USER MOD reduce.3.24.130724 H: found=0, std=0, add=886, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 882 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 118 SER OG : rot 49:sc= 0.3 USER MOD Set 1.2: A 121 SER OG : rot 180:sc= 0.273 USER MOD Set 2.1: A 24 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 99 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Set 3.1: A 35 THR OG1 : rot 180:sc= 0.672 USER MOD Set 3.2: A 50 SER OG : rot 44:sc= 0.758 USER MOD Set 4.1: A 23 THR OG1 : rot 141:sc= 1.23 USER MOD Set 4.2: A 62 LYS NZ :NH3+ -126:sc= 0.524 (180deg=-0.0555) USER MOD Single : A 1 GLY N :NH3+ -109:sc= 0.105 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc=0.000829 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 10 THR OG1 : rot 89:sc= 0.738 USER MOD Single : A 14 SER OG : rot 57:sc= 0.514 USER MOD Single : A 15 GLN : amide:sc= 0 X(o=0,f=-0.039) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ 169:sc= 1.47 (180deg=1.43) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 29 ASN : amide:sc= 0 X(o=0,f=-0.44) USER MOD Single : A 30 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 47 GLN : amide:sc= 0.272 K(o=0.27,f=-2.1!) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 GLN : amide:sc= -0.425 X(o=-0.42,f=0) USER MOD Single : A 63 MET CE :methyl 147:sc= -1.28 (180deg=-4.41!) USER MOD Single : A 65 THR OG1 : rot 180:sc= 0.0306 USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 73 ASN : amide:sc= 0 K(o=0,f=-0.9) USER MOD Single : A 76 CYS SG : rot 42:sc= 0.117 USER MOD Single : A 80 HIS : no HD1:sc= -0.124 X(o=-0.12,f=-0.03) USER MOD Single : A 81 THR OG1 : rot 180:sc= 0.00884 USER MOD Single : A 82 HIS : no HD1:sc= -0.0497 X(o=-0.05,f=0) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 GLN : amide:sc= 0 K(o=0,f=-0.86) USER MOD Single : A 91 SER OG : rot -38:sc= 0.00427 USER MOD Single : A 96 GLN : amide:sc= -0.0774 K(o=-0.077,f=-1) USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 103 CYS SG : rot 111:sc= 0.716 USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 117 ASN : amide:sc= 0.15 X(o=0.15,f=0) USER MOD Single : A 122 SER OG : rot 25:sc= 0.00638 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 16.691 -17.850 15.962 1.00 0.00 N ATOM 2 CA GLY A 1 17.615 -16.820 15.474 1.00 0.00 C ATOM 3 C GLY A 1 16.888 -15.841 14.573 1.00 0.00 C ATOM 4 O GLY A 1 15.806 -16.139 14.058 1.00 0.00 O ATOM 0 H1 GLY A 1 16.510 -17.702 16.975 1.00 0.00 H new ATOM 0 H2 GLY A 1 15.795 -17.789 15.438 1.00 0.00 H new ATOM 0 H3 GLY A 1 17.112 -18.790 15.819 1.00 0.00 H new ATOM 0 HA2 GLY A 1 18.056 -16.289 16.318 1.00 0.00 H new ATOM 0 HA3 GLY A 1 18.435 -17.287 14.928 1.00 0.00 H new ATOM 8 N SER A 2 17.476 -14.663 14.375 1.00 0.00 N ATOM 9 CA SER A 2 16.881 -13.601 13.580 1.00 0.00 C ATOM 10 C SER A 2 16.699 -14.051 12.122 1.00 0.00 C ATOM 11 O SER A 2 17.407 -14.943 11.640 1.00 0.00 O ATOM 12 CB SER A 2 17.743 -12.339 13.700 1.00 0.00 C ATOM 13 OG SER A 2 18.050 -12.101 15.067 1.00 0.00 O ATOM 0 H SER A 2 18.386 -14.421 14.767 1.00 0.00 H new ATOM 0 HA SER A 2 15.886 -13.368 13.958 1.00 0.00 H new ATOM 0 HB2 SER A 2 18.662 -12.458 13.126 1.00 0.00 H new ATOM 0 HB3 SER A 2 17.214 -11.483 13.281 1.00 0.00 H new ATOM 0 HG SER A 2 18.602 -11.295 15.143 1.00 0.00 H new ATOM 19 N SER A 3 15.722 -13.458 11.443 1.00 0.00 N ATOM 20 CA SER A 3 15.290 -13.863 10.119 1.00 0.00 C ATOM 21 C SER A 3 16.339 -13.498 9.067 1.00 0.00 C ATOM 22 O SER A 3 17.256 -12.705 9.309 1.00 0.00 O ATOM 23 CB SER A 3 13.933 -13.208 9.838 1.00 0.00 C ATOM 24 OG SER A 3 13.134 -13.941 8.933 1.00 0.00 O ATOM 0 H SER A 3 15.199 -12.664 11.811 1.00 0.00 H new ATOM 0 HA SER A 3 15.177 -14.946 10.071 1.00 0.00 H new ATOM 0 HB2 SER A 3 13.392 -13.092 10.777 1.00 0.00 H new ATOM 0 HB3 SER A 3 14.097 -12.207 9.439 1.00 0.00 H new ATOM 0 HG SER A 3 12.283 -13.475 8.796 1.00 0.00 H new ATOM 30 N GLY A 4 16.174 -14.066 7.877 1.00 0.00 N ATOM 31 CA GLY A 4 17.069 -13.885 6.753 1.00 0.00 C ATOM 32 C GLY A 4 16.515 -14.651 5.568 1.00 0.00 C ATOM 33 O GLY A 4 16.913 -15.792 5.336 1.00 0.00 O ATOM 0 H GLY A 4 15.389 -14.682 7.668 1.00 0.00 H new ATOM 0 HA2 GLY A 4 17.162 -12.827 6.510 1.00 0.00 H new ATOM 0 HA3 GLY A 4 18.068 -14.244 7.002 1.00 0.00 H new ATOM 37 N SER A 5 15.533 -14.077 4.884 1.00 0.00 N ATOM 38 CA SER A 5 15.032 -14.533 3.600 1.00 0.00 C ATOM 39 C SER A 5 14.432 -13.298 2.932 1.00 0.00 C ATOM 40 O SER A 5 13.514 -12.659 3.469 1.00 0.00 O ATOM 41 CB SER A 5 14.020 -15.672 3.754 1.00 0.00 C ATOM 42 OG SER A 5 13.737 -16.242 2.500 1.00 0.00 O ATOM 0 H SER A 5 15.046 -13.248 5.225 1.00 0.00 H new ATOM 0 HA SER A 5 15.826 -14.958 2.986 1.00 0.00 H new ATOM 0 HB2 SER A 5 14.417 -16.433 4.426 1.00 0.00 H new ATOM 0 HB3 SER A 5 13.103 -15.295 4.206 1.00 0.00 H new ATOM 0 HG SER A 5 13.090 -16.970 2.610 1.00 0.00 H new ATOM 48 N SER A 6 15.029 -12.932 1.807 1.00 0.00 N ATOM 49 CA SER A 6 14.671 -11.833 0.936 1.00 0.00 C ATOM 50 C SER A 6 14.771 -12.355 -0.500 1.00 0.00 C ATOM 51 O SER A 6 15.100 -13.525 -0.729 1.00 0.00 O ATOM 52 CB SER A 6 15.629 -10.665 1.179 1.00 0.00 C ATOM 53 OG SER A 6 15.360 -9.964 2.383 1.00 0.00 O ATOM 0 H SER A 6 15.841 -13.440 1.456 1.00 0.00 H new ATOM 0 HA SER A 6 13.661 -11.471 1.127 1.00 0.00 H new ATOM 0 HB2 SER A 6 16.652 -11.042 1.206 1.00 0.00 H new ATOM 0 HB3 SER A 6 15.567 -9.971 0.340 1.00 0.00 H new ATOM 0 HG SER A 6 16.003 -9.232 2.486 1.00 0.00 H new ATOM 59 N GLY A 7 14.468 -11.512 -1.482 1.00 0.00 N ATOM 60 CA GLY A 7 14.010 -12.012 -2.762 1.00 0.00 C ATOM 61 C GLY A 7 12.662 -12.668 -2.498 1.00 0.00 C ATOM 62 O GLY A 7 11.766 -11.989 -1.990 1.00 0.00 O ATOM 0 H GLY A 7 14.531 -10.496 -1.414 1.00 0.00 H new ATOM 0 HA2 GLY A 7 13.915 -11.203 -3.486 1.00 0.00 H new ATOM 0 HA3 GLY A 7 14.718 -12.729 -3.177 1.00 0.00 H new ATOM 66 N LEU A 8 12.575 -13.963 -2.813 1.00 0.00 N ATOM 67 CA LEU A 8 11.494 -14.918 -2.591 1.00 0.00 C ATOM 68 C LEU A 8 10.150 -14.245 -2.345 1.00 0.00 C ATOM 69 O LEU A 8 9.741 -13.997 -1.203 1.00 0.00 O ATOM 70 CB LEU A 8 11.859 -15.953 -1.510 1.00 0.00 C ATOM 71 CG LEU A 8 12.449 -17.246 -2.107 1.00 0.00 C ATOM 72 CD1 LEU A 8 13.790 -17.005 -2.816 1.00 0.00 C ATOM 73 CD2 LEU A 8 12.637 -18.291 -1.003 1.00 0.00 C ATOM 0 H LEU A 8 13.356 -14.417 -3.286 1.00 0.00 H new ATOM 0 HA LEU A 8 11.369 -15.473 -3.521 1.00 0.00 H new ATOM 0 HB2 LEU A 8 12.579 -15.514 -0.819 1.00 0.00 H new ATOM 0 HB3 LEU A 8 10.969 -16.197 -0.930 1.00 0.00 H new ATOM 0 HG LEU A 8 11.741 -17.608 -2.853 1.00 0.00 H new ATOM 0 HD11 LEU A 8 14.163 -17.947 -3.219 1.00 0.00 H new ATOM 0 HD12 LEU A 8 13.649 -16.293 -3.629 1.00 0.00 H new ATOM 0 HD13 LEU A 8 14.511 -16.604 -2.104 1.00 0.00 H new ATOM 0 HD21 LEU A 8 13.054 -19.202 -1.432 1.00 0.00 H new ATOM 0 HD22 LEU A 8 13.317 -17.902 -0.246 1.00 0.00 H new ATOM 0 HD23 LEU A 8 11.673 -18.514 -0.545 1.00 0.00 H new ATOM 85 N PHE A 9 9.496 -13.938 -3.462 1.00 0.00 N ATOM 86 CA PHE A 9 8.131 -13.455 -3.514 1.00 0.00 C ATOM 87 C PHE A 9 7.192 -14.428 -2.783 1.00 0.00 C ATOM 88 O PHE A 9 7.430 -15.638 -2.702 1.00 0.00 O ATOM 89 CB PHE A 9 7.747 -13.252 -4.991 1.00 0.00 C ATOM 90 CG PHE A 9 6.313 -12.819 -5.214 1.00 0.00 C ATOM 91 CD1 PHE A 9 5.289 -13.781 -5.166 1.00 0.00 C ATOM 92 CD2 PHE A 9 5.982 -11.464 -5.404 1.00 0.00 C ATOM 93 CE1 PHE A 9 3.951 -13.389 -5.258 1.00 0.00 C ATOM 94 CE2 PHE A 9 4.632 -11.070 -5.463 1.00 0.00 C ATOM 95 CZ PHE A 9 3.616 -12.041 -5.364 1.00 0.00 C ATOM 0 H PHE A 9 9.922 -14.024 -4.385 1.00 0.00 H new ATOM 0 HA PHE A 9 8.037 -12.498 -3.000 1.00 0.00 H new ATOM 0 HB2 PHE A 9 8.411 -12.505 -5.426 1.00 0.00 H new ATOM 0 HB3 PHE A 9 7.920 -14.184 -5.529 1.00 0.00 H new ATOM 0 HD1 PHE A 9 5.537 -14.826 -5.058 1.00 0.00 H new ATOM 0 HD2 PHE A 9 6.764 -10.726 -5.505 1.00 0.00 H new ATOM 0 HE1 PHE A 9 3.171 -14.136 -5.247 1.00 0.00 H new ATOM 0 HE2 PHE A 9 4.376 -10.028 -5.584 1.00 0.00 H new ATOM 0 HZ PHE A 9 2.579 -11.741 -5.370 1.00 0.00 H new ATOM 105 N THR A 10 6.091 -13.878 -2.282 1.00 0.00 N ATOM 106 CA THR A 10 5.065 -14.533 -1.488 1.00 0.00 C ATOM 107 C THR A 10 4.107 -15.368 -2.355 1.00 0.00 C ATOM 108 O THR A 10 4.527 -16.037 -3.289 1.00 0.00 O ATOM 109 CB THR A 10 4.376 -13.414 -0.673 1.00 0.00 C ATOM 110 OG1 THR A 10 5.347 -12.539 -0.153 1.00 0.00 O ATOM 111 CG2 THR A 10 3.597 -13.909 0.551 1.00 0.00 C ATOM 0 H THR A 10 5.880 -12.892 -2.433 1.00 0.00 H new ATOM 0 HA THR A 10 5.488 -15.271 -0.807 1.00 0.00 H new ATOM 0 HB THR A 10 3.687 -12.948 -1.377 1.00 0.00 H new ATOM 0 HG1 THR A 10 5.530 -11.830 -0.804 1.00 0.00 H new ATOM 0 HG21 THR A 10 3.146 -13.059 1.064 1.00 0.00 H new ATOM 0 HG22 THR A 10 2.814 -14.596 0.230 1.00 0.00 H new ATOM 0 HG23 THR A 10 4.276 -14.424 1.230 1.00 0.00 H new ATOM 119 N ARG A 11 2.816 -15.414 -2.020 1.00 0.00 N ATOM 120 CA ARG A 11 1.708 -15.535 -2.956 1.00 0.00 C ATOM 121 C ARG A 11 0.462 -15.124 -2.197 1.00 0.00 C ATOM 122 O ARG A 11 -0.051 -14.029 -2.390 1.00 0.00 O ATOM 123 CB ARG A 11 1.610 -16.955 -3.554 1.00 0.00 C ATOM 124 CG ARG A 11 2.211 -16.967 -4.967 1.00 0.00 C ATOM 125 CD ARG A 11 3.031 -18.225 -5.277 1.00 0.00 C ATOM 126 NE ARG A 11 3.967 -17.956 -6.376 1.00 0.00 N ATOM 127 CZ ARG A 11 3.637 -17.643 -7.635 1.00 0.00 C ATOM 128 NH1 ARG A 11 2.415 -17.873 -8.108 1.00 0.00 N ATOM 129 NH2 ARG A 11 4.536 -17.077 -8.427 1.00 0.00 N ATOM 0 H ARG A 11 2.507 -15.366 -1.049 1.00 0.00 H new ATOM 0 HA ARG A 11 1.850 -14.888 -3.822 1.00 0.00 H new ATOM 0 HB2 ARG A 11 2.139 -17.665 -2.918 1.00 0.00 H new ATOM 0 HB3 ARG A 11 0.568 -17.274 -3.589 1.00 0.00 H new ATOM 0 HG2 ARG A 11 1.405 -16.881 -5.696 1.00 0.00 H new ATOM 0 HG3 ARG A 11 2.847 -16.090 -5.089 1.00 0.00 H new ATOM 0 HD2 ARG A 11 3.580 -18.539 -4.389 1.00 0.00 H new ATOM 0 HD3 ARG A 11 2.366 -19.045 -5.547 1.00 0.00 H new ATOM 0 HE ARG A 11 4.962 -18.013 -6.160 1.00 0.00 H new ATOM 0 HH11 ARG A 11 1.707 -18.296 -7.508 1.00 0.00 H new ATOM 0 HH12 ARG A 11 2.186 -17.626 -9.071 1.00 0.00 H new ATOM 0 HH21 ARG A 11 5.474 -16.882 -8.076 1.00 0.00 H new ATOM 0 HH22 ARG A 11 4.290 -16.836 -9.387 1.00 0.00 H new ATOM 143 N ASP A 12 0.061 -15.953 -1.244 1.00 0.00 N ATOM 144 CA ASP A 12 -1.176 -15.868 -0.472 1.00 0.00 C ATOM 145 C ASP A 12 -1.004 -15.025 0.788 1.00 0.00 C ATOM 146 O ASP A 12 -1.692 -15.223 1.790 1.00 0.00 O ATOM 147 CB ASP A 12 -1.604 -17.311 -0.143 1.00 0.00 C ATOM 148 CG ASP A 12 -2.580 -17.885 -1.186 1.00 0.00 C ATOM 149 OD1 ASP A 12 -3.257 -17.110 -1.904 1.00 0.00 O ATOM 150 OD2 ASP A 12 -2.691 -19.128 -1.270 1.00 0.00 O ATOM 0 H ASP A 12 0.626 -16.756 -0.970 1.00 0.00 H new ATOM 0 HA ASP A 12 -1.950 -15.366 -1.052 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -0.720 -17.946 -0.088 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -2.073 -17.333 0.841 1.00 0.00 H new ATOM 155 N ALA A 13 -0.007 -14.136 0.790 1.00 0.00 N ATOM 156 CA ALA A 13 0.482 -13.351 1.921 1.00 0.00 C ATOM 157 C ALA A 13 0.911 -14.183 3.142 1.00 0.00 C ATOM 158 O ALA A 13 1.476 -13.643 4.089 1.00 0.00 O ATOM 159 CB ALA A 13 -0.555 -12.298 2.281 1.00 0.00 C ATOM 0 H ALA A 13 0.516 -13.933 -0.062 1.00 0.00 H new ATOM 0 HA ALA A 13 1.405 -12.868 1.600 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -0.197 -11.708 3.125 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -0.721 -11.644 1.425 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -1.491 -12.787 2.551 1.00 0.00 H new ATOM 165 N SER A 14 0.692 -15.494 3.126 1.00 0.00 N ATOM 166 CA SER A 14 0.809 -16.367 4.272 1.00 0.00 C ATOM 167 C SER A 14 2.274 -16.629 4.600 1.00 0.00 C ATOM 168 O SER A 14 2.593 -16.911 5.752 1.00 0.00 O ATOM 169 CB SER A 14 0.054 -17.667 3.978 1.00 0.00 C ATOM 170 OG SER A 14 -1.319 -17.412 3.733 1.00 0.00 O ATOM 0 H SER A 14 0.418 -15.989 2.278 1.00 0.00 H new ATOM 0 HA SER A 14 0.368 -15.893 5.148 1.00 0.00 H new ATOM 0 HB2 SER A 14 0.496 -18.161 3.113 1.00 0.00 H new ATOM 0 HB3 SER A 14 0.156 -18.350 4.821 1.00 0.00 H new ATOM 0 HG SER A 14 -1.406 -16.772 2.996 1.00 0.00 H new ATOM 176 N GLN A 15 3.180 -16.515 3.618 1.00 0.00 N ATOM 177 CA GLN A 15 4.603 -16.656 3.936 1.00 0.00 C ATOM 178 C GLN A 15 5.166 -15.518 4.809 1.00 0.00 C ATOM 179 O GLN A 15 6.273 -15.692 5.323 1.00 0.00 O ATOM 180 CB GLN A 15 5.491 -16.823 2.692 1.00 0.00 C ATOM 181 CG GLN A 15 5.142 -18.026 1.805 1.00 0.00 C ATOM 182 CD GLN A 15 6.361 -18.534 1.039 1.00 0.00 C ATOM 183 OE1 GLN A 15 7.153 -17.753 0.523 1.00 0.00 O ATOM 184 NE2 GLN A 15 6.561 -19.839 0.973 1.00 0.00 N ATOM 0 H GLN A 15 2.964 -16.333 2.638 1.00 0.00 H new ATOM 0 HA GLN A 15 4.639 -17.577 4.519 1.00 0.00 H new ATOM 0 HB2 GLN A 15 5.424 -15.916 2.091 1.00 0.00 H new ATOM 0 HB3 GLN A 15 6.528 -16.916 3.014 1.00 0.00 H new ATOM 0 HG2 GLN A 15 4.739 -18.829 2.422 1.00 0.00 H new ATOM 0 HG3 GLN A 15 4.360 -17.744 1.100 1.00 0.00 H new ATOM 0 HE21 GLN A 15 5.896 -20.479 1.406 1.00 0.00 H new ATOM 0 HE22 GLN A 15 7.381 -20.205 0.489 1.00 0.00 H new ATOM 193 N LEU A 16 4.482 -14.371 4.949 1.00 0.00 N ATOM 194 CA LEU A 16 5.027 -13.213 5.668 1.00 0.00 C ATOM 195 C LEU A 16 4.993 -13.459 7.179 1.00 0.00 C ATOM 196 O LEU A 16 4.235 -14.300 7.668 1.00 0.00 O ATOM 197 CB LEU A 16 4.248 -11.924 5.341 1.00 0.00 C ATOM 198 CG LEU A 16 4.144 -11.531 3.856 1.00 0.00 C ATOM 199 CD1 LEU A 16 3.540 -10.130 3.712 1.00 0.00 C ATOM 200 CD2 LEU A 16 5.504 -11.561 3.149 1.00 0.00 C ATOM 0 H LEU A 16 3.546 -14.223 4.571 1.00 0.00 H new ATOM 0 HA LEU A 16 6.059 -13.083 5.341 1.00 0.00 H new ATOM 0 HB2 LEU A 16 3.237 -12.029 5.736 1.00 0.00 H new ATOM 0 HB3 LEU A 16 4.716 -11.099 5.878 1.00 0.00 H new ATOM 0 HG LEU A 16 3.497 -12.270 3.383 1.00 0.00 H new ATOM 0 HD11 LEU A 16 3.474 -9.869 2.656 1.00 0.00 H new ATOM 0 HD12 LEU A 16 2.543 -10.117 4.152 1.00 0.00 H new ATOM 0 HD13 LEU A 16 4.173 -9.406 4.226 1.00 0.00 H new ATOM 0 HD21 LEU A 16 5.377 -11.276 2.104 1.00 0.00 H new ATOM 0 HD22 LEU A 16 6.183 -10.861 3.636 1.00 0.00 H new ATOM 0 HD23 LEU A 16 5.920 -12.567 3.203 1.00 0.00 H new ATOM 212 N LYS A 17 5.773 -12.689 7.947 1.00 0.00 N ATOM 213 CA LYS A 17 6.074 -12.998 9.349 1.00 0.00 C ATOM 214 C LYS A 17 5.924 -11.825 10.321 1.00 0.00 C ATOM 215 O LYS A 17 6.201 -11.991 11.505 1.00 0.00 O ATOM 216 CB LYS A 17 7.484 -13.603 9.402 1.00 0.00 C ATOM 217 CG LYS A 17 7.472 -15.131 9.270 1.00 0.00 C ATOM 218 CD LYS A 17 6.961 -15.881 10.508 1.00 0.00 C ATOM 219 CE LYS A 17 7.986 -15.822 11.645 1.00 0.00 C ATOM 220 NZ LYS A 17 7.608 -16.705 12.767 1.00 0.00 N ATOM 0 H LYS A 17 6.214 -11.832 7.612 1.00 0.00 H new ATOM 0 HA LYS A 17 5.324 -13.708 9.698 1.00 0.00 H new ATOM 0 HB2 LYS A 17 8.089 -13.177 8.602 1.00 0.00 H new ATOM 0 HB3 LYS A 17 7.960 -13.326 10.343 1.00 0.00 H new ATOM 0 HG2 LYS A 17 6.851 -15.403 8.416 1.00 0.00 H new ATOM 0 HG3 LYS A 17 8.484 -15.470 9.049 1.00 0.00 H new ATOM 0 HD2 LYS A 17 6.019 -15.444 10.839 1.00 0.00 H new ATOM 0 HD3 LYS A 17 6.757 -16.920 10.250 1.00 0.00 H new ATOM 0 HE2 LYS A 17 8.966 -16.113 11.267 1.00 0.00 H new ATOM 0 HE3 LYS A 17 8.074 -14.796 12.003 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 8.325 -16.639 13.518 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 6.684 -16.411 13.144 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 7.548 -17.687 12.431 1.00 0.00 H new ATOM 234 N GLY A 18 5.504 -10.664 9.844 1.00 0.00 N ATOM 235 CA GLY A 18 4.972 -9.578 10.664 1.00 0.00 C ATOM 236 C GLY A 18 3.455 -9.696 10.774 1.00 0.00 C ATOM 237 O GLY A 18 2.859 -10.633 10.233 1.00 0.00 O ATOM 0 H GLY A 18 5.523 -10.441 8.849 1.00 0.00 H new ATOM 0 HA2 GLY A 18 5.420 -9.610 11.657 1.00 0.00 H new ATOM 0 HA3 GLY A 18 5.238 -8.617 10.225 1.00 0.00 H new ATOM 241 N THR A 19 2.828 -8.758 11.485 1.00 0.00 N ATOM 242 CA THR A 19 1.407 -8.812 11.811 1.00 0.00 C ATOM 243 C THR A 19 0.594 -8.301 10.624 1.00 0.00 C ATOM 244 O THR A 19 1.089 -7.503 9.821 1.00 0.00 O ATOM 245 CB THR A 19 1.169 -7.992 13.093 1.00 0.00 C ATOM 246 OG1 THR A 19 2.028 -8.467 14.111 1.00 0.00 O ATOM 247 CG2 THR A 19 -0.258 -8.062 13.645 1.00 0.00 C ATOM 0 H THR A 19 3.299 -7.932 11.853 1.00 0.00 H new ATOM 0 HA THR A 19 1.082 -9.835 12.002 1.00 0.00 H new ATOM 0 HB THR A 19 1.361 -6.957 12.812 1.00 0.00 H new ATOM 0 HG1 THR A 19 1.883 -7.948 14.930 1.00 0.00 H new ATOM 0 HG21 THR A 19 -0.329 -7.454 14.547 1.00 0.00 H new ATOM 0 HG22 THR A 19 -0.956 -7.685 12.898 1.00 0.00 H new ATOM 0 HG23 THR A 19 -0.505 -9.096 13.884 1.00 0.00 H new ATOM 255 N PHE A 20 -0.660 -8.746 10.521 1.00 0.00 N ATOM 256 CA PHE A 20 -1.615 -8.300 9.519 1.00 0.00 C ATOM 257 C PHE A 20 -2.706 -7.512 10.217 1.00 0.00 C ATOM 258 O PHE A 20 -3.139 -7.856 11.321 1.00 0.00 O ATOM 259 CB PHE A 20 -2.215 -9.490 8.769 1.00 0.00 C ATOM 260 CG PHE A 20 -1.382 -9.972 7.607 1.00 0.00 C ATOM 261 CD1 PHE A 20 -0.032 -10.322 7.780 1.00 0.00 C ATOM 262 CD2 PHE A 20 -1.967 -10.075 6.336 1.00 0.00 C ATOM 263 CE1 PHE A 20 0.740 -10.710 6.679 1.00 0.00 C ATOM 264 CE2 PHE A 20 -1.202 -10.504 5.245 1.00 0.00 C ATOM 265 CZ PHE A 20 0.162 -10.793 5.407 1.00 0.00 C ATOM 0 H PHE A 20 -1.045 -9.447 11.154 1.00 0.00 H new ATOM 0 HA PHE A 20 -1.109 -7.672 8.786 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -2.353 -10.314 9.469 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -3.204 -9.213 8.403 1.00 0.00 H new ATOM 0 HD1 PHE A 20 0.411 -10.292 8.765 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -3.008 -9.823 6.199 1.00 0.00 H new ATOM 0 HE1 PHE A 20 1.786 -10.946 6.811 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -1.663 -10.613 4.275 1.00 0.00 H new ATOM 0 HZ PHE A 20 0.762 -11.078 4.555 1.00 0.00 H new ATOM 275 N LEU A 21 -3.136 -6.440 9.568 1.00 0.00 N ATOM 276 CA LEU A 21 -4.125 -5.496 10.044 1.00 0.00 C ATOM 277 C LEU A 21 -5.257 -5.452 9.016 1.00 0.00 C ATOM 278 O LEU A 21 -5.198 -6.134 7.986 1.00 0.00 O ATOM 279 CB LEU A 21 -3.513 -4.099 10.215 1.00 0.00 C ATOM 280 CG LEU A 21 -2.079 -3.912 10.750 1.00 0.00 C ATOM 281 CD1 LEU A 21 -1.866 -4.520 12.132 1.00 0.00 C ATOM 282 CD2 LEU A 21 -0.974 -4.315 9.768 1.00 0.00 C ATOM 0 H LEU A 21 -2.781 -6.196 8.643 1.00 0.00 H new ATOM 0 HA LEU A 21 -4.500 -5.810 11.018 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -3.554 -3.613 9.240 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -4.175 -3.541 10.878 1.00 0.00 H new ATOM 0 HG LEU A 21 -1.984 -2.832 10.862 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -0.836 -4.353 12.448 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -2.545 -4.051 12.844 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -2.064 -5.591 12.093 1.00 0.00 H new ATOM 0 HD21 LEU A 21 0.000 -4.150 10.229 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -1.081 -5.369 9.513 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -1.054 -3.713 8.863 1.00 0.00 H new ATOM 294 N SER A 22 -6.271 -4.631 9.262 1.00 0.00 N ATOM 295 CA SER A 22 -7.210 -4.242 8.230 1.00 0.00 C ATOM 296 C SER A 22 -7.676 -2.803 8.423 1.00 0.00 C ATOM 297 O SER A 22 -7.535 -2.246 9.516 1.00 0.00 O ATOM 298 CB SER A 22 -8.365 -5.238 8.240 1.00 0.00 C ATOM 299 OG SER A 22 -9.022 -5.370 9.489 1.00 0.00 O ATOM 0 H SER A 22 -6.460 -4.222 10.177 1.00 0.00 H new ATOM 0 HA SER A 22 -6.730 -4.268 7.252 1.00 0.00 H new ATOM 0 HB2 SER A 22 -9.096 -4.934 7.491 1.00 0.00 H new ATOM 0 HB3 SER A 22 -7.987 -6.215 7.938 1.00 0.00 H new ATOM 0 HG SER A 22 -9.748 -6.024 9.409 1.00 0.00 H new ATOM 305 N THR A 23 -8.302 -2.225 7.395 1.00 0.00 N ATOM 306 CA THR A 23 -9.293 -1.185 7.594 1.00 0.00 C ATOM 307 C THR A 23 -10.271 -1.202 6.422 1.00 0.00 C ATOM 308 O THR A 23 -9.934 -1.642 5.324 1.00 0.00 O ATOM 309 CB THR A 23 -8.639 0.195 7.819 1.00 0.00 C ATOM 310 OG1 THR A 23 -9.654 1.102 8.217 1.00 0.00 O ATOM 311 CG2 THR A 23 -7.893 0.766 6.611 1.00 0.00 C ATOM 0 H THR A 23 -8.134 -2.466 6.418 1.00 0.00 H new ATOM 0 HA THR A 23 -9.854 -1.384 8.507 1.00 0.00 H new ATOM 0 HB THR A 23 -7.876 0.056 8.585 1.00 0.00 H new ATOM 0 HG1 THR A 23 -9.305 1.700 8.910 1.00 0.00 H new ATOM 0 HG21 THR A 23 -7.470 1.737 6.870 1.00 0.00 H new ATOM 0 HG22 THR A 23 -7.091 0.086 6.324 1.00 0.00 H new ATOM 0 HG23 THR A 23 -8.586 0.883 5.778 1.00 0.00 H new ATOM 319 N THR A 24 -11.472 -0.673 6.635 1.00 0.00 N ATOM 320 CA THR A 24 -12.373 -0.236 5.592 1.00 0.00 C ATOM 321 C THR A 24 -12.324 1.290 5.573 1.00 0.00 C ATOM 322 O THR A 24 -12.745 1.924 6.545 1.00 0.00 O ATOM 323 CB THR A 24 -13.784 -0.768 5.880 1.00 0.00 C ATOM 324 OG1 THR A 24 -13.741 -2.162 6.122 1.00 0.00 O ATOM 325 CG2 THR A 24 -14.731 -0.504 4.705 1.00 0.00 C ATOM 0 H THR A 24 -11.850 -0.535 7.572 1.00 0.00 H new ATOM 0 HA THR A 24 -12.085 -0.619 4.613 1.00 0.00 H new ATOM 0 HB THR A 24 -14.156 -0.244 6.761 1.00 0.00 H new ATOM 0 HG1 THR A 24 -14.646 -2.490 6.306 1.00 0.00 H new ATOM 0 HG21 THR A 24 -15.721 -0.893 4.941 1.00 0.00 H new ATOM 0 HG22 THR A 24 -14.796 0.569 4.524 1.00 0.00 H new ATOM 0 HG23 THR A 24 -14.350 -1.000 3.812 1.00 0.00 H new ATOM 333 N LEU A 25 -11.814 1.906 4.499 1.00 0.00 N ATOM 334 CA LEU A 25 -11.927 3.353 4.340 1.00 0.00 C ATOM 335 C LEU A 25 -13.091 3.647 3.425 1.00 0.00 C ATOM 336 O LEU A 25 -13.215 3.041 2.360 1.00 0.00 O ATOM 337 CB LEU A 25 -10.698 4.006 3.702 1.00 0.00 C ATOM 338 CG LEU A 25 -9.408 4.032 4.532 1.00 0.00 C ATOM 339 CD1 LEU A 25 -8.689 5.351 4.239 1.00 0.00 C ATOM 340 CD2 LEU A 25 -9.579 3.956 6.056 1.00 0.00 C ATOM 0 H LEU A 25 -11.327 1.430 3.740 1.00 0.00 H new ATOM 0 HA LEU A 25 -12.047 3.759 5.344 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -10.487 3.488 2.766 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -10.956 5.034 3.446 1.00 0.00 H new ATOM 0 HG LEU A 25 -8.864 3.134 4.238 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -7.766 5.398 4.816 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -8.455 5.410 3.176 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -9.333 6.186 4.516 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -8.600 3.982 6.534 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -10.173 4.804 6.398 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -10.086 3.028 6.319 1.00 0.00 H new ATOM 352 N LYS A 26 -13.865 4.666 3.793 1.00 0.00 N ATOM 353 CA LYS A 26 -14.715 5.381 2.855 1.00 0.00 C ATOM 354 C LYS A 26 -13.846 6.406 2.132 1.00 0.00 C ATOM 355 O LYS A 26 -12.835 6.873 2.671 1.00 0.00 O ATOM 356 CB LYS A 26 -15.864 6.057 3.619 1.00 0.00 C ATOM 357 CG LYS A 26 -17.063 6.372 2.706 1.00 0.00 C ATOM 358 CD LYS A 26 -18.133 7.180 3.444 1.00 0.00 C ATOM 359 CE LYS A 26 -17.750 8.647 3.639 1.00 0.00 C ATOM 360 NZ LYS A 26 -18.535 9.303 4.703 1.00 0.00 N ATOM 0 H LYS A 26 -13.918 5.016 4.750 1.00 0.00 H new ATOM 0 HA LYS A 26 -15.159 4.704 2.125 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -16.189 5.408 4.432 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -15.503 6.980 4.073 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -16.721 6.930 1.834 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -17.497 5.442 2.339 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -19.069 7.126 2.887 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -18.315 6.726 4.418 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -16.690 8.712 3.882 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -17.896 9.184 2.702 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -18.236 10.295 4.794 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -19.546 9.267 4.461 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -18.377 8.810 5.605 1.00 0.00 H new ATOM 374 N LYS A 27 -14.254 6.801 0.927 1.00 0.00 N ATOM 375 CA LYS A 27 -13.876 8.104 0.394 1.00 0.00 C ATOM 376 C LYS A 27 -14.367 9.186 1.372 1.00 0.00 C ATOM 377 O LYS A 27 -15.309 8.945 2.121 1.00 0.00 O ATOM 378 CB LYS A 27 -14.510 8.290 -1.007 1.00 0.00 C ATOM 379 CG LYS A 27 -13.457 8.563 -2.088 1.00 0.00 C ATOM 380 CD LYS A 27 -12.906 7.305 -2.773 1.00 0.00 C ATOM 381 CE LYS A 27 -11.812 7.660 -3.786 1.00 0.00 C ATOM 382 NZ LYS A 27 -11.523 6.571 -4.736 1.00 0.00 N ATOM 0 H LYS A 27 -14.841 6.242 0.308 1.00 0.00 H new ATOM 0 HA LYS A 27 -12.794 8.181 0.288 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -15.075 7.396 -1.270 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -15.219 9.117 -0.976 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -13.894 9.213 -2.847 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -12.628 9.110 -1.639 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -12.503 6.626 -2.022 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -13.716 6.778 -3.278 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -12.115 8.547 -4.342 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -10.899 7.917 -3.249 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -10.918 6.930 -5.502 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -11.033 5.799 -4.241 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -12.414 6.214 -5.137 1.00 0.00 H new ATOM 396 N SER A 28 -13.822 10.397 1.301 1.00 0.00 N ATOM 397 CA SER A 28 -14.503 11.568 1.850 1.00 0.00 C ATOM 398 C SER A 28 -14.514 12.640 0.771 1.00 0.00 C ATOM 399 O SER A 28 -15.515 12.796 0.068 1.00 0.00 O ATOM 400 CB SER A 28 -13.848 12.051 3.152 1.00 0.00 C ATOM 401 OG SER A 28 -14.034 11.158 4.232 1.00 0.00 O ATOM 0 H SER A 28 -12.918 10.594 0.872 1.00 0.00 H new ATOM 0 HA SER A 28 -15.527 11.316 2.124 1.00 0.00 H new ATOM 0 HB2 SER A 28 -12.780 12.191 2.984 1.00 0.00 H new ATOM 0 HB3 SER A 28 -14.259 13.025 3.419 1.00 0.00 H new ATOM 0 HG SER A 28 -13.595 11.516 5.032 1.00 0.00 H new ATOM 407 N ASN A 29 -13.381 13.319 0.602 1.00 0.00 N ATOM 408 CA ASN A 29 -13.209 14.505 -0.216 1.00 0.00 C ATOM 409 C ASN A 29 -11.992 14.238 -1.084 1.00 0.00 C ATOM 410 O ASN A 29 -10.992 13.754 -0.547 1.00 0.00 O ATOM 411 CB ASN A 29 -12.976 15.725 0.680 1.00 0.00 C ATOM 412 CG ASN A 29 -14.221 16.099 1.467 1.00 0.00 C ATOM 413 OD1 ASN A 29 -14.483 15.543 2.532 1.00 0.00 O ATOM 414 ND2 ASN A 29 -15.023 17.008 0.951 1.00 0.00 N ATOM 0 H ASN A 29 -12.514 13.036 1.060 1.00 0.00 H new ATOM 0 HA ASN A 29 -14.089 14.712 -0.824 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -12.159 15.517 1.371 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -12.667 16.571 0.067 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -15.883 17.264 1.436 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -14.784 17.456 0.066 1.00 0.00 H new ATOM 421 N MET A 30 -12.080 14.506 -2.392 1.00 0.00 N ATOM 422 CA MET A 30 -11.154 14.073 -3.450 1.00 0.00 C ATOM 423 C MET A 30 -11.134 12.543 -3.576 1.00 0.00 C ATOM 424 O MET A 30 -11.488 11.984 -4.617 1.00 0.00 O ATOM 425 CB MET A 30 -9.724 14.638 -3.271 1.00 0.00 C ATOM 426 CG MET A 30 -9.575 16.130 -3.580 1.00 0.00 C ATOM 427 SD MET A 30 -9.753 16.537 -5.342 1.00 0.00 S ATOM 428 CE MET A 30 -8.172 17.379 -5.635 1.00 0.00 C ATOM 0 H MET A 30 -12.847 15.066 -2.765 1.00 0.00 H new ATOM 0 HA MET A 30 -11.535 14.491 -4.382 1.00 0.00 H new ATOM 0 HB2 MET A 30 -9.406 14.461 -2.244 1.00 0.00 H new ATOM 0 HB3 MET A 30 -9.045 14.079 -3.915 1.00 0.00 H new ATOM 0 HG2 MET A 30 -10.321 16.685 -3.012 1.00 0.00 H new ATOM 0 HG3 MET A 30 -8.597 16.467 -3.236 1.00 0.00 H new ATOM 0 HE1 MET A 30 -8.116 17.697 -6.676 1.00 0.00 H new ATOM 0 HE2 MET A 30 -8.098 18.251 -4.985 1.00 0.00 H new ATOM 0 HE3 MET A 30 -7.350 16.696 -5.420 1.00 0.00 H new ATOM 438 N GLY A 31 -10.719 11.846 -2.522 1.00 0.00 N ATOM 439 CA GLY A 31 -10.455 10.429 -2.540 1.00 0.00 C ATOM 440 C GLY A 31 -10.250 9.905 -1.122 1.00 0.00 C ATOM 441 O GLY A 31 -10.808 10.431 -0.155 1.00 0.00 O ATOM 0 H GLY A 31 -10.555 12.273 -1.610 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -11.286 9.904 -3.011 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -9.568 10.226 -3.141 1.00 0.00 H new ATOM 445 N PHE A 32 -9.507 8.809 -1.003 1.00 0.00 N ATOM 446 CA PHE A 32 -8.939 8.381 0.266 1.00 0.00 C ATOM 447 C PHE A 32 -7.814 9.345 0.648 1.00 0.00 C ATOM 448 O PHE A 32 -7.207 9.983 -0.217 1.00 0.00 O ATOM 449 CB PHE A 32 -8.437 6.933 0.218 1.00 0.00 C ATOM 450 CG PHE A 32 -9.385 5.960 -0.449 1.00 0.00 C ATOM 451 CD1 PHE A 32 -10.536 5.521 0.232 1.00 0.00 C ATOM 452 CD2 PHE A 32 -9.117 5.498 -1.752 1.00 0.00 C ATOM 453 CE1 PHE A 32 -11.401 4.599 -0.379 1.00 0.00 C ATOM 454 CE2 PHE A 32 -10.000 4.601 -2.375 1.00 0.00 C ATOM 455 CZ PHE A 32 -11.124 4.137 -1.676 1.00 0.00 C ATOM 0 H PHE A 32 -9.283 8.194 -1.785 1.00 0.00 H new ATOM 0 HA PHE A 32 -9.720 8.404 1.026 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -7.483 6.910 -0.309 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -8.246 6.594 1.236 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -10.753 5.893 1.222 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -8.232 5.834 -2.272 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -12.276 4.246 0.147 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -9.815 4.270 -3.386 1.00 0.00 H new ATOM 0 HZ PHE A 32 -11.783 3.418 -2.140 1.00 0.00 H new ATOM 465 N GLY A 33 -7.541 9.470 1.945 1.00 0.00 N ATOM 466 CA GLY A 33 -6.477 10.312 2.478 1.00 0.00 C ATOM 467 C GLY A 33 -5.098 9.649 2.418 1.00 0.00 C ATOM 468 O GLY A 33 -4.336 9.830 3.357 1.00 0.00 O ATOM 0 H GLY A 33 -8.065 8.978 2.668 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -6.448 11.248 1.919 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -6.707 10.566 3.513 1.00 0.00 H new ATOM 472 N PHE A 34 -4.765 8.845 1.400 1.00 0.00 N ATOM 473 CA PHE A 34 -3.443 8.214 1.299 1.00 0.00 C ATOM 474 C PHE A 34 -3.023 8.038 -0.159 1.00 0.00 C ATOM 475 O PHE A 34 -3.870 8.104 -1.062 1.00 0.00 O ATOM 476 CB PHE A 34 -3.440 6.876 2.052 1.00 0.00 C ATOM 477 CG PHE A 34 -4.275 5.774 1.427 1.00 0.00 C ATOM 478 CD1 PHE A 34 -5.620 5.618 1.805 1.00 0.00 C ATOM 479 CD2 PHE A 34 -3.655 4.799 0.620 1.00 0.00 C ATOM 480 CE1 PHE A 34 -6.354 4.500 1.381 1.00 0.00 C ATOM 481 CE2 PHE A 34 -4.388 3.668 0.214 1.00 0.00 C ATOM 482 CZ PHE A 34 -5.736 3.514 0.587 1.00 0.00 C ATOM 0 H PHE A 34 -5.396 8.616 0.632 1.00 0.00 H new ATOM 0 HA PHE A 34 -2.708 8.871 1.765 1.00 0.00 H new ATOM 0 HB2 PHE A 34 -2.411 6.527 2.133 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -3.799 7.049 3.067 1.00 0.00 H new ATOM 0 HD1 PHE A 34 -6.092 6.365 2.427 1.00 0.00 H new ATOM 0 HD2 PHE A 34 -2.626 4.919 0.316 1.00 0.00 H new ATOM 0 HE1 PHE A 34 -7.391 4.395 1.663 1.00 0.00 H new ATOM 0 HE2 PHE A 34 -3.911 2.911 -0.390 1.00 0.00 H new ATOM 0 HZ PHE A 34 -6.293 2.646 0.267 1.00 0.00 H new ATOM 492 N THR A 35 -1.731 7.806 -0.396 1.00 0.00 N ATOM 493 CA THR A 35 -1.156 7.530 -1.705 1.00 0.00 C ATOM 494 C THR A 35 -0.371 6.214 -1.643 1.00 0.00 C ATOM 495 O THR A 35 0.075 5.796 -0.575 1.00 0.00 O ATOM 496 CB THR A 35 -0.301 8.736 -2.157 1.00 0.00 C ATOM 497 OG1 THR A 35 0.455 9.306 -1.100 1.00 0.00 O ATOM 498 CG2 THR A 35 -1.187 9.828 -2.755 1.00 0.00 C ATOM 0 H THR A 35 -1.034 7.806 0.349 1.00 0.00 H new ATOM 0 HA THR A 35 -1.935 7.400 -2.457 1.00 0.00 H new ATOM 0 HB THR A 35 0.392 8.348 -2.903 1.00 0.00 H new ATOM 0 HG1 THR A 35 0.977 10.062 -1.442 1.00 0.00 H new ATOM 0 HG21 THR A 35 -0.568 10.669 -3.067 1.00 0.00 H new ATOM 0 HG22 THR A 35 -1.722 9.431 -3.618 1.00 0.00 H new ATOM 0 HG23 THR A 35 -1.905 10.164 -2.007 1.00 0.00 H new ATOM 506 N ILE A 36 -0.205 5.532 -2.783 1.00 0.00 N ATOM 507 CA ILE A 36 0.387 4.199 -2.894 1.00 0.00 C ATOM 508 C ILE A 36 1.606 4.243 -3.833 1.00 0.00 C ATOM 509 O ILE A 36 1.781 5.218 -4.577 1.00 0.00 O ATOM 510 CB ILE A 36 -0.714 3.204 -3.343 1.00 0.00 C ATOM 511 CG1 ILE A 36 -1.994 3.339 -2.478 1.00 0.00 C ATOM 512 CG2 ILE A 36 -0.248 1.748 -3.182 1.00 0.00 C ATOM 513 CD1 ILE A 36 -3.116 4.203 -3.062 1.00 0.00 C ATOM 0 H ILE A 36 -0.491 5.910 -3.686 1.00 0.00 H new ATOM 0 HA ILE A 36 0.764 3.851 -1.932 1.00 0.00 H new ATOM 0 HB ILE A 36 -0.920 3.443 -4.386 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -2.391 2.340 -2.295 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -1.711 3.753 -1.510 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -1.042 1.074 -3.505 1.00 0.00 H new ATOM 0 HG22 ILE A 36 0.640 1.581 -3.791 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -0.012 1.555 -2.136 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -3.958 4.223 -2.370 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -2.750 5.218 -3.218 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -3.440 3.784 -4.015 1.00 0.00 H new ATOM 525 N ILE A 37 2.462 3.220 -3.760 1.00 0.00 N ATOM 526 CA ILE A 37 3.660 2.979 -4.567 1.00 0.00 C ATOM 527 C ILE A 37 3.684 1.486 -4.960 1.00 0.00 C ATOM 528 O ILE A 37 3.025 0.669 -4.311 1.00 0.00 O ATOM 529 CB ILE A 37 4.913 3.450 -3.776 1.00 0.00 C ATOM 530 CG1 ILE A 37 6.243 3.137 -4.502 1.00 0.00 C ATOM 531 CG2 ILE A 37 4.934 2.902 -2.338 1.00 0.00 C ATOM 532 CD1 ILE A 37 7.468 3.806 -3.867 1.00 0.00 C ATOM 0 H ILE A 37 2.322 2.476 -3.076 1.00 0.00 H new ATOM 0 HA ILE A 37 3.656 3.554 -5.493 1.00 0.00 H new ATOM 0 HB ILE A 37 4.828 4.535 -3.721 1.00 0.00 H new ATOM 0 HG12 ILE A 37 6.395 2.058 -4.513 1.00 0.00 H new ATOM 0 HG13 ILE A 37 6.163 3.458 -5.541 1.00 0.00 H new ATOM 0 HG21 ILE A 37 5.828 3.258 -1.826 1.00 0.00 H new ATOM 0 HG22 ILE A 37 4.048 3.247 -1.804 1.00 0.00 H new ATOM 0 HG23 ILE A 37 4.941 1.812 -2.364 1.00 0.00 H new ATOM 0 HD11 ILE A 37 8.362 3.539 -4.431 1.00 0.00 H new ATOM 0 HD12 ILE A 37 7.340 4.888 -3.881 1.00 0.00 H new ATOM 0 HD13 ILE A 37 7.575 3.466 -2.837 1.00 0.00 H new ATOM 544 N GLY A 38 4.402 1.144 -6.035 1.00 0.00 N ATOM 545 CA GLY A 38 4.743 -0.204 -6.486 1.00 0.00 C ATOM 546 C GLY A 38 6.181 -0.180 -6.996 1.00 0.00 C ATOM 547 O GLY A 38 6.629 0.878 -7.443 1.00 0.00 O ATOM 0 H GLY A 38 4.787 1.856 -6.656 1.00 0.00 H new ATOM 0 HA2 GLY A 38 4.640 -0.917 -5.668 1.00 0.00 H new ATOM 0 HA3 GLY A 38 4.064 -0.525 -7.276 1.00 0.00 H new ATOM 551 N GLY A 39 6.880 -1.317 -6.920 1.00 0.00 N ATOM 552 CA GLY A 39 8.294 -1.442 -7.257 1.00 0.00 C ATOM 553 C GLY A 39 8.593 -1.047 -8.699 1.00 0.00 C ATOM 554 O GLY A 39 9.196 -0.001 -8.931 1.00 0.00 O ATOM 0 H GLY A 39 6.463 -2.196 -6.614 1.00 0.00 H new ATOM 0 HA2 GLY A 39 8.880 -0.816 -6.584 1.00 0.00 H new ATOM 0 HA3 GLY A 39 8.613 -2.471 -7.093 1.00 0.00 H new ATOM 558 N ASP A 40 8.166 -1.880 -9.658 1.00 0.00 N ATOM 559 CA ASP A 40 8.344 -1.682 -11.107 1.00 0.00 C ATOM 560 C ASP A 40 7.946 -2.939 -11.876 1.00 0.00 C ATOM 561 O ASP A 40 7.081 -2.861 -12.748 1.00 0.00 O ATOM 562 CB ASP A 40 9.777 -1.263 -11.527 1.00 0.00 C ATOM 563 CG ASP A 40 9.892 0.193 -11.999 1.00 0.00 C ATOM 564 OD1 ASP A 40 8.873 0.841 -12.337 1.00 0.00 O ATOM 565 OD2 ASP A 40 11.039 0.686 -12.094 1.00 0.00 O ATOM 0 H ASP A 40 7.668 -2.743 -9.440 1.00 0.00 H new ATOM 0 HA ASP A 40 7.687 -0.849 -11.360 1.00 0.00 H new ATOM 0 HB2 ASP A 40 10.450 -1.414 -10.683 1.00 0.00 H new ATOM 0 HB3 ASP A 40 10.116 -1.921 -12.327 1.00 0.00 H new ATOM 570 N GLU A 41 8.564 -4.102 -11.632 1.00 0.00 N ATOM 571 CA GLU A 41 8.110 -5.337 -12.290 1.00 0.00 C ATOM 572 C GLU A 41 6.752 -5.775 -11.719 1.00 0.00 C ATOM 573 O GLU A 41 6.407 -5.369 -10.605 1.00 0.00 O ATOM 574 CB GLU A 41 9.152 -6.470 -12.204 1.00 0.00 C ATOM 575 CG GLU A 41 10.108 -6.440 -13.412 1.00 0.00 C ATOM 576 CD GLU A 41 10.569 -7.840 -13.824 1.00 0.00 C ATOM 577 OE1 GLU A 41 11.001 -8.623 -12.946 1.00 0.00 O ATOM 578 OE2 GLU A 41 10.475 -8.175 -15.027 1.00 0.00 O ATOM 0 H GLU A 41 9.358 -4.215 -11.002 1.00 0.00 H new ATOM 0 HA GLU A 41 7.988 -5.118 -13.351 1.00 0.00 H new ATOM 0 HB2 GLU A 41 9.724 -6.372 -11.281 1.00 0.00 H new ATOM 0 HB3 GLU A 41 8.643 -7.433 -12.163 1.00 0.00 H new ATOM 0 HG2 GLU A 41 9.609 -5.962 -14.255 1.00 0.00 H new ATOM 0 HG3 GLU A 41 10.978 -5.831 -13.169 1.00 0.00 H new ATOM 585 N PRO A 42 5.968 -6.592 -12.452 1.00 0.00 N ATOM 586 CA PRO A 42 4.610 -6.996 -12.077 1.00 0.00 C ATOM 587 C PRO A 42 4.605 -8.088 -10.987 1.00 0.00 C ATOM 588 O PRO A 42 3.868 -9.076 -11.066 1.00 0.00 O ATOM 589 CB PRO A 42 3.979 -7.438 -13.405 1.00 0.00 C ATOM 590 CG PRO A 42 5.154 -8.052 -14.157 1.00 0.00 C ATOM 591 CD PRO A 42 6.294 -7.115 -13.779 1.00 0.00 C ATOM 0 HA PRO A 42 4.038 -6.192 -11.614 1.00 0.00 H new ATOM 0 HB2 PRO A 42 3.178 -8.160 -13.250 1.00 0.00 H new ATOM 0 HB3 PRO A 42 3.549 -6.596 -13.947 1.00 0.00 H new ATOM 0 HG2 PRO A 42 5.348 -9.078 -13.844 1.00 0.00 H new ATOM 0 HG3 PRO A 42 4.983 -8.074 -15.233 1.00 0.00 H new ATOM 0 HD2 PRO A 42 7.246 -7.646 -13.765 1.00 0.00 H new ATOM 0 HD3 PRO A 42 6.390 -6.306 -14.504 1.00 0.00 H new ATOM 599 N ASP A 43 5.455 -7.928 -9.978 1.00 0.00 N ATOM 600 CA ASP A 43 5.825 -8.881 -8.935 1.00 0.00 C ATOM 601 C ASP A 43 6.698 -8.159 -7.896 1.00 0.00 C ATOM 602 O ASP A 43 7.635 -8.726 -7.324 1.00 0.00 O ATOM 603 CB ASP A 43 6.463 -10.168 -9.511 1.00 0.00 C ATOM 604 CG ASP A 43 7.538 -9.948 -10.577 1.00 0.00 C ATOM 605 OD1 ASP A 43 8.706 -9.673 -10.230 1.00 0.00 O ATOM 606 OD2 ASP A 43 7.208 -10.127 -11.771 1.00 0.00 O ATOM 0 H ASP A 43 5.950 -7.044 -9.858 1.00 0.00 H new ATOM 0 HA ASP A 43 4.929 -9.239 -8.429 1.00 0.00 H new ATOM 0 HB2 ASP A 43 6.901 -10.735 -8.689 1.00 0.00 H new ATOM 0 HB3 ASP A 43 5.673 -10.785 -9.938 1.00 0.00 H new ATOM 611 N GLU A 44 6.373 -6.893 -7.612 1.00 0.00 N ATOM 612 CA GLU A 44 6.918 -6.144 -6.481 1.00 0.00 C ATOM 613 C GLU A 44 5.796 -5.861 -5.496 1.00 0.00 C ATOM 614 O GLU A 44 4.631 -5.729 -5.882 1.00 0.00 O ATOM 615 CB GLU A 44 7.564 -4.827 -6.929 1.00 0.00 C ATOM 616 CG GLU A 44 8.850 -5.077 -7.726 1.00 0.00 C ATOM 617 CD GLU A 44 10.143 -5.028 -6.914 1.00 0.00 C ATOM 618 OE1 GLU A 44 10.109 -4.814 -5.683 1.00 0.00 O ATOM 619 OE2 GLU A 44 11.222 -5.244 -7.507 1.00 0.00 O ATOM 0 H GLU A 44 5.713 -6.354 -8.172 1.00 0.00 H new ATOM 0 HA GLU A 44 7.696 -6.745 -6.010 1.00 0.00 H new ATOM 0 HB2 GLU A 44 6.859 -4.264 -7.540 1.00 0.00 H new ATOM 0 HB3 GLU A 44 7.789 -4.215 -6.056 1.00 0.00 H new ATOM 0 HG2 GLU A 44 8.777 -6.054 -8.204 1.00 0.00 H new ATOM 0 HG3 GLU A 44 8.913 -4.336 -8.523 1.00 0.00 H new ATOM 626 N PHE A 45 6.162 -5.767 -4.225 1.00 0.00 N ATOM 627 CA PHE A 45 5.209 -5.529 -3.152 1.00 0.00 C ATOM 628 C PHE A 45 4.774 -4.065 -3.185 1.00 0.00 C ATOM 629 O PHE A 45 5.590 -3.137 -3.160 1.00 0.00 O ATOM 630 CB PHE A 45 5.786 -5.902 -1.779 1.00 0.00 C ATOM 631 CG PHE A 45 6.096 -7.371 -1.512 1.00 0.00 C ATOM 632 CD1 PHE A 45 6.024 -8.360 -2.516 1.00 0.00 C ATOM 633 CD2 PHE A 45 6.527 -7.743 -0.224 1.00 0.00 C ATOM 634 CE1 PHE A 45 6.462 -9.666 -2.254 1.00 0.00 C ATOM 635 CE2 PHE A 45 6.946 -9.059 0.042 1.00 0.00 C ATOM 636 CZ PHE A 45 6.947 -10.017 -0.986 1.00 0.00 C ATOM 0 H PHE A 45 7.128 -5.854 -3.910 1.00 0.00 H new ATOM 0 HA PHE A 45 4.342 -6.170 -3.309 1.00 0.00 H new ATOM 0 HB2 PHE A 45 6.706 -5.335 -1.637 1.00 0.00 H new ATOM 0 HB3 PHE A 45 5.083 -5.565 -1.018 1.00 0.00 H new ATOM 0 HD1 PHE A 45 5.630 -8.110 -3.490 1.00 0.00 H new ATOM 0 HD2 PHE A 45 6.536 -7.009 0.569 1.00 0.00 H new ATOM 0 HE1 PHE A 45 6.425 -10.409 -3.037 1.00 0.00 H new ATOM 0 HE2 PHE A 45 7.267 -9.333 1.036 1.00 0.00 H new ATOM 0 HZ PHE A 45 7.318 -11.014 -0.801 1.00 0.00 H new ATOM 646 N LEU A 46 3.463 -3.852 -3.211 1.00 0.00 N ATOM 647 CA LEU A 46 2.843 -2.537 -3.117 1.00 0.00 C ATOM 648 C LEU A 46 2.795 -2.153 -1.639 1.00 0.00 C ATOM 649 O LEU A 46 2.494 -3.002 -0.791 1.00 0.00 O ATOM 650 CB LEU A 46 1.401 -2.624 -3.634 1.00 0.00 C ATOM 651 CG LEU A 46 1.260 -3.004 -5.121 1.00 0.00 C ATOM 652 CD1 LEU A 46 -0.078 -3.714 -5.298 1.00 0.00 C ATOM 653 CD2 LEU A 46 1.291 -1.780 -6.043 1.00 0.00 C ATOM 0 H LEU A 46 2.785 -4.609 -3.300 1.00 0.00 H new ATOM 0 HA LEU A 46 3.405 -1.808 -3.700 1.00 0.00 H new ATOM 0 HB2 LEU A 46 0.861 -3.357 -3.035 1.00 0.00 H new ATOM 0 HB3 LEU A 46 0.916 -1.661 -3.474 1.00 0.00 H new ATOM 0 HG LEU A 46 2.102 -3.641 -5.393 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -0.205 -3.995 -6.343 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -0.100 -4.609 -4.676 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -0.886 -3.046 -5.001 1.00 0.00 H new ATOM 0 HD21 LEU A 46 1.188 -2.102 -7.079 1.00 0.00 H new ATOM 0 HD22 LEU A 46 0.469 -1.111 -5.788 1.00 0.00 H new ATOM 0 HD23 LEU A 46 2.238 -1.255 -5.919 1.00 0.00 H new ATOM 665 N GLN A 47 3.006 -0.879 -1.317 1.00 0.00 N ATOM 666 CA GLN A 47 2.918 -0.364 0.044 1.00 0.00 C ATOM 667 C GLN A 47 2.302 1.035 0.058 1.00 0.00 C ATOM 668 O GLN A 47 2.248 1.718 -0.969 1.00 0.00 O ATOM 669 CB GLN A 47 4.305 -0.276 0.664 1.00 0.00 C ATOM 670 CG GLN A 47 5.170 -1.532 0.642 1.00 0.00 C ATOM 671 CD GLN A 47 6.499 -1.196 1.308 1.00 0.00 C ATOM 672 OE1 GLN A 47 7.341 -0.556 0.689 1.00 0.00 O ATOM 673 NE2 GLN A 47 6.693 -1.493 2.579 1.00 0.00 N ATOM 0 H GLN A 47 3.246 -0.166 -2.006 1.00 0.00 H new ATOM 0 HA GLN A 47 2.290 -1.048 0.615 1.00 0.00 H new ATOM 0 HB2 GLN A 47 4.851 0.517 0.153 1.00 0.00 H new ATOM 0 HB3 GLN A 47 4.190 0.034 1.703 1.00 0.00 H new ATOM 0 HG2 GLN A 47 4.674 -2.347 1.170 1.00 0.00 H new ATOM 0 HG3 GLN A 47 5.330 -1.867 -0.383 1.00 0.00 H new ATOM 0 HE21 GLN A 47 5.990 -2.026 3.091 1.00 0.00 H new ATOM 0 HE22 GLN A 47 7.546 -1.190 3.049 1.00 0.00 H new ATOM 682 N VAL A 48 1.830 1.478 1.226 1.00 0.00 N ATOM 683 CA VAL A 48 1.312 2.827 1.394 1.00 0.00 C ATOM 684 C VAL A 48 2.484 3.801 1.211 1.00 0.00 C ATOM 685 O VAL A 48 3.421 3.782 2.008 1.00 0.00 O ATOM 686 CB VAL A 48 0.668 2.927 2.792 1.00 0.00 C ATOM 687 CG1 VAL A 48 0.264 4.367 3.122 1.00 0.00 C ATOM 688 CG2 VAL A 48 -0.568 2.017 2.898 1.00 0.00 C ATOM 0 H VAL A 48 1.799 0.911 2.074 1.00 0.00 H new ATOM 0 HA VAL A 48 0.545 3.076 0.660 1.00 0.00 H new ATOM 0 HB VAL A 48 1.419 2.599 3.511 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -0.186 4.400 4.114 1.00 0.00 H new ATOM 0 HG12 VAL A 48 1.147 5.006 3.103 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -0.456 4.721 2.385 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -1.002 2.107 3.894 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -1.305 2.316 2.153 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -0.274 0.982 2.723 1.00 0.00 H new ATOM 698 N LYS A 49 2.467 4.634 0.165 1.00 0.00 N ATOM 699 CA LYS A 49 3.494 5.649 -0.049 1.00 0.00 C ATOM 700 C LYS A 49 3.463 6.645 1.100 1.00 0.00 C ATOM 701 O LYS A 49 4.515 6.940 1.660 1.00 0.00 O ATOM 702 CB LYS A 49 3.303 6.372 -1.390 1.00 0.00 C ATOM 703 CG LYS A 49 4.491 7.305 -1.666 1.00 0.00 C ATOM 704 CD LYS A 49 4.306 8.166 -2.917 1.00 0.00 C ATOM 705 CE LYS A 49 4.399 7.326 -4.191 1.00 0.00 C ATOM 706 NZ LYS A 49 4.242 8.144 -5.407 1.00 0.00 N ATOM 0 H LYS A 49 1.742 4.621 -0.552 1.00 0.00 H new ATOM 0 HA LYS A 49 4.466 5.156 -0.082 1.00 0.00 H new ATOM 0 HB2 LYS A 49 3.210 5.642 -2.194 1.00 0.00 H new ATOM 0 HB3 LYS A 49 2.377 6.947 -1.373 1.00 0.00 H new ATOM 0 HG2 LYS A 49 4.641 7.956 -0.804 1.00 0.00 H new ATOM 0 HG3 LYS A 49 5.396 6.707 -1.775 1.00 0.00 H new ATOM 0 HD2 LYS A 49 3.337 8.664 -2.878 1.00 0.00 H new ATOM 0 HD3 LYS A 49 5.066 8.947 -2.938 1.00 0.00 H new ATOM 0 HE2 LYS A 49 5.362 6.816 -4.219 1.00 0.00 H new ATOM 0 HE3 LYS A 49 3.630 6.554 -4.172 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 4.312 7.535 -6.247 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 3.313 8.610 -5.394 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 4.991 8.865 -5.439 1.00 0.00 H new ATOM 720 N SER A 50 2.276 7.162 1.416 1.00 0.00 N ATOM 721 CA SER A 50 2.073 8.100 2.506 1.00 0.00 C ATOM 722 C SER A 50 0.598 8.171 2.866 1.00 0.00 C ATOM 723 O SER A 50 -0.253 7.973 2.000 1.00 0.00 O ATOM 724 CB SER A 50 2.599 9.487 2.117 1.00 0.00 C ATOM 725 OG SER A 50 2.542 9.779 0.726 1.00 0.00 O ATOM 0 H SER A 50 1.420 6.934 0.911 1.00 0.00 H new ATOM 0 HA SER A 50 2.627 7.753 3.378 1.00 0.00 H new ATOM 0 HB2 SER A 50 2.026 10.241 2.656 1.00 0.00 H new ATOM 0 HB3 SER A 50 3.633 9.574 2.450 1.00 0.00 H new ATOM 0 HG SER A 50 1.677 9.491 0.366 1.00 0.00 H new ATOM 731 N VAL A 51 0.303 8.532 4.107 1.00 0.00 N ATOM 732 CA VAL A 51 -1.024 8.900 4.575 1.00 0.00 C ATOM 733 C VAL A 51 -1.025 10.428 4.698 1.00 0.00 C ATOM 734 O VAL A 51 -0.174 10.983 5.399 1.00 0.00 O ATOM 735 CB VAL A 51 -1.298 8.187 5.913 1.00 0.00 C ATOM 736 CG1 VAL A 51 -2.710 8.503 6.412 1.00 0.00 C ATOM 737 CG2 VAL A 51 -1.183 6.662 5.792 1.00 0.00 C ATOM 0 H VAL A 51 1.008 8.578 4.842 1.00 0.00 H new ATOM 0 HA VAL A 51 -1.820 8.595 3.895 1.00 0.00 H new ATOM 0 HB VAL A 51 -0.545 8.552 6.611 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -2.885 7.990 7.358 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -2.812 9.578 6.558 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -3.440 8.165 5.676 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -1.385 6.204 6.760 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -1.906 6.299 5.061 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -0.176 6.398 5.468 1.00 0.00 H new ATOM 747 N ILE A 52 -1.923 11.111 3.988 1.00 0.00 N ATOM 748 CA ILE A 52 -2.089 12.550 4.086 1.00 0.00 C ATOM 749 C ILE A 52 -2.714 12.830 5.461 1.00 0.00 C ATOM 750 O ILE A 52 -3.767 12.270 5.777 1.00 0.00 O ATOM 751 CB ILE A 52 -2.988 13.103 2.956 1.00 0.00 C ATOM 752 CG1 ILE A 52 -2.354 13.069 1.546 1.00 0.00 C ATOM 753 CG2 ILE A 52 -3.318 14.577 3.267 1.00 0.00 C ATOM 754 CD1 ILE A 52 -1.862 11.715 1.030 1.00 0.00 C ATOM 0 H ILE A 52 -2.559 10.671 3.324 1.00 0.00 H new ATOM 0 HA ILE A 52 -1.125 13.048 3.979 1.00 0.00 H new ATOM 0 HB ILE A 52 -3.864 12.454 2.933 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -3.087 13.454 0.837 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -1.511 13.759 1.539 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -3.952 14.982 2.478 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -3.841 14.639 4.221 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -2.394 15.153 3.321 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -1.442 11.837 0.032 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -1.096 11.326 1.701 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -2.697 11.016 0.989 1.00 0.00 H new ATOM 766 N PRO A 53 -2.145 13.746 6.255 1.00 0.00 N ATOM 767 CA PRO A 53 -2.635 14.082 7.582 1.00 0.00 C ATOM 768 C PRO A 53 -3.737 15.148 7.551 1.00 0.00 C ATOM 769 O PRO A 53 -3.689 16.166 8.246 1.00 0.00 O ATOM 770 CB PRO A 53 -1.370 14.543 8.264 1.00 0.00 C ATOM 771 CG PRO A 53 -0.627 15.337 7.198 1.00 0.00 C ATOM 772 CD PRO A 53 -0.916 14.479 5.969 1.00 0.00 C ATOM 0 HA PRO A 53 -3.125 13.256 8.098 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -1.591 15.159 9.135 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -0.777 13.698 8.614 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -1.009 16.353 7.095 1.00 0.00 H new ATOM 0 HG3 PRO A 53 0.440 15.417 7.407 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -1.033 15.100 5.081 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -0.092 13.793 5.772 1.00 0.00 H new ATOM 780 N ASP A 54 -4.710 14.937 6.682 1.00 0.00 N ATOM 781 CA ASP A 54 -5.860 15.804 6.420 1.00 0.00 C ATOM 782 C ASP A 54 -6.881 14.993 5.620 1.00 0.00 C ATOM 783 O ASP A 54 -7.215 15.317 4.478 1.00 0.00 O ATOM 784 CB ASP A 54 -5.424 17.085 5.670 1.00 0.00 C ATOM 785 CG ASP A 54 -6.584 18.057 5.429 1.00 0.00 C ATOM 786 OD1 ASP A 54 -7.350 18.332 6.379 1.00 0.00 O ATOM 787 OD2 ASP A 54 -6.725 18.586 4.296 1.00 0.00 O ATOM 0 H ASP A 54 -4.724 14.101 6.098 1.00 0.00 H new ATOM 0 HA ASP A 54 -6.311 16.136 7.355 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -4.647 17.590 6.244 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -4.984 16.808 4.712 1.00 0.00 H new ATOM 792 N GLY A 55 -7.328 13.865 6.175 1.00 0.00 N ATOM 793 CA GLY A 55 -8.153 12.931 5.427 1.00 0.00 C ATOM 794 C GLY A 55 -8.710 11.812 6.299 1.00 0.00 C ATOM 795 O GLY A 55 -8.251 11.619 7.425 1.00 0.00 O ATOM 0 H GLY A 55 -7.131 13.582 7.135 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -8.979 13.471 4.964 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -7.563 12.498 4.619 1.00 0.00 H new ATOM 799 N PRO A 56 -9.630 10.988 5.768 1.00 0.00 N ATOM 800 CA PRO A 56 -10.240 9.905 6.529 1.00 0.00 C ATOM 801 C PRO A 56 -9.225 8.824 6.911 1.00 0.00 C ATOM 802 O PRO A 56 -9.425 8.138 7.901 1.00 0.00 O ATOM 803 CB PRO A 56 -11.357 9.351 5.636 1.00 0.00 C ATOM 804 CG PRO A 56 -10.910 9.717 4.220 1.00 0.00 C ATOM 805 CD PRO A 56 -10.181 11.047 4.423 1.00 0.00 C ATOM 0 HA PRO A 56 -10.633 10.265 7.480 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -11.466 8.273 5.755 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -12.321 9.797 5.879 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -10.254 8.958 3.795 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -11.758 9.821 3.543 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -9.393 11.179 3.682 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -10.864 11.889 4.316 1.00 0.00 H new ATOM 813 N ALA A 57 -8.131 8.668 6.159 1.00 0.00 N ATOM 814 CA ALA A 57 -7.101 7.680 6.466 1.00 0.00 C ATOM 815 C ALA A 57 -6.327 8.060 7.736 1.00 0.00 C ATOM 816 O ALA A 57 -5.893 7.176 8.472 1.00 0.00 O ATOM 817 CB ALA A 57 -6.165 7.548 5.260 1.00 0.00 C ATOM 0 H ALA A 57 -7.938 9.222 5.325 1.00 0.00 H new ATOM 0 HA ALA A 57 -7.572 6.717 6.661 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -5.391 6.812 5.479 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -6.736 7.226 4.389 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -5.700 8.512 5.053 1.00 0.00 H new ATOM 823 N ALA A 58 -6.170 9.363 7.990 1.00 0.00 N ATOM 824 CA ALA A 58 -5.616 9.894 9.225 1.00 0.00 C ATOM 825 C ALA A 58 -6.578 9.571 10.376 1.00 0.00 C ATOM 826 O ALA A 58 -6.219 8.895 11.339 1.00 0.00 O ATOM 827 CB ALA A 58 -5.388 11.404 9.050 1.00 0.00 C ATOM 0 H ALA A 58 -6.433 10.089 7.323 1.00 0.00 H new ATOM 0 HA ALA A 58 -4.655 9.439 9.463 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -4.972 11.818 9.969 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -4.693 11.574 8.228 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -6.337 11.892 8.829 1.00 0.00 H new ATOM 833 N GLN A 59 -7.833 10.004 10.235 1.00 0.00 N ATOM 834 CA GLN A 59 -8.827 9.928 11.303 1.00 0.00 C ATOM 835 C GLN A 59 -9.214 8.483 11.646 1.00 0.00 C ATOM 836 O GLN A 59 -9.618 8.205 12.778 1.00 0.00 O ATOM 837 CB GLN A 59 -10.072 10.720 10.884 1.00 0.00 C ATOM 838 CG GLN A 59 -9.767 12.211 10.663 1.00 0.00 C ATOM 839 CD GLN A 59 -10.970 13.050 10.237 1.00 0.00 C ATOM 840 OE1 GLN A 59 -10.905 14.274 10.264 1.00 0.00 O ATOM 841 NE2 GLN A 59 -12.079 12.470 9.803 1.00 0.00 N ATOM 0 H GLN A 59 -8.188 10.418 9.373 1.00 0.00 H new ATOM 0 HA GLN A 59 -8.385 10.358 12.202 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -10.479 10.295 9.967 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -10.840 10.618 11.651 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -9.360 12.626 11.585 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -8.991 12.301 9.903 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -12.145 11.453 9.776 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -12.867 13.041 9.496 1.00 0.00 H new ATOM 850 N ASP A 60 -9.148 7.564 10.678 1.00 0.00 N ATOM 851 CA ASP A 60 -9.469 6.153 10.897 1.00 0.00 C ATOM 852 C ASP A 60 -8.449 5.499 11.833 1.00 0.00 C ATOM 853 O ASP A 60 -8.776 4.539 12.530 1.00 0.00 O ATOM 854 CB ASP A 60 -9.522 5.408 9.558 1.00 0.00 C ATOM 855 CG ASP A 60 -10.009 3.975 9.741 1.00 0.00 C ATOM 856 OD1 ASP A 60 -11.241 3.759 9.683 1.00 0.00 O ATOM 857 OD2 ASP A 60 -9.187 3.046 9.908 1.00 0.00 O ATOM 0 H ASP A 60 -8.870 7.779 9.720 1.00 0.00 H new ATOM 0 HA ASP A 60 -10.449 6.094 11.371 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -10.185 5.935 8.872 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -8.532 5.403 9.103 1.00 0.00 H new ATOM 862 N GLY A 61 -7.219 6.024 11.866 1.00 0.00 N ATOM 863 CA GLY A 61 -6.172 5.694 12.829 1.00 0.00 C ATOM 864 C GLY A 61 -5.470 4.372 12.533 1.00 0.00 C ATOM 865 O GLY A 61 -4.397 4.100 13.074 1.00 0.00 O ATOM 0 H GLY A 61 -6.916 6.723 11.188 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -5.433 6.495 12.839 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -6.608 5.650 13.827 1.00 0.00 H new ATOM 869 N LYS A 62 -6.042 3.534 11.666 1.00 0.00 N ATOM 870 CA LYS A 62 -5.461 2.234 11.337 1.00 0.00 C ATOM 871 C LYS A 62 -4.393 2.360 10.260 1.00 0.00 C ATOM 872 O LYS A 62 -3.519 1.489 10.180 1.00 0.00 O ATOM 873 CB LYS A 62 -6.562 1.275 10.870 1.00 0.00 C ATOM 874 CG LYS A 62 -7.619 1.092 11.956 1.00 0.00 C ATOM 875 CD LYS A 62 -8.724 0.129 11.562 1.00 0.00 C ATOM 876 CE LYS A 62 -9.935 0.478 12.425 1.00 0.00 C ATOM 877 NZ LYS A 62 -10.728 1.569 11.815 1.00 0.00 N ATOM 0 H LYS A 62 -6.914 3.736 11.177 1.00 0.00 H new ATOM 0 HA LYS A 62 -4.988 1.838 12.236 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -7.028 1.663 9.964 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -6.125 0.309 10.615 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -7.138 0.730 12.864 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -8.058 2.061 12.193 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -8.962 0.225 10.503 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -8.415 -0.903 11.727 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -10.562 -0.405 12.551 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -9.603 0.778 13.419 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -10.850 2.337 12.505 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -10.231 1.933 10.977 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -11.661 1.205 11.534 1.00 0.00 H new ATOM 891 N MET A 63 -4.492 3.383 9.408 1.00 0.00 N ATOM 892 CA MET A 63 -3.637 3.542 8.251 1.00 0.00 C ATOM 893 C MET A 63 -2.397 4.329 8.622 1.00 0.00 C ATOM 894 O MET A 63 -2.511 5.421 9.173 1.00 0.00 O ATOM 895 CB MET A 63 -4.361 4.282 7.135 1.00 0.00 C ATOM 896 CG MET A 63 -3.700 3.922 5.802 1.00 0.00 C ATOM 897 SD MET A 63 -4.443 2.479 5.003 1.00 0.00 S ATOM 898 CE MET A 63 -5.965 3.287 4.478 1.00 0.00 C ATOM 0 H MET A 63 -5.180 4.129 9.512 1.00 0.00 H new ATOM 0 HA MET A 63 -3.361 2.546 7.905 1.00 0.00 H new ATOM 0 HB2 MET A 63 -5.416 4.007 7.121 1.00 0.00 H new ATOM 0 HB3 MET A 63 -4.314 5.358 7.302 1.00 0.00 H new ATOM 0 HG2 MET A 63 -3.767 4.776 5.129 1.00 0.00 H new ATOM 0 HG3 MET A 63 -2.640 3.731 5.970 1.00 0.00 H new ATOM 0 HE1 MET A 63 -6.300 2.855 3.535 1.00 0.00 H new ATOM 0 HE2 MET A 63 -6.734 3.142 5.237 1.00 0.00 H new ATOM 0 HE3 MET A 63 -5.783 4.353 4.344 1.00 0.00 H new ATOM 908 N GLU A 64 -1.237 3.820 8.248 1.00 0.00 N ATOM 909 CA GLU A 64 0.052 4.427 8.448 1.00 0.00 C ATOM 910 C GLU A 64 0.932 4.119 7.247 1.00 0.00 C ATOM 911 O GLU A 64 0.615 3.297 6.385 1.00 0.00 O ATOM 912 CB GLU A 64 0.649 3.909 9.761 1.00 0.00 C ATOM 913 CG GLU A 64 -0.063 4.582 10.944 1.00 0.00 C ATOM 914 CD GLU A 64 0.857 4.870 12.118 1.00 0.00 C ATOM 915 OE1 GLU A 64 1.889 5.549 11.920 1.00 0.00 O ATOM 916 OE2 GLU A 64 0.505 4.482 13.249 1.00 0.00 O ATOM 0 H GLU A 64 -1.174 2.921 7.770 1.00 0.00 H new ATOM 0 HA GLU A 64 -0.030 5.511 8.529 1.00 0.00 H new ATOM 0 HB2 GLU A 64 0.537 2.827 9.823 1.00 0.00 H new ATOM 0 HB3 GLU A 64 1.718 4.121 9.797 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -0.511 5.516 10.605 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -0.878 3.941 11.280 1.00 0.00 H new ATOM 923 N THR A 65 2.028 4.853 7.181 1.00 0.00 N ATOM 924 CA THR A 65 2.984 4.824 6.095 1.00 0.00 C ATOM 925 C THR A 65 4.005 3.720 6.419 1.00 0.00 C ATOM 926 O THR A 65 4.328 3.526 7.594 1.00 0.00 O ATOM 927 CB THR A 65 3.546 6.256 6.001 1.00 0.00 C ATOM 928 OG1 THR A 65 2.481 7.177 5.804 1.00 0.00 O ATOM 929 CG2 THR A 65 4.501 6.430 4.835 1.00 0.00 C ATOM 0 H THR A 65 2.285 5.513 7.915 1.00 0.00 H new ATOM 0 HA THR A 65 2.583 4.572 5.113 1.00 0.00 H new ATOM 0 HB THR A 65 4.080 6.440 6.933 1.00 0.00 H new ATOM 0 HG1 THR A 65 2.841 8.086 5.746 1.00 0.00 H new ATOM 0 HG21 THR A 65 4.867 7.456 4.815 1.00 0.00 H new ATOM 0 HG22 THR A 65 5.342 5.746 4.949 1.00 0.00 H new ATOM 0 HG23 THR A 65 3.980 6.212 3.903 1.00 0.00 H new ATOM 937 N GLY A 66 4.522 2.980 5.430 1.00 0.00 N ATOM 938 CA GLY A 66 5.396 1.839 5.694 1.00 0.00 C ATOM 939 C GLY A 66 4.613 0.566 6.003 1.00 0.00 C ATOM 940 O GLY A 66 5.165 -0.335 6.635 1.00 0.00 O ATOM 0 H GLY A 66 4.348 3.154 4.440 1.00 0.00 H new ATOM 0 HA2 GLY A 66 6.036 1.667 4.829 1.00 0.00 H new ATOM 0 HA3 GLY A 66 6.050 2.073 6.534 1.00 0.00 H new ATOM 944 N ASP A 67 3.344 0.470 5.591 1.00 0.00 N ATOM 945 CA ASP A 67 2.532 -0.741 5.725 1.00 0.00 C ATOM 946 C ASP A 67 2.208 -1.249 4.304 1.00 0.00 C ATOM 947 O ASP A 67 2.038 -0.459 3.372 1.00 0.00 O ATOM 948 CB ASP A 67 1.266 -0.457 6.550 1.00 0.00 C ATOM 949 CG ASP A 67 1.372 -0.548 8.084 1.00 0.00 C ATOM 950 OD1 ASP A 67 2.466 -0.426 8.685 1.00 0.00 O ATOM 951 OD2 ASP A 67 0.297 -0.702 8.725 1.00 0.00 O ATOM 0 H ASP A 67 2.847 1.243 5.149 1.00 0.00 H new ATOM 0 HA ASP A 67 3.076 -1.516 6.265 1.00 0.00 H new ATOM 0 HB2 ASP A 67 0.920 0.545 6.297 1.00 0.00 H new ATOM 0 HB3 ASP A 67 0.492 -1.153 6.226 1.00 0.00 H new ATOM 956 N VAL A 68 2.162 -2.570 4.115 1.00 0.00 N ATOM 957 CA VAL A 68 2.231 -3.266 2.822 1.00 0.00 C ATOM 958 C VAL A 68 0.824 -3.635 2.349 1.00 0.00 C ATOM 959 O VAL A 68 0.169 -4.407 3.038 1.00 0.00 O ATOM 960 CB VAL A 68 3.086 -4.541 3.017 1.00 0.00 C ATOM 961 CG1 VAL A 68 3.098 -5.493 1.816 1.00 0.00 C ATOM 962 CG2 VAL A 68 4.540 -4.208 3.352 1.00 0.00 C ATOM 0 H VAL A 68 2.071 -3.218 4.897 1.00 0.00 H new ATOM 0 HA VAL A 68 2.681 -2.623 2.066 1.00 0.00 H new ATOM 0 HB VAL A 68 2.596 -5.048 3.849 1.00 0.00 H new ATOM 0 HG11 VAL A 68 3.722 -6.357 2.043 1.00 0.00 H new ATOM 0 HG12 VAL A 68 2.081 -5.825 1.604 1.00 0.00 H new ATOM 0 HG13 VAL A 68 3.499 -4.975 0.945 1.00 0.00 H new ATOM 0 HG21 VAL A 68 5.104 -5.132 3.481 1.00 0.00 H new ATOM 0 HG22 VAL A 68 4.976 -3.626 2.540 1.00 0.00 H new ATOM 0 HG23 VAL A 68 4.577 -3.629 4.274 1.00 0.00 H new ATOM 972 N ILE A 69 0.361 -3.125 1.203 1.00 0.00 N ATOM 973 CA ILE A 69 -0.904 -3.486 0.562 1.00 0.00 C ATOM 974 C ILE A 69 -0.871 -4.967 0.206 1.00 0.00 C ATOM 975 O ILE A 69 -0.137 -5.376 -0.692 1.00 0.00 O ATOM 976 CB ILE A 69 -1.176 -2.581 -0.669 1.00 0.00 C ATOM 977 CG1 ILE A 69 -1.626 -1.170 -0.242 1.00 0.00 C ATOM 978 CG2 ILE A 69 -2.252 -3.144 -1.609 1.00 0.00 C ATOM 979 CD1 ILE A 69 -0.468 -0.222 -0.060 1.00 0.00 C ATOM 0 H ILE A 69 0.879 -2.421 0.677 1.00 0.00 H new ATOM 0 HA ILE A 69 -1.734 -3.320 1.249 1.00 0.00 H new ATOM 0 HB ILE A 69 -0.226 -2.541 -1.202 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -2.306 -0.767 -0.992 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -2.185 -1.238 0.691 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -2.394 -2.464 -2.449 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -1.936 -4.119 -1.981 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -3.191 -3.250 -1.065 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -0.843 0.756 0.241 1.00 0.00 H new ATOM 0 HD12 ILE A 69 0.200 -0.607 0.710 1.00 0.00 H new ATOM 0 HD13 ILE A 69 0.077 -0.129 -0.999 1.00 0.00 H new ATOM 991 N VAL A 70 -1.680 -5.765 0.895 1.00 0.00 N ATOM 992 CA VAL A 70 -1.837 -7.175 0.572 1.00 0.00 C ATOM 993 C VAL A 70 -3.066 -7.369 -0.314 1.00 0.00 C ATOM 994 O VAL A 70 -2.978 -7.892 -1.428 1.00 0.00 O ATOM 995 CB VAL A 70 -1.976 -8.018 1.849 1.00 0.00 C ATOM 996 CG1 VAL A 70 -1.716 -9.467 1.470 1.00 0.00 C ATOM 997 CG2 VAL A 70 -1.080 -7.593 3.015 1.00 0.00 C ATOM 0 H VAL A 70 -2.241 -5.453 1.688 1.00 0.00 H new ATOM 0 HA VAL A 70 -0.947 -7.507 0.037 1.00 0.00 H new ATOM 0 HB VAL A 70 -2.986 -7.867 2.229 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -1.807 -10.096 2.355 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -2.444 -9.784 0.723 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -0.711 -9.561 1.059 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -1.255 -8.251 3.867 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -0.035 -7.659 2.714 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -1.312 -6.566 3.296 1.00 0.00 H new ATOM 1007 N TYR A 71 -4.223 -6.977 0.218 1.00 0.00 N ATOM 1008 CA TYR A 71 -5.525 -7.200 -0.371 1.00 0.00 C ATOM 1009 C TYR A 71 -6.249 -5.859 -0.408 1.00 0.00 C ATOM 1010 O TYR A 71 -5.904 -4.928 0.338 1.00 0.00 O ATOM 1011 CB TYR A 71 -6.339 -8.232 0.432 1.00 0.00 C ATOM 1012 CG TYR A 71 -5.751 -9.627 0.614 1.00 0.00 C ATOM 1013 CD1 TYR A 71 -6.070 -10.657 -0.291 1.00 0.00 C ATOM 1014 CD2 TYR A 71 -4.998 -9.943 1.761 1.00 0.00 C ATOM 1015 CE1 TYR A 71 -5.599 -11.965 -0.082 1.00 0.00 C ATOM 1016 CE2 TYR A 71 -4.545 -11.251 1.998 1.00 0.00 C ATOM 1017 CZ TYR A 71 -4.829 -12.268 1.062 1.00 0.00 C ATOM 1018 OH TYR A 71 -4.391 -13.538 1.267 1.00 0.00 O ATOM 0 H TYR A 71 -4.271 -6.477 1.106 1.00 0.00 H new ATOM 0 HA TYR A 71 -5.410 -7.605 -1.377 1.00 0.00 H new ATOM 0 HB2 TYR A 71 -6.521 -7.815 1.423 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -7.310 -8.340 -0.052 1.00 0.00 H new ATOM 0 HD1 TYR A 71 -6.682 -10.440 -1.154 1.00 0.00 H new ATOM 0 HD2 TYR A 71 -4.764 -9.165 2.472 1.00 0.00 H new ATOM 0 HE1 TYR A 71 -5.827 -12.740 -0.799 1.00 0.00 H new ATOM 0 HE2 TYR A 71 -3.982 -11.477 2.892 1.00 0.00 H new ATOM 0 HH TYR A 71 -3.875 -13.576 2.099 1.00 0.00 H new ATOM 1028 N ILE A 72 -7.241 -5.765 -1.289 1.00 0.00 N ATOM 1029 CA ILE A 72 -8.122 -4.621 -1.438 1.00 0.00 C ATOM 1030 C ILE A 72 -9.502 -5.199 -1.708 1.00 0.00 C ATOM 1031 O ILE A 72 -9.690 -5.882 -2.715 1.00 0.00 O ATOM 1032 CB ILE A 72 -7.665 -3.699 -2.598 1.00 0.00 C ATOM 1033 CG1 ILE A 72 -6.259 -3.126 -2.306 1.00 0.00 C ATOM 1034 CG2 ILE A 72 -8.716 -2.593 -2.843 1.00 0.00 C ATOM 1035 CD1 ILE A 72 -5.703 -2.173 -3.363 1.00 0.00 C ATOM 0 H ILE A 72 -7.458 -6.517 -1.943 1.00 0.00 H new ATOM 0 HA ILE A 72 -8.115 -3.998 -0.544 1.00 0.00 H new ATOM 0 HB ILE A 72 -7.588 -4.280 -3.517 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -6.291 -2.602 -1.351 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -5.564 -3.958 -2.190 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -8.385 -1.951 -3.660 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -9.671 -3.050 -3.104 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -8.835 -1.997 -1.938 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -4.714 -1.830 -3.060 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -5.630 -2.692 -4.319 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -6.368 -1.316 -3.466 1.00 0.00 H new ATOM 1047 N ASN A 73 -10.470 -4.841 -0.868 1.00 0.00 N ATOM 1048 CA ASN A 73 -11.901 -5.059 -1.023 1.00 0.00 C ATOM 1049 C ASN A 73 -12.219 -6.548 -0.999 1.00 0.00 C ATOM 1050 O ASN A 73 -12.546 -7.085 0.057 1.00 0.00 O ATOM 1051 CB ASN A 73 -12.387 -4.312 -2.271 1.00 0.00 C ATOM 1052 CG ASN A 73 -13.883 -4.068 -2.242 1.00 0.00 C ATOM 1053 OD1 ASN A 73 -14.407 -3.406 -1.349 1.00 0.00 O ATOM 1054 ND2 ASN A 73 -14.579 -4.525 -3.259 1.00 0.00 N ATOM 0 H ASN A 73 -10.256 -4.355 0.003 1.00 0.00 H new ATOM 0 HA ASN A 73 -12.457 -4.644 -0.182 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -11.866 -3.358 -2.348 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -12.131 -4.888 -3.160 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -15.579 -4.333 -3.320 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -14.119 -5.072 -3.987 1.00 0.00 H new ATOM 1061 N GLU A 74 -12.043 -7.221 -2.132 1.00 0.00 N ATOM 1062 CA GLU A 74 -12.180 -8.668 -2.262 1.00 0.00 C ATOM 1063 C GLU A 74 -11.155 -9.221 -3.278 1.00 0.00 C ATOM 1064 O GLU A 74 -11.469 -10.122 -4.050 1.00 0.00 O ATOM 1065 CB GLU A 74 -13.652 -9.012 -2.586 1.00 0.00 C ATOM 1066 CG GLU A 74 -14.171 -10.245 -1.829 1.00 0.00 C ATOM 1067 CD GLU A 74 -14.522 -9.936 -0.367 1.00 0.00 C ATOM 1068 OE1 GLU A 74 -15.379 -9.055 -0.117 1.00 0.00 O ATOM 1069 OE2 GLU A 74 -13.957 -10.604 0.539 1.00 0.00 O ATOM 0 H GLU A 74 -11.794 -6.763 -3.009 1.00 0.00 H new ATOM 0 HA GLU A 74 -11.944 -9.165 -1.321 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -14.280 -8.155 -2.343 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -13.750 -9.185 -3.658 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -15.054 -10.633 -2.337 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -13.415 -11.030 -1.859 1.00 0.00 H new ATOM 1076 N VAL A 75 -9.933 -8.671 -3.337 1.00 0.00 N ATOM 1077 CA VAL A 75 -8.915 -9.003 -4.345 1.00 0.00 C ATOM 1078 C VAL A 75 -7.549 -9.152 -3.661 1.00 0.00 C ATOM 1079 O VAL A 75 -7.165 -8.282 -2.879 1.00 0.00 O ATOM 1080 CB VAL A 75 -8.862 -7.899 -5.432 1.00 0.00 C ATOM 1081 CG1 VAL A 75 -7.904 -8.276 -6.576 1.00 0.00 C ATOM 1082 CG2 VAL A 75 -10.231 -7.594 -6.064 1.00 0.00 C ATOM 0 H VAL A 75 -9.618 -7.967 -2.670 1.00 0.00 H new ATOM 0 HA VAL A 75 -9.175 -9.946 -4.827 1.00 0.00 H new ATOM 0 HB VAL A 75 -8.510 -7.013 -4.903 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -7.893 -7.479 -7.319 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -6.899 -8.415 -6.178 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -8.241 -9.202 -7.042 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -10.119 -6.813 -6.816 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -10.624 -8.496 -6.534 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -10.922 -7.257 -5.291 1.00 0.00 H new ATOM 1092 N CYS A 76 -6.800 -10.223 -3.960 1.00 0.00 N ATOM 1093 CA CYS A 76 -5.377 -10.336 -3.637 1.00 0.00 C ATOM 1094 C CYS A 76 -4.563 -9.522 -4.642 1.00 0.00 C ATOM 1095 O CYS A 76 -4.473 -9.904 -5.812 1.00 0.00 O ATOM 1096 CB CYS A 76 -4.930 -11.808 -3.616 1.00 0.00 C ATOM 1097 SG CYS A 76 -5.513 -12.773 -5.038 1.00 0.00 S ATOM 0 H CYS A 76 -7.173 -11.043 -4.439 1.00 0.00 H new ATOM 0 HA CYS A 76 -5.205 -9.935 -2.638 1.00 0.00 H new ATOM 0 HB2 CYS A 76 -3.841 -11.847 -3.585 1.00 0.00 H new ATOM 0 HB3 CYS A 76 -5.292 -12.274 -2.700 1.00 0.00 H new ATOM 0 HG CYS A 76 -5.404 -12.061 -6.120 1.00 0.00 H new ATOM 1103 N VAL A 77 -3.968 -8.410 -4.202 1.00 0.00 N ATOM 1104 CA VAL A 77 -3.293 -7.471 -5.097 1.00 0.00 C ATOM 1105 C VAL A 77 -1.775 -7.399 -4.882 1.00 0.00 C ATOM 1106 O VAL A 77 -1.121 -6.661 -5.610 1.00 0.00 O ATOM 1107 CB VAL A 77 -3.923 -6.069 -5.001 1.00 0.00 C ATOM 1108 CG1 VAL A 77 -5.394 -6.043 -5.436 1.00 0.00 C ATOM 1109 CG2 VAL A 77 -3.796 -5.477 -3.595 1.00 0.00 C ATOM 0 H VAL A 77 -3.941 -8.138 -3.219 1.00 0.00 H new ATOM 0 HA VAL A 77 -3.439 -7.861 -6.104 1.00 0.00 H new ATOM 0 HB VAL A 77 -3.355 -5.452 -5.698 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -5.782 -5.028 -5.346 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -5.473 -6.371 -6.472 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -5.974 -6.711 -4.799 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -4.254 -4.488 -3.574 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -4.301 -6.126 -2.880 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -2.742 -5.395 -3.329 1.00 0.00 H new ATOM 1119 N LEU A 78 -1.204 -8.103 -3.898 1.00 0.00 N ATOM 1120 CA LEU A 78 0.159 -7.862 -3.409 1.00 0.00 C ATOM 1121 C LEU A 78 1.238 -7.887 -4.500 1.00 0.00 C ATOM 1122 O LEU A 78 2.233 -7.184 -4.373 1.00 0.00 O ATOM 1123 CB LEU A 78 0.458 -8.799 -2.220 1.00 0.00 C ATOM 1124 CG LEU A 78 1.199 -10.126 -2.503 1.00 0.00 C ATOM 1125 CD1 LEU A 78 2.708 -9.919 -2.716 1.00 0.00 C ATOM 1126 CD2 LEU A 78 1.004 -11.075 -1.309 1.00 0.00 C ATOM 0 H LEU A 78 -1.680 -8.864 -3.414 1.00 0.00 H new ATOM 0 HA LEU A 78 0.200 -6.833 -3.052 1.00 0.00 H new ATOM 0 HB2 LEU A 78 1.046 -8.238 -1.494 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -0.491 -9.043 -1.742 1.00 0.00 H new ATOM 0 HG LEU A 78 0.781 -10.545 -3.418 1.00 0.00 H new ATOM 0 HD11 LEU A 78 3.183 -10.880 -2.911 1.00 0.00 H new ATOM 0 HD12 LEU A 78 2.868 -9.256 -3.566 1.00 0.00 H new ATOM 0 HD13 LEU A 78 3.144 -9.474 -1.822 1.00 0.00 H new ATOM 0 HD21 LEU A 78 1.524 -12.013 -1.501 1.00 0.00 H new ATOM 0 HD22 LEU A 78 1.409 -10.614 -0.408 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -0.059 -11.271 -1.170 1.00 0.00 H new ATOM 1138 N GLY A 79 1.056 -8.683 -5.557 1.00 0.00 N ATOM 1139 CA GLY A 79 1.927 -8.751 -6.728 1.00 0.00 C ATOM 1140 C GLY A 79 1.141 -8.484 -8.012 1.00 0.00 C ATOM 1141 O GLY A 79 1.436 -9.061 -9.061 1.00 0.00 O ATOM 0 H GLY A 79 0.264 -9.323 -5.620 1.00 0.00 H new ATOM 0 HA2 GLY A 79 2.731 -8.021 -6.631 1.00 0.00 H new ATOM 0 HA3 GLY A 79 2.394 -9.734 -6.781 1.00 0.00 H new ATOM 1145 N HIS A 80 0.067 -7.702 -7.915 1.00 0.00 N ATOM 1146 CA HIS A 80 -0.610 -7.067 -9.038 1.00 0.00 C ATOM 1147 C HIS A 80 0.162 -5.790 -9.372 1.00 0.00 C ATOM 1148 O HIS A 80 1.069 -5.406 -8.630 1.00 0.00 O ATOM 1149 CB HIS A 80 -2.059 -6.758 -8.629 1.00 0.00 C ATOM 1150 CG HIS A 80 -3.125 -7.102 -9.631 1.00 0.00 C ATOM 1151 ND1 HIS A 80 -4.266 -6.369 -9.868 1.00 0.00 N ATOM 1152 CD2 HIS A 80 -3.267 -8.307 -10.266 1.00 0.00 C ATOM 1153 CE1 HIS A 80 -5.084 -7.121 -10.618 1.00 0.00 C ATOM 1154 NE2 HIS A 80 -4.506 -8.298 -10.913 1.00 0.00 N ATOM 0 H HIS A 80 -0.369 -7.487 -7.018 1.00 0.00 H new ATOM 0 HA HIS A 80 -0.639 -7.711 -9.917 1.00 0.00 H new ATOM 0 HB2 HIS A 80 -2.274 -7.293 -7.704 1.00 0.00 H new ATOM 0 HB3 HIS A 80 -2.131 -5.694 -8.406 1.00 0.00 H new ATOM 0 HD2 HIS A 80 -2.552 -9.117 -10.267 1.00 0.00 H new ATOM 0 HE1 HIS A 80 -6.071 -6.822 -10.940 1.00 0.00 H new ATOM 0 HE2 HIS A 80 -4.895 -9.040 -11.495 1.00 0.00 H new ATOM 1162 N THR A 81 -0.177 -5.117 -10.470 1.00 0.00 N ATOM 1163 CA THR A 81 0.603 -3.966 -10.898 1.00 0.00 C ATOM 1164 C THR A 81 0.030 -2.698 -10.256 1.00 0.00 C ATOM 1165 O THR A 81 -1.173 -2.613 -9.980 1.00 0.00 O ATOM 1166 CB THR A 81 0.634 -3.917 -12.436 1.00 0.00 C ATOM 1167 OG1 THR A 81 -0.610 -4.216 -13.047 1.00 0.00 O ATOM 1168 CG2 THR A 81 1.646 -4.930 -12.957 1.00 0.00 C ATOM 0 H THR A 81 -0.972 -5.346 -11.067 1.00 0.00 H new ATOM 0 HA THR A 81 1.638 -4.045 -10.565 1.00 0.00 H new ATOM 0 HB THR A 81 0.898 -2.891 -12.692 1.00 0.00 H new ATOM 0 HG1 THR A 81 -0.517 -4.164 -14.021 1.00 0.00 H new ATOM 0 HG21 THR A 81 1.668 -4.895 -14.046 1.00 0.00 H new ATOM 0 HG22 THR A 81 2.635 -4.690 -12.566 1.00 0.00 H new ATOM 0 HG23 THR A 81 1.360 -5.930 -12.632 1.00 0.00 H new ATOM 1176 N HIS A 82 0.881 -1.687 -10.075 1.00 0.00 N ATOM 1177 CA HIS A 82 0.506 -0.337 -9.673 1.00 0.00 C ATOM 1178 C HIS A 82 -0.537 0.215 -10.635 1.00 0.00 C ATOM 1179 O HIS A 82 -1.470 0.873 -10.200 1.00 0.00 O ATOM 1180 CB HIS A 82 1.774 0.529 -9.649 1.00 0.00 C ATOM 1181 CG HIS A 82 1.585 1.907 -9.068 1.00 0.00 C ATOM 1182 ND1 HIS A 82 1.744 3.104 -9.727 1.00 0.00 N ATOM 1183 CD2 HIS A 82 1.226 2.190 -7.780 1.00 0.00 C ATOM 1184 CE1 HIS A 82 1.482 4.084 -8.848 1.00 0.00 C ATOM 1185 NE2 HIS A 82 1.197 3.583 -7.632 1.00 0.00 N ATOM 0 H HIS A 82 1.886 -1.793 -10.210 1.00 0.00 H new ATOM 0 HA HIS A 82 0.062 -0.337 -8.678 1.00 0.00 H new ATOM 0 HB2 HIS A 82 2.541 0.010 -9.075 1.00 0.00 H new ATOM 0 HB3 HIS A 82 2.150 0.627 -10.667 1.00 0.00 H new ATOM 0 HD2 HIS A 82 1.003 1.466 -7.010 1.00 0.00 H new ATOM 0 HE1 HIS A 82 1.498 5.137 -9.086 1.00 0.00 H new ATOM 0 HE2 HIS A 82 1.001 4.108 -6.780 1.00 0.00 H new ATOM 1193 N ALA A 83 -0.428 -0.107 -11.923 1.00 0.00 N ATOM 1194 CA ALA A 83 -1.402 0.245 -12.942 1.00 0.00 C ATOM 1195 C ALA A 83 -2.810 -0.156 -12.511 1.00 0.00 C ATOM 1196 O ALA A 83 -3.662 0.710 -12.297 1.00 0.00 O ATOM 1197 CB ALA A 83 -1.002 -0.408 -14.267 1.00 0.00 C ATOM 0 H ALA A 83 0.364 -0.634 -12.291 1.00 0.00 H new ATOM 0 HA ALA A 83 -1.413 1.326 -13.079 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -1.730 -0.147 -15.035 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -0.016 -0.052 -14.565 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -0.975 -1.491 -14.145 1.00 0.00 H new ATOM 1203 N ASP A 84 -3.053 -1.462 -12.358 1.00 0.00 N ATOM 1204 CA ASP A 84 -4.398 -1.937 -12.073 1.00 0.00 C ATOM 1205 C ASP A 84 -4.834 -1.518 -10.673 1.00 0.00 C ATOM 1206 O ASP A 84 -5.987 -1.183 -10.467 1.00 0.00 O ATOM 1207 CB ASP A 84 -4.514 -3.457 -12.220 1.00 0.00 C ATOM 1208 CG ASP A 84 -5.964 -3.834 -12.539 1.00 0.00 C ATOM 1209 OD1 ASP A 84 -6.543 -3.310 -13.517 1.00 0.00 O ATOM 1210 OD2 ASP A 84 -6.544 -4.707 -11.854 1.00 0.00 O ATOM 0 H ASP A 84 -2.345 -2.193 -12.426 1.00 0.00 H new ATOM 0 HA ASP A 84 -5.059 -1.478 -12.808 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -3.854 -3.807 -13.014 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -4.194 -3.947 -11.300 1.00 0.00 H new ATOM 1215 N VAL A 85 -3.935 -1.489 -9.691 1.00 0.00 N ATOM 1216 CA VAL A 85 -4.258 -1.101 -8.319 1.00 0.00 C ATOM 1217 C VAL A 85 -4.669 0.367 -8.241 1.00 0.00 C ATOM 1218 O VAL A 85 -5.635 0.693 -7.542 1.00 0.00 O ATOM 1219 CB VAL A 85 -3.083 -1.497 -7.400 1.00 0.00 C ATOM 1220 CG1 VAL A 85 -3.010 -0.754 -6.058 1.00 0.00 C ATOM 1221 CG2 VAL A 85 -3.249 -2.998 -7.131 1.00 0.00 C ATOM 0 H VAL A 85 -2.955 -1.736 -9.826 1.00 0.00 H new ATOM 0 HA VAL A 85 -5.134 -1.641 -7.960 1.00 0.00 H new ATOM 0 HB VAL A 85 -2.158 -1.229 -7.911 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -2.149 -1.109 -5.492 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -2.909 0.316 -6.240 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -3.920 -0.941 -5.488 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -2.444 -3.343 -6.482 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -4.208 -3.177 -6.645 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -3.213 -3.543 -8.074 1.00 0.00 H new ATOM 1231 N VAL A 86 -4.002 1.253 -8.974 1.00 0.00 N ATOM 1232 CA VAL A 86 -4.416 2.639 -9.098 1.00 0.00 C ATOM 1233 C VAL A 86 -5.774 2.696 -9.811 1.00 0.00 C ATOM 1234 O VAL A 86 -6.668 3.402 -9.337 1.00 0.00 O ATOM 1235 CB VAL A 86 -3.285 3.436 -9.781 1.00 0.00 C ATOM 1236 CG1 VAL A 86 -3.755 4.842 -10.175 1.00 0.00 C ATOM 1237 CG2 VAL A 86 -2.080 3.559 -8.817 1.00 0.00 C ATOM 0 H VAL A 86 -3.157 1.025 -9.499 1.00 0.00 H new ATOM 0 HA VAL A 86 -4.573 3.112 -8.129 1.00 0.00 H new ATOM 0 HB VAL A 86 -2.993 2.900 -10.684 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -2.936 5.379 -10.654 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -4.593 4.765 -10.868 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -4.071 5.383 -9.283 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -1.282 4.122 -9.302 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -2.391 4.077 -7.910 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -1.717 2.564 -8.560 1.00 0.00 H new ATOM 1247 N LYS A 87 -5.980 1.923 -10.887 1.00 0.00 N ATOM 1248 CA LYS A 87 -7.276 1.872 -11.576 1.00 0.00 C ATOM 1249 C LYS A 87 -8.373 1.416 -10.618 1.00 0.00 C ATOM 1250 O LYS A 87 -9.471 1.969 -10.621 1.00 0.00 O ATOM 1251 CB LYS A 87 -7.161 1.046 -12.879 1.00 0.00 C ATOM 1252 CG LYS A 87 -7.901 -0.298 -13.014 1.00 0.00 C ATOM 1253 CD LYS A 87 -9.421 -0.183 -13.220 1.00 0.00 C ATOM 1254 CE LYS A 87 -9.910 -1.228 -14.236 1.00 0.00 C ATOM 1255 NZ LYS A 87 -10.681 -2.329 -13.630 1.00 0.00 N ATOM 0 H LYS A 87 -5.264 1.324 -11.299 1.00 0.00 H new ATOM 0 HA LYS A 87 -7.574 2.871 -11.895 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -7.498 1.684 -13.696 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -6.102 0.849 -13.044 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -7.476 -0.847 -13.854 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -7.714 -0.890 -12.118 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -9.934 -0.325 -12.269 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -9.671 0.818 -13.571 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -10.528 -0.732 -14.984 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -9.049 -1.644 -14.759 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -10.978 -2.994 -14.372 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -10.088 -2.827 -12.936 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -11.522 -1.943 -13.154 1.00 0.00 H new ATOM 1269 N LEU A 88 -8.068 0.440 -9.769 1.00 0.00 N ATOM 1270 CA LEU A 88 -8.967 -0.135 -8.784 1.00 0.00 C ATOM 1271 C LEU A 88 -9.330 0.931 -7.749 1.00 0.00 C ATOM 1272 O LEU A 88 -10.502 1.021 -7.390 1.00 0.00 O ATOM 1273 CB LEU A 88 -8.319 -1.375 -8.133 1.00 0.00 C ATOM 1274 CG LEU A 88 -8.359 -2.660 -8.984 1.00 0.00 C ATOM 1275 CD1 LEU A 88 -7.324 -3.684 -8.493 1.00 0.00 C ATOM 1276 CD2 LEU A 88 -9.755 -3.288 -8.946 1.00 0.00 C ATOM 0 H LEU A 88 -7.143 0.011 -9.751 1.00 0.00 H new ATOM 0 HA LEU A 88 -9.887 -0.467 -9.266 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -7.279 -1.143 -7.903 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -8.819 -1.571 -7.185 1.00 0.00 H new ATOM 0 HG LEU A 88 -8.116 -2.382 -10.010 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -7.376 -4.579 -9.112 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -6.325 -3.253 -8.561 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -7.536 -3.947 -7.457 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -9.763 -4.194 -9.552 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -10.014 -3.538 -7.917 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -10.483 -2.580 -9.341 1.00 0.00 H new ATOM 1288 N PHE A 89 -8.383 1.763 -7.301 1.00 0.00 N ATOM 1289 CA PHE A 89 -8.668 2.813 -6.327 1.00 0.00 C ATOM 1290 C PHE A 89 -9.494 3.938 -6.953 1.00 0.00 C ATOM 1291 O PHE A 89 -10.403 4.455 -6.294 1.00 0.00 O ATOM 1292 CB PHE A 89 -7.380 3.375 -5.710 1.00 0.00 C ATOM 1293 CG PHE A 89 -6.727 2.546 -4.614 1.00 0.00 C ATOM 1294 CD1 PHE A 89 -7.423 2.272 -3.416 1.00 0.00 C ATOM 1295 CD2 PHE A 89 -5.400 2.095 -4.753 1.00 0.00 C ATOM 1296 CE1 PHE A 89 -6.774 1.665 -2.327 1.00 0.00 C ATOM 1297 CE2 PHE A 89 -4.758 1.460 -3.678 1.00 0.00 C ATOM 1298 CZ PHE A 89 -5.421 1.308 -2.448 1.00 0.00 C ATOM 0 H PHE A 89 -7.409 1.726 -7.602 1.00 0.00 H new ATOM 0 HA PHE A 89 -9.254 2.359 -5.528 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -6.653 3.514 -6.510 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -7.600 4.362 -5.304 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -8.468 2.532 -3.336 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -4.876 2.238 -5.687 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -7.309 1.475 -1.408 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -3.751 1.087 -3.797 1.00 0.00 H new ATOM 0 HZ PHE A 89 -4.889 0.916 -1.594 1.00 0.00 H new ATOM 1308 N GLN A 90 -9.218 4.321 -8.208 1.00 0.00 N ATOM 1309 CA GLN A 90 -10.049 5.279 -8.931 1.00 0.00 C ATOM 1310 C GLN A 90 -11.474 4.742 -9.082 1.00 0.00 C ATOM 1311 O GLN A 90 -12.419 5.518 -8.944 1.00 0.00 O ATOM 1312 CB GLN A 90 -9.463 5.625 -10.308 1.00 0.00 C ATOM 1313 CG GLN A 90 -8.330 6.664 -10.273 1.00 0.00 C ATOM 1314 CD GLN A 90 -7.927 7.125 -11.681 1.00 0.00 C ATOM 1315 OE1 GLN A 90 -8.660 6.984 -12.657 1.00 0.00 O ATOM 1316 NE2 GLN A 90 -6.729 7.650 -11.866 1.00 0.00 N ATOM 0 H GLN A 90 -8.420 3.976 -8.741 1.00 0.00 H new ATOM 0 HA GLN A 90 -10.072 6.197 -8.344 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -9.088 4.712 -10.770 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -10.263 5.999 -10.946 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -8.647 7.526 -9.686 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -7.463 6.237 -9.769 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -6.100 7.778 -11.073 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -6.433 7.927 -12.802 1.00 0.00 H new ATOM 1325 N SER A 91 -11.623 3.428 -9.294 1.00 0.00 N ATOM 1326 CA SER A 91 -12.890 2.721 -9.445 1.00 0.00 C ATOM 1327 C SER A 91 -13.807 2.843 -8.226 1.00 0.00 C ATOM 1328 O SER A 91 -14.967 2.450 -8.336 1.00 0.00 O ATOM 1329 CB SER A 91 -12.592 1.235 -9.701 1.00 0.00 C ATOM 1330 OG SER A 91 -13.635 0.532 -10.347 1.00 0.00 O ATOM 0 H SER A 91 -10.820 2.803 -9.368 1.00 0.00 H new ATOM 0 HA SER A 91 -13.418 3.180 -10.281 1.00 0.00 H new ATOM 0 HB2 SER A 91 -11.689 1.157 -10.306 1.00 0.00 H new ATOM 0 HB3 SER A 91 -12.380 0.750 -8.748 1.00 0.00 H new ATOM 0 HG SER A 91 -14.499 0.842 -10.004 1.00 0.00 H new ATOM 1336 N VAL A 92 -13.329 3.312 -7.071 1.00 0.00 N ATOM 1337 CA VAL A 92 -14.173 3.532 -5.904 1.00 0.00 C ATOM 1338 C VAL A 92 -14.739 4.948 -6.031 1.00 0.00 C ATOM 1339 O VAL A 92 -13.957 5.903 -5.924 1.00 0.00 O ATOM 1340 CB VAL A 92 -13.395 3.334 -4.592 1.00 0.00 C ATOM 1341 CG1 VAL A 92 -14.383 3.318 -3.414 1.00 0.00 C ATOM 1342 CG2 VAL A 92 -12.580 2.036 -4.629 1.00 0.00 C ATOM 0 H VAL A 92 -12.348 3.548 -6.923 1.00 0.00 H new ATOM 0 HA VAL A 92 -14.982 2.802 -5.869 1.00 0.00 H new ATOM 0 HB VAL A 92 -12.695 4.160 -4.466 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -13.836 3.178 -2.482 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -14.923 4.264 -3.379 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -15.092 2.500 -3.545 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -12.039 1.919 -3.690 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -13.251 1.189 -4.769 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -11.869 2.076 -5.454 1.00 0.00 H new ATOM 1352 N PRO A 93 -16.050 5.122 -6.281 1.00 0.00 N ATOM 1353 CA PRO A 93 -16.650 6.445 -6.329 1.00 0.00 C ATOM 1354 C PRO A 93 -16.444 7.209 -5.018 1.00 0.00 C ATOM 1355 O PRO A 93 -16.260 6.620 -3.947 1.00 0.00 O ATOM 1356 CB PRO A 93 -18.144 6.228 -6.593 1.00 0.00 C ATOM 1357 CG PRO A 93 -18.282 4.782 -7.056 1.00 0.00 C ATOM 1358 CD PRO A 93 -17.068 4.095 -6.441 1.00 0.00 C ATOM 0 HA PRO A 93 -16.185 7.047 -7.109 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -18.730 6.407 -5.691 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -18.510 6.918 -7.353 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -19.214 4.336 -6.709 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -18.278 4.706 -8.143 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -17.321 3.647 -5.480 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -16.710 3.291 -7.084 1.00 0.00 H new ATOM 1366 N ILE A 94 -16.577 8.533 -5.081 1.00 0.00 N ATOM 1367 CA ILE A 94 -16.857 9.335 -3.895 1.00 0.00 C ATOM 1368 C ILE A 94 -18.184 8.807 -3.333 1.00 0.00 C ATOM 1369 O ILE A 94 -19.111 8.499 -4.091 1.00 0.00 O ATOM 1370 CB ILE A 94 -16.860 10.835 -4.271 1.00 0.00 C ATOM 1371 CG1 ILE A 94 -15.426 11.279 -4.650 1.00 0.00 C ATOM 1372 CG2 ILE A 94 -17.382 11.745 -3.144 1.00 0.00 C ATOM 1373 CD1 ILE A 94 -15.419 12.488 -5.585 1.00 0.00 C ATOM 0 H ILE A 94 -16.495 9.072 -5.943 1.00 0.00 H new ATOM 0 HA ILE A 94 -16.097 9.249 -3.118 1.00 0.00 H new ATOM 0 HB ILE A 94 -17.541 10.942 -5.115 1.00 0.00 H new ATOM 0 HG12 ILE A 94 -14.872 11.521 -3.743 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -14.906 10.449 -5.129 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -17.357 12.784 -3.474 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -18.407 11.467 -2.897 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -16.752 11.630 -2.262 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -14.390 12.760 -5.821 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -15.949 12.240 -6.505 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -15.913 13.328 -5.097 1.00 0.00 H new ATOM 1385 N GLY A 95 -18.268 8.673 -2.013 1.00 0.00 N ATOM 1386 CA GLY A 95 -19.428 8.100 -1.364 1.00 0.00 C ATOM 1387 C GLY A 95 -19.435 6.571 -1.357 1.00 0.00 C ATOM 1388 O GLY A 95 -20.493 6.010 -1.065 1.00 0.00 O ATOM 0 H GLY A 95 -17.531 8.960 -1.369 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -19.473 8.460 -0.336 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -20.327 8.456 -1.866 1.00 0.00 H new ATOM 1392 N GLN A 96 -18.324 5.873 -1.637 1.00 0.00 N ATOM 1393 CA GLN A 96 -18.204 4.442 -1.331 1.00 0.00 C ATOM 1394 C GLN A 96 -17.006 4.164 -0.425 1.00 0.00 C ATOM 1395 O GLN A 96 -16.078 4.976 -0.342 1.00 0.00 O ATOM 1396 CB GLN A 96 -18.098 3.580 -2.598 1.00 0.00 C ATOM 1397 CG GLN A 96 -19.245 3.710 -3.605 1.00 0.00 C ATOM 1398 CD GLN A 96 -20.635 3.375 -3.081 1.00 0.00 C ATOM 1399 OE1 GLN A 96 -20.849 2.838 -1.991 1.00 0.00 O ATOM 1400 NE2 GLN A 96 -21.627 3.671 -3.895 1.00 0.00 N ATOM 0 H GLN A 96 -17.496 6.278 -2.075 1.00 0.00 H new ATOM 0 HA GLN A 96 -19.120 4.167 -0.808 1.00 0.00 H new ATOM 0 HB2 GLN A 96 -17.167 3.831 -3.106 1.00 0.00 H new ATOM 0 HB3 GLN A 96 -18.025 2.535 -2.296 1.00 0.00 H new ATOM 0 HG2 GLN A 96 -19.257 4.733 -3.982 1.00 0.00 H new ATOM 0 HG3 GLN A 96 -19.032 3.060 -4.454 1.00 0.00 H new ATOM 0 HE21 GLN A 96 -21.435 4.115 -4.793 1.00 0.00 H new ATOM 0 HE22 GLN A 96 -22.588 3.456 -3.627 1.00 0.00 H new ATOM 1409 N SER A 97 -17.005 2.986 0.202 1.00 0.00 N ATOM 1410 CA SER A 97 -15.924 2.421 0.972 1.00 0.00 C ATOM 1411 C SER A 97 -15.426 1.118 0.356 1.00 0.00 C ATOM 1412 O SER A 97 -16.185 0.421 -0.319 1.00 0.00 O ATOM 1413 CB SER A 97 -16.391 2.183 2.419 1.00 0.00 C ATOM 1414 OG SER A 97 -17.600 2.825 2.783 1.00 0.00 O ATOM 0 H SER A 97 -17.818 2.371 0.176 1.00 0.00 H new ATOM 0 HA SER A 97 -15.094 3.127 0.969 1.00 0.00 H new ATOM 0 HB2 SER A 97 -16.509 1.110 2.572 1.00 0.00 H new ATOM 0 HB3 SER A 97 -15.605 2.517 3.096 1.00 0.00 H new ATOM 0 HG SER A 97 -17.815 2.614 3.716 1.00 0.00 H new ATOM 1420 N VAL A 98 -14.170 0.774 0.631 1.00 0.00 N ATOM 1421 CA VAL A 98 -13.560 -0.511 0.315 1.00 0.00 C ATOM 1422 C VAL A 98 -12.767 -0.996 1.517 1.00 0.00 C ATOM 1423 O VAL A 98 -12.313 -0.191 2.338 1.00 0.00 O ATOM 1424 CB VAL A 98 -12.647 -0.405 -0.923 1.00 0.00 C ATOM 1425 CG1 VAL A 98 -13.499 -0.135 -2.159 1.00 0.00 C ATOM 1426 CG2 VAL A 98 -11.558 0.675 -0.799 1.00 0.00 C ATOM 0 H VAL A 98 -13.525 1.410 1.099 1.00 0.00 H new ATOM 0 HA VAL A 98 -14.348 -1.227 0.083 1.00 0.00 H new ATOM 0 HB VAL A 98 -12.126 -1.358 -1.009 1.00 0.00 H new ATOM 0 HG11 VAL A 98 -12.855 -0.060 -3.035 1.00 0.00 H new ATOM 0 HG12 VAL A 98 -14.207 -0.952 -2.298 1.00 0.00 H new ATOM 0 HG13 VAL A 98 -14.044 0.800 -2.028 1.00 0.00 H new ATOM 0 HG21 VAL A 98 -10.956 0.690 -1.707 1.00 0.00 H new ATOM 0 HG22 VAL A 98 -12.026 1.649 -0.658 1.00 0.00 H new ATOM 0 HG23 VAL A 98 -10.920 0.452 0.056 1.00 0.00 H new ATOM 1436 N ASN A 99 -12.551 -2.307 1.572 1.00 0.00 N ATOM 1437 CA ASN A 99 -11.670 -2.936 2.542 1.00 0.00 C ATOM 1438 C ASN A 99 -10.249 -2.840 2.028 1.00 0.00 C ATOM 1439 O ASN A 99 -10.012 -2.695 0.827 1.00 0.00 O ATOM 1440 CB ASN A 99 -12.004 -4.420 2.700 1.00 0.00 C ATOM 1441 CG ASN A 99 -13.279 -4.649 3.467 1.00 0.00 C ATOM 1442 OD1 ASN A 99 -14.372 -4.497 2.936 1.00 0.00 O ATOM 1443 ND2 ASN A 99 -13.166 -5.034 4.716 1.00 0.00 N ATOM 0 H ASN A 99 -12.991 -2.969 0.933 1.00 0.00 H new ATOM 0 HA ASN A 99 -11.791 -2.433 3.501 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -12.091 -4.876 1.714 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -11.182 -4.921 3.211 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -14.002 -5.215 5.271 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -12.242 -5.152 5.132 1.00 0.00 H new ATOM 1450 N LEU A 100 -9.302 -2.954 2.945 1.00 0.00 N ATOM 1451 CA LEU A 100 -7.874 -2.985 2.715 1.00 0.00 C ATOM 1452 C LEU A 100 -7.316 -3.937 3.783 1.00 0.00 C ATOM 1453 O LEU A 100 -7.836 -3.982 4.905 1.00 0.00 O ATOM 1454 CB LEU A 100 -7.322 -1.543 2.844 1.00 0.00 C ATOM 1455 CG LEU A 100 -7.909 -0.507 1.844 1.00 0.00 C ATOM 1456 CD1 LEU A 100 -7.539 0.920 2.224 1.00 0.00 C ATOM 1457 CD2 LEU A 100 -7.504 -0.719 0.386 1.00 0.00 C ATOM 0 H LEU A 100 -9.531 -3.032 3.936 1.00 0.00 H new ATOM 0 HA LEU A 100 -7.591 -3.336 1.723 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -7.511 -1.190 3.858 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -6.240 -1.574 2.714 1.00 0.00 H new ATOM 0 HG LEU A 100 -8.984 -0.668 1.919 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -7.969 1.612 1.500 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -7.929 1.145 3.217 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -6.454 1.026 2.228 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -7.962 0.051 -0.234 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -6.419 -0.659 0.297 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -7.842 -1.701 0.054 1.00 0.00 H new ATOM 1469 N VAL A 101 -6.267 -4.690 3.456 1.00 0.00 N ATOM 1470 CA VAL A 101 -5.459 -5.466 4.400 1.00 0.00 C ATOM 1471 C VAL A 101 -4.049 -4.973 4.190 1.00 0.00 C ATOM 1472 O VAL A 101 -3.568 -5.026 3.049 1.00 0.00 O ATOM 1473 CB VAL A 101 -5.497 -6.980 4.111 1.00 0.00 C ATOM 1474 CG1 VAL A 101 -4.650 -7.824 5.075 1.00 0.00 C ATOM 1475 CG2 VAL A 101 -6.929 -7.525 4.161 1.00 0.00 C ATOM 0 H VAL A 101 -5.944 -4.781 2.493 1.00 0.00 H new ATOM 0 HA VAL A 101 -5.834 -5.335 5.415 1.00 0.00 H new ATOM 0 HB VAL A 101 -5.074 -7.071 3.110 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -4.731 -8.877 4.804 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -3.608 -7.512 5.012 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -5.010 -7.683 6.094 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -6.919 -8.595 3.953 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -7.350 -7.352 5.152 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -7.538 -7.016 3.414 1.00 0.00 H new ATOM 1485 N LEU A 102 -3.390 -4.538 5.265 1.00 0.00 N ATOM 1486 CA LEU A 102 -1.962 -4.298 5.230 1.00 0.00 C ATOM 1487 C LEU A 102 -1.219 -5.295 6.118 1.00 0.00 C ATOM 1488 O LEU A 102 -1.818 -5.934 6.985 1.00 0.00 O ATOM 1489 CB LEU A 102 -1.573 -2.847 5.563 1.00 0.00 C ATOM 1490 CG LEU A 102 -2.324 -1.710 4.837 1.00 0.00 C ATOM 1491 CD1 LEU A 102 -1.718 -0.341 5.144 1.00 0.00 C ATOM 1492 CD2 LEU A 102 -2.230 -1.806 3.327 1.00 0.00 C ATOM 0 H LEU A 102 -3.829 -4.347 6.166 1.00 0.00 H new ATOM 0 HA LEU A 102 -1.652 -4.455 4.197 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -1.706 -2.703 6.635 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -0.509 -2.730 5.355 1.00 0.00 H new ATOM 0 HG LEU A 102 -3.350 -1.814 5.190 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -2.276 0.431 4.614 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -1.768 -0.153 6.216 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -0.677 -0.323 4.821 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -2.778 -0.979 2.875 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -1.184 -1.757 3.024 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -2.660 -2.751 2.995 1.00 0.00 H new ATOM 1504 N CYS A 103 0.100 -5.380 5.935 1.00 0.00 N ATOM 1505 CA CYS A 103 1.033 -6.075 6.816 1.00 0.00 C ATOM 1506 C CYS A 103 2.044 -5.054 7.347 1.00 0.00 C ATOM 1507 O CYS A 103 2.431 -4.119 6.630 1.00 0.00 O ATOM 1508 CB CYS A 103 1.691 -7.236 6.050 1.00 0.00 C ATOM 1509 SG CYS A 103 2.869 -8.149 7.093 1.00 0.00 S ATOM 0 H CYS A 103 0.564 -4.948 5.136 1.00 0.00 H new ATOM 0 HA CYS A 103 0.524 -6.516 7.673 1.00 0.00 H new ATOM 0 HB2 CYS A 103 0.920 -7.917 5.690 1.00 0.00 H new ATOM 0 HB3 CYS A 103 2.208 -6.847 5.173 1.00 0.00 H new ATOM 0 HG CYS A 103 2.396 -9.332 7.349 1.00 0.00 H new ATOM 1515 N ARG A 104 2.444 -5.240 8.608 1.00 0.00 N ATOM 1516 CA ARG A 104 3.359 -4.411 9.377 1.00 0.00 C ATOM 1517 C ARG A 104 4.762 -5.022 9.427 1.00 0.00 C ATOM 1518 O ARG A 104 4.928 -6.240 9.336 1.00 0.00 O ATOM 1519 CB ARG A 104 2.793 -4.254 10.799 1.00 0.00 C ATOM 1520 CG ARG A 104 3.030 -2.842 11.354 1.00 0.00 C ATOM 1521 CD ARG A 104 1.877 -2.357 12.230 1.00 0.00 C ATOM 1522 NE ARG A 104 0.974 -1.487 11.466 1.00 0.00 N ATOM 1523 CZ ARG A 104 0.160 -0.588 12.018 1.00 0.00 C ATOM 1524 NH1 ARG A 104 -0.089 -0.590 13.326 1.00 0.00 N ATOM 1525 NH2 ARG A 104 -0.394 0.326 11.238 1.00 0.00 N ATOM 0 H ARG A 104 2.108 -6.034 9.153 1.00 0.00 H new ATOM 0 HA ARG A 104 3.450 -3.437 8.896 1.00 0.00 H new ATOM 0 HB2 ARG A 104 1.724 -4.466 10.790 1.00 0.00 H new ATOM 0 HB3 ARG A 104 3.258 -4.987 11.458 1.00 0.00 H new ATOM 0 HG2 ARG A 104 3.952 -2.834 11.935 1.00 0.00 H new ATOM 0 HG3 ARG A 104 3.169 -2.148 10.525 1.00 0.00 H new ATOM 0 HD2 ARG A 104 1.324 -3.212 12.618 1.00 0.00 H new ATOM 0 HD3 ARG A 104 2.270 -1.815 13.090 1.00 0.00 H new ATOM 0 HE ARG A 104 0.970 -1.576 10.450 1.00 0.00 H new ATOM 0 HH11 ARG A 104 0.347 -1.289 13.927 1.00 0.00 H new ATOM 0 HH12 ARG A 104 -0.716 0.108 13.727 1.00 0.00 H new ATOM 0 HH21 ARG A 104 -0.194 0.332 10.238 1.00 0.00 H new ATOM 0 HH22 ARG A 104 -1.021 1.025 11.637 1.00 0.00 H new ATOM 1539 N GLY A 105 5.771 -4.181 9.645 1.00 0.00 N ATOM 1540 CA GLY A 105 7.134 -4.612 9.923 1.00 0.00 C ATOM 1541 C GLY A 105 8.018 -4.725 8.682 1.00 0.00 C ATOM 1542 O GLY A 105 9.200 -5.017 8.832 1.00 0.00 O ATOM 0 H GLY A 105 5.660 -3.167 9.633 1.00 0.00 H new ATOM 0 HA2 GLY A 105 7.591 -3.909 10.619 1.00 0.00 H new ATOM 0 HA3 GLY A 105 7.103 -5.580 10.423 1.00 0.00 H new ATOM 1546 N TYR A 106 7.486 -4.487 7.482 1.00 0.00 N ATOM 1547 CA TYR A 106 8.239 -4.316 6.248 1.00 0.00 C ATOM 1548 C TYR A 106 8.266 -2.810 5.949 1.00 0.00 C ATOM 1549 O TYR A 106 7.243 -2.258 5.537 1.00 0.00 O ATOM 1550 CB TYR A 106 7.568 -5.082 5.111 1.00 0.00 C ATOM 1551 CG TYR A 106 7.821 -6.575 5.086 1.00 0.00 C ATOM 1552 CD1 TYR A 106 9.038 -7.064 4.576 1.00 0.00 C ATOM 1553 CD2 TYR A 106 6.837 -7.479 5.530 1.00 0.00 C ATOM 1554 CE1 TYR A 106 9.285 -8.449 4.526 1.00 0.00 C ATOM 1555 CE2 TYR A 106 7.077 -8.864 5.481 1.00 0.00 C ATOM 1556 CZ TYR A 106 8.304 -9.357 4.982 1.00 0.00 C ATOM 1557 OH TYR A 106 8.545 -10.699 4.969 1.00 0.00 O ATOM 0 H TYR A 106 6.479 -4.406 7.343 1.00 0.00 H new ATOM 0 HA TYR A 106 9.252 -4.706 6.347 1.00 0.00 H new ATOM 0 HB2 TYR A 106 6.492 -4.915 5.170 1.00 0.00 H new ATOM 0 HB3 TYR A 106 7.904 -4.659 4.164 1.00 0.00 H new ATOM 0 HD1 TYR A 106 9.787 -6.372 4.221 1.00 0.00 H new ATOM 0 HD2 TYR A 106 5.896 -7.108 5.909 1.00 0.00 H new ATOM 0 HE1 TYR A 106 10.224 -8.817 4.139 1.00 0.00 H new ATOM 0 HE2 TYR A 106 6.321 -9.553 5.826 1.00 0.00 H new ATOM 0 HH TYR A 106 7.763 -11.175 5.318 1.00 0.00 H new ATOM 1567 N PRO A 107 9.386 -2.119 6.207 1.00 0.00 N ATOM 1568 CA PRO A 107 9.472 -0.664 6.151 1.00 0.00 C ATOM 1569 C PRO A 107 9.435 -0.114 4.717 1.00 0.00 C ATOM 1570 O PRO A 107 9.209 -0.834 3.738 1.00 0.00 O ATOM 1571 CB PRO A 107 10.773 -0.321 6.888 1.00 0.00 C ATOM 1572 CG PRO A 107 11.645 -1.534 6.600 1.00 0.00 C ATOM 1573 CD PRO A 107 10.656 -2.690 6.621 1.00 0.00 C ATOM 0 HA PRO A 107 8.607 -0.194 6.620 1.00 0.00 H new ATOM 0 HB2 PRO A 107 11.221 0.599 6.513 1.00 0.00 H new ATOM 0 HB3 PRO A 107 10.610 -0.183 7.957 1.00 0.00 H new ATOM 0 HG2 PRO A 107 12.145 -1.450 5.635 1.00 0.00 H new ATOM 0 HG3 PRO A 107 12.424 -1.657 7.353 1.00 0.00 H new ATOM 0 HD2 PRO A 107 10.968 -3.486 5.945 1.00 0.00 H new ATOM 0 HD3 PRO A 107 10.584 -3.127 7.617 1.00 0.00 H new ATOM 1581 N LEU A 108 9.622 1.202 4.617 1.00 0.00 N ATOM 1582 CA LEU A 108 9.694 1.957 3.372 1.00 0.00 C ATOM 1583 C LEU A 108 10.942 1.536 2.573 1.00 0.00 C ATOM 1584 O LEU A 108 11.966 1.229 3.181 1.00 0.00 O ATOM 1585 CB LEU A 108 9.742 3.458 3.718 1.00 0.00 C ATOM 1586 CG LEU A 108 8.419 3.974 4.327 1.00 0.00 C ATOM 1587 CD1 LEU A 108 8.617 5.246 5.151 1.00 0.00 C ATOM 1588 CD2 LEU A 108 7.398 4.251 3.222 1.00 0.00 C ATOM 0 H LEU A 108 9.732 1.795 5.440 1.00 0.00 H new ATOM 0 HA LEU A 108 8.819 1.755 2.754 1.00 0.00 H new ATOM 0 HB2 LEU A 108 10.555 3.638 4.421 1.00 0.00 H new ATOM 0 HB3 LEU A 108 9.968 4.027 2.816 1.00 0.00 H new ATOM 0 HG LEU A 108 8.052 3.192 4.992 1.00 0.00 H new ATOM 0 HD11 LEU A 108 7.659 5.569 5.558 1.00 0.00 H new ATOM 0 HD12 LEU A 108 9.309 5.046 5.969 1.00 0.00 H new ATOM 0 HD13 LEU A 108 9.025 6.032 4.515 1.00 0.00 H new ATOM 0 HD21 LEU A 108 6.471 4.614 3.666 1.00 0.00 H new ATOM 0 HD22 LEU A 108 7.794 5.005 2.541 1.00 0.00 H new ATOM 0 HD23 LEU A 108 7.201 3.332 2.670 1.00 0.00 H new ATOM 1600 N PRO A 109 10.887 1.525 1.228 1.00 0.00 N ATOM 1601 CA PRO A 109 11.959 1.019 0.378 1.00 0.00 C ATOM 1602 C PRO A 109 13.092 2.037 0.271 1.00 0.00 C ATOM 1603 O PRO A 109 14.266 1.681 0.363 1.00 0.00 O ATOM 1604 CB PRO A 109 11.307 0.770 -0.991 1.00 0.00 C ATOM 1605 CG PRO A 109 10.143 1.758 -1.044 1.00 0.00 C ATOM 1606 CD PRO A 109 9.733 1.870 0.424 1.00 0.00 C ATOM 0 HA PRO A 109 12.404 0.110 0.782 1.00 0.00 H new ATOM 0 HB2 PRO A 109 12.012 0.943 -1.804 1.00 0.00 H new ATOM 0 HB3 PRO A 109 10.959 -0.259 -1.084 1.00 0.00 H new ATOM 0 HG2 PRO A 109 10.447 2.721 -1.454 1.00 0.00 H new ATOM 0 HG3 PRO A 109 9.327 1.390 -1.666 1.00 0.00 H new ATOM 0 HD2 PRO A 109 9.396 2.881 0.651 1.00 0.00 H new ATOM 0 HD3 PRO A 109 8.901 1.201 0.641 1.00 0.00 H new ATOM 1614 N PHE A 110 12.730 3.304 0.050 1.00 0.00 N ATOM 1615 CA PHE A 110 13.615 4.454 0.028 1.00 0.00 C ATOM 1616 C PHE A 110 14.213 4.599 1.425 1.00 0.00 C ATOM 1617 O PHE A 110 13.505 4.992 2.355 1.00 0.00 O ATOM 1618 CB PHE A 110 12.818 5.699 -0.402 1.00 0.00 C ATOM 1619 CG PHE A 110 13.471 7.029 -0.066 1.00 0.00 C ATOM 1620 CD1 PHE A 110 14.769 7.336 -0.519 1.00 0.00 C ATOM 1621 CD2 PHE A 110 12.787 7.953 0.746 1.00 0.00 C ATOM 1622 CE1 PHE A 110 15.380 8.544 -0.143 1.00 0.00 C ATOM 1623 CE2 PHE A 110 13.400 9.159 1.126 1.00 0.00 C ATOM 1624 CZ PHE A 110 14.701 9.450 0.687 1.00 0.00 C ATOM 0 H PHE A 110 11.759 3.560 -0.127 1.00 0.00 H new ATOM 0 HA PHE A 110 14.426 4.331 -0.690 1.00 0.00 H new ATOM 0 HB2 PHE A 110 12.655 5.653 -1.479 1.00 0.00 H new ATOM 0 HB3 PHE A 110 11.836 5.664 0.070 1.00 0.00 H new ATOM 0 HD1 PHE A 110 15.296 6.641 -1.157 1.00 0.00 H new ATOM 0 HD2 PHE A 110 11.784 7.733 1.080 1.00 0.00 H new ATOM 0 HE1 PHE A 110 16.375 8.776 -0.493 1.00 0.00 H new ATOM 0 HE2 PHE A 110 12.871 9.860 1.754 1.00 0.00 H new ATOM 0 HZ PHE A 110 15.179 10.370 0.988 1.00 0.00 H new ATOM 1634 N ASP A 111 15.490 4.250 1.569 1.00 0.00 N ATOM 1635 CA ASP A 111 16.289 4.546 2.747 1.00 0.00 C ATOM 1636 C ASP A 111 16.778 5.986 2.594 1.00 0.00 C ATOM 1637 O ASP A 111 17.648 6.218 1.754 1.00 0.00 O ATOM 1638 CB ASP A 111 17.508 3.608 2.842 1.00 0.00 C ATOM 1639 CG ASP A 111 17.220 2.361 3.668 1.00 0.00 C ATOM 1640 OD1 ASP A 111 17.022 2.504 4.896 1.00 0.00 O ATOM 1641 OD2 ASP A 111 17.259 1.236 3.124 1.00 0.00 O ATOM 0 H ASP A 111 16.006 3.742 0.851 1.00 0.00 H new ATOM 0 HA ASP A 111 15.693 4.408 3.649 1.00 0.00 H new ATOM 0 HB2 ASP A 111 17.814 3.313 1.839 1.00 0.00 H new ATOM 0 HB3 ASP A 111 18.345 4.148 3.285 1.00 0.00 H new ATOM 1646 N PRO A 112 16.282 6.967 3.368 1.00 0.00 N ATOM 1647 CA PRO A 112 16.844 8.312 3.334 1.00 0.00 C ATOM 1648 C PRO A 112 18.262 8.351 3.914 1.00 0.00 C ATOM 1649 O PRO A 112 18.976 9.329 3.702 1.00 0.00 O ATOM 1650 CB PRO A 112 15.878 9.173 4.152 1.00 0.00 C ATOM 1651 CG PRO A 112 15.243 8.188 5.133 1.00 0.00 C ATOM 1652 CD PRO A 112 15.195 6.888 4.334 1.00 0.00 C ATOM 0 HA PRO A 112 16.944 8.677 2.312 1.00 0.00 H new ATOM 0 HB2 PRO A 112 16.402 9.974 4.674 1.00 0.00 H new ATOM 0 HB3 PRO A 112 15.127 9.644 3.517 1.00 0.00 H new ATOM 0 HG2 PRO A 112 15.838 8.082 6.040 1.00 0.00 H new ATOM 0 HG3 PRO A 112 14.248 8.510 5.440 1.00 0.00 H new ATOM 0 HD2 PRO A 112 15.317 6.024 4.988 1.00 0.00 H new ATOM 0 HD3 PRO A 112 14.234 6.775 3.831 1.00 0.00 H new ATOM 1660 N GLU A 113 18.653 7.315 4.671 1.00 0.00 N ATOM 1661 CA GLU A 113 19.971 7.180 5.262 1.00 0.00 C ATOM 1662 C GLU A 113 21.032 7.172 4.165 1.00 0.00 C ATOM 1663 O GLU A 113 21.883 8.057 4.142 1.00 0.00 O ATOM 1664 CB GLU A 113 20.028 5.915 6.141 1.00 0.00 C ATOM 1665 CG GLU A 113 21.001 6.063 7.318 1.00 0.00 C ATOM 1666 CD GLU A 113 22.411 6.514 6.921 1.00 0.00 C ATOM 1667 OE1 GLU A 113 23.153 5.739 6.284 1.00 0.00 O ATOM 1668 OE2 GLU A 113 22.797 7.653 7.278 1.00 0.00 O ATOM 0 H GLU A 113 18.036 6.532 4.888 1.00 0.00 H new ATOM 0 HA GLU A 113 20.176 8.033 5.909 1.00 0.00 H new ATOM 0 HB2 GLU A 113 19.031 5.696 6.523 1.00 0.00 H new ATOM 0 HB3 GLU A 113 20.329 5.064 5.529 1.00 0.00 H new ATOM 0 HG2 GLU A 113 20.589 6.782 8.026 1.00 0.00 H new ATOM 0 HG3 GLU A 113 21.071 5.108 7.838 1.00 0.00 H new ATOM 1675 N ASP A 114 20.973 6.182 3.273 1.00 0.00 N ATOM 1676 CA ASP A 114 21.952 6.013 2.212 1.00 0.00 C ATOM 1677 C ASP A 114 21.248 5.391 1.007 1.00 0.00 C ATOM 1678 O ASP A 114 21.255 4.163 0.858 1.00 0.00 O ATOM 1679 CB ASP A 114 23.148 5.189 2.706 1.00 0.00 C ATOM 1680 CG ASP A 114 24.383 5.533 1.887 1.00 0.00 C ATOM 1681 OD1 ASP A 114 24.449 5.143 0.697 1.00 0.00 O ATOM 1682 OD2 ASP A 114 25.243 6.253 2.449 1.00 0.00 O ATOM 0 H ASP A 114 20.239 5.474 3.271 1.00 0.00 H new ATOM 0 HA ASP A 114 22.364 6.975 1.906 1.00 0.00 H new ATOM 0 HB2 ASP A 114 23.331 5.393 3.761 1.00 0.00 H new ATOM 0 HB3 ASP A 114 22.928 4.125 2.621 1.00 0.00 H new ATOM 1687 N PRO A 115 20.554 6.201 0.189 1.00 0.00 N ATOM 1688 CA PRO A 115 19.645 5.682 -0.822 1.00 0.00 C ATOM 1689 C PRO A 115 20.372 4.986 -1.968 1.00 0.00 C ATOM 1690 O PRO A 115 19.913 3.930 -2.417 1.00 0.00 O ATOM 1691 CB PRO A 115 18.819 6.878 -1.309 1.00 0.00 C ATOM 1692 CG PRO A 115 19.641 8.098 -0.905 1.00 0.00 C ATOM 1693 CD PRO A 115 20.392 7.639 0.336 1.00 0.00 C ATOM 0 HA PRO A 115 19.006 4.908 -0.397 1.00 0.00 H new ATOM 0 HB2 PRO A 115 18.666 6.842 -2.388 1.00 0.00 H new ATOM 0 HB3 PRO A 115 17.832 6.893 -0.847 1.00 0.00 H new ATOM 0 HG2 PRO A 115 20.326 8.399 -1.698 1.00 0.00 H new ATOM 0 HG3 PRO A 115 19.004 8.956 -0.692 1.00 0.00 H new ATOM 0 HD2 PRO A 115 21.359 8.136 0.415 1.00 0.00 H new ATOM 0 HD3 PRO A 115 19.835 7.880 1.242 1.00 0.00 H new ATOM 1701 N ALA A 116 21.455 5.577 -2.474 1.00 0.00 N ATOM 1702 CA ALA A 116 22.288 4.994 -3.521 1.00 0.00 C ATOM 1703 C ALA A 116 23.618 5.725 -3.614 1.00 0.00 C ATOM 1704 O ALA A 116 24.677 5.097 -3.633 1.00 0.00 O ATOM 1705 CB ALA A 116 21.582 5.081 -4.883 1.00 0.00 C ATOM 0 H ALA A 116 21.782 6.491 -2.160 1.00 0.00 H new ATOM 0 HA ALA A 116 22.461 3.949 -3.264 1.00 0.00 H new ATOM 0 HB1 ALA A 116 22.218 4.641 -5.651 1.00 0.00 H new ATOM 0 HB2 ALA A 116 20.638 4.538 -4.839 1.00 0.00 H new ATOM 0 HB3 ALA A 116 21.388 6.126 -5.126 1.00 0.00 H new ATOM 1711 N ASN A 117 23.556 7.056 -3.650 1.00 0.00 N ATOM 1712 CA ASN A 117 24.690 7.962 -3.727 1.00 0.00 C ATOM 1713 C ASN A 117 25.616 7.606 -4.890 1.00 0.00 C ATOM 1714 O ASN A 117 26.763 7.203 -4.684 1.00 0.00 O ATOM 1715 CB ASN A 117 25.420 8.033 -2.378 1.00 0.00 C ATOM 1716 CG ASN A 117 24.508 8.539 -1.279 1.00 0.00 C ATOM 1717 OD1 ASN A 117 24.268 9.741 -1.167 1.00 0.00 O ATOM 1718 ND2 ASN A 117 23.954 7.652 -0.477 1.00 0.00 N ATOM 0 H ASN A 117 22.665 7.552 -3.625 1.00 0.00 H new ATOM 0 HA ASN A 117 24.317 8.964 -3.938 1.00 0.00 H new ATOM 0 HB2 ASN A 117 25.796 7.044 -2.114 1.00 0.00 H new ATOM 0 HB3 ASN A 117 26.285 8.690 -2.465 1.00 0.00 H new ATOM 0 HD21 ASN A 117 23.312 7.957 0.255 1.00 0.00 H new ATOM 0 HD22 ASN A 117 24.167 6.661 -0.588 1.00 0.00 H new ATOM 1725 N SER A 118 25.152 7.804 -6.124 1.00 0.00 N ATOM 1726 CA SER A 118 25.953 7.692 -7.338 1.00 0.00 C ATOM 1727 C SER A 118 25.752 8.961 -8.163 1.00 0.00 C ATOM 1728 O SER A 118 24.672 9.555 -8.174 1.00 0.00 O ATOM 1729 CB SER A 118 25.511 6.444 -8.126 1.00 0.00 C ATOM 1730 OG SER A 118 26.296 6.188 -9.289 1.00 0.00 O ATOM 0 H SER A 118 24.181 8.054 -6.309 1.00 0.00 H new ATOM 0 HA SER A 118 27.011 7.585 -7.098 1.00 0.00 H new ATOM 0 HB2 SER A 118 25.558 5.576 -7.469 1.00 0.00 H new ATOM 0 HB3 SER A 118 24.469 6.563 -8.422 1.00 0.00 H new ATOM 0 HG SER A 118 27.247 6.224 -9.056 1.00 0.00 H new ATOM 1736 N GLY A 119 26.766 9.308 -8.942 1.00 0.00 N ATOM 1737 CA GLY A 119 26.671 10.088 -10.156 1.00 0.00 C ATOM 1738 C GLY A 119 27.705 9.486 -11.108 1.00 0.00 C ATOM 1739 O GLY A 119 27.483 8.353 -11.544 1.00 0.00 O ATOM 0 H GLY A 119 27.726 9.036 -8.728 1.00 0.00 H new ATOM 0 HA2 GLY A 119 25.668 10.034 -10.580 1.00 0.00 H new ATOM 0 HA3 GLY A 119 26.880 11.140 -9.964 1.00 0.00 H new ATOM 1743 N PRO A 120 28.837 10.162 -11.376 1.00 0.00 N ATOM 1744 CA PRO A 120 29.856 9.737 -12.330 1.00 0.00 C ATOM 1745 C PRO A 120 30.697 8.572 -11.774 1.00 0.00 C ATOM 1746 O PRO A 120 31.875 8.733 -11.439 1.00 0.00 O ATOM 1747 CB PRO A 120 30.675 11.009 -12.604 1.00 0.00 C ATOM 1748 CG PRO A 120 30.629 11.744 -11.266 1.00 0.00 C ATOM 1749 CD PRO A 120 29.235 11.409 -10.741 1.00 0.00 C ATOM 0 HA PRO A 120 29.436 9.337 -13.253 1.00 0.00 H new ATOM 0 HB2 PRO A 120 31.697 10.774 -12.900 1.00 0.00 H new ATOM 0 HB3 PRO A 120 30.239 11.604 -13.406 1.00 0.00 H new ATOM 0 HG2 PRO A 120 31.410 11.399 -10.588 1.00 0.00 H new ATOM 0 HG3 PRO A 120 30.767 12.818 -11.390 1.00 0.00 H new ATOM 0 HD2 PRO A 120 29.245 11.305 -9.656 1.00 0.00 H new ATOM 0 HD3 PRO A 120 28.530 12.206 -10.978 1.00 0.00 H new ATOM 1757 N SER A 121 30.106 7.380 -11.701 1.00 0.00 N ATOM 1758 CA SER A 121 30.759 6.134 -11.325 1.00 0.00 C ATOM 1759 C SER A 121 30.200 5.009 -12.197 1.00 0.00 C ATOM 1760 O SER A 121 29.473 4.137 -11.713 1.00 0.00 O ATOM 1761 CB SER A 121 30.633 5.895 -9.810 1.00 0.00 C ATOM 1762 OG SER A 121 29.336 6.183 -9.314 1.00 0.00 O ATOM 0 H SER A 121 29.116 7.255 -11.912 1.00 0.00 H new ATOM 0 HA SER A 121 31.832 6.176 -11.512 1.00 0.00 H new ATOM 0 HB2 SER A 121 30.879 4.856 -9.589 1.00 0.00 H new ATOM 0 HB3 SER A 121 31.363 6.514 -9.287 1.00 0.00 H new ATOM 0 HG SER A 121 29.310 6.013 -8.349 1.00 0.00 H new ATOM 1768 N SER A 122 30.549 5.069 -13.482 1.00 0.00 N ATOM 1769 CA SER A 122 30.208 4.131 -14.541 1.00 0.00 C ATOM 1770 C SER A 122 31.387 4.061 -15.517 1.00 0.00 C ATOM 1771 O SER A 122 32.333 4.844 -15.399 1.00 0.00 O ATOM 1772 CB SER A 122 28.950 4.633 -15.263 1.00 0.00 C ATOM 1773 OG SER A 122 27.795 4.288 -14.525 1.00 0.00 O ATOM 0 H SER A 122 31.122 5.836 -13.832 1.00 0.00 H new ATOM 0 HA SER A 122 30.011 3.139 -14.134 1.00 0.00 H new ATOM 0 HB2 SER A 122 29.001 5.715 -15.389 1.00 0.00 H new ATOM 0 HB3 SER A 122 28.896 4.198 -16.261 1.00 0.00 H new ATOM 0 HG SER A 122 28.032 4.173 -13.581 1.00 0.00 H new ATOM 1779 N GLY A 123 31.321 3.143 -16.480 1.00 0.00 N ATOM 1780 CA GLY A 123 32.153 3.110 -17.667 1.00 0.00 C ATOM 1781 C GLY A 123 31.186 2.836 -18.792 1.00 0.00 C ATOM 1782 O GLY A 123 30.609 1.733 -18.792 1.00 0.00 O ATOM 0 H GLY A 123 30.655 2.371 -16.446 1.00 0.00 H new ATOM 0 HA2 GLY A 123 32.676 4.055 -17.813 1.00 0.00 H new ATOM 0 HA3 GLY A 123 32.914 2.333 -17.598 1.00 0.00 H new TER 1786 GLY A 123