -7.379 14.392 24.070 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -6.451 16.145 21.841 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -8.166 16.216 22.199 1.00 0.00 H new ATOM 1442 N ALA A 95 -8.626 12.560 22.738 1.00 0.00 N ATOM 1443 CA ALA A 95 -9.650 11.744 22.099 1.00 0.00 C ATOM 1444 C ALA A 95 -10.849 12.591 21.686 1.00 0.00 C ATOM 1445 O ALA A 95 -11.438 12.375 20.627 1.00 0.00 O ATOM 1446 CB ALA A 95 -10.089 10.623 23.030 1.00 0.00 C ATOM 0 H ALA A 95 -8.232 12.154 23.587 1.00 0.00 H new ATOM 0 HA ALA A 95 -9.220 11.306 21.198 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -10.854 10.021 22.540 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -9.232 9.994 23.271 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -10.495 11.050 23.947 1.00 0.00 H new ATOM 1452 N ASP A 96 -11.205 13.555 22.528 1.00 0.00 N ATOM 1453 CA ASP A 96 -12.334 14.435 22.251 1.00 0.00 C ATOM 1454 C ASP A 96 -12.151 15.148 20.914 1.00 0.00 C ATOM 1455 O ASP A 96 -13.056 15.165 20.079 1.00 0.00 O ATOM 1456 CB ASP A 96 -12.495 15.462 23.373 1.00 0.00 C ATOM 1457 CG ASP A 96 -13.948 15.700 23.734 1.00 0.00 C ATOM 1458 OD1 ASP A 96 -14.745 16.005 22.822 1.00 0.00 O ATOM 1459 OD2 ASP A 96 -14.289 15.580 24.929 1.00 0.00 O ATOM 0 H ASP A 96 -10.727 13.747 23.409 1.00 0.00 H new ATOM 0 HA ASP A 96 -13.235 13.824 22.197 1.00 0.00 H new ATOM 0 HB2 ASP A 96 -11.955 15.119 24.256 1.00 0.00 H new ATOM 0 HB3 ASP A 96 -12.040 16.404 23.067 1.00 0.00 H new ATOM 1464 N LEU A 97 -10.976 15.736 20.719 1.00 0.00 N ATOM 1465 CA LEU A 97 -10.674 16.452 19.485 1.00 0.00 C ATOM 1466 C LEU A 97 -10.807 15.532 18.275 1.00 0.00 C ATOM 1467 O LEU A 97 -11.595 15.795 17.367 1.00 0.00 O ATOM 1468 CB LEU A 97 -9.261 17.035 19.542 1.00 0.00 C ATOM 1469 CG LEU A 97 -9.166 18.539 19.800 1.00 0.00 C ATOM 1470 CD1 LEU A 97 -8.493 18.811 21.136 1.00 0.00 C ATOM 1471 CD2 LEU A 97 -8.411 19.227 18.671 1.00 0.00 C ATOM 0 H LEU A 97 -10.217 15.731 21.400 1.00 0.00 H new ATOM 0 HA LEU A 97 -11.392 17.265 19.382 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -8.707 16.517 20.324 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -8.761 16.816 18.599 1.00 0.00 H new ATOM 0 HG LEU A 97 -10.177 18.946 19.836 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -8.435 19.887 21.302 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -9.074 18.352 21.936 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -7.488 18.390 21.129 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -8.353 20.297 18.871 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -7.404 18.815 18.603 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -8.935 19.062 17.729 1.00 0.00 H new ATOM 1483 N ALA A 98 -10.034 14.451 18.272 1.00 0.00 N ATOM 1484 CA ALA A 98 -10.069 13.490 17.177 1.00 0.00 C ATOM 1485 C ALA A 98 -11.476 12.938 16.976 1.00 0.00 C ATOM 1486 O ALA A 98 -11.854 12.563 15.866 1.00 0.00 O ATOM 1487 CB ALA A 98 -9.087 12.357 17.437 1.00 0.00 C ATOM 0 H ALA A 98 -9.376 14.219 19.016 1.00 0.00 H new ATOM 0 HA ALA A 98 -9.776 14.007 16.263 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -9.124 11.647 16.611 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -8.079 12.762 17.523 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -9.354 11.850 18.364 1.00 0.00 H new ATOM 1493 N ALA A 99 -12.248 12.889 18.057 1.00 0.00 N ATOM 1494 CA ALA A 99 -13.614 12.384 17.999 1.00 0.00 C ATOM 1495 C ALA A 99 -14.408 13.074 16.895 1.00 0.00 C ATOM 1496 O ALA A 99 -15.262 12.462 16.254 1.00 0.00 O ATOM 1497 CB ALA A 99 -14.303 12.569 19.343 1.00 0.00 C ATOM 0 H ALA A 99 -11.950 13.193 18.984 1.00 0.00 H new ATOM 0 HA ALA A 99 -13.572 11.319 17.769 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -15.322 12.187 19.285 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -13.755 12.024 20.111 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -14.326 13.629 19.597 1.00 0.00 H new ATOM 1503 N LYS A 100 -14.122 14.354 16.679 1.00 0.00 N ATOM 1504 CA LYS A 100 -14.809 15.128 15.652 1.00 0.00 C ATOM 1505 C LYS A 100 -14.750 14.418 14.303 1.00 0.00 C ATOM 1506 O LYS A 100 -15.647 14.566 13.473 1.00 0.00 O ATOM 1507 CB LYS A 100 -14.186 16.522 15.534 1.00 0.00 C ATOM 1508 CG LYS A 100 -14.869 17.568 16.398 1.00 0.00 C ATOM 1509 CD LYS A 100 -14.522 17.390 17.867 1.00 0.00 C ATOM 1510 CE LYS A 100 -15.769 17.176 18.712 1.00 0.00 C ATOM 1511 NZ LYS A 100 -15.655 17.833 20.044 1.00 0.00 N ATOM 0 H LYS A 100 -13.419 14.877 17.202 1.00 0.00 H new ATOM 0 HA LYS A 100 -15.854 15.226 15.945 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -13.133 16.465 15.811 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -14.225 16.841 14.493 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -14.570 18.564 16.070 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -15.949 17.501 16.267 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -13.852 16.538 17.983 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -13.985 18.269 18.224 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -16.637 17.571 18.185 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -15.937 16.108 18.847 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -16.524 17.664 20.590 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -14.842 17.438 20.558 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -15.520 18.856 19.916 1.00 0.00 H new ATOM 1525 N LEU A 101 -13.689 13.646 14.092 1.00 0.00 N ATOM 1526 CA LEU A 101 -13.514 12.911 12.845 1.00 0.00 C ATOM 1527 C LEU A 101 -14.417 11.682 12.806 1.00 0.00 C ATOM 1528 O LEU A 101 -15.206 11.508 11.878 1.00 0.00 O ATOM 1529 CB LEU A 101 -12.053 12.491 12.678 1.00 0.00 C ATOM 1530 CG LEU A 101 -11.080 13.595 12.263 1.00 0.00 C ATOM 1531 CD1 LEU A 101 -9.642 13.122 12.410 1.00 0.00 C ATOM 1532 CD2 LEU A 101 -11.354 14.038 10.833 1.00 0.00 C ATOM 0 H LEU A 101 -12.937 13.513 14.769 1.00 0.00 H new ATOM 0 HA LEU A 101 -13.792 13.569 12.022 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -11.708 12.066 13.621 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -12.007 11.696 11.934 1.00 0.00 H new ATOM 0 HG LEU A 101 -11.229 14.450 12.922 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -8.964 13.921 12.110 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -9.451 12.855 13.449 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -9.479 12.251 11.776 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -10.652 14.824 10.555 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -11.234 13.189 10.160 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -12.373 14.418 10.759 1.00 0.00 H new ATOM 1544 N ALA A 102 -14.295 10.833 13.821 1.00 0.00 N ATOM 1545 CA ALA A 102 -15.103 9.622 13.905 1.00 0.00 C ATOM 1546 C ALA A 102 -16.584 9.937 13.729 1.00 0.00 C ATOM 1547 O ALA A 102 -17.348 9.112 13.229 1.00 0.00 O ATOM 1548 CB ALA A 102 -14.864 8.920 15.233 1.00 0.00 C ATOM 0 H ALA A 102 -13.645 10.961 14.596 1.00 0.00 H new ATOM 0 HA ALA A 102 -14.802 8.957 13.096 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -15.473 8.018 15.282 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -13.811 8.652 15.318 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -15.136 9.587 16.051 1.00 0.00 H new ATOM 1554 N GLU A 103 -16.983 11.135 14.145 1.00 0.00 N ATOM 1555 CA GLU A 103 -18.375 11.557 14.034 1.00 0.00 C ATOM 1556 C GLU A 103 -18.885 11.381 12.607 1.00 0.00 C ATOM 1557 O GLU A 103 -20.072 11.141 12.385 1.00 0.00 O ATOM 1558 CB GLU A 103 -18.523 13.018 14.464 1.00 0.00 C ATOM 1559 CG GLU A 103 -18.462 13.219 15.969 1.00 0.00 C ATOM 1560 CD GLU A 103 -19.834 13.397 16.590 1.00 0.00 C ATOM 1561 OE1 GLU A 103 -20.180 14.543 16.946 1.00 0.00 O ATOM 1562 OE2 GLU A 103 -20.561 12.390 16.722 1.00 0.00 O ATOM 0 H GLU A 103 -16.363 11.830 14.561 1.00 0.00 H new ATOM 0 HA GLU A 103 -18.973 10.929 14.694 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -17.735 13.607 13.995 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -19.473 13.403 14.093 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -17.969 12.361 16.427 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -17.851 14.094 16.190 1.00 0.00 H new ATOM 1569 N VAL A 104 -17.979 11.503 11.642 1.00 0.00 N ATOM 1570 CA VAL A 104 -18.336 11.357 10.236 1.00 0.00 C ATOM 1571 C VAL A 104 -18.973 9.998 9.969 1.00 0.00 C ATOM 1572 O VAL A 104 -19.709 9.826 8.996 1.00 0.00 O ATOM 1573 CB VAL A 104 -17.106 11.523 9.324 1.00 0.00 C ATOM 1574 CG1 VAL A 104 -16.186 10.317 9.443 1.00 0.00 C ATOM 1575 CG2 VAL A 104 -17.537 11.734 7.881 1.00 0.00 C ATOM 0 H VAL A 104 -16.993 11.703 11.808 1.00 0.00 H new ATOM 0 HA VAL A 104 -19.056 12.143 10.009 1.00 0.00 H new ATOM 0 HB VAL A 104 -16.553 12.405 9.647 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -15.323 10.452 8.792 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -15.850 10.216 10.475 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -16.726 9.417 9.148 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -16.655 11.849 7.251 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -18.114 10.873 7.544 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -18.152 12.631 7.812 1.00 0.00 H new ATOM 1585 N ILE A 105 -18.686 9.035 10.838 1.00 0.00 N ATOM 1586 CA ILE A 105 -19.233 7.691 10.697 1.00 0.00 C ATOM 1587 C ILE A 105 -20.747 7.729 10.525 1.00 0.00 C ATOM 1588 O ILE A 105 -21.331 6.863 9.873 1.00 0.00 O ATOM 1589 CB ILE A 105 -18.887 6.812 11.914 1.00 0.00 C ATOM 1590 CG1 ILE A 105 -19.244 5.351 11.632 1.00 0.00 C ATOM 1591 CG2 ILE A 105 -19.615 7.312 13.152 1.00 0.00 C ATOM 1592 CD1 ILE A 105 -18.933 4.421 12.784 1.00 0.00 C ATOM 0 H ILE A 105 -18.078 9.160 11.647 1.00 0.00 H new ATOM 0 HA ILE A 105 -18.780 7.258 9.806 1.00 0.00 H new ATOM 0 HB ILE A 105 -17.814 6.875 12.097 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -20.306 5.284 11.397 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -18.701 5.016 10.748 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -19.360 6.681 14.003 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -19.316 8.339 13.360 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -20.691 7.275 12.981 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -19.211 3.402 12.515 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -17.866 4.459 13.005 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -19.497 4.731 13.664 1.00 0.00 H new ATOM 1604 N HIS A 106 -21.379 8.740 11.114 1.00 0.00 N ATOM 1605 CA HIS A 106 -22.827 8.892 11.024 1.00 0.00 C ATOM 1606 C HIS A 106 -23.250 9.232 9.598 1.00 0.00 C ATOM 1607 O HIS A 106 -23.307 10.402 9.218 1.00 0.00 O ATOM 1608 CB HIS A 106 -23.307 9.982 11.983 1.00 0.00 C ATOM 1609 CG HIS A 106 -24.694 9.755 12.502 1.00 0.00 C ATOM 1610 ND1 HIS A 106 -25.166 8.513 12.869 1.00 0.00 N ATOM 1611 CD2 HIS A 106 -25.712 10.621 12.715 1.00 0.00 C ATOM 1612 CE1 HIS A 106 -26.415 8.624 13.284 1.00 0.00 C ATOM 1613 NE2 HIS A 106 -26.770 9.894 13.201 1.00 0.00 N ATOM 0 H HIS A 106 -20.912 9.465 11.658 1.00 0.00 H new ATOM 0 HA HIS A 106 -23.285 7.943 11.304 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -22.618 10.042 12.825 1.00 0.00 H new ATOM 0 HB3 HIS A 106 -23.272 10.945 11.473 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -25.695 11.686 12.536 1.00 0.00 H new ATOM 0 HE1 HIS A 106 -27.040 7.815 13.632 1.00 0.00 H new ATOM 0 HE2 HIS A 106 -27.682 10.273 13.457 1.00 0.00 H new ATOM 1621 N HIS A 107 -23.545 8.201 8.812 1.00 0.00 N ATOM 1622 CA HIS A 107 -23.963 8.390 7.427 1.00 0.00 C ATOM 1623 C HIS A 107 -24.529 7.097 6.849 1.00 0.00 C ATOM 1624 O HIS A 107 -24.458 6.040 7.477 1.00 0.00 O ATOM 1625 CB HIS A 107 -22.786 8.870 6.578 1.00 0.00 C ATOM 1626 CG HIS A 107 -21.764 7.807 6.315 1.00 0.00 C ATOM 1627 ND1 HIS A 107 -20.637 7.637 7.092 1.00 0.00 N ATOM 1628 CD2 HIS A 107 -21.705 6.853 5.356 1.00 0.00 C ATOM 1629 CE1 HIS A 107 -19.928 6.627 6.621 1.00 0.00 C ATOM 1630 NE2 HIS A 107 -20.555 6.134 5.568 1.00 0.00 N ATOM 0 H HIS A 107 -23.502 7.227 9.110 1.00 0.00 H new ATOM 0 HA HIS A 107 -24.746 9.148 7.410 1.00 0.00 H new ATOM 0 HB2 HIS A 107 -23.164 9.243 5.626 1.00 0.00 H new ATOM 0 HB3 HIS A 107 -22.305 9.709 7.080 1.00 0.00 H new ATOM 0 HD1 HIS A 107 -20.390 8.203 7.904 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -22.428 6.688 4.571 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -18.995 6.266 7.027 1.00 0.00 H new ATOM 1638 N HIS A 108 -25.093 7.188 5.648 1.00 0.00 N ATOM 1639 CA HIS A 108 -25.672 6.025 4.985 1.00 0.00 C ATOM 1640 C HIS A 108 -24.839 5.620 3.773 1.00 0.00 C ATOM 1641 O HIS A 108 -24.841 6.304 2.749 1.00 0.00 O ATOM 1642 CB HIS A 108 -27.109 6.319 4.556 1.00 0.00 C ATOM 1643 CG HIS A 108 -27.263 7.619 3.827 1.00 0.00 C ATOM 1644 ND1 HIS A 108 -27.387 8.832 4.471 1.00 0.00 N ATOM 1645 CD2 HIS A 108 -27.310 7.891 2.502 1.00 0.00 C ATOM 1646 CE1 HIS A 108 -27.505 9.794 3.573 1.00 0.00 C ATOM 1647 NE2 HIS A 108 -27.462 9.249 2.371 1.00 0.00 N ATOM 0 H HIS A 108 -25.161 8.055 5.115 1.00 0.00 H new ATOM 0 HA HIS A 108 -25.675 5.197 5.694 1.00 0.00 H new ATOM 0 HB2 HIS A 108 -27.461 5.510 3.917 1.00 0.00 H new ATOM 0 HB3 HIS A 108 -27.748 6.329 5.439 1.00 0.00 H new ATOM 0 HD2 HIS A 108 -27.241 7.173 1.698 1.00 0.00 H new ATOM 0 HE1 HIS A 108 -27.617 10.847 3.786 1.00 0.00 H new ATOM 0 HE2 HIS A 108 -27.531 9.755 1.488 1.00 0.00 H new ATOM 1655 N HIS A 109 -24.126 4.505 3.896 1.00 0.00 N ATOM 1656 CA HIS A 109 -23.288 4.010 2.810 1.00 0.00 C ATOM 1657 C HIS A 109 -24.029 2.961 1.986 1.00 0.00 C ATOM 1658 O HIS A 109 -24.608 2.022 2.533 1.00 0.00 O ATOM 1659 CB HIS A 109 -21.993 3.416 3.366 1.00 0.00 C ATOM 1660 CG HIS A 109 -22.217 2.363 4.407 1.00 0.00 C ATOM 1661 ND1 HIS A 109 -22.178 2.622 5.761 1.00 0.00 N ATOM 1662 CD2 HIS A 109 -22.484 1.041 4.286 1.00 0.00 C ATOM 1663 CE1 HIS A 109 -22.410 1.506 6.428 1.00 0.00 C ATOM 1664 NE2 HIS A 109 -22.600 0.531 5.556 1.00 0.00 N ATOM 0 H HIS A 109 -24.112 3.927 4.737 1.00 0.00 H new ATOM 0 HA HIS A 109 -23.044 4.851 2.161 1.00 0.00 H new ATOM 0 HB2 HIS A 109 -21.417 2.988 2.545 1.00 0.00 H new ATOM 0 HB3 HIS A 109 -21.390 4.217 3.794 1.00 0.00 H new ATOM 0 HD2 HIS A 109 -22.587 0.490 3.363 1.00 0.00 H new ATOM 0 HE1 HIS A 109 -22.439 1.407 7.503 1.00 0.00 H new ATOM 0 HE2 HIS A 109 -22.800 -0.442 5.788 1.00 0.00 H new ATOM 1672 N HIS A 110 -24.009 3.129 0.667 1.00 0.00 N ATOM 1673 CA HIS A 110 -24.680 2.197 -0.232 1.00 0.00 C ATOM 1674 C HIS A 110 -26.196 2.305 -0.095 1.00 0.00 C ATOM 1675 O HIS A 110 -26.867 2.882 -0.951 1.00 0.00 O ATOM 1676 CB HIS A 110 -24.232 0.764 0.057 1.00 0.00 C ATOM 1677 CG HIS A 110 -23.468 0.137 -1.068 1.00 0.00 C ATOM 1678 ND1 HIS A 110 -22.093 0.177 -1.159 1.00 0.00 N ATOM 1679 CD2 HIS A 110 -23.895 -0.551 -2.153 1.00 0.00 C ATOM 1680 CE1 HIS A 110 -21.707 -0.456 -2.252 1.00 0.00 C ATOM 1681 NE2 HIS A 110 -22.782 -0.908 -2.873 1.00 0.00 N ATOM 0 H HIS A 110 -23.536 3.901 0.198 1.00 0.00 H new ATOM 0 HA HIS A 110 -24.405 2.457 -1.254 1.00 0.00 H new ATOM 0 HB2 HIS A 110 -23.612 0.760 0.953 1.00 0.00 H new ATOM 0 HB3 HIS A 110 -25.109 0.154 0.274 1.00 0.00 H new ATOM 0 HD2 HIS A 110 -24.921 -0.777 -2.405 1.00 0.00 H new ATOM 0 HE1 HIS A 110 -20.686 -0.583 -2.582 1.00 0.00 H new ATOM 0 HE2 HIS A 110 -22.785 -1.436 -3.746 1.00 0.00 H new ATOM 1689 N HIS A 111 -26.729 1.746 0.987 1.00 0.00 N ATOM 1690 CA HIS A 111 -28.166 1.780 1.236 1.00 0.00 C ATOM 1691 C HIS A 111 -28.465 2.367 2.612 1.00 0.00 C ATOM 1692 O HIS A 111 -27.614 2.352 3.502 1.00 0.00 O ATOM 1693 CB HIS A 111 -28.757 0.374 1.129 1.00 0.00 C ATOM 1694 CG HIS A 111 -28.660 -0.213 -0.246 1.00 0.00 C ATOM 1695 ND1 HIS A 111 -27.874 -1.306 -0.544 1.00 0.00 N ATOM 1696 CD2 HIS A 111 -29.258 0.146 -1.406 1.00 0.00 C ATOM 1697 CE1 HIS A 111 -27.992 -1.593 -1.828 1.00 0.00 C ATOM 1698 NE2 HIS A 111 -28.826 -0.727 -2.374 1.00 0.00 N ATOM 0 H HIS A 111 -26.188 1.264 1.705 1.00 0.00 H new ATOM 0 HA HIS A 111 -28.626 2.417 0.481 1.00 0.00 H new ATOM 0 HB2 HIS A 111 -28.243 -0.282 1.832 1.00 0.00 H new ATOM 0 HB3 HIS A 111 -29.804 0.405 1.429 1.00 0.00 H new ATOM 0 HD2 HIS A 111 -29.947 0.966 -1.544 1.00 0.00 H new ATOM 0 HE1 HIS A 111 -27.491 -2.399 -2.344 1.00 0.00 H new ATOM 0 HE2 HIS A 111 -29.104 -0.709 -3.355 1.00 0.00 H new TER 1706 HIS A 111