USER MOD reduce.3.24.130724 H: found=0, std=0, add=796, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 792 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 18 THR OG1 : rot -65:sc= 0.157 USER MOD Set 1.2: A 65 THR OG1 : rot 180:sc= 0.144 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot -55:sc= 0.15 USER MOD Single : A 3 SER OG : rot 71:sc= 0.00317 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 27:sc= 0.142 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 HIS : no HD1:sc= -4.24! C(o=-4.2!,f=-5.2!) USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 GLN : amide:sc= -0.677 K(o=-0.68,f=-1.3) USER MOD Single : A 35 LYS NZ :NH3+ 141:sc= -1.21 (180deg=-2.91!) USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 MET CE :methyl -139:sc= -0.234 (180deg=-0.9) USER MOD Single : A 43 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 49 ASN : amide:sc=-0.00328 K(o=-0.0033,f=-0.79) USER MOD Single : A 51 HIS : no HD1:sc= 0 X(o=0,f=-0.0034) USER MOD Single : A 58 GLN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 70 ASN : amide:sc= -0.947 K(o=-0.95,f=-4.2!) USER MOD Single : A 75 LYS NZ :NH3+ -125:sc= -0.084 (180deg=-0.122) USER MOD Single : A 83 LYS NZ :NH3+ 151:sc= -0.89 (180deg=-1.36) USER MOD Single : A 86 GLN : amide:sc=-0.00711 X(o=-0.0071,f=0) USER MOD Single : A 89 GLN : amide:sc= -1.54 K(o=-1.5,f=-4.1!) USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 SER OG : rot 180:sc= -0.0525 USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 7.967 -31.039 -21.086 1.00 0.00 N ATOM 2 CA GLY A 1 7.324 -31.814 -20.041 1.00 0.00 C ATOM 3 C GLY A 1 8.155 -31.883 -18.776 1.00 0.00 C ATOM 4 O GLY A 1 8.346 -30.876 -18.094 1.00 0.00 O ATOM 0 H1 GLY A 1 7.359 -31.022 -21.930 1.00 0.00 H new ATOM 0 H2 GLY A 1 8.122 -30.067 -20.751 1.00 0.00 H new ATOM 0 H3 GLY A 1 8.881 -31.472 -21.327 1.00 0.00 H new ATOM 0 HA2 GLY A 1 6.354 -31.374 -19.811 1.00 0.00 H new ATOM 0 HA3 GLY A 1 7.137 -32.824 -20.405 1.00 0.00 H new ATOM 8 N SER A 2 8.650 -33.075 -18.460 1.00 0.00 N ATOM 9 CA SER A 2 9.462 -33.273 -17.264 1.00 0.00 C ATOM 10 C SER A 2 8.903 -32.476 -16.090 1.00 0.00 C ATOM 11 O SER A 2 9.650 -31.858 -15.332 1.00 0.00 O ATOM 12 CB SER A 2 10.910 -32.860 -17.532 1.00 0.00 C ATOM 13 OG SER A 2 11.776 -33.353 -16.522 1.00 0.00 O ATOM 0 H SER A 2 8.503 -33.918 -19.015 1.00 0.00 H new ATOM 0 HA SER A 2 9.435 -34.332 -17.007 1.00 0.00 H new ATOM 0 HB2 SER A 2 11.226 -33.240 -18.504 1.00 0.00 H new ATOM 0 HB3 SER A 2 10.979 -31.773 -17.576 1.00 0.00 H new ATOM 0 HG SER A 2 11.458 -33.054 -15.644 1.00 0.00 H new ATOM 19 N SER A 3 7.581 -32.497 -15.945 1.00 0.00 N ATOM 20 CA SER A 3 6.919 -31.774 -14.865 1.00 0.00 C ATOM 21 C SER A 3 6.090 -32.722 -14.004 1.00 0.00 C ATOM 22 O SER A 3 5.665 -33.782 -14.461 1.00 0.00 O ATOM 23 CB SER A 3 6.025 -30.671 -15.435 1.00 0.00 C ATOM 24 OG SER A 3 6.752 -29.468 -15.617 1.00 0.00 O ATOM 0 H SER A 3 6.948 -33.007 -16.562 1.00 0.00 H new ATOM 0 HA SER A 3 7.688 -31.322 -14.239 1.00 0.00 H new ATOM 0 HB2 SER A 3 5.606 -30.994 -16.388 1.00 0.00 H new ATOM 0 HB3 SER A 3 5.186 -30.494 -14.762 1.00 0.00 H new ATOM 0 HG SER A 3 7.381 -29.575 -16.361 1.00 0.00 H new ATOM 30 N GLY A 4 5.865 -32.332 -12.754 1.00 0.00 N ATOM 31 CA GLY A 4 5.088 -33.157 -11.847 1.00 0.00 C ATOM 32 C GLY A 4 4.237 -32.336 -10.899 1.00 0.00 C ATOM 33 O GLY A 4 4.723 -31.389 -10.280 1.00 0.00 O ATOM 0 H GLY A 4 6.207 -31.459 -12.352 1.00 0.00 H new ATOM 0 HA2 GLY A 4 4.445 -33.820 -12.425 1.00 0.00 H new ATOM 0 HA3 GLY A 4 5.762 -33.790 -11.269 1.00 0.00 H new ATOM 37 N SER A 5 2.963 -32.697 -10.787 1.00 0.00 N ATOM 38 CA SER A 5 2.041 -31.983 -9.912 1.00 0.00 C ATOM 39 C SER A 5 1.878 -32.713 -8.582 1.00 0.00 C ATOM 40 O SER A 5 1.755 -33.936 -8.544 1.00 0.00 O ATOM 41 CB SER A 5 0.678 -31.827 -10.590 1.00 0.00 C ATOM 42 OG SER A 5 0.765 -30.973 -11.719 1.00 0.00 O ATOM 0 H SER A 5 2.546 -33.479 -11.291 1.00 0.00 H new ATOM 0 HA SER A 5 2.457 -30.995 -9.716 1.00 0.00 H new ATOM 0 HB2 SER A 5 0.307 -32.805 -10.897 1.00 0.00 H new ATOM 0 HB3 SER A 5 -0.042 -31.422 -9.878 1.00 0.00 H new ATOM 0 HG SER A 5 -0.118 -30.891 -12.136 1.00 0.00 H new ATOM 48 N SER A 6 1.880 -31.951 -7.493 1.00 0.00 N ATOM 49 CA SER A 6 1.737 -32.523 -6.159 1.00 0.00 C ATOM 50 C SER A 6 1.032 -31.549 -5.222 1.00 0.00 C ATOM 51 O SER A 6 0.661 -30.444 -5.619 1.00 0.00 O ATOM 52 CB SER A 6 3.107 -32.895 -5.591 1.00 0.00 C ATOM 53 OG SER A 6 3.493 -34.196 -5.998 1.00 0.00 O ATOM 0 H SER A 6 1.979 -30.936 -7.508 1.00 0.00 H new ATOM 0 HA SER A 6 1.129 -33.424 -6.241 1.00 0.00 H new ATOM 0 HB2 SER A 6 3.851 -32.171 -5.924 1.00 0.00 H new ATOM 0 HB3 SER A 6 3.078 -32.845 -4.503 1.00 0.00 H new ATOM 0 HG SER A 6 3.060 -34.414 -6.850 1.00 0.00 H new ATOM 59 N GLY A 7 0.850 -31.965 -3.972 1.00 0.00 N ATOM 60 CA GLY A 7 0.189 -31.117 -2.996 1.00 0.00 C ATOM 61 C GLY A 7 0.732 -31.316 -1.594 1.00 0.00 C ATOM 62 O GLY A 7 0.238 -32.157 -0.842 1.00 0.00 O ATOM 0 H GLY A 7 1.148 -32.874 -3.618 1.00 0.00 H new ATOM 0 HA2 GLY A 7 0.310 -30.073 -3.285 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -0.881 -31.327 -3.002 1.00 0.00 H new ATOM 66 N LYS A 8 1.752 -30.543 -1.242 1.00 0.00 N ATOM 67 CA LYS A 8 2.364 -30.636 0.078 1.00 0.00 C ATOM 68 C LYS A 8 2.835 -29.267 0.558 1.00 0.00 C ATOM 69 O LYS A 8 3.598 -28.588 -0.127 1.00 0.00 O ATOM 70 CB LYS A 8 3.543 -31.611 0.048 1.00 0.00 C ATOM 71 CG LYS A 8 3.170 -33.004 -0.428 1.00 0.00 C ATOM 72 CD LYS A 8 3.280 -33.124 -1.938 1.00 0.00 C ATOM 73 CE LYS A 8 4.729 -33.245 -2.384 1.00 0.00 C ATOM 74 NZ LYS A 8 5.203 -34.656 -2.354 1.00 0.00 N ATOM 0 H LYS A 8 2.174 -29.844 -1.853 1.00 0.00 H new ATOM 0 HA LYS A 8 1.611 -31.006 0.774 1.00 0.00 H new ATOM 0 HB2 LYS A 8 4.319 -31.209 -0.604 1.00 0.00 H new ATOM 0 HB3 LYS A 8 3.971 -31.681 1.048 1.00 0.00 H new ATOM 0 HG2 LYS A 8 3.822 -33.738 0.045 1.00 0.00 H new ATOM 0 HG3 LYS A 8 2.151 -33.235 -0.117 1.00 0.00 H new ATOM 0 HD2 LYS A 8 2.720 -33.996 -2.276 1.00 0.00 H new ATOM 0 HD3 LYS A 8 2.825 -32.252 -2.407 1.00 0.00 H new ATOM 0 HE2 LYS A 8 4.832 -32.849 -3.394 1.00 0.00 H new ATOM 0 HE3 LYS A 8 5.360 -32.636 -1.737 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 6.195 -34.696 -2.665 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 5.129 -35.027 -1.385 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 4.617 -35.233 -2.991 1.00 0.00 H new ATOM 88 N GLU A 9 2.375 -28.870 1.741 1.00 0.00 N ATOM 89 CA GLU A 9 2.750 -27.581 2.312 1.00 0.00 C ATOM 90 C GLU A 9 3.230 -27.743 3.750 1.00 0.00 C ATOM 91 O GLU A 9 2.798 -28.649 4.462 1.00 0.00 O ATOM 92 CB GLU A 9 1.567 -26.612 2.262 1.00 0.00 C ATOM 93 CG GLU A 9 1.511 -25.784 0.989 1.00 0.00 C ATOM 94 CD GLU A 9 0.094 -25.408 0.601 1.00 0.00 C ATOM 95 OE1 GLU A 9 -0.610 -26.265 0.025 1.00 0.00 O ATOM 96 OE2 GLU A 9 -0.311 -24.259 0.872 1.00 0.00 O ATOM 0 H GLU A 9 1.743 -29.421 2.322 1.00 0.00 H new ATOM 0 HA GLU A 9 3.568 -27.173 1.718 1.00 0.00 H new ATOM 0 HB2 GLU A 9 0.640 -27.178 2.358 1.00 0.00 H new ATOM 0 HB3 GLU A 9 1.621 -25.941 3.119 1.00 0.00 H new ATOM 0 HG2 GLU A 9 2.100 -24.877 1.124 1.00 0.00 H new ATOM 0 HG3 GLU A 9 1.970 -26.344 0.175 1.00 0.00 H new ATOM 103 N ALA A 10 4.128 -26.858 4.172 1.00 0.00 N ATOM 104 CA ALA A 10 4.666 -26.901 5.526 1.00 0.00 C ATOM 105 C ALA A 10 4.593 -25.530 6.190 1.00 0.00 C ATOM 106 O ALA A 10 5.480 -24.694 6.012 1.00 0.00 O ATOM 107 CB ALA A 10 6.102 -27.404 5.508 1.00 0.00 C ATOM 0 H ALA A 10 4.498 -26.103 3.595 1.00 0.00 H new ATOM 0 HA ALA A 10 4.058 -27.592 6.110 1.00 0.00 H new ATOM 0 HB1 ALA A 10 6.491 -27.431 6.526 1.00 0.00 H new ATOM 0 HB2 ALA A 10 6.131 -28.407 5.082 1.00 0.00 H new ATOM 0 HB3 ALA A 10 6.714 -26.735 4.903 1.00 0.00 H new ATOM 113 N LEU A 11 3.531 -25.304 6.955 1.00 0.00 N ATOM 114 CA LEU A 11 3.342 -24.033 7.646 1.00 0.00 C ATOM 115 C LEU A 11 2.611 -24.236 8.970 1.00 0.00 C ATOM 116 O LEU A 11 1.548 -24.855 9.013 1.00 0.00 O ATOM 117 CB LEU A 11 2.559 -23.062 6.762 1.00 0.00 C ATOM 118 CG LEU A 11 2.102 -21.765 7.430 1.00 0.00 C ATOM 119 CD1 LEU A 11 1.940 -20.660 6.396 1.00 0.00 C ATOM 120 CD2 LEU A 11 0.801 -21.984 8.187 1.00 0.00 C ATOM 0 H LEU A 11 2.787 -25.984 7.113 1.00 0.00 H new ATOM 0 HA LEU A 11 4.325 -23.612 7.856 1.00 0.00 H new ATOM 0 HB2 LEU A 11 3.178 -22.806 5.902 1.00 0.00 H new ATOM 0 HB3 LEU A 11 1.679 -23.579 6.379 1.00 0.00 H new ATOM 0 HG LEU A 11 2.867 -21.458 8.144 1.00 0.00 H new ATOM 0 HD11 LEU A 11 1.614 -19.745 6.890 1.00 0.00 H new ATOM 0 HD12 LEU A 11 2.894 -20.484 5.899 1.00 0.00 H new ATOM 0 HD13 LEU A 11 1.196 -20.959 5.658 1.00 0.00 H new ATOM 0 HD21 LEU A 11 0.491 -21.050 8.656 1.00 0.00 H new ATOM 0 HD22 LEU A 11 0.028 -22.316 7.494 1.00 0.00 H new ATOM 0 HD23 LEU A 11 0.950 -22.743 8.955 1.00 0.00 H new ATOM 132 N GLU A 12 3.188 -23.710 10.045 1.00 0.00 N ATOM 133 CA GLU A 12 2.590 -23.832 11.369 1.00 0.00 C ATOM 134 C GLU A 12 2.669 -22.510 12.127 1.00 0.00 C ATOM 135 O GLU A 12 3.757 -22.023 12.435 1.00 0.00 O ATOM 136 CB GLU A 12 3.289 -24.933 12.169 1.00 0.00 C ATOM 137 CG GLU A 12 2.921 -24.942 13.643 1.00 0.00 C ATOM 138 CD GLU A 12 3.321 -26.230 14.336 1.00 0.00 C ATOM 139 OE1 GLU A 12 2.585 -27.230 14.201 1.00 0.00 O ATOM 140 OE2 GLU A 12 4.369 -26.237 15.014 1.00 0.00 O ATOM 0 H GLU A 12 4.068 -23.195 10.025 1.00 0.00 H new ATOM 0 HA GLU A 12 1.540 -24.095 11.242 1.00 0.00 H new ATOM 0 HB2 GLU A 12 3.038 -25.901 11.735 1.00 0.00 H new ATOM 0 HB3 GLU A 12 4.368 -24.811 12.073 1.00 0.00 H new ATOM 0 HG2 GLU A 12 3.405 -24.101 14.140 1.00 0.00 H new ATOM 0 HG3 GLU A 12 1.846 -24.797 13.746 1.00 0.00 H new ATOM 147 N ALA A 13 1.508 -21.933 12.422 1.00 0.00 N ATOM 148 CA ALA A 13 1.445 -20.669 13.144 1.00 0.00 C ATOM 149 C ALA A 13 0.014 -20.345 13.560 1.00 0.00 C ATOM 150 O ALA A 13 -0.933 -20.607 12.818 1.00 0.00 O ATOM 151 CB ALA A 13 2.016 -19.545 12.291 1.00 0.00 C ATOM 0 H ALA A 13 0.599 -22.322 12.172 1.00 0.00 H new ATOM 0 HA ALA A 13 2.046 -20.765 14.049 1.00 0.00 H new ATOM 0 HB1 ALA A 13 1.963 -18.606 12.843 1.00 0.00 H new ATOM 0 HB2 ALA A 13 3.056 -19.765 12.048 1.00 0.00 H new ATOM 0 HB3 ALA A 13 1.439 -19.458 11.370 1.00 0.00 H new ATOM 157 N LEU A 14 -0.136 -19.774 14.750 1.00 0.00 N ATOM 158 CA LEU A 14 -1.453 -19.414 15.265 1.00 0.00 C ATOM 159 C LEU A 14 -1.598 -17.900 15.378 1.00 0.00 C ATOM 160 O LEU A 14 -2.655 -17.344 15.079 1.00 0.00 O ATOM 161 CB LEU A 14 -1.682 -20.064 16.631 1.00 0.00 C ATOM 162 CG LEU A 14 -0.578 -19.853 17.668 1.00 0.00 C ATOM 163 CD1 LEU A 14 -1.140 -19.973 19.076 1.00 0.00 C ATOM 164 CD2 LEU A 14 0.551 -20.851 17.455 1.00 0.00 C ATOM 0 H LEU A 14 0.637 -19.550 15.376 1.00 0.00 H new ATOM 0 HA LEU A 14 -2.203 -19.780 14.565 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -2.616 -19.681 17.041 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -1.814 -21.136 16.483 1.00 0.00 H new ATOM 0 HG LEU A 14 -0.175 -18.848 17.544 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -0.341 -19.820 19.801 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -1.914 -19.220 19.224 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -1.569 -20.966 19.213 1.00 0.00 H new ATOM 0 HD21 LEU A 14 1.328 -20.686 18.202 1.00 0.00 H new ATOM 0 HD22 LEU A 14 0.163 -21.865 17.552 1.00 0.00 H new ATOM 0 HD23 LEU A 14 0.972 -20.717 16.458 1.00 0.00 H new ATOM 176 N VAL A 15 -0.529 -17.239 15.810 1.00 0.00 N ATOM 177 CA VAL A 15 -0.537 -15.789 15.959 1.00 0.00 C ATOM 178 C VAL A 15 0.075 -15.107 14.740 1.00 0.00 C ATOM 179 O VAL A 15 1.099 -15.537 14.206 1.00 0.00 O ATOM 180 CB VAL A 15 0.234 -15.350 17.218 1.00 0.00 C ATOM 181 CG1 VAL A 15 1.686 -15.798 17.140 1.00 0.00 C ATOM 182 CG2 VAL A 15 0.142 -13.843 17.400 1.00 0.00 C ATOM 0 H VAL A 15 0.353 -17.684 16.063 1.00 0.00 H new ATOM 0 HA VAL A 15 -1.580 -15.487 16.056 1.00 0.00 H new ATOM 0 HB VAL A 15 -0.222 -15.827 18.086 1.00 0.00 H new ATOM 0 HG11 VAL A 15 2.214 -15.479 18.038 1.00 0.00 H new ATOM 0 HG12 VAL A 15 1.728 -16.884 17.061 1.00 0.00 H new ATOM 0 HG13 VAL A 15 2.158 -15.352 16.264 1.00 0.00 H new ATOM 0 HG21 VAL A 15 0.692 -13.550 18.294 1.00 0.00 H new ATOM 0 HG22 VAL A 15 0.571 -13.345 16.531 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -0.903 -13.552 17.506 1.00 0.00 H new ATOM 192 N PRO A 16 -0.565 -14.019 14.287 1.00 0.00 N ATOM 193 CA PRO A 16 -0.102 -13.255 13.125 1.00 0.00 C ATOM 194 C PRO A 16 1.190 -12.496 13.408 1.00 0.00 C ATOM 195 O PRO A 16 1.718 -12.543 14.520 1.00 0.00 O ATOM 196 CB PRO A 16 -1.249 -12.276 12.864 1.00 0.00 C ATOM 197 CG PRO A 16 -1.924 -12.122 14.183 1.00 0.00 C ATOM 198 CD PRO A 16 -1.790 -13.452 14.873 1.00 0.00 C ATOM 0 HA PRO A 16 0.127 -13.901 12.278 1.00 0.00 H new ATOM 0 HB2 PRO A 16 -0.877 -11.320 12.496 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -1.936 -12.663 12.111 1.00 0.00 H new ATOM 0 HG2 PRO A 16 -1.459 -11.329 14.769 1.00 0.00 H new ATOM 0 HG3 PRO A 16 -2.972 -11.852 14.056 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -1.703 -13.337 15.953 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -2.655 -14.089 14.689 1.00 0.00 H new ATOM 206 N VAL A 17 1.697 -11.798 12.396 1.00 0.00 N ATOM 207 CA VAL A 17 2.926 -11.029 12.537 1.00 0.00 C ATOM 208 C VAL A 17 2.832 -9.702 11.794 1.00 0.00 C ATOM 209 O VAL A 17 2.000 -9.533 10.901 1.00 0.00 O ATOM 210 CB VAL A 17 4.143 -11.814 12.011 1.00 0.00 C ATOM 211 CG1 VAL A 17 4.699 -12.726 13.094 1.00 0.00 C ATOM 212 CG2 VAL A 17 3.766 -12.612 10.773 1.00 0.00 C ATOM 0 H VAL A 17 1.274 -11.750 11.469 1.00 0.00 H new ATOM 0 HA VAL A 17 3.059 -10.837 13.602 1.00 0.00 H new ATOM 0 HB VAL A 17 4.921 -11.102 11.734 1.00 0.00 H new ATOM 0 HG11 VAL A 17 5.558 -13.272 12.704 1.00 0.00 H new ATOM 0 HG12 VAL A 17 5.008 -12.127 13.951 1.00 0.00 H new ATOM 0 HG13 VAL A 17 3.930 -13.433 13.404 1.00 0.00 H new ATOM 0 HG21 VAL A 17 4.637 -13.160 10.414 1.00 0.00 H new ATOM 0 HG22 VAL A 17 2.971 -13.315 11.022 1.00 0.00 H new ATOM 0 HG23 VAL A 17 3.419 -11.933 9.994 1.00 0.00 H new ATOM 222 N THR A 18 3.692 -8.758 12.169 1.00 0.00 N ATOM 223 CA THR A 18 3.705 -7.444 11.539 1.00 0.00 C ATOM 224 C THR A 18 4.758 -7.371 10.439 1.00 0.00 C ATOM 225 O THR A 18 5.882 -7.847 10.611 1.00 0.00 O ATOM 226 CB THR A 18 3.977 -6.330 12.568 1.00 0.00 C ATOM 227 OG1 THR A 18 3.008 -6.389 13.620 1.00 0.00 O ATOM 228 CG2 THR A 18 3.934 -4.961 11.907 1.00 0.00 C ATOM 0 H THR A 18 4.387 -8.880 12.905 1.00 0.00 H new ATOM 0 HA THR A 18 2.717 -7.294 11.103 1.00 0.00 H new ATOM 0 HB THR A 18 4.973 -6.484 12.983 1.00 0.00 H new ATOM 0 HG1 THR A 18 2.119 -6.194 13.257 1.00 0.00 H new ATOM 0 HG21 THR A 18 4.129 -4.191 12.653 1.00 0.00 H new ATOM 0 HG22 THR A 18 4.693 -4.910 11.126 1.00 0.00 H new ATOM 0 HG23 THR A 18 2.950 -4.800 11.468 1.00 0.00 H new ATOM 236 N ILE A 19 4.390 -6.775 9.311 1.00 0.00 N ATOM 237 CA ILE A 19 5.305 -6.639 8.185 1.00 0.00 C ATOM 238 C ILE A 19 5.571 -5.172 7.865 1.00 0.00 C ATOM 239 O ILE A 19 5.099 -4.279 8.568 1.00 0.00 O ATOM 240 CB ILE A 19 4.755 -7.335 6.926 1.00 0.00 C ATOM 241 CG1 ILE A 19 3.412 -6.723 6.525 1.00 0.00 C ATOM 242 CG2 ILE A 19 4.612 -8.830 7.168 1.00 0.00 C ATOM 243 CD1 ILE A 19 3.081 -6.900 5.059 1.00 0.00 C ATOM 0 H ILE A 19 3.464 -6.378 9.152 1.00 0.00 H new ATOM 0 HA ILE A 19 6.239 -7.119 8.478 1.00 0.00 H new ATOM 0 HB ILE A 19 5.459 -7.185 6.108 1.00 0.00 H new ATOM 0 HG12 ILE A 19 2.622 -7.175 7.125 1.00 0.00 H new ATOM 0 HG13 ILE A 19 3.422 -5.659 6.761 1.00 0.00 H new ATOM 0 HG21 ILE A 19 4.222 -9.308 6.269 1.00 0.00 H new ATOM 0 HG22 ILE A 19 5.586 -9.254 7.411 1.00 0.00 H new ATOM 0 HG23 ILE A 19 3.925 -9.000 7.997 1.00 0.00 H new ATOM 0 HD11 ILE A 19 2.115 -6.442 4.846 1.00 0.00 H new ATOM 0 HD12 ILE A 19 3.851 -6.423 4.452 1.00 0.00 H new ATOM 0 HD13 ILE A 19 3.039 -7.963 4.821 1.00 0.00 H new ATOM 255 N GLU A 20 6.329 -4.932 6.800 1.00 0.00 N ATOM 256 CA GLU A 20 6.657 -3.572 6.387 1.00 0.00 C ATOM 257 C GLU A 20 6.503 -3.410 4.878 1.00 0.00 C ATOM 258 O GLU A 20 7.085 -4.162 4.098 1.00 0.00 O ATOM 259 CB GLU A 20 8.086 -3.219 6.805 1.00 0.00 C ATOM 260 CG GLU A 20 8.198 -2.734 8.241 1.00 0.00 C ATOM 261 CD GLU A 20 9.615 -2.348 8.617 1.00 0.00 C ATOM 262 OE1 GLU A 20 10.212 -1.512 7.906 1.00 0.00 O ATOM 263 OE2 GLU A 20 10.127 -2.882 9.623 1.00 0.00 O ATOM 0 H GLU A 20 6.727 -5.661 6.208 1.00 0.00 H new ATOM 0 HA GLU A 20 5.963 -2.892 6.881 1.00 0.00 H new ATOM 0 HB2 GLU A 20 8.720 -4.096 6.676 1.00 0.00 H new ATOM 0 HB3 GLU A 20 8.470 -2.447 6.139 1.00 0.00 H new ATOM 0 HG2 GLU A 20 7.542 -1.875 8.383 1.00 0.00 H new ATOM 0 HG3 GLU A 20 7.848 -3.517 8.913 1.00 0.00 H new ATOM 270 N VAL A 21 5.711 -2.420 4.473 1.00 0.00 N ATOM 271 CA VAL A 21 5.479 -2.158 3.058 1.00 0.00 C ATOM 272 C VAL A 21 5.918 -0.746 2.682 1.00 0.00 C ATOM 273 O VAL A 21 5.602 0.218 3.379 1.00 0.00 O ATOM 274 CB VAL A 21 3.994 -2.338 2.690 1.00 0.00 C ATOM 275 CG1 VAL A 21 3.838 -2.554 1.192 1.00 0.00 C ATOM 276 CG2 VAL A 21 3.389 -3.495 3.470 1.00 0.00 C ATOM 0 H VAL A 21 5.220 -1.788 5.105 1.00 0.00 H new ATOM 0 HA VAL A 21 6.074 -2.881 2.500 1.00 0.00 H new ATOM 0 HB VAL A 21 3.457 -1.428 2.959 1.00 0.00 H new ATOM 0 HG11 VAL A 21 2.783 -2.679 0.950 1.00 0.00 H new ATOM 0 HG12 VAL A 21 4.233 -1.690 0.657 1.00 0.00 H new ATOM 0 HG13 VAL A 21 4.387 -3.447 0.894 1.00 0.00 H new ATOM 0 HG21 VAL A 21 2.340 -3.608 3.198 1.00 0.00 H new ATOM 0 HG22 VAL A 21 3.926 -4.414 3.234 1.00 0.00 H new ATOM 0 HG23 VAL A 21 3.467 -3.294 4.538 1.00 0.00 H new ATOM 286 N GLU A 22 6.645 -0.634 1.576 1.00 0.00 N ATOM 287 CA GLU A 22 7.127 0.660 1.108 1.00 0.00 C ATOM 288 C GLU A 22 5.996 1.464 0.470 1.00 0.00 C ATOM 289 O GLU A 22 5.443 1.071 -0.558 1.00 0.00 O ATOM 290 CB GLU A 22 8.264 0.473 0.102 1.00 0.00 C ATOM 291 CG GLU A 22 9.574 0.038 0.738 1.00 0.00 C ATOM 292 CD GLU A 22 10.503 -0.644 -0.247 1.00 0.00 C ATOM 293 OE1 GLU A 22 10.346 -1.864 -0.462 1.00 0.00 O ATOM 294 OE2 GLU A 22 11.386 0.041 -0.803 1.00 0.00 O ATOM 0 H GLU A 22 6.913 -1.423 0.987 1.00 0.00 H new ATOM 0 HA GLU A 22 7.502 1.212 1.970 1.00 0.00 H new ATOM 0 HB2 GLU A 22 7.965 -0.269 -0.638 1.00 0.00 H new ATOM 0 HB3 GLU A 22 8.423 1.410 -0.432 1.00 0.00 H new ATOM 0 HG2 GLU A 22 10.075 0.909 1.161 1.00 0.00 H new ATOM 0 HG3 GLU A 22 9.364 -0.641 1.564 1.00 0.00 H new ATOM 301 N VAL A 23 5.658 2.591 1.088 1.00 0.00 N ATOM 302 CA VAL A 23 4.594 3.450 0.582 1.00 0.00 C ATOM 303 C VAL A 23 4.796 4.894 1.026 1.00 0.00 C ATOM 304 O VAL A 23 5.001 5.184 2.205 1.00 0.00 O ATOM 305 CB VAL A 23 3.209 2.968 1.055 1.00 0.00 C ATOM 306 CG1 VAL A 23 2.148 4.016 0.758 1.00 0.00 C ATOM 307 CG2 VAL A 23 2.857 1.640 0.402 1.00 0.00 C ATOM 0 H VAL A 23 6.105 2.930 1.940 1.00 0.00 H new ATOM 0 HA VAL A 23 4.636 3.398 -0.506 1.00 0.00 H new ATOM 0 HB VAL A 23 3.244 2.819 2.134 1.00 0.00 H new ATOM 0 HG11 VAL A 23 1.177 3.657 1.099 1.00 0.00 H new ATOM 0 HG12 VAL A 23 2.396 4.942 1.277 1.00 0.00 H new ATOM 0 HG13 VAL A 23 2.110 4.201 -0.316 1.00 0.00 H new ATOM 0 HG21 VAL A 23 1.876 1.314 0.747 1.00 0.00 H new ATOM 0 HG22 VAL A 23 2.839 1.761 -0.681 1.00 0.00 H new ATOM 0 HG23 VAL A 23 3.603 0.893 0.672 1.00 0.00 H new ATOM 317 N PRO A 24 4.735 5.824 0.061 1.00 0.00 N ATOM 318 CA PRO A 24 4.908 7.255 0.329 1.00 0.00 C ATOM 319 C PRO A 24 3.736 7.845 1.106 1.00 0.00 C ATOM 320 O PRO A 24 2.576 7.566 0.807 1.00 0.00 O ATOM 321 CB PRO A 24 4.985 7.871 -1.070 1.00 0.00 C ATOM 322 CG PRO A 24 4.249 6.916 -1.946 1.00 0.00 C ATOM 323 CD PRO A 24 4.493 5.551 -1.366 1.00 0.00 C ATOM 0 HA PRO A 24 5.785 7.451 0.945 1.00 0.00 H new ATOM 0 HB2 PRO A 24 4.529 8.861 -1.092 1.00 0.00 H new ATOM 0 HB3 PRO A 24 6.019 7.989 -1.394 1.00 0.00 H new ATOM 0 HG2 PRO A 24 3.184 7.147 -1.967 1.00 0.00 H new ATOM 0 HG3 PRO A 24 4.608 6.973 -2.974 1.00 0.00 H new ATOM 0 HD2 PRO A 24 3.635 4.894 -1.509 1.00 0.00 H new ATOM 0 HD3 PRO A 24 5.349 5.063 -1.833 1.00 0.00 H new ATOM 331 N PHE A 25 4.048 8.662 2.107 1.00 0.00 N ATOM 332 CA PHE A 25 3.020 9.291 2.928 1.00 0.00 C ATOM 333 C PHE A 25 2.073 10.125 2.071 1.00 0.00 C ATOM 334 O PHE A 25 0.948 10.420 2.475 1.00 0.00 O ATOM 335 CB PHE A 25 3.664 10.172 4.002 1.00 0.00 C ATOM 336 CG PHE A 25 2.674 10.758 4.969 1.00 0.00 C ATOM 337 CD1 PHE A 25 1.857 11.811 4.591 1.00 0.00 C ATOM 338 CD2 PHE A 25 2.562 10.256 6.255 1.00 0.00 C ATOM 339 CE1 PHE A 25 0.945 12.352 5.478 1.00 0.00 C ATOM 340 CE2 PHE A 25 1.652 10.793 7.146 1.00 0.00 C ATOM 341 CZ PHE A 25 0.844 11.843 6.757 1.00 0.00 C ATOM 0 H PHE A 25 5.004 8.904 2.369 1.00 0.00 H new ATOM 0 HA PHE A 25 2.444 8.502 3.411 1.00 0.00 H new ATOM 0 HB2 PHE A 25 4.394 9.582 4.555 1.00 0.00 H new ATOM 0 HB3 PHE A 25 4.210 10.982 3.517 1.00 0.00 H new ATOM 0 HD1 PHE A 25 1.933 12.214 3.592 1.00 0.00 H new ATOM 0 HD2 PHE A 25 3.193 9.436 6.565 1.00 0.00 H new ATOM 0 HE1 PHE A 25 0.313 13.172 5.171 1.00 0.00 H new ATOM 0 HE2 PHE A 25 1.573 10.392 8.146 1.00 0.00 H new ATOM 0 HZ PHE A 25 0.134 12.265 7.453 1.00 0.00 H new ATOM 351 N ASP A 26 2.536 10.503 0.885 1.00 0.00 N ATOM 352 CA ASP A 26 1.732 11.303 -0.032 1.00 0.00 C ATOM 353 C ASP A 26 0.531 10.509 -0.535 1.00 0.00 C ATOM 354 O ASP A 26 -0.385 11.066 -1.143 1.00 0.00 O ATOM 355 CB ASP A 26 2.582 11.771 -1.214 1.00 0.00 C ATOM 356 CG ASP A 26 3.746 12.640 -0.783 1.00 0.00 C ATOM 357 OD1 ASP A 26 3.505 13.796 -0.373 1.00 0.00 O ATOM 358 OD2 ASP A 26 4.899 12.166 -0.853 1.00 0.00 O ATOM 0 H ASP A 26 3.465 10.268 0.535 1.00 0.00 H new ATOM 0 HA ASP A 26 1.367 12.175 0.510 1.00 0.00 H new ATOM 0 HB2 ASP A 26 2.961 10.902 -1.752 1.00 0.00 H new ATOM 0 HB3 ASP A 26 1.955 12.328 -1.910 1.00 0.00 H new ATOM 363 N LEU A 27 0.541 9.205 -0.279 1.00 0.00 N ATOM 364 CA LEU A 27 -0.547 8.333 -0.707 1.00 0.00 C ATOM 365 C LEU A 27 -1.426 7.938 0.476 1.00 0.00 C ATOM 366 O LEU A 27 -2.624 7.699 0.321 1.00 0.00 O ATOM 367 CB LEU A 27 0.012 7.080 -1.382 1.00 0.00 C ATOM 368 CG LEU A 27 0.651 7.286 -2.755 1.00 0.00 C ATOM 369 CD1 LEU A 27 1.295 5.998 -3.244 1.00 0.00 C ATOM 370 CD2 LEU A 27 -0.383 7.781 -3.756 1.00 0.00 C ATOM 0 H LEU A 27 1.291 8.729 0.223 1.00 0.00 H new ATOM 0 HA LEU A 27 -1.158 8.882 -1.423 1.00 0.00 H new ATOM 0 HB2 LEU A 27 0.756 6.636 -0.720 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -0.796 6.356 -1.484 1.00 0.00 H new ATOM 0 HG LEU A 27 1.429 8.044 -2.662 1.00 0.00 H new ATOM 0 HD11 LEU A 27 1.744 6.165 -4.223 1.00 0.00 H new ATOM 0 HD12 LEU A 27 2.066 5.686 -2.539 1.00 0.00 H new ATOM 0 HD13 LEU A 27 0.537 5.219 -3.321 1.00 0.00 H new ATOM 0 HD21 LEU A 27 0.090 7.922 -4.728 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -1.184 7.047 -3.845 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -0.797 8.729 -3.413 1.00 0.00 H new ATOM 382 N HIS A 28 -0.823 7.874 1.659 1.00 0.00 N ATOM 383 CA HIS A 28 -1.551 7.510 2.869 1.00 0.00 C ATOM 384 C HIS A 28 -2.910 8.203 2.915 1.00 0.00 C ATOM 385 O HIS A 28 -3.951 7.547 2.956 1.00 0.00 O ATOM 386 CB HIS A 28 -0.736 7.878 4.111 1.00 0.00 C ATOM 387 CG HIS A 28 0.561 7.137 4.216 1.00 0.00 C ATOM 388 ND1 HIS A 28 1.364 7.183 5.336 1.00 0.00 N ATOM 389 CD2 HIS A 28 1.191 6.326 3.335 1.00 0.00 C ATOM 390 CE1 HIS A 28 2.435 6.433 5.138 1.00 0.00 C ATOM 391 NE2 HIS A 28 2.354 5.903 3.931 1.00 0.00 N ATOM 0 H HIS A 28 0.167 8.069 1.805 1.00 0.00 H new ATOM 0 HA HIS A 28 -1.712 6.432 2.855 1.00 0.00 H new ATOM 0 HB2 HIS A 28 -0.533 8.949 4.099 1.00 0.00 H new ATOM 0 HB3 HIS A 28 -1.333 7.677 5.000 1.00 0.00 H new ATOM 0 HD2 HIS A 28 0.844 6.061 2.347 1.00 0.00 H new ATOM 0 HE1 HIS A 28 3.239 6.280 5.843 1.00 0.00 H new ATOM 0 HE2 HIS A 28 3.043 5.280 3.510 1.00 0.00 H new ATOM 399 N ARG A 29 -2.891 9.532 2.909 1.00 0.00 N ATOM 400 CA ARG A 29 -4.121 10.313 2.951 1.00 0.00 C ATOM 401 C ARG A 29 -5.166 9.734 2.002 1.00 0.00 C ATOM 402 O ARG A 29 -6.368 9.814 2.262 1.00 0.00 O ATOM 403 CB ARG A 29 -3.838 11.771 2.585 1.00 0.00 C ATOM 404 CG ARG A 29 -3.435 11.968 1.133 1.00 0.00 C ATOM 405 CD ARG A 29 -2.980 13.395 0.869 1.00 0.00 C ATOM 406 NE ARG A 29 -1.665 13.664 1.444 1.00 0.00 N ATOM 407 CZ ARG A 29 -1.112 14.871 1.482 1.00 0.00 C ATOM 408 NH1 ARG A 29 -1.759 15.916 0.984 1.00 0.00 N ATOM 409 NH2 ARG A 29 0.089 15.036 2.020 1.00 0.00 N ATOM 0 H ARG A 29 -2.038 10.090 2.875 1.00 0.00 H new ATOM 0 HA ARG A 29 -4.514 10.270 3.967 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -4.727 12.367 2.790 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -3.044 12.151 3.228 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -2.631 11.276 0.880 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -4.278 11.728 0.485 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -2.949 13.573 -0.206 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -3.708 14.091 1.286 1.00 0.00 H new ATOM 0 HE ARG A 29 -1.142 12.882 1.838 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -2.683 15.794 0.571 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -1.332 16.842 1.014 1.00 0.00 H new ATOM 0 HH21 ARG A 29 0.590 14.235 2.405 1.00 0.00 H new ATOM 0 HH22 ARG A 29 0.512 15.964 2.048 1.00 0.00 H new ATOM 423 N TYR A 30 -4.701 9.152 0.902 1.00 0.00 N ATOM 424 CA TYR A 30 -5.595 8.562 -0.086 1.00 0.00 C ATOM 425 C TYR A 30 -5.953 7.127 0.289 1.00 0.00 C ATOM 426 O TYR A 30 -7.082 6.682 0.083 1.00 0.00 O ATOM 427 CB TYR A 30 -4.947 8.592 -1.472 1.00 0.00 C ATOM 428 CG TYR A 30 -4.569 9.981 -1.934 1.00 0.00 C ATOM 429 CD1 TYR A 30 -5.438 11.051 -1.763 1.00 0.00 C ATOM 430 CD2 TYR A 30 -3.342 10.222 -2.540 1.00 0.00 C ATOM 431 CE1 TYR A 30 -5.096 12.323 -2.184 1.00 0.00 C ATOM 432 CE2 TYR A 30 -2.992 11.490 -2.963 1.00 0.00 C ATOM 433 CZ TYR A 30 -3.873 12.537 -2.784 1.00 0.00 C ATOM 434 OH TYR A 30 -3.528 13.801 -3.204 1.00 0.00 O ATOM 0 H TYR A 30 -3.710 9.076 0.673 1.00 0.00 H new ATOM 0 HA TYR A 30 -6.512 9.152 -0.107 1.00 0.00 H new ATOM 0 HB2 TYR A 30 -4.054 7.967 -1.460 1.00 0.00 H new ATOM 0 HB3 TYR A 30 -5.634 8.152 -2.195 1.00 0.00 H new ATOM 0 HD1 TYR A 30 -6.397 10.887 -1.293 1.00 0.00 H new ATOM 0 HD2 TYR A 30 -2.651 9.405 -2.683 1.00 0.00 H new ATOM 0 HE1 TYR A 30 -5.783 13.144 -2.044 1.00 0.00 H new ATOM 0 HE2 TYR A 30 -2.034 11.661 -3.431 1.00 0.00 H new ATOM 0 HH TYR A 30 -2.634 13.780 -3.604 1.00 0.00 H new ATOM 444 N VAL A 31 -4.982 6.408 0.844 1.00 0.00 N ATOM 445 CA VAL A 31 -5.192 5.024 1.251 1.00 0.00 C ATOM 446 C VAL A 31 -6.162 4.938 2.424 1.00 0.00 C ATOM 447 O VAL A 31 -7.237 4.346 2.312 1.00 0.00 O ATOM 448 CB VAL A 31 -3.867 4.347 1.644 1.00 0.00 C ATOM 449 CG1 VAL A 31 -4.111 2.912 2.085 1.00 0.00 C ATOM 450 CG2 VAL A 31 -2.880 4.396 0.488 1.00 0.00 C ATOM 0 H VAL A 31 -4.042 6.762 1.022 1.00 0.00 H new ATOM 0 HA VAL A 31 -5.616 4.503 0.393 1.00 0.00 H new ATOM 0 HB VAL A 31 -3.436 4.892 2.484 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -3.163 2.449 2.359 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -4.780 2.905 2.945 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -4.565 2.352 1.267 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -1.949 3.913 0.784 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -3.301 3.876 -0.372 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -2.681 5.434 0.223 1.00 0.00 H new ATOM 460 N ILE A 32 -5.777 5.533 3.547 1.00 0.00 N ATOM 461 CA ILE A 32 -6.614 5.525 4.741 1.00 0.00 C ATOM 462 C ILE A 32 -8.035 5.975 4.419 1.00 0.00 C ATOM 463 O ILE A 32 -8.995 5.236 4.636 1.00 0.00 O ATOM 464 CB ILE A 32 -6.036 6.436 5.840 1.00 0.00 C ATOM 465 CG1 ILE A 32 -4.612 6.005 6.194 1.00 0.00 C ATOM 466 CG2 ILE A 32 -6.925 6.409 7.073 1.00 0.00 C ATOM 467 CD1 ILE A 32 -3.841 7.046 6.976 1.00 0.00 C ATOM 0 H ILE A 32 -4.891 6.027 3.656 1.00 0.00 H new ATOM 0 HA ILE A 32 -6.634 4.498 5.105 1.00 0.00 H new ATOM 0 HB ILE A 32 -6.003 7.458 5.463 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -4.654 5.084 6.775 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -4.071 5.778 5.275 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -6.503 7.058 7.840 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -7.923 6.760 6.810 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -6.988 5.390 7.454 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -2.840 6.672 7.192 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -3.767 7.961 6.389 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -4.359 7.256 7.912 1.00 0.00 H new ATOM 479 N GLY A 33 -8.162 7.192 3.899 1.00 0.00 N ATOM 480 CA GLY A 33 -9.470 7.718 3.554 1.00 0.00 C ATOM 481 C GLY A 33 -10.250 8.176 4.770 1.00 0.00 C ATOM 482 O GLY A 33 -9.775 8.060 5.899 1.00 0.00 O ATOM 0 H GLY A 33 -7.383 7.823 3.711 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -9.352 8.555 2.866 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -10.039 6.951 3.029 1.00 0.00 H new ATOM 486 N GLN A 34 -11.450 8.698 4.539 1.00 0.00 N ATOM 487 CA GLN A 34 -12.296 9.177 5.626 1.00 0.00 C ATOM 488 C GLN A 34 -12.851 8.012 6.438 1.00 0.00 C ATOM 489 O GLN A 34 -13.024 6.907 5.922 1.00 0.00 O ATOM 490 CB GLN A 34 -13.446 10.020 5.072 1.00 0.00 C ATOM 491 CG GLN A 34 -13.108 11.496 4.935 1.00 0.00 C ATOM 492 CD GLN A 34 -12.400 12.048 6.156 1.00 0.00 C ATOM 493 OE1 GLN A 34 -12.696 11.661 7.287 1.00 0.00 O ATOM 494 NE2 GLN A 34 -11.458 12.957 5.935 1.00 0.00 N ATOM 0 H GLN A 34 -11.858 8.800 3.610 1.00 0.00 H new ATOM 0 HA GLN A 34 -11.684 9.795 6.283 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -13.734 9.630 4.096 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -14.311 9.913 5.726 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -12.477 11.641 4.058 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -14.025 12.061 4.765 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -11.245 13.249 4.981 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -10.947 13.363 6.719 1.00 0.00 H new ATOM 503 N LYS A 35 -13.125 8.263 7.714 1.00 0.00 N ATOM 504 CA LYS A 35 -13.661 7.236 8.599 1.00 0.00 C ATOM 505 C LYS A 35 -12.949 5.905 8.381 1.00 0.00 C ATOM 506 O LYS A 35 -13.542 4.839 8.541 1.00 0.00 O ATOM 507 CB LYS A 35 -15.164 7.067 8.367 1.00 0.00 C ATOM 508 CG LYS A 35 -15.939 8.372 8.420 1.00 0.00 C ATOM 509 CD LYS A 35 -17.242 8.278 7.644 1.00 0.00 C ATOM 510 CE LYS A 35 -17.018 8.460 6.151 1.00 0.00 C ATOM 511 NZ LYS A 35 -16.582 7.194 5.499 1.00 0.00 N ATOM 0 H LYS A 35 -12.984 9.170 8.158 1.00 0.00 H new ATOM 0 HA LYS A 35 -13.492 7.554 9.628 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -15.323 6.599 7.395 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -15.564 6.386 9.118 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -16.150 8.629 9.458 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -15.328 9.176 8.011 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -17.706 7.309 7.827 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -17.936 9.038 8.004 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -17.939 8.810 5.685 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -16.265 9.231 5.988 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -17.038 7.108 4.568 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -15.549 7.203 5.379 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -16.854 6.386 6.094 1.00 0.00 H new ATOM 525 N GLY A 36 -11.672 5.974 8.017 1.00 0.00 N ATOM 526 CA GLY A 36 -10.900 4.768 7.785 1.00 0.00 C ATOM 527 C GLY A 36 -11.706 3.688 7.091 1.00 0.00 C ATOM 528 O GLY A 36 -11.830 2.574 7.598 1.00 0.00 O ATOM 0 H GLY A 36 -11.158 6.844 7.879 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -10.026 5.010 7.180 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -10.532 4.387 8.738 1.00 0.00 H new ATOM 532 N SER A 37 -12.256 4.020 5.927 1.00 0.00 N ATOM 533 CA SER A 37 -13.061 3.071 5.164 1.00 0.00 C ATOM 534 C SER A 37 -12.228 2.411 4.070 1.00 0.00 C ATOM 535 O SER A 37 -12.198 1.187 3.949 1.00 0.00 O ATOM 536 CB SER A 37 -14.270 3.776 4.547 1.00 0.00 C ATOM 537 OG SER A 37 -15.304 2.853 4.254 1.00 0.00 O ATOM 0 H SER A 37 -12.159 4.937 5.492 1.00 0.00 H new ATOM 0 HA SER A 37 -13.412 2.297 5.846 1.00 0.00 H new ATOM 0 HB2 SER A 37 -14.641 4.536 5.234 1.00 0.00 H new ATOM 0 HB3 SER A 37 -13.968 4.291 3.635 1.00 0.00 H new ATOM 0 HG SER A 37 -16.066 3.329 3.862 1.00 0.00 H new ATOM 543 N GLY A 38 -11.552 3.233 3.272 1.00 0.00 N ATOM 544 CA GLY A 38 -10.729 2.711 2.196 1.00 0.00 C ATOM 545 C GLY A 38 -9.965 1.466 2.601 1.00 0.00 C ATOM 546 O GLY A 38 -10.173 0.392 2.037 1.00 0.00 O ATOM 0 H GLY A 38 -11.560 4.250 3.351 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -11.361 2.482 1.338 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -10.024 3.479 1.877 1.00 0.00 H new ATOM 550 N ILE A 39 -9.080 1.609 3.581 1.00 0.00 N ATOM 551 CA ILE A 39 -8.284 0.486 4.061 1.00 0.00 C ATOM 552 C ILE A 39 -9.173 -0.621 4.617 1.00 0.00 C ATOM 553 O ILE A 39 -8.923 -1.804 4.390 1.00 0.00 O ATOM 554 CB ILE A 39 -7.289 0.926 5.151 1.00 0.00 C ATOM 555 CG1 ILE A 39 -6.210 1.831 4.553 1.00 0.00 C ATOM 556 CG2 ILE A 39 -6.660 -0.289 5.816 1.00 0.00 C ATOM 557 CD1 ILE A 39 -5.318 2.477 5.590 1.00 0.00 C ATOM 0 H ILE A 39 -8.896 2.491 4.058 1.00 0.00 H new ATOM 0 HA ILE A 39 -7.727 0.106 3.205 1.00 0.00 H new ATOM 0 HB ILE A 39 -7.831 1.491 5.909 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -5.594 1.246 3.870 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -6.689 2.611 3.961 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -5.959 0.039 6.584 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -7.440 -0.898 6.273 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -6.130 -0.879 5.069 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -4.577 3.104 5.093 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -5.922 3.090 6.259 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -4.811 1.703 6.166 1.00 0.00 H new ATOM 569 N ARG A 40 -10.212 -0.227 5.345 1.00 0.00 N ATOM 570 CA ARG A 40 -11.140 -1.186 5.933 1.00 0.00 C ATOM 571 C ARG A 40 -11.461 -2.306 4.948 1.00 0.00 C ATOM 572 O ARG A 40 -11.354 -3.488 5.278 1.00 0.00 O ATOM 573 CB ARG A 40 -12.431 -0.484 6.362 1.00 0.00 C ATOM 574 CG ARG A 40 -13.234 -1.261 7.390 1.00 0.00 C ATOM 575 CD ARG A 40 -14.331 -0.405 8.003 1.00 0.00 C ATOM 576 NE ARG A 40 -15.321 -1.210 8.716 1.00 0.00 N ATOM 577 CZ ARG A 40 -16.433 -0.710 9.242 1.00 0.00 C ATOM 578 NH1 ARG A 40 -16.697 0.585 9.137 1.00 0.00 N ATOM 579 NH2 ARG A 40 -17.284 -1.506 9.876 1.00 0.00 N ATOM 0 H ARG A 40 -10.433 0.749 5.542 1.00 0.00 H new ATOM 0 HA ARG A 40 -10.663 -1.622 6.811 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -12.183 0.495 6.772 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -13.051 -0.314 5.482 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -13.676 -2.139 6.920 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -12.570 -1.621 8.176 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -13.887 0.315 8.690 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -14.826 0.166 7.218 1.00 0.00 H new ATOM 0 HE ARG A 40 -15.148 -2.210 8.815 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -16.045 1.201 8.651 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -17.552 0.966 9.542 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -17.084 -2.503 9.960 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -18.138 -1.121 10.280 1.00 0.00 H new ATOM 593 N LYS A 41 -11.856 -1.928 3.738 1.00 0.00 N ATOM 594 CA LYS A 41 -12.193 -2.899 2.703 1.00 0.00 C ATOM 595 C LYS A 41 -11.176 -4.035 2.673 1.00 0.00 C ATOM 596 O LYS A 41 -11.543 -5.207 2.576 1.00 0.00 O ATOM 597 CB LYS A 41 -12.250 -2.217 1.335 1.00 0.00 C ATOM 598 CG LYS A 41 -12.153 -3.185 0.168 1.00 0.00 C ATOM 599 CD LYS A 41 -10.709 -3.406 -0.253 1.00 0.00 C ATOM 600 CE LYS A 41 -10.621 -4.236 -1.524 1.00 0.00 C ATOM 601 NZ LYS A 41 -9.305 -4.921 -1.650 1.00 0.00 N ATOM 0 H LYS A 41 -11.951 -0.954 3.449 1.00 0.00 H new ATOM 0 HA LYS A 41 -13.173 -3.316 2.936 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -13.182 -1.658 1.256 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -11.438 -1.494 1.265 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -12.602 -4.138 0.446 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -12.724 -2.798 -0.676 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -10.223 -2.443 -0.411 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -10.168 -3.908 0.549 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -11.419 -4.979 -1.528 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -10.780 -3.593 -2.389 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -9.285 -5.476 -2.529 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -8.545 -4.211 -1.671 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -9.164 -5.555 -0.837 1.00 0.00 H new ATOM 615 N MET A 42 -9.897 -3.683 2.759 1.00 0.00 N ATOM 616 CA MET A 42 -8.829 -4.675 2.745 1.00 0.00 C ATOM 617 C MET A 42 -8.801 -5.464 4.050 1.00 0.00 C ATOM 618 O MET A 42 -8.886 -6.692 4.046 1.00 0.00 O ATOM 619 CB MET A 42 -7.477 -3.996 2.516 1.00 0.00 C ATOM 620 CG MET A 42 -7.412 -3.189 1.230 1.00 0.00 C ATOM 621 SD MET A 42 -6.086 -1.967 1.244 1.00 0.00 S ATOM 622 CE MET A 42 -4.647 -3.027 1.130 1.00 0.00 C ATOM 0 H MET A 42 -9.576 -2.718 2.839 1.00 0.00 H new ATOM 0 HA MET A 42 -9.023 -5.369 1.927 1.00 0.00 H new ATOM 0 HB2 MET A 42 -7.262 -3.339 3.359 1.00 0.00 H new ATOM 0 HB3 MET A 42 -6.696 -4.756 2.498 1.00 0.00 H new ATOM 0 HG2 MET A 42 -7.268 -3.866 0.388 1.00 0.00 H new ATOM 0 HG3 MET A 42 -8.365 -2.684 1.074 1.00 0.00 H new ATOM 0 HE1 MET A 42 -3.868 -2.655 1.795 1.00 0.00 H new ATOM 0 HE2 MET A 42 -4.919 -4.042 1.421 1.00 0.00 H new ATOM 0 HE3 MET A 42 -4.278 -3.030 0.104 1.00 0.00 H new ATOM 632 N MET A 43 -8.682 -4.750 5.165 1.00 0.00 N ATOM 633 CA MET A 43 -8.644 -5.384 6.478 1.00 0.00 C ATOM 634 C MET A 43 -9.736 -6.442 6.602 1.00 0.00 C ATOM 635 O MET A 43 -9.575 -7.434 7.314 1.00 0.00 O ATOM 636 CB MET A 43 -8.806 -4.336 7.579 1.00 0.00 C ATOM 637 CG MET A 43 -7.554 -3.508 7.819 1.00 0.00 C ATOM 638 SD MET A 43 -7.532 -2.740 9.450 1.00 0.00 S ATOM 639 CE MET A 43 -8.711 -1.412 9.215 1.00 0.00 C ATOM 0 H MET A 43 -8.610 -3.733 5.185 1.00 0.00 H new ATOM 0 HA MET A 43 -7.676 -5.871 6.591 1.00 0.00 H new ATOM 0 HB2 MET A 43 -9.628 -3.670 7.317 1.00 0.00 H new ATOM 0 HB3 MET A 43 -9.085 -4.836 8.507 1.00 0.00 H new ATOM 0 HG2 MET A 43 -6.676 -4.144 7.709 1.00 0.00 H new ATOM 0 HG3 MET A 43 -7.484 -2.733 7.056 1.00 0.00 H new ATOM 0 HE1 MET A 43 -8.807 -0.843 10.140 1.00 0.00 H new ATOM 0 HE2 MET A 43 -8.364 -0.754 8.419 1.00 0.00 H new ATOM 0 HE3 MET A 43 -9.680 -1.830 8.943 1.00 0.00 H new ATOM 649 N ASP A 44 -10.847 -6.225 5.905 1.00 0.00 N ATOM 650 CA ASP A 44 -11.965 -7.160 5.937 1.00 0.00 C ATOM 651 C ASP A 44 -11.775 -8.269 4.908 1.00 0.00 C ATOM 652 O ASP A 44 -12.048 -9.437 5.183 1.00 0.00 O ATOM 653 CB ASP A 44 -13.280 -6.424 5.676 1.00 0.00 C ATOM 654 CG ASP A 44 -13.913 -5.898 6.949 1.00 0.00 C ATOM 655 OD1 ASP A 44 -13.215 -5.200 7.713 1.00 0.00 O ATOM 656 OD2 ASP A 44 -15.106 -6.187 7.182 1.00 0.00 O ATOM 0 H ASP A 44 -10.997 -5.409 5.311 1.00 0.00 H new ATOM 0 HA ASP A 44 -12.001 -7.612 6.928 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -13.099 -5.593 4.994 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -13.977 -7.098 5.179 1.00 0.00 H new ATOM 661 N GLU A 45 -11.306 -7.895 3.722 1.00 0.00 N ATOM 662 CA GLU A 45 -11.082 -8.860 2.651 1.00 0.00 C ATOM 663 C GLU A 45 -9.922 -9.790 2.991 1.00 0.00 C ATOM 664 O GLU A 45 -10.096 -11.004 3.102 1.00 0.00 O ATOM 665 CB GLU A 45 -10.801 -8.136 1.333 1.00 0.00 C ATOM 666 CG GLU A 45 -10.590 -9.074 0.156 1.00 0.00 C ATOM 667 CD GLU A 45 -11.893 -9.481 -0.505 1.00 0.00 C ATOM 668 OE1 GLU A 45 -12.927 -9.512 0.192 1.00 0.00 O ATOM 669 OE2 GLU A 45 -11.877 -9.769 -1.721 1.00 0.00 O ATOM 0 H GLU A 45 -11.074 -6.932 3.478 1.00 0.00 H new ATOM 0 HA GLU A 45 -11.986 -9.460 2.542 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -11.634 -7.469 1.110 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -9.915 -7.512 1.453 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -9.949 -8.589 -0.580 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -10.065 -9.967 0.497 1.00 0.00 H new ATOM 676 N PHE A 46 -8.736 -9.212 3.154 1.00 0.00 N ATOM 677 CA PHE A 46 -7.545 -9.989 3.480 1.00 0.00 C ATOM 678 C PHE A 46 -7.557 -10.413 4.946 1.00 0.00 C ATOM 679 O PHE A 46 -6.686 -11.158 5.394 1.00 0.00 O ATOM 680 CB PHE A 46 -6.284 -9.176 3.183 1.00 0.00 C ATOM 681 CG PHE A 46 -6.146 -8.790 1.738 1.00 0.00 C ATOM 682 CD1 PHE A 46 -5.826 -9.739 0.781 1.00 0.00 C ATOM 683 CD2 PHE A 46 -6.336 -7.476 1.338 1.00 0.00 C ATOM 684 CE1 PHE A 46 -5.699 -9.386 -0.549 1.00 0.00 C ATOM 685 CE2 PHE A 46 -6.211 -7.119 0.008 1.00 0.00 C ATOM 686 CZ PHE A 46 -5.890 -8.074 -0.936 1.00 0.00 C ATOM 0 H PHE A 46 -8.574 -8.209 3.066 1.00 0.00 H new ATOM 0 HA PHE A 46 -7.545 -10.886 2.861 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -6.292 -8.273 3.793 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -5.410 -9.755 3.481 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -5.674 -10.766 1.078 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -6.584 -6.724 2.072 1.00 0.00 H new ATOM 0 HE1 PHE A 46 -5.450 -10.136 -1.286 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -6.364 -6.093 -0.292 1.00 0.00 H new ATOM 0 HZ PHE A 46 -5.788 -7.796 -1.975 1.00 0.00 H new ATOM 696 N GLU A 47 -8.551 -9.934 5.687 1.00 0.00 N ATOM 697 CA GLU A 47 -8.675 -10.262 7.102 1.00 0.00 C ATOM 698 C GLU A 47 -7.389 -9.929 7.853 1.00 0.00 C ATOM 699 O GLU A 47 -6.859 -10.755 8.596 1.00 0.00 O ATOM 700 CB GLU A 47 -9.011 -11.744 7.277 1.00 0.00 C ATOM 701 CG GLU A 47 -10.403 -12.114 6.792 1.00 0.00 C ATOM 702 CD GLU A 47 -10.783 -13.539 7.140 1.00 0.00 C ATOM 703 OE1 GLU A 47 -10.488 -13.971 8.274 1.00 0.00 O ATOM 704 OE2 GLU A 47 -11.376 -14.224 6.280 1.00 0.00 O ATOM 0 H GLU A 47 -9.282 -9.318 5.331 1.00 0.00 H new ATOM 0 HA GLU A 47 -9.484 -9.661 7.518 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -8.276 -12.341 6.736 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -8.921 -12.006 8.331 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -11.130 -11.431 7.231 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -10.454 -11.982 5.711 1.00 0.00 H new ATOM 711 N VAL A 48 -6.891 -8.714 7.652 1.00 0.00 N ATOM 712 CA VAL A 48 -5.668 -8.270 8.310 1.00 0.00 C ATOM 713 C VAL A 48 -5.842 -6.883 8.916 1.00 0.00 C ATOM 714 O VAL A 48 -6.891 -6.257 8.770 1.00 0.00 O ATOM 715 CB VAL A 48 -4.481 -8.244 7.328 1.00 0.00 C ATOM 716 CG1 VAL A 48 -4.011 -9.659 7.023 1.00 0.00 C ATOM 717 CG2 VAL A 48 -4.862 -7.513 6.050 1.00 0.00 C ATOM 0 H VAL A 48 -7.316 -8.019 7.038 1.00 0.00 H new ATOM 0 HA VAL A 48 -5.458 -8.986 9.104 1.00 0.00 H new ATOM 0 HB VAL A 48 -3.657 -7.705 7.795 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -3.172 -9.622 6.328 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -3.696 -10.145 7.947 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -4.828 -10.225 6.576 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -4.011 -7.505 5.368 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -5.702 -8.022 5.576 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -5.146 -6.488 6.288 1.00 0.00 H new ATOM 727 N ASN A 49 -4.805 -6.406 9.598 1.00 0.00 N ATOM 728 CA ASN A 49 -4.842 -5.090 10.227 1.00 0.00 C ATOM 729 C ASN A 49 -3.708 -4.209 9.713 1.00 0.00 C ATOM 730 O ASN A 49 -2.534 -4.478 9.970 1.00 0.00 O ATOM 731 CB ASN A 49 -4.748 -5.227 11.748 1.00 0.00 C ATOM 732 CG ASN A 49 -5.975 -5.890 12.346 1.00 0.00 C ATOM 733 OD1 ASN A 49 -7.091 -5.712 11.857 1.00 0.00 O ATOM 734 ND2 ASN A 49 -5.771 -6.660 13.409 1.00 0.00 N ATOM 0 H ASN A 49 -3.929 -6.911 9.729 1.00 0.00 H new ATOM 0 HA ASN A 49 -5.790 -4.618 9.969 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -3.863 -5.809 12.004 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -4.619 -4.240 12.192 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -6.557 -7.133 13.855 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -4.828 -6.778 13.780 1.00 0.00 H new ATOM 741 N ILE A 50 -4.068 -3.156 8.988 1.00 0.00 N ATOM 742 CA ILE A 50 -3.080 -2.234 8.439 1.00 0.00 C ATOM 743 C ILE A 50 -2.880 -1.033 9.358 1.00 0.00 C ATOM 744 O ILE A 50 -3.844 -0.460 9.866 1.00 0.00 O ATOM 745 CB ILE A 50 -3.491 -1.735 7.042 1.00 0.00 C ATOM 746 CG1 ILE A 50 -3.449 -2.884 6.033 1.00 0.00 C ATOM 747 CG2 ILE A 50 -2.583 -0.598 6.597 1.00 0.00 C ATOM 748 CD1 ILE A 50 -3.876 -2.481 4.639 1.00 0.00 C ATOM 0 H ILE A 50 -5.035 -2.919 8.767 1.00 0.00 H new ATOM 0 HA ILE A 50 -2.144 -2.786 8.357 1.00 0.00 H new ATOM 0 HB ILE A 50 -4.513 -1.359 7.093 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -2.436 -3.284 5.992 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -4.095 -3.688 6.384 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -2.886 -0.256 5.607 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -2.659 0.227 7.305 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -1.552 -0.949 6.559 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -3.821 -3.346 3.977 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -4.900 -2.109 4.666 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -3.215 -1.698 4.268 1.00 0.00 H new ATOM 760 N HIS A 51 -1.624 -0.655 9.564 1.00 0.00 N ATOM 761 CA HIS A 51 -1.297 0.481 10.419 1.00 0.00 C ATOM 762 C HIS A 51 -0.434 1.493 9.671 1.00 0.00 C ATOM 763 O HIS A 51 0.600 1.144 9.103 1.00 0.00 O ATOM 764 CB HIS A 51 -0.571 0.006 11.678 1.00 0.00 C ATOM 765 CG HIS A 51 -1.495 -0.389 12.789 1.00 0.00 C ATOM 766 ND1 HIS A 51 -1.577 0.302 13.979 1.00 0.00 N ATOM 767 CD2 HIS A 51 -2.381 -1.407 12.884 1.00 0.00 C ATOM 768 CE1 HIS A 51 -2.472 -0.277 14.760 1.00 0.00 C ATOM 769 NE2 HIS A 51 -2.975 -1.316 14.118 1.00 0.00 N ATOM 0 H HIS A 51 -0.815 -1.118 9.151 1.00 0.00 H new ATOM 0 HA HIS A 51 -2.229 0.967 10.708 1.00 0.00 H new ATOM 0 HB2 HIS A 51 0.062 -0.844 11.424 1.00 0.00 H new ATOM 0 HB3 HIS A 51 0.088 0.800 12.029 1.00 0.00 H new ATOM 0 HD2 HIS A 51 -2.583 -2.153 12.129 1.00 0.00 H new ATOM 0 HE1 HIS A 51 -2.746 0.045 15.754 1.00 0.00 H new ATOM 0 HE2 HIS A 51 -3.689 -1.948 14.480 1.00 0.00 H new ATOM 777 N VAL A 52 -0.867 2.750 9.675 1.00 0.00 N ATOM 778 CA VAL A 52 -0.134 3.813 8.999 1.00 0.00 C ATOM 779 C VAL A 52 0.494 4.774 10.003 1.00 0.00 C ATOM 780 O VAL A 52 -0.112 5.141 11.010 1.00 0.00 O ATOM 781 CB VAL A 52 -1.049 4.608 8.048 1.00 0.00 C ATOM 782 CG1 VAL A 52 -0.288 5.762 7.414 1.00 0.00 C ATOM 783 CG2 VAL A 52 -1.631 3.693 6.981 1.00 0.00 C ATOM 0 H VAL A 52 -1.722 3.057 10.139 1.00 0.00 H new ATOM 0 HA VAL A 52 0.654 3.334 8.418 1.00 0.00 H new ATOM 0 HB VAL A 52 -1.873 5.023 8.628 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -0.951 6.312 6.746 1.00 0.00 H new ATOM 0 HG12 VAL A 52 0.076 6.430 8.194 1.00 0.00 H new ATOM 0 HG13 VAL A 52 0.557 5.372 6.847 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -2.275 4.271 6.318 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -0.822 3.247 6.403 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -2.214 2.904 7.457 1.00 0.00 H new ATOM 793 N PRO A 53 1.737 5.192 9.724 1.00 0.00 N ATOM 794 CA PRO A 53 2.475 6.116 10.590 1.00 0.00 C ATOM 795 C PRO A 53 1.890 7.525 10.566 1.00 0.00 C ATOM 796 O PRO A 53 1.519 8.035 9.509 1.00 0.00 O ATOM 797 CB PRO A 53 3.884 6.112 9.995 1.00 0.00 C ATOM 798 CG PRO A 53 3.692 5.736 8.566 1.00 0.00 C ATOM 799 CD PRO A 53 2.519 4.794 8.541 1.00 0.00 C ATOM 0 HA PRO A 53 2.439 5.811 11.636 1.00 0.00 H new ATOM 0 HB2 PRO A 53 4.355 7.091 10.087 1.00 0.00 H new ATOM 0 HB3 PRO A 53 4.528 5.399 10.509 1.00 0.00 H new ATOM 0 HG2 PRO A 53 3.499 6.616 7.953 1.00 0.00 H new ATOM 0 HG3 PRO A 53 4.585 5.258 8.165 1.00 0.00 H new ATOM 0 HD2 PRO A 53 1.940 4.897 7.623 1.00 0.00 H new ATOM 0 HD3 PRO A 53 2.838 3.753 8.601 1.00 0.00 H new ATOM 807 N ALA A 54 1.811 8.149 11.736 1.00 0.00 N ATOM 808 CA ALA A 54 1.275 9.500 11.848 1.00 0.00 C ATOM 809 C ALA A 54 2.094 10.485 11.022 1.00 0.00 C ATOM 810 O ALA A 54 3.214 10.198 10.599 1.00 0.00 O ATOM 811 CB ALA A 54 1.235 9.933 13.305 1.00 0.00 C ATOM 0 H ALA A 54 2.112 7.740 12.621 1.00 0.00 H new ATOM 0 HA ALA A 54 0.258 9.495 11.455 1.00 0.00 H new ATOM 0 HB1 ALA A 54 0.833 10.944 13.373 1.00 0.00 H new ATOM 0 HB2 ALA A 54 0.600 9.251 13.870 1.00 0.00 H new ATOM 0 HB3 ALA A 54 2.244 9.915 13.718 1.00 0.00 H new ATOM 817 N PRO A 55 1.524 11.676 10.784 1.00 0.00 N ATOM 818 CA PRO A 55 2.185 12.729 10.007 1.00 0.00 C ATOM 819 C PRO A 55 3.373 13.335 10.745 1.00 0.00 C ATOM 820 O PRO A 55 4.312 13.833 10.124 1.00 0.00 O ATOM 821 CB PRO A 55 1.083 13.775 9.817 1.00 0.00 C ATOM 822 CG PRO A 55 0.157 13.562 10.965 1.00 0.00 C ATOM 823 CD PRO A 55 0.191 12.087 11.256 1.00 0.00 C ATOM 0 HA PRO A 55 2.596 12.348 9.072 1.00 0.00 H new ATOM 0 HB2 PRO A 55 1.492 14.786 9.820 1.00 0.00 H new ATOM 0 HB3 PRO A 55 0.570 13.641 8.865 1.00 0.00 H new ATOM 0 HG2 PRO A 55 0.474 14.139 11.834 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -0.853 13.888 10.717 1.00 0.00 H new ATOM 0 HD2 PRO A 55 0.061 11.884 12.319 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -0.603 11.556 10.731 1.00 0.00 H new ATOM 831 N GLU A 56 3.326 13.290 12.073 1.00 0.00 N ATOM 832 CA GLU A 56 4.400 13.835 12.894 1.00 0.00 C ATOM 833 C GLU A 56 5.634 12.939 12.842 1.00 0.00 C ATOM 834 O GLU A 56 6.710 13.318 13.305 1.00 0.00 O ATOM 835 CB GLU A 56 3.933 13.995 14.342 1.00 0.00 C ATOM 836 CG GLU A 56 3.467 12.696 14.979 1.00 0.00 C ATOM 837 CD GLU A 56 3.475 12.753 16.494 1.00 0.00 C ATOM 838 OE1 GLU A 56 2.528 13.325 17.072 1.00 0.00 O ATOM 839 OE2 GLU A 56 4.430 12.226 17.102 1.00 0.00 O ATOM 0 H GLU A 56 2.556 12.882 12.603 1.00 0.00 H new ATOM 0 HA GLU A 56 4.667 14.814 12.495 1.00 0.00 H new ATOM 0 HB2 GLU A 56 4.749 14.408 14.935 1.00 0.00 H new ATOM 0 HB3 GLU A 56 3.118 14.718 14.374 1.00 0.00 H new ATOM 0 HG2 GLU A 56 2.459 12.467 14.633 1.00 0.00 H new ATOM 0 HG3 GLU A 56 4.110 11.881 14.646 1.00 0.00 H new ATOM 846 N LEU A 57 5.469 11.748 12.276 1.00 0.00 N ATOM 847 CA LEU A 57 6.569 10.797 12.163 1.00 0.00 C ATOM 848 C LEU A 57 7.240 10.899 10.797 1.00 0.00 C ATOM 849 O LEU A 57 8.410 10.553 10.642 1.00 0.00 O ATOM 850 CB LEU A 57 6.061 9.371 12.388 1.00 0.00 C ATOM 851 CG LEU A 57 5.396 9.102 13.738 1.00 0.00 C ATOM 852 CD1 LEU A 57 4.687 7.757 13.724 1.00 0.00 C ATOM 853 CD2 LEU A 57 6.425 9.153 14.859 1.00 0.00 C ATOM 0 H LEU A 57 4.585 11.418 11.889 1.00 0.00 H new ATOM 0 HA LEU A 57 7.306 11.040 12.928 1.00 0.00 H new ATOM 0 HB2 LEU A 57 5.347 9.132 11.600 1.00 0.00 H new ATOM 0 HB3 LEU A 57 6.901 8.685 12.276 1.00 0.00 H new ATOM 0 HG LEU A 57 4.654 9.880 13.918 1.00 0.00 H new ATOM 0 HD11 LEU A 57 4.219 7.582 14.693 1.00 0.00 H new ATOM 0 HD12 LEU A 57 3.923 7.757 12.947 1.00 0.00 H new ATOM 0 HD13 LEU A 57 5.410 6.967 13.522 1.00 0.00 H new ATOM 0 HD21 LEU A 57 5.934 8.959 15.813 1.00 0.00 H new ATOM 0 HD22 LEU A 57 7.191 8.397 14.685 1.00 0.00 H new ATOM 0 HD23 LEU A 57 6.888 10.139 14.883 1.00 0.00 H new ATOM 865 N GLN A 58 6.490 11.379 9.809 1.00 0.00 N ATOM 866 CA GLN A 58 7.014 11.528 8.456 1.00 0.00 C ATOM 867 C GLN A 58 7.649 10.230 7.972 1.00 0.00 C ATOM 868 O GLN A 58 8.777 10.226 7.477 1.00 0.00 O ATOM 869 CB GLN A 58 8.040 12.662 8.406 1.00 0.00 C ATOM 870 CG GLN A 58 7.566 13.943 9.075 1.00 0.00 C ATOM 871 CD GLN A 58 8.462 15.126 8.771 1.00 0.00 C ATOM 872 OE1 GLN A 58 9.400 15.023 7.980 1.00 0.00 O ATOM 873 NE2 GLN A 58 8.177 16.261 9.399 1.00 0.00 N ATOM 0 H GLN A 58 5.519 11.671 9.920 1.00 0.00 H new ATOM 0 HA GLN A 58 6.182 11.771 7.796 1.00 0.00 H new ATOM 0 HB2 GLN A 58 8.960 12.330 8.887 1.00 0.00 H new ATOM 0 HB3 GLN A 58 8.284 12.874 7.365 1.00 0.00 H new ATOM 0 HG2 GLN A 58 6.551 14.166 8.745 1.00 0.00 H new ATOM 0 HG3 GLN A 58 7.525 13.791 10.154 1.00 0.00 H new ATOM 0 HE21 GLN A 58 7.390 16.302 10.047 1.00 0.00 H new ATOM 0 HE22 GLN A 58 8.745 17.092 9.234 1.00 0.00 H new ATOM 882 N SER A 59 6.918 9.129 8.117 1.00 0.00 N ATOM 883 CA SER A 59 7.413 7.823 7.698 1.00 0.00 C ATOM 884 C SER A 59 6.739 7.377 6.404 1.00 0.00 C ATOM 885 O SER A 59 5.582 7.710 6.147 1.00 0.00 O ATOM 886 CB SER A 59 7.169 6.786 8.797 1.00 0.00 C ATOM 887 OG SER A 59 8.141 5.756 8.750 1.00 0.00 O ATOM 0 H SER A 59 5.982 9.116 8.521 1.00 0.00 H new ATOM 0 HA SER A 59 8.485 7.908 7.519 1.00 0.00 H new ATOM 0 HB2 SER A 59 7.196 7.272 9.772 1.00 0.00 H new ATOM 0 HB3 SER A 59 6.174 6.357 8.682 1.00 0.00 H new ATOM 0 HG SER A 59 7.965 5.107 9.463 1.00 0.00 H new ATOM 893 N ASP A 60 7.472 6.622 5.594 1.00 0.00 N ATOM 894 CA ASP A 60 6.947 6.128 4.326 1.00 0.00 C ATOM 895 C ASP A 60 6.842 4.606 4.336 1.00 0.00 C ATOM 896 O ASP A 60 6.770 3.972 3.282 1.00 0.00 O ATOM 897 CB ASP A 60 7.837 6.583 3.169 1.00 0.00 C ATOM 898 CG ASP A 60 8.039 8.086 3.149 1.00 0.00 C ATOM 899 OD1 ASP A 60 7.046 8.820 3.337 1.00 0.00 O ATOM 900 OD2 ASP A 60 9.189 8.528 2.946 1.00 0.00 O ATOM 0 H ASP A 60 8.431 6.338 5.792 1.00 0.00 H new ATOM 0 HA ASP A 60 5.948 6.542 4.190 1.00 0.00 H new ATOM 0 HB2 ASP A 60 8.806 6.090 3.245 1.00 0.00 H new ATOM 0 HB3 ASP A 60 7.391 6.267 2.226 1.00 0.00 H new ATOM 905 N ILE A 61 6.838 4.027 5.531 1.00 0.00 N ATOM 906 CA ILE A 61 6.743 2.579 5.678 1.00 0.00 C ATOM 907 C ILE A 61 5.492 2.187 6.457 1.00 0.00 C ATOM 908 O ILE A 61 5.319 2.580 7.611 1.00 0.00 O ATOM 909 CB ILE A 61 7.980 2.004 6.391 1.00 0.00 C ATOM 910 CG1 ILE A 61 9.250 2.699 5.896 1.00 0.00 C ATOM 911 CG2 ILE A 61 8.070 0.502 6.166 1.00 0.00 C ATOM 912 CD1 ILE A 61 9.632 2.325 4.481 1.00 0.00 C ATOM 0 H ILE A 61 6.899 4.537 6.412 1.00 0.00 H new ATOM 0 HA ILE A 61 6.687 2.162 4.672 1.00 0.00 H new ATOM 0 HB ILE A 61 7.882 2.187 7.461 1.00 0.00 H new ATOM 0 HG12 ILE A 61 9.109 3.778 5.952 1.00 0.00 H new ATOM 0 HG13 ILE A 61 10.075 2.450 6.564 1.00 0.00 H new ATOM 0 HG21 ILE A 61 8.950 0.110 6.676 1.00 0.00 H new ATOM 0 HG22 ILE A 61 7.176 0.021 6.562 1.00 0.00 H new ATOM 0 HG23 ILE A 61 8.149 0.298 5.098 1.00 0.00 H new ATOM 0 HD11 ILE A 61 10.541 2.855 4.197 1.00 0.00 H new ATOM 0 HD12 ILE A 61 9.805 1.250 4.423 1.00 0.00 H new ATOM 0 HD13 ILE A 61 8.825 2.600 3.802 1.00 0.00 H new ATOM 924 N ILE A 62 4.625 1.408 5.819 1.00 0.00 N ATOM 925 CA ILE A 62 3.391 0.959 6.453 1.00 0.00 C ATOM 926 C ILE A 62 3.560 -0.429 7.063 1.00 0.00 C ATOM 927 O ILE A 62 4.251 -1.282 6.506 1.00 0.00 O ATOM 928 CB ILE A 62 2.221 0.930 5.452 1.00 0.00 C ATOM 929 CG1 ILE A 62 1.805 2.354 5.079 1.00 0.00 C ATOM 930 CG2 ILE A 62 1.044 0.163 6.035 1.00 0.00 C ATOM 931 CD1 ILE A 62 0.743 2.410 4.003 1.00 0.00 C ATOM 0 H ILE A 62 4.754 1.075 4.864 1.00 0.00 H new ATOM 0 HA ILE A 62 3.163 1.675 7.243 1.00 0.00 H new ATOM 0 HB ILE A 62 2.549 0.419 4.547 1.00 0.00 H new ATOM 0 HG12 ILE A 62 1.435 2.861 5.970 1.00 0.00 H new ATOM 0 HG13 ILE A 62 2.683 2.904 4.741 1.00 0.00 H new ATOM 0 HG21 ILE A 62 0.225 0.151 5.316 1.00 0.00 H new ATOM 0 HG22 ILE A 62 1.349 -0.860 6.254 1.00 0.00 H new ATOM 0 HG23 ILE A 62 0.713 0.647 6.954 1.00 0.00 H new ATOM 0 HD11 ILE A 62 0.497 3.450 3.789 1.00 0.00 H new ATOM 0 HD12 ILE A 62 1.117 1.932 3.098 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -0.151 1.889 4.346 1.00 0.00 H new ATOM 943 N ALA A 63 2.922 -0.648 8.207 1.00 0.00 N ATOM 944 CA ALA A 63 2.998 -1.933 8.890 1.00 0.00 C ATOM 945 C ALA A 63 1.674 -2.685 8.795 1.00 0.00 C ATOM 946 O ALA A 63 0.614 -2.131 9.089 1.00 0.00 O ATOM 947 CB ALA A 63 3.391 -1.735 10.346 1.00 0.00 C ATOM 0 H ALA A 63 2.346 0.048 8.681 1.00 0.00 H new ATOM 0 HA ALA A 63 3.763 -2.533 8.397 1.00 0.00 H new ATOM 0 HB1 ALA A 63 3.444 -2.703 10.844 1.00 0.00 H new ATOM 0 HB2 ALA A 63 4.364 -1.247 10.397 1.00 0.00 H new ATOM 0 HB3 ALA A 63 2.647 -1.112 10.842 1.00 0.00 H new ATOM 953 N ILE A 64 1.743 -3.946 8.382 1.00 0.00 N ATOM 954 CA ILE A 64 0.549 -4.772 8.250 1.00 0.00 C ATOM 955 C ILE A 64 0.634 -6.006 9.140 1.00 0.00 C ATOM 956 O ILE A 64 1.551 -6.818 9.012 1.00 0.00 O ATOM 957 CB ILE A 64 0.332 -5.218 6.792 1.00 0.00 C ATOM 958 CG1 ILE A 64 0.434 -4.017 5.849 1.00 0.00 C ATOM 959 CG2 ILE A 64 -1.018 -5.903 6.643 1.00 0.00 C ATOM 960 CD1 ILE A 64 0.341 -4.389 4.386 1.00 0.00 C ATOM 0 H ILE A 64 2.612 -4.418 8.133 1.00 0.00 H new ATOM 0 HA ILE A 64 -0.296 -4.159 8.563 1.00 0.00 H new ATOM 0 HB ILE A 64 1.111 -5.933 6.526 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -0.360 -3.310 6.087 1.00 0.00 H new ATOM 0 HG13 ILE A 64 1.380 -3.505 6.026 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -1.157 -6.212 5.607 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -1.055 -6.778 7.291 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -1.811 -5.210 6.924 1.00 0.00 H new ATOM 0 HD11 ILE A 64 0.421 -3.489 3.776 1.00 0.00 H new ATOM 0 HD12 ILE A 64 1.151 -5.073 4.132 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -0.616 -4.874 4.194 1.00 0.00 H new ATOM 972 N THR A 65 -0.331 -6.145 10.044 1.00 0.00 N ATOM 973 CA THR A 65 -0.368 -7.282 10.955 1.00 0.00 C ATOM 974 C THR A 65 -1.281 -8.381 10.427 1.00 0.00 C ATOM 975 O THR A 65 -2.352 -8.107 9.889 1.00 0.00 O ATOM 976 CB THR A 65 -0.846 -6.861 12.358 1.00 0.00 C ATOM 977 OG1 THR A 65 -0.003 -5.825 12.874 1.00 0.00 O ATOM 978 CG2 THR A 65 -0.840 -8.049 13.310 1.00 0.00 C ATOM 0 H THR A 65 -1.098 -5.483 10.165 1.00 0.00 H new ATOM 0 HA THR A 65 0.650 -7.664 11.025 1.00 0.00 H new ATOM 0 HB THR A 65 -1.867 -6.488 12.273 1.00 0.00 H new ATOM 0 HG1 THR A 65 -0.315 -5.563 13.765 1.00 0.00 H new ATOM 0 HG21 THR A 65 -1.181 -7.728 14.294 1.00 0.00 H new ATOM 0 HG22 THR A 65 -1.506 -8.823 12.930 1.00 0.00 H new ATOM 0 HG23 THR A 65 0.172 -8.447 13.389 1.00 0.00 H new ATOM 986 N GLY A 66 -0.850 -9.630 10.586 1.00 0.00 N ATOM 987 CA GLY A 66 -1.643 -10.753 10.120 1.00 0.00 C ATOM 988 C GLY A 66 -0.801 -11.985 9.853 1.00 0.00 C ATOM 989 O GLY A 66 0.428 -11.935 9.928 1.00 0.00 O ATOM 0 H GLY A 66 0.033 -9.883 11.029 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -2.404 -10.990 10.864 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -2.167 -10.470 9.207 1.00 0.00 H new ATOM 993 N LEU A 67 -1.462 -13.094 9.542 1.00 0.00 N ATOM 994 CA LEU A 67 -0.767 -14.347 9.265 1.00 0.00 C ATOM 995 C LEU A 67 0.058 -14.240 7.986 1.00 0.00 C ATOM 996 O LEU A 67 -0.396 -13.679 6.988 1.00 0.00 O ATOM 997 CB LEU A 67 -1.770 -15.494 9.144 1.00 0.00 C ATOM 998 CG LEU A 67 -2.495 -15.891 10.431 1.00 0.00 C ATOM 999 CD1 LEU A 67 -3.591 -16.902 10.137 1.00 0.00 C ATOM 1000 CD2 LEU A 67 -1.510 -16.449 11.448 1.00 0.00 C ATOM 0 H LEU A 67 -2.478 -13.152 9.475 1.00 0.00 H new ATOM 0 HA LEU A 67 -0.091 -14.551 10.096 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -2.517 -15.219 8.400 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -1.246 -16.370 8.761 1.00 0.00 H new ATOM 0 HG LEU A 67 -2.957 -14.999 10.854 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -4.095 -17.172 11.065 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -4.312 -16.466 9.446 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -3.153 -17.794 9.689 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -2.044 -16.726 12.357 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -1.018 -17.329 11.033 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -0.762 -15.692 11.683 1.00 0.00 H new ATOM 1012 N ALA A 68 1.269 -14.784 8.021 1.00 0.00 N ATOM 1013 CA ALA A 68 2.155 -14.755 6.864 1.00 0.00 C ATOM 1014 C ALA A 68 1.367 -14.907 5.567 1.00 0.00 C ATOM 1015 O ALA A 68 1.718 -14.318 4.544 1.00 0.00 O ATOM 1016 CB ALA A 68 3.208 -15.847 6.976 1.00 0.00 C ATOM 0 H ALA A 68 1.660 -15.251 8.839 1.00 0.00 H new ATOM 0 HA ALA A 68 2.655 -13.787 6.844 1.00 0.00 H new ATOM 0 HB1 ALA A 68 3.862 -15.813 6.105 1.00 0.00 H new ATOM 0 HB2 ALA A 68 3.798 -15.692 7.879 1.00 0.00 H new ATOM 0 HB3 ALA A 68 2.719 -16.820 7.025 1.00 0.00 H new ATOM 1022 N ALA A 69 0.303 -15.701 5.616 1.00 0.00 N ATOM 1023 CA ALA A 69 -0.534 -15.929 4.445 1.00 0.00 C ATOM 1024 C ALA A 69 -1.348 -14.686 4.101 1.00 0.00 C ATOM 1025 O ALA A 69 -1.398 -14.267 2.946 1.00 0.00 O ATOM 1026 CB ALA A 69 -1.456 -17.118 4.678 1.00 0.00 C ATOM 0 H ALA A 69 0.000 -16.197 6.454 1.00 0.00 H new ATOM 0 HA ALA A 69 0.119 -16.149 3.600 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -2.075 -17.277 3.795 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -0.859 -18.010 4.867 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -2.095 -16.920 5.539 1.00 0.00 H new ATOM 1032 N ASN A 70 -1.984 -14.103 5.111 1.00 0.00 N ATOM 1033 CA ASN A 70 -2.797 -12.908 4.915 1.00 0.00 C ATOM 1034 C ASN A 70 -1.931 -11.722 4.506 1.00 0.00 C ATOM 1035 O ASN A 70 -2.330 -10.903 3.676 1.00 0.00 O ATOM 1036 CB ASN A 70 -3.567 -12.575 6.194 1.00 0.00 C ATOM 1037 CG ASN A 70 -4.212 -13.798 6.816 1.00 0.00 C ATOM 1038 OD1 ASN A 70 -4.156 -14.895 6.259 1.00 0.00 O ATOM 1039 ND2 ASN A 70 -4.827 -13.615 7.979 1.00 0.00 N ATOM 0 H ASN A 70 -1.952 -14.438 6.074 1.00 0.00 H new ATOM 0 HA ASN A 70 -3.507 -13.109 4.113 1.00 0.00 H new ATOM 0 HB2 ASN A 70 -2.888 -12.119 6.915 1.00 0.00 H new ATOM 0 HB3 ASN A 70 -4.337 -11.836 5.970 1.00 0.00 H new ATOM 0 HD21 ASN A 70 -5.278 -14.401 8.447 1.00 0.00 H new ATOM 0 HD22 ASN A 70 -4.849 -12.688 8.404 1.00 0.00 H new ATOM 1046 N LEU A 71 -0.742 -11.634 5.092 1.00 0.00 N ATOM 1047 CA LEU A 71 0.183 -10.548 4.789 1.00 0.00 C ATOM 1048 C LEU A 71 0.568 -10.557 3.312 1.00 0.00 C ATOM 1049 O LEU A 71 0.757 -9.503 2.704 1.00 0.00 O ATOM 1050 CB LEU A 71 1.438 -10.664 5.656 1.00 0.00 C ATOM 1051 CG LEU A 71 1.204 -10.839 7.157 1.00 0.00 C ATOM 1052 CD1 LEU A 71 2.450 -11.392 7.830 1.00 0.00 C ATOM 1053 CD2 LEU A 71 0.795 -9.517 7.790 1.00 0.00 C ATOM 0 H LEU A 71 -0.396 -12.302 5.780 1.00 0.00 H new ATOM 0 HA LEU A 71 -0.317 -9.605 5.009 1.00 0.00 H new ATOM 0 HB2 LEU A 71 2.025 -11.510 5.299 1.00 0.00 H new ATOM 0 HB3 LEU A 71 2.043 -9.770 5.505 1.00 0.00 H new ATOM 0 HG LEU A 71 0.393 -11.553 7.299 1.00 0.00 H new ATOM 0 HD11 LEU A 71 2.265 -11.510 8.898 1.00 0.00 H new ATOM 0 HD12 LEU A 71 2.699 -12.360 7.396 1.00 0.00 H new ATOM 0 HD13 LEU A 71 3.281 -10.703 7.680 1.00 0.00 H new ATOM 0 HD21 LEU A 71 0.633 -9.660 8.858 1.00 0.00 H new ATOM 0 HD22 LEU A 71 1.585 -8.781 7.638 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -0.126 -9.162 7.327 1.00 0.00 H new ATOM 1065 N ASP A 72 0.681 -11.751 2.744 1.00 0.00 N ATOM 1066 CA ASP A 72 1.039 -11.898 1.337 1.00 0.00 C ATOM 1067 C ASP A 72 -0.076 -11.379 0.435 1.00 0.00 C ATOM 1068 O ASP A 72 0.144 -10.502 -0.400 1.00 0.00 O ATOM 1069 CB ASP A 72 1.334 -13.363 1.014 1.00 0.00 C ATOM 1070 CG ASP A 72 2.769 -13.745 1.318 1.00 0.00 C ATOM 1071 OD1 ASP A 72 3.623 -12.837 1.386 1.00 0.00 O ATOM 1072 OD2 ASP A 72 3.039 -14.954 1.487 1.00 0.00 O ATOM 0 H ASP A 72 0.530 -12.632 3.235 1.00 0.00 H new ATOM 0 HA ASP A 72 1.935 -11.306 1.152 1.00 0.00 H new ATOM 0 HB2 ASP A 72 0.662 -14.001 1.588 1.00 0.00 H new ATOM 0 HB3 ASP A 72 1.127 -13.548 -0.040 1.00 0.00 H new ATOM 1077 N ARG A 73 -1.274 -11.928 0.609 1.00 0.00 N ATOM 1078 CA ARG A 73 -2.424 -11.522 -0.191 1.00 0.00 C ATOM 1079 C ARG A 73 -2.682 -10.024 -0.052 1.00 0.00 C ATOM 1080 O ARG A 73 -2.964 -9.338 -1.034 1.00 0.00 O ATOM 1081 CB ARG A 73 -3.667 -12.305 0.230 1.00 0.00 C ATOM 1082 CG ARG A 73 -3.874 -12.357 1.735 1.00 0.00 C ATOM 1083 CD ARG A 73 -5.189 -13.032 2.094 1.00 0.00 C ATOM 1084 NE ARG A 73 -5.077 -14.489 2.079 1.00 0.00 N ATOM 1085 CZ ARG A 73 -5.212 -15.225 0.982 1.00 0.00 C ATOM 1086 NH1 ARG A 73 -5.462 -14.644 -0.183 1.00 0.00 N ATOM 1087 NH2 ARG A 73 -5.098 -16.545 1.049 1.00 0.00 N ATOM 0 H ARG A 73 -1.474 -12.655 1.296 1.00 0.00 H new ATOM 0 HA ARG A 73 -2.203 -11.740 -1.236 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -4.544 -11.854 -0.233 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -3.592 -13.323 -0.153 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -3.048 -12.897 2.198 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -3.861 -11.345 2.140 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -5.508 -12.703 3.083 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -5.961 -12.720 1.390 1.00 0.00 H new ATOM 0 HE ARG A 73 -4.885 -14.967 2.959 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -5.551 -13.629 -0.238 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -5.565 -15.212 -1.024 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -4.906 -16.996 1.944 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -5.202 -17.109 0.206 1.00 0.00 H new ATOM 1101 N ALA A 74 -2.583 -9.524 1.176 1.00 0.00 N ATOM 1102 CA ALA A 74 -2.805 -8.109 1.443 1.00 0.00 C ATOM 1103 C ALA A 74 -1.678 -7.258 0.867 1.00 0.00 C ATOM 1104 O ALA A 74 -1.915 -6.362 0.057 1.00 0.00 O ATOM 1105 CB ALA A 74 -2.937 -7.869 2.940 1.00 0.00 C ATOM 0 H ALA A 74 -2.351 -10.078 2.000 1.00 0.00 H new ATOM 0 HA ALA A 74 -3.734 -7.814 0.955 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -3.103 -6.808 3.125 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -3.780 -8.441 3.327 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -2.023 -8.186 3.441 1.00 0.00 H new ATOM 1111 N LYS A 75 -0.451 -7.544 1.291 1.00 0.00 N ATOM 1112 CA LYS A 75 0.713 -6.806 0.816 1.00 0.00 C ATOM 1113 C LYS A 75 0.726 -6.728 -0.707 1.00 0.00 C ATOM 1114 O LYS A 75 1.137 -5.722 -1.283 1.00 0.00 O ATOM 1115 CB LYS A 75 2.000 -7.469 1.314 1.00 0.00 C ATOM 1116 CG LYS A 75 3.262 -6.722 0.918 1.00 0.00 C ATOM 1117 CD LYS A 75 4.511 -7.463 1.361 1.00 0.00 C ATOM 1118 CE LYS A 75 5.774 -6.762 0.884 1.00 0.00 C ATOM 1119 NZ LYS A 75 6.259 -5.761 1.873 1.00 0.00 N ATOM 0 H LYS A 75 -0.238 -8.282 1.963 1.00 0.00 H new ATOM 0 HA LYS A 75 0.655 -5.792 1.213 1.00 0.00 H new ATOM 0 HB2 LYS A 75 1.961 -7.549 2.400 1.00 0.00 H new ATOM 0 HB3 LYS A 75 2.051 -8.485 0.922 1.00 0.00 H new ATOM 0 HG2 LYS A 75 3.282 -6.588 -0.164 1.00 0.00 H new ATOM 0 HG3 LYS A 75 3.251 -5.727 1.363 1.00 0.00 H new ATOM 0 HD2 LYS A 75 4.524 -7.538 2.448 1.00 0.00 H new ATOM 0 HD3 LYS A 75 4.489 -8.481 0.971 1.00 0.00 H new ATOM 0 HE2 LYS A 75 6.554 -7.502 0.704 1.00 0.00 H new ATOM 0 HE3 LYS A 75 5.578 -6.267 -0.067 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 6.354 -4.834 1.411 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 5.579 -5.689 2.656 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 7.184 -6.059 2.244 1.00 0.00 H new ATOM 1133 N ALA A 76 0.271 -7.796 -1.353 1.00 0.00 N ATOM 1134 CA ALA A 76 0.226 -7.848 -2.809 1.00 0.00 C ATOM 1135 C ALA A 76 -0.714 -6.785 -3.366 1.00 0.00 C ATOM 1136 O ALA A 76 -0.435 -6.175 -4.398 1.00 0.00 O ATOM 1137 CB ALA A 76 -0.202 -9.232 -3.276 1.00 0.00 C ATOM 0 H ALA A 76 -0.072 -8.638 -0.891 1.00 0.00 H new ATOM 0 HA ALA A 76 1.228 -7.644 -3.187 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -0.231 -9.256 -4.365 1.00 0.00 H new ATOM 0 HB2 ALA A 76 0.511 -9.974 -2.916 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -1.193 -9.459 -2.882 1.00 0.00 H new ATOM 1143 N GLY A 77 -1.831 -6.569 -2.679 1.00 0.00 N ATOM 1144 CA GLY A 77 -2.795 -5.580 -3.122 1.00 0.00 C ATOM 1145 C GLY A 77 -2.292 -4.161 -2.950 1.00 0.00 C ATOM 1146 O GLY A 77 -2.481 -3.316 -3.826 1.00 0.00 O ATOM 0 H GLY A 77 -2.085 -7.062 -1.823 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -3.032 -5.753 -4.172 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -3.722 -5.704 -2.561 1.00 0.00 H new ATOM 1150 N LEU A 78 -1.649 -3.896 -1.818 1.00 0.00 N ATOM 1151 CA LEU A 78 -1.118 -2.567 -1.533 1.00 0.00 C ATOM 1152 C LEU A 78 -0.041 -2.184 -2.543 1.00 0.00 C ATOM 1153 O LEU A 78 -0.190 -1.213 -3.286 1.00 0.00 O ATOM 1154 CB LEU A 78 -0.542 -2.520 -0.115 1.00 0.00 C ATOM 1155 CG LEU A 78 -0.331 -1.127 0.477 1.00 0.00 C ATOM 1156 CD1 LEU A 78 -1.667 -0.451 0.743 1.00 0.00 C ATOM 1157 CD2 LEU A 78 0.492 -1.209 1.754 1.00 0.00 C ATOM 0 H LEU A 78 -1.483 -4.583 -1.083 1.00 0.00 H new ATOM 0 HA LEU A 78 -1.936 -1.851 -1.611 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -1.208 -3.076 0.545 1.00 0.00 H new ATOM 0 HB3 LEU A 78 0.415 -3.042 -0.116 1.00 0.00 H new ATOM 0 HG LEU A 78 0.218 -0.525 -0.247 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -1.496 0.540 1.164 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -2.220 -0.357 -0.192 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -2.244 -1.050 1.447 1.00 0.00 H new ATOM 0 HD21 LEU A 78 0.632 -0.208 2.161 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -0.030 -1.828 2.484 1.00 0.00 H new ATOM 0 HD23 LEU A 78 1.464 -1.650 1.533 1.00 0.00 H new ATOM 1169 N LEU A 79 1.043 -2.952 -2.566 1.00 0.00 N ATOM 1170 CA LEU A 79 2.144 -2.694 -3.488 1.00 0.00 C ATOM 1171 C LEU A 79 1.622 -2.256 -4.852 1.00 0.00 C ATOM 1172 O LEU A 79 2.098 -1.276 -5.424 1.00 0.00 O ATOM 1173 CB LEU A 79 3.011 -3.945 -3.640 1.00 0.00 C ATOM 1174 CG LEU A 79 3.875 -4.313 -2.433 1.00 0.00 C ATOM 1175 CD1 LEU A 79 4.489 -5.692 -2.616 1.00 0.00 C ATOM 1176 CD2 LEU A 79 4.961 -3.269 -2.215 1.00 0.00 C ATOM 0 H LEU A 79 1.183 -3.758 -1.957 1.00 0.00 H new ATOM 0 HA LEU A 79 2.749 -1.887 -3.075 1.00 0.00 H new ATOM 0 HB2 LEU A 79 2.359 -4.789 -3.866 1.00 0.00 H new ATOM 0 HB3 LEU A 79 3.665 -3.807 -4.501 1.00 0.00 H new ATOM 0 HG LEU A 79 3.238 -4.336 -1.549 1.00 0.00 H new ATOM 0 HD11 LEU A 79 5.100 -5.936 -1.747 1.00 0.00 H new ATOM 0 HD12 LEU A 79 3.696 -6.432 -2.722 1.00 0.00 H new ATOM 0 HD13 LEU A 79 5.112 -5.697 -3.511 1.00 0.00 H new ATOM 0 HD21 LEU A 79 5.566 -3.548 -1.352 1.00 0.00 H new ATOM 0 HD22 LEU A 79 5.595 -3.214 -3.100 1.00 0.00 H new ATOM 0 HD23 LEU A 79 4.501 -2.297 -2.037 1.00 0.00 H new ATOM 1188 N GLU A 80 0.637 -2.987 -5.366 1.00 0.00 N ATOM 1189 CA GLU A 80 0.049 -2.673 -6.663 1.00 0.00 C ATOM 1190 C GLU A 80 -0.758 -1.379 -6.594 1.00 0.00 C ATOM 1191 O GLU A 80 -0.744 -0.576 -7.527 1.00 0.00 O ATOM 1192 CB GLU A 80 -0.845 -3.820 -7.135 1.00 0.00 C ATOM 1193 CG GLU A 80 -0.073 -5.059 -7.556 1.00 0.00 C ATOM 1194 CD GLU A 80 -0.973 -6.261 -7.772 1.00 0.00 C ATOM 1195 OE1 GLU A 80 -1.840 -6.200 -8.669 1.00 0.00 O ATOM 1196 OE2 GLU A 80 -0.809 -7.264 -7.046 1.00 0.00 O ATOM 0 H GLU A 80 0.230 -3.800 -4.904 1.00 0.00 H new ATOM 0 HA GLU A 80 0.860 -2.538 -7.378 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -1.534 -4.086 -6.333 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -1.450 -3.476 -7.974 1.00 0.00 H new ATOM 0 HG2 GLU A 80 0.472 -4.848 -8.476 1.00 0.00 H new ATOM 0 HG3 GLU A 80 0.669 -5.297 -6.793 1.00 0.00 H new ATOM 1203 N ARG A 81 -1.462 -1.185 -5.483 1.00 0.00 N ATOM 1204 CA ARG A 81 -2.276 0.008 -5.293 1.00 0.00 C ATOM 1205 C ARG A 81 -1.418 1.269 -5.357 1.00 0.00 C ATOM 1206 O ARG A 81 -1.867 2.315 -5.824 1.00 0.00 O ATOM 1207 CB ARG A 81 -3.007 -0.056 -3.951 1.00 0.00 C ATOM 1208 CG ARG A 81 -4.340 0.674 -3.948 1.00 0.00 C ATOM 1209 CD ARG A 81 -5.430 -0.154 -4.609 1.00 0.00 C ATOM 1210 NE ARG A 81 -6.746 0.465 -4.474 1.00 0.00 N ATOM 1211 CZ ARG A 81 -7.390 0.578 -3.318 1.00 0.00 C ATOM 1212 NH1 ARG A 81 -6.841 0.118 -2.202 1.00 0.00 N ATOM 1213 NH2 ARG A 81 -8.585 1.154 -3.276 1.00 0.00 N ATOM 0 H ARG A 81 -1.484 -1.840 -4.701 1.00 0.00 H new ATOM 0 HA ARG A 81 -3.010 0.048 -6.098 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -3.174 -1.100 -3.687 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -2.367 0.370 -3.178 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -4.628 0.904 -2.922 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -4.236 1.625 -4.471 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -5.197 -0.283 -5.666 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -5.450 -1.149 -4.164 1.00 0.00 H new ATOM 0 HE ARG A 81 -7.195 0.831 -5.314 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -5.922 -0.324 -2.230 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -7.338 0.206 -1.315 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -9.010 1.510 -4.132 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -9.079 1.240 -2.388 1.00 0.00 H new ATOM 1227 N VAL A 82 -0.180 1.160 -4.885 1.00 0.00 N ATOM 1228 CA VAL A 82 0.741 2.290 -4.889 1.00 0.00 C ATOM 1229 C VAL A 82 1.233 2.593 -6.300 1.00 0.00 C ATOM 1230 O VAL A 82 1.261 3.748 -6.725 1.00 0.00 O ATOM 1231 CB VAL A 82 1.956 2.027 -3.980 1.00 0.00 C ATOM 1232 CG1 VAL A 82 2.874 3.240 -3.950 1.00 0.00 C ATOM 1233 CG2 VAL A 82 1.500 1.658 -2.576 1.00 0.00 C ATOM 0 H VAL A 82 0.208 0.301 -4.495 1.00 0.00 H new ATOM 0 HA VAL A 82 0.189 3.149 -4.507 1.00 0.00 H new ATOM 0 HB VAL A 82 2.518 1.187 -4.388 1.00 0.00 H new ATOM 0 HG11 VAL A 82 3.727 3.035 -3.303 1.00 0.00 H new ATOM 0 HG12 VAL A 82 3.227 3.454 -4.959 1.00 0.00 H new ATOM 0 HG13 VAL A 82 2.326 4.101 -3.567 1.00 0.00 H new ATOM 0 HG21 VAL A 82 2.371 1.475 -1.947 1.00 0.00 H new ATOM 0 HG22 VAL A 82 0.915 2.476 -2.157 1.00 0.00 H new ATOM 0 HG23 VAL A 82 0.887 0.758 -2.617 1.00 0.00 H new ATOM 1243 N LYS A 83 1.619 1.547 -7.023 1.00 0.00 N ATOM 1244 CA LYS A 83 2.108 1.699 -8.388 1.00 0.00 C ATOM 1245 C LYS A 83 1.049 2.341 -9.278 1.00 0.00 C ATOM 1246 O LYS A 83 1.370 3.102 -10.190 1.00 0.00 O ATOM 1247 CB LYS A 83 2.513 0.340 -8.961 1.00 0.00 C ATOM 1248 CG LYS A 83 3.633 -0.337 -8.188 1.00 0.00 C ATOM 1249 CD LYS A 83 3.994 -1.682 -8.794 1.00 0.00 C ATOM 1250 CE LYS A 83 4.867 -2.501 -7.854 1.00 0.00 C ATOM 1251 NZ LYS A 83 4.056 -3.223 -6.834 1.00 0.00 N ATOM 0 H LYS A 83 1.603 0.584 -6.686 1.00 0.00 H new ATOM 0 HA LYS A 83 2.981 2.351 -8.363 1.00 0.00 H new ATOM 0 HB2 LYS A 83 1.642 -0.315 -8.971 1.00 0.00 H new ATOM 0 HB3 LYS A 83 2.825 0.470 -9.997 1.00 0.00 H new ATOM 0 HG2 LYS A 83 4.512 0.307 -8.180 1.00 0.00 H new ATOM 0 HG3 LYS A 83 3.329 -0.474 -7.150 1.00 0.00 H new ATOM 0 HD2 LYS A 83 3.083 -2.236 -9.022 1.00 0.00 H new ATOM 0 HD3 LYS A 83 4.518 -1.528 -9.737 1.00 0.00 H new ATOM 0 HE2 LYS A 83 5.448 -3.220 -8.432 1.00 0.00 H new ATOM 0 HE3 LYS A 83 5.579 -1.844 -7.354 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 4.548 -4.095 -6.553 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 3.926 -2.615 -6.000 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 3.127 -3.464 -7.236 1.00 0.00 H new ATOM 1265 N GLU A 84 -0.215 2.032 -9.004 1.00 0.00 N ATOM 1266 CA GLU A 84 -1.321 2.581 -9.780 1.00 0.00 C ATOM 1267 C GLU A 84 -1.722 3.958 -9.257 1.00 0.00 C ATOM 1268 O GLU A 84 -1.968 4.881 -10.035 1.00 0.00 O ATOM 1269 CB GLU A 84 -2.524 1.636 -9.734 1.00 0.00 C ATOM 1270 CG GLU A 84 -2.524 0.597 -10.843 1.00 0.00 C ATOM 1271 CD GLU A 84 -3.772 -0.264 -10.835 1.00 0.00 C ATOM 1272 OE1 GLU A 84 -4.830 0.230 -10.392 1.00 0.00 O ATOM 1273 OE2 GLU A 84 -3.692 -1.431 -11.272 1.00 0.00 O ATOM 0 H GLU A 84 -0.498 1.405 -8.251 1.00 0.00 H new ATOM 0 HA GLU A 84 -0.990 2.686 -10.813 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -2.539 1.127 -8.770 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -3.440 2.224 -9.798 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -2.440 1.099 -11.807 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -1.646 -0.041 -10.738 1.00 0.00 H new ATOM 1280 N LEU A 85 -1.786 4.087 -7.936 1.00 0.00 N ATOM 1281 CA LEU A 85 -2.157 5.350 -7.309 1.00 0.00 C ATOM 1282 C LEU A 85 -1.176 6.455 -7.685 1.00 0.00 C ATOM 1283 O LEU A 85 -1.572 7.505 -8.191 1.00 0.00 O ATOM 1284 CB LEU A 85 -2.205 5.192 -5.788 1.00 0.00 C ATOM 1285 CG LEU A 85 -3.451 4.507 -5.224 1.00 0.00 C ATOM 1286 CD1 LEU A 85 -3.196 4.021 -3.805 1.00 0.00 C ATOM 1287 CD2 LEU A 85 -4.642 5.453 -5.260 1.00 0.00 C ATOM 0 H LEU A 85 -1.586 3.333 -7.279 1.00 0.00 H new ATOM 0 HA LEU A 85 -3.146 5.629 -7.672 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -1.329 4.625 -5.474 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -2.123 6.181 -5.337 1.00 0.00 H new ATOM 0 HG LEU A 85 -3.681 3.642 -5.847 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -4.093 3.536 -3.420 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -2.371 3.309 -3.807 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -2.941 4.870 -3.170 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -5.519 4.949 -4.855 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -4.423 6.337 -4.661 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -4.838 5.752 -6.290 1.00 0.00 H new ATOM 1299 N GLN A 86 0.106 6.209 -7.439 1.00 0.00 N ATOM 1300 CA GLN A 86 1.145 7.183 -7.754 1.00 0.00 C ATOM 1301 C GLN A 86 1.059 7.618 -9.214 1.00 0.00 C ATOM 1302 O GLN A 86 1.398 8.750 -9.555 1.00 0.00 O ATOM 1303 CB GLN A 86 2.528 6.598 -7.465 1.00 0.00 C ATOM 1304 CG GLN A 86 3.017 5.635 -8.536 1.00 0.00 C ATOM 1305 CD GLN A 86 4.490 5.305 -8.395 1.00 0.00 C ATOM 1306 OE1 GLN A 86 5.259 5.430 -9.349 1.00 0.00 O ATOM 1307 NE2 GLN A 86 4.891 4.883 -7.202 1.00 0.00 N ATOM 0 H GLN A 86 0.451 5.344 -7.023 1.00 0.00 H new ATOM 0 HA GLN A 86 0.990 8.058 -7.123 1.00 0.00 H new ATOM 0 HB2 GLN A 86 3.245 7.413 -7.366 1.00 0.00 H new ATOM 0 HB3 GLN A 86 2.501 6.079 -6.507 1.00 0.00 H new ATOM 0 HG2 GLN A 86 2.436 4.714 -8.484 1.00 0.00 H new ATOM 0 HG3 GLN A 86 2.838 6.070 -9.519 1.00 0.00 H new ATOM 0 HE21 GLN A 86 4.219 4.794 -6.440 1.00 0.00 H new ATOM 0 HE22 GLN A 86 5.871 4.647 -7.047 1.00 0.00 H new ATOM 1316 N ALA A 87 0.603 6.710 -10.071 1.00 0.00 N ATOM 1317 CA ALA A 87 0.471 7.000 -11.493 1.00 0.00 C ATOM 1318 C ALA A 87 -0.627 8.028 -11.744 1.00 0.00 C ATOM 1319 O ALA A 87 -0.611 8.732 -12.752 1.00 0.00 O ATOM 1320 CB ALA A 87 0.186 5.722 -12.268 1.00 0.00 C ATOM 0 H ALA A 87 0.319 5.767 -9.805 1.00 0.00 H new ATOM 0 HA ALA A 87 1.414 7.421 -11.842 1.00 0.00 H new ATOM 0 HB1 ALA A 87 0.090 5.954 -13.329 1.00 0.00 H new ATOM 0 HB2 ALA A 87 1.006 5.018 -12.123 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -0.742 5.277 -11.908 1.00 0.00 H new ATOM 1326 N GLU A 88 -1.580 8.108 -10.818 1.00 0.00 N ATOM 1327 CA GLU A 88 -2.686 9.050 -10.941 1.00 0.00 C ATOM 1328 C GLU A 88 -2.328 10.394 -10.316 1.00 0.00 C ATOM 1329 O GLU A 88 -2.293 11.418 -10.998 1.00 0.00 O ATOM 1330 CB GLU A 88 -3.943 8.484 -10.278 1.00 0.00 C ATOM 1331 CG GLU A 88 -4.439 7.195 -10.912 1.00 0.00 C ATOM 1332 CD GLU A 88 -5.169 7.431 -12.219 1.00 0.00 C ATOM 1333 OE1 GLU A 88 -5.915 8.429 -12.311 1.00 0.00 O ATOM 1334 OE2 GLU A 88 -4.994 6.619 -13.152 1.00 0.00 O ATOM 0 H GLU A 88 -1.607 7.532 -9.976 1.00 0.00 H new ATOM 0 HA GLU A 88 -2.882 9.204 -12.002 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -3.737 8.304 -9.223 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -4.736 9.231 -10.325 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -3.592 6.532 -11.088 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -5.104 6.685 -10.216 1.00 0.00 H new ATOM 1341 N GLN A 89 -2.064 10.383 -9.013 1.00 0.00 N ATOM 1342 CA GLN A 89 -1.710 11.602 -8.295 1.00 0.00 C ATOM 1343 C GLN A 89 -0.539 12.309 -8.967 1.00 0.00 C ATOM 1344 O GLN A 89 -0.387 13.525 -8.850 1.00 0.00 O ATOM 1345 CB GLN A 89 -1.360 11.278 -6.841 1.00 0.00 C ATOM 1346 CG GLN A 89 0.021 10.669 -6.669 1.00 0.00 C ATOM 1347 CD GLN A 89 1.102 11.715 -6.480 1.00 0.00 C ATOM 1348 OE1 GLN A 89 0.831 12.917 -6.511 1.00 0.00 O ATOM 1349 NE2 GLN A 89 2.335 11.265 -6.281 1.00 0.00 N ATOM 0 H GLN A 89 -2.089 9.544 -8.433 1.00 0.00 H new ATOM 0 HA GLN A 89 -2.572 12.269 -8.314 1.00 0.00 H new ATOM 0 HB2 GLN A 89 -1.421 12.191 -6.249 1.00 0.00 H new ATOM 0 HB3 GLN A 89 -2.104 10.589 -6.442 1.00 0.00 H new ATOM 0 HG2 GLN A 89 0.014 10.000 -5.808 1.00 0.00 H new ATOM 0 HG3 GLN A 89 0.257 10.062 -7.543 1.00 0.00 H new ATOM 0 HE21 GLN A 89 2.515 10.261 -6.263 1.00 0.00 H new ATOM 0 HE22 GLN A 89 3.103 11.923 -6.146 1.00 0.00 H new ATOM 1358 N GLU A 90 0.286 11.539 -9.671 1.00 0.00 N ATOM 1359 CA GLU A 90 1.445 12.094 -10.361 1.00 0.00 C ATOM 1360 C GLU A 90 1.046 12.673 -11.715 1.00 0.00 C ATOM 1361 O GLU A 90 1.513 13.742 -12.107 1.00 0.00 O ATOM 1362 CB GLU A 90 2.516 11.019 -10.550 1.00 0.00 C ATOM 1363 CG GLU A 90 3.773 11.526 -11.237 1.00 0.00 C ATOM 1364 CD GLU A 90 4.552 12.505 -10.379 1.00 0.00 C ATOM 1365 OE1 GLU A 90 4.399 12.460 -9.140 1.00 0.00 O ATOM 1366 OE2 GLU A 90 5.315 13.314 -10.947 1.00 0.00 O ATOM 0 H GLU A 90 0.173 10.531 -9.778 1.00 0.00 H new ATOM 0 HA GLU A 90 1.851 12.898 -9.747 1.00 0.00 H new ATOM 0 HB2 GLU A 90 2.784 10.610 -9.576 1.00 0.00 H new ATOM 0 HB3 GLU A 90 2.098 10.200 -11.135 1.00 0.00 H new ATOM 0 HG2 GLU A 90 4.412 10.679 -11.488 1.00 0.00 H new ATOM 0 HG3 GLU A 90 3.500 12.008 -12.176 1.00 0.00 H new ATOM 1373 N ASP A 91 0.179 11.960 -12.425 1.00 0.00 N ATOM 1374 CA ASP A 91 -0.285 12.402 -13.736 1.00 0.00 C ATOM 1375 C ASP A 91 -0.533 13.907 -13.745 1.00 0.00 C ATOM 1376 O ASP A 91 -0.152 14.603 -14.685 1.00 0.00 O ATOM 1377 CB ASP A 91 -1.563 11.659 -14.126 1.00 0.00 C ATOM 1378 CG ASP A 91 -1.787 11.640 -15.624 1.00 0.00 C ATOM 1379 OD1 ASP A 91 -1.068 10.894 -16.322 1.00 0.00 O ATOM 1380 OD2 ASP A 91 -2.682 12.369 -16.100 1.00 0.00 O ATOM 0 H ASP A 91 -0.217 11.073 -12.115 1.00 0.00 H new ATOM 0 HA ASP A 91 0.493 12.176 -14.465 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -1.512 10.635 -13.756 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -2.417 12.131 -13.640 1.00 0.00 H new ATOM 1385 N ARG A 92 -1.174 14.403 -12.690 1.00 0.00 N ATOM 1386 CA ARG A 92 -1.476 15.824 -12.579 1.00 0.00 C ATOM 1387 C ARG A 92 -0.198 16.657 -12.642 1.00 0.00 C ATOM 1388 O ARG A 92 -0.024 17.475 -13.544 1.00 0.00 O ATOM 1389 CB ARG A 92 -2.218 16.108 -11.271 1.00 0.00 C ATOM 1390 CG ARG A 92 -3.046 14.936 -10.774 1.00 0.00 C ATOM 1391 CD ARG A 92 -4.275 15.406 -10.010 1.00 0.00 C ATOM 1392 NE ARG A 92 -5.055 14.286 -9.488 1.00 0.00 N ATOM 1393 CZ ARG A 92 -6.335 14.381 -9.144 1.00 0.00 C ATOM 1394 NH1 ARG A 92 -6.974 15.535 -9.267 1.00 0.00 N ATOM 1395 NH2 ARG A 92 -6.977 13.317 -8.677 1.00 0.00 N ATOM 0 H ARG A 92 -1.493 13.841 -11.901 1.00 0.00 H new ATOM 0 HA ARG A 92 -2.113 16.102 -13.419 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -1.493 16.381 -10.504 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -2.871 16.969 -11.413 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -3.355 14.323 -11.620 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -2.435 14.305 -10.129 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -3.966 16.048 -9.185 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -4.902 16.010 -10.667 1.00 0.00 H new ATOM 0 HE ARG A 92 -4.592 13.383 -9.382 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -6.483 16.354 -9.627 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -7.957 15.605 -9.002 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -6.488 12.427 -8.582 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -7.960 13.389 -8.413 1.00 0.00 H new ATOM 1409 N ALA A 93 0.691 16.443 -11.678 1.00 0.00 N ATOM 1410 CA ALA A 93 1.951 17.172 -11.625 1.00 0.00 C ATOM 1411 C ALA A 93 2.669 17.127 -12.970 1.00 0.00 C ATOM 1412 O ALA A 93 3.078 18.159 -13.504 1.00 0.00 O ATOM 1413 CB ALA A 93 2.843 16.607 -10.529 1.00 0.00 C ATOM 0 H ALA A 93 0.561 15.770 -10.923 1.00 0.00 H new ATOM 0 HA ALA A 93 1.729 18.214 -11.396 1.00 0.00 H new ATOM 0 HB1 ALA A 93 3.781 17.162 -10.501 1.00 0.00 H new ATOM 0 HB2 ALA A 93 2.339 16.698 -9.567 1.00 0.00 H new ATOM 0 HB3 ALA A 93 3.049 15.556 -10.733 1.00 0.00 H new ATOM 1419 N LEU A 94 2.819 15.924 -13.514 1.00 0.00 N ATOM 1420 CA LEU A 94 3.489 15.743 -14.797 1.00 0.00 C ATOM 1421 C LEU A 94 3.119 16.862 -15.766 1.00 0.00 C ATOM 1422 O LEU A 94 3.993 17.536 -16.313 1.00 0.00 O ATOM 1423 CB LEU A 94 3.118 14.388 -15.402 1.00 0.00 C ATOM 1424 CG LEU A 94 3.566 14.150 -16.844 1.00 0.00 C ATOM 1425 CD1 LEU A 94 5.067 13.910 -16.904 1.00 0.00 C ATOM 1426 CD2 LEU A 94 2.812 12.976 -17.452 1.00 0.00 C ATOM 0 H LEU A 94 2.486 15.060 -13.087 1.00 0.00 H new ATOM 0 HA LEU A 94 4.565 15.775 -14.625 1.00 0.00 H new ATOM 0 HB2 LEU A 94 3.545 13.604 -14.776 1.00 0.00 H new ATOM 0 HB3 LEU A 94 2.035 14.277 -15.357 1.00 0.00 H new ATOM 0 HG LEU A 94 3.337 15.043 -17.426 1.00 0.00 H new ATOM 0 HD11 LEU A 94 5.368 13.742 -17.938 1.00 0.00 H new ATOM 0 HD12 LEU A 94 5.591 14.781 -16.510 1.00 0.00 H new ATOM 0 HD13 LEU A 94 5.320 13.034 -16.306 1.00 0.00 H new ATOM 0 HD21 LEU A 94 3.145 12.822 -18.479 1.00 0.00 H new ATOM 0 HD22 LEU A 94 3.008 12.076 -16.869 1.00 0.00 H new ATOM 0 HD23 LEU A 94 1.743 13.187 -17.445 1.00 0.00 H new ATOM 1438 N ARG A 95 1.822 17.056 -15.972 1.00 0.00 N ATOM 1439 CA ARG A 95 1.337 18.094 -16.874 1.00 0.00 C ATOM 1440 C ARG A 95 1.381 19.462 -16.201 1.00 0.00 C ATOM 1441 O ARG A 95 0.592 19.748 -15.300 1.00 0.00 O ATOM 1442 CB ARG A 95 -0.091 17.781 -17.326 1.00 0.00 C ATOM 1443 CG ARG A 95 -0.454 18.395 -18.668 1.00 0.00 C ATOM 1444 CD ARG A 95 0.065 17.555 -19.824 1.00 0.00 C ATOM 1445 NE ARG A 95 -0.560 17.922 -21.092 1.00 0.00 N ATOM 1446 CZ ARG A 95 -0.107 17.527 -22.276 1.00 0.00 C ATOM 1447 NH1 ARG A 95 0.969 16.757 -22.355 1.00 0.00 N ATOM 1448 NH2 ARG A 95 -0.731 17.904 -23.386 1.00 0.00 N ATOM 0 H ARG A 95 1.086 16.508 -15.526 1.00 0.00 H new ATOM 0 HA ARG A 95 1.990 18.116 -17.747 1.00 0.00 H new ATOM 0 HB2 ARG A 95 -0.215 16.700 -17.385 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -0.789 18.141 -16.571 1.00 0.00 H new ATOM 0 HG2 ARG A 95 -1.537 18.491 -18.744 1.00 0.00 H new ATOM 0 HG3 ARG A 95 -0.039 19.401 -18.733 1.00 0.00 H new ATOM 0 HD2 ARG A 95 1.145 17.677 -19.904 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -0.123 16.501 -19.619 1.00 0.00 H new ATOM 0 HE ARG A 95 -1.390 18.514 -21.067 1.00 0.00 H new ATOM 0 HH11 ARG A 95 1.452 16.466 -21.505 1.00 0.00 H new ATOM 0 HH12 ARG A 95 1.314 16.455 -23.266 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -1.559 18.497 -23.329 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -0.383 17.600 -24.295 1.00 0.00 H new ATOM 1462 N SER A 96 2.308 20.305 -16.645 1.00 0.00 N ATOM 1463 CA SER A 96 2.458 21.642 -16.083 1.00 0.00 C ATOM 1464 C SER A 96 1.117 22.371 -16.052 1.00 0.00 C ATOM 1465 O SER A 96 0.343 22.312 -17.007 1.00 0.00 O ATOM 1466 CB SER A 96 3.472 22.449 -16.896 1.00 0.00 C ATOM 1467 OG SER A 96 3.797 23.665 -16.243 1.00 0.00 O ATOM 0 H SER A 96 2.966 20.086 -17.392 1.00 0.00 H new ATOM 0 HA SER A 96 2.821 21.542 -15.060 1.00 0.00 H new ATOM 0 HB2 SER A 96 4.376 21.859 -17.044 1.00 0.00 H new ATOM 0 HB3 SER A 96 3.064 22.661 -17.884 1.00 0.00 H new ATOM 0 HG SER A 96 4.448 24.162 -16.782 1.00 0.00 H new ATOM 1473 N PHE A 97 0.852 23.059 -14.946 1.00 0.00 N ATOM 1474 CA PHE A 97 -0.395 23.800 -14.787 1.00 0.00 C ATOM 1475 C PHE A 97 -0.215 24.965 -13.820 1.00 0.00 C ATOM 1476 O PHE A 97 0.503 24.857 -12.825 1.00 0.00 O ATOM 1477 CB PHE A 97 -1.504 22.872 -14.287 1.00 0.00 C ATOM 1478 CG PHE A 97 -2.887 23.392 -14.555 1.00 0.00 C ATOM 1479 CD1 PHE A 97 -3.444 24.367 -13.744 1.00 0.00 C ATOM 1480 CD2 PHE A 97 -3.630 22.906 -15.619 1.00 0.00 C ATOM 1481 CE1 PHE A 97 -4.717 24.849 -13.989 1.00 0.00 C ATOM 1482 CE2 PHE A 97 -4.903 23.383 -15.869 1.00 0.00 C ATOM 1483 CZ PHE A 97 -5.448 24.355 -15.052 1.00 0.00 C ATOM 0 H PHE A 97 1.483 23.119 -14.147 1.00 0.00 H new ATOM 0 HA PHE A 97 -0.678 24.200 -15.761 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -1.393 21.897 -14.762 1.00 0.00 H new ATOM 0 HB3 PHE A 97 -1.383 22.720 -13.214 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -2.878 24.755 -12.911 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -3.209 22.146 -16.260 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -5.139 25.611 -13.350 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -5.471 22.996 -16.702 1.00 0.00 H new ATOM 0 HZ PHE A 97 -6.443 24.728 -15.244 1.00 0.00 H new ATOM 1493 N LYS A 98 -0.873 26.081 -14.119 1.00 0.00 N ATOM 1494 CA LYS A 98 -0.788 27.268 -13.276 1.00 0.00 C ATOM 1495 C LYS A 98 -2.165 27.892 -13.077 1.00 0.00 C ATOM 1496 O LYS A 98 -2.933 28.043 -14.028 1.00 0.00 O ATOM 1497 CB LYS A 98 0.164 28.292 -13.897 1.00 0.00 C ATOM 1498 CG LYS A 98 0.824 29.206 -12.879 1.00 0.00 C ATOM 1499 CD LYS A 98 1.156 30.562 -13.478 1.00 0.00 C ATOM 1500 CE LYS A 98 1.294 31.628 -12.402 1.00 0.00 C ATOM 1501 NZ LYS A 98 1.593 32.966 -12.983 1.00 0.00 N ATOM 0 H LYS A 98 -1.471 26.188 -14.939 1.00 0.00 H new ATOM 0 HA LYS A 98 -0.401 26.966 -12.303 1.00 0.00 H new ATOM 0 HB2 LYS A 98 0.938 27.764 -14.454 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -0.387 28.900 -14.614 1.00 0.00 H new ATOM 0 HG2 LYS A 98 0.161 29.338 -12.024 1.00 0.00 H new ATOM 0 HG3 LYS A 98 1.736 28.739 -12.507 1.00 0.00 H new ATOM 0 HD2 LYS A 98 2.085 30.493 -14.045 1.00 0.00 H new ATOM 0 HD3 LYS A 98 0.375 30.852 -14.181 1.00 0.00 H new ATOM 0 HE2 LYS A 98 0.372 31.681 -11.823 1.00 0.00 H new ATOM 0 HE3 LYS A 98 2.089 31.346 -11.711 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 1.680 33.665 -12.218 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 2.486 32.922 -13.515 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 0.823 33.247 -13.623 1.00 0.00 H new ATOM 1515 N SER A 99 -2.471 28.256 -11.835 1.00 0.00 N ATOM 1516 CA SER A 99 -3.758 28.863 -11.511 1.00 0.00 C ATOM 1517 C SER A 99 -3.581 30.013 -10.525 1.00 0.00 C ATOM 1518 O SER A 99 -2.480 30.267 -10.039 1.00 0.00 O ATOM 1519 CB SER A 99 -4.706 27.815 -10.927 1.00 0.00 C ATOM 1520 OG SER A 99 -6.032 28.311 -10.858 1.00 0.00 O ATOM 0 H SER A 99 -1.846 28.141 -11.037 1.00 0.00 H new ATOM 0 HA SER A 99 -4.189 29.259 -12.431 1.00 0.00 H new ATOM 0 HB2 SER A 99 -4.682 26.915 -11.542 1.00 0.00 H new ATOM 0 HB3 SER A 99 -4.369 27.529 -9.931 1.00 0.00 H new ATOM 0 HG SER A 99 -6.620 27.622 -10.483 1.00 0.00 H new ATOM 1526 N GLY A 100 -4.678 30.707 -10.233 1.00 0.00 N ATOM 1527 CA GLY A 100 -4.626 31.822 -9.306 1.00 0.00 C ATOM 1528 C GLY A 100 -5.591 31.661 -8.149 1.00 0.00 C ATOM 1529 O GLY A 100 -6.517 32.452 -7.970 1.00 0.00 O ATOM 0 H GLY A 100 -5.601 30.516 -10.622 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -3.612 31.921 -8.918 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -4.854 32.745 -9.840 1.00 0.00 H new ATOM 1533 N PRO A 101 -5.380 30.612 -7.340 1.00 0.00 N ATOM 1534 CA PRO A 101 -6.231 30.324 -6.180 1.00 0.00 C ATOM 1535 C PRO A 101 -6.054 31.348 -5.063 1.00 0.00 C ATOM 1536 O PRO A 101 -5.004 31.978 -4.946 1.00 0.00 O ATOM 1537 CB PRO A 101 -5.750 28.945 -5.723 1.00 0.00 C ATOM 1538 CG PRO A 101 -4.344 28.854 -6.204 1.00 0.00 C ATOM 1539 CD PRO A 101 -4.296 29.628 -7.492 1.00 0.00 C ATOM 0 HA PRO A 101 -7.291 30.359 -6.432 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -5.804 28.846 -4.639 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -6.365 28.151 -6.147 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -3.653 29.272 -5.472 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -4.052 27.816 -6.362 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -3.330 30.113 -7.633 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -4.458 28.982 -8.355 1.00 0.00 H new ATOM 1547 N SER A 102 -7.089 31.506 -4.244 1.00 0.00 N ATOM 1548 CA SER A 102 -7.049 32.456 -3.138 1.00 0.00 C ATOM 1549 C SER A 102 -7.428 31.777 -1.826 1.00 0.00 C ATOM 1550 O SER A 102 -8.273 30.883 -1.798 1.00 0.00 O ATOM 1551 CB SER A 102 -7.993 33.629 -3.411 1.00 0.00 C ATOM 1552 OG SER A 102 -9.348 33.219 -3.340 1.00 0.00 O ATOM 0 H SER A 102 -7.965 30.989 -4.325 1.00 0.00 H new ATOM 0 HA SER A 102 -6.030 32.833 -3.051 1.00 0.00 H new ATOM 0 HB2 SER A 102 -7.811 34.423 -2.686 1.00 0.00 H new ATOM 0 HB3 SER A 102 -7.786 34.044 -4.397 1.00 0.00 H new ATOM 0 HG SER A 102 -9.932 33.986 -3.516 1.00 0.00 H new ATOM 1558 N SER A 103 -6.795 32.209 -0.738 1.00 0.00 N ATOM 1559 CA SER A 103 -7.063 31.642 0.577 1.00 0.00 C ATOM 1560 C SER A 103 -8.316 32.259 1.191 1.00 0.00 C ATOM 1561 O SER A 103 -8.246 33.270 1.888 1.00 0.00 O ATOM 1562 CB SER A 103 -5.865 31.862 1.504 1.00 0.00 C ATOM 1563 OG SER A 103 -6.131 31.369 2.806 1.00 0.00 O ATOM 0 H SER A 103 -6.094 32.950 -0.743 1.00 0.00 H new ATOM 0 HA SER A 103 -7.229 30.571 0.457 1.00 0.00 H new ATOM 0 HB2 SER A 103 -4.987 31.362 1.094 1.00 0.00 H new ATOM 0 HB3 SER A 103 -5.631 32.925 1.555 1.00 0.00 H new ATOM 0 HG SER A 103 -5.350 31.520 3.379 1.00 0.00 H new ATOM 1569 N GLY A 104 -9.463 31.640 0.927 1.00 0.00 N ATOM 1570 CA GLY A 104 -10.716 32.143 1.460 1.00 0.00 C ATOM 1571 C GLY A 104 -11.404 31.140 2.366 1.00 0.00 C ATOM 1572 O GLY A 104 -10.953 30.894 3.484 1.00 0.00 O ATOM 0 H GLY A 104 -9.547 30.800 0.354 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -10.528 33.062 2.016 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -11.381 32.400 0.636 1.00 0.00 H new TER 1576 GLY A 104