USER MOD reduce.3.24.130724 H: found=0, std=0, add=796, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 792 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 24 LYS NZ :NH3+ -150:sc= -0.242 (180deg=-1.24!) USER MOD Set 1.2: A 60 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 23 THR OG1 : rot -120:sc= -0.215 USER MOD Set 2.2: A 27 CYS SG : rot 172:sc= -3.98! USER MOD Set 2.3: A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 GLY N :NH3+ -126:sc= 0.134 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= -0.132 USER MOD Single : A 5 SER OG : rot 61:sc= 0.00716 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 ASN : amide:sc= -0.722 K(o=-0.72,f=-3!) USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 13 ASN : amide:sc= -0.409 K(o=-0.41,f=-3.1!) USER MOD Single : A 20 THR OG1 : rot 180:sc= 0.00914 USER MOD Single : A 30 CYS SG : rot 180:sc= -1.3 USER MOD Single : A 38 GLN : amide:sc= -0.767 K(o=-0.77,f=-0.089) USER MOD Single : A 40 TYR OH : rot 71:sc= -2.18 USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 GLN : amide:sc= -0.0835 X(o=-0.084,f=0) USER MOD Single : A 52 THR OG1 : rot 180:sc= 0.0678 USER MOD Single : A 56 ASN : amide:sc= -0.339 K(o=-0.34,f=-1.3) USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 LYS NZ :NH3+ -119:sc= -1.24! (180deg=-5.8!) USER MOD Single : A 71 HIS : no HE2:sc= -9.6! C(o=-9.6!,f=-11!) USER MOD Single : A 73 ASN : amide:sc= -3.99! K(o=-4!,f=-0.7) USER MOD Single : A 75 GLN : amide:sc= -0.521 K(o=-0.52,f=-3.4!) USER MOD Single : A 78 MET CE :methyl 168:sc= -0.256 (180deg=-0.522) USER MOD Single : A 79 MET CE :methyl 178:sc= 0 (180deg=-0.00608) USER MOD Single : A 80 HIS : no HD1:sc= -13.5! C(o=-14!,f=-15!) USER MOD Single : A 83 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 84 THR OG1 : rot 180:sc= 0.00295 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 86 LYS NZ :NH3+ 173:sc= 0.615 (180deg=0.576) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 GLN : amide:sc= -1.59 K(o=-1.6,f=-0.69) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 43.486 18.553 12.176 1.00 0.00 N ATOM 2 CA GLY A 1 42.979 19.726 11.483 1.00 0.00 C ATOM 3 C GLY A 1 41.979 20.488 12.354 1.00 0.00 C ATOM 4 O GLY A 1 41.766 20.136 13.513 1.00 0.00 O ATOM 0 H1 GLY A 1 44.526 18.578 12.185 1.00 0.00 H new ATOM 0 H2 GLY A 1 43.131 18.547 13.154 1.00 0.00 H new ATOM 0 H3 GLY A 1 43.164 17.694 11.686 1.00 0.00 H new ATOM 0 HA2 GLY A 1 43.808 20.382 11.216 1.00 0.00 H new ATOM 0 HA3 GLY A 1 42.499 19.424 10.552 1.00 0.00 H new ATOM 8 N SER A 2 41.393 21.519 11.763 1.00 0.00 N ATOM 9 CA SER A 2 40.421 22.334 12.471 1.00 0.00 C ATOM 10 C SER A 2 39.418 22.931 11.481 1.00 0.00 C ATOM 11 O SER A 2 39.749 23.160 10.319 1.00 0.00 O ATOM 12 CB SER A 2 41.109 23.447 13.265 1.00 0.00 C ATOM 13 OG SER A 2 41.964 24.237 12.444 1.00 0.00 O ATOM 0 H SER A 2 41.573 21.808 10.802 1.00 0.00 H new ATOM 0 HA SER A 2 39.890 21.696 13.177 1.00 0.00 H new ATOM 0 HB2 SER A 2 40.354 24.086 13.723 1.00 0.00 H new ATOM 0 HB3 SER A 2 41.689 23.008 14.076 1.00 0.00 H new ATOM 0 HG SER A 2 42.383 24.937 12.987 1.00 0.00 H new ATOM 19 N SER A 3 38.213 23.165 11.978 1.00 0.00 N ATOM 20 CA SER A 3 37.160 23.731 11.152 1.00 0.00 C ATOM 21 C SER A 3 36.050 24.302 12.037 1.00 0.00 C ATOM 22 O SER A 3 35.774 25.500 11.998 1.00 0.00 O ATOM 23 CB SER A 3 36.588 22.683 10.195 1.00 0.00 C ATOM 24 OG SER A 3 36.093 21.540 10.887 1.00 0.00 O ATOM 0 H SER A 3 37.942 22.973 12.942 1.00 0.00 H new ATOM 0 HA SER A 3 37.589 24.535 10.554 1.00 0.00 H new ATOM 0 HB2 SER A 3 35.784 23.128 9.609 1.00 0.00 H new ATOM 0 HB3 SER A 3 37.361 22.374 9.492 1.00 0.00 H new ATOM 0 HG SER A 3 35.735 20.896 10.241 1.00 0.00 H new ATOM 30 N GLY A 4 35.443 23.417 12.815 1.00 0.00 N ATOM 31 CA GLY A 4 34.370 23.818 13.708 1.00 0.00 C ATOM 32 C GLY A 4 33.444 22.640 14.017 1.00 0.00 C ATOM 33 O GLY A 4 33.871 21.486 13.987 1.00 0.00 O ATOM 0 H GLY A 4 35.674 22.424 12.845 1.00 0.00 H new ATOM 0 HA2 GLY A 4 34.790 24.208 14.635 1.00 0.00 H new ATOM 0 HA3 GLY A 4 33.797 24.626 13.254 1.00 0.00 H new ATOM 37 N SER A 5 32.194 22.970 14.307 1.00 0.00 N ATOM 38 CA SER A 5 31.205 21.953 14.621 1.00 0.00 C ATOM 39 C SER A 5 29.822 22.593 14.756 1.00 0.00 C ATOM 40 O SER A 5 29.701 23.816 14.800 1.00 0.00 O ATOM 41 CB SER A 5 31.571 21.206 15.905 1.00 0.00 C ATOM 42 OG SER A 5 31.885 19.839 15.657 1.00 0.00 O ATOM 0 H SER A 5 31.843 23.928 14.331 1.00 0.00 H new ATOM 0 HA SER A 5 31.187 21.230 13.805 1.00 0.00 H new ATOM 0 HB2 SER A 5 32.424 21.694 16.377 1.00 0.00 H new ATOM 0 HB3 SER A 5 30.740 21.265 16.608 1.00 0.00 H new ATOM 0 HG SER A 5 32.656 19.785 15.055 1.00 0.00 H new ATOM 48 N SER A 6 28.812 21.737 14.817 1.00 0.00 N ATOM 49 CA SER A 6 27.442 22.203 14.945 1.00 0.00 C ATOM 50 C SER A 6 26.616 21.187 15.736 1.00 0.00 C ATOM 51 O SER A 6 27.087 20.089 16.026 1.00 0.00 O ATOM 52 CB SER A 6 26.812 22.446 13.572 1.00 0.00 C ATOM 53 OG SER A 6 25.966 23.593 13.569 1.00 0.00 O ATOM 0 H SER A 6 28.916 20.723 14.780 1.00 0.00 H new ATOM 0 HA SER A 6 27.452 23.151 15.483 1.00 0.00 H new ATOM 0 HB2 SER A 6 27.599 22.574 12.829 1.00 0.00 H new ATOM 0 HB3 SER A 6 26.235 21.569 13.277 1.00 0.00 H new ATOM 0 HG SER A 6 25.584 23.716 12.675 1.00 0.00 H new ATOM 59 N GLY A 7 25.397 21.590 16.063 1.00 0.00 N ATOM 60 CA GLY A 7 24.500 20.728 16.815 1.00 0.00 C ATOM 61 C GLY A 7 23.149 20.595 16.110 1.00 0.00 C ATOM 62 O GLY A 7 22.940 21.175 15.045 1.00 0.00 O ATOM 0 H GLY A 7 25.009 22.502 15.821 1.00 0.00 H new ATOM 0 HA2 GLY A 7 24.951 19.743 16.934 1.00 0.00 H new ATOM 0 HA3 GLY A 7 24.354 21.134 17.816 1.00 0.00 H new ATOM 66 N ASN A 8 22.266 19.826 16.731 1.00 0.00 N ATOM 67 CA ASN A 8 20.941 19.609 16.177 1.00 0.00 C ATOM 68 C ASN A 8 20.128 18.738 17.137 1.00 0.00 C ATOM 69 O ASN A 8 20.573 17.662 17.532 1.00 0.00 O ATOM 70 CB ASN A 8 21.019 18.884 14.832 1.00 0.00 C ATOM 71 CG ASN A 8 20.739 19.845 13.674 1.00 0.00 C ATOM 72 OD1 ASN A 8 20.235 20.941 13.851 1.00 0.00 O ATOM 73 ND2 ASN A 8 21.094 19.373 12.482 1.00 0.00 N ATOM 0 H ASN A 8 22.443 19.345 17.613 1.00 0.00 H new ATOM 0 HA ASN A 8 20.471 20.582 16.036 1.00 0.00 H new ATOM 0 HB2 ASN A 8 22.007 18.441 14.711 1.00 0.00 H new ATOM 0 HB3 ASN A 8 20.298 18.066 14.813 1.00 0.00 H new ATOM 0 HD21 ASN A 8 20.949 19.938 11.646 1.00 0.00 H new ATOM 0 HD22 ASN A 8 21.512 18.446 12.404 1.00 0.00 H new ATOM 80 N LEU A 9 18.950 19.237 17.483 1.00 0.00 N ATOM 81 CA LEU A 9 18.071 18.518 18.389 1.00 0.00 C ATOM 82 C LEU A 9 16.723 18.280 17.704 1.00 0.00 C ATOM 83 O LEU A 9 15.935 19.210 17.538 1.00 0.00 O ATOM 84 CB LEU A 9 17.960 19.254 19.726 1.00 0.00 C ATOM 85 CG LEU A 9 18.137 18.397 20.981 1.00 0.00 C ATOM 86 CD1 LEU A 9 17.180 17.204 20.969 1.00 0.00 C ATOM 87 CD2 LEU A 9 19.594 17.962 21.146 1.00 0.00 C ATOM 0 H LEU A 9 18.584 20.130 17.152 1.00 0.00 H new ATOM 0 HA LEU A 9 18.487 17.538 18.625 1.00 0.00 H new ATOM 0 HB2 LEU A 9 18.707 20.048 19.744 1.00 0.00 H new ATOM 0 HB3 LEU A 9 16.983 19.735 19.773 1.00 0.00 H new ATOM 0 HG LEU A 9 17.882 19.005 21.849 1.00 0.00 H new ATOM 0 HD11 LEU A 9 17.326 16.611 21.872 1.00 0.00 H new ATOM 0 HD12 LEU A 9 16.151 17.563 20.933 1.00 0.00 H new ATOM 0 HD13 LEU A 9 17.379 16.586 20.093 1.00 0.00 H new ATOM 0 HD21 LEU A 9 19.693 17.354 22.045 1.00 0.00 H new ATOM 0 HD22 LEU A 9 19.900 17.378 20.278 1.00 0.00 H new ATOM 0 HD23 LEU A 9 20.229 18.843 21.232 1.00 0.00 H new ATOM 99 N SER A 10 16.500 17.031 17.325 1.00 0.00 N ATOM 100 CA SER A 10 15.262 16.659 16.662 1.00 0.00 C ATOM 101 C SER A 10 14.173 16.388 17.701 1.00 0.00 C ATOM 102 O SER A 10 14.457 16.296 18.895 1.00 0.00 O ATOM 103 CB SER A 10 15.461 15.433 15.769 1.00 0.00 C ATOM 104 OG SER A 10 15.916 14.303 16.509 1.00 0.00 O ATOM 0 H SER A 10 17.156 16.263 17.464 1.00 0.00 H new ATOM 0 HA SER A 10 14.952 17.489 16.028 1.00 0.00 H new ATOM 0 HB2 SER A 10 14.521 15.188 15.274 1.00 0.00 H new ATOM 0 HB3 SER A 10 16.182 15.668 14.986 1.00 0.00 H new ATOM 0 HG SER A 10 16.029 13.540 15.904 1.00 0.00 H new ATOM 110 N ALA A 11 12.948 16.267 17.211 1.00 0.00 N ATOM 111 CA ALA A 11 11.814 16.008 18.082 1.00 0.00 C ATOM 112 C ALA A 11 11.815 14.533 18.487 1.00 0.00 C ATOM 113 O ALA A 11 12.521 13.722 17.890 1.00 0.00 O ATOM 114 CB ALA A 11 10.522 16.418 17.374 1.00 0.00 C ATOM 0 H ALA A 11 12.716 16.344 16.221 1.00 0.00 H new ATOM 0 HA ALA A 11 11.887 16.600 18.994 1.00 0.00 H new ATOM 0 HB1 ALA A 11 9.672 16.224 18.027 1.00 0.00 H new ATOM 0 HB2 ALA A 11 10.560 17.481 17.134 1.00 0.00 H new ATOM 0 HB3 ALA A 11 10.412 15.842 16.455 1.00 0.00 H new ATOM 120 N SER A 12 11.014 14.229 19.498 1.00 0.00 N ATOM 121 CA SER A 12 10.913 12.866 19.990 1.00 0.00 C ATOM 122 C SER A 12 9.532 12.293 19.664 1.00 0.00 C ATOM 123 O SER A 12 8.617 12.368 20.481 1.00 0.00 O ATOM 124 CB SER A 12 11.172 12.803 21.496 1.00 0.00 C ATOM 125 OG SER A 12 12.228 11.902 21.819 1.00 0.00 O ATOM 0 H SER A 12 10.429 14.904 19.990 1.00 0.00 H new ATOM 0 HA SER A 12 11.675 12.266 19.493 1.00 0.00 H new ATOM 0 HB2 SER A 12 11.420 13.799 21.863 1.00 0.00 H new ATOM 0 HB3 SER A 12 10.261 12.492 22.008 1.00 0.00 H new ATOM 0 HG SER A 12 12.364 11.891 22.790 1.00 0.00 H new ATOM 131 N ASN A 13 9.426 11.734 18.467 1.00 0.00 N ATOM 132 CA ASN A 13 8.173 11.149 18.023 1.00 0.00 C ATOM 133 C ASN A 13 8.340 10.616 16.599 1.00 0.00 C ATOM 134 O ASN A 13 8.907 11.292 15.742 1.00 0.00 O ATOM 135 CB ASN A 13 7.053 12.191 18.010 1.00 0.00 C ATOM 136 CG ASN A 13 5.846 11.708 18.818 1.00 0.00 C ATOM 137 OD1 ASN A 13 5.839 10.630 19.389 1.00 0.00 O ATOM 138 ND2 ASN A 13 4.828 12.565 18.833 1.00 0.00 N ATOM 0 H ASN A 13 10.188 11.674 17.791 1.00 0.00 H new ATOM 0 HA ASN A 13 7.912 10.347 18.714 1.00 0.00 H new ATOM 0 HB2 ASN A 13 7.420 13.130 18.424 1.00 0.00 H new ATOM 0 HB3 ASN A 13 6.750 12.392 16.982 1.00 0.00 H new ATOM 0 HD21 ASN A 13 3.976 12.336 19.344 1.00 0.00 H new ATOM 0 HD22 ASN A 13 4.900 13.451 18.333 1.00 0.00 H new ATOM 145 N ARG A 14 7.835 9.409 16.389 1.00 0.00 N ATOM 146 CA ARG A 14 7.921 8.778 15.083 1.00 0.00 C ATOM 147 C ARG A 14 6.771 7.787 14.896 1.00 0.00 C ATOM 148 O ARG A 14 6.386 7.093 15.835 1.00 0.00 O ATOM 149 CB ARG A 14 9.252 8.044 14.913 1.00 0.00 C ATOM 150 CG ARG A 14 9.912 8.405 13.581 1.00 0.00 C ATOM 151 CD ARG A 14 11.036 7.424 13.241 1.00 0.00 C ATOM 152 NE ARG A 14 10.532 6.371 12.332 1.00 0.00 N ATOM 153 CZ ARG A 14 11.278 5.359 11.868 1.00 0.00 C ATOM 154 NH1 ARG A 14 12.565 5.256 12.226 1.00 0.00 N ATOM 155 NH2 ARG A 14 10.736 4.449 11.047 1.00 0.00 N ATOM 0 H ARG A 14 7.365 8.851 17.102 1.00 0.00 H new ATOM 0 HA ARG A 14 7.854 9.563 14.330 1.00 0.00 H new ATOM 0 HB2 ARG A 14 9.920 8.300 15.735 1.00 0.00 H new ATOM 0 HB3 ARG A 14 9.086 6.968 14.961 1.00 0.00 H new ATOM 0 HG2 ARG A 14 9.165 8.397 12.787 1.00 0.00 H new ATOM 0 HG3 ARG A 14 10.312 9.418 13.632 1.00 0.00 H new ATOM 0 HD2 ARG A 14 11.864 7.955 12.771 1.00 0.00 H new ATOM 0 HD3 ARG A 14 11.424 6.972 14.154 1.00 0.00 H new ATOM 0 HE ARG A 14 9.556 6.418 12.040 1.00 0.00 H new ATOM 0 HH11 ARG A 14 12.977 5.948 12.852 1.00 0.00 H new ATOM 0 HH12 ARG A 14 13.133 4.486 11.873 1.00 0.00 H new ATOM 0 HH21 ARG A 14 9.756 4.527 10.775 1.00 0.00 H new ATOM 0 HH22 ARG A 14 11.304 3.679 10.694 1.00 0.00 H new ATOM 169 N ALA A 15 6.255 7.751 13.676 1.00 0.00 N ATOM 170 CA ALA A 15 5.157 6.856 13.353 1.00 0.00 C ATOM 171 C ALA A 15 4.929 6.860 11.840 1.00 0.00 C ATOM 172 O ALA A 15 4.826 7.922 11.228 1.00 0.00 O ATOM 173 CB ALA A 15 3.910 7.277 14.132 1.00 0.00 C ATOM 0 H ALA A 15 6.577 8.328 12.899 1.00 0.00 H new ATOM 0 HA ALA A 15 5.396 5.834 13.647 1.00 0.00 H new ATOM 0 HB1 ALA A 15 3.086 6.606 13.890 1.00 0.00 H new ATOM 0 HB2 ALA A 15 4.115 7.228 15.201 1.00 0.00 H new ATOM 0 HB3 ALA A 15 3.639 8.297 13.861 1.00 0.00 H new ATOM 179 N LEU A 16 4.857 5.661 11.281 1.00 0.00 N ATOM 180 CA LEU A 16 4.643 5.513 9.852 1.00 0.00 C ATOM 181 C LEU A 16 3.178 5.157 9.594 1.00 0.00 C ATOM 182 O LEU A 16 2.496 4.639 10.478 1.00 0.00 O ATOM 183 CB LEU A 16 5.634 4.507 9.263 1.00 0.00 C ATOM 184 CG LEU A 16 7.106 4.731 9.613 1.00 0.00 C ATOM 185 CD1 LEU A 16 7.969 3.566 9.126 1.00 0.00 C ATOM 186 CD2 LEU A 16 7.600 6.075 9.073 1.00 0.00 C ATOM 0 H LEU A 16 4.943 4.783 11.792 1.00 0.00 H new ATOM 0 HA LEU A 16 4.837 6.454 9.338 1.00 0.00 H new ATOM 0 HB2 LEU A 16 5.350 3.509 9.597 1.00 0.00 H new ATOM 0 HB3 LEU A 16 5.533 4.521 8.178 1.00 0.00 H new ATOM 0 HG LEU A 16 7.197 4.767 10.699 1.00 0.00 H new ATOM 0 HD11 LEU A 16 9.011 3.751 9.388 1.00 0.00 H new ATOM 0 HD12 LEU A 16 7.634 2.643 9.599 1.00 0.00 H new ATOM 0 HD13 LEU A 16 7.878 3.473 8.044 1.00 0.00 H new ATOM 0 HD21 LEU A 16 8.649 6.209 9.336 1.00 0.00 H new ATOM 0 HD22 LEU A 16 7.492 6.093 7.988 1.00 0.00 H new ATOM 0 HD23 LEU A 16 7.011 6.881 9.510 1.00 0.00 H new ATOM 198 N PRO A 17 2.724 5.455 8.347 1.00 0.00 N ATOM 199 CA PRO A 17 1.352 5.172 7.962 1.00 0.00 C ATOM 200 C PRO A 17 1.150 3.675 7.715 1.00 0.00 C ATOM 201 O PRO A 17 2.111 2.907 7.716 1.00 0.00 O ATOM 202 CB PRO A 17 1.109 6.016 6.722 1.00 0.00 C ATOM 203 CG PRO A 17 2.486 6.381 6.190 1.00 0.00 C ATOM 204 CD PRO A 17 3.503 6.068 7.275 1.00 0.00 C ATOM 0 HA PRO A 17 0.635 5.422 8.744 1.00 0.00 H new ATOM 0 HB2 PRO A 17 0.537 5.461 5.978 1.00 0.00 H new ATOM 0 HB3 PRO A 17 0.534 6.910 6.964 1.00 0.00 H new ATOM 0 HG2 PRO A 17 2.708 5.816 5.285 1.00 0.00 H new ATOM 0 HG3 PRO A 17 2.525 7.437 5.924 1.00 0.00 H new ATOM 0 HD2 PRO A 17 4.276 5.391 6.910 1.00 0.00 H new ATOM 0 HD3 PRO A 17 4.007 6.972 7.618 1.00 0.00 H new ATOM 212 N VAL A 18 -0.106 3.307 7.509 1.00 0.00 N ATOM 213 CA VAL A 18 -0.446 1.916 7.262 1.00 0.00 C ATOM 214 C VAL A 18 -1.009 1.778 5.845 1.00 0.00 C ATOM 215 O VAL A 18 -2.070 2.319 5.540 1.00 0.00 O ATOM 216 CB VAL A 18 -1.409 1.413 8.339 1.00 0.00 C ATOM 217 CG1 VAL A 18 -1.907 0.003 8.014 1.00 0.00 C ATOM 218 CG2 VAL A 18 -0.757 1.459 9.722 1.00 0.00 C ATOM 0 H VAL A 18 -0.900 3.947 7.508 1.00 0.00 H new ATOM 0 HA VAL A 18 0.443 1.289 7.322 1.00 0.00 H new ATOM 0 HB VAL A 18 -2.272 2.078 8.354 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -2.590 -0.331 8.795 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -2.428 0.013 7.057 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -1.058 -0.679 7.958 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -1.463 1.096 10.469 1.00 0.00 H new ATOM 0 HG22 VAL A 18 0.132 0.828 9.726 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -0.475 2.485 9.957 1.00 0.00 H new ATOM 228 N LEU A 19 -0.272 1.050 5.019 1.00 0.00 N ATOM 229 CA LEU A 19 -0.684 0.834 3.642 1.00 0.00 C ATOM 230 C LEU A 19 -1.361 -0.534 3.526 1.00 0.00 C ATOM 231 O LEU A 19 -0.706 -1.567 3.653 1.00 0.00 O ATOM 232 CB LEU A 19 0.502 1.016 2.693 1.00 0.00 C ATOM 233 CG LEU A 19 0.187 0.913 1.199 1.00 0.00 C ATOM 234 CD1 LEU A 19 -0.197 2.279 0.625 1.00 0.00 C ATOM 235 CD2 LEU A 19 1.351 0.278 0.436 1.00 0.00 C ATOM 0 H LEU A 19 0.608 0.602 5.276 1.00 0.00 H new ATOM 0 HA LEU A 19 -1.419 1.581 3.342 1.00 0.00 H new ATOM 0 HB2 LEU A 19 0.948 1.992 2.884 1.00 0.00 H new ATOM 0 HB3 LEU A 19 1.256 0.268 2.938 1.00 0.00 H new ATOM 0 HG LEU A 19 -0.675 0.257 1.076 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -0.416 2.178 -0.438 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -1.079 2.657 1.143 1.00 0.00 H new ATOM 0 HD13 LEU A 19 0.630 2.976 0.761 1.00 0.00 H new ATOM 0 HD21 LEU A 19 1.101 0.217 -0.623 1.00 0.00 H new ATOM 0 HD22 LEU A 19 2.245 0.888 0.563 1.00 0.00 H new ATOM 0 HD23 LEU A 19 1.537 -0.724 0.824 1.00 0.00 H new ATOM 247 N THR A 20 -2.663 -0.495 3.286 1.00 0.00 N ATOM 248 CA THR A 20 -3.436 -1.719 3.151 1.00 0.00 C ATOM 249 C THR A 20 -3.231 -2.328 1.763 1.00 0.00 C ATOM 250 O THR A 20 -3.755 -1.818 0.774 1.00 0.00 O ATOM 251 CB THR A 20 -4.898 -1.391 3.461 1.00 0.00 C ATOM 252 OG1 THR A 20 -4.823 -0.427 4.508 1.00 0.00 O ATOM 253 CG2 THR A 20 -5.640 -2.571 4.093 1.00 0.00 C ATOM 0 H THR A 20 -3.203 0.364 3.181 1.00 0.00 H new ATOM 0 HA THR A 20 -3.101 -2.479 3.857 1.00 0.00 H new ATOM 0 HB THR A 20 -5.406 -1.091 2.544 1.00 0.00 H new ATOM 0 HG1 THR A 20 -5.728 -0.157 4.770 1.00 0.00 H new ATOM 0 HG21 THR A 20 -6.673 -2.286 4.293 1.00 0.00 H new ATOM 0 HG22 THR A 20 -5.624 -3.420 3.409 1.00 0.00 H new ATOM 0 HG23 THR A 20 -5.153 -2.849 5.027 1.00 0.00 H new ATOM 261 N LEU A 21 -2.468 -3.411 1.734 1.00 0.00 N ATOM 262 CA LEU A 21 -2.187 -4.095 0.483 1.00 0.00 C ATOM 263 C LEU A 21 -3.091 -5.325 0.366 1.00 0.00 C ATOM 264 O LEU A 21 -3.070 -6.199 1.231 1.00 0.00 O ATOM 265 CB LEU A 21 -0.696 -4.415 0.370 1.00 0.00 C ATOM 266 CG LEU A 21 -0.329 -5.597 -0.530 1.00 0.00 C ATOM 267 CD1 LEU A 21 -0.833 -5.376 -1.958 1.00 0.00 C ATOM 268 CD2 LEU A 21 1.175 -5.872 -0.489 1.00 0.00 C ATOM 0 H LEU A 21 -2.036 -3.832 2.557 1.00 0.00 H new ATOM 0 HA LEU A 21 -2.415 -3.449 -0.364 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -0.182 -3.528 -0.001 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -0.310 -4.612 1.370 1.00 0.00 H new ATOM 0 HG LEU A 21 -0.829 -6.486 -0.146 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -0.559 -6.230 -2.577 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -1.918 -5.268 -1.948 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -0.382 -4.472 -2.367 1.00 0.00 H new ATOM 0 HD21 LEU A 21 1.408 -6.717 -1.137 1.00 0.00 H new ATOM 0 HD22 LEU A 21 1.716 -4.990 -0.833 1.00 0.00 H new ATOM 0 HD23 LEU A 21 1.475 -6.105 0.533 1.00 0.00 H new ATOM 280 N PHE A 22 -3.862 -5.352 -0.711 1.00 0.00 N ATOM 281 CA PHE A 22 -4.771 -6.460 -0.953 1.00 0.00 C ATOM 282 C PHE A 22 -4.269 -7.341 -2.098 1.00 0.00 C ATOM 283 O PHE A 22 -4.396 -6.978 -3.267 1.00 0.00 O ATOM 284 CB PHE A 22 -6.120 -5.854 -1.345 1.00 0.00 C ATOM 285 CG PHE A 22 -6.894 -5.246 -0.173 1.00 0.00 C ATOM 286 CD1 PHE A 22 -7.579 -6.053 0.681 1.00 0.00 C ATOM 287 CD2 PHE A 22 -6.895 -3.899 0.016 1.00 0.00 C ATOM 288 CE1 PHE A 22 -8.297 -5.489 1.769 1.00 0.00 C ATOM 289 CE2 PHE A 22 -7.613 -3.336 1.104 1.00 0.00 C ATOM 290 CZ PHE A 22 -8.299 -4.143 1.957 1.00 0.00 C ATOM 0 H PHE A 22 -3.876 -4.625 -1.426 1.00 0.00 H new ATOM 0 HA PHE A 22 -4.848 -7.080 -0.060 1.00 0.00 H new ATOM 0 HB2 PHE A 22 -5.955 -5.083 -2.097 1.00 0.00 H new ATOM 0 HB3 PHE A 22 -6.732 -6.627 -1.810 1.00 0.00 H new ATOM 0 HD1 PHE A 22 -7.577 -7.123 0.532 1.00 0.00 H new ATOM 0 HD2 PHE A 22 -6.350 -3.258 -0.661 1.00 0.00 H new ATOM 0 HE1 PHE A 22 -8.841 -6.130 2.447 1.00 0.00 H new ATOM 0 HE2 PHE A 22 -7.614 -2.266 1.254 1.00 0.00 H new ATOM 0 HZ PHE A 22 -8.845 -3.714 2.784 1.00 0.00 H new ATOM 300 N THR A 23 -3.710 -8.482 -1.723 1.00 0.00 N ATOM 301 CA THR A 23 -3.188 -9.418 -2.704 1.00 0.00 C ATOM 302 C THR A 23 -3.945 -10.746 -2.630 1.00 0.00 C ATOM 303 O THR A 23 -4.743 -10.959 -1.719 1.00 0.00 O ATOM 304 CB THR A 23 -1.684 -9.562 -2.468 1.00 0.00 C ATOM 305 OG1 THR A 23 -1.329 -10.737 -3.191 1.00 0.00 O ATOM 306 CG2 THR A 23 -1.350 -9.905 -1.014 1.00 0.00 C ATOM 0 H THR A 23 -3.607 -8.780 -0.753 1.00 0.00 H new ATOM 0 HA THR A 23 -3.338 -9.051 -3.719 1.00 0.00 H new ATOM 0 HB THR A 23 -1.183 -8.635 -2.748 1.00 0.00 H new ATOM 0 HG1 THR A 23 -0.951 -11.399 -2.575 1.00 0.00 H new ATOM 0 HG21 THR A 23 -0.270 -9.996 -0.901 1.00 0.00 H new ATOM 0 HG22 THR A 23 -1.718 -9.115 -0.360 1.00 0.00 H new ATOM 0 HG23 THR A 23 -1.824 -10.849 -0.745 1.00 0.00 H new ATOM 314 N LYS A 24 -3.668 -11.603 -3.601 1.00 0.00 N ATOM 315 CA LYS A 24 -4.312 -12.905 -3.657 1.00 0.00 C ATOM 316 C LYS A 24 -3.543 -13.808 -4.623 1.00 0.00 C ATOM 317 O LYS A 24 -3.395 -13.482 -5.799 1.00 0.00 O ATOM 318 CB LYS A 24 -5.795 -12.754 -4.004 1.00 0.00 C ATOM 319 CG LYS A 24 -5.974 -12.038 -5.344 1.00 0.00 C ATOM 320 CD LYS A 24 -7.379 -12.269 -5.905 1.00 0.00 C ATOM 321 CE LYS A 24 -7.322 -12.658 -7.384 1.00 0.00 C ATOM 322 NZ LYS A 24 -8.339 -11.911 -8.156 1.00 0.00 N ATOM 0 H LYS A 24 -3.006 -11.422 -4.356 1.00 0.00 H new ATOM 0 HA LYS A 24 -4.284 -13.387 -2.680 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -6.264 -13.737 -4.047 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -6.301 -12.194 -3.218 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -5.801 -10.970 -5.216 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -5.231 -12.398 -6.055 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -7.876 -13.056 -5.337 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -7.975 -11.364 -5.786 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -6.329 -12.450 -7.783 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -7.490 -13.730 -7.491 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -8.650 -12.484 -8.966 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -9.155 -11.703 -7.545 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -7.928 -11.020 -8.501 1.00 0.00 H new ATOM 336 N ALA A 25 -3.075 -14.927 -4.090 1.00 0.00 N ATOM 337 CA ALA A 25 -2.325 -15.881 -4.890 1.00 0.00 C ATOM 338 C ALA A 25 -3.298 -16.854 -5.559 1.00 0.00 C ATOM 339 O ALA A 25 -4.248 -17.318 -4.931 1.00 0.00 O ATOM 340 CB ALA A 25 -1.301 -16.596 -4.006 1.00 0.00 C ATOM 0 H ALA A 25 -3.201 -15.195 -3.114 1.00 0.00 H new ATOM 0 HA ALA A 25 -1.773 -15.370 -5.679 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -0.739 -17.311 -4.606 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -0.616 -15.864 -3.578 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -1.818 -17.123 -3.204 1.00 0.00 H new ATOM 346 N PRO A 26 -3.019 -17.142 -6.859 1.00 0.00 N ATOM 347 CA PRO A 26 -1.874 -16.548 -7.528 1.00 0.00 C ATOM 348 C PRO A 26 -2.140 -15.082 -7.873 1.00 0.00 C ATOM 349 O PRO A 26 -3.284 -14.631 -7.844 1.00 0.00 O ATOM 350 CB PRO A 26 -1.643 -17.415 -8.755 1.00 0.00 C ATOM 351 CG PRO A 26 -2.940 -18.175 -8.979 1.00 0.00 C ATOM 352 CD PRO A 26 -3.785 -18.036 -7.723 1.00 0.00 C ATOM 0 HA PRO A 26 -0.984 -16.525 -6.899 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -1.393 -16.805 -9.623 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -0.811 -18.101 -8.597 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -3.472 -17.776 -9.843 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -2.736 -19.225 -9.187 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -4.767 -17.622 -7.950 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -3.949 -19.003 -7.247 1.00 0.00 H new ATOM 360 N CYS A 27 -1.064 -14.378 -8.193 1.00 0.00 N ATOM 361 CA CYS A 27 -1.166 -12.972 -8.544 1.00 0.00 C ATOM 362 C CYS A 27 0.202 -12.499 -9.038 1.00 0.00 C ATOM 363 O CYS A 27 1.148 -12.399 -8.257 1.00 0.00 O ATOM 364 CB CYS A 27 -1.671 -12.131 -7.369 1.00 0.00 C ATOM 365 SG CYS A 27 -0.823 -12.637 -5.828 1.00 0.00 S ATOM 0 H CYS A 27 -0.117 -14.756 -8.216 1.00 0.00 H new ATOM 0 HA CYS A 27 -1.901 -12.846 -9.339 1.00 0.00 H new ATOM 0 HB2 CYS A 27 -1.490 -11.074 -7.563 1.00 0.00 H new ATOM 0 HB3 CYS A 27 -2.748 -12.255 -7.259 1.00 0.00 H new ATOM 0 HG CYS A 27 -1.130 -11.810 -4.873 1.00 0.00 H new ATOM 371 N PRO A 28 0.267 -12.213 -10.366 1.00 0.00 N ATOM 372 CA PRO A 28 1.504 -11.753 -10.973 1.00 0.00 C ATOM 373 C PRO A 28 1.783 -10.293 -10.610 1.00 0.00 C ATOM 374 O PRO A 28 2.928 -9.921 -10.358 1.00 0.00 O ATOM 375 CB PRO A 28 1.313 -11.968 -12.466 1.00 0.00 C ATOM 376 CG PRO A 28 -0.186 -12.103 -12.679 1.00 0.00 C ATOM 377 CD PRO A 28 -0.833 -12.320 -11.321 1.00 0.00 C ATOM 0 HA PRO A 28 2.377 -12.298 -10.614 1.00 0.00 H new ATOM 0 HB2 PRO A 28 1.715 -11.130 -13.036 1.00 0.00 H new ATOM 0 HB3 PRO A 28 1.837 -12.863 -12.802 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -0.586 -11.207 -13.153 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -0.403 -12.940 -13.343 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -1.602 -11.573 -11.125 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -1.315 -13.296 -11.263 1.00 0.00 H new ATOM 385 N LEU A 29 0.717 -9.506 -10.596 1.00 0.00 N ATOM 386 CA LEU A 29 0.834 -8.095 -10.269 1.00 0.00 C ATOM 387 C LEU A 29 1.087 -7.944 -8.767 1.00 0.00 C ATOM 388 O LEU A 29 2.165 -7.519 -8.356 1.00 0.00 O ATOM 389 CB LEU A 29 -0.393 -7.327 -10.766 1.00 0.00 C ATOM 390 CG LEU A 29 -0.385 -6.936 -12.245 1.00 0.00 C ATOM 391 CD1 LEU A 29 -0.073 -8.145 -13.130 1.00 0.00 C ATOM 392 CD2 LEU A 29 -1.699 -6.261 -12.641 1.00 0.00 C ATOM 0 H LEU A 29 -0.231 -9.818 -10.806 1.00 0.00 H new ATOM 0 HA LEU A 29 1.688 -7.654 -10.783 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -1.278 -7.934 -10.576 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -0.495 -6.419 -10.171 1.00 0.00 H new ATOM 0 HG LEU A 29 0.411 -6.208 -12.401 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -0.073 -7.840 -14.176 1.00 0.00 H new ATOM 0 HD12 LEU A 29 0.907 -8.544 -12.869 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -0.830 -8.914 -12.976 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -1.667 -5.993 -13.697 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -2.528 -6.947 -12.466 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -1.840 -5.361 -12.043 1.00 0.00 H new ATOM 404 N CYS A 30 0.074 -8.299 -7.990 1.00 0.00 N ATOM 405 CA CYS A 30 0.174 -8.209 -6.543 1.00 0.00 C ATOM 406 C CYS A 30 1.571 -8.672 -6.128 1.00 0.00 C ATOM 407 O CYS A 30 2.228 -8.024 -5.315 1.00 0.00 O ATOM 408 CB CYS A 30 -0.925 -9.015 -5.849 1.00 0.00 C ATOM 409 SG CYS A 30 -2.565 -8.532 -6.503 1.00 0.00 S ATOM 0 H CYS A 30 -0.820 -8.649 -8.335 1.00 0.00 H new ATOM 0 HA CYS A 30 0.028 -7.175 -6.229 1.00 0.00 H new ATOM 0 HB2 CYS A 30 -0.761 -10.081 -6.008 1.00 0.00 H new ATOM 0 HB3 CYS A 30 -0.889 -8.844 -4.773 1.00 0.00 H new ATOM 0 HG CYS A 30 -3.491 -9.224 -5.908 1.00 0.00 H new ATOM 415 N ASP A 31 1.984 -9.792 -6.704 1.00 0.00 N ATOM 416 CA ASP A 31 3.292 -10.350 -6.404 1.00 0.00 C ATOM 417 C ASP A 31 4.364 -9.284 -6.643 1.00 0.00 C ATOM 418 O ASP A 31 5.118 -8.942 -5.734 1.00 0.00 O ATOM 419 CB ASP A 31 3.602 -11.544 -7.309 1.00 0.00 C ATOM 420 CG ASP A 31 5.075 -11.954 -7.355 1.00 0.00 C ATOM 421 OD1 ASP A 31 5.791 -11.610 -6.390 1.00 0.00 O ATOM 422 OD2 ASP A 31 5.452 -12.604 -8.355 1.00 0.00 O ATOM 0 H ASP A 31 1.436 -10.328 -7.377 1.00 0.00 H new ATOM 0 HA ASP A 31 3.289 -10.677 -5.364 1.00 0.00 H new ATOM 0 HB2 ASP A 31 3.013 -12.398 -6.974 1.00 0.00 H new ATOM 0 HB3 ASP A 31 3.274 -11.308 -8.321 1.00 0.00 H new ATOM 427 N GLU A 32 4.397 -8.789 -7.872 1.00 0.00 N ATOM 428 CA GLU A 32 5.364 -7.770 -8.242 1.00 0.00 C ATOM 429 C GLU A 32 5.161 -6.513 -7.394 1.00 0.00 C ATOM 430 O GLU A 32 6.123 -5.944 -6.880 1.00 0.00 O ATOM 431 CB GLU A 32 5.273 -7.445 -9.734 1.00 0.00 C ATOM 432 CG GLU A 32 6.666 -7.362 -10.362 1.00 0.00 C ATOM 433 CD GLU A 32 6.922 -8.555 -11.286 1.00 0.00 C ATOM 434 OE1 GLU A 32 6.901 -9.691 -10.765 1.00 0.00 O ATOM 435 OE2 GLU A 32 7.134 -8.303 -12.492 1.00 0.00 O ATOM 0 H GLU A 32 3.770 -9.075 -8.624 1.00 0.00 H new ATOM 0 HA GLU A 32 6.364 -8.158 -8.048 1.00 0.00 H new ATOM 0 HB2 GLU A 32 4.686 -8.210 -10.242 1.00 0.00 H new ATOM 0 HB3 GLU A 32 4.750 -6.499 -9.873 1.00 0.00 H new ATOM 0 HG2 GLU A 32 6.760 -6.434 -10.926 1.00 0.00 H new ATOM 0 HG3 GLU A 32 7.422 -7.336 -9.577 1.00 0.00 H new ATOM 442 N ALA A 33 3.902 -6.116 -7.273 1.00 0.00 N ATOM 443 CA ALA A 33 3.561 -4.937 -6.496 1.00 0.00 C ATOM 444 C ALA A 33 4.434 -4.888 -5.240 1.00 0.00 C ATOM 445 O ALA A 33 5.201 -3.946 -5.049 1.00 0.00 O ATOM 446 CB ALA A 33 2.067 -4.957 -6.167 1.00 0.00 C ATOM 0 H ALA A 33 3.106 -6.590 -7.700 1.00 0.00 H new ATOM 0 HA ALA A 33 3.757 -4.031 -7.069 1.00 0.00 H new ATOM 0 HB1 ALA A 33 1.811 -4.072 -5.584 1.00 0.00 H new ATOM 0 HB2 ALA A 33 1.491 -4.961 -7.092 1.00 0.00 H new ATOM 0 HB3 ALA A 33 1.833 -5.852 -5.590 1.00 0.00 H new ATOM 452 N LYS A 34 4.287 -5.916 -4.417 1.00 0.00 N ATOM 453 CA LYS A 34 5.053 -6.002 -3.185 1.00 0.00 C ATOM 454 C LYS A 34 6.518 -5.669 -3.475 1.00 0.00 C ATOM 455 O LYS A 34 7.109 -4.820 -2.809 1.00 0.00 O ATOM 456 CB LYS A 34 4.852 -7.367 -2.524 1.00 0.00 C ATOM 457 CG LYS A 34 3.406 -7.543 -2.056 1.00 0.00 C ATOM 458 CD LYS A 34 3.120 -9.001 -1.694 1.00 0.00 C ATOM 459 CE LYS A 34 1.875 -9.513 -2.421 1.00 0.00 C ATOM 460 NZ LYS A 34 1.935 -10.984 -2.579 1.00 0.00 N ATOM 0 H LYS A 34 3.650 -6.696 -4.579 1.00 0.00 H new ATOM 0 HA LYS A 34 4.696 -5.268 -2.463 1.00 0.00 H new ATOM 0 HB2 LYS A 34 5.108 -8.158 -3.229 1.00 0.00 H new ATOM 0 HB3 LYS A 34 5.527 -7.466 -1.674 1.00 0.00 H new ATOM 0 HG2 LYS A 34 3.220 -6.907 -1.191 1.00 0.00 H new ATOM 0 HG3 LYS A 34 2.724 -7.219 -2.842 1.00 0.00 H new ATOM 0 HD2 LYS A 34 3.978 -9.619 -1.956 1.00 0.00 H new ATOM 0 HD3 LYS A 34 2.979 -9.091 -0.617 1.00 0.00 H new ATOM 0 HE2 LYS A 34 0.981 -9.238 -1.862 1.00 0.00 H new ATOM 0 HE3 LYS A 34 1.797 -9.039 -3.400 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 1.083 -11.315 -3.074 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 2.778 -11.240 -3.132 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 1.987 -11.432 -1.642 1.00 0.00 H new ATOM 474 N GLU A 35 7.061 -6.354 -4.470 1.00 0.00 N ATOM 475 CA GLU A 35 8.445 -6.142 -4.857 1.00 0.00 C ATOM 476 C GLU A 35 8.694 -4.660 -5.148 1.00 0.00 C ATOM 477 O GLU A 35 9.807 -4.168 -4.974 1.00 0.00 O ATOM 478 CB GLU A 35 8.817 -7.007 -6.062 1.00 0.00 C ATOM 479 CG GLU A 35 8.268 -8.427 -5.908 1.00 0.00 C ATOM 480 CD GLU A 35 9.109 -9.430 -6.700 1.00 0.00 C ATOM 481 OE1 GLU A 35 9.178 -9.261 -7.937 1.00 0.00 O ATOM 482 OE2 GLU A 35 9.665 -10.342 -6.051 1.00 0.00 O ATOM 0 H GLU A 35 6.567 -7.057 -5.020 1.00 0.00 H new ATOM 0 HA GLU A 35 9.084 -6.442 -4.026 1.00 0.00 H new ATOM 0 HB2 GLU A 35 8.422 -6.557 -6.973 1.00 0.00 H new ATOM 0 HB3 GLU A 35 9.901 -7.042 -6.168 1.00 0.00 H new ATOM 0 HG2 GLU A 35 8.261 -8.705 -4.854 1.00 0.00 H new ATOM 0 HG3 GLU A 35 7.235 -8.461 -6.254 1.00 0.00 H new ATOM 489 N VAL A 36 7.638 -3.991 -5.586 1.00 0.00 N ATOM 490 CA VAL A 36 7.727 -2.576 -5.903 1.00 0.00 C ATOM 491 C VAL A 36 7.678 -1.764 -4.608 1.00 0.00 C ATOM 492 O VAL A 36 8.119 -0.616 -4.574 1.00 0.00 O ATOM 493 CB VAL A 36 6.625 -2.191 -6.893 1.00 0.00 C ATOM 494 CG1 VAL A 36 6.838 -0.772 -7.425 1.00 0.00 C ATOM 495 CG2 VAL A 36 6.540 -3.200 -8.039 1.00 0.00 C ATOM 0 H VAL A 36 6.716 -4.403 -5.729 1.00 0.00 H new ATOM 0 HA VAL A 36 8.676 -2.353 -6.391 1.00 0.00 H new ATOM 0 HB VAL A 36 5.674 -2.210 -6.360 1.00 0.00 H new ATOM 0 HG11 VAL A 36 6.042 -0.523 -8.126 1.00 0.00 H new ATOM 0 HG12 VAL A 36 6.824 -0.066 -6.595 1.00 0.00 H new ATOM 0 HG13 VAL A 36 7.800 -0.715 -7.934 1.00 0.00 H new ATOM 0 HG21 VAL A 36 5.749 -2.903 -8.728 1.00 0.00 H new ATOM 0 HG22 VAL A 36 7.492 -3.229 -8.570 1.00 0.00 H new ATOM 0 HG23 VAL A 36 6.319 -4.189 -7.637 1.00 0.00 H new ATOM 505 N LEU A 37 7.138 -2.391 -3.573 1.00 0.00 N ATOM 506 CA LEU A 37 7.026 -1.740 -2.279 1.00 0.00 C ATOM 507 C LEU A 37 8.203 -2.163 -1.397 1.00 0.00 C ATOM 508 O LEU A 37 8.152 -2.018 -0.177 1.00 0.00 O ATOM 509 CB LEU A 37 5.658 -2.022 -1.655 1.00 0.00 C ATOM 510 CG LEU A 37 4.451 -1.441 -2.395 1.00 0.00 C ATOM 511 CD1 LEU A 37 3.226 -1.375 -1.480 1.00 0.00 C ATOM 512 CD2 LEU A 37 4.785 -0.077 -3.003 1.00 0.00 C ATOM 0 H LEU A 37 6.773 -3.343 -3.604 1.00 0.00 H new ATOM 0 HA LEU A 37 7.083 -0.657 -2.390 1.00 0.00 H new ATOM 0 HB2 LEU A 37 5.529 -3.102 -1.582 1.00 0.00 H new ATOM 0 HB3 LEU A 37 5.658 -1.632 -0.637 1.00 0.00 H new ATOM 0 HG LEU A 37 4.202 -2.109 -3.219 1.00 0.00 H new ATOM 0 HD11 LEU A 37 2.383 -0.958 -2.031 1.00 0.00 H new ATOM 0 HD12 LEU A 37 2.975 -2.378 -1.136 1.00 0.00 H new ATOM 0 HD13 LEU A 37 3.447 -0.741 -0.621 1.00 0.00 H new ATOM 0 HD21 LEU A 37 3.910 0.314 -3.523 1.00 0.00 H new ATOM 0 HD22 LEU A 37 5.074 0.613 -2.211 1.00 0.00 H new ATOM 0 HD23 LEU A 37 5.609 -0.185 -3.709 1.00 0.00 H new ATOM 524 N GLN A 38 9.235 -2.678 -2.049 1.00 0.00 N ATOM 525 CA GLN A 38 10.422 -3.122 -1.340 1.00 0.00 C ATOM 526 C GLN A 38 11.139 -1.929 -0.704 1.00 0.00 C ATOM 527 O GLN A 38 11.454 -1.951 0.485 1.00 0.00 O ATOM 528 CB GLN A 38 11.360 -3.894 -2.270 1.00 0.00 C ATOM 529 CG GLN A 38 11.260 -5.400 -2.024 1.00 0.00 C ATOM 530 CD GLN A 38 12.649 -6.029 -1.894 1.00 0.00 C ATOM 531 OE1 GLN A 38 12.879 -6.932 -1.107 1.00 0.00 O ATOM 532 NE2 GLN A 38 13.559 -5.502 -2.708 1.00 0.00 N ATOM 0 H GLN A 38 9.273 -2.798 -3.061 1.00 0.00 H new ATOM 0 HA GLN A 38 10.113 -3.801 -0.545 1.00 0.00 H new ATOM 0 HB2 GLN A 38 11.110 -3.674 -3.308 1.00 0.00 H new ATOM 0 HB3 GLN A 38 12.387 -3.564 -2.112 1.00 0.00 H new ATOM 0 HG2 GLN A 38 10.686 -5.586 -1.116 1.00 0.00 H new ATOM 0 HG3 GLN A 38 10.719 -5.871 -2.845 1.00 0.00 H new ATOM 0 HE21 GLN A 38 13.299 -4.747 -3.343 1.00 0.00 H new ATOM 0 HE22 GLN A 38 14.517 -5.853 -2.697 1.00 0.00 H new ATOM 541 N PRO A 39 11.382 -0.890 -1.547 1.00 0.00 N ATOM 542 CA PRO A 39 12.056 0.310 -1.080 1.00 0.00 C ATOM 543 C PRO A 39 11.117 1.171 -0.233 1.00 0.00 C ATOM 544 O PRO A 39 11.505 2.239 0.239 1.00 0.00 O ATOM 545 CB PRO A 39 12.528 1.012 -2.343 1.00 0.00 C ATOM 546 CG PRO A 39 11.704 0.427 -3.478 1.00 0.00 C ATOM 547 CD PRO A 39 11.023 -0.829 -2.961 1.00 0.00 C ATOM 0 HA PRO A 39 12.898 0.092 -0.423 1.00 0.00 H new ATOM 0 HB2 PRO A 39 12.381 2.090 -2.269 1.00 0.00 H new ATOM 0 HB3 PRO A 39 13.593 0.846 -2.507 1.00 0.00 H new ATOM 0 HG2 PRO A 39 10.963 1.148 -3.823 1.00 0.00 H new ATOM 0 HG3 PRO A 39 12.341 0.192 -4.331 1.00 0.00 H new ATOM 0 HD2 PRO A 39 9.942 -0.777 -3.093 1.00 0.00 H new ATOM 0 HD3 PRO A 39 11.367 -1.715 -3.495 1.00 0.00 H new ATOM 555 N TYR A 40 9.900 0.676 -0.066 1.00 0.00 N ATOM 556 CA TYR A 40 8.903 1.386 0.716 1.00 0.00 C ATOM 557 C TYR A 40 8.349 0.500 1.834 1.00 0.00 C ATOM 558 O TYR A 40 7.494 0.931 2.606 1.00 0.00 O ATOM 559 CB TYR A 40 7.771 1.730 -0.255 1.00 0.00 C ATOM 560 CG TYR A 40 8.224 2.519 -1.484 1.00 0.00 C ATOM 561 CD1 TYR A 40 8.325 3.894 -1.423 1.00 0.00 C ATOM 562 CD2 TYR A 40 8.532 1.856 -2.655 1.00 0.00 C ATOM 563 CE1 TYR A 40 8.752 4.637 -2.581 1.00 0.00 C ATOM 564 CE2 TYR A 40 8.958 2.598 -3.813 1.00 0.00 C ATOM 565 CZ TYR A 40 9.047 3.952 -3.718 1.00 0.00 C ATOM 566 OH TYR A 40 9.450 4.654 -4.812 1.00 0.00 O ATOM 0 H TYR A 40 9.581 -0.209 -0.459 1.00 0.00 H new ATOM 0 HA TYR A 40 9.339 2.271 1.180 1.00 0.00 H new ATOM 0 HB2 TYR A 40 7.295 0.806 -0.584 1.00 0.00 H new ATOM 0 HB3 TYR A 40 7.014 2.307 0.276 1.00 0.00 H new ATOM 0 HD1 TYR A 40 8.084 4.413 -0.507 1.00 0.00 H new ATOM 0 HD2 TYR A 40 8.453 0.780 -2.703 1.00 0.00 H new ATOM 0 HE1 TYR A 40 8.836 5.713 -2.547 1.00 0.00 H new ATOM 0 HE2 TYR A 40 9.201 2.091 -4.735 1.00 0.00 H new ATOM 0 HH TYR A 40 10.351 5.007 -4.660 1.00 0.00 H new ATOM 576 N LYS A 41 8.859 -0.721 1.885 1.00 0.00 N ATOM 577 CA LYS A 41 8.426 -1.672 2.895 1.00 0.00 C ATOM 578 C LYS A 41 8.748 -1.115 4.284 1.00 0.00 C ATOM 579 O LYS A 41 8.139 -1.517 5.274 1.00 0.00 O ATOM 580 CB LYS A 41 9.033 -3.050 2.629 1.00 0.00 C ATOM 581 CG LYS A 41 10.451 -3.144 3.196 1.00 0.00 C ATOM 582 CD LYS A 41 11.025 -4.550 3.009 1.00 0.00 C ATOM 583 CE LYS A 41 12.497 -4.601 3.421 1.00 0.00 C ATOM 584 NZ LYS A 41 12.621 -4.788 4.884 1.00 0.00 N ATOM 0 H LYS A 41 9.569 -1.074 1.243 1.00 0.00 H new ATOM 0 HA LYS A 41 7.346 -1.812 2.849 1.00 0.00 H new ATOM 0 HB2 LYS A 41 8.406 -3.820 3.078 1.00 0.00 H new ATOM 0 HB3 LYS A 41 9.053 -3.241 1.556 1.00 0.00 H new ATOM 0 HG2 LYS A 41 11.094 -2.416 2.700 1.00 0.00 H new ATOM 0 HG3 LYS A 41 10.440 -2.890 4.256 1.00 0.00 H new ATOM 0 HD2 LYS A 41 10.453 -5.262 3.603 1.00 0.00 H new ATOM 0 HD3 LYS A 41 10.925 -4.852 1.966 1.00 0.00 H new ATOM 0 HE2 LYS A 41 12.998 -5.417 2.901 1.00 0.00 H new ATOM 0 HE3 LYS A 41 12.996 -3.679 3.123 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 13.627 -4.820 5.146 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 12.161 -3.996 5.376 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 12.163 -5.680 5.160 1.00 0.00 H new ATOM 598 N ASP A 42 9.706 -0.200 4.312 1.00 0.00 N ATOM 599 CA ASP A 42 10.116 0.415 5.563 1.00 0.00 C ATOM 600 C ASP A 42 9.531 1.826 5.648 1.00 0.00 C ATOM 601 O ASP A 42 9.506 2.427 6.721 1.00 0.00 O ATOM 602 CB ASP A 42 11.640 0.529 5.646 1.00 0.00 C ATOM 603 CG ASP A 42 12.247 1.682 4.844 1.00 0.00 C ATOM 604 OD1 ASP A 42 12.305 1.541 3.603 1.00 0.00 O ATOM 605 OD2 ASP A 42 12.640 2.678 5.489 1.00 0.00 O ATOM 0 H ASP A 42 10.210 0.130 3.489 1.00 0.00 H new ATOM 0 HA ASP A 42 9.756 -0.209 6.381 1.00 0.00 H new ATOM 0 HB2 ASP A 42 11.924 0.645 6.692 1.00 0.00 H new ATOM 0 HB3 ASP A 42 12.079 -0.406 5.298 1.00 0.00 H new ATOM 610 N ARG A 43 9.075 2.313 4.504 1.00 0.00 N ATOM 611 CA ARG A 43 8.491 3.642 4.436 1.00 0.00 C ATOM 612 C ARG A 43 7.134 3.662 5.141 1.00 0.00 C ATOM 613 O ARG A 43 6.587 4.730 5.412 1.00 0.00 O ATOM 614 CB ARG A 43 8.312 4.091 2.984 1.00 0.00 C ATOM 615 CG ARG A 43 9.598 4.715 2.440 1.00 0.00 C ATOM 616 CD ARG A 43 9.337 6.116 1.885 1.00 0.00 C ATOM 617 NE ARG A 43 9.758 6.187 0.468 1.00 0.00 N ATOM 618 CZ ARG A 43 11.035 6.258 0.067 1.00 0.00 C ATOM 619 NH1 ARG A 43 12.022 6.269 0.973 1.00 0.00 N ATOM 620 NH2 ARG A 43 11.324 6.319 -1.240 1.00 0.00 N ATOM 0 H ARG A 43 9.098 1.811 3.616 1.00 0.00 H new ATOM 0 HA ARG A 43 9.173 4.330 4.935 1.00 0.00 H new ATOM 0 HB2 ARG A 43 8.029 3.237 2.368 1.00 0.00 H new ATOM 0 HB3 ARG A 43 7.498 4.813 2.921 1.00 0.00 H new ATOM 0 HG2 ARG A 43 10.344 4.768 3.233 1.00 0.00 H new ATOM 0 HG3 ARG A 43 10.010 4.080 1.656 1.00 0.00 H new ATOM 0 HD2 ARG A 43 8.278 6.358 1.971 1.00 0.00 H new ATOM 0 HD3 ARG A 43 9.881 6.856 2.472 1.00 0.00 H new ATOM 0 HE ARG A 43 9.031 6.182 -0.248 1.00 0.00 H new ATOM 0 HH11 ARG A 43 11.802 6.223 1.968 1.00 0.00 H new ATOM 0 HH12 ARG A 43 12.994 6.323 0.668 1.00 0.00 H new ATOM 0 HH21 ARG A 43 10.572 6.311 -1.929 1.00 0.00 H new ATOM 0 HH22 ARG A 43 12.296 6.373 -1.545 1.00 0.00 H new ATOM 634 N PHE A 44 6.629 2.469 5.418 1.00 0.00 N ATOM 635 CA PHE A 44 5.345 2.336 6.086 1.00 0.00 C ATOM 636 C PHE A 44 5.055 0.874 6.429 1.00 0.00 C ATOM 637 O PHE A 44 5.854 -0.010 6.125 1.00 0.00 O ATOM 638 CB PHE A 44 4.279 2.841 5.111 1.00 0.00 C ATOM 639 CG PHE A 44 4.425 2.291 3.691 1.00 0.00 C ATOM 640 CD1 PHE A 44 4.153 0.983 3.436 1.00 0.00 C ATOM 641 CD2 PHE A 44 4.827 3.111 2.682 1.00 0.00 C ATOM 642 CE1 PHE A 44 4.288 0.474 2.118 1.00 0.00 C ATOM 643 CE2 PHE A 44 4.962 2.601 1.364 1.00 0.00 C ATOM 644 CZ PHE A 44 4.690 1.293 1.109 1.00 0.00 C ATOM 0 H PHE A 44 7.086 1.585 5.192 1.00 0.00 H new ATOM 0 HA PHE A 44 5.348 2.905 7.015 1.00 0.00 H new ATOM 0 HB2 PHE A 44 3.294 2.573 5.494 1.00 0.00 H new ATOM 0 HB3 PHE A 44 4.321 3.930 5.074 1.00 0.00 H new ATOM 0 HD1 PHE A 44 3.834 0.332 4.236 1.00 0.00 H new ATOM 0 HD2 PHE A 44 5.043 4.150 2.884 1.00 0.00 H new ATOM 0 HE1 PHE A 44 4.071 -0.565 1.916 1.00 0.00 H new ATOM 0 HE2 PHE A 44 5.281 3.252 0.563 1.00 0.00 H new ATOM 0 HZ PHE A 44 4.793 0.905 0.106 1.00 0.00 H new ATOM 654 N ILE A 45 3.907 0.664 7.058 1.00 0.00 N ATOM 655 CA ILE A 45 3.501 -0.676 7.446 1.00 0.00 C ATOM 656 C ILE A 45 2.579 -1.256 6.372 1.00 0.00 C ATOM 657 O ILE A 45 1.386 -0.958 6.346 1.00 0.00 O ATOM 658 CB ILE A 45 2.884 -0.665 8.846 1.00 0.00 C ATOM 659 CG1 ILE A 45 3.917 -0.256 9.898 1.00 0.00 C ATOM 660 CG2 ILE A 45 2.237 -2.012 9.171 1.00 0.00 C ATOM 661 CD1 ILE A 45 3.236 0.313 11.144 1.00 0.00 C ATOM 0 H ILE A 45 3.246 1.399 7.308 1.00 0.00 H new ATOM 0 HA ILE A 45 4.368 -1.333 7.511 1.00 0.00 H new ATOM 0 HB ILE A 45 2.093 0.084 8.864 1.00 0.00 H new ATOM 0 HG12 ILE A 45 4.523 -1.120 10.173 1.00 0.00 H new ATOM 0 HG13 ILE A 45 4.594 0.488 9.478 1.00 0.00 H new ATOM 0 HG21 ILE A 45 1.806 -1.977 10.172 1.00 0.00 H new ATOM 0 HG22 ILE A 45 1.452 -2.223 8.445 1.00 0.00 H new ATOM 0 HG23 ILE A 45 2.991 -2.798 9.128 1.00 0.00 H new ATOM 0 HD11 ILE A 45 3.993 0.596 11.875 1.00 0.00 H new ATOM 0 HD12 ILE A 45 2.651 1.191 10.870 1.00 0.00 H new ATOM 0 HD13 ILE A 45 2.578 -0.441 11.576 1.00 0.00 H new ATOM 673 N LEU A 46 3.167 -2.074 5.511 1.00 0.00 N ATOM 674 CA LEU A 46 2.412 -2.698 4.437 1.00 0.00 C ATOM 675 C LEU A 46 1.520 -3.796 5.018 1.00 0.00 C ATOM 676 O LEU A 46 2.011 -4.842 5.439 1.00 0.00 O ATOM 677 CB LEU A 46 3.354 -3.189 3.336 1.00 0.00 C ATOM 678 CG LEU A 46 2.684 -3.786 2.097 1.00 0.00 C ATOM 679 CD1 LEU A 46 1.808 -2.748 1.394 1.00 0.00 C ATOM 680 CD2 LEU A 46 3.722 -4.395 1.152 1.00 0.00 C ATOM 0 H LEU A 46 4.157 -2.319 5.535 1.00 0.00 H new ATOM 0 HA LEU A 46 1.754 -1.971 3.961 1.00 0.00 H new ATOM 0 HB2 LEU A 46 3.978 -2.353 3.020 1.00 0.00 H new ATOM 0 HB3 LEU A 46 4.019 -3.940 3.762 1.00 0.00 H new ATOM 0 HG LEU A 46 2.029 -4.595 2.419 1.00 0.00 H new ATOM 0 HD11 LEU A 46 1.343 -3.198 0.517 1.00 0.00 H new ATOM 0 HD12 LEU A 46 1.033 -2.403 2.078 1.00 0.00 H new ATOM 0 HD13 LEU A 46 2.423 -1.902 1.085 1.00 0.00 H new ATOM 0 HD21 LEU A 46 3.219 -4.812 0.280 1.00 0.00 H new ATOM 0 HD22 LEU A 46 4.421 -3.622 0.833 1.00 0.00 H new ATOM 0 HD23 LEU A 46 4.266 -5.185 1.670 1.00 0.00 H new ATOM 692 N GLN A 47 0.224 -3.520 5.023 1.00 0.00 N ATOM 693 CA GLN A 47 -0.742 -4.471 5.546 1.00 0.00 C ATOM 694 C GLN A 47 -1.290 -5.346 4.416 1.00 0.00 C ATOM 695 O GLN A 47 -2.190 -4.932 3.687 1.00 0.00 O ATOM 696 CB GLN A 47 -1.875 -3.754 6.283 1.00 0.00 C ATOM 697 CG GLN A 47 -2.448 -4.633 7.396 1.00 0.00 C ATOM 698 CD GLN A 47 -3.795 -4.095 7.882 1.00 0.00 C ATOM 699 OE1 GLN A 47 -4.827 -4.735 7.766 1.00 0.00 O ATOM 700 NE2 GLN A 47 -3.728 -2.885 8.430 1.00 0.00 N ATOM 0 H GLN A 47 -0.180 -2.651 4.673 1.00 0.00 H new ATOM 0 HA GLN A 47 -0.236 -5.115 6.266 1.00 0.00 H new ATOM 0 HB2 GLN A 47 -1.505 -2.820 6.706 1.00 0.00 H new ATOM 0 HB3 GLN A 47 -2.664 -3.493 5.578 1.00 0.00 H new ATOM 0 HG2 GLN A 47 -2.570 -5.653 7.032 1.00 0.00 H new ATOM 0 HG3 GLN A 47 -1.747 -4.674 8.229 1.00 0.00 H new ATOM 0 HE21 GLN A 47 -2.831 -2.404 8.496 1.00 0.00 H new ATOM 0 HE22 GLN A 47 -4.574 -2.438 8.784 1.00 0.00 H new ATOM 709 N GLU A 48 -0.725 -6.539 4.308 1.00 0.00 N ATOM 710 CA GLU A 48 -1.146 -7.475 3.280 1.00 0.00 C ATOM 711 C GLU A 48 -2.431 -8.190 3.706 1.00 0.00 C ATOM 712 O GLU A 48 -2.391 -9.116 4.515 1.00 0.00 O ATOM 713 CB GLU A 48 -0.037 -8.482 2.967 1.00 0.00 C ATOM 714 CG GLU A 48 0.739 -8.071 1.714 1.00 0.00 C ATOM 715 CD GLU A 48 2.207 -8.492 1.816 1.00 0.00 C ATOM 716 OE1 GLU A 48 2.437 -9.709 1.984 1.00 0.00 O ATOM 717 OE2 GLU A 48 3.065 -7.588 1.722 1.00 0.00 O ATOM 0 H GLU A 48 0.021 -6.879 4.915 1.00 0.00 H new ATOM 0 HA GLU A 48 -1.350 -6.914 2.368 1.00 0.00 H new ATOM 0 HB2 GLU A 48 0.645 -8.553 3.815 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -0.470 -9.472 2.823 1.00 0.00 H new ATOM 0 HG2 GLU A 48 0.286 -8.529 0.835 1.00 0.00 H new ATOM 0 HG3 GLU A 48 0.675 -6.991 1.580 1.00 0.00 H new ATOM 724 N VAL A 49 -3.539 -7.733 3.142 1.00 0.00 N ATOM 725 CA VAL A 49 -4.833 -8.317 3.454 1.00 0.00 C ATOM 726 C VAL A 49 -5.099 -9.489 2.507 1.00 0.00 C ATOM 727 O VAL A 49 -4.809 -9.407 1.315 1.00 0.00 O ATOM 728 CB VAL A 49 -5.920 -7.242 3.395 1.00 0.00 C ATOM 729 CG1 VAL A 49 -7.306 -7.851 3.618 1.00 0.00 C ATOM 730 CG2 VAL A 49 -5.642 -6.126 4.404 1.00 0.00 C ATOM 0 H VAL A 49 -3.568 -6.965 2.471 1.00 0.00 H new ATOM 0 HA VAL A 49 -4.840 -8.711 4.470 1.00 0.00 H new ATOM 0 HB VAL A 49 -5.904 -6.803 2.397 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -8.060 -7.066 3.571 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -7.506 -8.593 2.845 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -7.340 -8.329 4.597 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -6.429 -5.375 4.342 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -5.618 -6.543 5.411 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -4.681 -5.664 4.180 1.00 0.00 H new ATOM 740 N ASP A 50 -5.649 -10.553 3.075 1.00 0.00 N ATOM 741 CA ASP A 50 -5.958 -11.740 2.296 1.00 0.00 C ATOM 742 C ASP A 50 -7.446 -11.738 1.941 1.00 0.00 C ATOM 743 O ASP A 50 -8.289 -12.050 2.781 1.00 0.00 O ATOM 744 CB ASP A 50 -5.664 -13.013 3.093 1.00 0.00 C ATOM 745 CG ASP A 50 -4.197 -13.448 3.098 1.00 0.00 C ATOM 746 OD1 ASP A 50 -3.764 -13.995 2.060 1.00 0.00 O ATOM 747 OD2 ASP A 50 -3.542 -13.225 4.138 1.00 0.00 O ATOM 0 H ASP A 50 -5.888 -10.617 4.064 1.00 0.00 H new ATOM 0 HA ASP A 50 -5.340 -11.725 1.398 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -5.986 -12.861 4.123 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -6.267 -13.825 2.687 1.00 0.00 H new ATOM 752 N ILE A 51 -7.724 -11.385 0.695 1.00 0.00 N ATOM 753 CA ILE A 51 -9.095 -11.338 0.218 1.00 0.00 C ATOM 754 C ILE A 51 -9.576 -12.760 -0.078 1.00 0.00 C ATOM 755 O ILE A 51 -10.772 -13.042 -0.011 1.00 0.00 O ATOM 756 CB ILE A 51 -9.216 -10.388 -0.975 1.00 0.00 C ATOM 757 CG1 ILE A 51 -8.430 -10.914 -2.178 1.00 0.00 C ATOM 758 CG2 ILE A 51 -8.793 -8.969 -0.590 1.00 0.00 C ATOM 759 CD1 ILE A 51 -8.884 -10.234 -3.470 1.00 0.00 C ATOM 0 H ILE A 51 -7.022 -11.129 0.001 1.00 0.00 H new ATOM 0 HA ILE A 51 -9.752 -10.932 0.987 1.00 0.00 H new ATOM 0 HB ILE A 51 -10.264 -10.343 -1.271 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -7.365 -10.739 -2.026 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -8.567 -11.992 -2.263 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -8.888 -8.313 -1.456 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -9.433 -8.604 0.214 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -7.756 -8.977 -0.253 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -8.309 -10.626 -4.309 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -9.944 -10.431 -3.632 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -8.723 -9.159 -3.391 1.00 0.00 H new ATOM 771 N THR A 52 -8.620 -13.620 -0.399 1.00 0.00 N ATOM 772 CA THR A 52 -8.931 -15.005 -0.705 1.00 0.00 C ATOM 773 C THR A 52 -9.680 -15.654 0.461 1.00 0.00 C ATOM 774 O THR A 52 -10.302 -16.703 0.297 1.00 0.00 O ATOM 775 CB THR A 52 -7.623 -15.716 -1.058 1.00 0.00 C ATOM 776 OG1 THR A 52 -6.688 -15.217 -0.105 1.00 0.00 O ATOM 777 CG2 THR A 52 -7.057 -15.266 -2.406 1.00 0.00 C ATOM 0 H THR A 52 -7.629 -13.383 -0.454 1.00 0.00 H new ATOM 0 HA THR A 52 -9.600 -15.080 -1.562 1.00 0.00 H new ATOM 0 HB THR A 52 -7.789 -16.793 -1.076 1.00 0.00 H new ATOM 0 HG1 THR A 52 -5.812 -15.628 -0.260 1.00 0.00 H new ATOM 0 HG21 THR A 52 -6.129 -15.801 -2.608 1.00 0.00 H new ATOM 0 HG22 THR A 52 -7.779 -15.481 -3.194 1.00 0.00 H new ATOM 0 HG23 THR A 52 -6.859 -14.194 -2.378 1.00 0.00 H new ATOM 785 N LEU A 53 -9.595 -15.003 1.612 1.00 0.00 N ATOM 786 CA LEU A 53 -10.257 -15.504 2.805 1.00 0.00 C ATOM 787 C LEU A 53 -11.770 -15.339 2.650 1.00 0.00 C ATOM 788 O LEU A 53 -12.231 -14.510 1.868 1.00 0.00 O ATOM 789 CB LEU A 53 -9.689 -14.829 4.055 1.00 0.00 C ATOM 790 CG LEU A 53 -8.297 -15.288 4.492 1.00 0.00 C ATOM 791 CD1 LEU A 53 -7.831 -14.524 5.732 1.00 0.00 C ATOM 792 CD2 LEU A 53 -8.260 -16.803 4.704 1.00 0.00 C ATOM 0 H LEU A 53 -9.078 -14.134 1.744 1.00 0.00 H new ATOM 0 HA LEU A 53 -10.064 -16.569 2.930 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -9.657 -13.754 3.880 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -10.381 -14.997 4.880 1.00 0.00 H new ATOM 0 HG LEU A 53 -7.595 -15.058 3.690 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -6.839 -14.870 6.021 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -7.793 -13.458 5.509 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -8.529 -14.699 6.551 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -7.259 -17.103 5.014 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -8.977 -17.080 5.477 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -8.517 -17.307 3.772 1.00 0.00 H new ATOM 804 N PRO A 54 -12.520 -16.164 3.429 1.00 0.00 N ATOM 805 CA PRO A 54 -13.972 -16.117 3.386 1.00 0.00 C ATOM 806 C PRO A 54 -14.503 -14.884 4.120 1.00 0.00 C ATOM 807 O PRO A 54 -15.481 -14.274 3.689 1.00 0.00 O ATOM 808 CB PRO A 54 -14.426 -17.424 4.016 1.00 0.00 C ATOM 809 CG PRO A 54 -13.235 -17.942 4.805 1.00 0.00 C ATOM 810 CD PRO A 54 -12.009 -17.158 4.368 1.00 0.00 C ATOM 0 HA PRO A 54 -14.360 -16.022 2.372 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -15.286 -17.266 4.666 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -14.730 -18.140 3.253 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -13.404 -17.821 5.875 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -13.091 -19.007 4.624 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -11.518 -16.684 5.218 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -11.272 -17.807 3.895 1.00 0.00 H new ATOM 818 N GLU A 55 -13.835 -14.553 5.215 1.00 0.00 N ATOM 819 CA GLU A 55 -14.228 -13.404 6.013 1.00 0.00 C ATOM 820 C GLU A 55 -13.953 -12.108 5.247 1.00 0.00 C ATOM 821 O GLU A 55 -14.710 -11.145 5.359 1.00 0.00 O ATOM 822 CB GLU A 55 -13.512 -13.404 7.365 1.00 0.00 C ATOM 823 CG GLU A 55 -11.997 -13.294 7.183 1.00 0.00 C ATOM 824 CD GLU A 55 -11.277 -13.351 8.532 1.00 0.00 C ATOM 825 OE1 GLU A 55 -11.126 -14.480 9.047 1.00 0.00 O ATOM 826 OE2 GLU A 55 -10.894 -12.265 9.017 1.00 0.00 O ATOM 0 H GLU A 55 -13.024 -15.060 5.569 1.00 0.00 H new ATOM 0 HA GLU A 55 -15.299 -13.469 6.207 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -13.871 -12.572 7.970 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -13.751 -14.319 7.907 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -11.644 -14.104 6.544 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -11.755 -12.360 6.677 1.00 0.00 H new ATOM 833 N ASN A 56 -12.868 -12.126 4.487 1.00 0.00 N ATOM 834 CA ASN A 56 -12.484 -10.965 3.703 1.00 0.00 C ATOM 835 C ASN A 56 -13.112 -11.064 2.311 1.00 0.00 C ATOM 836 O ASN A 56 -12.811 -10.258 1.432 1.00 0.00 O ATOM 837 CB ASN A 56 -10.966 -10.892 3.533 1.00 0.00 C ATOM 838 CG ASN A 56 -10.271 -10.704 4.883 1.00 0.00 C ATOM 839 OD1 ASN A 56 -10.709 -9.948 5.735 1.00 0.00 O ATOM 840 ND2 ASN A 56 -9.167 -11.430 5.029 1.00 0.00 N ATOM 0 H ASN A 56 -12.243 -12.927 4.398 1.00 0.00 H new ATOM 0 HA ASN A 56 -12.831 -10.075 4.228 1.00 0.00 H new ATOM 0 HB2 ASN A 56 -10.605 -11.805 3.058 1.00 0.00 H new ATOM 0 HB3 ASN A 56 -10.710 -10.065 2.870 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -8.631 -11.374 5.895 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -8.856 -12.043 4.275 1.00 0.00 H new ATOM 847 N SER A 57 -13.973 -12.059 2.155 1.00 0.00 N ATOM 848 CA SER A 57 -14.645 -12.274 0.885 1.00 0.00 C ATOM 849 C SER A 57 -15.143 -10.940 0.324 1.00 0.00 C ATOM 850 O SER A 57 -15.273 -10.783 -0.889 1.00 0.00 O ATOM 851 CB SER A 57 -15.811 -13.253 1.037 1.00 0.00 C ATOM 852 OG SER A 57 -16.752 -13.134 -0.026 1.00 0.00 O ATOM 0 H SER A 57 -14.221 -12.725 2.887 1.00 0.00 H new ATOM 0 HA SER A 57 -13.928 -12.710 0.189 1.00 0.00 H new ATOM 0 HB2 SER A 57 -15.426 -14.272 1.068 1.00 0.00 H new ATOM 0 HB3 SER A 57 -16.313 -13.073 1.987 1.00 0.00 H new ATOM 0 HG SER A 57 -17.480 -13.777 0.108 1.00 0.00 H new ATOM 858 N THR A 58 -15.409 -10.014 1.233 1.00 0.00 N ATOM 859 CA THR A 58 -15.889 -8.699 0.845 1.00 0.00 C ATOM 860 C THR A 58 -14.772 -7.900 0.172 1.00 0.00 C ATOM 861 O THR A 58 -15.001 -7.232 -0.835 1.00 0.00 O ATOM 862 CB THR A 58 -16.459 -8.017 2.090 1.00 0.00 C ATOM 863 OG1 THR A 58 -17.748 -8.603 2.248 1.00 0.00 O ATOM 864 CG2 THR A 58 -16.750 -6.532 1.863 1.00 0.00 C ATOM 0 H THR A 58 -15.301 -10.149 2.238 1.00 0.00 H new ATOM 0 HA THR A 58 -16.685 -8.772 0.104 1.00 0.00 H new ATOM 0 HB THR A 58 -15.757 -8.127 2.917 1.00 0.00 H new ATOM 0 HG1 THR A 58 -18.188 -8.219 3.035 1.00 0.00 H new ATOM 0 HG21 THR A 58 -17.153 -6.096 2.777 1.00 0.00 H new ATOM 0 HG22 THR A 58 -15.828 -6.018 1.591 1.00 0.00 H new ATOM 0 HG23 THR A 58 -17.477 -6.423 1.058 1.00 0.00 H new ATOM 872 N TRP A 59 -13.586 -7.996 0.754 1.00 0.00 N ATOM 873 CA TRP A 59 -12.432 -7.291 0.223 1.00 0.00 C ATOM 874 C TRP A 59 -12.174 -7.805 -1.194 1.00 0.00 C ATOM 875 O TRP A 59 -11.453 -7.175 -1.966 1.00 0.00 O ATOM 876 CB TRP A 59 -11.221 -7.448 1.145 1.00 0.00 C ATOM 877 CG TRP A 59 -11.214 -6.483 2.333 1.00 0.00 C ATOM 878 CD1 TRP A 59 -11.285 -6.780 3.638 1.00 0.00 C ATOM 879 CD2 TRP A 59 -11.127 -5.044 2.271 1.00 0.00 C ATOM 880 NE1 TRP A 59 -11.250 -5.643 4.418 1.00 0.00 N ATOM 881 CE2 TRP A 59 -11.151 -4.553 3.560 1.00 0.00 C ATOM 882 CE3 TRP A 59 -11.030 -4.185 1.162 1.00 0.00 C ATOM 883 CZ2 TRP A 59 -11.083 -3.188 3.862 1.00 0.00 C ATOM 884 CZ3 TRP A 59 -10.964 -2.824 1.480 1.00 0.00 C ATOM 885 CH2 TRP A 59 -10.987 -2.313 2.773 1.00 0.00 C ATOM 0 H TRP A 59 -13.399 -8.552 1.589 1.00 0.00 H new ATOM 0 HA TRP A 59 -12.624 -6.219 0.175 1.00 0.00 H new ATOM 0 HB2 TRP A 59 -11.193 -8.471 1.521 1.00 0.00 H new ATOM 0 HB3 TRP A 59 -10.312 -7.298 0.563 1.00 0.00 H new ATOM 0 HD1 TRP A 59 -11.360 -7.784 4.030 1.00 0.00 H new ATOM 0 HE1 TRP A 59 -11.289 -5.608 5.437 1.00 0.00 H new ATOM 0 HE3 TRP A 59 -11.008 -4.547 0.145 1.00 0.00 H new ATOM 0 HZ2 TRP A 59 -11.103 -2.829 4.880 1.00 0.00 H new ATOM 0 HZ3 TRP A 59 -10.890 -2.121 0.664 1.00 0.00 H new ATOM 0 HH2 TRP A 59 -10.931 -1.247 2.936 1.00 0.00 H new ATOM 896 N TYR A 60 -12.779 -8.945 -1.495 1.00 0.00 N ATOM 897 CA TYR A 60 -12.624 -9.551 -2.806 1.00 0.00 C ATOM 898 C TYR A 60 -13.789 -9.176 -3.725 1.00 0.00 C ATOM 899 O TYR A 60 -13.578 -8.662 -4.822 1.00 0.00 O ATOM 900 CB TYR A 60 -12.639 -11.064 -2.576 1.00 0.00 C ATOM 901 CG TYR A 60 -12.308 -11.886 -3.823 1.00 0.00 C ATOM 902 CD1 TYR A 60 -13.267 -12.080 -4.796 1.00 0.00 C ATOM 903 CD2 TYR A 60 -11.050 -12.434 -3.975 1.00 0.00 C ATOM 904 CE1 TYR A 60 -12.955 -12.854 -5.970 1.00 0.00 C ATOM 905 CE2 TYR A 60 -10.739 -13.208 -5.148 1.00 0.00 C ATOM 906 CZ TYR A 60 -11.707 -13.380 -6.088 1.00 0.00 C ATOM 907 OH TYR A 60 -11.412 -14.111 -7.197 1.00 0.00 O ATOM 0 H TYR A 60 -13.377 -9.465 -0.853 1.00 0.00 H new ATOM 0 HA TYR A 60 -11.704 -9.209 -3.280 1.00 0.00 H new ATOM 0 HB2 TYR A 60 -11.923 -11.309 -1.791 1.00 0.00 H new ATOM 0 HB3 TYR A 60 -13.624 -11.356 -2.212 1.00 0.00 H new ATOM 0 HD1 TYR A 60 -14.251 -11.652 -4.677 1.00 0.00 H new ATOM 0 HD2 TYR A 60 -10.299 -12.282 -3.214 1.00 0.00 H new ATOM 0 HE1 TYR A 60 -13.696 -13.013 -6.739 1.00 0.00 H new ATOM 0 HE2 TYR A 60 -9.759 -13.642 -5.279 1.00 0.00 H new ATOM 0 HH TYR A 60 -10.484 -14.423 -7.146 1.00 0.00 H new ATOM 917 N GLU A 61 -14.992 -9.447 -3.242 1.00 0.00 N ATOM 918 CA GLU A 61 -16.191 -9.144 -4.006 1.00 0.00 C ATOM 919 C GLU A 61 -16.162 -7.691 -4.484 1.00 0.00 C ATOM 920 O GLU A 61 -16.859 -7.332 -5.432 1.00 0.00 O ATOM 921 CB GLU A 61 -17.450 -9.426 -3.184 1.00 0.00 C ATOM 922 CG GLU A 61 -17.665 -10.930 -3.008 1.00 0.00 C ATOM 923 CD GLU A 61 -19.156 -11.267 -2.934 1.00 0.00 C ATOM 924 OE1 GLU A 61 -19.762 -10.930 -1.895 1.00 0.00 O ATOM 925 OE2 GLU A 61 -19.655 -11.853 -3.919 1.00 0.00 O ATOM 0 H GLU A 61 -15.163 -9.873 -2.331 1.00 0.00 H new ATOM 0 HA GLU A 61 -16.215 -9.793 -4.881 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -17.365 -8.951 -2.207 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -18.317 -8.987 -3.678 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -17.208 -11.466 -3.840 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -17.167 -11.268 -2.099 1.00 0.00 H new ATOM 932 N ARG A 62 -15.348 -6.894 -3.807 1.00 0.00 N ATOM 933 CA ARG A 62 -15.220 -5.488 -4.151 1.00 0.00 C ATOM 934 C ARG A 62 -13.968 -5.263 -5.002 1.00 0.00 C ATOM 935 O ARG A 62 -13.960 -4.407 -5.886 1.00 0.00 O ATOM 936 CB ARG A 62 -15.137 -4.619 -2.895 1.00 0.00 C ATOM 937 CG ARG A 62 -13.768 -4.752 -2.225 1.00 0.00 C ATOM 938 CD ARG A 62 -13.631 -3.772 -1.058 1.00 0.00 C ATOM 939 NE ARG A 62 -14.040 -2.415 -1.485 1.00 0.00 N ATOM 940 CZ ARG A 62 -14.337 -1.419 -0.639 1.00 0.00 C ATOM 941 NH1 ARG A 62 -14.273 -1.622 0.684 1.00 0.00 N ATOM 942 NH2 ARG A 62 -14.699 -0.220 -1.117 1.00 0.00 N ATOM 0 H ARG A 62 -14.771 -7.195 -3.022 1.00 0.00 H new ATOM 0 HA ARG A 62 -16.106 -5.203 -4.718 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -15.318 -3.577 -3.157 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -15.919 -4.911 -2.194 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -13.633 -5.772 -1.866 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -12.982 -4.565 -2.956 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -14.249 -4.101 -0.222 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -12.600 -3.756 -0.705 1.00 0.00 H new ATOM 0 HE ARG A 62 -14.099 -2.226 -2.486 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -13.998 -2.535 1.047 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -14.499 -0.864 1.328 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -14.748 -0.066 -2.124 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -14.925 0.538 -0.474 1.00 0.00 H new ATOM 956 N TYR A 63 -12.941 -6.044 -4.705 1.00 0.00 N ATOM 957 CA TYR A 63 -11.687 -5.941 -5.432 1.00 0.00 C ATOM 958 C TYR A 63 -11.201 -7.318 -5.886 1.00 0.00 C ATOM 959 O TYR A 63 -10.222 -7.842 -5.355 1.00 0.00 O ATOM 960 CB TYR A 63 -10.674 -5.356 -4.445 1.00 0.00 C ATOM 961 CG TYR A 63 -10.966 -3.910 -4.038 1.00 0.00 C ATOM 962 CD1 TYR A 63 -11.319 -2.981 -4.996 1.00 0.00 C ATOM 963 CD2 TYR A 63 -10.875 -3.534 -2.713 1.00 0.00 C ATOM 964 CE1 TYR A 63 -11.593 -1.620 -4.614 1.00 0.00 C ATOM 965 CE2 TYR A 63 -11.150 -2.173 -2.331 1.00 0.00 C ATOM 966 CZ TYR A 63 -11.495 -1.284 -3.300 1.00 0.00 C ATOM 967 OH TYR A 63 -11.754 0.002 -2.938 1.00 0.00 O ATOM 0 H TYR A 63 -12.951 -6.752 -3.970 1.00 0.00 H new ATOM 0 HA TYR A 63 -11.809 -5.323 -6.322 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -10.654 -5.978 -3.550 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -9.680 -5.404 -4.889 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -11.390 -3.275 -6.033 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -10.598 -4.260 -1.963 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -11.870 -0.883 -5.354 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -11.084 -1.865 -1.298 1.00 0.00 H new ATOM 0 HH TYR A 63 -11.646 0.097 -1.969 1.00 0.00 H new ATOM 977 N LYS A 64 -11.906 -7.867 -6.864 1.00 0.00 N ATOM 978 CA LYS A 64 -11.559 -9.173 -7.396 1.00 0.00 C ATOM 979 C LYS A 64 -10.989 -9.010 -8.807 1.00 0.00 C ATOM 980 O LYS A 64 -10.524 -9.977 -9.408 1.00 0.00 O ATOM 981 CB LYS A 64 -12.761 -10.118 -7.324 1.00 0.00 C ATOM 982 CG LYS A 64 -13.903 -9.621 -8.212 1.00 0.00 C ATOM 983 CD LYS A 64 -15.194 -10.390 -7.926 1.00 0.00 C ATOM 984 CE LYS A 64 -16.409 -9.461 -7.980 1.00 0.00 C ATOM 985 NZ LYS A 64 -17.348 -9.771 -6.880 1.00 0.00 N ATOM 0 H LYS A 64 -12.717 -7.430 -7.302 1.00 0.00 H new ATOM 0 HA LYS A 64 -10.781 -9.637 -6.789 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -12.461 -11.118 -7.637 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -13.105 -10.196 -6.293 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -14.064 -8.557 -8.042 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -13.630 -9.738 -9.261 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -15.313 -11.192 -8.654 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -15.133 -10.858 -6.943 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -16.084 -8.423 -7.907 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -16.915 -9.570 -8.939 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -18.265 -10.060 -7.277 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -16.962 -10.545 -6.302 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -17.478 -8.927 -6.286 1.00 0.00 H new ATOM 999 N PHE A 65 -11.045 -7.779 -9.294 1.00 0.00 N ATOM 1000 CA PHE A 65 -10.540 -7.477 -10.623 1.00 0.00 C ATOM 1001 C PHE A 65 -9.872 -6.101 -10.655 1.00 0.00 C ATOM 1002 O PHE A 65 -9.615 -5.557 -11.728 1.00 0.00 O ATOM 1003 CB PHE A 65 -11.744 -7.469 -11.567 1.00 0.00 C ATOM 1004 CG PHE A 65 -13.028 -6.930 -10.934 1.00 0.00 C ATOM 1005 CD1 PHE A 65 -13.110 -5.622 -10.571 1.00 0.00 C ATOM 1006 CD2 PHE A 65 -14.088 -7.758 -10.735 1.00 0.00 C ATOM 1007 CE1 PHE A 65 -14.302 -5.121 -9.983 1.00 0.00 C ATOM 1008 CE2 PHE A 65 -15.280 -7.258 -10.147 1.00 0.00 C ATOM 1009 CZ PHE A 65 -15.362 -5.950 -9.784 1.00 0.00 C ATOM 0 H PHE A 65 -11.432 -6.980 -8.793 1.00 0.00 H new ATOM 0 HA PHE A 65 -9.797 -8.219 -10.917 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -11.502 -6.866 -12.442 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -11.923 -8.485 -11.919 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -12.269 -4.964 -10.730 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -14.023 -8.797 -11.024 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -14.367 -4.082 -9.694 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -16.121 -7.916 -9.988 1.00 0.00 H new ATOM 0 HZ PHE A 65 -16.269 -5.569 -9.338 1.00 0.00 H new ATOM 1019 N ASP A 66 -9.609 -5.578 -9.467 1.00 0.00 N ATOM 1020 CA ASP A 66 -8.975 -4.276 -9.346 1.00 0.00 C ATOM 1021 C ASP A 66 -7.563 -4.451 -8.783 1.00 0.00 C ATOM 1022 O ASP A 66 -6.611 -3.864 -9.294 1.00 0.00 O ATOM 1023 CB ASP A 66 -9.756 -3.370 -8.391 1.00 0.00 C ATOM 1024 CG ASP A 66 -11.273 -3.566 -8.409 1.00 0.00 C ATOM 1025 OD1 ASP A 66 -11.693 -4.743 -8.429 1.00 0.00 O ATOM 1026 OD2 ASP A 66 -11.979 -2.534 -8.404 1.00 0.00 O ATOM 0 H ASP A 66 -9.823 -6.032 -8.579 1.00 0.00 H new ATOM 0 HA ASP A 66 -8.949 -3.820 -10.336 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -9.395 -3.540 -7.377 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -9.536 -2.331 -8.638 1.00 0.00 H new ATOM 1031 N ILE A 67 -7.474 -5.260 -7.738 1.00 0.00 N ATOM 1032 CA ILE A 67 -6.194 -5.520 -7.100 1.00 0.00 C ATOM 1033 C ILE A 67 -5.096 -5.557 -8.166 1.00 0.00 C ATOM 1034 O ILE A 67 -5.372 -5.809 -9.338 1.00 0.00 O ATOM 1035 CB ILE A 67 -6.268 -6.789 -6.248 1.00 0.00 C ATOM 1036 CG1 ILE A 67 -6.979 -7.914 -7.001 1.00 0.00 C ATOM 1037 CG2 ILE A 67 -6.920 -6.502 -4.894 1.00 0.00 C ATOM 1038 CD1 ILE A 67 -7.120 -9.158 -6.122 1.00 0.00 C ATOM 0 H ILE A 67 -8.267 -5.744 -7.317 1.00 0.00 H new ATOM 0 HA ILE A 67 -5.941 -4.715 -6.410 1.00 0.00 H new ATOM 0 HB ILE A 67 -5.251 -7.128 -6.050 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -7.965 -7.576 -7.320 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -6.420 -8.163 -7.903 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -6.961 -7.420 -4.308 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -6.334 -5.755 -4.359 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -7.931 -6.126 -5.050 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -7.629 -9.943 -6.681 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -6.131 -9.507 -5.824 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -7.700 -8.911 -5.233 1.00 0.00 H new ATOM 1050 N PRO A 68 -3.842 -5.297 -7.708 1.00 0.00 N ATOM 1051 CA PRO A 68 -3.603 -5.009 -6.304 1.00 0.00 C ATOM 1052 C PRO A 68 -4.063 -3.594 -5.948 1.00 0.00 C ATOM 1053 O PRO A 68 -3.795 -2.646 -6.685 1.00 0.00 O ATOM 1054 CB PRO A 68 -2.109 -5.214 -6.110 1.00 0.00 C ATOM 1055 CG PRO A 68 -1.496 -5.155 -7.500 1.00 0.00 C ATOM 1056 CD PRO A 68 -2.624 -5.270 -8.512 1.00 0.00 C ATOM 0 HA PRO A 68 -4.171 -5.659 -5.639 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -1.689 -4.442 -5.465 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -1.905 -6.173 -5.634 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -0.953 -4.220 -7.638 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -0.778 -5.964 -7.635 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -2.624 -4.427 -9.203 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -2.526 -6.174 -9.113 1.00 0.00 H new ATOM 1064 N VAL A 69 -4.749 -3.496 -4.819 1.00 0.00 N ATOM 1065 CA VAL A 69 -5.250 -2.213 -4.357 1.00 0.00 C ATOM 1066 C VAL A 69 -4.396 -1.730 -3.183 1.00 0.00 C ATOM 1067 O VAL A 69 -4.013 -2.521 -2.322 1.00 0.00 O ATOM 1068 CB VAL A 69 -6.736 -2.326 -4.008 1.00 0.00 C ATOM 1069 CG1 VAL A 69 -7.264 -1.012 -3.429 1.00 0.00 C ATOM 1070 CG2 VAL A 69 -7.554 -2.756 -5.227 1.00 0.00 C ATOM 0 H VAL A 69 -4.970 -4.284 -4.210 1.00 0.00 H new ATOM 0 HA VAL A 69 -5.171 -1.466 -5.146 1.00 0.00 H new ATOM 0 HB VAL A 69 -6.844 -3.096 -3.244 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -8.322 -1.119 -3.189 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -6.710 -0.765 -2.523 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -7.137 -0.215 -4.161 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -8.606 -2.829 -4.952 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -7.437 -2.020 -6.022 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -7.203 -3.727 -5.577 1.00 0.00 H new ATOM 1080 N PHE A 70 -4.121 -0.434 -3.186 1.00 0.00 N ATOM 1081 CA PHE A 70 -3.319 0.164 -2.132 1.00 0.00 C ATOM 1082 C PHE A 70 -4.082 1.291 -1.435 1.00 0.00 C ATOM 1083 O PHE A 70 -4.524 2.239 -2.082 1.00 0.00 O ATOM 1084 CB PHE A 70 -2.069 0.745 -2.797 1.00 0.00 C ATOM 1085 CG PHE A 70 -1.177 -0.302 -3.467 1.00 0.00 C ATOM 1086 CD1 PHE A 70 -1.420 -0.680 -4.751 1.00 0.00 C ATOM 1087 CD2 PHE A 70 -0.141 -0.853 -2.780 1.00 0.00 C ATOM 1088 CE1 PHE A 70 -0.592 -1.651 -5.374 1.00 0.00 C ATOM 1089 CE2 PHE A 70 0.687 -1.825 -3.403 1.00 0.00 C ATOM 1090 CZ PHE A 70 0.444 -2.203 -4.686 1.00 0.00 C ATOM 0 H PHE A 70 -4.439 0.219 -3.902 1.00 0.00 H new ATOM 0 HA PHE A 70 -3.070 -0.587 -1.382 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -2.375 1.478 -3.543 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -1.485 1.278 -2.047 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -2.243 -0.242 -5.297 1.00 0.00 H new ATOM 0 HD2 PHE A 70 0.052 -0.552 -1.761 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -0.785 -1.951 -6.393 1.00 0.00 H new ATOM 0 HE2 PHE A 70 1.509 -2.264 -2.857 1.00 0.00 H new ATOM 0 HZ PHE A 70 1.074 -2.942 -5.159 1.00 0.00 H new ATOM 1100 N HIS A 71 -4.214 1.150 -0.124 1.00 0.00 N ATOM 1101 CA HIS A 71 -4.916 2.145 0.669 1.00 0.00 C ATOM 1102 C HIS A 71 -3.940 2.807 1.644 1.00 0.00 C ATOM 1103 O HIS A 71 -3.314 2.129 2.457 1.00 0.00 O ATOM 1104 CB HIS A 71 -6.126 1.526 1.370 1.00 0.00 C ATOM 1105 CG HIS A 71 -7.140 0.923 0.428 1.00 0.00 C ATOM 1106 ND1 HIS A 71 -8.248 0.219 0.868 1.00 0.00 N ATOM 1107 CD2 HIS A 71 -7.204 0.927 -0.935 1.00 0.00 C ATOM 1108 CE1 HIS A 71 -8.939 -0.179 -0.190 1.00 0.00 C ATOM 1109 NE2 HIS A 71 -8.290 0.260 -1.307 1.00 0.00 N ATOM 0 H HIS A 71 -3.847 0.362 0.409 1.00 0.00 H new ATOM 0 HA HIS A 71 -5.308 2.925 0.016 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -5.779 0.754 2.057 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -6.615 2.292 1.972 1.00 0.00 H new ATOM 0 HD1 HIS A 71 -8.491 0.037 1.842 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -6.492 1.394 -1.599 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -9.855 -0.751 -0.172 1.00 0.00 H new ATOM 1117 N LEU A 72 -3.841 4.123 1.530 1.00 0.00 N ATOM 1118 CA LEU A 72 -2.952 4.884 2.391 1.00 0.00 C ATOM 1119 C LEU A 72 -3.782 5.652 3.422 1.00 0.00 C ATOM 1120 O LEU A 72 -4.531 6.562 3.068 1.00 0.00 O ATOM 1121 CB LEU A 72 -2.031 5.776 1.556 1.00 0.00 C ATOM 1122 CG LEU A 72 -0.530 5.601 1.797 1.00 0.00 C ATOM 1123 CD1 LEU A 72 0.258 6.782 1.227 1.00 0.00 C ATOM 1124 CD2 LEU A 72 -0.235 5.379 3.282 1.00 0.00 C ATOM 0 H LEU A 72 -4.362 4.682 0.854 1.00 0.00 H new ATOM 0 HA LEU A 72 -2.293 4.215 2.945 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -2.234 5.588 0.502 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -2.291 6.816 1.750 1.00 0.00 H new ATOM 0 HG LEU A 72 -0.201 4.708 1.266 1.00 0.00 H new ATOM 0 HD11 LEU A 72 1.322 6.633 1.412 1.00 0.00 H new ATOM 0 HD12 LEU A 72 0.082 6.852 0.154 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -0.068 7.704 1.709 1.00 0.00 H new ATOM 0 HD21 LEU A 72 0.839 5.258 3.425 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -0.583 6.239 3.855 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -0.751 4.482 3.625 1.00 0.00 H new ATOM 1136 N ASN A 73 -3.621 5.258 4.677 1.00 0.00 N ATOM 1137 CA ASN A 73 -4.346 5.898 5.761 1.00 0.00 C ATOM 1138 C ASN A 73 -5.845 5.653 5.581 1.00 0.00 C ATOM 1139 O ASN A 73 -6.628 6.599 5.513 1.00 0.00 O ATOM 1140 CB ASN A 73 -4.111 7.410 5.764 1.00 0.00 C ATOM 1141 CG ASN A 73 -2.939 7.781 6.675 1.00 0.00 C ATOM 1142 OD1 ASN A 73 -3.085 7.970 7.872 1.00 0.00 O ATOM 1143 ND2 ASN A 73 -1.772 7.873 6.045 1.00 0.00 N ATOM 0 H ASN A 73 -2.999 4.503 4.967 1.00 0.00 H new ATOM 0 HA ASN A 73 -3.989 5.476 6.700 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -3.910 7.752 4.749 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -5.013 7.921 6.100 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -0.929 8.114 6.566 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -1.720 7.702 5.041 1.00 0.00 H new ATOM 1150 N GLY A 74 -6.200 4.378 5.510 1.00 0.00 N ATOM 1151 CA GLY A 74 -7.591 3.997 5.339 1.00 0.00 C ATOM 1152 C GLY A 74 -8.240 4.785 4.199 1.00 0.00 C ATOM 1153 O GLY A 74 -9.380 5.230 4.318 1.00 0.00 O ATOM 0 H GLY A 74 -5.548 3.596 5.568 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -7.656 2.929 5.131 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -8.137 4.175 6.266 1.00 0.00 H new ATOM 1157 N GLN A 75 -7.485 4.933 3.121 1.00 0.00 N ATOM 1158 CA GLN A 75 -7.972 5.660 1.960 1.00 0.00 C ATOM 1159 C GLN A 75 -7.279 5.159 0.691 1.00 0.00 C ATOM 1160 O GLN A 75 -6.052 5.177 0.601 1.00 0.00 O ATOM 1161 CB GLN A 75 -7.774 7.167 2.135 1.00 0.00 C ATOM 1162 CG GLN A 75 -8.756 7.953 1.263 1.00 0.00 C ATOM 1163 CD GLN A 75 -10.134 8.031 1.922 1.00 0.00 C ATOM 1164 OE1 GLN A 75 -10.735 7.032 2.283 1.00 0.00 O ATOM 1165 NE2 GLN A 75 -10.599 9.269 2.058 1.00 0.00 N ATOM 0 H GLN A 75 -6.540 4.562 3.026 1.00 0.00 H new ATOM 0 HA GLN A 75 -9.042 5.476 1.862 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -7.915 7.437 3.182 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -6.751 7.436 1.871 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -8.373 8.959 1.094 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -8.842 7.476 0.287 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -10.044 10.061 1.734 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -11.511 9.427 2.487 1.00 0.00 H new ATOM 1174 N PHE A 76 -8.094 4.724 -0.258 1.00 0.00 N ATOM 1175 CA PHE A 76 -7.575 4.220 -1.518 1.00 0.00 C ATOM 1176 C PHE A 76 -6.537 5.177 -2.105 1.00 0.00 C ATOM 1177 O PHE A 76 -6.876 6.279 -2.535 1.00 0.00 O ATOM 1178 CB PHE A 76 -8.759 4.117 -2.480 1.00 0.00 C ATOM 1179 CG PHE A 76 -8.438 4.553 -3.911 1.00 0.00 C ATOM 1180 CD1 PHE A 76 -7.681 3.755 -4.712 1.00 0.00 C ATOM 1181 CD2 PHE A 76 -8.909 5.738 -4.383 1.00 0.00 C ATOM 1182 CE1 PHE A 76 -7.383 4.160 -6.039 1.00 0.00 C ATOM 1183 CE2 PHE A 76 -8.611 6.143 -5.711 1.00 0.00 C ATOM 1184 CZ PHE A 76 -7.854 5.345 -6.511 1.00 0.00 C ATOM 0 H PHE A 76 -9.111 4.710 -0.180 1.00 0.00 H new ATOM 0 HA PHE A 76 -7.093 3.255 -1.363 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -9.112 3.086 -2.496 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -9.577 4.729 -2.100 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -7.307 2.813 -4.338 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -9.510 6.372 -3.748 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -6.782 3.527 -6.674 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -8.985 7.084 -6.086 1.00 0.00 H new ATOM 0 HZ PHE A 76 -7.627 5.653 -7.521 1.00 0.00 H new ATOM 1194 N LEU A 77 -5.292 4.722 -2.106 1.00 0.00 N ATOM 1195 CA LEU A 77 -4.202 5.525 -2.634 1.00 0.00 C ATOM 1196 C LEU A 77 -4.057 5.256 -4.133 1.00 0.00 C ATOM 1197 O LEU A 77 -3.899 6.187 -4.922 1.00 0.00 O ATOM 1198 CB LEU A 77 -2.920 5.277 -1.838 1.00 0.00 C ATOM 1199 CG LEU A 77 -1.706 4.815 -2.647 1.00 0.00 C ATOM 1200 CD1 LEU A 77 -1.096 5.977 -3.433 1.00 0.00 C ATOM 1201 CD2 LEU A 77 -0.677 4.128 -1.747 1.00 0.00 C ATOM 0 H LEU A 77 -5.014 3.808 -1.750 1.00 0.00 H new ATOM 0 HA LEU A 77 -4.420 6.587 -2.520 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -2.656 6.197 -1.317 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -3.129 4.528 -1.075 1.00 0.00 H new ATOM 0 HG LEU A 77 -2.041 4.076 -3.375 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -0.235 5.621 -3.999 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -1.839 6.382 -4.120 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -0.778 6.757 -2.741 1.00 0.00 H new ATOM 0 HD21 LEU A 77 0.176 3.809 -2.347 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -0.341 4.826 -0.980 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -1.132 3.259 -1.272 1.00 0.00 H new ATOM 1213 N MET A 78 -4.115 3.979 -4.482 1.00 0.00 N ATOM 1214 CA MET A 78 -3.991 3.576 -5.872 1.00 0.00 C ATOM 1215 C MET A 78 -4.154 2.062 -6.020 1.00 0.00 C ATOM 1216 O MET A 78 -3.850 1.308 -5.097 1.00 0.00 O ATOM 1217 CB MET A 78 -2.621 3.997 -6.406 1.00 0.00 C ATOM 1218 CG MET A 78 -1.533 3.022 -5.954 1.00 0.00 C ATOM 1219 SD MET A 78 0.077 3.657 -6.391 1.00 0.00 S ATOM 1220 CE MET A 78 1.096 2.723 -5.262 1.00 0.00 C ATOM 0 H MET A 78 -4.246 3.210 -3.825 1.00 0.00 H new ATOM 0 HA MET A 78 -4.779 4.065 -6.444 1.00 0.00 H new ATOM 0 HB2 MET A 78 -2.648 4.038 -7.495 1.00 0.00 H new ATOM 0 HB3 MET A 78 -2.383 5.001 -6.055 1.00 0.00 H new ATOM 0 HG2 MET A 78 -1.593 2.872 -4.876 1.00 0.00 H new ATOM 0 HG3 MET A 78 -1.688 2.049 -6.421 1.00 0.00 H new ATOM 0 HE1 MET A 78 2.144 2.834 -5.540 1.00 0.00 H new ATOM 0 HE2 MET A 78 0.949 3.093 -4.247 1.00 0.00 H new ATOM 0 HE3 MET A 78 0.819 1.670 -5.308 1.00 0.00 H new ATOM 1230 N MET A 79 -4.633 1.662 -7.190 1.00 0.00 N ATOM 1231 CA MET A 79 -4.839 0.252 -7.471 1.00 0.00 C ATOM 1232 C MET A 79 -4.653 -0.043 -8.961 1.00 0.00 C ATOM 1233 O MET A 79 -4.670 0.870 -9.785 1.00 0.00 O ATOM 1234 CB MET A 79 -6.251 -0.153 -7.042 1.00 0.00 C ATOM 1235 CG MET A 79 -7.304 0.722 -7.726 1.00 0.00 C ATOM 1236 SD MET A 79 -8.936 0.076 -7.404 1.00 0.00 S ATOM 1237 CE MET A 79 -9.867 1.599 -7.350 1.00 0.00 C ATOM 0 H MET A 79 -4.884 2.290 -7.953 1.00 0.00 H new ATOM 0 HA MET A 79 -4.101 -0.323 -6.911 1.00 0.00 H new ATOM 0 HB2 MET A 79 -6.425 -1.200 -7.292 1.00 0.00 H new ATOM 0 HB3 MET A 79 -6.346 -0.064 -5.960 1.00 0.00 H new ATOM 0 HG2 MET A 79 -7.231 1.746 -7.361 1.00 0.00 H new ATOM 0 HG3 MET A 79 -7.121 0.753 -8.800 1.00 0.00 H new ATOM 0 HE1 MET A 79 -10.922 1.375 -7.192 1.00 0.00 H new ATOM 0 HE2 MET A 79 -9.501 2.220 -6.533 1.00 0.00 H new ATOM 0 HE3 MET A 79 -9.747 2.132 -8.293 1.00 0.00 H new ATOM 1247 N HIS A 80 -4.481 -1.322 -9.261 1.00 0.00 N ATOM 1248 CA HIS A 80 -4.293 -1.749 -10.637 1.00 0.00 C ATOM 1249 C HIS A 80 -2.808 -1.676 -10.998 1.00 0.00 C ATOM 1250 O HIS A 80 -2.442 -1.811 -12.165 1.00 0.00 O ATOM 1251 CB HIS A 80 -5.174 -0.933 -11.585 1.00 0.00 C ATOM 1252 CG HIS A 80 -6.604 -0.787 -11.120 1.00 0.00 C ATOM 1253 ND1 HIS A 80 -7.571 -0.135 -11.865 1.00 0.00 N ATOM 1254 CD2 HIS A 80 -7.219 -1.215 -9.981 1.00 0.00 C ATOM 1255 CE1 HIS A 80 -8.713 -0.175 -11.194 1.00 0.00 C ATOM 1256 NE2 HIS A 80 -8.493 -0.844 -10.027 1.00 0.00 N ATOM 0 H HIS A 80 -4.468 -2.076 -8.575 1.00 0.00 H new ATOM 0 HA HIS A 80 -4.608 -2.787 -10.745 1.00 0.00 H new ATOM 0 HB2 HIS A 80 -4.739 0.059 -11.706 1.00 0.00 H new ATOM 0 HB3 HIS A 80 -5.168 -1.405 -12.567 1.00 0.00 H new ATOM 0 HD2 HIS A 80 -6.749 -1.763 -9.177 1.00 0.00 H new ATOM 0 HE1 HIS A 80 -9.653 0.248 -11.515 1.00 0.00 H new ATOM 0 HE2 HIS A 80 -9.192 -1.029 -9.308 1.00 0.00 H new ATOM 1264 N ARG A 81 -1.993 -1.462 -9.976 1.00 0.00 N ATOM 1265 CA ARG A 81 -0.556 -1.369 -10.171 1.00 0.00 C ATOM 1266 C ARG A 81 0.097 -0.669 -8.977 1.00 0.00 C ATOM 1267 O ARG A 81 -0.551 -0.437 -7.958 1.00 0.00 O ATOM 1268 CB ARG A 81 -0.222 -0.599 -11.450 1.00 0.00 C ATOM 1269 CG ARG A 81 0.296 -1.542 -12.538 1.00 0.00 C ATOM 1270 CD ARG A 81 1.810 -1.402 -12.708 1.00 0.00 C ATOM 1271 NE ARG A 81 2.484 -2.652 -12.292 1.00 0.00 N ATOM 1272 CZ ARG A 81 3.801 -2.869 -12.406 1.00 0.00 C ATOM 1273 NH1 ARG A 81 4.594 -1.922 -12.924 1.00 0.00 N ATOM 1274 NH2 ARG A 81 4.326 -4.035 -12.003 1.00 0.00 N ATOM 0 H ARG A 81 -2.300 -1.350 -9.010 1.00 0.00 H new ATOM 0 HA ARG A 81 -0.167 -2.383 -10.260 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -1.110 -0.078 -11.808 1.00 0.00 H new ATOM 0 HB3 ARG A 81 0.529 0.162 -11.235 1.00 0.00 H new ATOM 0 HG2 ARG A 81 0.049 -2.572 -12.280 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -0.202 -1.322 -13.482 1.00 0.00 H new ATOM 0 HD2 ARG A 81 2.048 -1.179 -13.748 1.00 0.00 H new ATOM 0 HD3 ARG A 81 2.175 -0.566 -12.111 1.00 0.00 H new ATOM 0 HE ARG A 81 1.910 -3.395 -11.893 1.00 0.00 H new ATOM 0 HH11 ARG A 81 4.195 -1.035 -13.232 1.00 0.00 H new ATOM 0 HH12 ARG A 81 5.597 -2.088 -13.011 1.00 0.00 H new ATOM 0 HH21 ARG A 81 3.723 -4.757 -11.610 1.00 0.00 H new ATOM 0 HH22 ARG A 81 5.329 -4.200 -12.090 1.00 0.00 H new ATOM 1288 N VAL A 82 1.373 -0.352 -9.144 1.00 0.00 N ATOM 1289 CA VAL A 82 2.121 0.317 -8.093 1.00 0.00 C ATOM 1290 C VAL A 82 2.838 1.535 -8.679 1.00 0.00 C ATOM 1291 O VAL A 82 4.015 1.459 -9.028 1.00 0.00 O ATOM 1292 CB VAL A 82 3.075 -0.671 -7.420 1.00 0.00 C ATOM 1293 CG1 VAL A 82 3.825 -0.008 -6.263 1.00 0.00 C ATOM 1294 CG2 VAL A 82 2.328 -1.919 -6.945 1.00 0.00 C ATOM 0 H VAL A 82 1.907 -0.546 -9.991 1.00 0.00 H new ATOM 0 HA VAL A 82 1.447 0.679 -7.316 1.00 0.00 H new ATOM 0 HB VAL A 82 3.811 -0.983 -8.161 1.00 0.00 H new ATOM 0 HG11 VAL A 82 4.496 -0.732 -5.802 1.00 0.00 H new ATOM 0 HG12 VAL A 82 4.404 0.835 -6.640 1.00 0.00 H new ATOM 0 HG13 VAL A 82 3.109 0.347 -5.521 1.00 0.00 H new ATOM 0 HG21 VAL A 82 3.030 -2.605 -6.470 1.00 0.00 H new ATOM 0 HG22 VAL A 82 1.560 -1.632 -6.227 1.00 0.00 H new ATOM 0 HG23 VAL A 82 1.862 -2.411 -7.799 1.00 0.00 H new ATOM 1304 N ASN A 83 2.097 2.630 -8.770 1.00 0.00 N ATOM 1305 CA ASN A 83 2.647 3.863 -9.308 1.00 0.00 C ATOM 1306 C ASN A 83 3.391 4.611 -8.200 1.00 0.00 C ATOM 1307 O ASN A 83 2.880 5.589 -7.656 1.00 0.00 O ATOM 1308 CB ASN A 83 1.539 4.777 -9.835 1.00 0.00 C ATOM 1309 CG ASN A 83 1.082 4.338 -11.227 1.00 0.00 C ATOM 1310 OD1 ASN A 83 0.308 3.408 -11.390 1.00 0.00 O ATOM 1311 ND2 ASN A 83 1.601 5.056 -12.218 1.00 0.00 N ATOM 0 H ASN A 83 1.121 2.689 -8.480 1.00 0.00 H new ATOM 0 HA ASN A 83 3.319 3.604 -10.126 1.00 0.00 H new ATOM 0 HB2 ASN A 83 0.692 4.761 -9.149 1.00 0.00 H new ATOM 0 HB3 ASN A 83 1.899 5.805 -9.874 1.00 0.00 H new ATOM 0 HD21 ASN A 83 1.357 4.842 -13.185 1.00 0.00 H new ATOM 0 HD22 ASN A 83 2.243 5.821 -12.011 1.00 0.00 H new ATOM 1318 N THR A 84 4.585 4.123 -7.898 1.00 0.00 N ATOM 1319 CA THR A 84 5.403 4.734 -6.864 1.00 0.00 C ATOM 1320 C THR A 84 5.218 6.252 -6.865 1.00 0.00 C ATOM 1321 O THR A 84 5.025 6.858 -5.812 1.00 0.00 O ATOM 1322 CB THR A 84 6.853 4.298 -7.090 1.00 0.00 C ATOM 1323 OG1 THR A 84 7.003 4.313 -8.507 1.00 0.00 O ATOM 1324 CG2 THR A 84 7.092 2.837 -6.705 1.00 0.00 C ATOM 0 H THR A 84 5.006 3.312 -8.351 1.00 0.00 H new ATOM 0 HA THR A 84 5.099 4.402 -5.871 1.00 0.00 H new ATOM 0 HB THR A 84 7.519 4.939 -6.512 1.00 0.00 H new ATOM 0 HG1 THR A 84 7.916 4.044 -8.742 1.00 0.00 H new ATOM 0 HG21 THR A 84 8.136 2.579 -6.885 1.00 0.00 H new ATOM 0 HG22 THR A 84 6.860 2.696 -5.649 1.00 0.00 H new ATOM 0 HG23 THR A 84 6.451 2.193 -7.306 1.00 0.00 H new ATOM 1332 N SER A 85 5.283 6.824 -8.058 1.00 0.00 N ATOM 1333 CA SER A 85 5.125 8.260 -8.210 1.00 0.00 C ATOM 1334 C SER A 85 4.028 8.768 -7.272 1.00 0.00 C ATOM 1335 O SER A 85 4.208 9.775 -6.588 1.00 0.00 O ATOM 1336 CB SER A 85 4.797 8.629 -9.658 1.00 0.00 C ATOM 1337 OG SER A 85 5.870 9.323 -10.288 1.00 0.00 O ATOM 0 H SER A 85 5.443 6.318 -8.929 1.00 0.00 H new ATOM 0 HA SER A 85 6.069 8.737 -7.947 1.00 0.00 H new ATOM 0 HB2 SER A 85 4.571 7.723 -10.221 1.00 0.00 H new ATOM 0 HB3 SER A 85 3.901 9.250 -9.680 1.00 0.00 H new ATOM 0 HG SER A 85 5.622 9.539 -11.211 1.00 0.00 H new ATOM 1343 N LYS A 86 2.916 8.048 -7.269 1.00 0.00 N ATOM 1344 CA LYS A 86 1.790 8.412 -6.426 1.00 0.00 C ATOM 1345 C LYS A 86 2.153 8.162 -4.961 1.00 0.00 C ATOM 1346 O LYS A 86 2.191 9.094 -4.159 1.00 0.00 O ATOM 1347 CB LYS A 86 0.524 7.683 -6.879 1.00 0.00 C ATOM 1348 CG LYS A 86 -0.665 8.644 -6.951 1.00 0.00 C ATOM 1349 CD LYS A 86 -1.872 8.080 -6.198 1.00 0.00 C ATOM 1350 CE LYS A 86 -2.277 8.999 -5.044 1.00 0.00 C ATOM 1351 NZ LYS A 86 -3.750 9.096 -4.950 1.00 0.00 N ATOM 0 H LYS A 86 2.771 7.214 -7.837 1.00 0.00 H new ATOM 0 HA LYS A 86 1.570 9.475 -6.523 1.00 0.00 H new ATOM 0 HB2 LYS A 86 0.690 7.231 -7.857 1.00 0.00 H new ATOM 0 HB3 LYS A 86 0.299 6.872 -6.186 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -0.385 9.608 -6.526 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -0.932 8.821 -7.993 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -2.710 7.961 -6.884 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -1.634 7.089 -5.812 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -1.872 8.616 -4.107 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -1.850 9.991 -5.194 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -4.009 9.625 -4.093 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -4.119 9.590 -5.787 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -4.159 8.141 -4.903 1.00 0.00 H new ATOM 1365 N LEU A 87 2.411 6.899 -4.656 1.00 0.00 N ATOM 1366 CA LEU A 87 2.770 6.514 -3.302 1.00 0.00 C ATOM 1367 C LEU A 87 3.701 7.572 -2.706 1.00 0.00 C ATOM 1368 O LEU A 87 3.321 8.288 -1.781 1.00 0.00 O ATOM 1369 CB LEU A 87 3.354 5.100 -3.283 1.00 0.00 C ATOM 1370 CG LEU A 87 4.294 4.778 -2.120 1.00 0.00 C ATOM 1371 CD1 LEU A 87 3.614 5.041 -0.775 1.00 0.00 C ATOM 1372 CD2 LEU A 87 4.824 3.346 -2.224 1.00 0.00 C ATOM 0 H LEU A 87 2.379 6.129 -5.324 1.00 0.00 H new ATOM 0 HA LEU A 87 1.883 6.476 -2.669 1.00 0.00 H new ATOM 0 HB2 LEU A 87 2.529 4.388 -3.265 1.00 0.00 H new ATOM 0 HB3 LEU A 87 3.894 4.939 -4.216 1.00 0.00 H new ATOM 0 HG LEU A 87 5.154 5.445 -2.181 1.00 0.00 H new ATOM 0 HD11 LEU A 87 4.305 4.804 0.034 1.00 0.00 H new ATOM 0 HD12 LEU A 87 3.327 6.091 -0.711 1.00 0.00 H new ATOM 0 HD13 LEU A 87 2.725 4.416 -0.688 1.00 0.00 H new ATOM 0 HD21 LEU A 87 5.490 3.143 -1.385 1.00 0.00 H new ATOM 0 HD22 LEU A 87 3.989 2.646 -2.202 1.00 0.00 H new ATOM 0 HD23 LEU A 87 5.372 3.228 -3.159 1.00 0.00 H new ATOM 1384 N GLU A 88 4.903 7.635 -3.259 1.00 0.00 N ATOM 1385 CA GLU A 88 5.892 8.593 -2.794 1.00 0.00 C ATOM 1386 C GLU A 88 5.232 9.947 -2.521 1.00 0.00 C ATOM 1387 O GLU A 88 5.391 10.512 -1.440 1.00 0.00 O ATOM 1388 CB GLU A 88 7.036 8.734 -3.800 1.00 0.00 C ATOM 1389 CG GLU A 88 7.555 7.362 -4.234 1.00 0.00 C ATOM 1390 CD GLU A 88 9.083 7.356 -4.319 1.00 0.00 C ATOM 1391 OE1 GLU A 88 9.709 7.720 -3.301 1.00 0.00 O ATOM 1392 OE2 GLU A 88 9.590 6.988 -5.401 1.00 0.00 O ATOM 0 H GLU A 88 5.215 7.038 -4.025 1.00 0.00 H new ATOM 0 HA GLU A 88 6.317 8.222 -1.861 1.00 0.00 H new ATOM 0 HB2 GLU A 88 6.692 9.289 -4.672 1.00 0.00 H new ATOM 0 HB3 GLU A 88 7.848 9.310 -3.355 1.00 0.00 H new ATOM 0 HG2 GLU A 88 7.224 6.603 -3.525 1.00 0.00 H new ATOM 0 HG3 GLU A 88 7.132 7.099 -5.204 1.00 0.00 H new ATOM 1399 N LYS A 89 4.506 10.427 -3.520 1.00 0.00 N ATOM 1400 CA LYS A 89 3.822 11.703 -3.402 1.00 0.00 C ATOM 1401 C LYS A 89 3.095 11.765 -2.056 1.00 0.00 C ATOM 1402 O LYS A 89 3.411 12.603 -1.214 1.00 0.00 O ATOM 1403 CB LYS A 89 2.907 11.934 -4.606 1.00 0.00 C ATOM 1404 CG LYS A 89 2.733 13.429 -4.884 1.00 0.00 C ATOM 1405 CD LYS A 89 1.734 14.055 -3.909 1.00 0.00 C ATOM 1406 CE LYS A 89 1.343 15.466 -4.355 1.00 0.00 C ATOM 1407 NZ LYS A 89 1.599 16.442 -3.273 1.00 0.00 N ATOM 0 H LYS A 89 4.377 9.955 -4.415 1.00 0.00 H new ATOM 0 HA LYS A 89 4.540 12.523 -3.415 1.00 0.00 H new ATOM 0 HB2 LYS A 89 3.326 11.443 -5.485 1.00 0.00 H new ATOM 0 HB3 LYS A 89 1.934 11.479 -4.420 1.00 0.00 H new ATOM 0 HG2 LYS A 89 3.696 13.933 -4.798 1.00 0.00 H new ATOM 0 HG3 LYS A 89 2.388 13.574 -5.908 1.00 0.00 H new ATOM 0 HD2 LYS A 89 0.843 13.430 -3.844 1.00 0.00 H new ATOM 0 HD3 LYS A 89 2.170 14.093 -2.911 1.00 0.00 H new ATOM 0 HE2 LYS A 89 1.910 15.743 -5.244 1.00 0.00 H new ATOM 0 HE3 LYS A 89 0.288 15.488 -4.630 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 1.328 17.394 -3.593 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 1.039 16.186 -2.435 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 2.610 16.433 -3.030 1.00 0.00 H new ATOM 1421 N GLN A 90 2.136 10.865 -1.897 1.00 0.00 N ATOM 1422 CA GLN A 90 1.362 10.807 -0.668 1.00 0.00 C ATOM 1423 C GLN A 90 2.294 10.749 0.544 1.00 0.00 C ATOM 1424 O GLN A 90 2.177 11.561 1.460 1.00 0.00 O ATOM 1425 CB GLN A 90 0.403 9.614 -0.681 1.00 0.00 C ATOM 1426 CG GLN A 90 -0.662 9.778 -1.767 1.00 0.00 C ATOM 1427 CD GLN A 90 -1.439 11.082 -1.581 1.00 0.00 C ATOM 1428 OE1 GLN A 90 -2.470 11.133 -0.931 1.00 0.00 O ATOM 1429 NE2 GLN A 90 -0.889 12.131 -2.186 1.00 0.00 N ATOM 0 H GLN A 90 1.877 10.171 -2.598 1.00 0.00 H new ATOM 0 HA GLN A 90 0.761 11.714 -0.596 1.00 0.00 H new ATOM 0 HB2 GLN A 90 0.963 8.695 -0.852 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -0.077 9.518 0.293 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -0.189 9.769 -2.749 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -1.350 8.933 -1.737 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -0.024 12.019 -2.715 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -1.332 13.047 -2.121 1.00 0.00 H new ATOM 1438 N LEU A 91 3.197 9.780 0.509 1.00 0.00 N ATOM 1439 CA LEU A 91 4.149 9.606 1.593 1.00 0.00 C ATOM 1440 C LEU A 91 4.582 10.979 2.112 1.00 0.00 C ATOM 1441 O LEU A 91 4.363 11.303 3.278 1.00 0.00 O ATOM 1442 CB LEU A 91 5.315 8.722 1.146 1.00 0.00 C ATOM 1443 CG LEU A 91 5.072 7.212 1.203 1.00 0.00 C ATOM 1444 CD1 LEU A 91 6.190 6.450 0.490 1.00 0.00 C ATOM 1445 CD2 LEU A 91 4.887 6.740 2.647 1.00 0.00 C ATOM 0 H LEU A 91 3.290 9.108 -0.252 1.00 0.00 H new ATOM 0 HA LEU A 91 3.683 9.082 2.428 1.00 0.00 H new ATOM 0 HB2 LEU A 91 5.576 8.990 0.122 1.00 0.00 H new ATOM 0 HB3 LEU A 91 6.180 8.955 1.767 1.00 0.00 H new ATOM 0 HG LEU A 91 4.145 6.995 0.672 1.00 0.00 H new ATOM 0 HD11 LEU A 91 5.993 5.379 0.545 1.00 0.00 H new ATOM 0 HD12 LEU A 91 6.231 6.758 -0.555 1.00 0.00 H new ATOM 0 HD13 LEU A 91 7.143 6.669 0.971 1.00 0.00 H new ATOM 0 HD21 LEU A 91 4.716 5.664 2.659 1.00 0.00 H new ATOM 0 HD22 LEU A 91 5.783 6.971 3.223 1.00 0.00 H new ATOM 0 HD23 LEU A 91 4.030 7.248 3.089 1.00 0.00 H new ATOM 1457 N ARG A 92 5.189 11.748 1.221 1.00 0.00 N ATOM 1458 CA ARG A 92 5.655 13.078 1.574 1.00 0.00 C ATOM 1459 C ARG A 92 4.644 13.768 2.492 1.00 0.00 C ATOM 1460 O ARG A 92 4.953 14.074 3.643 1.00 0.00 O ATOM 1461 CB ARG A 92 5.868 13.937 0.325 1.00 0.00 C ATOM 1462 CG ARG A 92 7.147 13.529 -0.409 1.00 0.00 C ATOM 1463 CD ARG A 92 7.569 14.604 -1.412 1.00 0.00 C ATOM 1464 NE ARG A 92 8.985 14.409 -1.796 1.00 0.00 N ATOM 1465 CZ ARG A 92 9.534 14.900 -2.916 1.00 0.00 C ATOM 1466 NH1 ARG A 92 8.790 15.618 -3.768 1.00 0.00 N ATOM 1467 NH2 ARG A 92 10.827 14.673 -3.183 1.00 0.00 N ATOM 0 H ARG A 92 5.369 11.476 0.255 1.00 0.00 H new ATOM 0 HA ARG A 92 6.607 12.969 2.093 1.00 0.00 H new ATOM 0 HB2 ARG A 92 5.012 13.833 -0.342 1.00 0.00 H new ATOM 0 HB3 ARG A 92 5.926 14.988 0.608 1.00 0.00 H new ATOM 0 HG2 ARG A 92 7.948 13.365 0.312 1.00 0.00 H new ATOM 0 HG3 ARG A 92 6.987 12.584 -0.929 1.00 0.00 H new ATOM 0 HD2 ARG A 92 6.934 14.557 -2.297 1.00 0.00 H new ATOM 0 HD3 ARG A 92 7.435 15.594 -0.975 1.00 0.00 H new ATOM 0 HE ARG A 92 9.580 13.867 -1.169 1.00 0.00 H new ATOM 0 HH11 ARG A 92 7.806 15.791 -3.564 1.00 0.00 H new ATOM 0 HH12 ARG A 92 9.208 15.992 -4.620 1.00 0.00 H new ATOM 0 HH21 ARG A 92 11.393 14.127 -2.534 1.00 0.00 H new ATOM 0 HH22 ARG A 92 11.245 15.046 -4.035 1.00 0.00 H new ATOM 1481 N LYS A 93 3.457 13.993 1.950 1.00 0.00 N ATOM 1482 CA LYS A 93 2.399 14.641 2.706 1.00 0.00 C ATOM 1483 C LYS A 93 1.379 13.591 3.152 1.00 0.00 C ATOM 1484 O LYS A 93 0.583 13.112 2.346 1.00 0.00 O ATOM 1485 CB LYS A 93 1.787 15.787 1.898 1.00 0.00 C ATOM 1486 CG LYS A 93 2.716 17.003 1.882 1.00 0.00 C ATOM 1487 CD LYS A 93 2.094 18.178 2.639 1.00 0.00 C ATOM 1488 CE LYS A 93 1.796 19.344 1.694 1.00 0.00 C ATOM 1489 NZ LYS A 93 1.364 20.534 2.460 1.00 0.00 N ATOM 0 H LYS A 93 3.204 13.738 0.995 1.00 0.00 H new ATOM 0 HA LYS A 93 2.803 15.098 3.609 1.00 0.00 H new ATOM 0 HB2 LYS A 93 1.597 15.456 0.877 1.00 0.00 H new ATOM 0 HB3 LYS A 93 0.824 16.066 2.327 1.00 0.00 H new ATOM 0 HG2 LYS A 93 3.673 16.740 2.334 1.00 0.00 H new ATOM 0 HG3 LYS A 93 2.920 17.296 0.852 1.00 0.00 H new ATOM 0 HD2 LYS A 93 1.173 17.855 3.125 1.00 0.00 H new ATOM 0 HD3 LYS A 93 2.772 18.508 3.426 1.00 0.00 H new ATOM 0 HE2 LYS A 93 2.685 19.583 1.110 1.00 0.00 H new ATOM 0 HE3 LYS A 93 1.018 19.057 0.987 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 1.166 21.316 1.804 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 0.503 20.307 2.998 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 2.119 20.817 3.117 1.00 0.00 H new ATOM 1503 N LEU A 94 1.438 13.263 4.434 1.00 0.00 N ATOM 1504 CA LEU A 94 0.530 12.278 4.997 1.00 0.00 C ATOM 1505 C LEU A 94 0.762 12.179 6.506 1.00 0.00 C ATOM 1506 O LEU A 94 -0.117 12.518 7.297 1.00 0.00 O ATOM 1507 CB LEU A 94 0.668 10.942 4.265 1.00 0.00 C ATOM 1508 CG LEU A 94 -0.592 10.075 4.207 1.00 0.00 C ATOM 1509 CD1 LEU A 94 -1.763 10.850 3.599 1.00 0.00 C ATOM 1510 CD2 LEU A 94 -0.323 8.766 3.462 1.00 0.00 C ATOM 0 H LEU A 94 2.100 13.662 5.099 1.00 0.00 H new ATOM 0 HA LEU A 94 -0.505 12.589 4.853 1.00 0.00 H new ATOM 0 HB2 LEU A 94 0.995 11.142 3.244 1.00 0.00 H new ATOM 0 HB3 LEU A 94 1.459 10.367 4.746 1.00 0.00 H new ATOM 0 HG LEU A 94 -0.874 9.813 5.227 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -2.646 10.211 3.569 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -1.972 11.730 4.207 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -1.506 11.162 2.586 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -1.234 8.169 3.435 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -0.003 8.986 2.443 1.00 0.00 H new ATOM 0 HD23 LEU A 94 0.461 8.209 3.976 1.00 0.00 H new ATOM 1522 N SER A 95 1.951 11.714 6.860 1.00 0.00 N ATOM 1523 CA SER A 95 2.311 11.567 8.260 1.00 0.00 C ATOM 1524 C SER A 95 1.784 12.757 9.064 1.00 0.00 C ATOM 1525 O SER A 95 1.646 13.858 8.531 1.00 0.00 O ATOM 1526 CB SER A 95 3.826 11.441 8.429 1.00 0.00 C ATOM 1527 OG SER A 95 4.210 10.132 8.841 1.00 0.00 O ATOM 0 H SER A 95 2.678 11.434 6.201 1.00 0.00 H new ATOM 0 HA SER A 95 1.854 10.652 8.636 1.00 0.00 H new ATOM 0 HB2 SER A 95 4.317 11.683 7.487 1.00 0.00 H new ATOM 0 HB3 SER A 95 4.171 12.168 9.164 1.00 0.00 H new ATOM 0 HG SER A 95 5.185 10.092 8.936 1.00 0.00 H new ATOM 1533 N GLY A 96 1.504 12.497 10.332 1.00 0.00 N ATOM 1534 CA GLY A 96 0.996 13.533 11.214 1.00 0.00 C ATOM 1535 C GLY A 96 -0.098 12.984 12.133 1.00 0.00 C ATOM 1536 O GLY A 96 -0.272 11.771 12.240 1.00 0.00 O ATOM 0 H GLY A 96 1.619 11.583 10.770 1.00 0.00 H new ATOM 0 HA2 GLY A 96 1.811 13.936 11.814 1.00 0.00 H new ATOM 0 HA3 GLY A 96 0.598 14.357 10.622 1.00 0.00 H new ATOM 1540 N PRO A 97 -0.825 13.927 12.789 1.00 0.00 N ATOM 1541 CA PRO A 97 -1.896 13.550 13.695 1.00 0.00 C ATOM 1542 C PRO A 97 -3.132 13.088 12.920 1.00 0.00 C ATOM 1543 O PRO A 97 -3.919 13.909 12.452 1.00 0.00 O ATOM 1544 CB PRO A 97 -2.153 14.788 14.538 1.00 0.00 C ATOM 1545 CG PRO A 97 -1.544 15.950 13.769 1.00 0.00 C ATOM 1546 CD PRO A 97 -0.646 15.373 12.687 1.00 0.00 C ATOM 0 HA PRO A 97 -1.633 12.702 14.327 1.00 0.00 H new ATOM 0 HB2 PRO A 97 -3.221 14.940 14.694 1.00 0.00 H new ATOM 0 HB3 PRO A 97 -1.698 14.691 15.524 1.00 0.00 H new ATOM 0 HG2 PRO A 97 -2.326 16.567 13.327 1.00 0.00 H new ATOM 0 HG3 PRO A 97 -0.971 16.592 14.438 1.00 0.00 H new ATOM 0 HD2 PRO A 97 -0.930 15.739 11.700 1.00 0.00 H new ATOM 0 HD3 PRO A 97 0.395 15.655 12.844 1.00 0.00 H new ATOM 1554 N SER A 98 -3.264 11.774 12.809 1.00 0.00 N ATOM 1555 CA SER A 98 -4.390 11.192 12.099 1.00 0.00 C ATOM 1556 C SER A 98 -5.674 11.949 12.446 1.00 0.00 C ATOM 1557 O SER A 98 -6.075 11.999 13.607 1.00 0.00 O ATOM 1558 CB SER A 98 -4.543 9.707 12.431 1.00 0.00 C ATOM 1559 OG SER A 98 -3.415 8.946 12.009 1.00 0.00 O ATOM 0 H SER A 98 -2.609 11.096 13.199 1.00 0.00 H new ATOM 0 HA SER A 98 -4.202 11.279 11.029 1.00 0.00 H new ATOM 0 HB2 SER A 98 -4.679 9.588 13.506 1.00 0.00 H new ATOM 0 HB3 SER A 98 -5.442 9.319 11.951 1.00 0.00 H new ATOM 0 HG SER A 98 -3.551 8.004 12.241 1.00 0.00 H new ATOM 1565 N SER A 99 -6.284 12.519 11.416 1.00 0.00 N ATOM 1566 CA SER A 99 -7.514 13.270 11.598 1.00 0.00 C ATOM 1567 C SER A 99 -8.704 12.456 11.087 1.00 0.00 C ATOM 1568 O SER A 99 -9.105 12.594 9.932 1.00 0.00 O ATOM 1569 CB SER A 99 -7.446 14.620 10.879 1.00 0.00 C ATOM 1570 OG SER A 99 -8.416 15.538 11.375 1.00 0.00 O ATOM 0 H SER A 99 -5.949 12.475 10.454 1.00 0.00 H new ATOM 0 HA SER A 99 -7.644 13.462 12.663 1.00 0.00 H new ATOM 0 HB2 SER A 99 -6.450 15.045 10.999 1.00 0.00 H new ATOM 0 HB3 SER A 99 -7.602 14.470 9.811 1.00 0.00 H new ATOM 0 HG SER A 99 -8.339 16.387 10.892 1.00 0.00 H new ATOM 1576 N GLY A 100 -9.237 11.627 11.972 1.00 0.00 N ATOM 1577 CA GLY A 100 -10.373 10.791 11.625 1.00 0.00 C ATOM 1578 C GLY A 100 -10.980 10.145 12.872 1.00 0.00 C ATOM 1579 O GLY A 100 -10.458 9.152 13.377 1.00 0.00 O ATOM 0 H GLY A 100 -8.903 11.516 12.929 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -11.129 11.391 11.117 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -10.059 10.016 10.926 1.00 0.00 H new TER 1583 GLY A 100