USER MOD reduce.3.24.130724 H: found=0, std=0, add=739, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 743 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 Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 9 THR OG1 : rot 75:sc= 0.247 USER MOD Single : A 12 THR OG1 : rot 180:sc= 0.19 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 ASN :FLIP amide:sc= 0.261 F(o=-1.5!,f=0.26) USER MOD Single : A 36 ASN : amide:sc= 0 K(o=0,f=-0.87) USER MOD Single : A 38 THR OG1 : rot 44:sc= 0.0805 USER MOD Single : A 43 THR OG1 : rot 7:sc= 0.843 USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 GLN :FLIP amide:sc= -0.715 F(o=-1.9!,f=-0.71) USER MOD Single : B 7 SER OG : rot 180:sc= 0 USER MOD Single : B 9 THR OG1 : rot 76:sc= 0.28 USER MOD Single : B 12 THR OG1 : rot 180:sc= 0.0707 USER MOD Single : B 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 32 TYR OH : rot 180:sc= -0.182 USER MOD Single : B 33 ASN : amide:sc= -0.617 X(o=-0.62,f=-0.62) USER MOD Single : B 36 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 38 THR OG1 : rot 47:sc= 0.0804 USER MOD Single : B 45 THR OG1 : rot 180:sc= -0.23 USER MOD Single : B 49 GLN :FLIP amide:sc= -0.568 F(o=-2!,f=-0.57) USER MOD ----------------------------------------------------------------- ATOM 16 N ARG A 3 3.689 -2.442 1.023 1.00 0.00 N ATOM 17 CA ARG A 3 5.094 -2.712 1.304 1.00 0.00 C ATOM 18 C ARG A 3 5.648 -3.763 0.346 1.00 0.00 C ATOM 19 O ARG A 3 4.944 -4.696 -0.043 1.00 0.00 O ATOM 20 CB ARG A 3 5.266 -3.183 2.749 1.00 0.00 C ATOM 21 CG ARG A 3 6.687 -3.043 3.270 1.00 0.00 C ATOM 22 CD ARG A 3 7.412 -4.380 3.277 1.00 0.00 C ATOM 23 NE ARG A 3 7.137 -5.145 4.491 1.00 0.00 N ATOM 24 CZ ARG A 3 7.301 -6.460 4.584 1.00 0.00 C ATOM 25 NH1 ARG A 3 7.738 -7.152 3.541 1.00 0.00 N ATOM 26 NH2 ARG A 3 7.029 -7.085 5.722 1.00 0.00 N ATOM 0 HA ARG A 3 5.651 -1.786 1.162 1.00 0.00 H new ATOM 0 HB2 ARG A 3 4.595 -2.612 3.391 1.00 0.00 H new ATOM 0 HB3 ARG A 3 4.963 -4.228 2.820 1.00 0.00 H new ATOM 0 HG2 ARG A 3 7.235 -2.334 2.649 1.00 0.00 H new ATOM 0 HG3 ARG A 3 6.667 -2.634 4.280 1.00 0.00 H new ATOM 0 HD2 ARG A 3 7.109 -4.961 2.406 1.00 0.00 H new ATOM 0 HD3 ARG A 3 8.485 -4.211 3.190 1.00 0.00 H new ATOM 0 HE ARG A 3 6.801 -4.642 5.312 1.00 0.00 H new ATOM 0 HH11 ARG A 3 7.949 -6.675 2.665 1.00 0.00 H new ATOM 0 HH12 ARG A 3 7.863 -8.162 3.615 1.00 0.00 H new ATOM 0 HH21 ARG A 3 6.693 -6.556 6.527 1.00 0.00 H new ATOM 0 HH22 ARG A 3 7.155 -8.095 5.792 1.00 0.00 H new ATOM 40 N VAL A 4 6.912 -3.605 -0.032 1.00 0.00 N ATOM 41 CA VAL A 4 7.560 -4.539 -0.944 1.00 0.00 C ATOM 42 C VAL A 4 8.923 -4.969 -0.413 1.00 0.00 C ATOM 43 O VAL A 4 9.765 -4.133 -0.086 1.00 0.00 O ATOM 44 CB VAL A 4 7.738 -3.925 -2.345 1.00 0.00 C ATOM 45 CG1 VAL A 4 8.434 -4.907 -3.275 1.00 0.00 C ATOM 46 CG2 VAL A 4 6.393 -3.501 -2.915 1.00 0.00 C ATOM 0 H VAL A 4 7.508 -2.838 0.280 1.00 0.00 H new ATOM 0 HA VAL A 4 6.910 -5.411 -1.018 1.00 0.00 H new ATOM 0 HB VAL A 4 8.366 -3.038 -2.257 1.00 0.00 H new ATOM 0 HG11 VAL A 4 8.551 -4.455 -4.260 1.00 0.00 H new ATOM 0 HG12 VAL A 4 9.415 -5.157 -2.872 1.00 0.00 H new ATOM 0 HG13 VAL A 4 7.835 -5.814 -3.361 1.00 0.00 H new ATOM 0 HG21 VAL A 4 6.537 -3.069 -3.905 1.00 0.00 H new ATOM 0 HG22 VAL A 4 5.739 -4.370 -2.990 1.00 0.00 H new ATOM 0 HG23 VAL A 4 5.937 -2.759 -2.259 1.00 0.00 H new ATOM 56 N ARG A 5 9.134 -6.279 -0.331 1.00 0.00 N ATOM 57 CA ARG A 5 10.395 -6.820 0.161 1.00 0.00 C ATOM 58 C ARG A 5 10.942 -7.878 -0.793 1.00 0.00 C ATOM 59 O ARG A 5 10.236 -8.818 -1.163 1.00 0.00 O ATOM 60 CB ARG A 5 10.207 -7.423 1.554 1.00 0.00 C ATOM 61 CG ARG A 5 11.484 -7.994 2.148 1.00 0.00 C ATOM 62 CD ARG A 5 11.199 -9.205 3.022 1.00 0.00 C ATOM 63 NE ARG A 5 11.590 -8.982 4.412 1.00 0.00 N ATOM 64 CZ ARG A 5 11.456 -9.893 5.369 1.00 0.00 C ATOM 65 NH1 ARG A 5 10.945 -11.084 5.088 1.00 0.00 N ATOM 66 NH2 ARG A 5 11.835 -9.615 6.609 1.00 0.00 N ATOM 0 H ARG A 5 8.448 -6.985 -0.599 1.00 0.00 H new ATOM 0 HA ARG A 5 11.113 -6.002 0.220 1.00 0.00 H new ATOM 0 HB2 ARG A 5 9.816 -6.656 2.223 1.00 0.00 H new ATOM 0 HB3 ARG A 5 9.457 -8.212 1.501 1.00 0.00 H new ATOM 0 HG2 ARG A 5 12.166 -8.276 1.345 1.00 0.00 H new ATOM 0 HG3 ARG A 5 11.986 -7.228 2.739 1.00 0.00 H new ATOM 0 HD2 ARG A 5 10.136 -9.441 2.978 1.00 0.00 H new ATOM 0 HD3 ARG A 5 11.734 -10.069 2.629 1.00 0.00 H new ATOM 0 HE ARG A 5 11.988 -8.076 4.661 1.00 0.00 H new ATOM 0 HH11 ARG A 5 10.654 -11.302 4.135 1.00 0.00 H new ATOM 0 HH12 ARG A 5 10.843 -11.782 5.825 1.00 0.00 H new ATOM 0 HH21 ARG A 5 12.230 -8.701 6.829 1.00 0.00 H new ATOM 0 HH22 ARG A 5 11.732 -10.316 7.343 1.00 0.00 H new ATOM 80 N ILE A 6 12.200 -7.719 -1.187 1.00 0.00 N ATOM 81 CA ILE A 6 12.841 -8.661 -2.097 1.00 0.00 C ATOM 82 C ILE A 6 14.135 -9.206 -1.503 1.00 0.00 C ATOM 83 O ILE A 6 14.969 -8.449 -1.006 1.00 0.00 O ATOM 84 CB ILE A 6 13.149 -8.008 -3.458 1.00 0.00 C ATOM 85 CG1 ILE A 6 11.907 -7.297 -4.000 1.00 0.00 C ATOM 86 CG2 ILE A 6 13.641 -9.053 -4.447 1.00 0.00 C ATOM 87 CD1 ILE A 6 12.123 -6.646 -5.348 1.00 0.00 C ATOM 0 H ILE A 6 12.797 -6.947 -0.891 1.00 0.00 H new ATOM 0 HA ILE A 6 12.139 -9.482 -2.247 1.00 0.00 H new ATOM 0 HB ILE A 6 13.937 -7.268 -3.319 1.00 0.00 H new ATOM 0 HG12 ILE A 6 11.092 -8.017 -4.080 1.00 0.00 H new ATOM 0 HG13 ILE A 6 11.592 -6.537 -3.285 1.00 0.00 H new ATOM 0 HG21 ILE A 6 13.854 -8.576 -5.404 1.00 0.00 H new ATOM 0 HG22 ILE A 6 14.549 -9.519 -4.063 1.00 0.00 H new ATOM 0 HG23 ILE A 6 12.873 -9.814 -4.584 1.00 0.00 H new ATOM 0 HD11 ILE A 6 11.201 -6.161 -5.670 1.00 0.00 H new ATOM 0 HD12 ILE A 6 12.916 -5.902 -5.270 1.00 0.00 H new ATOM 0 HD13 ILE A 6 12.408 -7.405 -6.077 1.00 0.00 H new ATOM 99 N SER A 7 14.296 -10.524 -1.559 1.00 0.00 N ATOM 100 CA SER A 7 15.489 -11.172 -1.025 1.00 0.00 C ATOM 101 C SER A 7 16.270 -11.871 -2.133 1.00 0.00 C ATOM 102 O SER A 7 15.697 -12.591 -2.952 1.00 0.00 O ATOM 103 CB SER A 7 15.104 -12.181 0.059 1.00 0.00 C ATOM 104 OG SER A 7 13.720 -12.109 0.355 1.00 0.00 O ATOM 0 H SER A 7 13.616 -11.164 -1.969 1.00 0.00 H new ATOM 0 HA SER A 7 16.125 -10.403 -0.587 1.00 0.00 H new ATOM 0 HB2 SER A 7 15.356 -13.189 -0.272 1.00 0.00 H new ATOM 0 HB3 SER A 7 15.683 -11.988 0.962 1.00 0.00 H new ATOM 0 HG SER A 7 13.499 -12.765 1.049 1.00 0.00 H new ATOM 110 N ILE A 8 17.580 -11.654 -2.152 1.00 0.00 N ATOM 111 CA ILE A 8 18.441 -12.264 -3.158 1.00 0.00 C ATOM 112 C ILE A 8 19.342 -13.327 -2.539 1.00 0.00 C ATOM 113 O ILE A 8 19.930 -13.117 -1.477 1.00 0.00 O ATOM 114 CB ILE A 8 19.316 -11.211 -3.863 1.00 0.00 C ATOM 115 CG1 ILE A 8 18.444 -10.094 -4.440 1.00 0.00 C ATOM 116 CG2 ILE A 8 20.147 -11.861 -4.959 1.00 0.00 C ATOM 117 CD1 ILE A 8 19.195 -8.803 -4.678 1.00 0.00 C ATOM 0 H ILE A 8 18.069 -11.060 -1.482 1.00 0.00 H new ATOM 0 HA ILE A 8 17.786 -12.731 -3.893 1.00 0.00 H new ATOM 0 HB ILE A 8 19.994 -10.774 -3.130 1.00 0.00 H new ATOM 0 HG12 ILE A 8 18.011 -10.432 -5.382 1.00 0.00 H new ATOM 0 HG13 ILE A 8 17.615 -9.902 -3.759 1.00 0.00 H new ATOM 0 HG21 ILE A 8 20.760 -11.104 -5.448 1.00 0.00 H new ATOM 0 HG22 ILE A 8 20.792 -12.624 -4.523 1.00 0.00 H new ATOM 0 HG23 ILE A 8 19.485 -12.321 -5.693 1.00 0.00 H new ATOM 0 HD11 ILE A 8 18.515 -8.056 -5.087 1.00 0.00 H new ATOM 0 HD12 ILE A 8 19.605 -8.442 -3.735 1.00 0.00 H new ATOM 0 HD13 ILE A 8 20.007 -8.979 -5.383 1.00 0.00 H new ATOM 129 N THR A 9 19.449 -14.469 -3.211 1.00 0.00 N ATOM 130 CA THR A 9 20.280 -15.565 -2.728 1.00 0.00 C ATOM 131 C THR A 9 21.586 -15.651 -3.510 1.00 0.00 C ATOM 132 O THR A 9 21.754 -16.521 -4.363 1.00 0.00 O ATOM 133 CB THR A 9 19.544 -16.914 -2.831 1.00 0.00 C ATOM 134 OG1 THR A 9 18.138 -16.722 -2.638 1.00 0.00 O ATOM 135 CG2 THR A 9 20.073 -17.899 -1.799 1.00 0.00 C ATOM 0 H THR A 9 18.970 -14.659 -4.092 1.00 0.00 H new ATOM 0 HA THR A 9 20.500 -15.358 -1.681 1.00 0.00 H new ATOM 0 HB THR A 9 19.721 -17.324 -3.825 1.00 0.00 H new ATOM 0 HG1 THR A 9 17.751 -16.312 -3.440 1.00 0.00 H new ATOM 0 HG21 THR A 9 19.538 -18.844 -1.891 1.00 0.00 H new ATOM 0 HG22 THR A 9 21.137 -18.066 -1.967 1.00 0.00 H new ATOM 0 HG23 THR A 9 19.923 -17.493 -0.798 1.00 0.00 H new ATOM 143 N ALA A 10 22.509 -14.742 -3.212 1.00 0.00 N ATOM 144 CA ALA A 10 23.801 -14.717 -3.885 1.00 0.00 C ATOM 145 C ALA A 10 24.883 -15.354 -3.020 1.00 0.00 C ATOM 146 O ALA A 10 24.831 -15.284 -1.792 1.00 0.00 O ATOM 147 CB ALA A 10 24.183 -13.288 -4.242 1.00 0.00 C ATOM 0 H ALA A 10 22.385 -14.013 -2.509 1.00 0.00 H new ATOM 0 HA ALA A 10 23.716 -15.299 -4.803 1.00 0.00 H new ATOM 0 HB1 ALA A 10 25.150 -13.285 -4.744 1.00 0.00 H new ATOM 0 HB2 ALA A 10 23.429 -12.865 -4.905 1.00 0.00 H new ATOM 0 HB3 ALA A 10 24.244 -12.690 -3.333 1.00 0.00 H new ATOM 153 N ARG A 11 25.862 -15.978 -3.668 1.00 0.00 N ATOM 154 CA ARG A 11 26.955 -16.630 -2.957 1.00 0.00 C ATOM 155 C ARG A 11 27.964 -15.603 -2.451 1.00 0.00 C ATOM 156 O ARG A 11 28.460 -15.703 -1.329 1.00 0.00 O ATOM 157 CB ARG A 11 27.653 -17.640 -3.869 1.00 0.00 C ATOM 158 CG ARG A 11 28.219 -17.026 -5.139 1.00 0.00 C ATOM 159 CD ARG A 11 28.797 -18.088 -6.061 1.00 0.00 C ATOM 160 NE ARG A 11 30.112 -18.542 -5.615 1.00 0.00 N ATOM 161 CZ ARG A 11 31.214 -17.807 -5.708 1.00 0.00 C ATOM 162 NH1 ARG A 11 31.160 -16.588 -6.226 1.00 0.00 N ATOM 163 NH2 ARG A 11 32.373 -18.291 -5.280 1.00 0.00 N ATOM 0 H ARG A 11 25.920 -16.046 -4.684 1.00 0.00 H new ATOM 0 HA ARG A 11 26.535 -17.155 -2.099 1.00 0.00 H new ATOM 0 HB2 ARG A 11 28.461 -18.118 -3.316 1.00 0.00 H new ATOM 0 HB3 ARG A 11 26.944 -18.423 -4.139 1.00 0.00 H new ATOM 0 HG2 ARG A 11 27.434 -16.478 -5.660 1.00 0.00 H new ATOM 0 HG3 ARG A 11 28.995 -16.305 -4.881 1.00 0.00 H new ATOM 0 HD2 ARG A 11 28.116 -18.938 -6.107 1.00 0.00 H new ATOM 0 HD3 ARG A 11 28.875 -17.687 -7.072 1.00 0.00 H new ATOM 0 HE ARG A 11 30.188 -19.475 -5.210 1.00 0.00 H new ATOM 0 HH11 ARG A 11 30.270 -16.212 -6.554 1.00 0.00 H new ATOM 0 HH12 ARG A 11 32.008 -16.026 -6.296 1.00 0.00 H new ATOM 0 HH21 ARG A 11 32.418 -19.228 -4.879 1.00 0.00 H new ATOM 0 HH22 ARG A 11 33.219 -17.726 -5.352 1.00 0.00 H new ATOM 177 N THR A 12 28.264 -14.614 -3.288 1.00 0.00 N ATOM 178 CA THR A 12 29.214 -13.569 -2.927 1.00 0.00 C ATOM 179 C THR A 12 28.521 -12.219 -2.791 1.00 0.00 C ATOM 180 O THR A 12 27.554 -11.931 -3.496 1.00 0.00 O ATOM 181 CB THR A 12 30.342 -13.452 -3.970 1.00 0.00 C ATOM 182 OG1 THR A 12 31.049 -12.220 -3.790 1.00 0.00 O ATOM 183 CG2 THR A 12 29.783 -13.520 -5.383 1.00 0.00 C ATOM 0 H THR A 12 27.863 -14.515 -4.220 1.00 0.00 H new ATOM 0 HA THR A 12 29.645 -13.851 -1.966 1.00 0.00 H new ATOM 0 HB THR A 12 31.027 -14.288 -3.827 1.00 0.00 H new ATOM 0 HG1 THR A 12 31.765 -12.154 -4.455 1.00 0.00 H new ATOM 0 HG21 THR A 12 30.598 -13.435 -6.101 1.00 0.00 H new ATOM 0 HG22 THR A 12 29.271 -14.471 -5.526 1.00 0.00 H new ATOM 0 HG23 THR A 12 29.079 -12.702 -5.535 1.00 0.00 H new ATOM 191 N LYS A 13 29.022 -11.391 -1.879 1.00 0.00 N ATOM 192 CA LYS A 13 28.453 -10.069 -1.651 1.00 0.00 C ATOM 193 C LYS A 13 28.517 -9.222 -2.918 1.00 0.00 C ATOM 194 O LYS A 13 27.717 -8.305 -3.106 1.00 0.00 O ATOM 195 CB LYS A 13 29.194 -9.361 -0.514 1.00 0.00 C ATOM 196 CG LYS A 13 30.696 -9.280 -0.726 1.00 0.00 C ATOM 197 CD LYS A 13 31.435 -9.097 0.589 1.00 0.00 C ATOM 198 CE LYS A 13 32.835 -9.687 0.528 1.00 0.00 C ATOM 199 NZ LYS A 13 32.930 -10.969 1.280 1.00 0.00 N ATOM 0 H LYS A 13 29.822 -11.614 -1.286 1.00 0.00 H new ATOM 0 HA LYS A 13 27.407 -10.195 -1.372 1.00 0.00 H new ATOM 0 HB2 LYS A 13 28.796 -8.352 -0.404 1.00 0.00 H new ATOM 0 HB3 LYS A 13 28.995 -9.885 0.421 1.00 0.00 H new ATOM 0 HG2 LYS A 13 31.045 -10.188 -1.217 1.00 0.00 H new ATOM 0 HG3 LYS A 13 30.926 -8.449 -1.393 1.00 0.00 H new ATOM 0 HD2 LYS A 13 31.497 -8.035 0.828 1.00 0.00 H new ATOM 0 HD3 LYS A 13 30.873 -9.573 1.393 1.00 0.00 H new ATOM 0 HE2 LYS A 13 33.113 -9.855 -0.512 1.00 0.00 H new ATOM 0 HE3 LYS A 13 33.549 -8.972 0.938 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 33.900 -11.339 1.214 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 32.689 -10.805 2.278 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 32.268 -11.660 0.873 1.00 0.00 H new ATOM 213 N LYS A 14 29.472 -9.537 -3.786 1.00 0.00 N ATOM 214 CA LYS A 14 29.640 -8.808 -5.038 1.00 0.00 C ATOM 215 C LYS A 14 28.389 -8.919 -5.904 1.00 0.00 C ATOM 216 O LYS A 14 27.943 -7.936 -6.493 1.00 0.00 O ATOM 217 CB LYS A 14 30.853 -9.341 -5.804 1.00 0.00 C ATOM 218 CG LYS A 14 31.950 -8.309 -6.000 1.00 0.00 C ATOM 219 CD LYS A 14 33.054 -8.467 -4.967 1.00 0.00 C ATOM 220 CE LYS A 14 32.624 -7.941 -3.607 1.00 0.00 C ATOM 221 NZ LYS A 14 33.699 -7.142 -2.956 1.00 0.00 N ATOM 0 H LYS A 14 30.142 -10.293 -3.646 1.00 0.00 H new ATOM 0 HA LYS A 14 29.803 -7.757 -4.799 1.00 0.00 H new ATOM 0 HB2 LYS A 14 31.263 -10.197 -5.268 1.00 0.00 H new ATOM 0 HB3 LYS A 14 30.526 -9.702 -6.779 1.00 0.00 H new ATOM 0 HG2 LYS A 14 32.370 -8.408 -7.001 1.00 0.00 H new ATOM 0 HG3 LYS A 14 31.526 -7.307 -5.930 1.00 0.00 H new ATOM 0 HD2 LYS A 14 33.326 -9.519 -4.882 1.00 0.00 H new ATOM 0 HD3 LYS A 14 33.944 -7.933 -5.300 1.00 0.00 H new ATOM 0 HE2 LYS A 14 31.732 -7.325 -3.721 1.00 0.00 H new ATOM 0 HE3 LYS A 14 32.353 -8.778 -2.963 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 33.367 -6.801 -2.031 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 34.542 -7.737 -2.823 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 33.940 -6.329 -3.558 1.00 0.00 H new ATOM 235 N GLU A 15 27.829 -10.122 -5.975 1.00 0.00 N ATOM 236 CA GLU A 15 26.629 -10.360 -6.769 1.00 0.00 C ATOM 237 C GLU A 15 25.430 -9.625 -6.176 1.00 0.00 C ATOM 238 O GLU A 15 24.735 -8.887 -6.873 1.00 0.00 O ATOM 239 CB GLU A 15 26.333 -11.859 -6.850 1.00 0.00 C ATOM 240 CG GLU A 15 26.882 -12.521 -8.103 1.00 0.00 C ATOM 241 CD GLU A 15 26.653 -14.020 -8.119 1.00 0.00 C ATOM 242 OE1 GLU A 15 27.247 -14.721 -7.274 1.00 0.00 O ATOM 243 OE2 GLU A 15 25.879 -14.491 -8.978 1.00 0.00 O ATOM 0 H GLU A 15 28.186 -10.947 -5.493 1.00 0.00 H new ATOM 0 HA GLU A 15 26.807 -9.978 -7.774 1.00 0.00 H new ATOM 0 HB2 GLU A 15 26.755 -12.352 -5.974 1.00 0.00 H new ATOM 0 HB3 GLU A 15 25.254 -12.010 -6.812 1.00 0.00 H new ATOM 0 HG2 GLU A 15 26.412 -12.076 -8.980 1.00 0.00 H new ATOM 0 HG3 GLU A 15 27.951 -12.320 -8.177 1.00 0.00 H new ATOM 250 N ALA A 16 25.194 -9.835 -4.885 1.00 0.00 N ATOM 251 CA ALA A 16 24.081 -9.192 -4.197 1.00 0.00 C ATOM 252 C ALA A 16 24.202 -7.673 -4.258 1.00 0.00 C ATOM 253 O ALA A 16 23.213 -6.970 -4.460 1.00 0.00 O ATOM 254 CB ALA A 16 24.012 -9.661 -2.752 1.00 0.00 C ATOM 0 H ALA A 16 25.759 -10.445 -4.294 1.00 0.00 H new ATOM 0 HA ALA A 16 23.159 -9.477 -4.704 1.00 0.00 H new ATOM 0 HB1 ALA A 16 23.176 -9.173 -2.251 1.00 0.00 H new ATOM 0 HB2 ALA A 16 23.869 -10.741 -2.727 1.00 0.00 H new ATOM 0 HB3 ALA A 16 24.941 -9.406 -2.242 1.00 0.00 H new ATOM 260 N GLU A 17 25.421 -7.173 -4.079 1.00 0.00 N ATOM 261 CA GLU A 17 25.670 -5.737 -4.112 1.00 0.00 C ATOM 262 C GLU A 17 25.327 -5.157 -5.481 1.00 0.00 C ATOM 263 O GLU A 17 24.745 -4.076 -5.583 1.00 0.00 O ATOM 264 CB GLU A 17 27.132 -5.442 -3.773 1.00 0.00 C ATOM 265 CG GLU A 17 27.398 -5.319 -2.282 1.00 0.00 C ATOM 266 CD GLU A 17 28.431 -4.257 -1.959 1.00 0.00 C ATOM 267 OE1 GLU A 17 28.158 -3.065 -2.213 1.00 0.00 O ATOM 268 OE2 GLU A 17 29.514 -4.618 -1.452 1.00 0.00 O ATOM 0 H GLU A 17 26.251 -7.741 -3.910 1.00 0.00 H new ATOM 0 HA GLU A 17 25.030 -5.266 -3.366 1.00 0.00 H new ATOM 0 HB2 GLU A 17 27.758 -6.236 -4.181 1.00 0.00 H new ATOM 0 HB3 GLU A 17 27.430 -4.516 -4.264 1.00 0.00 H new ATOM 0 HG2 GLU A 17 26.466 -5.082 -1.769 1.00 0.00 H new ATOM 0 HG3 GLU A 17 27.738 -6.280 -1.897 1.00 0.00 H new ATOM 275 N LYS A 18 25.692 -5.882 -6.533 1.00 0.00 N ATOM 276 CA LYS A 18 25.424 -5.441 -7.897 1.00 0.00 C ATOM 277 C LYS A 18 23.926 -5.442 -8.184 1.00 0.00 C ATOM 278 O LYS A 18 23.416 -4.562 -8.878 1.00 0.00 O ATOM 279 CB LYS A 18 26.146 -6.346 -8.898 1.00 0.00 C ATOM 280 CG LYS A 18 27.659 -6.225 -8.845 1.00 0.00 C ATOM 281 CD LYS A 18 28.179 -5.263 -9.901 1.00 0.00 C ATOM 282 CE LYS A 18 29.550 -4.717 -9.531 1.00 0.00 C ATOM 283 NZ LYS A 18 30.294 -4.231 -10.725 1.00 0.00 N ATOM 0 H LYS A 18 26.175 -6.778 -6.467 1.00 0.00 H new ATOM 0 HA LYS A 18 25.796 -4.422 -8.003 1.00 0.00 H new ATOM 0 HB2 LYS A 18 25.866 -7.382 -8.707 1.00 0.00 H new ATOM 0 HB3 LYS A 18 25.805 -6.104 -9.905 1.00 0.00 H new ATOM 0 HG2 LYS A 18 27.963 -5.881 -7.857 1.00 0.00 H new ATOM 0 HG3 LYS A 18 28.109 -7.207 -8.993 1.00 0.00 H new ATOM 0 HD2 LYS A 18 28.237 -5.773 -10.863 1.00 0.00 H new ATOM 0 HD3 LYS A 18 27.477 -4.437 -10.020 1.00 0.00 H new ATOM 0 HE2 LYS A 18 29.435 -3.901 -8.818 1.00 0.00 H new ATOM 0 HE3 LYS A 18 30.129 -5.496 -9.034 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 31.223 -3.867 -10.431 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 30.426 -5.016 -11.395 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 29.754 -3.470 -11.185 1.00 0.00 H new ATOM 297 N PHE A 19 23.225 -6.434 -7.644 1.00 0.00 N ATOM 298 CA PHE A 19 21.785 -6.548 -7.842 1.00 0.00 C ATOM 299 C PHE A 19 21.038 -5.498 -7.025 1.00 0.00 C ATOM 300 O PHE A 19 20.082 -4.888 -7.503 1.00 0.00 O ATOM 301 CB PHE A 19 21.305 -7.948 -7.455 1.00 0.00 C ATOM 302 CG PHE A 19 21.529 -8.977 -8.527 1.00 0.00 C ATOM 303 CD1 PHE A 19 20.890 -8.869 -9.752 1.00 0.00 C ATOM 304 CD2 PHE A 19 22.377 -10.050 -8.309 1.00 0.00 C ATOM 305 CE1 PHE A 19 21.094 -9.815 -10.739 1.00 0.00 C ATOM 306 CE2 PHE A 19 22.585 -10.998 -9.293 1.00 0.00 C ATOM 307 CZ PHE A 19 21.943 -10.880 -10.510 1.00 0.00 C ATOM 0 H PHE A 19 23.631 -7.170 -7.066 1.00 0.00 H new ATOM 0 HA PHE A 19 21.574 -6.378 -8.898 1.00 0.00 H new ATOM 0 HB2 PHE A 19 21.821 -8.262 -6.548 1.00 0.00 H new ATOM 0 HB3 PHE A 19 20.242 -7.906 -7.219 1.00 0.00 H new ATOM 0 HD1 PHE A 19 20.226 -8.038 -9.937 1.00 0.00 H new ATOM 0 HD2 PHE A 19 22.882 -10.147 -7.359 1.00 0.00 H new ATOM 0 HE1 PHE A 19 20.589 -9.721 -11.689 1.00 0.00 H new ATOM 0 HE2 PHE A 19 23.249 -11.830 -9.110 1.00 0.00 H new ATOM 0 HZ PHE A 19 22.104 -11.619 -11.281 1.00 0.00 H new ATOM 317 N ALA A 20 21.482 -5.293 -5.789 1.00 0.00 N ATOM 318 CA ALA A 20 20.858 -4.317 -4.905 1.00 0.00 C ATOM 319 C ALA A 20 20.833 -2.933 -5.546 1.00 0.00 C ATOM 320 O ALA A 20 19.813 -2.246 -5.520 1.00 0.00 O ATOM 321 CB ALA A 20 21.589 -4.269 -3.571 1.00 0.00 C ATOM 0 H ALA A 20 22.272 -5.790 -5.378 1.00 0.00 H new ATOM 0 HA ALA A 20 19.828 -4.628 -4.731 1.00 0.00 H new ATOM 0 HB1 ALA A 20 21.112 -3.536 -2.921 1.00 0.00 H new ATOM 0 HB2 ALA A 20 21.551 -5.251 -3.100 1.00 0.00 H new ATOM 0 HB3 ALA A 20 22.629 -3.986 -3.736 1.00 0.00 H new ATOM 327 N ALA A 21 21.962 -2.532 -6.120 1.00 0.00 N ATOM 328 CA ALA A 21 22.068 -1.231 -6.769 1.00 0.00 C ATOM 329 C ALA A 21 20.942 -1.026 -7.777 1.00 0.00 C ATOM 330 O ALA A 21 20.297 0.023 -7.798 1.00 0.00 O ATOM 331 CB ALA A 21 23.421 -1.089 -7.451 1.00 0.00 C ATOM 0 H ALA A 21 22.816 -3.089 -6.149 1.00 0.00 H new ATOM 0 HA ALA A 21 21.978 -0.462 -6.001 1.00 0.00 H new ATOM 0 HB1 ALA A 21 23.486 -0.113 -7.931 1.00 0.00 H new ATOM 0 HB2 ALA A 21 24.214 -1.182 -6.709 1.00 0.00 H new ATOM 0 HB3 ALA A 21 23.534 -1.871 -8.202 1.00 0.00 H new ATOM 337 N ILE A 22 20.711 -2.034 -8.611 1.00 0.00 N ATOM 338 CA ILE A 22 19.662 -1.965 -9.621 1.00 0.00 C ATOM 339 C ILE A 22 18.282 -1.889 -8.977 1.00 0.00 C ATOM 340 O ILE A 22 17.466 -1.036 -9.329 1.00 0.00 O ATOM 341 CB ILE A 22 19.709 -3.180 -10.567 1.00 0.00 C ATOM 342 CG1 ILE A 22 21.069 -3.260 -11.262 1.00 0.00 C ATOM 343 CG2 ILE A 22 18.588 -3.097 -11.592 1.00 0.00 C ATOM 344 CD1 ILE A 22 21.569 -4.676 -11.449 1.00 0.00 C ATOM 0 H ILE A 22 21.236 -2.908 -8.607 1.00 0.00 H new ATOM 0 HA ILE A 22 19.841 -1.058 -10.199 1.00 0.00 H new ATOM 0 HB ILE A 22 19.569 -4.086 -9.978 1.00 0.00 H new ATOM 0 HG12 ILE A 22 20.999 -2.776 -12.236 1.00 0.00 H new ATOM 0 HG13 ILE A 22 21.800 -2.699 -10.679 1.00 0.00 H new ATOM 0 HG21 ILE A 22 18.635 -3.962 -12.253 1.00 0.00 H new ATOM 0 HG22 ILE A 22 17.626 -3.084 -11.079 1.00 0.00 H new ATOM 0 HG23 ILE A 22 18.699 -2.185 -12.179 1.00 0.00 H new ATOM 0 HD11 ILE A 22 22.538 -4.657 -11.948 1.00 0.00 H new ATOM 0 HD12 ILE A 22 21.671 -5.157 -10.476 1.00 0.00 H new ATOM 0 HD13 ILE A 22 20.859 -5.235 -12.058 1.00 0.00 H new ATOM 356 N LEU A 23 18.028 -2.785 -8.030 1.00 0.00 N ATOM 357 CA LEU A 23 16.746 -2.820 -7.334 1.00 0.00 C ATOM 358 C LEU A 23 16.410 -1.454 -6.745 1.00 0.00 C ATOM 359 O LEU A 23 15.255 -1.026 -6.763 1.00 0.00 O ATOM 360 CB LEU A 23 16.774 -3.873 -6.225 1.00 0.00 C ATOM 361 CG LEU A 23 15.925 -5.122 -6.464 1.00 0.00 C ATOM 362 CD1 LEU A 23 14.452 -4.755 -6.562 1.00 0.00 C ATOM 363 CD2 LEU A 23 16.381 -5.845 -7.723 1.00 0.00 C ATOM 0 H LEU A 23 18.692 -3.497 -7.726 1.00 0.00 H new ATOM 0 HA LEU A 23 15.974 -3.084 -8.057 1.00 0.00 H new ATOM 0 HB2 LEU A 23 17.808 -4.184 -6.073 1.00 0.00 H new ATOM 0 HB3 LEU A 23 16.443 -3.405 -5.298 1.00 0.00 H new ATOM 0 HG LEU A 23 16.056 -5.794 -5.616 1.00 0.00 H new ATOM 0 HD11 LEU A 23 13.863 -5.656 -6.732 1.00 0.00 H new ATOM 0 HD12 LEU A 23 14.132 -4.282 -5.633 1.00 0.00 H new ATOM 0 HD13 LEU A 23 14.304 -4.063 -7.391 1.00 0.00 H new ATOM 0 HD21 LEU A 23 15.765 -6.731 -7.877 1.00 0.00 H new ATOM 0 HD22 LEU A 23 16.281 -5.180 -8.581 1.00 0.00 H new ATOM 0 HD23 LEU A 23 17.424 -6.142 -7.614 1.00 0.00 H new ATOM 375 N ILE A 24 17.426 -0.773 -6.224 1.00 0.00 N ATOM 376 CA ILE A 24 17.238 0.546 -5.633 1.00 0.00 C ATOM 377 C ILE A 24 16.725 1.543 -6.666 1.00 0.00 C ATOM 378 O ILE A 24 15.830 2.341 -6.385 1.00 0.00 O ATOM 379 CB ILE A 24 18.548 1.082 -5.025 1.00 0.00 C ATOM 380 CG1 ILE A 24 19.045 0.144 -3.923 1.00 0.00 C ATOM 381 CG2 ILE A 24 18.342 2.487 -4.479 1.00 0.00 C ATOM 382 CD1 ILE A 24 20.553 0.054 -3.841 1.00 0.00 C ATOM 0 H ILE A 24 18.387 -1.113 -6.199 1.00 0.00 H new ATOM 0 HA ILE A 24 16.498 0.434 -4.841 1.00 0.00 H new ATOM 0 HB ILE A 24 19.305 1.125 -5.808 1.00 0.00 H new ATOM 0 HG12 ILE A 24 18.657 0.486 -2.964 1.00 0.00 H new ATOM 0 HG13 ILE A 24 18.638 -0.853 -4.095 1.00 0.00 H new ATOM 0 HG21 ILE A 24 19.276 2.852 -4.053 1.00 0.00 H new ATOM 0 HG22 ILE A 24 18.028 3.149 -5.286 1.00 0.00 H new ATOM 0 HG23 ILE A 24 17.574 2.468 -3.706 1.00 0.00 H new ATOM 0 HD11 ILE A 24 20.834 -0.628 -3.038 1.00 0.00 H new ATOM 0 HD12 ILE A 24 20.947 -0.317 -4.787 1.00 0.00 H new ATOM 0 HD13 ILE A 24 20.966 1.042 -3.638 1.00 0.00 H new ATOM 394 N LYS A 25 17.296 1.492 -7.864 1.00 0.00 N ATOM 395 CA LYS A 25 16.896 2.389 -8.942 1.00 0.00 C ATOM 396 C LYS A 25 15.464 2.103 -9.384 1.00 0.00 C ATOM 397 O LYS A 25 14.682 3.024 -9.623 1.00 0.00 O ATOM 398 CB LYS A 25 17.846 2.244 -10.133 1.00 0.00 C ATOM 399 CG LYS A 25 19.304 2.481 -9.780 1.00 0.00 C ATOM 400 CD LYS A 25 19.725 3.910 -10.079 1.00 0.00 C ATOM 401 CE LYS A 25 18.968 4.907 -9.214 1.00 0.00 C ATOM 402 NZ LYS A 25 19.553 6.273 -9.302 1.00 0.00 N ATOM 0 H LYS A 25 18.038 0.838 -8.114 1.00 0.00 H new ATOM 0 HA LYS A 25 16.946 3.411 -8.567 1.00 0.00 H new ATOM 0 HB2 LYS A 25 17.740 1.243 -10.552 1.00 0.00 H new ATOM 0 HB3 LYS A 25 17.550 2.948 -10.911 1.00 0.00 H new ATOM 0 HG2 LYS A 25 19.463 2.268 -8.723 1.00 0.00 H new ATOM 0 HG3 LYS A 25 19.932 1.790 -10.342 1.00 0.00 H new ATOM 0 HD2 LYS A 25 20.796 4.018 -9.908 1.00 0.00 H new ATOM 0 HD3 LYS A 25 19.546 4.130 -11.131 1.00 0.00 H new ATOM 0 HE2 LYS A 25 17.924 4.938 -9.525 1.00 0.00 H new ATOM 0 HE3 LYS A 25 18.982 4.572 -8.177 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 19.009 6.923 -8.699 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 20.542 6.248 -8.981 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 19.517 6.603 -10.287 1.00 0.00 H new ATOM 416 N VAL A 26 15.126 0.822 -9.488 1.00 0.00 N ATOM 417 CA VAL A 26 13.787 0.415 -9.898 1.00 0.00 C ATOM 418 C VAL A 26 12.745 0.837 -8.867 1.00 0.00 C ATOM 419 O VAL A 26 11.655 1.287 -9.219 1.00 0.00 O ATOM 420 CB VAL A 26 13.701 -1.109 -10.104 1.00 0.00 C ATOM 421 CG1 VAL A 26 12.394 -1.483 -10.786 1.00 0.00 C ATOM 422 CG2 VAL A 26 14.893 -1.604 -10.909 1.00 0.00 C ATOM 0 H VAL A 26 15.761 0.048 -9.294 1.00 0.00 H new ATOM 0 HA VAL A 26 13.581 0.914 -10.845 1.00 0.00 H new ATOM 0 HB VAL A 26 13.724 -1.593 -9.128 1.00 0.00 H new ATOM 0 HG11 VAL A 26 12.351 -2.564 -10.923 1.00 0.00 H new ATOM 0 HG12 VAL A 26 11.556 -1.162 -10.167 1.00 0.00 H new ATOM 0 HG13 VAL A 26 12.337 -0.992 -11.757 1.00 0.00 H new ATOM 0 HG21 VAL A 26 14.817 -2.683 -11.046 1.00 0.00 H new ATOM 0 HG22 VAL A 26 14.903 -1.115 -11.883 1.00 0.00 H new ATOM 0 HG23 VAL A 26 15.815 -1.370 -10.376 1.00 0.00 H new ATOM 432 N PHE A 27 13.088 0.688 -7.592 1.00 0.00 N ATOM 433 CA PHE A 27 12.183 1.052 -6.509 1.00 0.00 C ATOM 434 C PHE A 27 11.980 2.564 -6.455 1.00 0.00 C ATOM 435 O PHE A 27 10.867 3.044 -6.243 1.00 0.00 O ATOM 436 CB PHE A 27 12.727 0.551 -5.170 1.00 0.00 C ATOM 437 CG PHE A 27 12.234 -0.817 -4.796 1.00 0.00 C ATOM 438 CD1 PHE A 27 10.876 -1.082 -4.723 1.00 0.00 C ATOM 439 CD2 PHE A 27 13.128 -1.839 -4.519 1.00 0.00 C ATOM 440 CE1 PHE A 27 10.419 -2.340 -4.378 1.00 0.00 C ATOM 441 CE2 PHE A 27 12.677 -3.099 -4.174 1.00 0.00 C ATOM 442 CZ PHE A 27 11.321 -3.350 -4.105 1.00 0.00 C ATOM 0 H PHE A 27 13.987 0.317 -7.284 1.00 0.00 H new ATOM 0 HA PHE A 27 11.219 0.580 -6.701 1.00 0.00 H new ATOM 0 HB2 PHE A 27 13.816 0.537 -5.212 1.00 0.00 H new ATOM 0 HB3 PHE A 27 12.447 1.256 -4.387 1.00 0.00 H new ATOM 0 HD1 PHE A 27 10.166 -0.297 -4.938 1.00 0.00 H new ATOM 0 HD2 PHE A 27 14.190 -1.649 -4.573 1.00 0.00 H new ATOM 0 HE1 PHE A 27 9.358 -2.533 -4.322 1.00 0.00 H new ATOM 0 HE2 PHE A 27 13.384 -3.886 -3.959 1.00 0.00 H new ATOM 0 HZ PHE A 27 10.966 -4.334 -3.838 1.00 0.00 H new ATOM 452 N ALA A 28 13.065 3.307 -6.648 1.00 0.00 N ATOM 453 CA ALA A 28 13.007 4.763 -6.623 1.00 0.00 C ATOM 454 C ALA A 28 12.089 5.295 -7.718 1.00 0.00 C ATOM 455 O ALA A 28 11.267 6.179 -7.477 1.00 0.00 O ATOM 456 CB ALA A 28 14.403 5.350 -6.770 1.00 0.00 C ATOM 0 H ALA A 28 13.994 2.925 -6.823 1.00 0.00 H new ATOM 0 HA ALA A 28 12.596 5.069 -5.661 1.00 0.00 H new ATOM 0 HB1 ALA A 28 14.344 6.438 -6.750 1.00 0.00 H new ATOM 0 HB2 ALA A 28 15.031 5.005 -5.949 1.00 0.00 H new ATOM 0 HB3 ALA A 28 14.835 5.028 -7.717 1.00 0.00 H new ATOM 462 N GLU A 29 12.237 4.752 -8.923 1.00 0.00 N ATOM 463 CA GLU A 29 11.421 5.174 -10.056 1.00 0.00 C ATOM 464 C GLU A 29 9.970 4.738 -9.874 1.00 0.00 C ATOM 465 O GLU A 29 9.066 5.268 -10.521 1.00 0.00 O ATOM 466 CB GLU A 29 11.980 4.597 -11.358 1.00 0.00 C ATOM 467 CG GLU A 29 11.860 3.085 -11.454 1.00 0.00 C ATOM 468 CD GLU A 29 12.072 2.572 -12.865 1.00 0.00 C ATOM 469 OE1 GLU A 29 11.695 3.283 -13.819 1.00 0.00 O ATOM 470 OE2 GLU A 29 12.616 1.457 -13.014 1.00 0.00 O ATOM 0 H GLU A 29 12.914 4.020 -9.139 1.00 0.00 H new ATOM 0 HA GLU A 29 11.451 6.262 -10.107 1.00 0.00 H new ATOM 0 HB2 GLU A 29 11.456 5.049 -12.200 1.00 0.00 H new ATOM 0 HB3 GLU A 29 13.030 4.876 -11.448 1.00 0.00 H new ATOM 0 HG2 GLU A 29 12.591 2.623 -10.790 1.00 0.00 H new ATOM 0 HG3 GLU A 29 10.874 2.780 -11.105 1.00 0.00 H new ATOM 477 N LEU A 30 9.756 3.770 -8.990 1.00 0.00 N ATOM 478 CA LEU A 30 8.415 3.262 -8.722 1.00 0.00 C ATOM 479 C LEU A 30 7.771 4.010 -7.560 1.00 0.00 C ATOM 480 O LEU A 30 6.638 3.724 -7.176 1.00 0.00 O ATOM 481 CB LEU A 30 8.469 1.765 -8.413 1.00 0.00 C ATOM 482 CG LEU A 30 8.811 0.848 -9.588 1.00 0.00 C ATOM 483 CD1 LEU A 30 9.362 -0.478 -9.087 1.00 0.00 C ATOM 484 CD2 LEU A 30 7.587 0.623 -10.463 1.00 0.00 C ATOM 0 H LEU A 30 10.493 3.321 -8.447 1.00 0.00 H new ATOM 0 HA LEU A 30 7.808 3.422 -9.613 1.00 0.00 H new ATOM 0 HB2 LEU A 30 9.206 1.603 -7.626 1.00 0.00 H new ATOM 0 HB3 LEU A 30 7.502 1.462 -8.012 1.00 0.00 H new ATOM 0 HG LEU A 30 9.579 1.333 -10.191 1.00 0.00 H new ATOM 0 HD11 LEU A 30 9.600 -1.118 -9.937 1.00 0.00 H new ATOM 0 HD12 LEU A 30 10.265 -0.300 -8.503 1.00 0.00 H new ATOM 0 HD13 LEU A 30 8.617 -0.969 -8.461 1.00 0.00 H new ATOM 0 HD21 LEU A 30 7.849 -0.032 -11.294 1.00 0.00 H new ATOM 0 HD22 LEU A 30 6.797 0.160 -9.872 1.00 0.00 H new ATOM 0 HD23 LEU A 30 7.237 1.579 -10.851 1.00 0.00 H new ATOM 496 N GLY A 31 8.500 4.974 -7.006 1.00 0.00 N ATOM 497 CA GLY A 31 7.983 5.750 -5.894 1.00 0.00 C ATOM 498 C GLY A 31 8.271 5.106 -4.553 1.00 0.00 C ATOM 499 O GLY A 31 7.764 5.549 -3.522 1.00 0.00 O ATOM 0 H GLY A 31 9.440 5.231 -7.308 1.00 0.00 H new ATOM 0 HA2 GLY A 31 8.422 6.747 -5.916 1.00 0.00 H new ATOM 0 HA3 GLY A 31 6.906 5.873 -6.011 1.00 0.00 H new ATOM 503 N TYR A 32 9.087 4.058 -4.565 1.00 0.00 N ATOM 504 CA TYR A 32 9.439 3.349 -3.340 1.00 0.00 C ATOM 505 C TYR A 32 10.749 3.876 -2.764 1.00 0.00 C ATOM 506 O TYR A 32 11.527 3.126 -2.175 1.00 0.00 O ATOM 507 CB TYR A 32 9.554 1.848 -3.610 1.00 0.00 C ATOM 508 CG TYR A 32 8.240 1.196 -3.979 1.00 0.00 C ATOM 509 CD1 TYR A 32 7.623 1.470 -5.193 1.00 0.00 C ATOM 510 CD2 TYR A 32 7.617 0.306 -3.113 1.00 0.00 C ATOM 511 CE1 TYR A 32 6.422 0.878 -5.533 1.00 0.00 C ATOM 512 CE2 TYR A 32 6.417 -0.292 -3.445 1.00 0.00 C ATOM 513 CZ TYR A 32 5.823 -0.003 -4.656 1.00 0.00 C ATOM 514 OH TYR A 32 4.628 -0.597 -4.992 1.00 0.00 O ATOM 0 H TYR A 32 9.517 3.680 -5.409 1.00 0.00 H new ATOM 0 HA TYR A 32 8.648 3.520 -2.610 1.00 0.00 H new ATOM 0 HB2 TYR A 32 10.269 1.686 -4.416 1.00 0.00 H new ATOM 0 HB3 TYR A 32 9.957 1.358 -2.724 1.00 0.00 H new ATOM 0 HD1 TYR A 32 8.090 2.157 -5.883 1.00 0.00 H new ATOM 0 HD2 TYR A 32 8.079 0.078 -2.164 1.00 0.00 H new ATOM 0 HE1 TYR A 32 5.954 1.104 -6.480 1.00 0.00 H new ATOM 0 HE2 TYR A 32 5.946 -0.982 -2.760 1.00 0.00 H new ATOM 0 HH TYR A 32 4.342 -1.190 -4.266 1.00 0.00 H new ATOM 524 N ASN A 33 10.986 5.172 -2.937 1.00 0.00 N ATOM 525 CA ASN A 33 12.202 5.801 -2.434 1.00 0.00 C ATOM 526 C ASN A 33 12.430 5.449 -0.968 1.00 0.00 C ATOM 527 O ASN A 33 11.510 5.022 -0.270 1.00 0.00 O ATOM 528 CB ASN A 33 12.121 7.320 -2.599 1.00 0.00 C ATOM 529 CG ASN A 33 10.729 7.858 -2.327 1.00 0.00 C ATOM 530 OD1 ASN A 33 9.870 7.813 -3.338 1.00 0.00 O flip ATOM 531 ND2 ASN A 33 10.431 8.307 -1.220 1.00 0.00 N flip ATOM 0 H ASN A 33 10.352 5.807 -3.422 1.00 0.00 H new ATOM 0 HA ASN A 33 13.044 5.423 -3.015 1.00 0.00 H new ATOM 0 HB2 ASN A 33 12.830 7.795 -1.921 1.00 0.00 H new ATOM 0 HB3 ASN A 33 12.420 7.589 -3.612 1.00 0.00 H new ATOM 0 HD21 ASN A 33 11.124 8.322 -0.472 1.00 0.00 H new ATOM 0 HD22 ASN A 33 9.491 8.664 -1.051 1.00 0.00 H new ATOM 538 N ASP A 34 13.663 5.630 -0.506 1.00 0.00 N ATOM 539 CA ASP A 34 14.012 5.333 0.878 1.00 0.00 C ATOM 540 C ASP A 34 14.028 3.828 1.124 1.00 0.00 C ATOM 541 O ASP A 34 13.265 3.314 1.942 1.00 0.00 O ATOM 542 CB ASP A 34 13.025 6.008 1.832 1.00 0.00 C ATOM 543 CG ASP A 34 13.662 6.379 3.157 1.00 0.00 C ATOM 544 OD1 ASP A 34 13.687 5.521 4.064 1.00 0.00 O ATOM 545 OD2 ASP A 34 14.134 7.528 3.287 1.00 0.00 O ATOM 0 H ASP A 34 14.437 5.981 -1.070 1.00 0.00 H new ATOM 0 HA ASP A 34 15.012 5.724 1.066 1.00 0.00 H new ATOM 0 HB2 ASP A 34 12.625 6.906 1.361 1.00 0.00 H new ATOM 0 HB3 ASP A 34 12.183 5.340 2.012 1.00 0.00 H new ATOM 550 N ILE A 35 14.902 3.126 0.409 1.00 0.00 N ATOM 551 CA ILE A 35 15.017 1.680 0.550 1.00 0.00 C ATOM 552 C ILE A 35 16.101 1.310 1.556 1.00 0.00 C ATOM 553 O ILE A 35 17.091 2.024 1.708 1.00 0.00 O ATOM 554 CB ILE A 35 15.332 1.007 -0.799 1.00 0.00 C ATOM 555 CG1 ILE A 35 14.212 0.038 -1.185 1.00 0.00 C ATOM 556 CG2 ILE A 35 16.667 0.280 -0.728 1.00 0.00 C ATOM 557 CD1 ILE A 35 13.056 0.705 -1.897 1.00 0.00 C ATOM 0 H ILE A 35 15.540 3.536 -0.273 1.00 0.00 H new ATOM 0 HA ILE A 35 14.053 1.320 0.910 1.00 0.00 H new ATOM 0 HB ILE A 35 15.400 1.778 -1.566 1.00 0.00 H new ATOM 0 HG12 ILE A 35 14.622 -0.742 -1.826 1.00 0.00 H new ATOM 0 HG13 ILE A 35 13.840 -0.452 -0.285 1.00 0.00 H new ATOM 0 HG21 ILE A 35 16.876 -0.191 -1.688 1.00 0.00 H new ATOM 0 HG22 ILE A 35 17.457 0.993 -0.493 1.00 0.00 H new ATOM 0 HG23 ILE A 35 16.625 -0.484 0.049 1.00 0.00 H new ATOM 0 HD11 ILE A 35 12.299 -0.041 -2.141 1.00 0.00 H new ATOM 0 HD12 ILE A 35 12.620 1.466 -1.250 1.00 0.00 H new ATOM 0 HD13 ILE A 35 13.414 1.171 -2.815 1.00 0.00 H new ATOM 569 N ASN A 36 15.907 0.187 2.241 1.00 0.00 N ATOM 570 CA ASN A 36 16.869 -0.279 3.233 1.00 0.00 C ATOM 571 C ASN A 36 17.093 -1.783 3.108 1.00 0.00 C ATOM 572 O ASN A 36 16.140 -2.559 3.025 1.00 0.00 O ATOM 573 CB ASN A 36 16.384 0.061 4.644 1.00 0.00 C ATOM 574 CG ASN A 36 16.895 1.405 5.123 1.00 0.00 C ATOM 575 OD1 ASN A 36 16.611 2.441 4.521 1.00 0.00 O ATOM 576 ND2 ASN A 36 17.655 1.395 6.212 1.00 0.00 N ATOM 0 H ASN A 36 15.093 -0.417 2.127 1.00 0.00 H new ATOM 0 HA ASN A 36 17.816 0.228 3.050 1.00 0.00 H new ATOM 0 HB2 ASN A 36 15.294 0.063 4.660 1.00 0.00 H new ATOM 0 HB3 ASN A 36 16.711 -0.716 5.335 1.00 0.00 H new ATOM 0 HD21 ASN A 36 18.029 2.269 6.581 1.00 0.00 H new ATOM 0 HD22 ASN A 36 17.865 0.513 6.679 1.00 0.00 H new ATOM 583 N VAL A 37 18.359 -2.189 3.097 1.00 0.00 N ATOM 584 CA VAL A 37 18.708 -3.599 2.985 1.00 0.00 C ATOM 585 C VAL A 37 19.102 -4.178 4.339 1.00 0.00 C ATOM 586 O VAL A 37 19.825 -3.546 5.110 1.00 0.00 O ATOM 587 CB VAL A 37 19.866 -3.813 1.991 1.00 0.00 C ATOM 588 CG1 VAL A 37 21.115 -3.085 2.462 1.00 0.00 C ATOM 589 CG2 VAL A 37 20.141 -5.298 1.806 1.00 0.00 C ATOM 0 H VAL A 37 19.160 -1.560 3.164 1.00 0.00 H new ATOM 0 HA VAL A 37 17.822 -4.116 2.617 1.00 0.00 H new ATOM 0 HB VAL A 37 19.576 -3.398 1.026 1.00 0.00 H new ATOM 0 HG11 VAL A 37 21.922 -3.248 1.748 1.00 0.00 H new ATOM 0 HG12 VAL A 37 20.907 -2.018 2.538 1.00 0.00 H new ATOM 0 HG13 VAL A 37 21.412 -3.467 3.439 1.00 0.00 H new ATOM 0 HG21 VAL A 37 20.962 -5.431 1.101 1.00 0.00 H new ATOM 0 HG22 VAL A 37 20.411 -5.740 2.765 1.00 0.00 H new ATOM 0 HG23 VAL A 37 19.247 -5.788 1.419 1.00 0.00 H new ATOM 599 N THR A 38 18.623 -5.384 4.624 1.00 0.00 N ATOM 600 CA THR A 38 18.924 -6.049 5.885 1.00 0.00 C ATOM 601 C THR A 38 19.273 -7.516 5.665 1.00 0.00 C ATOM 602 O THR A 38 18.428 -8.309 5.250 1.00 0.00 O ATOM 603 CB THR A 38 17.739 -5.957 6.866 1.00 0.00 C ATOM 604 OG1 THR A 38 16.513 -6.232 6.179 1.00 0.00 O ATOM 605 CG2 THR A 38 17.671 -4.577 7.503 1.00 0.00 C ATOM 0 H THR A 38 18.024 -5.921 3.997 1.00 0.00 H new ATOM 0 HA THR A 38 19.784 -5.535 6.315 1.00 0.00 H new ATOM 0 HB THR A 38 17.888 -6.696 7.653 1.00 0.00 H new ATOM 0 HG1 THR A 38 16.636 -7.003 5.586 1.00 0.00 H new ATOM 0 HG21 THR A 38 16.827 -4.535 8.192 1.00 0.00 H new ATOM 0 HG22 THR A 38 18.594 -4.382 8.048 1.00 0.00 H new ATOM 0 HG23 THR A 38 17.543 -3.823 6.726 1.00 0.00 H new ATOM 613 N TRP A 39 20.522 -7.870 5.944 1.00 0.00 N ATOM 614 CA TRP A 39 20.982 -9.244 5.776 1.00 0.00 C ATOM 615 C TRP A 39 20.166 -10.201 6.639 1.00 0.00 C ATOM 616 O TRP A 39 19.922 -9.936 7.816 1.00 0.00 O ATOM 617 CB TRP A 39 22.465 -9.354 6.134 1.00 0.00 C ATOM 618 CG TRP A 39 23.341 -8.445 5.325 1.00 0.00 C ATOM 619 CD1 TRP A 39 23.558 -7.114 5.538 1.00 0.00 C ATOM 620 CD2 TRP A 39 24.114 -8.801 4.174 1.00 0.00 C ATOM 621 NE1 TRP A 39 24.420 -6.621 4.588 1.00 0.00 N ATOM 622 CE2 TRP A 39 24.776 -7.636 3.740 1.00 0.00 C ATOM 623 CE3 TRP A 39 24.313 -9.991 3.469 1.00 0.00 C ATOM 624 CZ2 TRP A 39 25.620 -7.628 2.633 1.00 0.00 C ATOM 625 CZ3 TRP A 39 25.151 -9.982 2.370 1.00 0.00 C ATOM 626 CH2 TRP A 39 25.797 -8.807 1.961 1.00 0.00 C ATOM 0 H TRP A 39 21.234 -7.225 6.287 1.00 0.00 H new ATOM 0 HA TRP A 39 20.846 -9.521 4.731 1.00 0.00 H new ATOM 0 HB2 TRP A 39 22.594 -9.124 7.192 1.00 0.00 H new ATOM 0 HB3 TRP A 39 22.791 -10.384 5.989 1.00 0.00 H new ATOM 0 HD1 TRP A 39 23.117 -6.534 6.335 1.00 0.00 H new ATOM 0 HE1 TRP A 39 24.743 -5.655 4.525 1.00 0.00 H new ATOM 0 HE3 TRP A 39 23.821 -10.901 3.777 1.00 0.00 H new ATOM 0 HZ2 TRP A 39 26.117 -6.723 2.316 1.00 0.00 H new ATOM 0 HZ3 TRP A 39 25.311 -10.896 1.817 1.00 0.00 H new ATOM 0 HH2 TRP A 39 26.447 -8.833 1.099 1.00 0.00 H new ATOM 668 N THR A 43 21.483 -13.909 3.325 1.00 0.00 N ATOM 669 CA THR A 43 20.670 -13.479 2.194 1.00 0.00 C ATOM 670 C THR A 43 20.252 -12.021 2.341 1.00 0.00 C ATOM 671 O THR A 43 19.607 -11.645 3.320 1.00 0.00 O ATOM 672 CB THR A 43 19.409 -14.351 2.045 1.00 0.00 C ATOM 673 OG1 THR A 43 19.402 -15.378 3.043 1.00 0.00 O ATOM 674 CG2 THR A 43 19.346 -14.980 0.662 1.00 0.00 C ATOM 0 HA THR A 43 21.286 -13.589 1.301 1.00 0.00 H new ATOM 0 HB THR A 43 18.535 -13.712 2.176 1.00 0.00 H new ATOM 0 HG1 THR A 43 20.143 -15.232 3.667 1.00 0.00 H new ATOM 0 HG21 THR A 43 18.447 -15.591 0.581 1.00 0.00 H new ATOM 0 HG22 THR A 43 19.321 -14.195 -0.094 1.00 0.00 H new ATOM 0 HG23 THR A 43 20.225 -15.605 0.506 1.00 0.00 H new ATOM 682 N VAL A 44 20.623 -11.202 1.361 1.00 0.00 N ATOM 683 CA VAL A 44 20.284 -9.784 1.380 1.00 0.00 C ATOM 684 C VAL A 44 18.804 -9.569 1.084 1.00 0.00 C ATOM 685 O VAL A 44 18.273 -10.091 0.104 1.00 0.00 O ATOM 686 CB VAL A 44 21.121 -8.994 0.358 1.00 0.00 C ATOM 687 CG1 VAL A 44 22.601 -9.079 0.699 1.00 0.00 C ATOM 688 CG2 VAL A 44 20.861 -9.503 -1.052 1.00 0.00 C ATOM 0 H VAL A 44 21.158 -11.497 0.544 1.00 0.00 H new ATOM 0 HA VAL A 44 20.508 -9.418 2.382 1.00 0.00 H new ATOM 0 HB VAL A 44 20.822 -7.947 0.403 1.00 0.00 H new ATOM 0 HG11 VAL A 44 23.176 -8.514 -0.035 1.00 0.00 H new ATOM 0 HG12 VAL A 44 22.770 -8.662 1.692 1.00 0.00 H new ATOM 0 HG13 VAL A 44 22.918 -10.122 0.685 1.00 0.00 H new ATOM 0 HG21 VAL A 44 21.461 -8.933 -1.761 1.00 0.00 H new ATOM 0 HG22 VAL A 44 21.131 -10.557 -1.114 1.00 0.00 H new ATOM 0 HG23 VAL A 44 19.805 -9.384 -1.293 1.00 0.00 H new ATOM 698 N THR A 45 18.142 -8.795 1.939 1.00 0.00 N ATOM 699 CA THR A 45 16.723 -8.510 1.770 1.00 0.00 C ATOM 700 C THR A 45 16.463 -7.008 1.738 1.00 0.00 C ATOM 701 O THR A 45 16.696 -6.307 2.723 1.00 0.00 O ATOM 702 CB THR A 45 15.885 -9.140 2.898 1.00 0.00 C ATOM 703 OG1 THR A 45 16.356 -10.464 3.177 1.00 0.00 O ATOM 704 CG2 THR A 45 14.413 -9.190 2.516 1.00 0.00 C ATOM 0 H THR A 45 18.566 -8.355 2.755 1.00 0.00 H new ATOM 0 HA THR A 45 16.425 -8.948 0.817 1.00 0.00 H new ATOM 0 HB THR A 45 15.992 -8.521 3.789 1.00 0.00 H new ATOM 0 HG1 THR A 45 15.819 -10.857 3.896 1.00 0.00 H new ATOM 0 HG21 THR A 45 13.841 -9.639 3.328 1.00 0.00 H new ATOM 0 HG22 THR A 45 14.050 -8.179 2.333 1.00 0.00 H new ATOM 0 HG23 THR A 45 14.292 -9.788 1.613 1.00 0.00 H new ATOM 712 N VAL A 46 15.980 -6.519 0.601 1.00 0.00 N ATOM 713 CA VAL A 46 15.687 -5.099 0.442 1.00 0.00 C ATOM 714 C VAL A 46 14.253 -4.785 0.853 1.00 0.00 C ATOM 715 O VAL A 46 13.322 -5.503 0.491 1.00 0.00 O ATOM 716 CB VAL A 46 15.904 -4.641 -1.012 1.00 0.00 C ATOM 717 CG1 VAL A 46 14.846 -5.240 -1.926 1.00 0.00 C ATOM 718 CG2 VAL A 46 15.897 -3.122 -1.098 1.00 0.00 C ATOM 0 H VAL A 46 15.783 -7.085 -0.224 1.00 0.00 H new ATOM 0 HA VAL A 46 16.375 -4.559 1.092 1.00 0.00 H new ATOM 0 HB VAL A 46 16.879 -4.997 -1.345 1.00 0.00 H new ATOM 0 HG11 VAL A 46 15.017 -4.904 -2.949 1.00 0.00 H new ATOM 0 HG12 VAL A 46 14.905 -6.328 -1.886 1.00 0.00 H new ATOM 0 HG13 VAL A 46 13.858 -4.918 -1.599 1.00 0.00 H new ATOM 0 HG21 VAL A 46 16.052 -2.815 -2.132 1.00 0.00 H new ATOM 0 HG22 VAL A 46 14.938 -2.742 -0.746 1.00 0.00 H new ATOM 0 HG23 VAL A 46 16.697 -2.719 -0.477 1.00 0.00 H new ATOM 728 N GLU A 47 14.084 -3.706 1.612 1.00 0.00 N ATOM 729 CA GLU A 47 12.762 -3.297 2.072 1.00 0.00 C ATOM 730 C GLU A 47 12.401 -1.917 1.531 1.00 0.00 C ATOM 731 O GLU A 47 13.078 -0.930 1.815 1.00 0.00 O ATOM 732 CB GLU A 47 12.711 -3.286 3.601 1.00 0.00 C ATOM 733 CG GLU A 47 12.553 -4.667 4.215 1.00 0.00 C ATOM 734 CD GLU A 47 12.747 -4.664 5.719 1.00 0.00 C ATOM 735 OE1 GLU A 47 12.942 -3.571 6.290 1.00 0.00 O ATOM 736 OE2 GLU A 47 12.703 -5.755 6.324 1.00 0.00 O ATOM 0 H GLU A 47 14.845 -3.101 1.921 1.00 0.00 H new ATOM 0 HA GLU A 47 12.036 -4.017 1.696 1.00 0.00 H new ATOM 0 HB2 GLU A 47 13.624 -2.830 3.983 1.00 0.00 H new ATOM 0 HB3 GLU A 47 11.881 -2.657 3.924 1.00 0.00 H new ATOM 0 HG2 GLU A 47 11.561 -5.053 3.981 1.00 0.00 H new ATOM 0 HG3 GLU A 47 13.274 -5.347 3.761 1.00 0.00 H new ATOM 743 N GLY A 48 11.327 -1.856 0.749 1.00 0.00 N ATOM 744 CA GLY A 48 10.894 -0.594 0.179 1.00 0.00 C ATOM 745 C GLY A 48 9.425 -0.317 0.432 1.00 0.00 C ATOM 746 O GLY A 48 8.601 -1.231 0.403 1.00 0.00 O ATOM 0 H GLY A 48 10.749 -2.659 0.500 1.00 0.00 H new ATOM 0 HA2 GLY A 48 11.491 0.215 0.600 1.00 0.00 H new ATOM 0 HA3 GLY A 48 11.079 -0.601 -0.895 1.00 0.00 H new ATOM 750 N GLN A 49 9.097 0.946 0.683 1.00 0.00 N ATOM 751 CA GLN A 49 7.717 1.339 0.944 1.00 0.00 C ATOM 752 C GLN A 49 7.260 2.409 -0.041 1.00 0.00 C ATOM 753 O GLN A 49 8.032 3.292 -0.419 1.00 0.00 O ATOM 754 CB GLN A 49 7.575 1.855 2.377 1.00 0.00 C ATOM 755 CG GLN A 49 8.305 3.164 2.628 1.00 0.00 C ATOM 756 CD GLN A 49 9.807 2.985 2.725 1.00 0.00 C ATOM 757 OE1 GLN A 49 10.516 3.339 1.660 1.00 0.00 O flip ATOM 758 NE2 GLN A 49 10.326 2.534 3.747 1.00 0.00 N flip ATOM 0 H GLN A 49 9.767 1.714 0.711 1.00 0.00 H new ATOM 0 HA GLN A 49 7.085 0.460 0.816 1.00 0.00 H new ATOM 0 HB2 GLN A 49 6.517 1.990 2.602 1.00 0.00 H new ATOM 0 HB3 GLN A 49 7.954 1.100 3.065 1.00 0.00 H new ATOM 0 HG2 GLN A 49 8.077 3.863 1.823 1.00 0.00 H new ATOM 0 HG3 GLN A 49 7.936 3.610 3.551 1.00 0.00 H new ATOM 0 HE21 GLN A 49 9.743 2.274 4.543 1.00 0.00 H new ATOM 0 HE22 GLN A 49 11.338 2.420 3.797 1.00 0.00 H new ATOM 767 N LEU A 50 6.001 2.325 -0.456 1.00 0.00 N ATOM 768 CA LEU A 50 5.440 3.286 -1.399 1.00 0.00 C ATOM 769 C LEU A 50 4.752 4.432 -0.664 1.00 0.00 C ATOM 770 O LEU A 50 4.207 4.246 0.423 1.00 0.00 O ATOM 771 CB LEU A 50 4.445 2.594 -2.332 1.00 0.00 C ATOM 772 CG LEU A 50 3.932 3.429 -3.506 1.00 0.00 C ATOM 773 CD1 LEU A 50 5.095 4.000 -4.302 1.00 0.00 C ATOM 774 CD2 LEU A 50 3.029 2.594 -4.401 1.00 0.00 C ATOM 0 H LEU A 50 5.349 1.601 -0.154 1.00 0.00 H new ATOM 0 HA LEU A 50 6.258 3.697 -1.991 1.00 0.00 H new ATOM 0 HB2 LEU A 50 4.916 1.695 -2.730 1.00 0.00 H new ATOM 0 HB3 LEU A 50 3.588 2.270 -1.741 1.00 0.00 H new ATOM 0 HG LEU A 50 3.348 4.259 -3.109 1.00 0.00 H new ATOM 0 HD11 LEU A 50 4.711 4.591 -5.133 1.00 0.00 H new ATOM 0 HD12 LEU A 50 5.702 4.634 -3.656 1.00 0.00 H new ATOM 0 HD13 LEU A 50 5.707 3.185 -4.688 1.00 0.00 H new ATOM 0 HD21 LEU A 50 2.674 3.205 -5.231 1.00 0.00 H new ATOM 0 HD22 LEU A 50 3.588 1.743 -4.790 1.00 0.00 H new ATOM 0 HD23 LEU A 50 2.177 2.234 -3.824 1.00 0.00 H new ATOM 910 N ARG B 3 24.813 -19.504 -9.277 1.00 0.00 N ATOM 911 CA ARG B 3 23.377 -19.373 -9.493 1.00 0.00 C ATOM 912 C ARG B 3 22.818 -18.180 -8.724 1.00 0.00 C ATOM 913 O ARG B 3 23.299 -17.846 -7.641 1.00 0.00 O ATOM 914 CB ARG B 3 22.656 -20.653 -9.065 1.00 0.00 C ATOM 915 CG ARG B 3 21.142 -20.522 -9.048 1.00 0.00 C ATOM 916 CD ARG B 3 20.632 -20.144 -7.666 1.00 0.00 C ATOM 917 NE ARG B 3 19.425 -20.884 -7.307 1.00 0.00 N ATOM 918 CZ ARG B 3 19.431 -22.151 -6.907 1.00 0.00 C ATOM 919 NH1 ARG B 3 20.574 -22.815 -6.814 1.00 0.00 N ATOM 920 NH2 ARG B 3 18.291 -22.755 -6.597 1.00 0.00 N ATOM 0 HA ARG B 3 23.209 -19.208 -10.557 1.00 0.00 H new ATOM 0 HB2 ARG B 3 22.935 -21.461 -9.742 1.00 0.00 H new ATOM 0 HB3 ARG B 3 22.999 -20.938 -8.070 1.00 0.00 H new ATOM 0 HG2 ARG B 3 20.833 -19.767 -9.770 1.00 0.00 H new ATOM 0 HG3 ARG B 3 20.690 -21.464 -9.359 1.00 0.00 H new ATOM 0 HD2 ARG B 3 21.409 -20.338 -6.927 1.00 0.00 H new ATOM 0 HD3 ARG B 3 20.424 -19.074 -7.636 1.00 0.00 H new ATOM 0 HE ARG B 3 18.528 -20.402 -7.367 1.00 0.00 H new ATOM 0 HH11 ARG B 3 21.453 -22.354 -7.050 1.00 0.00 H new ATOM 0 HH12 ARG B 3 20.575 -23.788 -6.507 1.00 0.00 H new ATOM 0 HH21 ARG B 3 17.409 -22.247 -6.666 1.00 0.00 H new ATOM 0 HH22 ARG B 3 18.296 -23.728 -6.290 1.00 0.00 H new ATOM 934 N VAL B 4 21.799 -17.541 -9.290 1.00 0.00 N ATOM 935 CA VAL B 4 21.174 -16.386 -8.658 1.00 0.00 C ATOM 936 C VAL B 4 19.667 -16.576 -8.534 1.00 0.00 C ATOM 937 O VAL B 4 18.985 -16.869 -9.516 1.00 0.00 O ATOM 938 CB VAL B 4 21.455 -15.094 -9.447 1.00 0.00 C ATOM 939 CG1 VAL B 4 20.813 -13.898 -8.760 1.00 0.00 C ATOM 940 CG2 VAL B 4 22.953 -14.884 -9.611 1.00 0.00 C ATOM 0 H VAL B 4 21.389 -17.804 -10.186 1.00 0.00 H new ATOM 0 HA VAL B 4 21.609 -16.296 -7.662 1.00 0.00 H new ATOM 0 HB VAL B 4 21.015 -15.193 -10.439 1.00 0.00 H new ATOM 0 HG11 VAL B 4 21.022 -12.994 -9.332 1.00 0.00 H new ATOM 0 HG12 VAL B 4 19.735 -14.048 -8.700 1.00 0.00 H new ATOM 0 HG13 VAL B 4 21.221 -13.794 -7.755 1.00 0.00 H new ATOM 0 HG21 VAL B 4 23.133 -13.966 -10.171 1.00 0.00 H new ATOM 0 HG22 VAL B 4 23.419 -14.807 -8.629 1.00 0.00 H new ATOM 0 HG23 VAL B 4 23.382 -15.728 -10.151 1.00 0.00 H new ATOM 950 N ARG B 5 19.152 -16.406 -7.320 1.00 0.00 N ATOM 951 CA ARG B 5 17.725 -16.559 -7.068 1.00 0.00 C ATOM 952 C ARG B 5 17.177 -15.362 -6.296 1.00 0.00 C ATOM 953 O ARG B 5 17.672 -15.026 -5.220 1.00 0.00 O ATOM 954 CB ARG B 5 17.459 -17.848 -6.286 1.00 0.00 C ATOM 955 CG ARG B 5 16.009 -18.014 -5.861 1.00 0.00 C ATOM 956 CD ARG B 5 15.809 -19.282 -5.047 1.00 0.00 C ATOM 957 NE ARG B 5 16.359 -19.160 -3.699 1.00 0.00 N ATOM 958 CZ ARG B 5 15.993 -19.933 -2.683 1.00 0.00 C ATOM 959 NH1 ARG B 5 15.083 -20.881 -2.861 1.00 0.00 N ATOM 960 NH2 ARG B 5 16.539 -19.760 -1.486 1.00 0.00 N ATOM 0 H ARG B 5 19.702 -16.162 -6.496 1.00 0.00 H new ATOM 0 HA ARG B 5 17.216 -16.613 -8.030 1.00 0.00 H new ATOM 0 HB2 ARG B 5 17.749 -18.701 -6.899 1.00 0.00 H new ATOM 0 HB3 ARG B 5 18.093 -17.862 -5.399 1.00 0.00 H new ATOM 0 HG2 ARG B 5 15.700 -17.150 -5.273 1.00 0.00 H new ATOM 0 HG3 ARG B 5 15.371 -18.043 -6.744 1.00 0.00 H new ATOM 0 HD2 ARG B 5 14.745 -19.509 -4.985 1.00 0.00 H new ATOM 0 HD3 ARG B 5 16.284 -20.119 -5.558 1.00 0.00 H new ATOM 0 HE ARG B 5 17.063 -18.442 -3.529 1.00 0.00 H new ATOM 0 HH11 ARG B 5 14.662 -21.018 -3.780 1.00 0.00 H new ATOM 0 HH12 ARG B 5 14.804 -21.473 -2.079 1.00 0.00 H new ATOM 0 HH21 ARG B 5 17.240 -19.033 -1.346 1.00 0.00 H new ATOM 0 HH22 ARG B 5 16.257 -20.354 -0.706 1.00 0.00 H new ATOM 974 N ILE B 6 16.155 -14.723 -6.854 1.00 0.00 N ATOM 975 CA ILE B 6 15.541 -13.564 -6.218 1.00 0.00 C ATOM 976 C ILE B 6 14.043 -13.773 -6.024 1.00 0.00 C ATOM 977 O ILE B 6 13.319 -14.072 -6.974 1.00 0.00 O ATOM 978 CB ILE B 6 15.766 -12.283 -7.044 1.00 0.00 C ATOM 979 CG1 ILE B 6 17.249 -12.125 -7.385 1.00 0.00 C ATOM 980 CG2 ILE B 6 15.260 -11.067 -6.283 1.00 0.00 C ATOM 981 CD1 ILE B 6 17.556 -10.877 -8.183 1.00 0.00 C ATOM 0 H ILE B 6 15.735 -14.988 -7.745 1.00 0.00 H new ATOM 0 HA ILE B 6 16.019 -13.448 -5.245 1.00 0.00 H new ATOM 0 HB ILE B 6 15.205 -12.365 -7.975 1.00 0.00 H new ATOM 0 HG12 ILE B 6 17.826 -12.106 -6.460 1.00 0.00 H new ATOM 0 HG13 ILE B 6 17.579 -12.997 -7.949 1.00 0.00 H new ATOM 0 HG21 ILE B 6 15.426 -10.170 -6.879 1.00 0.00 H new ATOM 0 HG22 ILE B 6 14.194 -11.179 -6.085 1.00 0.00 H new ATOM 0 HG23 ILE B 6 15.797 -10.979 -5.339 1.00 0.00 H new ATOM 0 HD11 ILE B 6 18.625 -10.830 -8.389 1.00 0.00 H new ATOM 0 HD12 ILE B 6 17.006 -10.902 -9.124 1.00 0.00 H new ATOM 0 HD13 ILE B 6 17.258 -9.998 -7.612 1.00 0.00 H new ATOM 993 N SER B 7 13.583 -13.611 -4.787 1.00 0.00 N ATOM 994 CA SER B 7 12.171 -13.783 -4.467 1.00 0.00 C ATOM 995 C SER B 7 11.558 -12.470 -3.991 1.00 0.00 C ATOM 996 O SER B 7 12.163 -11.738 -3.207 1.00 0.00 O ATOM 997 CB SER B 7 11.997 -14.860 -3.394 1.00 0.00 C ATOM 998 OG SER B 7 13.229 -15.502 -3.112 1.00 0.00 O ATOM 0 H SER B 7 14.168 -13.361 -3.990 1.00 0.00 H new ATOM 0 HA SER B 7 11.654 -14.097 -5.374 1.00 0.00 H new ATOM 0 HB2 SER B 7 11.601 -14.410 -2.484 1.00 0.00 H new ATOM 0 HB3 SER B 7 11.267 -15.597 -3.729 1.00 0.00 H new ATOM 0 HG SER B 7 13.092 -16.185 -2.422 1.00 0.00 H new ATOM 1004 N ILE B 8 10.353 -12.179 -4.470 1.00 0.00 N ATOM 1005 CA ILE B 8 9.657 -10.955 -4.093 1.00 0.00 C ATOM 1006 C ILE B 8 8.453 -11.259 -3.208 1.00 0.00 C ATOM 1007 O ILE B 8 7.680 -12.177 -3.483 1.00 0.00 O ATOM 1008 CB ILE B 8 9.184 -10.172 -5.332 1.00 0.00 C ATOM 1009 CG1 ILE B 8 10.363 -9.894 -6.267 1.00 0.00 C ATOM 1010 CG2 ILE B 8 8.515 -8.871 -4.913 1.00 0.00 C ATOM 1011 CD1 ILE B 8 9.950 -9.633 -7.699 1.00 0.00 C ATOM 0 H ILE B 8 9.839 -12.774 -5.120 1.00 0.00 H new ATOM 0 HA ILE B 8 10.369 -10.345 -3.538 1.00 0.00 H new ATOM 0 HB ILE B 8 8.453 -10.777 -5.869 1.00 0.00 H new ATOM 0 HG12 ILE B 8 10.917 -9.032 -5.894 1.00 0.00 H new ATOM 0 HG13 ILE B 8 11.044 -10.745 -6.243 1.00 0.00 H new ATOM 0 HG21 ILE B 8 8.186 -8.329 -5.800 1.00 0.00 H new ATOM 0 HG22 ILE B 8 7.654 -9.091 -4.282 1.00 0.00 H new ATOM 0 HG23 ILE B 8 9.225 -8.259 -4.356 1.00 0.00 H new ATOM 0 HD11 ILE B 8 10.836 -9.444 -8.305 1.00 0.00 H new ATOM 0 HD12 ILE B 8 9.422 -10.503 -8.090 1.00 0.00 H new ATOM 0 HD13 ILE B 8 9.293 -8.764 -7.736 1.00 0.00 H new ATOM 1023 N THR B 9 8.297 -10.479 -2.142 1.00 0.00 N ATOM 1024 CA THR B 9 7.187 -10.663 -1.216 1.00 0.00 C ATOM 1025 C THR B 9 6.112 -9.604 -1.429 1.00 0.00 C ATOM 1026 O THR B 9 5.978 -8.673 -0.635 1.00 0.00 O ATOM 1027 CB THR B 9 7.662 -10.608 0.248 1.00 0.00 C ATOM 1028 OG1 THR B 9 8.993 -11.126 0.351 1.00 0.00 O ATOM 1029 CG2 THR B 9 6.732 -11.406 1.149 1.00 0.00 C ATOM 0 H THR B 9 8.926 -9.714 -1.899 1.00 0.00 H new ATOM 0 HA THR B 9 6.767 -11.649 -1.418 1.00 0.00 H new ATOM 0 HB THR B 9 7.651 -9.567 0.571 1.00 0.00 H new ATOM 0 HG1 THR B 9 9.630 -10.459 0.020 1.00 0.00 H new ATOM 0 HG21 THR B 9 7.088 -11.352 2.178 1.00 0.00 H new ATOM 0 HG22 THR B 9 5.725 -10.992 1.091 1.00 0.00 H new ATOM 0 HG23 THR B 9 6.715 -12.446 0.825 1.00 0.00 H new ATOM 1037 N ALA B 10 5.347 -9.752 -2.506 1.00 0.00 N ATOM 1038 CA ALA B 10 4.282 -8.808 -2.822 1.00 0.00 C ATOM 1039 C ALA B 10 2.921 -9.359 -2.407 1.00 0.00 C ATOM 1040 O ALA B 10 2.716 -10.572 -2.373 1.00 0.00 O ATOM 1041 CB ALA B 10 4.290 -8.481 -4.307 1.00 0.00 C ATOM 0 H ALA B 10 5.445 -10.516 -3.174 1.00 0.00 H new ATOM 0 HA ALA B 10 4.462 -7.892 -2.259 1.00 0.00 H new ATOM 0 HB1 ALA B 10 3.490 -7.775 -4.528 1.00 0.00 H new ATOM 0 HB2 ALA B 10 5.249 -8.039 -4.577 1.00 0.00 H new ATOM 0 HB3 ALA B 10 4.137 -9.395 -4.882 1.00 0.00 H new ATOM 1047 N ARG B 11 1.995 -8.459 -2.091 1.00 0.00 N ATOM 1048 CA ARG B 11 0.655 -8.855 -1.677 1.00 0.00 C ATOM 1049 C ARG B 11 -0.163 -9.338 -2.871 1.00 0.00 C ATOM 1050 O ARG B 11 -0.892 -10.326 -2.779 1.00 0.00 O ATOM 1051 CB ARG B 11 -0.058 -7.684 -0.997 1.00 0.00 C ATOM 1052 CG ARG B 11 -0.187 -6.454 -1.879 1.00 0.00 C ATOM 1053 CD ARG B 11 -0.723 -5.263 -1.100 1.00 0.00 C ATOM 1054 NE ARG B 11 -2.154 -5.384 -0.833 1.00 0.00 N ATOM 1055 CZ ARG B 11 -2.868 -4.449 -0.215 1.00 0.00 C ATOM 1056 NH1 ARG B 11 -2.286 -3.332 0.198 1.00 0.00 N ATOM 1057 NH2 ARG B 11 -4.166 -4.632 -0.008 1.00 0.00 N ATOM 0 H ARG B 11 2.149 -7.451 -2.114 1.00 0.00 H new ATOM 0 HA ARG B 11 0.749 -9.677 -0.967 1.00 0.00 H new ATOM 0 HB2 ARG B 11 -1.053 -8.005 -0.689 1.00 0.00 H new ATOM 0 HB3 ARG B 11 0.485 -7.416 -0.091 1.00 0.00 H new ATOM 0 HG2 ARG B 11 0.786 -6.205 -2.302 1.00 0.00 H new ATOM 0 HG3 ARG B 11 -0.852 -6.672 -2.715 1.00 0.00 H new ATOM 0 HD2 ARG B 11 -0.184 -5.174 -0.157 1.00 0.00 H new ATOM 0 HD3 ARG B 11 -0.535 -4.348 -1.662 1.00 0.00 H new ATOM 0 HE ARG B 11 -2.631 -6.232 -1.138 1.00 0.00 H new ATOM 0 HH11 ARG B 11 -1.288 -3.189 0.042 1.00 0.00 H new ATOM 0 HH12 ARG B 11 -2.836 -2.616 0.672 1.00 0.00 H new ATOM 0 HH21 ARG B 11 -4.617 -5.491 -0.323 1.00 0.00 H new ATOM 0 HH22 ARG B 11 -4.713 -3.914 0.466 1.00 0.00 H new ATOM 1071 N THR B 12 -0.037 -8.634 -3.992 1.00 0.00 N ATOM 1072 CA THR B 12 -0.765 -8.990 -5.203 1.00 0.00 C ATOM 1073 C THR B 12 0.187 -9.443 -6.304 1.00 0.00 C ATOM 1074 O THR B 12 1.369 -9.098 -6.298 1.00 0.00 O ATOM 1075 CB THR B 12 -1.605 -7.807 -5.722 1.00 0.00 C ATOM 1076 OG1 THR B 12 -2.017 -8.053 -7.071 1.00 0.00 O ATOM 1077 CG2 THR B 12 -0.811 -6.511 -5.657 1.00 0.00 C ATOM 0 H THR B 12 0.562 -7.814 -4.086 1.00 0.00 H new ATOM 0 HA THR B 12 -1.431 -9.812 -4.941 1.00 0.00 H new ATOM 0 HB THR B 12 -2.485 -7.708 -5.087 1.00 0.00 H new ATOM 0 HG1 THR B 12 -2.552 -7.297 -7.393 1.00 0.00 H new ATOM 0 HG21 THR B 12 -1.424 -5.690 -6.028 1.00 0.00 H new ATOM 0 HG22 THR B 12 -0.524 -6.312 -4.625 1.00 0.00 H new ATOM 0 HG23 THR B 12 0.085 -6.602 -6.271 1.00 0.00 H new ATOM 1085 N LYS B 13 -0.334 -10.219 -7.248 1.00 0.00 N ATOM 1086 CA LYS B 13 0.468 -10.719 -8.358 1.00 0.00 C ATOM 1087 C LYS B 13 0.839 -9.589 -9.314 1.00 0.00 C ATOM 1088 O LYS B 13 1.857 -9.654 -10.003 1.00 0.00 O ATOM 1089 CB LYS B 13 -0.292 -11.811 -9.113 1.00 0.00 C ATOM 1090 CG LYS B 13 -1.699 -11.405 -9.517 1.00 0.00 C ATOM 1091 CD LYS B 13 -2.343 -12.447 -10.417 1.00 0.00 C ATOM 1092 CE LYS B 13 -3.778 -12.732 -10.000 1.00 0.00 C ATOM 1093 NZ LYS B 13 -4.422 -13.742 -10.885 1.00 0.00 N ATOM 0 H LYS B 13 -1.310 -10.516 -7.266 1.00 0.00 H new ATOM 0 HA LYS B 13 1.386 -11.141 -7.949 1.00 0.00 H new ATOM 0 HB2 LYS B 13 0.270 -12.081 -10.007 1.00 0.00 H new ATOM 0 HB3 LYS B 13 -0.345 -12.703 -8.489 1.00 0.00 H new ATOM 0 HG2 LYS B 13 -2.309 -11.267 -8.624 1.00 0.00 H new ATOM 0 HG3 LYS B 13 -1.668 -10.446 -10.034 1.00 0.00 H new ATOM 0 HD2 LYS B 13 -2.325 -12.099 -11.450 1.00 0.00 H new ATOM 0 HD3 LYS B 13 -1.763 -13.369 -10.382 1.00 0.00 H new ATOM 0 HE2 LYS B 13 -3.793 -13.089 -8.970 1.00 0.00 H new ATOM 0 HE3 LYS B 13 -4.354 -11.807 -10.025 1.00 0.00 H new ATOM 0 HZ1 LYS B 13 -5.398 -13.909 -10.568 1.00 0.00 H new ATOM 0 HZ2 LYS B 13 -4.431 -13.391 -11.864 1.00 0.00 H new ATOM 0 HZ3 LYS B 13 -3.887 -14.633 -10.842 1.00 0.00 H new ATOM 1107 N LYS B 14 0.006 -8.554 -9.351 1.00 0.00 N ATOM 1108 CA LYS B 14 0.247 -7.409 -10.220 1.00 0.00 C ATOM 1109 C LYS B 14 1.539 -6.695 -9.834 1.00 0.00 C ATOM 1110 O LYS B 14 2.321 -6.300 -10.698 1.00 0.00 O ATOM 1111 CB LYS B 14 -0.929 -6.432 -10.148 1.00 0.00 C ATOM 1112 CG LYS B 14 -1.952 -6.628 -11.254 1.00 0.00 C ATOM 1113 CD LYS B 14 -2.810 -7.858 -11.008 1.00 0.00 C ATOM 1114 CE LYS B 14 -2.588 -8.915 -12.079 1.00 0.00 C ATOM 1115 NZ LYS B 14 -3.296 -8.579 -13.345 1.00 0.00 N ATOM 0 H LYS B 14 -0.842 -8.485 -8.789 1.00 0.00 H new ATOM 0 HA LYS B 14 0.346 -7.775 -11.242 1.00 0.00 H new ATOM 0 HB2 LYS B 14 -1.424 -6.543 -9.183 1.00 0.00 H new ATOM 0 HB3 LYS B 14 -0.547 -5.412 -10.195 1.00 0.00 H new ATOM 0 HG2 LYS B 14 -2.589 -5.746 -11.322 1.00 0.00 H new ATOM 0 HG3 LYS B 14 -1.440 -6.726 -12.211 1.00 0.00 H new ATOM 0 HD2 LYS B 14 -2.577 -8.276 -10.029 1.00 0.00 H new ATOM 0 HD3 LYS B 14 -3.862 -7.572 -10.990 1.00 0.00 H new ATOM 0 HE2 LYS B 14 -1.520 -9.014 -12.275 1.00 0.00 H new ATOM 0 HE3 LYS B 14 -2.936 -9.881 -11.714 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 -3.120 -9.324 -14.049 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 -4.318 -8.509 -13.163 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 -2.946 -7.669 -13.708 1.00 0.00 H new ATOM 1129 N GLU B 15 1.755 -6.535 -8.533 1.00 0.00 N ATOM 1130 CA GLU B 15 2.953 -5.869 -8.035 1.00 0.00 C ATOM 1131 C GLU B 15 4.199 -6.699 -8.330 1.00 0.00 C ATOM 1132 O GLU B 15 5.170 -6.200 -8.898 1.00 0.00 O ATOM 1133 CB GLU B 15 2.837 -5.622 -6.529 1.00 0.00 C ATOM 1134 CG GLU B 15 2.436 -4.200 -6.175 1.00 0.00 C ATOM 1135 CD GLU B 15 2.325 -3.980 -4.679 1.00 0.00 C ATOM 1136 OE1 GLU B 15 2.319 -4.980 -3.931 1.00 0.00 O ATOM 1137 OE2 GLU B 15 2.243 -2.808 -4.257 1.00 0.00 O ATOM 0 H GLU B 15 1.117 -6.857 -7.805 1.00 0.00 H new ATOM 0 HA GLU B 15 3.045 -4.911 -8.548 1.00 0.00 H new ATOM 0 HB2 GLU B 15 2.104 -6.312 -6.112 1.00 0.00 H new ATOM 0 HB3 GLU B 15 3.793 -5.849 -6.057 1.00 0.00 H new ATOM 0 HG2 GLU B 15 3.169 -3.507 -6.587 1.00 0.00 H new ATOM 0 HG3 GLU B 15 1.480 -3.969 -6.644 1.00 0.00 H new ATOM 1144 N ALA B 16 4.164 -7.969 -7.940 1.00 0.00 N ATOM 1145 CA ALA B 16 5.289 -8.869 -8.164 1.00 0.00 C ATOM 1146 C ALA B 16 5.577 -9.027 -9.653 1.00 0.00 C ATOM 1147 O ALA B 16 6.733 -9.024 -10.074 1.00 0.00 O ATOM 1148 CB ALA B 16 5.014 -10.225 -7.530 1.00 0.00 C ATOM 0 H ALA B 16 3.369 -8.398 -7.467 1.00 0.00 H new ATOM 0 HA ALA B 16 6.171 -8.433 -7.695 1.00 0.00 H new ATOM 0 HB1 ALA B 16 5.862 -10.887 -7.705 1.00 0.00 H new ATOM 0 HB2 ALA B 16 4.865 -10.102 -6.457 1.00 0.00 H new ATOM 0 HB3 ALA B 16 4.118 -10.659 -7.973 1.00 0.00 H new ATOM 1154 N GLU B 17 4.518 -9.166 -10.444 1.00 0.00 N ATOM 1155 CA GLU B 17 4.659 -9.327 -11.887 1.00 0.00 C ATOM 1156 C GLU B 17 5.411 -8.147 -12.495 1.00 0.00 C ATOM 1157 O GLU B 17 6.256 -8.321 -13.374 1.00 0.00 O ATOM 1158 CB GLU B 17 3.284 -9.464 -12.544 1.00 0.00 C ATOM 1159 CG GLU B 17 2.742 -10.883 -12.532 1.00 0.00 C ATOM 1160 CD GLU B 17 2.564 -11.452 -13.926 1.00 0.00 C ATOM 1161 OE1 GLU B 17 3.566 -11.521 -14.669 1.00 0.00 O ATOM 1162 OE2 GLU B 17 1.426 -11.827 -14.274 1.00 0.00 O ATOM 0 H GLU B 17 3.554 -9.170 -10.111 1.00 0.00 H new ATOM 0 HA GLU B 17 5.233 -10.235 -12.071 1.00 0.00 H new ATOM 0 HB2 GLU B 17 2.579 -8.810 -12.031 1.00 0.00 H new ATOM 0 HB3 GLU B 17 3.347 -9.117 -13.575 1.00 0.00 H new ATOM 0 HG2 GLU B 17 3.420 -11.522 -11.967 1.00 0.00 H new ATOM 0 HG3 GLU B 17 1.784 -10.897 -12.013 1.00 0.00 H new ATOM 1169 N LYS B 18 5.098 -6.946 -12.021 1.00 0.00 N ATOM 1170 CA LYS B 18 5.743 -5.736 -12.516 1.00 0.00 C ATOM 1171 C LYS B 18 7.240 -5.758 -12.222 1.00 0.00 C ATOM 1172 O LYS B 18 8.045 -5.263 -13.011 1.00 0.00 O ATOM 1173 CB LYS B 18 5.106 -4.498 -11.882 1.00 0.00 C ATOM 1174 CG LYS B 18 3.695 -4.221 -12.372 1.00 0.00 C ATOM 1175 CD LYS B 18 3.692 -3.259 -13.548 1.00 0.00 C ATOM 1176 CE LYS B 18 2.349 -3.257 -14.263 1.00 0.00 C ATOM 1177 NZ LYS B 18 2.245 -2.141 -15.243 1.00 0.00 N ATOM 0 H LYS B 18 4.401 -6.785 -11.294 1.00 0.00 H new ATOM 0 HA LYS B 18 5.603 -5.696 -13.596 1.00 0.00 H new ATOM 0 HB2 LYS B 18 5.088 -4.623 -10.799 1.00 0.00 H new ATOM 0 HB3 LYS B 18 5.731 -3.630 -12.092 1.00 0.00 H new ATOM 0 HG2 LYS B 18 3.220 -5.157 -12.666 1.00 0.00 H new ATOM 0 HG3 LYS B 18 3.102 -3.804 -11.558 1.00 0.00 H new ATOM 0 HD2 LYS B 18 3.920 -2.253 -13.197 1.00 0.00 H new ATOM 0 HD3 LYS B 18 4.478 -3.538 -14.249 1.00 0.00 H new ATOM 0 HE2 LYS B 18 2.211 -4.207 -14.779 1.00 0.00 H new ATOM 0 HE3 LYS B 18 1.547 -3.172 -13.530 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 1.316 -2.174 -15.709 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 2.352 -1.233 -14.748 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 2.995 -2.236 -15.958 1.00 0.00 H new ATOM 1191 N PHE B 19 7.606 -6.335 -11.082 1.00 0.00 N ATOM 1192 CA PHE B 19 9.006 -6.421 -10.684 1.00 0.00 C ATOM 1193 C PHE B 19 9.743 -7.470 -11.512 1.00 0.00 C ATOM 1194 O PHE B 19 10.883 -7.261 -11.925 1.00 0.00 O ATOM 1195 CB PHE B 19 9.115 -6.761 -9.196 1.00 0.00 C ATOM 1196 CG PHE B 19 8.869 -5.586 -8.293 1.00 0.00 C ATOM 1197 CD1 PHE B 19 9.775 -4.540 -8.233 1.00 0.00 C ATOM 1198 CD2 PHE B 19 7.730 -5.528 -7.506 1.00 0.00 C ATOM 1199 CE1 PHE B 19 9.551 -3.458 -7.402 1.00 0.00 C ATOM 1200 CE2 PHE B 19 7.501 -4.448 -6.673 1.00 0.00 C ATOM 1201 CZ PHE B 19 8.412 -3.412 -6.623 1.00 0.00 C ATOM 0 H PHE B 19 6.952 -6.750 -10.418 1.00 0.00 H new ATOM 0 HA PHE B 19 9.469 -5.451 -10.863 1.00 0.00 H new ATOM 0 HB2 PHE B 19 8.399 -7.548 -8.958 1.00 0.00 H new ATOM 0 HB3 PHE B 19 10.108 -7.162 -8.995 1.00 0.00 H new ATOM 0 HD1 PHE B 19 10.666 -4.570 -8.842 1.00 0.00 H new ATOM 0 HD2 PHE B 19 7.013 -6.335 -7.544 1.00 0.00 H new ATOM 0 HE1 PHE B 19 10.266 -2.650 -7.362 1.00 0.00 H new ATOM 0 HE2 PHE B 19 6.611 -4.415 -6.062 1.00 0.00 H new ATOM 0 HZ PHE B 19 8.234 -2.566 -5.975 1.00 0.00 H new ATOM 1211 N ALA B 20 9.082 -8.598 -11.751 1.00 0.00 N ATOM 1212 CA ALA B 20 9.673 -9.679 -12.530 1.00 0.00 C ATOM 1213 C ALA B 20 10.116 -9.186 -13.903 1.00 0.00 C ATOM 1214 O ALA B 20 11.210 -9.510 -14.366 1.00 0.00 O ATOM 1215 CB ALA B 20 8.685 -10.827 -12.672 1.00 0.00 C ATOM 0 H ALA B 20 8.137 -8.787 -11.416 1.00 0.00 H new ATOM 0 HA ALA B 20 10.555 -10.037 -12.000 1.00 0.00 H new ATOM 0 HB1 ALA B 20 9.139 -11.628 -13.256 1.00 0.00 H new ATOM 0 HB2 ALA B 20 8.420 -11.204 -11.684 1.00 0.00 H new ATOM 0 HB3 ALA B 20 7.787 -10.473 -13.178 1.00 0.00 H new ATOM 1221 N ALA B 21 9.260 -8.403 -14.551 1.00 0.00 N ATOM 1222 CA ALA B 21 9.564 -7.866 -15.871 1.00 0.00 C ATOM 1223 C ALA B 21 10.926 -7.179 -15.884 1.00 0.00 C ATOM 1224 O ALA B 21 11.743 -7.417 -16.774 1.00 0.00 O ATOM 1225 CB ALA B 21 8.478 -6.895 -16.309 1.00 0.00 C ATOM 0 H ALA B 21 8.350 -8.126 -14.183 1.00 0.00 H new ATOM 0 HA ALA B 21 9.598 -8.698 -16.575 1.00 0.00 H new ATOM 0 HB1 ALA B 21 8.718 -6.502 -17.297 1.00 0.00 H new ATOM 0 HB2 ALA B 21 7.520 -7.414 -16.348 1.00 0.00 H new ATOM 0 HB3 ALA B 21 8.416 -6.073 -15.596 1.00 0.00 H new ATOM 1231 N ILE B 22 11.163 -6.327 -14.892 1.00 0.00 N ATOM 1232 CA ILE B 22 12.426 -5.607 -14.790 1.00 0.00 C ATOM 1233 C ILE B 22 13.581 -6.561 -14.507 1.00 0.00 C ATOM 1234 O ILE B 22 14.619 -6.510 -15.169 1.00 0.00 O ATOM 1235 CB ILE B 22 12.376 -4.537 -13.683 1.00 0.00 C ATOM 1236 CG1 ILE B 22 11.233 -3.554 -13.944 1.00 0.00 C ATOM 1237 CG2 ILE B 22 13.705 -3.802 -13.596 1.00 0.00 C ATOM 1238 CD1 ILE B 22 10.459 -3.182 -12.699 1.00 0.00 C ATOM 0 H ILE B 22 10.497 -6.119 -14.148 1.00 0.00 H new ATOM 0 HA ILE B 22 12.589 -5.118 -15.750 1.00 0.00 H new ATOM 0 HB ILE B 22 12.194 -5.031 -12.729 1.00 0.00 H new ATOM 0 HG12 ILE B 22 11.639 -2.648 -14.393 1.00 0.00 H new ATOM 0 HG13 ILE B 22 10.548 -3.991 -14.671 1.00 0.00 H new ATOM 0 HG21 ILE B 22 13.654 -3.049 -12.809 1.00 0.00 H new ATOM 0 HG22 ILE B 22 14.499 -4.512 -13.367 1.00 0.00 H new ATOM 0 HG23 ILE B 22 13.916 -3.317 -14.549 1.00 0.00 H new ATOM 0 HD11 ILE B 22 9.665 -2.483 -12.960 1.00 0.00 H new ATOM 0 HD12 ILE B 22 10.023 -4.079 -12.260 1.00 0.00 H new ATOM 0 HD13 ILE B 22 11.131 -2.716 -11.979 1.00 0.00 H new ATOM 1250 N LEU B 23 13.394 -7.433 -13.522 1.00 0.00 N ATOM 1251 CA LEU B 23 14.421 -8.401 -13.153 1.00 0.00 C ATOM 1252 C LEU B 23 14.902 -9.178 -14.375 1.00 0.00 C ATOM 1253 O LEU B 23 16.096 -9.438 -14.526 1.00 0.00 O ATOM 1254 CB LEU B 23 13.880 -9.370 -12.099 1.00 0.00 C ATOM 1255 CG LEU B 23 14.451 -9.215 -10.689 1.00 0.00 C ATOM 1256 CD1 LEU B 23 15.951 -9.469 -10.690 1.00 0.00 C ATOM 1257 CD2 LEU B 23 14.144 -7.830 -10.138 1.00 0.00 C ATOM 0 H LEU B 23 12.541 -7.489 -12.965 1.00 0.00 H new ATOM 0 HA LEU B 23 15.268 -7.855 -12.737 1.00 0.00 H new ATOM 0 HB2 LEU B 23 12.798 -9.251 -12.046 1.00 0.00 H new ATOM 0 HB3 LEU B 23 14.072 -10.388 -12.437 1.00 0.00 H new ATOM 0 HG LEU B 23 13.978 -9.954 -10.043 1.00 0.00 H new ATOM 0 HD11 LEU B 23 16.340 -9.354 -9.678 1.00 0.00 H new ATOM 0 HD12 LEU B 23 16.148 -10.482 -11.042 1.00 0.00 H new ATOM 0 HD13 LEU B 23 16.441 -8.753 -11.350 1.00 0.00 H new ATOM 0 HD21 LEU B 23 14.558 -7.738 -9.134 1.00 0.00 H new ATOM 0 HD22 LEU B 23 14.589 -7.074 -10.785 1.00 0.00 H new ATOM 0 HD23 LEU B 23 13.064 -7.685 -10.100 1.00 0.00 H new ATOM 1269 N ILE B 24 13.965 -9.543 -15.243 1.00 0.00 N ATOM 1270 CA ILE B 24 14.294 -10.287 -16.453 1.00 0.00 C ATOM 1271 C ILE B 24 15.271 -9.508 -17.328 1.00 0.00 C ATOM 1272 O ILE B 24 16.243 -10.064 -17.839 1.00 0.00 O ATOM 1273 CB ILE B 24 13.033 -10.612 -17.275 1.00 0.00 C ATOM 1274 CG1 ILE B 24 12.061 -11.454 -16.446 1.00 0.00 C ATOM 1275 CG2 ILE B 24 13.409 -11.337 -18.558 1.00 0.00 C ATOM 1276 CD1 ILE B 24 10.606 -11.137 -16.714 1.00 0.00 C ATOM 0 H ILE B 24 12.972 -9.336 -15.131 1.00 0.00 H new ATOM 0 HA ILE B 24 14.759 -11.220 -16.133 1.00 0.00 H new ATOM 0 HB ILE B 24 12.539 -9.677 -17.541 1.00 0.00 H new ATOM 0 HG12 ILE B 24 12.239 -12.509 -16.654 1.00 0.00 H new ATOM 0 HG13 ILE B 24 12.269 -11.298 -15.388 1.00 0.00 H new ATOM 0 HG21 ILE B 24 12.507 -11.560 -19.128 1.00 0.00 H new ATOM 0 HG22 ILE B 24 14.068 -10.705 -19.154 1.00 0.00 H new ATOM 0 HG23 ILE B 24 13.922 -12.267 -18.313 1.00 0.00 H new ATOM 0 HD11 ILE B 24 9.975 -11.771 -16.092 1.00 0.00 H new ATOM 0 HD12 ILE B 24 10.412 -10.090 -16.479 1.00 0.00 H new ATOM 0 HD13 ILE B 24 10.381 -11.320 -17.765 1.00 0.00 H new ATOM 1288 N LYS B 25 15.006 -8.217 -17.496 1.00 0.00 N ATOM 1289 CA LYS B 25 15.863 -7.359 -18.306 1.00 0.00 C ATOM 1290 C LYS B 25 17.254 -7.244 -17.693 1.00 0.00 C ATOM 1291 O LYS B 25 18.261 -7.290 -18.400 1.00 0.00 O ATOM 1292 CB LYS B 25 15.239 -5.969 -18.448 1.00 0.00 C ATOM 1293 CG LYS B 25 13.834 -5.988 -19.024 1.00 0.00 C ATOM 1294 CD LYS B 25 13.842 -5.739 -20.523 1.00 0.00 C ATOM 1295 CE LYS B 25 14.571 -6.847 -21.268 1.00 0.00 C ATOM 1296 NZ LYS B 25 14.180 -6.899 -22.704 1.00 0.00 N ATOM 0 H LYS B 25 14.204 -7.742 -17.082 1.00 0.00 H new ATOM 0 HA LYS B 25 15.958 -7.811 -19.294 1.00 0.00 H new ATOM 0 HB2 LYS B 25 15.215 -5.489 -17.470 1.00 0.00 H new ATOM 0 HB3 LYS B 25 15.876 -5.358 -19.087 1.00 0.00 H new ATOM 0 HG2 LYS B 25 13.368 -6.951 -18.817 1.00 0.00 H new ATOM 0 HG3 LYS B 25 13.228 -5.228 -18.531 1.00 0.00 H new ATOM 0 HD2 LYS B 25 12.817 -5.668 -20.887 1.00 0.00 H new ATOM 0 HD3 LYS B 25 14.321 -4.782 -20.732 1.00 0.00 H new ATOM 0 HE2 LYS B 25 15.647 -6.691 -21.190 1.00 0.00 H new ATOM 0 HE3 LYS B 25 14.353 -7.806 -20.797 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 14.698 -7.667 -23.177 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 13.158 -7.074 -22.779 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 14.411 -5.993 -23.160 1.00 0.00 H new ATOM 1310 N VAL B 26 17.304 -7.096 -16.373 1.00 0.00 N ATOM 1311 CA VAL B 26 18.573 -6.977 -15.664 1.00 0.00 C ATOM 1312 C VAL B 26 19.384 -8.263 -15.770 1.00 0.00 C ATOM 1313 O VAL B 26 20.603 -8.229 -15.942 1.00 0.00 O ATOM 1314 CB VAL B 26 18.355 -6.641 -14.177 1.00 0.00 C ATOM 1315 CG1 VAL B 26 19.671 -6.257 -13.518 1.00 0.00 C ATOM 1316 CG2 VAL B 26 17.329 -5.528 -14.027 1.00 0.00 C ATOM 0 H VAL B 26 16.480 -7.056 -15.773 1.00 0.00 H new ATOM 0 HA VAL B 26 19.125 -6.164 -16.135 1.00 0.00 H new ATOM 0 HB VAL B 26 17.970 -7.528 -13.675 1.00 0.00 H new ATOM 0 HG11 VAL B 26 19.497 -6.023 -12.468 1.00 0.00 H new ATOM 0 HG12 VAL B 26 20.372 -7.088 -13.593 1.00 0.00 H new ATOM 0 HG13 VAL B 26 20.088 -5.384 -14.020 1.00 0.00 H new ATOM 0 HG21 VAL B 26 17.187 -5.304 -12.970 1.00 0.00 H new ATOM 0 HG22 VAL B 26 17.682 -4.635 -14.543 1.00 0.00 H new ATOM 0 HG23 VAL B 26 16.381 -5.846 -14.460 1.00 0.00 H new ATOM 1326 N PHE B 27 18.700 -9.398 -15.667 1.00 0.00 N ATOM 1327 CA PHE B 27 19.357 -10.697 -15.751 1.00 0.00 C ATOM 1328 C PHE B 27 19.841 -10.971 -17.172 1.00 0.00 C ATOM 1329 O PHE B 27 20.947 -11.471 -17.377 1.00 0.00 O ATOM 1330 CB PHE B 27 18.402 -11.805 -15.303 1.00 0.00 C ATOM 1331 CG PHE B 27 18.490 -12.116 -13.836 1.00 0.00 C ATOM 1332 CD1 PHE B 27 19.698 -12.479 -13.263 1.00 0.00 C ATOM 1333 CD2 PHE B 27 17.366 -12.044 -13.030 1.00 0.00 C ATOM 1334 CE1 PHE B 27 19.782 -12.766 -11.913 1.00 0.00 C ATOM 1335 CE2 PHE B 27 17.443 -12.329 -11.680 1.00 0.00 C ATOM 1336 CZ PHE B 27 18.654 -12.690 -11.121 1.00 0.00 C ATOM 0 H PHE B 27 17.691 -9.444 -15.525 1.00 0.00 H new ATOM 0 HA PHE B 27 20.222 -10.682 -15.088 1.00 0.00 H new ATOM 0 HB2 PHE B 27 17.380 -11.512 -15.543 1.00 0.00 H new ATOM 0 HB3 PHE B 27 18.616 -12.710 -15.872 1.00 0.00 H new ATOM 0 HD1 PHE B 27 20.584 -12.538 -13.878 1.00 0.00 H new ATOM 0 HD2 PHE B 27 16.417 -11.762 -13.462 1.00 0.00 H new ATOM 0 HE1 PHE B 27 20.729 -13.049 -11.479 1.00 0.00 H new ATOM 0 HE2 PHE B 27 16.558 -12.270 -11.063 1.00 0.00 H new ATOM 0 HZ PHE B 27 18.718 -12.912 -10.066 1.00 0.00 H new ATOM 1346 N ALA B 28 19.004 -10.641 -18.150 1.00 0.00 N ATOM 1347 CA ALA B 28 19.345 -10.849 -19.551 1.00 0.00 C ATOM 1348 C ALA B 28 20.561 -10.020 -19.949 1.00 0.00 C ATOM 1349 O ALA B 28 21.475 -10.517 -20.607 1.00 0.00 O ATOM 1350 CB ALA B 28 18.158 -10.510 -20.440 1.00 0.00 C ATOM 0 H ALA B 28 18.084 -10.228 -17.997 1.00 0.00 H new ATOM 0 HA ALA B 28 19.596 -11.901 -19.685 1.00 0.00 H new ATOM 0 HB1 ALA B 28 18.428 -10.670 -21.484 1.00 0.00 H new ATOM 0 HB2 ALA B 28 17.315 -11.150 -20.181 1.00 0.00 H new ATOM 0 HB3 ALA B 28 17.880 -9.466 -20.293 1.00 0.00 H new ATOM 1356 N GLU B 29 20.565 -8.753 -19.546 1.00 0.00 N ATOM 1357 CA GLU B 29 21.669 -7.854 -19.863 1.00 0.00 C ATOM 1358 C GLU B 29 22.932 -8.257 -19.108 1.00 0.00 C ATOM 1359 O GLU B 29 24.040 -7.860 -19.472 1.00 0.00 O ATOM 1360 CB GLU B 29 21.295 -6.410 -19.522 1.00 0.00 C ATOM 1361 CG GLU B 29 21.517 -6.054 -18.061 1.00 0.00 C ATOM 1362 CD GLU B 29 22.762 -5.215 -17.849 1.00 0.00 C ATOM 1363 OE1 GLU B 29 22.909 -4.184 -18.539 1.00 0.00 O ATOM 1364 OE2 GLU B 29 23.590 -5.589 -16.992 1.00 0.00 O ATOM 0 H GLU B 29 19.817 -8.326 -19.000 1.00 0.00 H new ATOM 0 HA GLU B 29 21.867 -7.926 -20.932 1.00 0.00 H new ATOM 0 HB2 GLU B 29 21.881 -5.735 -20.145 1.00 0.00 H new ATOM 0 HB3 GLU B 29 20.247 -6.246 -19.772 1.00 0.00 H new ATOM 0 HG2 GLU B 29 20.649 -5.511 -17.687 1.00 0.00 H new ATOM 0 HG3 GLU B 29 21.596 -6.970 -17.475 1.00 0.00 H new ATOM 1371 N LEU B 30 22.757 -9.046 -18.053 1.00 0.00 N ATOM 1372 CA LEU B 30 23.882 -9.502 -17.245 1.00 0.00 C ATOM 1373 C LEU B 30 24.416 -10.836 -17.758 1.00 0.00 C ATOM 1374 O LEU B 30 25.389 -11.372 -17.229 1.00 0.00 O ATOM 1375 CB LEU B 30 23.461 -9.639 -15.780 1.00 0.00 C ATOM 1376 CG LEU B 30 23.342 -8.334 -14.992 1.00 0.00 C ATOM 1377 CD1 LEU B 30 22.588 -8.563 -13.691 1.00 0.00 C ATOM 1378 CD2 LEU B 30 24.720 -7.751 -14.716 1.00 0.00 C ATOM 0 H LEU B 30 21.847 -9.383 -17.738 1.00 0.00 H new ATOM 0 HA LEU B 30 24.676 -8.759 -17.321 1.00 0.00 H new ATOM 0 HB2 LEU B 30 22.499 -10.150 -15.745 1.00 0.00 H new ATOM 0 HB3 LEU B 30 24.182 -10.281 -15.274 1.00 0.00 H new ATOM 0 HG LEU B 30 22.780 -7.619 -15.593 1.00 0.00 H new ATOM 0 HD11 LEU B 30 22.513 -7.623 -13.144 1.00 0.00 H new ATOM 0 HD12 LEU B 30 21.588 -8.936 -13.911 1.00 0.00 H new ATOM 0 HD13 LEU B 30 23.122 -9.294 -13.085 1.00 0.00 H new ATOM 0 HD21 LEU B 30 24.616 -6.823 -14.154 1.00 0.00 H new ATOM 0 HD22 LEU B 30 25.307 -8.463 -14.135 1.00 0.00 H new ATOM 0 HD23 LEU B 30 25.226 -7.549 -15.660 1.00 0.00 H new ATOM 1390 N GLY B 31 23.774 -11.365 -18.795 1.00 0.00 N ATOM 1391 CA GLY B 31 24.200 -12.630 -19.364 1.00 0.00 C ATOM 1392 C GLY B 31 23.560 -13.820 -18.677 1.00 0.00 C ATOM 1393 O GLY B 31 23.984 -14.960 -18.871 1.00 0.00 O ATOM 0 H GLY B 31 22.967 -10.940 -19.251 1.00 0.00 H new ATOM 0 HA2 GLY B 31 23.951 -12.650 -20.425 1.00 0.00 H new ATOM 0 HA3 GLY B 31 25.284 -12.711 -19.290 1.00 0.00 H new ATOM 1397 N TYR B 32 22.538 -13.556 -17.871 1.00 0.00 N ATOM 1398 CA TYR B 32 21.840 -14.614 -17.149 1.00 0.00 C ATOM 1399 C TYR B 32 20.615 -15.086 -17.925 1.00 0.00 C ATOM 1400 O TYR B 32 19.589 -15.429 -17.338 1.00 0.00 O ATOM 1401 CB TYR B 32 21.422 -14.124 -15.762 1.00 0.00 C ATOM 1402 CG TYR B 32 22.588 -13.872 -14.832 1.00 0.00 C ATOM 1403 CD1 TYR B 32 23.493 -12.848 -15.083 1.00 0.00 C ATOM 1404 CD2 TYR B 32 22.784 -14.658 -13.704 1.00 0.00 C ATOM 1405 CE1 TYR B 32 24.560 -12.615 -14.237 1.00 0.00 C ATOM 1406 CE2 TYR B 32 23.847 -14.431 -12.851 1.00 0.00 C ATOM 1407 CZ TYR B 32 24.732 -13.409 -13.122 1.00 0.00 C ATOM 1408 OH TYR B 32 25.793 -13.180 -12.276 1.00 0.00 O ATOM 0 H TYR B 32 22.174 -12.618 -17.701 1.00 0.00 H new ATOM 0 HA TYR B 32 22.524 -15.456 -17.038 1.00 0.00 H new ATOM 0 HB2 TYR B 32 20.848 -13.204 -15.869 1.00 0.00 H new ATOM 0 HB3 TYR B 32 20.760 -14.862 -15.309 1.00 0.00 H new ATOM 0 HD1 TYR B 32 23.360 -12.224 -15.954 1.00 0.00 H new ATOM 0 HD2 TYR B 32 22.094 -15.460 -13.490 1.00 0.00 H new ATOM 0 HE1 TYR B 32 25.255 -11.816 -14.447 1.00 0.00 H new ATOM 0 HE2 TYR B 32 23.984 -15.051 -11.977 1.00 0.00 H new ATOM 0 HH TYR B 32 25.769 -13.826 -11.539 1.00 0.00 H new ATOM 1418 N ASN B 33 20.730 -15.102 -19.249 1.00 0.00 N ATOM 1419 CA ASN B 33 19.632 -15.532 -20.107 1.00 0.00 C ATOM 1420 C ASN B 33 19.071 -16.872 -19.642 1.00 0.00 C ATOM 1421 O ASN B 33 19.725 -17.607 -18.901 1.00 0.00 O ATOM 1422 CB ASN B 33 20.103 -15.639 -21.559 1.00 0.00 C ATOM 1423 CG ASN B 33 18.964 -15.931 -22.517 1.00 0.00 C ATOM 1424 OD1 ASN B 33 18.888 -17.014 -23.096 1.00 0.00 O ATOM 1425 ND2 ASN B 33 18.072 -14.962 -22.687 1.00 0.00 N ATOM 0 H ASN B 33 21.573 -14.822 -19.751 1.00 0.00 H new ATOM 0 HA ASN B 33 18.840 -14.785 -20.043 1.00 0.00 H new ATOM 0 HB2 ASN B 33 20.589 -14.708 -21.850 1.00 0.00 H new ATOM 0 HB3 ASN B 33 20.852 -16.427 -21.638 1.00 0.00 H new ATOM 0 HD21 ASN B 33 17.283 -15.100 -23.319 1.00 0.00 H new ATOM 0 HD22 ASN B 33 18.175 -14.080 -22.186 1.00 0.00 H new ATOM 1432 N ASP B 34 17.858 -17.185 -20.083 1.00 0.00 N ATOM 1433 CA ASP B 34 17.209 -18.437 -19.714 1.00 0.00 C ATOM 1434 C ASP B 34 16.801 -18.426 -18.244 1.00 0.00 C ATOM 1435 O ASP B 34 17.237 -19.271 -17.462 1.00 0.00 O ATOM 1436 CB ASP B 34 18.141 -19.619 -19.988 1.00 0.00 C ATOM 1437 CG ASP B 34 17.383 -20.882 -20.348 1.00 0.00 C ATOM 1438 OD1 ASP B 34 17.013 -21.036 -21.531 1.00 0.00 O ATOM 1439 OD2 ASP B 34 17.163 -21.718 -19.447 1.00 0.00 O ATOM 0 H ASP B 34 17.304 -16.588 -20.697 1.00 0.00 H new ATOM 0 HA ASP B 34 16.310 -18.544 -20.321 1.00 0.00 H new ATOM 0 HB2 ASP B 34 18.820 -19.362 -20.801 1.00 0.00 H new ATOM 0 HB3 ASP B 34 18.755 -19.806 -19.107 1.00 0.00 H new ATOM 1444 N ILE B 35 15.964 -17.462 -17.876 1.00 0.00 N ATOM 1445 CA ILE B 35 15.497 -17.341 -16.500 1.00 0.00 C ATOM 1446 C ILE B 35 14.207 -18.124 -16.286 1.00 0.00 C ATOM 1447 O ILE B 35 13.398 -18.270 -17.201 1.00 0.00 O ATOM 1448 CB ILE B 35 15.261 -15.869 -16.113 1.00 0.00 C ATOM 1449 CG1 ILE B 35 16.157 -15.478 -14.936 1.00 0.00 C ATOM 1450 CG2 ILE B 35 13.797 -15.640 -15.771 1.00 0.00 C ATOM 1451 CD1 ILE B 35 17.548 -15.052 -15.351 1.00 0.00 C ATOM 0 H ILE B 35 15.595 -16.754 -18.511 1.00 0.00 H new ATOM 0 HA ILE B 35 16.280 -17.755 -15.864 1.00 0.00 H new ATOM 0 HB ILE B 35 15.518 -15.239 -16.965 1.00 0.00 H new ATOM 0 HG12 ILE B 35 15.685 -14.664 -14.386 1.00 0.00 H new ATOM 0 HG13 ILE B 35 16.234 -16.323 -14.252 1.00 0.00 H new ATOM 0 HG21 ILE B 35 13.646 -14.595 -15.500 1.00 0.00 H new ATOM 0 HG22 ILE B 35 13.179 -15.883 -16.635 1.00 0.00 H new ATOM 0 HG23 ILE B 35 13.515 -16.277 -14.933 1.00 0.00 H new ATOM 0 HD11 ILE B 35 18.127 -14.789 -14.466 1.00 0.00 H new ATOM 0 HD12 ILE B 35 18.038 -15.872 -15.875 1.00 0.00 H new ATOM 0 HD13 ILE B 35 17.482 -14.187 -16.011 1.00 0.00 H new ATOM 1463 N ASN B 36 14.020 -18.626 -15.069 1.00 0.00 N ATOM 1464 CA ASN B 36 12.827 -19.394 -14.734 1.00 0.00 C ATOM 1465 C ASN B 36 12.119 -18.797 -13.521 1.00 0.00 C ATOM 1466 O ASN B 36 12.711 -18.656 -12.451 1.00 0.00 O ATOM 1467 CB ASN B 36 13.195 -20.853 -14.457 1.00 0.00 C ATOM 1468 CG ASN B 36 13.234 -21.689 -15.721 1.00 0.00 C ATOM 1469 OD1 ASN B 36 14.124 -21.530 -16.557 1.00 0.00 O ATOM 1470 ND2 ASN B 36 12.266 -22.587 -15.867 1.00 0.00 N ATOM 0 H ASN B 36 14.680 -18.514 -14.299 1.00 0.00 H new ATOM 0 HA ASN B 36 12.148 -19.353 -15.586 1.00 0.00 H new ATOM 0 HB2 ASN B 36 14.168 -20.893 -13.968 1.00 0.00 H new ATOM 0 HB3 ASN B 36 12.472 -21.282 -13.763 1.00 0.00 H new ATOM 0 HD21 ASN B 36 12.240 -23.179 -16.697 1.00 0.00 H new ATOM 0 HD22 ASN B 36 11.548 -22.685 -15.149 1.00 0.00 H new ATOM 1477 N VAL B 37 10.848 -18.449 -13.696 1.00 0.00 N ATOM 1478 CA VAL B 37 10.058 -17.870 -12.616 1.00 0.00 C ATOM 1479 C VAL B 37 8.986 -18.841 -12.137 1.00 0.00 C ATOM 1480 O VAL B 37 8.319 -19.494 -12.941 1.00 0.00 O ATOM 1481 CB VAL B 37 9.386 -16.555 -13.056 1.00 0.00 C ATOM 1482 CG1 VAL B 37 8.323 -16.826 -14.110 1.00 0.00 C ATOM 1483 CG2 VAL B 37 8.788 -15.836 -11.856 1.00 0.00 C ATOM 0 H VAL B 37 10.343 -18.558 -14.576 1.00 0.00 H new ATOM 0 HA VAL B 37 10.746 -17.662 -11.797 1.00 0.00 H new ATOM 0 HB VAL B 37 10.145 -15.908 -13.497 1.00 0.00 H new ATOM 0 HG11 VAL B 37 7.859 -15.886 -14.409 1.00 0.00 H new ATOM 0 HG12 VAL B 37 8.784 -17.296 -14.979 1.00 0.00 H new ATOM 0 HG13 VAL B 37 7.564 -17.491 -13.698 1.00 0.00 H new ATOM 0 HG21 VAL B 37 8.317 -14.909 -12.184 1.00 0.00 H new ATOM 0 HG22 VAL B 37 8.041 -16.475 -11.384 1.00 0.00 H new ATOM 0 HG23 VAL B 37 9.576 -15.608 -11.138 1.00 0.00 H new ATOM 1493 N THR B 38 8.823 -18.933 -10.821 1.00 0.00 N ATOM 1494 CA THR B 38 7.832 -19.825 -10.233 1.00 0.00 C ATOM 1495 C THR B 38 7.075 -19.138 -9.103 1.00 0.00 C ATOM 1496 O THR B 38 7.651 -18.814 -8.064 1.00 0.00 O ATOM 1497 CB THR B 38 8.485 -21.111 -9.691 1.00 0.00 C ATOM 1498 OG1 THR B 38 9.682 -20.788 -8.974 1.00 0.00 O ATOM 1499 CG2 THR B 38 8.810 -22.072 -10.824 1.00 0.00 C ATOM 0 H THR B 38 9.366 -18.400 -10.142 1.00 0.00 H new ATOM 0 HA THR B 38 7.133 -20.088 -11.027 1.00 0.00 H new ATOM 0 HB THR B 38 7.778 -21.595 -9.017 1.00 0.00 H new ATOM 0 HG1 THR B 38 9.507 -20.039 -8.366 1.00 0.00 H new ATOM 0 HG21 THR B 38 9.270 -22.972 -10.417 1.00 0.00 H new ATOM 0 HG22 THR B 38 7.893 -22.339 -11.349 1.00 0.00 H new ATOM 0 HG23 THR B 38 9.500 -21.594 -11.519 1.00 0.00 H new ATOM 1576 N VAL B 44 6.570 -14.400 -5.796 1.00 0.00 N ATOM 1577 CA VAL B 44 7.207 -14.721 -7.067 1.00 0.00 C ATOM 1578 C VAL B 44 8.717 -14.852 -6.907 1.00 0.00 C ATOM 1579 O VAL B 44 9.370 -13.984 -6.327 1.00 0.00 O ATOM 1580 CB VAL B 44 6.906 -13.650 -8.132 1.00 0.00 C ATOM 1581 CG1 VAL B 44 7.459 -12.299 -7.703 1.00 0.00 C ATOM 1582 CG2 VAL B 44 7.475 -14.065 -9.480 1.00 0.00 C ATOM 0 HA VAL B 44 6.795 -15.675 -7.395 1.00 0.00 H new ATOM 0 HB VAL B 44 5.825 -13.557 -8.233 1.00 0.00 H new ATOM 0 HG11 VAL B 44 7.237 -11.555 -8.468 1.00 0.00 H new ATOM 0 HG12 VAL B 44 6.999 -12.000 -6.761 1.00 0.00 H new ATOM 0 HG13 VAL B 44 8.539 -12.373 -7.572 1.00 0.00 H new ATOM 0 HG21 VAL B 44 7.253 -13.297 -10.221 1.00 0.00 H new ATOM 0 HG22 VAL B 44 8.555 -14.188 -9.397 1.00 0.00 H new ATOM 0 HG23 VAL B 44 7.025 -15.008 -9.790 1.00 0.00 H new ATOM 1592 N THR B 45 9.269 -15.945 -7.426 1.00 0.00 N ATOM 1593 CA THR B 45 10.703 -16.192 -7.341 1.00 0.00 C ATOM 1594 C THR B 45 11.311 -16.382 -8.726 1.00 0.00 C ATOM 1595 O THR B 45 10.737 -17.058 -9.579 1.00 0.00 O ATOM 1596 CB THR B 45 11.009 -17.433 -6.483 1.00 0.00 C ATOM 1597 OG1 THR B 45 10.398 -17.302 -5.195 1.00 0.00 O ATOM 1598 CG2 THR B 45 12.510 -17.622 -6.321 1.00 0.00 C ATOM 0 H THR B 45 8.744 -16.673 -7.910 1.00 0.00 H new ATOM 0 HA THR B 45 11.148 -15.316 -6.870 1.00 0.00 H new ATOM 0 HB THR B 45 10.601 -18.307 -6.990 1.00 0.00 H new ATOM 0 HG1 THR B 45 10.596 -18.096 -4.657 1.00 0.00 H new ATOM 0 HG21 THR B 45 12.702 -18.505 -5.711 1.00 0.00 H new ATOM 0 HG22 THR B 45 12.968 -17.752 -7.301 1.00 0.00 H new ATOM 0 HG23 THR B 45 12.937 -16.745 -5.834 1.00 0.00 H new ATOM 1606 N VAL B 46 12.477 -15.782 -8.943 1.00 0.00 N ATOM 1607 CA VAL B 46 13.165 -15.887 -10.224 1.00 0.00 C ATOM 1608 C VAL B 46 14.487 -16.633 -10.079 1.00 0.00 C ATOM 1609 O VAL B 46 15.238 -16.405 -9.131 1.00 0.00 O ATOM 1610 CB VAL B 46 13.436 -14.498 -10.831 1.00 0.00 C ATOM 1611 CG1 VAL B 46 14.501 -13.764 -10.031 1.00 0.00 C ATOM 1612 CG2 VAL B 46 13.847 -14.626 -12.290 1.00 0.00 C ATOM 0 H VAL B 46 12.965 -15.218 -8.248 1.00 0.00 H new ATOM 0 HA VAL B 46 12.508 -16.445 -10.891 1.00 0.00 H new ATOM 0 HB VAL B 46 12.516 -13.915 -10.786 1.00 0.00 H new ATOM 0 HG11 VAL B 46 14.679 -12.785 -10.475 1.00 0.00 H new ATOM 0 HG12 VAL B 46 14.162 -13.640 -9.002 1.00 0.00 H new ATOM 0 HG13 VAL B 46 15.426 -14.341 -10.042 1.00 0.00 H new ATOM 0 HG21 VAL B 46 14.035 -13.635 -12.703 1.00 0.00 H new ATOM 0 HG22 VAL B 46 14.754 -15.227 -12.361 1.00 0.00 H new ATOM 0 HG23 VAL B 46 13.047 -15.108 -12.852 1.00 0.00 H new ATOM 1622 N GLU B 47 14.764 -17.525 -11.025 1.00 0.00 N ATOM 1623 CA GLU B 47 15.996 -18.305 -11.002 1.00 0.00 C ATOM 1624 C GLU B 47 16.799 -18.091 -12.281 1.00 0.00 C ATOM 1625 O GLU B 47 16.348 -18.431 -13.374 1.00 0.00 O ATOM 1626 CB GLU B 47 15.681 -19.792 -10.826 1.00 0.00 C ATOM 1627 CG GLU B 47 15.432 -20.195 -9.383 1.00 0.00 C ATOM 1628 CD GLU B 47 15.511 -21.695 -9.174 1.00 0.00 C ATOM 1629 OE1 GLU B 47 16.638 -22.230 -9.131 1.00 0.00 O ATOM 1630 OE2 GLU B 47 14.444 -22.333 -9.054 1.00 0.00 O ATOM 0 H GLU B 47 14.152 -17.725 -11.816 1.00 0.00 H new ATOM 0 HA GLU B 47 16.595 -17.966 -10.157 1.00 0.00 H new ATOM 0 HB2 GLU B 47 14.802 -20.041 -11.421 1.00 0.00 H new ATOM 0 HB3 GLU B 47 16.510 -20.379 -11.220 1.00 0.00 H new ATOM 0 HG2 GLU B 47 16.163 -19.704 -8.741 1.00 0.00 H new ATOM 0 HG3 GLU B 47 14.448 -19.840 -9.075 1.00 0.00 H new ATOM 1637 N GLY B 48 17.993 -17.525 -12.136 1.00 0.00 N ATOM 1638 CA GLY B 48 18.841 -17.275 -13.287 1.00 0.00 C ATOM 1639 C GLY B 48 20.246 -17.812 -13.100 1.00 0.00 C ATOM 1640 O GLY B 48 20.788 -17.777 -11.996 1.00 0.00 O ATOM 0 H GLY B 48 18.388 -17.235 -11.242 1.00 0.00 H new ATOM 0 HA2 GLY B 48 18.395 -17.733 -14.170 1.00 0.00 H new ATOM 0 HA3 GLY B 48 18.887 -16.202 -13.474 1.00 0.00 H new ATOM 1644 N GLN B 49 20.835 -18.312 -14.182 1.00 0.00 N ATOM 1645 CA GLN B 49 22.184 -18.862 -14.131 1.00 0.00 C ATOM 1646 C GLN B 49 23.115 -18.108 -15.075 1.00 0.00 C ATOM 1647 O GLN B 49 22.673 -17.522 -16.063 1.00 0.00 O ATOM 1648 CB GLN B 49 22.166 -20.348 -14.493 1.00 0.00 C ATOM 1649 CG GLN B 49 21.786 -20.617 -15.940 1.00 0.00 C ATOM 1650 CD GLN B 49 20.299 -20.463 -16.191 1.00 0.00 C ATOM 1651 OE1 GLN B 49 19.911 -19.336 -16.776 1.00 0.00 O flip ATOM 1652 NE2 GLN B 49 19.508 -21.347 -15.863 1.00 0.00 N flip ATOM 0 H GLN B 49 20.399 -18.347 -15.104 1.00 0.00 H new ATOM 0 HA GLN B 49 22.557 -18.748 -13.113 1.00 0.00 H new ATOM 0 HB2 GLN B 49 23.151 -20.772 -14.300 1.00 0.00 H new ATOM 0 HB3 GLN B 49 21.463 -20.864 -13.839 1.00 0.00 H new ATOM 0 HG2 GLN B 49 22.333 -19.933 -16.589 1.00 0.00 H new ATOM 0 HG3 GLN B 49 22.094 -21.627 -16.211 1.00 0.00 H new ATOM 0 HE21 GLN B 49 19.850 -22.197 -15.416 1.00 0.00 H new ATOM 0 HE22 GLN B 49 18.510 -21.229 -16.039 1.00 0.00 H new ATOM 1661 N LEU B 50 24.407 -18.126 -14.763 1.00 0.00 N ATOM 1662 CA LEU B 50 25.401 -17.444 -15.584 1.00 0.00 C ATOM 1663 C LEU B 50 26.284 -18.448 -16.318 1.00 0.00 C ATOM 1664 O LEU B 50 26.579 -19.524 -15.799 1.00 0.00 O ATOM 1665 CB LEU B 50 26.265 -16.527 -14.716 1.00 0.00 C ATOM 1666 CG LEU B 50 27.242 -15.619 -15.464 1.00 0.00 C ATOM 1667 CD1 LEU B 50 26.504 -14.773 -16.490 1.00 0.00 C ATOM 1668 CD2 LEU B 50 28.002 -14.734 -14.487 1.00 0.00 C ATOM 0 H LEU B 50 24.790 -18.605 -13.948 1.00 0.00 H new ATOM 0 HA LEU B 50 24.874 -16.843 -16.325 1.00 0.00 H new ATOM 0 HB2 LEU B 50 25.605 -15.901 -14.116 1.00 0.00 H new ATOM 0 HB3 LEU B 50 26.834 -17.146 -14.023 1.00 0.00 H new ATOM 0 HG LEU B 50 27.962 -16.246 -15.990 1.00 0.00 H new ATOM 0 HD11 LEU B 50 27.215 -14.133 -17.013 1.00 0.00 H new ATOM 0 HD12 LEU B 50 26.006 -15.424 -17.208 1.00 0.00 H new ATOM 0 HD13 LEU B 50 25.762 -14.154 -15.985 1.00 0.00 H new ATOM 0 HD21 LEU B 50 28.693 -14.095 -15.037 1.00 0.00 H new ATOM 0 HD22 LEU B 50 27.297 -14.114 -13.933 1.00 0.00 H new ATOM 0 HD23 LEU B 50 28.562 -15.358 -13.790 1.00 0.00 H new