USER MOD reduce.3.24.130724 H: found=0, std=0, add=640, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 635 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 52 LYS NZ :NH3+ -169:sc=-0.00605 (180deg=-0.255) USER MOD Set 1.2: A 56 ASN :FLIP amide:sc= -1.62 F(o=-2.8,f=-1.6) USER MOD Set 2.1: A 19 SER OG : rot 40:sc= -2.11 USER MOD Set 2.2: A 41 GLN : amide:sc= -1.5 X(o=-3.6,f=-3.8) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -114:sc= 0.093 (180deg=0) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 LYS NZ :NH3+ 179:sc= 0.0375 (180deg=0.00426) USER MOD Single : A 15 SER OG : rot -76:sc= 0.65 USER MOD Single : A 18 SER OG : rot -74:sc= 0.839 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot 140:sc= 0.0197 USER MOD Single : A 30 GLN : amide:sc= -0.951 K(o=-0.95,f=-1.6) USER MOD Single : A 32 HIS : no HD1:sc= -0.82 K(o=-0.82,f=-2.2) USER MOD Single : A 33 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 43 ASN : amide:sc= -0.205 K(o=-0.2,f=-0.73) USER MOD Single : A 46 SER OG : rot 180:sc= -0.0392 USER MOD Single : A 49 ASN : amide:sc= -1.03 X(o=-1,f=-1.4) USER MOD Single : A 50 GLN : amide:sc= -5.14 K(o=-5.1,f=-9!) USER MOD Single : A 51 HIS : no HD1:sc= -3.17! C(o=-3.2!,f=-4.4!) USER MOD Single : A 55 LYS NZ :NH3+ -170:sc= -1.85! (180deg=-2.3!) USER MOD Single : A 59 SER OG : rot -30:sc= 0.499 USER MOD Single : A 63 ASN : amide:sc= -7.46! C(o=-7.5!,f=-15!) USER MOD Single : A 64 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.0613) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 HIS : no HE2:sc= -2.23 K(o=-2.2,f=-5.7!) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 THR OG1 : rot 8:sc= 0.916 USER MOD Single : A 75 SER OG : rot 71:sc= 0.92 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 7.386 -4.401 -4.730 1.00 0.00 N ATOM 2 CA MET A 1 7.125 -5.395 -3.695 1.00 0.00 C ATOM 3 C MET A 1 5.704 -5.937 -3.808 1.00 0.00 C ATOM 4 O MET A 1 4.856 -5.348 -4.479 1.00 0.00 O ATOM 5 CB MET A 1 7.343 -4.788 -2.308 1.00 0.00 C ATOM 6 CG MET A 1 8.773 -4.913 -1.808 1.00 0.00 C ATOM 7 SD MET A 1 9.213 -6.607 -1.376 1.00 0.00 S ATOM 8 CE MET A 1 10.979 -6.445 -1.125 1.00 0.00 C ATOM 0 H1 MET A 1 8.109 -4.763 -5.385 1.00 0.00 H new ATOM 0 H2 MET A 1 6.509 -4.208 -5.255 1.00 0.00 H new ATOM 0 H3 MET A 1 7.727 -3.523 -4.290 1.00 0.00 H new ATOM 0 HA MET A 1 7.822 -6.221 -3.836 1.00 0.00 H new ATOM 0 HB2 MET A 1 7.067 -3.734 -2.334 1.00 0.00 H new ATOM 0 HB3 MET A 1 6.675 -5.275 -1.598 1.00 0.00 H new ATOM 0 HG2 MET A 1 9.455 -4.549 -2.576 1.00 0.00 H new ATOM 0 HG3 MET A 1 8.906 -4.274 -0.935 1.00 0.00 H new ATOM 0 HE1 MET A 1 11.398 -7.413 -0.851 1.00 0.00 H new ATOM 0 HE2 MET A 1 11.447 -6.095 -2.045 1.00 0.00 H new ATOM 0 HE3 MET A 1 11.169 -5.728 -0.326 1.00 0.00 H new ATOM 18 N ALA A 2 5.450 -7.062 -3.148 1.00 0.00 N ATOM 19 CA ALA A 2 4.130 -7.682 -3.174 1.00 0.00 C ATOM 20 C ALA A 2 3.577 -7.853 -1.763 1.00 0.00 C ATOM 21 O ALA A 2 4.289 -8.283 -0.855 1.00 0.00 O ATOM 22 CB ALA A 2 4.192 -9.025 -3.885 1.00 0.00 C ATOM 0 H ALA A 2 6.140 -7.563 -2.589 1.00 0.00 H new ATOM 0 HA ALA A 2 3.457 -7.024 -3.723 1.00 0.00 H new ATOM 0 HB1 ALA A 2 3.200 -9.476 -3.897 1.00 0.00 H new ATOM 0 HB2 ALA A 2 4.537 -8.879 -4.909 1.00 0.00 H new ATOM 0 HB3 ALA A 2 4.884 -9.683 -3.360 1.00 0.00 H new ATOM 28 N ILE A 3 2.305 -7.513 -1.586 1.00 0.00 N ATOM 29 CA ILE A 3 1.657 -7.630 -0.286 1.00 0.00 C ATOM 30 C ILE A 3 0.756 -8.859 -0.229 1.00 0.00 C ATOM 31 O ILE A 3 0.217 -9.294 -1.247 1.00 0.00 O ATOM 32 CB ILE A 3 0.821 -6.379 0.041 1.00 0.00 C ATOM 33 CG1 ILE A 3 0.348 -6.420 1.496 1.00 0.00 C ATOM 34 CG2 ILE A 3 -0.367 -6.273 -0.904 1.00 0.00 C ATOM 35 CD1 ILE A 3 0.344 -5.065 2.168 1.00 0.00 C ATOM 0 H ILE A 3 1.703 -7.154 -2.327 1.00 0.00 H new ATOM 0 HA ILE A 3 2.451 -7.730 0.454 1.00 0.00 H new ATOM 0 HB ILE A 3 1.448 -5.497 -0.093 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -0.659 -6.837 1.531 1.00 0.00 H new ATOM 0 HG13 ILE A 3 0.992 -7.095 2.060 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -0.948 -5.384 -0.660 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -0.010 -6.202 -1.931 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -0.996 -7.157 -0.799 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -0.002 -5.170 3.196 1.00 0.00 H new ATOM 0 HD12 ILE A 3 1.354 -4.654 2.165 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -0.323 -4.393 1.628 1.00 0.00 H new ATOM 47 N SER A 4 0.595 -9.414 0.968 1.00 0.00 N ATOM 48 CA SER A 4 -0.240 -10.594 1.157 1.00 0.00 C ATOM 49 C SER A 4 -1.643 -10.361 0.607 1.00 0.00 C ATOM 50 O SER A 4 -2.219 -9.287 0.778 1.00 0.00 O ATOM 51 CB SER A 4 -0.316 -10.958 2.642 1.00 0.00 C ATOM 52 OG SER A 4 0.910 -11.503 3.097 1.00 0.00 O ATOM 0 H SER A 4 1.032 -9.065 1.821 1.00 0.00 H new ATOM 0 HA SER A 4 0.213 -11.421 0.610 1.00 0.00 H new ATOM 0 HB2 SER A 4 -0.562 -10.070 3.225 1.00 0.00 H new ATOM 0 HB3 SER A 4 -1.119 -11.677 2.803 1.00 0.00 H new ATOM 0 HG SER A 4 0.836 -11.726 4.049 1.00 0.00 H new ATOM 58 N ALA A 5 -2.188 -11.376 -0.056 1.00 0.00 N ATOM 59 CA ALA A 5 -3.525 -11.284 -0.630 1.00 0.00 C ATOM 60 C ALA A 5 -4.560 -10.953 0.439 1.00 0.00 C ATOM 61 O ALA A 5 -5.568 -10.304 0.159 1.00 0.00 O ATOM 62 CB ALA A 5 -3.887 -12.584 -1.334 1.00 0.00 C ATOM 0 H ALA A 5 -1.724 -12.271 -0.209 1.00 0.00 H new ATOM 0 HA ALA A 5 -3.525 -10.475 -1.361 1.00 0.00 H new ATOM 0 HB1 ALA A 5 -4.888 -12.502 -1.758 1.00 0.00 H new ATOM 0 HB2 ALA A 5 -3.170 -12.778 -2.132 1.00 0.00 H new ATOM 0 HB3 ALA A 5 -3.863 -13.405 -0.617 1.00 0.00 H new ATOM 68 N GLU A 6 -4.305 -11.402 1.663 1.00 0.00 N ATOM 69 CA GLU A 6 -5.217 -11.154 2.773 1.00 0.00 C ATOM 70 C GLU A 6 -5.395 -9.656 3.007 1.00 0.00 C ATOM 71 O GLU A 6 -6.413 -9.218 3.540 1.00 0.00 O ATOM 72 CB GLU A 6 -4.698 -11.822 4.048 1.00 0.00 C ATOM 73 CG GLU A 6 -3.486 -11.129 4.648 1.00 0.00 C ATOM 74 CD GLU A 6 -2.883 -11.906 5.803 1.00 0.00 C ATOM 75 OE1 GLU A 6 -3.091 -13.136 5.863 1.00 0.00 O ATOM 76 OE2 GLU A 6 -2.203 -11.284 6.646 1.00 0.00 O ATOM 0 H GLU A 6 -3.474 -11.939 1.911 1.00 0.00 H new ATOM 0 HA GLU A 6 -6.186 -11.582 2.516 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -5.498 -11.843 4.788 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -4.441 -12.858 3.827 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -2.731 -10.991 3.874 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -3.774 -10.136 4.994 1.00 0.00 H new ATOM 83 N GLU A 7 -4.395 -8.878 2.603 1.00 0.00 N ATOM 84 CA GLU A 7 -4.441 -7.430 2.770 1.00 0.00 C ATOM 85 C GLU A 7 -5.437 -6.801 1.799 1.00 0.00 C ATOM 86 O GLU A 7 -6.017 -5.752 2.080 1.00 0.00 O ATOM 87 CB GLU A 7 -3.052 -6.826 2.555 1.00 0.00 C ATOM 88 CG GLU A 7 -2.985 -5.335 2.841 1.00 0.00 C ATOM 89 CD GLU A 7 -2.602 -5.033 4.277 1.00 0.00 C ATOM 90 OE1 GLU A 7 -1.828 -5.820 4.862 1.00 0.00 O ATOM 91 OE2 GLU A 7 -3.076 -4.011 4.816 1.00 0.00 O ATOM 0 H GLU A 7 -3.545 -9.225 2.159 1.00 0.00 H new ATOM 0 HA GLU A 7 -4.769 -7.218 3.788 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -2.337 -7.343 3.196 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -2.743 -7.004 1.525 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -2.260 -4.872 2.171 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -3.953 -4.883 2.624 1.00 0.00 H new ATOM 98 N LEU A 8 -5.630 -7.451 0.657 1.00 0.00 N ATOM 99 CA LEU A 8 -6.555 -6.956 -0.357 1.00 0.00 C ATOM 100 C LEU A 8 -8.002 -7.181 0.070 1.00 0.00 C ATOM 101 O LEU A 8 -8.831 -6.276 -0.013 1.00 0.00 O ATOM 102 CB LEU A 8 -6.293 -7.649 -1.696 1.00 0.00 C ATOM 103 CG LEU A 8 -7.356 -7.445 -2.776 1.00 0.00 C ATOM 104 CD1 LEU A 8 -7.585 -5.963 -3.027 1.00 0.00 C ATOM 105 CD2 LEU A 8 -6.950 -8.149 -4.063 1.00 0.00 C ATOM 0 H LEU A 8 -5.159 -8.321 0.410 1.00 0.00 H new ATOM 0 HA LEU A 8 -6.391 -5.884 -0.471 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -5.337 -7.297 -2.084 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -6.189 -8.719 -1.515 1.00 0.00 H new ATOM 0 HG LEU A 8 -8.291 -7.882 -2.425 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -8.345 -5.838 -3.799 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -7.921 -5.486 -2.106 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -6.654 -5.502 -3.356 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -7.718 -7.993 -4.821 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -6.003 -7.742 -4.417 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -6.838 -9.217 -3.874 1.00 0.00 H new ATOM 117 N GLU A 9 -8.296 -8.394 0.529 1.00 0.00 N ATOM 118 CA GLU A 9 -9.643 -8.736 0.970 1.00 0.00 C ATOM 119 C GLU A 9 -10.066 -7.866 2.151 1.00 0.00 C ATOM 120 O GLU A 9 -11.225 -7.464 2.257 1.00 0.00 O ATOM 121 CB GLU A 9 -9.716 -10.214 1.360 1.00 0.00 C ATOM 122 CG GLU A 9 -8.679 -10.623 2.392 1.00 0.00 C ATOM 123 CD GLU A 9 -8.726 -12.105 2.711 1.00 0.00 C ATOM 124 OE1 GLU A 9 -8.491 -12.918 1.793 1.00 0.00 O ATOM 125 OE2 GLU A 9 -8.999 -12.451 3.879 1.00 0.00 O ATOM 0 H GLU A 9 -7.621 -9.155 0.605 1.00 0.00 H new ATOM 0 HA GLU A 9 -10.327 -8.552 0.141 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -10.710 -10.429 1.751 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -9.587 -10.824 0.466 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -7.685 -10.366 2.025 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -8.838 -10.053 3.307 1.00 0.00 H new ATOM 132 N LYS A 10 -9.119 -7.580 3.037 1.00 0.00 N ATOM 133 CA LYS A 10 -9.390 -6.758 4.210 1.00 0.00 C ATOM 134 C LYS A 10 -9.908 -5.382 3.802 1.00 0.00 C ATOM 135 O LYS A 10 -10.639 -4.737 4.554 1.00 0.00 O ATOM 136 CB LYS A 10 -8.125 -6.608 5.057 1.00 0.00 C ATOM 137 CG LYS A 10 -7.863 -7.790 5.974 1.00 0.00 C ATOM 138 CD LYS A 10 -8.881 -7.858 7.100 1.00 0.00 C ATOM 139 CE LYS A 10 -8.410 -8.770 8.223 1.00 0.00 C ATOM 140 NZ LYS A 10 -8.607 -10.208 7.889 1.00 0.00 N ATOM 0 H LYS A 10 -8.155 -7.906 2.965 1.00 0.00 H new ATOM 0 HA LYS A 10 -10.158 -7.256 4.802 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -7.269 -6.475 4.396 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -8.206 -5.703 5.659 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -7.895 -8.714 5.397 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -6.860 -7.711 6.393 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -9.058 -6.857 7.493 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -9.832 -8.220 6.710 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -7.355 -8.585 8.423 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -8.954 -8.532 9.137 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -8.274 -10.797 8.679 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -9.617 -10.391 7.723 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -8.068 -10.442 7.031 1.00 0.00 H new ATOM 154 N ILE A 11 -9.526 -4.941 2.609 1.00 0.00 N ATOM 155 CA ILE A 11 -9.954 -3.644 2.101 1.00 0.00 C ATOM 156 C ILE A 11 -11.446 -3.642 1.787 1.00 0.00 C ATOM 157 O ILE A 11 -12.171 -2.721 2.168 1.00 0.00 O ATOM 158 CB ILE A 11 -9.174 -3.249 0.833 1.00 0.00 C ATOM 159 CG1 ILE A 11 -7.675 -3.172 1.134 1.00 0.00 C ATOM 160 CG2 ILE A 11 -9.680 -1.921 0.292 1.00 0.00 C ATOM 161 CD1 ILE A 11 -6.804 -3.359 -0.088 1.00 0.00 C ATOM 0 H ILE A 11 -8.920 -5.463 1.976 1.00 0.00 H new ATOM 0 HA ILE A 11 -9.748 -2.915 2.885 1.00 0.00 H new ATOM 0 HB ILE A 11 -9.334 -4.013 0.072 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -7.452 -2.205 1.585 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -7.421 -3.933 1.871 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -9.119 -1.656 -0.604 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -10.738 -2.008 0.045 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -9.546 -1.146 1.047 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -5.755 -3.292 0.199 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -6.998 -4.337 -0.527 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -7.030 -2.582 -0.818 1.00 0.00 H new ATOM 173 N LEU A 12 -11.900 -4.679 1.093 1.00 0.00 N ATOM 174 CA LEU A 12 -13.308 -4.799 0.729 1.00 0.00 C ATOM 175 C LEU A 12 -14.171 -5.044 1.963 1.00 0.00 C ATOM 176 O LEU A 12 -15.331 -4.635 2.014 1.00 0.00 O ATOM 177 CB LEU A 12 -13.500 -5.936 -0.276 1.00 0.00 C ATOM 178 CG LEU A 12 -13.316 -5.569 -1.749 1.00 0.00 C ATOM 179 CD1 LEU A 12 -13.478 -6.797 -2.630 1.00 0.00 C ATOM 180 CD2 LEU A 12 -14.303 -4.484 -2.156 1.00 0.00 C ATOM 0 H LEU A 12 -11.314 -5.449 0.771 1.00 0.00 H new ATOM 0 HA LEU A 12 -13.621 -3.861 0.271 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -12.798 -6.733 -0.031 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -14.503 -6.343 -0.146 1.00 0.00 H new ATOM 0 HG LEU A 12 -12.306 -5.182 -1.883 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -13.344 -6.516 -3.674 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -12.731 -7.542 -2.356 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -14.475 -7.215 -2.492 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -14.157 -4.236 -3.207 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -15.321 -4.843 -2.006 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -14.138 -3.595 -1.547 1.00 0.00 H new ATOM 192 N LYS A 13 -13.596 -5.712 2.957 1.00 0.00 N ATOM 193 CA LYS A 13 -14.309 -6.010 4.193 1.00 0.00 C ATOM 194 C LYS A 13 -14.945 -4.749 4.771 1.00 0.00 C ATOM 195 O LYS A 13 -16.030 -4.798 5.351 1.00 0.00 O ATOM 196 CB LYS A 13 -13.358 -6.630 5.219 1.00 0.00 C ATOM 197 CG LYS A 13 -12.988 -8.071 4.912 1.00 0.00 C ATOM 198 CD LYS A 13 -12.710 -8.858 6.181 1.00 0.00 C ATOM 199 CE LYS A 13 -13.984 -9.101 6.976 1.00 0.00 C ATOM 200 NZ LYS A 13 -13.784 -10.117 8.046 1.00 0.00 N ATOM 0 H LYS A 13 -12.637 -6.058 2.930 1.00 0.00 H new ATOM 0 HA LYS A 13 -15.100 -6.724 3.963 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -12.448 -6.032 5.266 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -13.821 -6.585 6.205 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -13.798 -8.546 4.359 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -12.108 -8.093 4.269 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -12.252 -9.813 5.925 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -11.993 -8.315 6.797 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -14.318 -8.164 7.422 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -14.774 -9.433 6.303 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -14.675 -10.254 8.565 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -13.490 -11.018 7.618 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -13.048 -9.789 8.703 1.00 0.00 H new ATOM 214 N LYS A 14 -14.264 -3.620 4.606 1.00 0.00 N ATOM 215 CA LYS A 14 -14.763 -2.345 5.108 1.00 0.00 C ATOM 216 C LYS A 14 -16.197 -2.103 4.649 1.00 0.00 C ATOM 217 O LYS A 14 -16.988 -1.477 5.355 1.00 0.00 O ATOM 218 CB LYS A 14 -13.865 -1.200 4.635 1.00 0.00 C ATOM 219 CG LYS A 14 -12.619 -1.014 5.484 1.00 0.00 C ATOM 220 CD LYS A 14 -11.567 -2.065 5.169 1.00 0.00 C ATOM 221 CE LYS A 14 -10.340 -1.907 6.052 1.00 0.00 C ATOM 222 NZ LYS A 14 -9.103 -2.385 5.374 1.00 0.00 N ATOM 0 H LYS A 14 -13.365 -3.562 4.128 1.00 0.00 H new ATOM 0 HA LYS A 14 -14.750 -2.382 6.197 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -13.567 -1.386 3.603 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -14.439 -0.273 4.639 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -12.205 -0.021 5.311 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -12.885 -1.069 6.540 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -11.991 -3.059 5.308 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -11.275 -1.987 4.122 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -10.222 -0.858 6.326 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -10.485 -2.464 6.978 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -8.286 -2.245 6.002 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -9.198 -3.396 5.151 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -8.960 -1.848 4.495 1.00 0.00 H new ATOM 236 N SER A 15 -16.527 -2.604 3.463 1.00 0.00 N ATOM 237 CA SER A 15 -17.865 -2.440 2.908 1.00 0.00 C ATOM 238 C SER A 15 -18.613 -3.770 2.891 1.00 0.00 C ATOM 239 O SER A 15 -19.684 -3.901 3.484 1.00 0.00 O ATOM 240 CB SER A 15 -17.787 -1.867 1.492 1.00 0.00 C ATOM 241 OG SER A 15 -18.939 -2.206 0.740 1.00 0.00 O ATOM 0 H SER A 15 -15.885 -3.127 2.868 1.00 0.00 H new ATOM 0 HA SER A 15 -18.412 -1.744 3.544 1.00 0.00 H new ATOM 0 HB2 SER A 15 -17.687 -0.783 1.540 1.00 0.00 H new ATOM 0 HB3 SER A 15 -16.897 -2.248 0.991 1.00 0.00 H new ATOM 0 HG SER A 15 -18.881 -3.142 0.456 1.00 0.00 H new ATOM 247 N PHE A 16 -18.041 -4.754 2.205 1.00 0.00 N ATOM 248 CA PHE A 16 -18.652 -6.074 2.108 1.00 0.00 C ATOM 249 C PHE A 16 -17.834 -7.110 2.874 1.00 0.00 C ATOM 250 O PHE A 16 -17.047 -7.863 2.301 1.00 0.00 O ATOM 251 CB PHE A 16 -18.783 -6.493 0.642 1.00 0.00 C ATOM 252 CG PHE A 16 -19.326 -5.409 -0.245 1.00 0.00 C ATOM 253 CD1 PHE A 16 -20.525 -4.785 0.058 1.00 0.00 C ATOM 254 CD2 PHE A 16 -18.637 -5.015 -1.380 1.00 0.00 C ATOM 255 CE1 PHE A 16 -21.028 -3.788 -0.757 1.00 0.00 C ATOM 256 CE2 PHE A 16 -19.135 -4.018 -2.199 1.00 0.00 C ATOM 257 CZ PHE A 16 -20.331 -3.403 -1.886 1.00 0.00 C ATOM 0 H PHE A 16 -17.155 -4.662 1.708 1.00 0.00 H new ATOM 0 HA PHE A 16 -19.646 -6.020 2.553 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -17.805 -6.799 0.271 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -19.435 -7.364 0.578 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -21.073 -5.081 0.941 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -17.700 -5.492 -1.628 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -21.965 -3.311 -0.511 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -18.589 -3.721 -3.082 1.00 0.00 H new ATOM 0 HZ PHE A 16 -20.721 -2.622 -2.523 1.00 0.00 H new ATOM 267 N PRO A 17 -18.024 -7.150 4.201 1.00 0.00 N ATOM 268 CA PRO A 17 -17.313 -8.088 5.075 1.00 0.00 C ATOM 269 C PRO A 17 -17.767 -9.529 4.868 1.00 0.00 C ATOM 270 O PRO A 17 -17.018 -10.470 5.134 1.00 0.00 O ATOM 271 CB PRO A 17 -17.678 -7.609 6.482 1.00 0.00 C ATOM 272 CG PRO A 17 -18.983 -6.910 6.317 1.00 0.00 C ATOM 273 CD PRO A 17 -18.947 -6.282 4.951 1.00 0.00 C ATOM 0 HA PRO A 17 -16.241 -8.096 4.878 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -17.762 -8.446 7.176 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -16.917 -6.938 6.882 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -19.814 -7.610 6.403 1.00 0.00 H new ATOM 0 HG3 PRO A 17 -19.121 -6.154 7.090 1.00 0.00 H new ATOM 0 HD2 PRO A 17 -19.936 -6.257 4.494 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -18.588 -5.253 4.991 1.00 0.00 H new ATOM 281 N SER A 18 -18.997 -9.695 4.393 1.00 0.00 N ATOM 282 CA SER A 18 -19.551 -11.023 4.154 1.00 0.00 C ATOM 283 C SER A 18 -19.189 -11.520 2.758 1.00 0.00 C ATOM 284 O SER A 18 -19.214 -12.721 2.488 1.00 0.00 O ATOM 285 CB SER A 18 -21.072 -11.001 4.322 1.00 0.00 C ATOM 286 OG SER A 18 -21.681 -12.043 3.579 1.00 0.00 O ATOM 0 H SER A 18 -19.629 -8.927 4.166 1.00 0.00 H new ATOM 0 HA SER A 18 -19.121 -11.707 4.886 1.00 0.00 H new ATOM 0 HB2 SER A 18 -21.326 -11.105 5.377 1.00 0.00 H new ATOM 0 HB3 SER A 18 -21.464 -10.038 3.993 1.00 0.00 H new ATOM 0 HG SER A 18 -21.662 -11.819 2.625 1.00 0.00 H new ATOM 292 N SER A 19 -18.853 -10.586 1.873 1.00 0.00 N ATOM 293 CA SER A 19 -18.489 -10.928 0.503 1.00 0.00 C ATOM 294 C SER A 19 -17.305 -11.889 0.479 1.00 0.00 C ATOM 295 O SER A 19 -16.592 -12.040 1.471 1.00 0.00 O ATOM 296 CB SER A 19 -18.150 -9.662 -0.287 1.00 0.00 C ATOM 297 OG SER A 19 -19.308 -9.110 -0.888 1.00 0.00 O ATOM 0 H SER A 19 -18.825 -9.588 2.080 1.00 0.00 H new ATOM 0 HA SER A 19 -19.343 -11.421 0.038 1.00 0.00 H new ATOM 0 HB2 SER A 19 -17.695 -8.926 0.377 1.00 0.00 H new ATOM 0 HB3 SER A 19 -17.414 -9.896 -1.056 1.00 0.00 H new ATOM 0 HG SER A 19 -20.063 -9.177 -0.266 1.00 0.00 H new ATOM 303 N VAL A 20 -17.100 -12.537 -0.664 1.00 0.00 N ATOM 304 CA VAL A 20 -16.002 -13.484 -0.820 1.00 0.00 C ATOM 305 C VAL A 20 -14.915 -12.920 -1.728 1.00 0.00 C ATOM 306 O VAL A 20 -14.991 -13.040 -2.951 1.00 0.00 O ATOM 307 CB VAL A 20 -16.494 -14.824 -1.397 1.00 0.00 C ATOM 308 CG1 VAL A 20 -15.327 -15.779 -1.599 1.00 0.00 C ATOM 309 CG2 VAL A 20 -17.548 -15.441 -0.489 1.00 0.00 C ATOM 0 H VAL A 20 -17.680 -12.423 -1.495 1.00 0.00 H new ATOM 0 HA VAL A 20 -15.588 -13.656 0.174 1.00 0.00 H new ATOM 0 HB VAL A 20 -16.951 -14.635 -2.369 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -15.694 -16.721 -2.007 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -14.611 -15.337 -2.292 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -14.839 -15.964 -0.642 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -17.884 -16.387 -0.913 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -17.120 -15.617 0.498 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -18.396 -14.761 -0.401 1.00 0.00 H new ATOM 319 N ILE A 21 -13.906 -12.305 -1.122 1.00 0.00 N ATOM 320 CA ILE A 21 -12.802 -11.724 -1.876 1.00 0.00 C ATOM 321 C ILE A 21 -11.789 -12.790 -2.278 1.00 0.00 C ATOM 322 O ILE A 21 -11.244 -13.496 -1.429 1.00 0.00 O ATOM 323 CB ILE A 21 -12.083 -10.627 -1.067 1.00 0.00 C ATOM 324 CG1 ILE A 21 -13.102 -9.658 -0.463 1.00 0.00 C ATOM 325 CG2 ILE A 21 -11.094 -9.881 -1.950 1.00 0.00 C ATOM 326 CD1 ILE A 21 -13.469 -9.983 0.968 1.00 0.00 C ATOM 0 H ILE A 21 -13.830 -12.196 -0.111 1.00 0.00 H new ATOM 0 HA ILE A 21 -13.233 -11.279 -2.773 1.00 0.00 H new ATOM 0 HB ILE A 21 -11.531 -11.098 -0.254 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -12.699 -8.646 -0.506 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -14.006 -9.667 -1.073 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -10.594 -9.109 -1.365 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -10.353 -10.580 -2.337 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -11.626 -9.418 -2.781 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -14.195 -9.256 1.332 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -13.902 -10.982 1.015 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -12.575 -9.946 1.590 1.00 0.00 H new ATOM 338 N LYS A 22 -11.539 -12.901 -3.578 1.00 0.00 N ATOM 339 CA LYS A 22 -10.589 -13.879 -4.095 1.00 0.00 C ATOM 340 C LYS A 22 -9.647 -13.239 -5.109 1.00 0.00 C ATOM 341 O LYS A 22 -10.090 -12.654 -6.098 1.00 0.00 O ATOM 342 CB LYS A 22 -11.332 -15.050 -4.741 1.00 0.00 C ATOM 343 CG LYS A 22 -10.633 -16.387 -4.561 1.00 0.00 C ATOM 344 CD LYS A 22 -11.626 -17.537 -4.544 1.00 0.00 C ATOM 345 CE LYS A 22 -12.170 -17.783 -3.145 1.00 0.00 C ATOM 346 NZ LYS A 22 -12.703 -19.165 -2.992 1.00 0.00 N ATOM 0 H LYS A 22 -11.982 -12.325 -4.294 1.00 0.00 H new ATOM 0 HA LYS A 22 -9.996 -14.250 -3.259 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -12.334 -15.113 -4.316 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -11.450 -14.851 -5.806 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -9.916 -16.536 -5.369 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -10.067 -16.380 -3.630 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -12.450 -17.317 -5.223 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -11.143 -18.442 -4.912 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -11.380 -17.616 -2.413 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -12.960 -17.063 -2.931 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -13.064 -19.293 -2.025 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -13.474 -19.317 -3.673 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -11.943 -19.852 -3.171 1.00 0.00 H new ATOM 360 N ILE A 23 -8.347 -13.355 -4.859 1.00 0.00 N ATOM 361 CA ILE A 23 -7.344 -12.789 -5.752 1.00 0.00 C ATOM 362 C ILE A 23 -6.995 -13.763 -6.873 1.00 0.00 C ATOM 363 O ILE A 23 -6.668 -14.924 -6.623 1.00 0.00 O ATOM 364 CB ILE A 23 -6.058 -12.417 -4.991 1.00 0.00 C ATOM 365 CG1 ILE A 23 -6.370 -11.414 -3.878 1.00 0.00 C ATOM 366 CG2 ILE A 23 -5.021 -11.849 -5.948 1.00 0.00 C ATOM 367 CD1 ILE A 23 -6.787 -12.065 -2.578 1.00 0.00 C ATOM 0 H ILE A 23 -7.964 -13.836 -4.045 1.00 0.00 H new ATOM 0 HA ILE A 23 -7.777 -11.885 -6.180 1.00 0.00 H new ATOM 0 HB ILE A 23 -5.648 -13.319 -4.537 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -5.490 -10.796 -3.700 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -7.165 -10.748 -4.213 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -4.118 -11.591 -5.395 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -4.781 -12.593 -6.708 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -5.420 -10.956 -6.428 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -6.992 -11.295 -1.835 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -7.685 -12.661 -2.741 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -5.984 -12.710 -2.220 1.00 0.00 H new ATOM 379 N THR A 24 -7.064 -13.282 -8.110 1.00 0.00 N ATOM 380 CA THR A 24 -6.755 -14.109 -9.270 1.00 0.00 C ATOM 381 C THR A 24 -5.953 -13.327 -10.304 1.00 0.00 C ATOM 382 O THR A 24 -6.233 -12.158 -10.566 1.00 0.00 O ATOM 383 CB THR A 24 -8.036 -14.649 -9.932 1.00 0.00 C ATOM 384 OG1 THR A 24 -8.795 -15.409 -8.985 1.00 0.00 O ATOM 385 CG2 THR A 24 -7.699 -15.520 -11.133 1.00 0.00 C ATOM 0 H THR A 24 -7.331 -12.324 -8.335 1.00 0.00 H new ATOM 0 HA THR A 24 -6.159 -14.948 -8.911 1.00 0.00 H new ATOM 0 HB THR A 24 -8.627 -13.799 -10.273 1.00 0.00 H new ATOM 0 HG1 THR A 24 -9.749 -15.221 -9.104 1.00 0.00 H new ATOM 0 HG21 THR A 24 -8.620 -15.890 -11.584 1.00 0.00 H new ATOM 0 HG22 THR A 24 -7.147 -14.932 -11.866 1.00 0.00 H new ATOM 0 HG23 THR A 24 -7.088 -16.364 -10.811 1.00 0.00 H new ATOM 393 N ASP A 25 -4.955 -13.981 -10.889 1.00 0.00 N ATOM 394 CA ASP A 25 -4.113 -13.347 -11.896 1.00 0.00 C ATOM 395 C ASP A 25 -4.757 -13.435 -13.276 1.00 0.00 C ATOM 396 O ASP A 25 -5.358 -14.450 -13.630 1.00 0.00 O ATOM 397 CB ASP A 25 -2.731 -14.003 -11.922 1.00 0.00 C ATOM 398 CG ASP A 25 -1.964 -13.788 -10.633 1.00 0.00 C ATOM 399 OD1 ASP A 25 -2.484 -13.082 -9.744 1.00 0.00 O ATOM 400 OD2 ASP A 25 -0.842 -14.324 -10.513 1.00 0.00 O ATOM 0 H ASP A 25 -4.710 -14.949 -10.683 1.00 0.00 H new ATOM 0 HA ASP A 25 -4.003 -12.295 -11.632 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -2.843 -15.072 -12.101 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -2.156 -13.599 -12.755 1.00 0.00 H new ATOM 405 N LEU A 26 -4.629 -12.364 -14.052 1.00 0.00 N ATOM 406 CA LEU A 26 -5.200 -12.319 -15.394 1.00 0.00 C ATOM 407 C LEU A 26 -4.103 -12.209 -16.449 1.00 0.00 C ATOM 408 O LEU A 26 -4.281 -12.634 -17.590 1.00 0.00 O ATOM 409 CB LEU A 26 -6.164 -11.138 -15.520 1.00 0.00 C ATOM 410 CG LEU A 26 -7.621 -11.419 -15.151 1.00 0.00 C ATOM 411 CD1 LEU A 26 -8.450 -10.148 -15.243 1.00 0.00 C ATOM 412 CD2 LEU A 26 -8.200 -12.501 -16.052 1.00 0.00 C ATOM 0 H LEU A 26 -4.135 -11.516 -13.775 1.00 0.00 H new ATOM 0 HA LEU A 26 -5.748 -13.247 -15.561 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -5.800 -10.328 -14.888 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -6.133 -10.778 -16.548 1.00 0.00 H new ATOM 0 HG LEU A 26 -7.652 -11.775 -14.121 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -9.484 -10.368 -14.977 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -8.049 -9.402 -14.557 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -8.412 -9.762 -16.262 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -9.238 -12.688 -15.775 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -8.155 -12.172 -17.090 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -7.623 -13.418 -15.936 1.00 0.00 H new ATOM 424 N VAL A 27 -2.968 -11.638 -16.058 1.00 0.00 N ATOM 425 CA VAL A 27 -1.841 -11.476 -16.968 1.00 0.00 C ATOM 426 C VAL A 27 -0.792 -12.559 -16.743 1.00 0.00 C ATOM 427 O VAL A 27 -0.589 -13.427 -17.591 1.00 0.00 O ATOM 428 CB VAL A 27 -1.181 -10.094 -16.803 1.00 0.00 C ATOM 429 CG1 VAL A 27 0.011 -9.956 -17.738 1.00 0.00 C ATOM 430 CG2 VAL A 27 -2.194 -8.986 -17.050 1.00 0.00 C ATOM 0 H VAL A 27 -2.805 -11.280 -15.117 1.00 0.00 H new ATOM 0 HA VAL A 27 -2.236 -11.563 -17.980 1.00 0.00 H new ATOM 0 HB VAL A 27 -0.821 -10.003 -15.778 1.00 0.00 H new ATOM 0 HG11 VAL A 27 0.464 -8.973 -17.607 1.00 0.00 H new ATOM 0 HG12 VAL A 27 0.745 -10.728 -17.508 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -0.321 -10.068 -18.770 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -1.710 -8.017 -16.929 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -2.587 -9.071 -18.063 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -3.012 -9.075 -16.335 1.00 0.00 H new ATOM 440 N GLY A 28 -0.128 -12.501 -15.593 1.00 0.00 N ATOM 441 CA GLY A 28 0.892 -13.483 -15.276 1.00 0.00 C ATOM 442 C GLY A 28 2.197 -12.845 -14.841 1.00 0.00 C ATOM 443 O GLY A 28 2.743 -13.186 -13.792 1.00 0.00 O ATOM 0 H GLY A 28 -0.278 -11.792 -14.875 1.00 0.00 H new ATOM 0 HA2 GLY A 28 0.529 -14.136 -14.483 1.00 0.00 H new ATOM 0 HA3 GLY A 28 1.071 -14.111 -16.149 1.00 0.00 H new ATOM 447 N ASP A 29 2.698 -11.918 -15.650 1.00 0.00 N ATOM 448 CA ASP A 29 3.947 -11.230 -15.344 1.00 0.00 C ATOM 449 C ASP A 29 3.682 -9.795 -14.899 1.00 0.00 C ATOM 450 O ASP A 29 4.254 -9.325 -13.916 1.00 0.00 O ATOM 451 CB ASP A 29 4.870 -11.238 -16.563 1.00 0.00 C ATOM 452 CG ASP A 29 6.153 -10.466 -16.323 1.00 0.00 C ATOM 453 OD1 ASP A 29 6.132 -9.225 -16.461 1.00 0.00 O ATOM 454 OD2 ASP A 29 7.177 -11.102 -15.997 1.00 0.00 O ATOM 0 H ASP A 29 2.258 -11.626 -16.523 1.00 0.00 H new ATOM 0 HA ASP A 29 4.435 -11.760 -14.526 1.00 0.00 H new ATOM 0 HB2 ASP A 29 5.113 -12.268 -16.825 1.00 0.00 H new ATOM 0 HB3 ASP A 29 4.345 -10.808 -17.416 1.00 0.00 H new ATOM 459 N GLN A 30 2.814 -9.105 -15.632 1.00 0.00 N ATOM 460 CA GLN A 30 2.475 -7.723 -15.313 1.00 0.00 C ATOM 461 C GLN A 30 1.848 -7.621 -13.927 1.00 0.00 C ATOM 462 O GLN A 30 1.308 -8.597 -13.406 1.00 0.00 O ATOM 463 CB GLN A 30 1.517 -7.155 -16.362 1.00 0.00 C ATOM 464 CG GLN A 30 1.591 -5.643 -16.499 1.00 0.00 C ATOM 465 CD GLN A 30 0.628 -4.926 -15.572 1.00 0.00 C ATOM 466 OE1 GLN A 30 1.033 -4.088 -14.766 1.00 0.00 O ATOM 467 NE2 GLN A 30 -0.654 -5.253 -15.682 1.00 0.00 N ATOM 0 H GLN A 30 2.333 -9.480 -16.450 1.00 0.00 H new ATOM 0 HA GLN A 30 3.396 -7.140 -15.318 1.00 0.00 H new ATOM 0 HB2 GLN A 30 1.738 -7.610 -17.328 1.00 0.00 H new ATOM 0 HB3 GLN A 30 0.497 -7.438 -16.102 1.00 0.00 H new ATOM 0 HG2 GLN A 30 2.608 -5.312 -16.287 1.00 0.00 H new ATOM 0 HG3 GLN A 30 1.373 -5.364 -17.530 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -0.945 -5.953 -16.364 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -1.348 -4.804 -15.084 1.00 0.00 H new ATOM 476 N ASP A 31 1.923 -6.434 -13.335 1.00 0.00 N ATOM 477 CA ASP A 31 1.362 -6.205 -12.008 1.00 0.00 C ATOM 478 C ASP A 31 -0.151 -6.025 -12.082 1.00 0.00 C ATOM 479 O ASP A 31 -0.665 -4.921 -11.900 1.00 0.00 O ATOM 480 CB ASP A 31 2.004 -4.974 -11.366 1.00 0.00 C ATOM 481 CG ASP A 31 3.410 -5.246 -10.869 1.00 0.00 C ATOM 482 OD1 ASP A 31 3.549 -5.772 -9.745 1.00 0.00 O ATOM 483 OD2 ASP A 31 4.370 -4.934 -11.603 1.00 0.00 O ATOM 0 H ASP A 31 2.366 -5.616 -13.753 1.00 0.00 H new ATOM 0 HA ASP A 31 1.576 -7.079 -11.393 1.00 0.00 H new ATOM 0 HB2 ASP A 31 2.029 -4.161 -12.092 1.00 0.00 H new ATOM 0 HB3 ASP A 31 1.386 -4.638 -10.533 1.00 0.00 H new ATOM 488 N HIS A 32 -0.859 -7.117 -12.352 1.00 0.00 N ATOM 489 CA HIS A 32 -2.314 -7.081 -12.450 1.00 0.00 C ATOM 490 C HIS A 32 -2.957 -7.768 -11.250 1.00 0.00 C ATOM 491 O HIS A 32 -2.288 -8.470 -10.491 1.00 0.00 O ATOM 492 CB HIS A 32 -2.775 -7.751 -13.745 1.00 0.00 C ATOM 493 CG HIS A 32 -4.050 -7.186 -14.290 1.00 0.00 C ATOM 494 ND1 HIS A 32 -4.883 -7.887 -15.137 1.00 0.00 N ATOM 495 CD2 HIS A 32 -4.635 -5.979 -14.104 1.00 0.00 C ATOM 496 CE1 HIS A 32 -5.924 -7.135 -15.449 1.00 0.00 C ATOM 497 NE2 HIS A 32 -5.797 -5.972 -14.835 1.00 0.00 N ATOM 0 H HIS A 32 -0.449 -8.038 -12.507 1.00 0.00 H new ATOM 0 HA HIS A 32 -2.628 -6.037 -12.458 1.00 0.00 H new ATOM 0 HB2 HIS A 32 -1.992 -7.649 -14.496 1.00 0.00 H new ATOM 0 HB3 HIS A 32 -2.907 -8.818 -13.565 1.00 0.00 H new ATOM 0 HD2 HIS A 32 -4.258 -5.172 -13.494 1.00 0.00 H new ATOM 0 HE1 HIS A 32 -6.740 -7.422 -16.096 1.00 0.00 H new ATOM 0 HE2 HIS A 32 -6.455 -5.195 -14.894 1.00 0.00 H new ATOM 505 N TYR A 33 -4.259 -7.561 -11.083 1.00 0.00 N ATOM 506 CA TYR A 33 -4.992 -8.158 -9.973 1.00 0.00 C ATOM 507 C TYR A 33 -6.489 -8.191 -10.264 1.00 0.00 C ATOM 508 O TYR A 33 -7.138 -7.149 -10.354 1.00 0.00 O ATOM 509 CB TYR A 33 -4.728 -7.379 -8.683 1.00 0.00 C ATOM 510 CG TYR A 33 -3.551 -7.900 -7.891 1.00 0.00 C ATOM 511 CD1 TYR A 33 -3.486 -9.233 -7.501 1.00 0.00 C ATOM 512 CD2 TYR A 33 -2.504 -7.061 -7.531 1.00 0.00 C ATOM 513 CE1 TYR A 33 -2.412 -9.713 -6.777 1.00 0.00 C ATOM 514 CE2 TYR A 33 -1.426 -7.533 -6.808 1.00 0.00 C ATOM 515 CZ TYR A 33 -1.385 -8.860 -6.433 1.00 0.00 C ATOM 516 OH TYR A 33 -0.313 -9.334 -5.711 1.00 0.00 O ATOM 0 H TYR A 33 -4.828 -6.984 -11.702 1.00 0.00 H new ATOM 0 HA TYR A 33 -4.642 -9.183 -9.849 1.00 0.00 H new ATOM 0 HB2 TYR A 33 -4.554 -6.332 -8.930 1.00 0.00 H new ATOM 0 HB3 TYR A 33 -5.620 -7.415 -8.058 1.00 0.00 H new ATOM 0 HD1 TYR A 33 -4.289 -9.904 -7.769 1.00 0.00 H new ATOM 0 HD2 TYR A 33 -2.533 -6.021 -7.822 1.00 0.00 H new ATOM 0 HE1 TYR A 33 -2.377 -10.751 -6.482 1.00 0.00 H new ATOM 0 HE2 TYR A 33 -0.620 -6.867 -6.538 1.00 0.00 H new ATOM 0 HH TYR A 33 0.323 -8.605 -5.553 1.00 0.00 H new ATOM 526 N ALA A 34 -7.030 -9.396 -10.409 1.00 0.00 N ATOM 527 CA ALA A 34 -8.451 -9.567 -10.687 1.00 0.00 C ATOM 528 C ALA A 34 -9.238 -9.794 -9.401 1.00 0.00 C ATOM 529 O ALA A 34 -9.264 -10.903 -8.865 1.00 0.00 O ATOM 530 CB ALA A 34 -8.665 -10.724 -11.651 1.00 0.00 C ATOM 0 H ALA A 34 -6.506 -10.268 -10.339 1.00 0.00 H new ATOM 0 HA ALA A 34 -8.818 -8.651 -11.150 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -9.730 -10.840 -11.849 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -8.142 -10.521 -12.585 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -8.276 -11.642 -11.210 1.00 0.00 H new ATOM 536 N LEU A 35 -9.879 -8.739 -8.911 1.00 0.00 N ATOM 537 CA LEU A 35 -10.668 -8.824 -7.686 1.00 0.00 C ATOM 538 C LEU A 35 -12.084 -9.307 -7.983 1.00 0.00 C ATOM 539 O LEU A 35 -12.861 -8.615 -8.639 1.00 0.00 O ATOM 540 CB LEU A 35 -10.716 -7.461 -6.993 1.00 0.00 C ATOM 541 CG LEU A 35 -11.721 -7.326 -5.848 1.00 0.00 C ATOM 542 CD1 LEU A 35 -11.345 -8.245 -4.696 1.00 0.00 C ATOM 543 CD2 LEU A 35 -11.801 -5.882 -5.376 1.00 0.00 C ATOM 0 H LEU A 35 -9.868 -7.815 -9.342 1.00 0.00 H new ATOM 0 HA LEU A 35 -10.190 -9.545 -7.023 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -9.722 -7.237 -6.606 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -10.944 -6.703 -7.742 1.00 0.00 H new ATOM 0 HG LEU A 35 -12.703 -7.622 -6.216 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -12.071 -8.135 -3.891 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -11.340 -9.279 -5.042 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -10.353 -7.981 -4.329 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -12.521 -5.805 -4.561 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -10.821 -5.559 -5.026 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -12.119 -5.246 -6.202 1.00 0.00 H new ATOM 555 N GLU A 36 -12.412 -10.498 -7.493 1.00 0.00 N ATOM 556 CA GLU A 36 -13.735 -11.073 -7.705 1.00 0.00 C ATOM 557 C GLU A 36 -14.530 -11.104 -6.402 1.00 0.00 C ATOM 558 O GLU A 36 -14.111 -11.721 -5.422 1.00 0.00 O ATOM 559 CB GLU A 36 -13.616 -12.487 -8.276 1.00 0.00 C ATOM 560 CG GLU A 36 -12.574 -13.341 -7.574 1.00 0.00 C ATOM 561 CD GLU A 36 -12.642 -14.800 -7.984 1.00 0.00 C ATOM 562 OE1 GLU A 36 -12.070 -15.146 -9.039 1.00 0.00 O ATOM 563 OE2 GLU A 36 -13.267 -15.594 -7.251 1.00 0.00 O ATOM 0 H GLU A 36 -11.780 -11.083 -6.947 1.00 0.00 H new ATOM 0 HA GLU A 36 -14.266 -10.444 -8.420 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -14.585 -12.981 -8.206 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -13.367 -12.422 -9.335 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -11.581 -12.951 -7.796 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -12.713 -13.264 -6.496 1.00 0.00 H new ATOM 570 N ILE A 37 -15.677 -10.433 -6.400 1.00 0.00 N ATOM 571 CA ILE A 37 -16.530 -10.384 -5.219 1.00 0.00 C ATOM 572 C ILE A 37 -17.742 -11.295 -5.378 1.00 0.00 C ATOM 573 O ILE A 37 -18.338 -11.370 -6.453 1.00 0.00 O ATOM 574 CB ILE A 37 -17.013 -8.950 -4.933 1.00 0.00 C ATOM 575 CG1 ILE A 37 -17.676 -8.877 -3.556 1.00 0.00 C ATOM 576 CG2 ILE A 37 -17.977 -8.490 -6.016 1.00 0.00 C ATOM 577 CD1 ILE A 37 -17.097 -7.802 -2.663 1.00 0.00 C ATOM 0 H ILE A 37 -16.037 -9.916 -7.202 1.00 0.00 H new ATOM 0 HA ILE A 37 -15.927 -10.730 -4.379 1.00 0.00 H new ATOM 0 HB ILE A 37 -16.150 -8.284 -4.936 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -18.743 -8.695 -3.685 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -17.574 -9.843 -3.061 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -18.310 -7.475 -5.800 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -17.474 -8.509 -6.983 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -18.839 -9.156 -6.043 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -17.615 -7.808 -1.704 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -16.036 -7.994 -2.504 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -17.223 -6.829 -3.137 1.00 0.00 H new ATOM 589 N SER A 38 -18.104 -11.984 -4.301 1.00 0.00 N ATOM 590 CA SER A 38 -19.245 -12.892 -4.321 1.00 0.00 C ATOM 591 C SER A 38 -20.144 -12.662 -3.111 1.00 0.00 C ATOM 592 O SER A 38 -19.751 -12.923 -1.973 1.00 0.00 O ATOM 593 CB SER A 38 -18.767 -14.345 -4.347 1.00 0.00 C ATOM 594 OG SER A 38 -19.608 -15.144 -5.160 1.00 0.00 O ATOM 0 H SER A 38 -17.623 -11.931 -3.403 1.00 0.00 H new ATOM 0 HA SER A 38 -19.822 -12.691 -5.224 1.00 0.00 H new ATOM 0 HB2 SER A 38 -17.745 -14.388 -4.723 1.00 0.00 H new ATOM 0 HB3 SER A 38 -18.751 -14.744 -3.333 1.00 0.00 H new ATOM 0 HG SER A 38 -19.280 -16.068 -5.161 1.00 0.00 H new ATOM 600 N ASP A 39 -21.352 -12.171 -3.364 1.00 0.00 N ATOM 601 CA ASP A 39 -22.309 -11.906 -2.296 1.00 0.00 C ATOM 602 C ASP A 39 -23.633 -11.404 -2.864 1.00 0.00 C ATOM 603 O ASP A 39 -23.829 -11.383 -4.079 1.00 0.00 O ATOM 604 CB ASP A 39 -21.739 -10.880 -1.314 1.00 0.00 C ATOM 605 CG ASP A 39 -22.160 -11.152 0.117 1.00 0.00 C ATOM 606 OD1 ASP A 39 -21.444 -11.902 0.813 1.00 0.00 O ATOM 607 OD2 ASP A 39 -23.204 -10.615 0.540 1.00 0.00 O ATOM 0 H ASP A 39 -21.692 -11.948 -4.300 1.00 0.00 H new ATOM 0 HA ASP A 39 -22.493 -12.841 -1.767 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -20.651 -10.887 -1.377 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -22.069 -9.882 -1.603 1.00 0.00 H new ATOM 612 N ALA A 40 -24.537 -11.003 -1.977 1.00 0.00 N ATOM 613 CA ALA A 40 -25.842 -10.500 -2.390 1.00 0.00 C ATOM 614 C ALA A 40 -26.021 -9.041 -1.985 1.00 0.00 C ATOM 615 O ALA A 40 -27.140 -8.589 -1.742 1.00 0.00 O ATOM 616 CB ALA A 40 -26.950 -11.356 -1.794 1.00 0.00 C ATOM 0 H ALA A 40 -24.390 -11.016 -0.968 1.00 0.00 H new ATOM 0 HA ALA A 40 -25.899 -10.557 -3.477 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -27.919 -10.969 -2.110 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -26.840 -12.385 -2.138 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -26.886 -11.328 -0.706 1.00 0.00 H new ATOM 622 N GLN A 41 -24.913 -8.311 -1.914 1.00 0.00 N ATOM 623 CA GLN A 41 -24.950 -6.903 -1.537 1.00 0.00 C ATOM 624 C GLN A 41 -25.063 -6.012 -2.770 1.00 0.00 C ATOM 625 O GLN A 41 -25.161 -4.790 -2.658 1.00 0.00 O ATOM 626 CB GLN A 41 -23.698 -6.534 -0.740 1.00 0.00 C ATOM 627 CG GLN A 41 -23.855 -6.723 0.761 1.00 0.00 C ATOM 628 CD GLN A 41 -22.563 -7.141 1.434 1.00 0.00 C ATOM 629 OE1 GLN A 41 -22.122 -6.517 2.400 1.00 0.00 O ATOM 630 NE2 GLN A 41 -21.948 -8.204 0.928 1.00 0.00 N ATOM 0 H GLN A 41 -23.979 -8.671 -2.112 1.00 0.00 H new ATOM 0 HA GLN A 41 -25.830 -6.743 -0.914 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -22.863 -7.141 -1.089 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -23.442 -5.494 -0.942 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -24.207 -5.792 1.206 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -24.619 -7.476 0.951 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -22.349 -8.692 0.127 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -21.075 -8.533 1.341 1.00 0.00 H new ATOM 639 N PHE A 42 -25.049 -6.632 -3.945 1.00 0.00 N ATOM 640 CA PHE A 42 -25.148 -5.894 -5.200 1.00 0.00 C ATOM 641 C PHE A 42 -26.318 -6.401 -6.037 1.00 0.00 C ATOM 642 O PHE A 42 -26.350 -6.217 -7.253 1.00 0.00 O ATOM 643 CB PHE A 42 -23.846 -6.020 -5.994 1.00 0.00 C ATOM 644 CG PHE A 42 -23.721 -7.318 -6.740 1.00 0.00 C ATOM 645 CD1 PHE A 42 -23.583 -8.514 -6.055 1.00 0.00 C ATOM 646 CD2 PHE A 42 -23.743 -7.341 -8.125 1.00 0.00 C ATOM 647 CE1 PHE A 42 -23.467 -9.710 -6.740 1.00 0.00 C ATOM 648 CE2 PHE A 42 -23.628 -8.533 -8.814 1.00 0.00 C ATOM 649 CZ PHE A 42 -23.491 -9.719 -8.121 1.00 0.00 C ATOM 0 H PHE A 42 -24.970 -7.643 -4.055 1.00 0.00 H new ATOM 0 HA PHE A 42 -25.321 -4.844 -4.963 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -23.781 -5.195 -6.703 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -23.002 -5.920 -5.311 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -23.566 -8.513 -4.975 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -23.851 -6.416 -8.672 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -23.358 -10.636 -6.195 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -23.645 -8.537 -9.894 1.00 0.00 H new ATOM 0 HZ PHE A 42 -23.403 -10.652 -8.658 1.00 0.00 H new ATOM 659 N ASN A 43 -27.278 -7.041 -5.376 1.00 0.00 N ATOM 660 CA ASN A 43 -28.450 -7.575 -6.059 1.00 0.00 C ATOM 661 C ASN A 43 -29.149 -6.489 -6.872 1.00 0.00 C ATOM 662 O ASN A 43 -29.501 -6.698 -8.032 1.00 0.00 O ATOM 663 CB ASN A 43 -29.426 -8.177 -5.046 1.00 0.00 C ATOM 664 CG ASN A 43 -29.507 -9.688 -5.148 1.00 0.00 C ATOM 665 OD1 ASN A 43 -29.470 -10.250 -6.243 1.00 0.00 O ATOM 666 ND2 ASN A 43 -29.620 -10.353 -4.004 1.00 0.00 N ATOM 0 H ASN A 43 -27.267 -7.202 -4.369 1.00 0.00 H new ATOM 0 HA ASN A 43 -28.117 -8.357 -6.742 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -29.116 -7.900 -4.038 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -30.417 -7.751 -5.203 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -29.680 -11.371 -4.010 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -29.647 -9.846 -3.120 1.00 0.00 H new ATOM 673 N GLY A 44 -29.345 -5.329 -6.254 1.00 0.00 N ATOM 674 CA GLY A 44 -30.000 -4.227 -6.934 1.00 0.00 C ATOM 675 C GLY A 44 -29.036 -3.114 -7.296 1.00 0.00 C ATOM 676 O GLY A 44 -29.212 -1.969 -6.876 1.00 0.00 O ATOM 0 H GLY A 44 -29.062 -5.132 -5.294 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -30.480 -4.597 -7.840 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -30.788 -3.828 -6.296 1.00 0.00 H new ATOM 680 N LEU A 45 -28.014 -3.449 -8.075 1.00 0.00 N ATOM 681 CA LEU A 45 -27.017 -2.469 -8.493 1.00 0.00 C ATOM 682 C LEU A 45 -26.659 -2.649 -9.964 1.00 0.00 C ATOM 683 O LEU A 45 -27.000 -3.661 -10.577 1.00 0.00 O ATOM 684 CB LEU A 45 -25.759 -2.594 -7.631 1.00 0.00 C ATOM 685 CG LEU A 45 -25.903 -2.178 -6.167 1.00 0.00 C ATOM 686 CD1 LEU A 45 -24.589 -2.368 -5.426 1.00 0.00 C ATOM 687 CD2 LEU A 45 -26.370 -0.733 -6.067 1.00 0.00 C ATOM 0 H LEU A 45 -27.853 -4.392 -8.430 1.00 0.00 H new ATOM 0 HA LEU A 45 -27.443 -1.475 -8.362 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -25.424 -3.631 -7.662 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -24.972 -1.991 -8.083 1.00 0.00 H new ATOM 0 HG LEU A 45 -26.654 -2.815 -5.700 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -24.711 -2.067 -4.386 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -24.296 -3.417 -5.468 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -23.817 -1.757 -5.893 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -26.467 -0.454 -5.018 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -25.642 -0.081 -6.550 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -27.336 -0.628 -6.561 1.00 0.00 H new ATOM 699 N SER A 46 -25.968 -1.662 -10.525 1.00 0.00 N ATOM 700 CA SER A 46 -25.565 -1.710 -11.926 1.00 0.00 C ATOM 701 C SER A 46 -24.069 -1.979 -12.052 1.00 0.00 C ATOM 702 O SER A 46 -23.327 -1.897 -11.072 1.00 0.00 O ATOM 703 CB SER A 46 -25.920 -0.397 -12.626 1.00 0.00 C ATOM 704 OG SER A 46 -25.751 -0.505 -14.029 1.00 0.00 O ATOM 0 H SER A 46 -25.675 -0.819 -10.031 1.00 0.00 H new ATOM 0 HA SER A 46 -26.105 -2.526 -12.406 1.00 0.00 H new ATOM 0 HB2 SER A 46 -26.952 -0.129 -12.400 1.00 0.00 H new ATOM 0 HB3 SER A 46 -25.291 0.406 -12.241 1.00 0.00 H new ATOM 0 HG SER A 46 -25.986 0.347 -14.453 1.00 0.00 H new ATOM 710 N LEU A 47 -23.632 -2.300 -13.264 1.00 0.00 N ATOM 711 CA LEU A 47 -22.223 -2.581 -13.521 1.00 0.00 C ATOM 712 C LEU A 47 -21.344 -1.423 -13.059 1.00 0.00 C ATOM 713 O LEU A 47 -20.171 -1.612 -12.735 1.00 0.00 O ATOM 714 CB LEU A 47 -21.998 -2.844 -15.011 1.00 0.00 C ATOM 715 CG LEU A 47 -22.303 -4.263 -15.495 1.00 0.00 C ATOM 716 CD1 LEU A 47 -21.426 -5.273 -14.771 1.00 0.00 C ATOM 717 CD2 LEU A 47 -23.775 -4.590 -15.294 1.00 0.00 C ATOM 0 H LEU A 47 -24.233 -2.372 -14.085 1.00 0.00 H new ATOM 0 HA LEU A 47 -21.947 -3.471 -12.956 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -22.614 -2.147 -15.580 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -20.958 -2.616 -15.247 1.00 0.00 H new ATOM 0 HG LEU A 47 -22.082 -4.319 -16.561 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -21.657 -6.277 -15.128 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -20.377 -5.050 -14.967 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -21.615 -5.217 -13.699 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -23.974 -5.603 -15.644 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -24.023 -4.517 -14.235 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -24.385 -3.885 -15.859 1.00 0.00 H new ATOM 729 N ILE A 48 -21.919 -0.225 -13.030 1.00 0.00 N ATOM 730 CA ILE A 48 -21.189 0.962 -12.605 1.00 0.00 C ATOM 731 C ILE A 48 -21.231 1.120 -11.089 1.00 0.00 C ATOM 732 O ILE A 48 -20.232 1.472 -10.464 1.00 0.00 O ATOM 733 CB ILE A 48 -21.756 2.236 -13.259 1.00 0.00 C ATOM 734 CG1 ILE A 48 -21.828 2.067 -14.778 1.00 0.00 C ATOM 735 CG2 ILE A 48 -20.904 3.443 -12.894 1.00 0.00 C ATOM 736 CD1 ILE A 48 -20.481 1.828 -15.424 1.00 0.00 C ATOM 0 H ILE A 48 -22.888 -0.051 -13.296 1.00 0.00 H new ATOM 0 HA ILE A 48 -20.156 0.828 -12.925 1.00 0.00 H new ATOM 0 HB ILE A 48 -22.766 2.402 -12.883 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -22.487 1.231 -15.012 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -22.278 2.959 -15.214 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -21.317 4.336 -13.364 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -20.900 3.571 -11.812 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -19.884 3.288 -13.245 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -20.608 1.717 -16.501 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -19.825 2.674 -15.221 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -20.038 0.920 -15.016 1.00 0.00 H new ATOM 748 N ASN A 49 -22.395 0.855 -10.504 1.00 0.00 N ATOM 749 CA ASN A 49 -22.568 0.967 -9.061 1.00 0.00 C ATOM 750 C ASN A 49 -21.722 -0.072 -8.330 1.00 0.00 C ATOM 751 O ASN A 49 -21.259 0.165 -7.214 1.00 0.00 O ATOM 752 CB ASN A 49 -24.041 0.795 -8.688 1.00 0.00 C ATOM 753 CG ASN A 49 -24.959 1.636 -9.554 1.00 0.00 C ATOM 754 OD1 ASN A 49 -24.518 2.578 -10.213 1.00 0.00 O ATOM 755 ND2 ASN A 49 -26.243 1.299 -9.556 1.00 0.00 N ATOM 0 H ASN A 49 -23.232 0.561 -11.008 1.00 0.00 H new ATOM 0 HA ASN A 49 -22.237 1.960 -8.756 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -24.317 -0.255 -8.784 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -24.182 1.068 -7.642 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -26.908 1.829 -10.119 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -26.564 0.511 -8.994 1.00 0.00 H new ATOM 762 N GLN A 50 -21.526 -1.221 -8.967 1.00 0.00 N ATOM 763 CA GLN A 50 -20.736 -2.296 -8.377 1.00 0.00 C ATOM 764 C GLN A 50 -19.245 -1.991 -8.473 1.00 0.00 C ATOM 765 O GLN A 50 -18.474 -2.323 -7.572 1.00 0.00 O ATOM 766 CB GLN A 50 -21.043 -3.624 -9.072 1.00 0.00 C ATOM 767 CG GLN A 50 -22.478 -4.090 -8.885 1.00 0.00 C ATOM 768 CD GLN A 50 -23.118 -4.541 -10.183 1.00 0.00 C ATOM 769 OE1 GLN A 50 -22.428 -4.836 -11.160 1.00 0.00 O ATOM 770 NE2 GLN A 50 -24.445 -4.597 -10.201 1.00 0.00 N ATOM 0 H GLN A 50 -21.903 -1.432 -9.891 1.00 0.00 H new ATOM 0 HA GLN A 50 -21.005 -2.375 -7.324 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -20.838 -3.523 -10.138 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -20.368 -4.390 -8.689 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -22.499 -4.912 -8.169 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -23.067 -3.279 -8.457 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -24.977 -4.344 -9.369 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -24.932 -4.893 -11.047 1.00 0.00 H new ATOM 779 N HIS A 51 -18.845 -1.358 -9.571 1.00 0.00 N ATOM 780 CA HIS A 51 -17.445 -1.008 -9.784 1.00 0.00 C ATOM 781 C HIS A 51 -17.079 0.261 -9.020 1.00 0.00 C ATOM 782 O HIS A 51 -15.936 0.438 -8.598 1.00 0.00 O ATOM 783 CB HIS A 51 -17.166 -0.818 -11.275 1.00 0.00 C ATOM 784 CG HIS A 51 -15.756 -1.134 -11.666 1.00 0.00 C ATOM 785 ND1 HIS A 51 -15.396 -2.300 -12.309 1.00 0.00 N ATOM 786 CD2 HIS A 51 -14.612 -0.428 -11.504 1.00 0.00 C ATOM 787 CE1 HIS A 51 -14.092 -2.298 -12.523 1.00 0.00 C ATOM 788 NE2 HIS A 51 -13.593 -1.173 -12.044 1.00 0.00 N ATOM 0 H HIS A 51 -19.470 -1.077 -10.327 1.00 0.00 H new ATOM 0 HA HIS A 51 -16.831 -1.826 -9.408 1.00 0.00 H new ATOM 0 HB2 HIS A 51 -17.844 -1.452 -11.847 1.00 0.00 H new ATOM 0 HB3 HIS A 51 -17.388 0.213 -11.549 1.00 0.00 H new ATOM 0 HD2 HIS A 51 -14.518 0.541 -11.037 1.00 0.00 H new ATOM 0 HE1 HIS A 51 -13.530 -3.083 -13.007 1.00 0.00 H new ATOM 0 HE2 HIS A 51 -12.610 -0.902 -12.071 1.00 0.00 H new ATOM 796 N LYS A 52 -18.057 1.144 -8.847 1.00 0.00 N ATOM 797 CA LYS A 52 -17.840 2.397 -8.134 1.00 0.00 C ATOM 798 C LYS A 52 -17.885 2.180 -6.625 1.00 0.00 C ATOM 799 O LYS A 52 -17.221 2.886 -5.866 1.00 0.00 O ATOM 800 CB LYS A 52 -18.894 3.429 -8.543 1.00 0.00 C ATOM 801 CG LYS A 52 -20.180 3.336 -7.740 1.00 0.00 C ATOM 802 CD LYS A 52 -21.249 4.265 -8.290 1.00 0.00 C ATOM 803 CE LYS A 52 -20.764 5.706 -8.340 1.00 0.00 C ATOM 804 NZ LYS A 52 -20.210 6.150 -7.031 1.00 0.00 N ATOM 0 H LYS A 52 -19.008 1.015 -9.191 1.00 0.00 H new ATOM 0 HA LYS A 52 -16.851 2.771 -8.400 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -18.475 4.429 -8.428 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -19.126 3.300 -9.600 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -20.546 2.309 -7.755 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -19.979 3.587 -6.699 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -21.534 3.941 -9.291 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -22.142 4.202 -7.668 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -19.999 5.805 -9.111 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -21.590 6.358 -8.625 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -20.064 7.180 -7.047 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -20.877 5.907 -6.271 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -19.301 5.674 -6.859 1.00 0.00 H new ATOM 818 N LEU A 53 -18.671 1.198 -6.197 1.00 0.00 N ATOM 819 CA LEU A 53 -18.801 0.886 -4.778 1.00 0.00 C ATOM 820 C LEU A 53 -17.465 0.435 -4.194 1.00 0.00 C ATOM 821 O LEU A 53 -16.991 0.988 -3.202 1.00 0.00 O ATOM 822 CB LEU A 53 -19.854 -0.204 -4.569 1.00 0.00 C ATOM 823 CG LEU A 53 -21.226 0.273 -4.090 1.00 0.00 C ATOM 824 CD1 LEU A 53 -22.173 -0.906 -3.927 1.00 0.00 C ATOM 825 CD2 LEU A 53 -21.098 1.041 -2.783 1.00 0.00 C ATOM 0 H LEU A 53 -19.228 0.604 -6.812 1.00 0.00 H new ATOM 0 HA LEU A 53 -19.116 1.792 -4.261 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -19.985 -0.740 -5.509 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -19.467 -0.921 -3.845 1.00 0.00 H new ATOM 0 HG LEU A 53 -21.639 0.944 -4.843 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -23.144 -0.548 -3.586 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -22.289 -1.414 -4.884 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -21.765 -1.602 -3.194 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -22.084 1.372 -2.458 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -20.663 0.393 -2.022 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -20.455 1.908 -2.932 1.00 0.00 H new ATOM 837 N VAL A 54 -16.862 -0.571 -4.819 1.00 0.00 N ATOM 838 CA VAL A 54 -15.579 -1.094 -4.364 1.00 0.00 C ATOM 839 C VAL A 54 -14.559 0.026 -4.192 1.00 0.00 C ATOM 840 O VAL A 54 -13.732 -0.007 -3.280 1.00 0.00 O ATOM 841 CB VAL A 54 -15.018 -2.138 -5.348 1.00 0.00 C ATOM 842 CG1 VAL A 54 -15.852 -3.409 -5.311 1.00 0.00 C ATOM 843 CG2 VAL A 54 -14.964 -1.566 -6.757 1.00 0.00 C ATOM 0 H VAL A 54 -17.241 -1.040 -5.642 1.00 0.00 H new ATOM 0 HA VAL A 54 -15.755 -1.572 -3.400 1.00 0.00 H new ATOM 0 HB VAL A 54 -14.002 -2.390 -5.044 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -15.441 -4.135 -6.013 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -15.834 -3.827 -4.304 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -16.880 -3.178 -5.590 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -14.565 -2.317 -7.439 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -15.968 -1.284 -7.074 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -14.320 -0.687 -6.768 1.00 0.00 H new ATOM 853 N LYS A 55 -14.623 1.018 -5.074 1.00 0.00 N ATOM 854 CA LYS A 55 -13.707 2.151 -5.019 1.00 0.00 C ATOM 855 C LYS A 55 -14.071 3.091 -3.875 1.00 0.00 C ATOM 856 O LYS A 55 -13.197 3.692 -3.251 1.00 0.00 O ATOM 857 CB LYS A 55 -13.728 2.914 -6.346 1.00 0.00 C ATOM 858 CG LYS A 55 -13.034 2.180 -7.480 1.00 0.00 C ATOM 859 CD LYS A 55 -11.534 2.093 -7.253 1.00 0.00 C ATOM 860 CE LYS A 55 -11.110 0.684 -6.865 1.00 0.00 C ATOM 861 NZ LYS A 55 -10.381 0.000 -7.968 1.00 0.00 N ATOM 0 H LYS A 55 -15.300 1.060 -5.836 1.00 0.00 H new ATOM 0 HA LYS A 55 -12.703 1.766 -4.843 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -14.763 3.107 -6.629 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -13.250 3.884 -6.206 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -13.448 1.176 -7.572 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -13.231 2.693 -8.421 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -11.010 2.395 -8.159 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -11.243 2.791 -6.468 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -10.474 0.727 -5.981 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -11.991 0.101 -6.596 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -10.259 -1.005 -7.732 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -10.926 0.085 -8.850 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -9.448 0.442 -8.094 1.00 0.00 H new ATOM 875 N ASN A 56 -15.367 3.212 -3.604 1.00 0.00 N ATOM 876 CA ASN A 56 -15.846 4.079 -2.533 1.00 0.00 C ATOM 877 C ASN A 56 -15.398 3.558 -1.170 1.00 0.00 C ATOM 878 O ASN A 56 -14.927 4.321 -0.328 1.00 0.00 O ATOM 879 CB ASN A 56 -17.372 4.181 -2.576 1.00 0.00 C ATOM 880 CG ASN A 56 -17.877 4.744 -3.890 1.00 0.00 C ATOM 881 OD1 ASN A 56 -19.045 4.282 -4.321 1.00 0.00 O flip ATOM 882 ND2 ASN A 56 -17.225 5.584 -4.510 1.00 0.00 N flip ATOM 0 H ASN A 56 -16.104 2.721 -4.111 1.00 0.00 H new ATOM 0 HA ASN A 56 -15.418 5.070 -2.682 1.00 0.00 H new ATOM 0 HB2 ASN A 56 -17.804 3.193 -2.417 1.00 0.00 H new ATOM 0 HB3 ASN A 56 -17.714 4.814 -1.757 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -16.332 5.911 -4.141 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -17.578 5.954 -5.393 1.00 0.00 H new ATOM 889 N ALA A 57 -15.547 2.254 -0.963 1.00 0.00 N ATOM 890 CA ALA A 57 -15.156 1.631 0.296 1.00 0.00 C ATOM 891 C ALA A 57 -13.672 1.845 0.575 1.00 0.00 C ATOM 892 O ALA A 57 -13.220 1.720 1.715 1.00 0.00 O ATOM 893 CB ALA A 57 -15.482 0.145 0.273 1.00 0.00 C ATOM 0 H ALA A 57 -15.936 1.608 -1.651 1.00 0.00 H new ATOM 0 HA ALA A 57 -15.722 2.103 1.099 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -15.185 -0.307 1.219 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -16.554 0.010 0.127 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -14.941 -0.334 -0.544 1.00 0.00 H new ATOM 899 N LEU A 58 -12.918 2.167 -0.470 1.00 0.00 N ATOM 900 CA LEU A 58 -11.484 2.398 -0.336 1.00 0.00 C ATOM 901 C LEU A 58 -11.137 3.855 -0.625 1.00 0.00 C ATOM 902 O LEU A 58 -9.965 4.230 -0.657 1.00 0.00 O ATOM 903 CB LEU A 58 -10.709 1.481 -1.284 1.00 0.00 C ATOM 904 CG LEU A 58 -11.120 1.536 -2.756 1.00 0.00 C ATOM 905 CD1 LEU A 58 -10.457 2.715 -3.451 1.00 0.00 C ATOM 906 CD2 LEU A 58 -10.766 0.233 -3.458 1.00 0.00 C ATOM 0 H LEU A 58 -13.276 2.274 -1.419 1.00 0.00 H new ATOM 0 HA LEU A 58 -11.200 2.173 0.692 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -9.650 1.730 -1.214 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -10.819 0.454 -0.935 1.00 0.00 H new ATOM 0 HG LEU A 58 -12.200 1.671 -2.807 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -10.761 2.738 -4.498 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -10.760 3.642 -2.964 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -9.374 2.611 -3.390 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -11.066 0.290 -4.504 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -9.690 0.068 -3.397 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -11.288 -0.594 -2.976 1.00 0.00 H new ATOM 918 N SER A 59 -12.165 4.673 -0.832 1.00 0.00 N ATOM 919 CA SER A 59 -11.969 6.089 -1.119 1.00 0.00 C ATOM 920 C SER A 59 -11.954 6.907 0.169 1.00 0.00 C ATOM 921 O SER A 59 -11.188 7.861 0.300 1.00 0.00 O ATOM 922 CB SER A 59 -13.072 6.599 -2.048 1.00 0.00 C ATOM 923 OG SER A 59 -14.328 6.612 -1.390 1.00 0.00 O ATOM 0 H SER A 59 -13.141 4.379 -0.806 1.00 0.00 H new ATOM 0 HA SER A 59 -11.005 6.205 -1.613 1.00 0.00 H new ATOM 0 HB2 SER A 59 -12.827 7.604 -2.391 1.00 0.00 H new ATOM 0 HB3 SER A 59 -13.128 5.965 -2.933 1.00 0.00 H new ATOM 0 HG SER A 59 -14.354 5.897 -0.720 1.00 0.00 H new ATOM 929 N GLU A 60 -12.805 6.525 1.116 1.00 0.00 N ATOM 930 CA GLU A 60 -12.890 7.224 2.393 1.00 0.00 C ATOM 931 C GLU A 60 -12.007 6.551 3.440 1.00 0.00 C ATOM 932 O GLU A 60 -11.423 7.218 4.295 1.00 0.00 O ATOM 933 CB GLU A 60 -14.339 7.265 2.881 1.00 0.00 C ATOM 934 CG GLU A 60 -15.347 7.536 1.777 1.00 0.00 C ATOM 935 CD GLU A 60 -15.158 8.898 1.137 1.00 0.00 C ATOM 936 OE1 GLU A 60 -14.184 9.067 0.375 1.00 0.00 O ATOM 937 OE2 GLU A 60 -15.986 9.796 1.400 1.00 0.00 O ATOM 0 H GLU A 60 -13.445 5.736 1.023 1.00 0.00 H new ATOM 0 HA GLU A 60 -12.536 8.244 2.245 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -14.580 6.314 3.356 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -14.434 8.036 3.645 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -15.259 6.764 1.012 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -16.355 7.467 2.186 1.00 0.00 H new ATOM 944 N ILE A 61 -11.917 5.228 3.368 1.00 0.00 N ATOM 945 CA ILE A 61 -11.106 4.465 4.309 1.00 0.00 C ATOM 946 C ILE A 61 -9.622 4.586 3.979 1.00 0.00 C ATOM 947 O ILE A 61 -8.765 4.402 4.845 1.00 0.00 O ATOM 948 CB ILE A 61 -11.500 2.976 4.314 1.00 0.00 C ATOM 949 CG1 ILE A 61 -13.020 2.829 4.400 1.00 0.00 C ATOM 950 CG2 ILE A 61 -10.826 2.254 5.471 1.00 0.00 C ATOM 951 CD1 ILE A 61 -13.626 3.506 5.610 1.00 0.00 C ATOM 0 H ILE A 61 -12.396 4.662 2.668 1.00 0.00 H new ATOM 0 HA ILE A 61 -11.291 4.884 5.298 1.00 0.00 H new ATOM 0 HB ILE A 61 -11.162 2.522 3.382 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -13.469 3.246 3.498 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -13.274 1.769 4.422 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -11.114 1.203 5.461 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -9.744 2.335 5.369 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -11.137 2.707 6.413 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -14.706 3.360 5.605 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -13.205 3.073 6.518 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -13.404 4.573 5.580 1.00 0.00 H new ATOM 963 N LEU A 62 -9.324 4.897 2.723 1.00 0.00 N ATOM 964 CA LEU A 62 -7.943 5.045 2.278 1.00 0.00 C ATOM 965 C LEU A 62 -7.129 3.797 2.605 1.00 0.00 C ATOM 966 O LEU A 62 -6.069 3.880 3.224 1.00 0.00 O ATOM 967 CB LEU A 62 -7.304 6.271 2.933 1.00 0.00 C ATOM 968 CG LEU A 62 -7.633 7.621 2.295 1.00 0.00 C ATOM 969 CD1 LEU A 62 -7.209 7.639 0.835 1.00 0.00 C ATOM 970 CD2 LEU A 62 -9.119 7.923 2.424 1.00 0.00 C ATOM 0 H LEU A 62 -10.020 5.052 1.994 1.00 0.00 H new ATOM 0 HA LEU A 62 -7.948 5.180 1.196 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -7.611 6.301 3.978 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -6.222 6.141 2.923 1.00 0.00 H new ATOM 0 HG LEU A 62 -7.077 8.396 2.823 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -7.451 8.608 0.398 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -6.135 7.468 0.766 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -7.737 6.854 0.293 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -9.335 8.887 1.965 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -9.693 7.145 1.922 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -9.394 7.953 3.478 1.00 0.00 H new ATOM 982 N ASN A 63 -7.632 2.641 2.184 1.00 0.00 N ATOM 983 CA ASN A 63 -6.951 1.376 2.430 1.00 0.00 C ATOM 984 C ASN A 63 -6.349 0.821 1.142 1.00 0.00 C ATOM 985 O ASN A 63 -6.147 -0.386 1.008 1.00 0.00 O ATOM 986 CB ASN A 63 -7.922 0.358 3.032 1.00 0.00 C ATOM 987 CG ASN A 63 -9.298 0.429 2.399 1.00 0.00 C ATOM 988 OD1 ASN A 63 -9.440 0.805 1.235 1.00 0.00 O ATOM 989 ND2 ASN A 63 -10.321 0.066 3.164 1.00 0.00 N ATOM 0 H ASN A 63 -8.509 2.555 1.671 1.00 0.00 H new ATOM 0 HA ASN A 63 -6.143 1.560 3.138 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -7.517 -0.646 2.904 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -8.009 0.532 4.104 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -11.270 0.092 2.792 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -10.157 -0.239 4.123 1.00 0.00 H new ATOM 996 N LYS A 64 -6.066 1.711 0.197 1.00 0.00 N ATOM 997 CA LYS A 64 -5.486 1.313 -1.080 1.00 0.00 C ATOM 998 C LYS A 64 -4.654 2.445 -1.676 1.00 0.00 C ATOM 999 O LYS A 64 -4.925 3.622 -1.436 1.00 0.00 O ATOM 1000 CB LYS A 64 -6.589 0.907 -2.060 1.00 0.00 C ATOM 1001 CG LYS A 64 -6.088 0.077 -3.229 1.00 0.00 C ATOM 1002 CD LYS A 64 -6.027 -1.401 -2.878 1.00 0.00 C ATOM 1003 CE LYS A 64 -4.694 -1.768 -2.243 1.00 0.00 C ATOM 1004 NZ LYS A 64 -4.359 -3.204 -2.449 1.00 0.00 N ATOM 0 H LYS A 64 -6.229 2.713 0.292 1.00 0.00 H new ATOM 0 HA LYS A 64 -4.832 0.459 -0.903 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -7.350 0.341 -1.523 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -7.072 1.806 -2.444 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -6.745 0.221 -4.087 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -5.097 0.423 -3.524 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -6.838 -1.647 -2.192 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -6.179 -1.997 -3.778 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -3.906 -1.147 -2.668 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -4.729 -1.553 -1.175 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -3.547 -3.460 -1.852 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -5.177 -3.792 -2.192 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -4.118 -3.364 -3.448 1.00 0.00 H new ATOM 1018 N LYS A 65 -3.640 2.081 -2.454 1.00 0.00 N ATOM 1019 CA LYS A 65 -2.770 3.065 -3.087 1.00 0.00 C ATOM 1020 C LYS A 65 -3.456 3.704 -4.290 1.00 0.00 C ATOM 1021 O LYS A 65 -4.632 3.450 -4.555 1.00 0.00 O ATOM 1022 CB LYS A 65 -1.458 2.409 -3.524 1.00 0.00 C ATOM 1023 CG LYS A 65 -0.650 1.837 -2.372 1.00 0.00 C ATOM 1024 CD LYS A 65 0.001 2.936 -1.548 1.00 0.00 C ATOM 1025 CE LYS A 65 1.043 2.373 -0.593 1.00 0.00 C ATOM 1026 NZ LYS A 65 0.422 1.820 0.642 1.00 0.00 N ATOM 0 H LYS A 65 -3.401 1.111 -2.661 1.00 0.00 H new ATOM 0 HA LYS A 65 -2.554 3.845 -2.357 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -1.679 1.611 -4.233 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -0.852 3.145 -4.052 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -1.299 1.238 -1.733 1.00 0.00 H new ATOM 0 HG3 LYS A 65 0.118 1.169 -2.761 1.00 0.00 H new ATOM 0 HD2 LYS A 65 0.469 3.662 -2.213 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -0.763 3.469 -0.982 1.00 0.00 H new ATOM 0 HE2 LYS A 65 1.611 1.590 -1.096 1.00 0.00 H new ATOM 0 HE3 LYS A 65 1.750 3.157 -0.324 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 1.165 1.446 1.267 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -0.099 2.573 1.135 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -0.234 1.054 0.388 1.00 0.00 H new ATOM 1040 N LEU A 66 -2.715 4.534 -5.016 1.00 0.00 N ATOM 1041 CA LEU A 66 -3.251 5.208 -6.193 1.00 0.00 C ATOM 1042 C LEU A 66 -3.465 4.222 -7.337 1.00 0.00 C ATOM 1043 O LEU A 66 -4.297 4.446 -8.217 1.00 0.00 O ATOM 1044 CB LEU A 66 -2.308 6.327 -6.638 1.00 0.00 C ATOM 1045 CG LEU A 66 -2.956 7.687 -6.901 1.00 0.00 C ATOM 1046 CD1 LEU A 66 -3.987 7.580 -8.014 1.00 0.00 C ATOM 1047 CD2 LEU A 66 -3.594 8.228 -5.630 1.00 0.00 C ATOM 0 H LEU A 66 -1.741 4.756 -4.810 1.00 0.00 H new ATOM 0 HA LEU A 66 -4.216 5.639 -5.926 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -1.541 6.454 -5.874 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -1.801 6.007 -7.548 1.00 0.00 H new ATOM 0 HG LEU A 66 -2.180 8.383 -7.219 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -4.438 8.557 -8.187 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -3.502 7.237 -8.928 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -4.761 6.869 -7.726 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -4.050 9.196 -5.836 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -4.358 7.533 -5.282 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -2.831 8.343 -4.860 1.00 0.00 H new ATOM 1059 N HIS A 67 -2.709 3.128 -7.317 1.00 0.00 N ATOM 1060 CA HIS A 67 -2.817 2.105 -8.351 1.00 0.00 C ATOM 1061 C HIS A 67 -4.267 1.664 -8.528 1.00 0.00 C ATOM 1062 O HIS A 67 -5.107 1.892 -7.658 1.00 0.00 O ATOM 1063 CB HIS A 67 -1.944 0.900 -7.999 1.00 0.00 C ATOM 1064 CG HIS A 67 -2.493 0.069 -6.881 1.00 0.00 C ATOM 1065 ND1 HIS A 67 -2.200 -1.269 -6.724 1.00 0.00 N ATOM 1066 CD2 HIS A 67 -3.321 0.393 -5.860 1.00 0.00 C ATOM 1067 CE1 HIS A 67 -2.824 -1.732 -5.656 1.00 0.00 C ATOM 1068 NE2 HIS A 67 -3.512 -0.743 -5.114 1.00 0.00 N ATOM 0 H HIS A 67 -2.016 2.928 -6.596 1.00 0.00 H new ATOM 0 HA HIS A 67 -2.469 2.534 -9.291 1.00 0.00 H new ATOM 0 HB2 HIS A 67 -1.830 0.274 -8.884 1.00 0.00 H new ATOM 0 HB3 HIS A 67 -0.949 1.250 -7.726 1.00 0.00 H new ATOM 0 HD1 HIS A 67 -1.596 -1.816 -7.337 1.00 0.00 H new ATOM 0 HD2 HIS A 67 -3.751 1.365 -5.668 1.00 0.00 H new ATOM 0 HE1 HIS A 67 -2.779 -2.747 -5.288 1.00 0.00 H new ATOM 1076 N SER A 68 -4.553 1.031 -9.662 1.00 0.00 N ATOM 1077 CA SER A 68 -5.902 0.562 -9.956 1.00 0.00 C ATOM 1078 C SER A 68 -5.886 -0.900 -10.390 1.00 0.00 C ATOM 1079 O SER A 68 -4.876 -1.400 -10.887 1.00 0.00 O ATOM 1080 CB SER A 68 -6.538 1.424 -11.049 1.00 0.00 C ATOM 1081 OG SER A 68 -5.921 1.193 -12.304 1.00 0.00 O ATOM 0 H SER A 68 -3.869 0.831 -10.392 1.00 0.00 H new ATOM 0 HA SER A 68 -6.496 0.646 -9.046 1.00 0.00 H new ATOM 0 HB2 SER A 68 -7.603 1.203 -11.118 1.00 0.00 H new ATOM 0 HB3 SER A 68 -6.448 2.478 -10.784 1.00 0.00 H new ATOM 0 HG SER A 68 -6.346 1.754 -12.986 1.00 0.00 H new ATOM 1087 N ILE A 69 -7.011 -1.580 -10.199 1.00 0.00 N ATOM 1088 CA ILE A 69 -7.128 -2.985 -10.571 1.00 0.00 C ATOM 1089 C ILE A 69 -8.521 -3.298 -11.105 1.00 0.00 C ATOM 1090 O ILE A 69 -9.433 -2.477 -11.009 1.00 0.00 O ATOM 1091 CB ILE A 69 -6.827 -3.910 -9.377 1.00 0.00 C ATOM 1092 CG1 ILE A 69 -7.791 -3.622 -8.225 1.00 0.00 C ATOM 1093 CG2 ILE A 69 -5.385 -3.739 -8.924 1.00 0.00 C ATOM 1094 CD1 ILE A 69 -7.314 -2.526 -7.298 1.00 0.00 C ATOM 0 H ILE A 69 -7.855 -1.181 -9.789 1.00 0.00 H new ATOM 0 HA ILE A 69 -6.393 -3.167 -11.355 1.00 0.00 H new ATOM 0 HB ILE A 69 -6.967 -4.944 -9.693 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -8.762 -3.343 -8.635 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -7.939 -4.535 -7.649 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -5.188 -4.399 -8.080 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -4.713 -3.990 -9.745 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -5.219 -2.705 -8.622 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -8.047 -2.376 -6.505 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -6.358 -2.811 -6.859 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -7.193 -1.600 -7.861 1.00 0.00 H new ATOM 1106 N SER A 70 -8.679 -4.493 -11.666 1.00 0.00 N ATOM 1107 CA SER A 70 -9.961 -4.915 -12.217 1.00 0.00 C ATOM 1108 C SER A 70 -10.897 -5.393 -11.111 1.00 0.00 C ATOM 1109 O SER A 70 -10.456 -5.968 -10.115 1.00 0.00 O ATOM 1110 CB SER A 70 -9.757 -6.030 -13.245 1.00 0.00 C ATOM 1111 OG SER A 70 -9.466 -5.496 -14.525 1.00 0.00 O ATOM 0 H SER A 70 -7.935 -5.186 -11.751 1.00 0.00 H new ATOM 0 HA SER A 70 -10.417 -4.056 -12.709 1.00 0.00 H new ATOM 0 HB2 SER A 70 -8.943 -6.680 -12.925 1.00 0.00 H new ATOM 0 HB3 SER A 70 -10.654 -6.647 -13.300 1.00 0.00 H new ATOM 0 HG SER A 70 -9.338 -6.228 -15.164 1.00 0.00 H new ATOM 1117 N ILE A 71 -12.191 -5.151 -11.293 1.00 0.00 N ATOM 1118 CA ILE A 71 -13.189 -5.557 -10.312 1.00 0.00 C ATOM 1119 C ILE A 71 -14.332 -6.319 -10.974 1.00 0.00 C ATOM 1120 O ILE A 71 -14.968 -5.822 -11.905 1.00 0.00 O ATOM 1121 CB ILE A 71 -13.764 -4.343 -9.558 1.00 0.00 C ATOM 1122 CG1 ILE A 71 -12.639 -3.547 -8.895 1.00 0.00 C ATOM 1123 CG2 ILE A 71 -14.782 -4.797 -8.522 1.00 0.00 C ATOM 1124 CD1 ILE A 71 -12.693 -2.064 -9.189 1.00 0.00 C ATOM 0 H ILE A 71 -12.572 -4.676 -12.111 1.00 0.00 H new ATOM 0 HA ILE A 71 -12.684 -6.210 -9.600 1.00 0.00 H new ATOM 0 HB ILE A 71 -14.268 -3.694 -10.274 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -12.686 -3.697 -7.816 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -11.680 -3.941 -9.231 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -15.179 -3.928 -7.997 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -15.596 -5.325 -9.019 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -14.301 -5.464 -7.807 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -11.865 -1.563 -8.687 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -12.616 -1.903 -10.264 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -13.637 -1.656 -8.828 1.00 0.00 H new ATOM 1136 N LYS A 72 -14.591 -7.528 -10.487 1.00 0.00 N ATOM 1137 CA LYS A 72 -15.660 -8.358 -11.028 1.00 0.00 C ATOM 1138 C LYS A 72 -16.849 -8.404 -10.074 1.00 0.00 C ATOM 1139 O LYS A 72 -16.689 -8.283 -8.859 1.00 0.00 O ATOM 1140 CB LYS A 72 -15.148 -9.777 -11.291 1.00 0.00 C ATOM 1141 CG LYS A 72 -16.128 -10.643 -12.064 1.00 0.00 C ATOM 1142 CD LYS A 72 -15.587 -12.048 -12.271 1.00 0.00 C ATOM 1143 CE LYS A 72 -16.658 -12.984 -12.807 1.00 0.00 C ATOM 1144 NZ LYS A 72 -16.361 -14.408 -12.488 1.00 0.00 N ATOM 0 H LYS A 72 -14.074 -7.955 -9.718 1.00 0.00 H new ATOM 0 HA LYS A 72 -15.989 -7.916 -11.969 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -14.211 -9.719 -11.845 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -14.926 -10.257 -10.338 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -17.075 -10.692 -11.526 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -16.335 -10.185 -13.031 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -14.748 -12.017 -12.966 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -15.204 -12.434 -11.326 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -17.624 -12.711 -12.383 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -16.738 -12.863 -13.887 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -17.115 -15.014 -12.871 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -15.451 -14.677 -12.914 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -16.310 -14.529 -11.456 1.00 0.00 H new ATOM 1158 N THR A 73 -18.043 -8.582 -10.632 1.00 0.00 N ATOM 1159 CA THR A 73 -19.259 -8.645 -9.831 1.00 0.00 C ATOM 1160 C THR A 73 -19.937 -10.003 -9.965 1.00 0.00 C ATOM 1161 O THR A 73 -20.381 -10.381 -11.050 1.00 0.00 O ATOM 1162 CB THR A 73 -20.256 -7.543 -10.236 1.00 0.00 C ATOM 1163 OG1 THR A 73 -20.872 -7.876 -11.486 1.00 0.00 O ATOM 1164 CG2 THR A 73 -19.558 -6.197 -10.352 1.00 0.00 C ATOM 0 H THR A 73 -18.193 -8.685 -11.636 1.00 0.00 H new ATOM 0 HA THR A 73 -18.962 -8.492 -8.793 1.00 0.00 H new ATOM 0 HB THR A 73 -21.020 -7.472 -9.462 1.00 0.00 H new ATOM 0 HG1 THR A 73 -20.620 -8.787 -11.743 1.00 0.00 H new ATOM 0 HG21 THR A 73 -20.283 -5.435 -10.639 1.00 0.00 H new ATOM 0 HG22 THR A 73 -19.115 -5.933 -9.392 1.00 0.00 H new ATOM 0 HG23 THR A 73 -18.776 -6.257 -11.108 1.00 0.00 H new ATOM 1172 N ILE A 74 -20.014 -10.733 -8.858 1.00 0.00 N ATOM 1173 CA ILE A 74 -20.640 -12.049 -8.853 1.00 0.00 C ATOM 1174 C ILE A 74 -21.590 -12.202 -7.670 1.00 0.00 C ATOM 1175 O ILE A 74 -21.335 -11.679 -6.585 1.00 0.00 O ATOM 1176 CB ILE A 74 -19.588 -13.173 -8.801 1.00 0.00 C ATOM 1177 CG1 ILE A 74 -18.598 -13.028 -9.959 1.00 0.00 C ATOM 1178 CG2 ILE A 74 -20.265 -14.535 -8.844 1.00 0.00 C ATOM 1179 CD1 ILE A 74 -17.198 -12.667 -9.514 1.00 0.00 C ATOM 0 H ILE A 74 -19.651 -10.435 -7.953 1.00 0.00 H new ATOM 0 HA ILE A 74 -21.204 -12.133 -9.782 1.00 0.00 H new ATOM 0 HB ILE A 74 -19.037 -13.092 -7.864 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -18.564 -13.964 -10.517 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -18.962 -12.262 -10.644 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -19.508 -15.319 -8.807 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -20.934 -14.636 -7.990 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -20.838 -14.628 -9.767 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -16.550 -12.581 -10.386 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -17.219 -11.716 -8.982 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -16.815 -13.444 -8.853 1.00 0.00 H new ATOM 1191 N SER A 75 -22.684 -12.925 -7.886 1.00 0.00 N ATOM 1192 CA SER A 75 -23.674 -13.146 -6.838 1.00 0.00 C ATOM 1193 C SER A 75 -23.806 -14.632 -6.520 1.00 0.00 C ATOM 1194 O SER A 75 -23.523 -15.485 -7.362 1.00 0.00 O ATOM 1195 CB SER A 75 -25.031 -12.580 -7.261 1.00 0.00 C ATOM 1196 OG SER A 75 -25.639 -11.867 -6.198 1.00 0.00 O ATOM 0 H SER A 75 -22.907 -13.368 -8.777 1.00 0.00 H new ATOM 0 HA SER A 75 -23.337 -12.629 -5.939 1.00 0.00 H new ATOM 0 HB2 SER A 75 -24.902 -11.920 -8.119 1.00 0.00 H new ATOM 0 HB3 SER A 75 -25.684 -13.392 -7.579 1.00 0.00 H new ATOM 0 HG SER A 75 -25.153 -11.029 -6.046 1.00 0.00 H new ATOM 1202 N ILE A 76 -24.238 -14.934 -5.301 1.00 0.00 N ATOM 1203 CA ILE A 76 -24.409 -16.316 -4.872 1.00 0.00 C ATOM 1204 C ILE A 76 -25.458 -17.029 -5.719 1.00 0.00 C ATOM 1205 O ILE A 76 -26.371 -16.413 -6.268 1.00 0.00 O ATOM 1206 CB ILE A 76 -24.819 -16.399 -3.390 1.00 0.00 C ATOM 1207 CG1 ILE A 76 -26.134 -15.651 -3.159 1.00 0.00 C ATOM 1208 CG2 ILE A 76 -23.720 -15.834 -2.503 1.00 0.00 C ATOM 1209 CD1 ILE A 76 -27.361 -16.520 -3.326 1.00 0.00 C ATOM 0 H ILE A 76 -24.476 -14.240 -4.593 1.00 0.00 H new ATOM 0 HA ILE A 76 -23.445 -16.808 -5.002 1.00 0.00 H new ATOM 0 HB ILE A 76 -24.967 -17.447 -3.128 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -26.131 -15.230 -2.154 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -26.194 -14.814 -3.855 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -24.025 -15.900 -1.459 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -22.804 -16.406 -2.650 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -23.542 -14.791 -2.764 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -28.256 -15.924 -3.148 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -27.388 -16.921 -4.339 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -27.324 -17.342 -2.612 1.00 0.00 H new ATOM 1221 N PRO A 77 -25.326 -18.360 -5.827 1.00 0.00 N ATOM 1222 CA PRO A 77 -26.255 -19.186 -6.603 1.00 0.00 C ATOM 1223 C PRO A 77 -27.632 -19.276 -5.954 1.00 0.00 C ATOM 1224 O PRO A 77 -28.642 -18.928 -6.567 1.00 0.00 O ATOM 1225 CB PRO A 77 -25.580 -20.560 -6.618 1.00 0.00 C ATOM 1226 CG PRO A 77 -24.727 -20.576 -5.397 1.00 0.00 C ATOM 1227 CD PRO A 77 -24.261 -19.160 -5.199 1.00 0.00 C ATOM 0 HA PRO A 77 -26.435 -18.773 -7.596 1.00 0.00 H new ATOM 0 HB2 PRO A 77 -26.317 -21.363 -6.597 1.00 0.00 H new ATOM 0 HB3 PRO A 77 -24.983 -20.698 -7.520 1.00 0.00 H new ATOM 0 HG2 PRO A 77 -25.290 -20.926 -4.532 1.00 0.00 H new ATOM 0 HG3 PRO A 77 -23.881 -21.252 -5.521 1.00 0.00 H new ATOM 0 HD2 PRO A 77 -24.147 -18.918 -4.142 1.00 0.00 H new ATOM 0 HD3 PRO A 77 -23.295 -18.985 -5.672 1.00 0.00 H new TER 1235 PRO A 77