USER MOD reduce.3.24.130724 H: found=0, std=0, add=993, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 992 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 125 ASN : amide:sc= -0.372 K(o=-0.37,f=-1.6) USER MOD Set 1.2: A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 8 SER OG : rot 99:sc= 2.55 USER MOD Set 2.2: A 15 SER OG : rot 75:sc= 1.15 USER MOD Set 3.1: A 12 SER OG : rot -74:sc= 1.22 USER MOD Set 3.2: A 13 SER OG : rot 180:sc= 0 USER MOD Set 3.3: A 40 SER OG : rot -93:sc= 1.3 USER MOD Set 3.4: A 43 HIS : no HD1:sc= 1.02 K(o=3.5,f=-6.1!) USER MOD Set 3.5: A 45 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: A 11 ASN : amide:sc= -0.838 K(o=0.41,f=-3.4!) USER MOD Set 4.2: A 34 SER OG : rot -51:sc= 1.25 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ 179:sc= 2.49 (180deg=2.48) USER MOD Single : A 3 LYS NZ :NH3+ -168:sc= 1.32 (180deg=1.12) USER MOD Single : A 5 MET CE :methyl -150:sc= -1.44 (180deg=-2.96!) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 GLN : amide:sc= 0.0632 K(o=0.063,f=-3.8!) USER MOD Single : A 17 MET CE :methyl 179:sc=-0.00231 (180deg=-0.00459) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot -75:sc= 0.13 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 THR OG1 : rot -170:sc=-0.00881 USER MOD Single : A 35 SER OG : rot 162:sc= -0.0723 USER MOD Single : A 39 SER OG : rot 180:sc= 0.0289 USER MOD Single : A 49 MET CE :methyl 176:sc= -0.263 (180deg=-0.348) USER MOD Single : A 50 MET CE :methyl -160:sc= -0.981 (180deg=-2.77!) USER MOD Single : A 58 SER OG : rot -94:sc= 1.22 USER MOD Single : A 60 GLN :FLIP amide:sc= -0.231 F(o=-0.95,f=-0.23) USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot -148:sc= 1.27 USER MOD Single : A 67 ASN : amide:sc= 0.703 K(o=0.7,f=0) USER MOD Single : A 69 ASN : amide:sc= 0.723 K(o=0.72,f=0) USER MOD Single : A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= 0 K(o=0,f=-0.86) USER MOD Single : A 92 THR OG1 : rot -77:sc= 0.122 USER MOD Single : A 93 GLN : amide:sc= 0.723 K(o=0.72,f=-0.13) USER MOD Single : A 100 GLN : amide:sc= 0.906 K(o=0.91,f=0) USER MOD Single : A 107 GLN : amide:sc= 0.845 K(o=0.85,f=-0.063) USER MOD Single : A 108 SER OG : rot 180:sc= 0.0747 USER MOD Single : A 114 THR OG1 : rot 68:sc= 1.24 USER MOD Single : A 118 GLN : amide:sc= -0.176 X(o=-0.18,f=-0.27) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 SER OG : rot 180:sc= -0.347 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.947 -0.013 0.671 1.00 0.00 N ATOM 2 CA MET A 1 2.396 0.003 -0.762 1.00 0.00 C ATOM 3 C MET A 1 2.639 -1.430 -1.273 1.00 0.00 C ATOM 4 O MET A 1 3.299 -2.201 -0.587 1.00 0.00 O ATOM 5 CB MET A 1 3.668 0.878 -0.952 1.00 0.00 C ATOM 6 CG MET A 1 3.791 1.438 -2.377 1.00 0.00 C ATOM 7 SD MET A 1 2.491 2.616 -2.855 1.00 0.00 S ATOM 8 CE MET A 1 3.028 4.115 -1.978 1.00 0.00 C ATOM 0 H1 MET A 1 1.789 0.962 0.996 1.00 0.00 H new ATOM 0 H2 MET A 1 1.062 -0.553 0.751 1.00 0.00 H new ATOM 0 H3 MET A 1 2.679 -0.459 1.259 1.00 0.00 H new ATOM 0 HA MET A 1 1.597 0.450 -1.353 1.00 0.00 H new ATOM 0 HB2 MET A 1 3.646 1.704 -0.241 1.00 0.00 H new ATOM 0 HB3 MET A 1 4.552 0.283 -0.722 1.00 0.00 H new ATOM 0 HG2 MET A 1 4.759 1.929 -2.476 1.00 0.00 H new ATOM 0 HG3 MET A 1 3.782 0.605 -3.080 1.00 0.00 H new ATOM 0 HE1 MET A 1 2.326 4.924 -2.177 1.00 0.00 H new ATOM 0 HE2 MET A 1 3.060 3.918 -0.906 1.00 0.00 H new ATOM 0 HE3 MET A 1 4.021 4.403 -2.324 1.00 0.00 H new ATOM 20 N LYS A 2 2.164 -1.802 -2.474 1.00 0.00 N ATOM 21 CA LYS A 2 2.337 -3.163 -3.044 1.00 0.00 C ATOM 22 C LYS A 2 3.711 -3.317 -3.718 1.00 0.00 C ATOM 23 O LYS A 2 3.842 -3.064 -4.912 1.00 0.00 O ATOM 24 CB LYS A 2 1.179 -3.466 -4.030 1.00 0.00 C ATOM 25 CG LYS A 2 -0.241 -3.351 -3.442 1.00 0.00 C ATOM 26 CD LYS A 2 -0.622 -4.447 -2.433 1.00 0.00 C ATOM 27 CE LYS A 2 -0.849 -5.807 -3.116 1.00 0.00 C ATOM 28 NZ LYS A 2 -1.271 -6.834 -2.127 1.00 0.00 N ATOM 0 H LYS A 2 1.646 -1.170 -3.084 1.00 0.00 H new ATOM 0 HA LYS A 2 2.302 -3.891 -2.234 1.00 0.00 H new ATOM 0 HB2 LYS A 2 1.259 -2.785 -4.877 1.00 0.00 H new ATOM 0 HB3 LYS A 2 1.311 -4.475 -4.419 1.00 0.00 H new ATOM 0 HG2 LYS A 2 -0.338 -2.381 -2.954 1.00 0.00 H new ATOM 0 HG3 LYS A 2 -0.959 -3.369 -4.262 1.00 0.00 H new ATOM 0 HD2 LYS A 2 0.167 -4.543 -1.687 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -1.527 -4.152 -1.903 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -1.610 -5.707 -3.890 1.00 0.00 H new ATOM 0 HE3 LYS A 2 0.068 -6.128 -3.610 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -1.434 -7.738 -2.614 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -0.525 -6.955 -1.413 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -2.149 -6.528 -1.662 1.00 0.00 H new ATOM 42 N LYS A 3 4.755 -3.659 -2.957 1.00 0.00 N ATOM 43 CA LYS A 3 6.149 -3.659 -3.457 1.00 0.00 C ATOM 44 C LYS A 3 6.472 -4.876 -4.329 1.00 0.00 C ATOM 45 O LYS A 3 5.979 -5.979 -4.085 1.00 0.00 O ATOM 46 CB LYS A 3 7.180 -3.510 -2.322 1.00 0.00 C ATOM 47 CG LYS A 3 6.880 -2.340 -1.384 1.00 0.00 C ATOM 48 CD LYS A 3 8.012 -2.096 -0.382 1.00 0.00 C ATOM 49 CE LYS A 3 7.536 -1.043 0.628 1.00 0.00 C ATOM 50 NZ LYS A 3 8.565 -0.788 1.674 1.00 0.00 N ATOM 0 H LYS A 3 4.667 -3.943 -1.981 1.00 0.00 H new ATOM 0 HA LYS A 3 6.226 -2.778 -4.094 1.00 0.00 H new ATOM 0 HB2 LYS A 3 7.209 -4.433 -1.743 1.00 0.00 H new ATOM 0 HB3 LYS A 3 8.171 -3.375 -2.756 1.00 0.00 H new ATOM 0 HG2 LYS A 3 6.718 -1.437 -1.973 1.00 0.00 H new ATOM 0 HG3 LYS A 3 5.955 -2.538 -0.843 1.00 0.00 H new ATOM 0 HD2 LYS A 3 8.274 -3.022 0.129 1.00 0.00 H new ATOM 0 HD3 LYS A 3 8.909 -1.751 -0.897 1.00 0.00 H new ATOM 0 HE2 LYS A 3 7.307 -0.114 0.106 1.00 0.00 H new ATOM 0 HE3 LYS A 3 6.612 -1.380 1.099 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 8.144 -0.234 2.447 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 8.912 -1.694 2.047 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 9.358 -0.258 1.259 1.00 0.00 H new ATOM 64 N VAL A 4 7.353 -4.668 -5.310 1.00 0.00 N ATOM 65 CA VAL A 4 7.859 -5.709 -6.227 1.00 0.00 C ATOM 66 C VAL A 4 9.320 -6.046 -5.924 1.00 0.00 C ATOM 67 O VAL A 4 10.111 -5.129 -5.730 1.00 0.00 O ATOM 68 CB VAL A 4 7.730 -5.269 -7.698 1.00 0.00 C ATOM 69 CG1 VAL A 4 8.229 -6.348 -8.672 1.00 0.00 C ATOM 70 CG2 VAL A 4 6.284 -4.943 -8.078 1.00 0.00 C ATOM 0 H VAL A 4 7.749 -3.747 -5.499 1.00 0.00 H new ATOM 0 HA VAL A 4 7.249 -6.598 -6.070 1.00 0.00 H new ATOM 0 HB VAL A 4 8.349 -4.376 -7.782 1.00 0.00 H new ATOM 0 HG11 VAL A 4 8.118 -5.993 -9.696 1.00 0.00 H new ATOM 0 HG12 VAL A 4 9.279 -6.560 -8.473 1.00 0.00 H new ATOM 0 HG13 VAL A 4 7.644 -7.258 -8.538 1.00 0.00 H new ATOM 0 HG21 VAL A 4 6.243 -4.638 -9.124 1.00 0.00 H new ATOM 0 HG22 VAL A 4 5.662 -5.826 -7.933 1.00 0.00 H new ATOM 0 HG23 VAL A 4 5.916 -4.133 -7.449 1.00 0.00 H new ATOM 80 N MET A 5 9.697 -7.328 -5.973 1.00 0.00 N ATOM 81 CA MET A 5 11.099 -7.763 -5.926 1.00 0.00 C ATOM 82 C MET A 5 11.428 -8.696 -7.101 1.00 0.00 C ATOM 83 O MET A 5 10.913 -9.811 -7.184 1.00 0.00 O ATOM 84 CB MET A 5 11.447 -8.453 -4.592 1.00 0.00 C ATOM 85 CG MET A 5 12.958 -8.753 -4.509 1.00 0.00 C ATOM 86 SD MET A 5 13.972 -7.251 -4.503 1.00 0.00 S ATOM 87 CE MET A 5 14.000 -6.867 -2.737 1.00 0.00 C ATOM 0 H MET A 5 9.034 -8.099 -6.047 1.00 0.00 H new ATOM 0 HA MET A 5 11.709 -6.863 -6.007 1.00 0.00 H new ATOM 0 HB2 MET A 5 11.152 -7.815 -3.759 1.00 0.00 H new ATOM 0 HB3 MET A 5 10.882 -9.380 -4.499 1.00 0.00 H new ATOM 0 HG2 MET A 5 13.161 -9.327 -3.605 1.00 0.00 H new ATOM 0 HG3 MET A 5 13.247 -9.378 -5.354 1.00 0.00 H new ATOM 0 HE1 MET A 5 14.087 -5.789 -2.600 1.00 0.00 H new ATOM 0 HE2 MET A 5 13.078 -7.219 -2.274 1.00 0.00 H new ATOM 0 HE3 MET A 5 14.852 -7.361 -2.271 1.00 0.00 H new ATOM 97 N PHE A 6 12.315 -8.270 -7.994 1.00 0.00 N ATOM 98 CA PHE A 6 12.891 -9.141 -9.031 1.00 0.00 C ATOM 99 C PHE A 6 14.042 -9.970 -8.451 1.00 0.00 C ATOM 100 O PHE A 6 14.787 -9.450 -7.624 1.00 0.00 O ATOM 101 CB PHE A 6 13.365 -8.279 -10.201 1.00 0.00 C ATOM 102 CG PHE A 6 12.264 -7.416 -10.766 1.00 0.00 C ATOM 103 CD1 PHE A 6 11.238 -7.988 -11.536 1.00 0.00 C ATOM 104 CD2 PHE A 6 12.215 -6.055 -10.430 1.00 0.00 C ATOM 105 CE1 PHE A 6 10.149 -7.208 -11.938 1.00 0.00 C ATOM 106 CE2 PHE A 6 11.111 -5.279 -10.801 1.00 0.00 C ATOM 107 CZ PHE A 6 10.071 -5.854 -11.556 1.00 0.00 C ATOM 0 H PHE A 6 12.660 -7.311 -8.025 1.00 0.00 H new ATOM 0 HA PHE A 6 12.133 -9.837 -9.391 1.00 0.00 H new ATOM 0 HB2 PHE A 6 14.187 -7.644 -9.871 1.00 0.00 H new ATOM 0 HB3 PHE A 6 13.757 -8.924 -10.988 1.00 0.00 H new ATOM 0 HD1 PHE A 6 11.290 -9.029 -11.817 1.00 0.00 H new ATOM 0 HD2 PHE A 6 13.031 -5.605 -9.884 1.00 0.00 H new ATOM 0 HE1 PHE A 6 9.367 -7.644 -12.542 1.00 0.00 H new ATOM 0 HE2 PHE A 6 11.057 -4.241 -10.509 1.00 0.00 H new ATOM 0 HZ PHE A 6 9.216 -5.259 -11.841 1.00 0.00 H new ATOM 117 N VAL A 7 14.203 -11.235 -8.855 1.00 0.00 N ATOM 118 CA VAL A 7 15.254 -12.132 -8.338 1.00 0.00 C ATOM 119 C VAL A 7 15.915 -12.935 -9.462 1.00 0.00 C ATOM 120 O VAL A 7 15.230 -13.590 -10.241 1.00 0.00 O ATOM 121 CB VAL A 7 14.709 -13.077 -7.240 1.00 0.00 C ATOM 122 CG1 VAL A 7 15.868 -13.554 -6.358 1.00 0.00 C ATOM 123 CG2 VAL A 7 13.683 -12.426 -6.299 1.00 0.00 C ATOM 0 H VAL A 7 13.605 -11.673 -9.556 1.00 0.00 H new ATOM 0 HA VAL A 7 16.016 -11.497 -7.886 1.00 0.00 H new ATOM 0 HB VAL A 7 14.215 -13.887 -7.776 1.00 0.00 H new ATOM 0 HG11 VAL A 7 15.486 -14.220 -5.584 1.00 0.00 H new ATOM 0 HG12 VAL A 7 16.595 -14.088 -6.970 1.00 0.00 H new ATOM 0 HG13 VAL A 7 16.348 -12.694 -5.892 1.00 0.00 H new ATOM 0 HG21 VAL A 7 13.352 -13.156 -5.560 1.00 0.00 H new ATOM 0 HG22 VAL A 7 14.142 -11.578 -5.791 1.00 0.00 H new ATOM 0 HG23 VAL A 7 12.826 -12.082 -6.878 1.00 0.00 H new ATOM 133 N SER A 8 17.249 -12.917 -9.547 1.00 0.00 N ATOM 134 CA SER A 8 18.040 -13.716 -10.517 1.00 0.00 C ATOM 135 C SER A 8 19.373 -14.191 -9.912 1.00 0.00 C ATOM 136 O SER A 8 19.667 -13.843 -8.773 1.00 0.00 O ATOM 137 CB SER A 8 18.228 -12.918 -11.821 1.00 0.00 C ATOM 138 OG SER A 8 18.592 -11.570 -11.573 1.00 0.00 O ATOM 0 H SER A 8 17.829 -12.340 -8.938 1.00 0.00 H new ATOM 0 HA SER A 8 17.487 -14.623 -10.760 1.00 0.00 H new ATOM 0 HB2 SER A 8 18.996 -13.395 -12.430 1.00 0.00 H new ATOM 0 HB3 SER A 8 17.303 -12.943 -12.398 1.00 0.00 H new ATOM 0 HG SER A 8 19.561 -11.469 -11.676 1.00 0.00 H new ATOM 144 N LYS A 9 20.207 -14.966 -10.637 1.00 0.00 N ATOM 145 CA LYS A 9 21.543 -15.384 -10.134 1.00 0.00 C ATOM 146 C LYS A 9 22.394 -14.147 -9.849 1.00 0.00 C ATOM 147 O LYS A 9 22.708 -13.894 -8.699 1.00 0.00 O ATOM 148 CB LYS A 9 22.205 -16.440 -11.053 1.00 0.00 C ATOM 149 CG LYS A 9 23.470 -17.022 -10.388 1.00 0.00 C ATOM 150 CD LYS A 9 24.044 -18.261 -11.095 1.00 0.00 C ATOM 151 CE LYS A 9 24.693 -17.947 -12.455 1.00 0.00 C ATOM 152 NZ LYS A 9 25.325 -19.167 -13.046 1.00 0.00 N ATOM 0 H LYS A 9 19.985 -15.316 -11.569 1.00 0.00 H new ATOM 0 HA LYS A 9 21.433 -15.905 -9.183 1.00 0.00 H new ATOM 0 HB2 LYS A 9 21.497 -17.241 -11.264 1.00 0.00 H new ATOM 0 HB3 LYS A 9 22.466 -15.986 -12.009 1.00 0.00 H new ATOM 0 HG2 LYS A 9 24.238 -16.249 -10.355 1.00 0.00 H new ATOM 0 HG3 LYS A 9 23.236 -17.283 -9.356 1.00 0.00 H new ATOM 0 HD2 LYS A 9 24.785 -18.728 -10.447 1.00 0.00 H new ATOM 0 HD3 LYS A 9 23.245 -18.988 -11.242 1.00 0.00 H new ATOM 0 HE2 LYS A 9 23.940 -17.557 -13.139 1.00 0.00 H new ATOM 0 HE3 LYS A 9 25.445 -17.168 -12.331 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 25.755 -18.926 -13.962 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 26.060 -19.524 -12.402 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 24.601 -19.900 -13.185 1.00 0.00 H new ATOM 166 N ARG A 10 22.678 -13.330 -10.866 1.00 0.00 N ATOM 167 CA ARG A 10 23.256 -11.987 -10.662 1.00 0.00 C ATOM 168 C ARG A 10 22.079 -11.085 -10.370 1.00 0.00 C ATOM 169 O ARG A 10 21.178 -11.029 -11.202 1.00 0.00 O ATOM 170 CB ARG A 10 23.976 -11.460 -11.921 1.00 0.00 C ATOM 171 CG ARG A 10 25.428 -11.945 -12.046 1.00 0.00 C ATOM 172 CD ARG A 10 25.562 -13.437 -12.372 1.00 0.00 C ATOM 173 NE ARG A 10 26.986 -13.807 -12.506 1.00 0.00 N ATOM 174 CZ ARG A 10 27.755 -13.659 -13.573 1.00 0.00 C ATOM 175 NH1 ARG A 10 27.302 -13.337 -14.743 1.00 0.00 N ATOM 176 NH2 ARG A 10 29.041 -13.827 -13.495 1.00 0.00 N ATOM 0 H ARG A 10 22.519 -13.570 -11.844 1.00 0.00 H new ATOM 0 HA ARG A 10 23.996 -12.017 -9.862 1.00 0.00 H new ATOM 0 HB2 ARG A 10 23.420 -11.772 -12.805 1.00 0.00 H new ATOM 0 HB3 ARG A 10 23.966 -10.370 -11.906 1.00 0.00 H new ATOM 0 HG2 ARG A 10 25.927 -11.368 -12.824 1.00 0.00 H new ATOM 0 HG3 ARG A 10 25.950 -11.740 -11.112 1.00 0.00 H new ATOM 0 HD2 ARG A 10 25.097 -14.031 -11.585 1.00 0.00 H new ATOM 0 HD3 ARG A 10 25.032 -13.663 -13.297 1.00 0.00 H new ATOM 0 HE ARG A 10 27.425 -14.223 -11.685 1.00 0.00 H new ATOM 0 HH11 ARG A 10 26.303 -13.183 -14.878 1.00 0.00 H new ATOM 0 HH12 ARG A 10 27.944 -13.237 -15.529 1.00 0.00 H new ATOM 0 HH21 ARG A 10 29.470 -14.076 -12.604 1.00 0.00 H new ATOM 0 HH22 ARG A 10 29.622 -13.710 -14.325 1.00 0.00 H new ATOM 190 N ASN A 11 22.063 -10.352 -9.266 1.00 0.00 N ATOM 191 CA ASN A 11 21.043 -9.314 -9.094 1.00 0.00 C ATOM 192 C ASN A 11 21.183 -8.293 -10.248 1.00 0.00 C ATOM 193 O ASN A 11 20.215 -7.964 -10.934 1.00 0.00 O ATOM 194 CB ASN A 11 21.191 -8.693 -7.691 1.00 0.00 C ATOM 195 CG ASN A 11 20.122 -7.650 -7.402 1.00 0.00 C ATOM 196 OD1 ASN A 11 19.434 -7.137 -8.264 1.00 0.00 O ATOM 197 ND2 ASN A 11 19.898 -7.315 -6.162 1.00 0.00 N ATOM 0 H ASN A 11 22.722 -10.447 -8.493 1.00 0.00 H new ATOM 0 HA ASN A 11 20.033 -9.720 -9.148 1.00 0.00 H new ATOM 0 HB2 ASN A 11 21.138 -9.481 -6.940 1.00 0.00 H new ATOM 0 HB3 ASN A 11 22.176 -8.234 -7.602 1.00 0.00 H new ATOM 0 HD21 ASN A 11 19.164 -6.642 -5.940 1.00 0.00 H new ATOM 0 HD22 ASN A 11 20.456 -7.726 -5.414 1.00 0.00 H new ATOM 204 N SER A 12 22.421 -7.914 -10.571 1.00 0.00 N ATOM 205 CA SER A 12 22.696 -6.928 -11.627 1.00 0.00 C ATOM 206 C SER A 12 22.320 -7.354 -13.057 1.00 0.00 C ATOM 207 O SER A 12 21.651 -6.608 -13.771 1.00 0.00 O ATOM 208 CB SER A 12 24.145 -6.487 -11.568 1.00 0.00 C ATOM 209 OG SER A 12 24.987 -7.598 -11.809 1.00 0.00 O ATOM 0 H SER A 12 23.258 -8.276 -10.114 1.00 0.00 H new ATOM 0 HA SER A 12 22.029 -6.094 -11.408 1.00 0.00 H new ATOM 0 HB2 SER A 12 24.330 -5.710 -12.309 1.00 0.00 H new ATOM 0 HB3 SER A 12 24.365 -6.055 -10.592 1.00 0.00 H new ATOM 0 HG SER A 12 24.992 -8.181 -11.022 1.00 0.00 H new ATOM 215 N SER A 13 22.712 -8.555 -13.496 1.00 0.00 N ATOM 216 CA SER A 13 22.587 -8.951 -14.911 1.00 0.00 C ATOM 217 C SER A 13 21.157 -9.223 -15.398 1.00 0.00 C ATOM 218 O SER A 13 20.961 -9.271 -16.606 1.00 0.00 O ATOM 219 CB SER A 13 23.529 -10.108 -15.255 1.00 0.00 C ATOM 220 OG SER A 13 24.801 -9.859 -14.687 1.00 0.00 O ATOM 0 H SER A 13 23.119 -9.272 -12.896 1.00 0.00 H new ATOM 0 HA SER A 13 22.896 -8.066 -15.467 1.00 0.00 H new ATOM 0 HB2 SER A 13 23.125 -11.046 -14.875 1.00 0.00 H new ATOM 0 HB3 SER A 13 23.615 -10.213 -16.337 1.00 0.00 H new ATOM 0 HG SER A 13 25.407 -10.598 -14.904 1.00 0.00 H new ATOM 226 N ARG A 14 20.158 -9.404 -14.510 1.00 0.00 N ATOM 227 CA ARG A 14 18.716 -9.431 -14.894 1.00 0.00 C ATOM 228 C ARG A 14 17.829 -8.605 -13.965 1.00 0.00 C ATOM 229 O ARG A 14 17.111 -7.731 -14.434 1.00 0.00 O ATOM 230 CB ARG A 14 18.120 -10.851 -15.052 1.00 0.00 C ATOM 231 CG ARG A 14 18.856 -11.780 -16.028 1.00 0.00 C ATOM 232 CD ARG A 14 19.768 -12.786 -15.311 1.00 0.00 C ATOM 233 NE ARG A 14 19.132 -14.125 -15.253 1.00 0.00 N ATOM 234 CZ ARG A 14 19.708 -15.283 -15.005 1.00 0.00 C ATOM 235 NH1 ARG A 14 20.876 -15.377 -14.449 1.00 0.00 N ATOM 236 NH2 ARG A 14 19.119 -16.394 -15.322 1.00 0.00 N ATOM 0 H ARG A 14 20.318 -9.536 -13.511 1.00 0.00 H new ATOM 0 HA ARG A 14 18.716 -8.968 -15.881 1.00 0.00 H new ATOM 0 HB2 ARG A 14 18.100 -11.327 -14.072 1.00 0.00 H new ATOM 0 HB3 ARG A 14 17.085 -10.756 -15.381 1.00 0.00 H new ATOM 0 HG2 ARG A 14 18.126 -12.322 -16.629 1.00 0.00 H new ATOM 0 HG3 ARG A 14 19.452 -11.180 -16.715 1.00 0.00 H new ATOM 0 HD2 ARG A 14 20.723 -12.854 -15.833 1.00 0.00 H new ATOM 0 HD3 ARG A 14 19.981 -12.435 -14.301 1.00 0.00 H new ATOM 0 HE ARG A 14 18.127 -14.152 -15.426 1.00 0.00 H new ATOM 0 HH11 ARG A 14 21.385 -14.533 -14.186 1.00 0.00 H new ATOM 0 HH12 ARG A 14 21.286 -16.295 -14.275 1.00 0.00 H new ATOM 0 HH21 ARG A 14 18.202 -16.376 -15.767 1.00 0.00 H new ATOM 0 HH22 ARG A 14 19.573 -17.286 -15.126 1.00 0.00 H new ATOM 250 N SER A 15 17.852 -8.849 -12.658 1.00 0.00 N ATOM 251 CA SER A 15 16.895 -8.211 -11.732 1.00 0.00 C ATOM 252 C SER A 15 17.004 -6.686 -11.690 1.00 0.00 C ATOM 253 O SER A 15 15.977 -6.017 -11.706 1.00 0.00 O ATOM 254 CB SER A 15 16.987 -8.839 -10.348 1.00 0.00 C ATOM 255 OG SER A 15 16.511 -10.157 -10.492 1.00 0.00 O ATOM 0 H SER A 15 18.516 -9.479 -12.209 1.00 0.00 H new ATOM 0 HA SER A 15 15.898 -8.406 -12.127 1.00 0.00 H new ATOM 0 HB2 SER A 15 18.014 -8.832 -9.983 1.00 0.00 H new ATOM 0 HB3 SER A 15 16.388 -8.284 -9.626 1.00 0.00 H new ATOM 0 HG SER A 15 17.191 -10.704 -10.938 1.00 0.00 H new ATOM 261 N GLN A 16 18.205 -6.115 -11.755 1.00 0.00 N ATOM 262 CA GLN A 16 18.406 -4.673 -11.949 1.00 0.00 C ATOM 263 C GLN A 16 17.861 -4.161 -13.290 1.00 0.00 C ATOM 264 O GLN A 16 17.271 -3.080 -13.340 1.00 0.00 O ATOM 265 CB GLN A 16 19.901 -4.361 -11.832 1.00 0.00 C ATOM 266 CG GLN A 16 20.359 -4.176 -10.382 1.00 0.00 C ATOM 267 CD GLN A 16 21.719 -3.495 -10.314 1.00 0.00 C ATOM 268 OE1 GLN A 16 22.598 -3.667 -11.149 1.00 0.00 O ATOM 269 NE2 GLN A 16 21.945 -2.680 -9.314 1.00 0.00 N ATOM 0 H GLN A 16 19.075 -6.641 -11.674 1.00 0.00 H new ATOM 0 HA GLN A 16 17.841 -4.155 -11.174 1.00 0.00 H new ATOM 0 HB2 GLN A 16 20.473 -5.169 -12.288 1.00 0.00 H new ATOM 0 HB3 GLN A 16 20.123 -3.455 -12.396 1.00 0.00 H new ATOM 0 HG2 GLN A 16 19.624 -3.581 -9.839 1.00 0.00 H new ATOM 0 HG3 GLN A 16 20.411 -5.146 -9.888 1.00 0.00 H new ATOM 0 HE21 GLN A 16 21.224 -2.525 -8.609 1.00 0.00 H new ATOM 0 HE22 GLN A 16 22.842 -2.200 -9.240 1.00 0.00 H new ATOM 278 N MET A 17 17.959 -4.948 -14.370 1.00 0.00 N ATOM 279 CA MET A 17 17.343 -4.587 -15.656 1.00 0.00 C ATOM 280 C MET A 17 15.819 -4.433 -15.494 1.00 0.00 C ATOM 281 O MET A 17 15.238 -3.432 -15.903 1.00 0.00 O ATOM 282 CB MET A 17 17.677 -5.612 -16.763 1.00 0.00 C ATOM 283 CG MET A 17 19.187 -5.791 -16.978 1.00 0.00 C ATOM 284 SD MET A 17 19.610 -6.903 -18.347 1.00 0.00 S ATOM 285 CE MET A 17 19.272 -5.842 -19.778 1.00 0.00 C ATOM 0 H MET A 17 18.458 -5.838 -14.380 1.00 0.00 H new ATOM 0 HA MET A 17 17.762 -3.630 -15.967 1.00 0.00 H new ATOM 0 HB2 MET A 17 17.236 -6.575 -16.505 1.00 0.00 H new ATOM 0 HB3 MET A 17 17.218 -5.291 -17.698 1.00 0.00 H new ATOM 0 HG2 MET A 17 19.635 -4.815 -17.164 1.00 0.00 H new ATOM 0 HG3 MET A 17 19.631 -6.176 -16.060 1.00 0.00 H new ATOM 0 HE1 MET A 17 19.503 -6.384 -20.695 1.00 0.00 H new ATOM 0 HE2 MET A 17 18.220 -5.558 -19.780 1.00 0.00 H new ATOM 0 HE3 MET A 17 19.890 -4.946 -19.720 1.00 0.00 H new ATOM 295 N ALA A 18 15.182 -5.382 -14.804 1.00 0.00 N ATOM 296 CA ALA A 18 13.760 -5.311 -14.462 1.00 0.00 C ATOM 297 C ALA A 18 13.433 -4.233 -13.421 1.00 0.00 C ATOM 298 O ALA A 18 12.377 -3.631 -13.533 1.00 0.00 O ATOM 299 CB ALA A 18 13.322 -6.698 -14.004 1.00 0.00 C ATOM 0 H ALA A 18 15.642 -6.227 -14.465 1.00 0.00 H new ATOM 0 HA ALA A 18 13.201 -5.008 -15.347 1.00 0.00 H new ATOM 0 HB1 ALA A 18 12.264 -6.677 -13.742 1.00 0.00 H new ATOM 0 HB2 ALA A 18 13.482 -7.415 -14.810 1.00 0.00 H new ATOM 0 HB3 ALA A 18 13.906 -6.995 -13.133 1.00 0.00 H new ATOM 305 N GLU A 19 14.309 -3.889 -12.471 1.00 0.00 N ATOM 306 CA GLU A 19 13.996 -2.813 -11.519 1.00 0.00 C ATOM 307 C GLU A 19 13.975 -1.488 -12.259 1.00 0.00 C ATOM 308 O GLU A 19 13.024 -0.735 -12.116 1.00 0.00 O ATOM 309 CB GLU A 19 14.976 -2.757 -10.335 1.00 0.00 C ATOM 310 CG GLU A 19 14.655 -1.590 -9.378 1.00 0.00 C ATOM 311 CD GLU A 19 15.648 -1.468 -8.208 1.00 0.00 C ATOM 312 OE1 GLU A 19 16.041 -2.513 -7.641 1.00 0.00 O ATOM 313 OE2 GLU A 19 16.010 -0.323 -7.850 1.00 0.00 O ATOM 0 H GLU A 19 15.221 -4.327 -12.340 1.00 0.00 H new ATOM 0 HA GLU A 19 13.015 -3.021 -11.091 1.00 0.00 H new ATOM 0 HB2 GLU A 19 14.937 -3.698 -9.786 1.00 0.00 H new ATOM 0 HB3 GLU A 19 15.994 -2.649 -10.711 1.00 0.00 H new ATOM 0 HG2 GLU A 19 14.653 -0.657 -9.942 1.00 0.00 H new ATOM 0 HG3 GLU A 19 13.649 -1.723 -8.979 1.00 0.00 H new ATOM 320 N GLY A 20 14.974 -1.227 -13.101 1.00 0.00 N ATOM 321 CA GLY A 20 15.054 0.024 -13.844 1.00 0.00 C ATOM 322 C GLY A 20 13.905 0.194 -14.836 1.00 0.00 C ATOM 323 O GLY A 20 13.293 1.257 -14.847 1.00 0.00 O ATOM 0 H GLY A 20 15.743 -1.872 -13.284 1.00 0.00 H new ATOM 0 HA2 GLY A 20 15.050 0.859 -13.143 1.00 0.00 H new ATOM 0 HA3 GLY A 20 16.002 0.063 -14.381 1.00 0.00 H new ATOM 327 N PHE A 21 13.527 -0.850 -15.582 1.00 0.00 N ATOM 328 CA PHE A 21 12.319 -0.789 -16.420 1.00 0.00 C ATOM 329 C PHE A 21 11.039 -0.677 -15.582 1.00 0.00 C ATOM 330 O PHE A 21 10.167 0.116 -15.912 1.00 0.00 O ATOM 331 CB PHE A 21 12.233 -2.006 -17.355 1.00 0.00 C ATOM 332 CG PHE A 21 12.754 -1.821 -18.765 1.00 0.00 C ATOM 333 CD1 PHE A 21 12.098 -0.915 -19.619 1.00 0.00 C ATOM 334 CD2 PHE A 21 13.815 -2.602 -19.268 1.00 0.00 C ATOM 335 CE1 PHE A 21 12.523 -0.755 -20.949 1.00 0.00 C ATOM 336 CE2 PHE A 21 14.234 -2.447 -20.598 1.00 0.00 C ATOM 337 CZ PHE A 21 13.588 -1.526 -21.441 1.00 0.00 C ATOM 0 H PHE A 21 14.030 -1.736 -15.625 1.00 0.00 H new ATOM 0 HA PHE A 21 12.402 0.115 -17.023 1.00 0.00 H new ATOM 0 HB2 PHE A 21 12.782 -2.828 -16.895 1.00 0.00 H new ATOM 0 HB3 PHE A 21 11.189 -2.315 -17.416 1.00 0.00 H new ATOM 0 HD1 PHE A 21 11.262 -0.339 -19.250 1.00 0.00 H new ATOM 0 HD2 PHE A 21 14.306 -3.321 -18.628 1.00 0.00 H new ATOM 0 HE1 PHE A 21 12.031 -0.040 -21.592 1.00 0.00 H new ATOM 0 HE2 PHE A 21 15.056 -3.037 -20.976 1.00 0.00 H new ATOM 0 HZ PHE A 21 13.910 -1.412 -22.465 1.00 0.00 H new ATOM 347 N ALA A 22 10.901 -1.421 -14.479 1.00 0.00 N ATOM 348 CA ALA A 22 9.698 -1.333 -13.641 1.00 0.00 C ATOM 349 C ALA A 22 9.559 0.063 -13.018 1.00 0.00 C ATOM 350 O ALA A 22 8.465 0.608 -12.922 1.00 0.00 O ATOM 351 CB ALA A 22 9.757 -2.422 -12.565 1.00 0.00 C ATOM 0 H ALA A 22 11.600 -2.085 -14.147 1.00 0.00 H new ATOM 0 HA ALA A 22 8.815 -1.493 -14.260 1.00 0.00 H new ATOM 0 HB1 ALA A 22 8.867 -2.363 -11.939 1.00 0.00 H new ATOM 0 HB2 ALA A 22 9.802 -3.402 -13.041 1.00 0.00 H new ATOM 0 HB3 ALA A 22 10.644 -2.277 -11.949 1.00 0.00 H new ATOM 357 N LYS A 23 10.693 0.673 -12.664 1.00 0.00 N ATOM 358 CA LYS A 23 10.815 2.040 -12.151 1.00 0.00 C ATOM 359 C LYS A 23 10.364 3.038 -13.214 1.00 0.00 C ATOM 360 O LYS A 23 9.396 3.752 -12.985 1.00 0.00 O ATOM 361 CB LYS A 23 12.270 2.233 -11.687 1.00 0.00 C ATOM 362 CG LYS A 23 12.518 3.522 -10.908 1.00 0.00 C ATOM 363 CD LYS A 23 13.993 3.551 -10.473 1.00 0.00 C ATOM 364 CE LYS A 23 14.478 4.938 -10.029 1.00 0.00 C ATOM 365 NZ LYS A 23 13.845 5.405 -8.756 1.00 0.00 N ATOM 0 H LYS A 23 11.596 0.203 -12.731 1.00 0.00 H new ATOM 0 HA LYS A 23 10.164 2.217 -11.295 1.00 0.00 H new ATOM 0 HB2 LYS A 23 12.555 1.386 -11.064 1.00 0.00 H new ATOM 0 HB3 LYS A 23 12.922 2.220 -12.561 1.00 0.00 H new ATOM 0 HG2 LYS A 23 12.288 4.389 -11.527 1.00 0.00 H new ATOM 0 HG3 LYS A 23 11.865 3.570 -10.037 1.00 0.00 H new ATOM 0 HD2 LYS A 23 14.135 2.847 -9.653 1.00 0.00 H new ATOM 0 HD3 LYS A 23 14.613 3.206 -11.300 1.00 0.00 H new ATOM 0 HE2 LYS A 23 15.560 4.913 -9.901 1.00 0.00 H new ATOM 0 HE3 LYS A 23 14.266 5.659 -10.818 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 14.213 6.346 -8.510 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 12.814 5.458 -8.880 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 14.067 4.736 -7.992 1.00 0.00 H new ATOM 379 N THR A 24 10.941 3.018 -14.414 1.00 0.00 N ATOM 380 CA THR A 24 10.509 3.933 -15.486 1.00 0.00 C ATOM 381 C THR A 24 9.104 3.654 -16.039 1.00 0.00 C ATOM 382 O THR A 24 8.529 4.542 -16.674 1.00 0.00 O ATOM 383 CB THR A 24 11.537 3.997 -16.613 1.00 0.00 C ATOM 384 OG1 THR A 24 11.743 2.719 -17.167 1.00 0.00 O ATOM 385 CG2 THR A 24 12.857 4.544 -16.090 1.00 0.00 C ATOM 0 H THR A 24 11.701 2.389 -14.674 1.00 0.00 H new ATOM 0 HA THR A 24 10.443 4.911 -15.009 1.00 0.00 H new ATOM 0 HB THR A 24 11.154 4.661 -17.388 1.00 0.00 H new ATOM 0 HG1 THR A 24 12.283 2.179 -16.553 1.00 0.00 H new ATOM 0 HG21 THR A 24 13.582 4.585 -16.903 1.00 0.00 H new ATOM 0 HG22 THR A 24 12.703 5.546 -15.691 1.00 0.00 H new ATOM 0 HG23 THR A 24 13.233 3.893 -15.301 1.00 0.00 H new ATOM 393 N LEU A 25 8.507 2.486 -15.756 1.00 0.00 N ATOM 394 CA LEU A 25 7.128 2.148 -16.129 1.00 0.00 C ATOM 395 C LEU A 25 6.106 2.329 -14.980 1.00 0.00 C ATOM 396 O LEU A 25 4.906 2.187 -15.216 1.00 0.00 O ATOM 397 CB LEU A 25 7.092 0.709 -16.695 1.00 0.00 C ATOM 398 CG LEU A 25 7.842 0.527 -18.033 1.00 0.00 C ATOM 399 CD1 LEU A 25 8.100 -0.963 -18.284 1.00 0.00 C ATOM 400 CD2 LEU A 25 7.034 1.087 -19.204 1.00 0.00 C ATOM 0 H LEU A 25 8.980 1.736 -15.251 1.00 0.00 H new ATOM 0 HA LEU A 25 6.817 2.857 -16.896 1.00 0.00 H new ATOM 0 HB2 LEU A 25 7.522 0.031 -15.957 1.00 0.00 H new ATOM 0 HB3 LEU A 25 6.052 0.412 -16.833 1.00 0.00 H new ATOM 0 HG LEU A 25 8.784 1.071 -17.962 1.00 0.00 H new ATOM 0 HD11 LEU A 25 8.629 -1.087 -19.229 1.00 0.00 H new ATOM 0 HD12 LEU A 25 8.705 -1.369 -17.473 1.00 0.00 H new ATOM 0 HD13 LEU A 25 7.149 -1.494 -18.328 1.00 0.00 H new ATOM 0 HD21 LEU A 25 7.589 0.943 -20.131 1.00 0.00 H new ATOM 0 HD22 LEU A 25 6.079 0.566 -19.269 1.00 0.00 H new ATOM 0 HD23 LEU A 25 6.857 2.151 -19.048 1.00 0.00 H new ATOM 412 N GLY A 26 6.552 2.630 -13.749 1.00 0.00 N ATOM 413 CA GLY A 26 5.706 2.616 -12.540 1.00 0.00 C ATOM 414 C GLY A 26 6.104 3.555 -11.396 1.00 0.00 C ATOM 415 O GLY A 26 5.539 3.450 -10.305 1.00 0.00 O ATOM 0 H GLY A 26 7.520 2.893 -13.562 1.00 0.00 H new ATOM 0 HA2 GLY A 26 4.686 2.860 -12.838 1.00 0.00 H new ATOM 0 HA3 GLY A 26 5.689 1.598 -12.151 1.00 0.00 H new ATOM 419 N ALA A 27 7.057 4.471 -11.597 1.00 0.00 N ATOM 420 CA ALA A 27 7.489 5.435 -10.578 1.00 0.00 C ATOM 421 C ALA A 27 6.304 6.278 -10.053 1.00 0.00 C ATOM 422 O ALA A 27 5.491 6.793 -10.825 1.00 0.00 O ATOM 423 CB ALA A 27 8.601 6.322 -11.158 1.00 0.00 C ATOM 0 H ALA A 27 7.556 4.565 -12.482 1.00 0.00 H new ATOM 0 HA ALA A 27 7.883 4.890 -9.721 1.00 0.00 H new ATOM 0 HB1 ALA A 27 8.925 7.040 -10.404 1.00 0.00 H new ATOM 0 HB2 ALA A 27 9.446 5.700 -11.453 1.00 0.00 H new ATOM 0 HB3 ALA A 27 8.223 6.857 -12.029 1.00 0.00 H new ATOM 429 N GLY A 28 6.200 6.393 -8.725 1.00 0.00 N ATOM 430 CA GLY A 28 5.103 7.079 -8.025 1.00 0.00 C ATOM 431 C GLY A 28 3.799 6.274 -7.889 1.00 0.00 C ATOM 432 O GLY A 28 2.890 6.732 -7.192 1.00 0.00 O ATOM 0 H GLY A 28 6.894 6.002 -8.088 1.00 0.00 H new ATOM 0 HA2 GLY A 28 5.447 7.352 -7.027 1.00 0.00 H new ATOM 0 HA3 GLY A 28 4.883 8.007 -8.552 1.00 0.00 H new ATOM 436 N LYS A 29 3.689 5.083 -8.506 1.00 0.00 N ATOM 437 CA LYS A 29 2.525 4.181 -8.357 1.00 0.00 C ATOM 438 C LYS A 29 2.693 3.274 -7.137 1.00 0.00 C ATOM 439 O LYS A 29 1.893 3.318 -6.205 1.00 0.00 O ATOM 440 CB LYS A 29 2.284 3.352 -9.640 1.00 0.00 C ATOM 441 CG LYS A 29 2.242 4.169 -10.944 1.00 0.00 C ATOM 442 CD LYS A 29 1.282 5.366 -10.907 1.00 0.00 C ATOM 443 CE LYS A 29 -0.180 4.937 -10.717 1.00 0.00 C ATOM 444 NZ LYS A 29 -1.111 6.099 -10.755 1.00 0.00 N ATOM 0 H LYS A 29 4.409 4.714 -9.127 1.00 0.00 H new ATOM 0 HA LYS A 29 1.642 4.801 -8.199 1.00 0.00 H new ATOM 0 HB2 LYS A 29 3.071 2.603 -9.724 1.00 0.00 H new ATOM 0 HB3 LYS A 29 1.342 2.814 -9.535 1.00 0.00 H new ATOM 0 HG2 LYS A 29 3.246 4.530 -11.166 1.00 0.00 H new ATOM 0 HG3 LYS A 29 1.952 3.510 -11.763 1.00 0.00 H new ATOM 0 HD2 LYS A 29 1.570 6.035 -10.096 1.00 0.00 H new ATOM 0 HD3 LYS A 29 1.374 5.931 -11.834 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -0.454 4.227 -11.497 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -0.285 4.419 -9.764 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -2.087 5.766 -10.623 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -0.866 6.765 -9.994 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -1.030 6.579 -11.674 1.00 0.00 H new ATOM 458 N ILE A 30 3.778 2.499 -7.167 1.00 0.00 N ATOM 459 CA ILE A 30 4.278 1.580 -6.117 1.00 0.00 C ATOM 460 C ILE A 30 5.824 1.576 -6.106 1.00 0.00 C ATOM 461 O ILE A 30 6.442 2.189 -6.979 1.00 0.00 O ATOM 462 CB ILE A 30 3.676 0.153 -6.277 1.00 0.00 C ATOM 463 CG1 ILE A 30 3.975 -0.561 -7.615 1.00 0.00 C ATOM 464 CG2 ILE A 30 2.147 0.182 -6.108 1.00 0.00 C ATOM 465 CD1 ILE A 30 5.372 -1.187 -7.710 1.00 0.00 C ATOM 0 H ILE A 30 4.385 2.489 -7.987 1.00 0.00 H new ATOM 0 HA ILE A 30 3.944 1.942 -5.144 1.00 0.00 H new ATOM 0 HB ILE A 30 4.173 -0.416 -5.492 1.00 0.00 H new ATOM 0 HG12 ILE A 30 3.231 -1.342 -7.768 1.00 0.00 H new ATOM 0 HG13 ILE A 30 3.857 0.156 -8.428 1.00 0.00 H new ATOM 0 HG21 ILE A 30 1.749 -0.826 -6.224 1.00 0.00 H new ATOM 0 HG22 ILE A 30 1.898 0.559 -5.116 1.00 0.00 H new ATOM 0 HG23 ILE A 30 1.710 0.834 -6.864 1.00 0.00 H new ATOM 0 HD11 ILE A 30 5.491 -1.665 -8.682 1.00 0.00 H new ATOM 0 HD12 ILE A 30 6.128 -0.410 -7.592 1.00 0.00 H new ATOM 0 HD13 ILE A 30 5.491 -1.931 -6.923 1.00 0.00 H new ATOM 477 N ALA A 31 6.468 0.869 -5.164 1.00 0.00 N ATOM 478 CA ALA A 31 7.930 0.713 -5.159 1.00 0.00 C ATOM 479 C ALA A 31 8.390 -0.595 -5.814 1.00 0.00 C ATOM 480 O ALA A 31 7.905 -1.682 -5.498 1.00 0.00 O ATOM 481 CB ALA A 31 8.483 0.808 -3.739 1.00 0.00 C ATOM 0 H ALA A 31 5.997 0.395 -4.394 1.00 0.00 H new ATOM 0 HA ALA A 31 8.328 1.533 -5.757 1.00 0.00 H new ATOM 0 HB1 ALA A 31 9.566 0.690 -3.762 1.00 0.00 H new ATOM 0 HB2 ALA A 31 8.233 1.781 -3.316 1.00 0.00 H new ATOM 0 HB3 ALA A 31 8.045 0.022 -3.125 1.00 0.00 H new ATOM 487 N VAL A 32 9.380 -0.487 -6.695 1.00 0.00 N ATOM 488 CA VAL A 32 10.080 -1.617 -7.301 1.00 0.00 C ATOM 489 C VAL A 32 11.470 -1.843 -6.699 1.00 0.00 C ATOM 490 O VAL A 32 12.170 -0.894 -6.347 1.00 0.00 O ATOM 491 CB VAL A 32 10.168 -1.414 -8.810 1.00 0.00 C ATOM 492 CG1 VAL A 32 8.763 -1.391 -9.421 1.00 0.00 C ATOM 493 CG2 VAL A 32 10.927 -0.154 -9.248 1.00 0.00 C ATOM 0 H VAL A 32 9.728 0.416 -7.017 1.00 0.00 H new ATOM 0 HA VAL A 32 9.504 -2.517 -7.086 1.00 0.00 H new ATOM 0 HB VAL A 32 10.747 -2.261 -9.178 1.00 0.00 H new ATOM 0 HG11 VAL A 32 8.837 -1.246 -10.499 1.00 0.00 H new ATOM 0 HG12 VAL A 32 8.262 -2.337 -9.216 1.00 0.00 H new ATOM 0 HG13 VAL A 32 8.189 -0.574 -8.983 1.00 0.00 H new ATOM 0 HG21 VAL A 32 10.937 -0.095 -10.336 1.00 0.00 H new ATOM 0 HG22 VAL A 32 10.433 0.728 -8.841 1.00 0.00 H new ATOM 0 HG23 VAL A 32 11.951 -0.199 -8.878 1.00 0.00 H new ATOM 503 N THR A 33 11.885 -3.108 -6.614 1.00 0.00 N ATOM 504 CA THR A 33 13.189 -3.515 -6.074 1.00 0.00 C ATOM 505 C THR A 33 13.731 -4.760 -6.781 1.00 0.00 C ATOM 506 O THR A 33 12.983 -5.539 -7.370 1.00 0.00 O ATOM 507 CB THR A 33 13.141 -3.718 -4.544 1.00 0.00 C ATOM 508 OG1 THR A 33 12.299 -2.784 -3.893 1.00 0.00 O ATOM 509 CG2 THR A 33 14.516 -3.532 -3.894 1.00 0.00 C ATOM 0 H THR A 33 11.315 -3.895 -6.924 1.00 0.00 H new ATOM 0 HA THR A 33 13.881 -2.697 -6.272 1.00 0.00 H new ATOM 0 HB THR A 33 12.769 -4.735 -4.425 1.00 0.00 H new ATOM 0 HG1 THR A 33 12.424 -2.851 -2.923 1.00 0.00 H new ATOM 0 HG21 THR A 33 14.433 -3.684 -2.818 1.00 0.00 H new ATOM 0 HG22 THR A 33 15.216 -4.256 -4.310 1.00 0.00 H new ATOM 0 HG23 THR A 33 14.878 -2.523 -4.091 1.00 0.00 H new ATOM 517 N SER A 34 15.045 -4.940 -6.746 1.00 0.00 N ATOM 518 CA SER A 34 15.787 -6.091 -7.258 1.00 0.00 C ATOM 519 C SER A 34 16.716 -6.746 -6.220 1.00 0.00 C ATOM 520 O SER A 34 17.390 -6.090 -5.420 1.00 0.00 O ATOM 521 CB SER A 34 16.565 -5.699 -8.510 1.00 0.00 C ATOM 522 OG SER A 34 17.427 -4.594 -8.322 1.00 0.00 O ATOM 0 H SER A 34 15.663 -4.242 -6.333 1.00 0.00 H new ATOM 0 HA SER A 34 15.045 -6.849 -7.508 1.00 0.00 H new ATOM 0 HB2 SER A 34 17.153 -6.554 -8.844 1.00 0.00 H new ATOM 0 HB3 SER A 34 15.859 -5.466 -9.307 1.00 0.00 H new ATOM 0 HG SER A 34 16.928 -3.856 -7.914 1.00 0.00 H new ATOM 528 N SER A 35 16.739 -8.078 -6.252 1.00 0.00 N ATOM 529 CA SER A 35 17.448 -9.020 -5.383 1.00 0.00 C ATOM 530 C SER A 35 18.142 -10.080 -6.244 1.00 0.00 C ATOM 531 O SER A 35 17.951 -10.144 -7.460 1.00 0.00 O ATOM 532 CB SER A 35 16.460 -9.641 -4.392 1.00 0.00 C ATOM 533 OG SER A 35 17.090 -10.588 -3.546 1.00 0.00 O ATOM 0 H SER A 35 16.205 -8.578 -6.963 1.00 0.00 H new ATOM 0 HA SER A 35 18.216 -8.504 -4.806 1.00 0.00 H new ATOM 0 HB2 SER A 35 16.010 -8.855 -3.786 1.00 0.00 H new ATOM 0 HB3 SER A 35 15.651 -10.124 -4.940 1.00 0.00 H new ATOM 0 HG SER A 35 16.528 -10.749 -2.759 1.00 0.00 H new ATOM 539 N GLY A 36 18.969 -10.931 -5.644 1.00 0.00 N ATOM 540 CA GLY A 36 19.492 -12.097 -6.347 1.00 0.00 C ATOM 541 C GLY A 36 20.434 -12.974 -5.532 1.00 0.00 C ATOM 542 O GLY A 36 20.794 -12.635 -4.406 1.00 0.00 O ATOM 0 H GLY A 36 19.289 -10.836 -4.680 1.00 0.00 H new ATOM 0 HA2 GLY A 36 18.653 -12.706 -6.683 1.00 0.00 H new ATOM 0 HA3 GLY A 36 20.017 -11.758 -7.240 1.00 0.00 H new ATOM 546 N LEU A 37 20.822 -14.118 -6.105 1.00 0.00 N ATOM 547 CA LEU A 37 21.697 -15.101 -5.439 1.00 0.00 C ATOM 548 C LEU A 37 23.115 -14.541 -5.212 1.00 0.00 C ATOM 549 O LEU A 37 23.780 -14.909 -4.243 1.00 0.00 O ATOM 550 CB LEU A 37 21.758 -16.414 -6.248 1.00 0.00 C ATOM 551 CG LEU A 37 20.408 -17.046 -6.650 1.00 0.00 C ATOM 552 CD1 LEU A 37 20.642 -18.373 -7.372 1.00 0.00 C ATOM 553 CD2 LEU A 37 19.493 -17.312 -5.457 1.00 0.00 C ATOM 0 H LEU A 37 20.540 -14.393 -7.046 1.00 0.00 H new ATOM 0 HA LEU A 37 21.265 -15.312 -4.461 1.00 0.00 H new ATOM 0 HB2 LEU A 37 22.330 -16.227 -7.157 1.00 0.00 H new ATOM 0 HB3 LEU A 37 22.316 -17.147 -5.665 1.00 0.00 H new ATOM 0 HG LEU A 37 19.918 -16.322 -7.301 1.00 0.00 H new ATOM 0 HD11 LEU A 37 19.683 -18.810 -7.651 1.00 0.00 H new ATOM 0 HD12 LEU A 37 21.236 -18.199 -8.269 1.00 0.00 H new ATOM 0 HD13 LEU A 37 21.174 -19.058 -6.712 1.00 0.00 H new ATOM 0 HD21 LEU A 37 18.561 -17.756 -5.805 1.00 0.00 H new ATOM 0 HD22 LEU A 37 19.985 -17.997 -4.766 1.00 0.00 H new ATOM 0 HD23 LEU A 37 19.279 -16.373 -4.946 1.00 0.00 H new ATOM 565 N GLU A 38 23.547 -13.620 -6.074 1.00 0.00 N ATOM 566 CA GLU A 38 24.751 -12.812 -5.946 1.00 0.00 C ATOM 567 C GLU A 38 24.345 -11.336 -5.954 1.00 0.00 C ATOM 568 O GLU A 38 23.665 -10.867 -6.870 1.00 0.00 O ATOM 569 CB GLU A 38 25.718 -13.157 -7.091 1.00 0.00 C ATOM 570 CG GLU A 38 27.084 -12.466 -6.975 1.00 0.00 C ATOM 571 CD GLU A 38 27.885 -12.980 -5.763 1.00 0.00 C ATOM 572 OE1 GLU A 38 27.734 -12.414 -4.653 1.00 0.00 O ATOM 573 OE2 GLU A 38 28.668 -13.950 -5.913 1.00 0.00 O ATOM 0 H GLU A 38 23.033 -13.409 -6.929 1.00 0.00 H new ATOM 0 HA GLU A 38 25.269 -13.019 -5.010 1.00 0.00 H new ATOM 0 HB2 GLU A 38 25.868 -14.236 -7.115 1.00 0.00 H new ATOM 0 HB3 GLU A 38 25.259 -12.877 -8.039 1.00 0.00 H new ATOM 0 HG2 GLU A 38 27.656 -12.636 -7.887 1.00 0.00 H new ATOM 0 HG3 GLU A 38 26.940 -11.389 -6.885 1.00 0.00 H new ATOM 580 N SER A 39 24.802 -10.586 -4.953 1.00 0.00 N ATOM 581 CA SER A 39 24.682 -9.129 -4.853 1.00 0.00 C ATOM 582 C SER A 39 25.720 -8.446 -5.747 1.00 0.00 C ATOM 583 O SER A 39 26.587 -7.687 -5.305 1.00 0.00 O ATOM 584 CB SER A 39 24.761 -8.711 -3.384 1.00 0.00 C ATOM 585 OG SER A 39 25.847 -9.323 -2.696 1.00 0.00 O ATOM 0 H SER A 39 25.288 -10.993 -4.154 1.00 0.00 H new ATOM 0 HA SER A 39 23.711 -8.800 -5.222 1.00 0.00 H new ATOM 0 HB2 SER A 39 24.863 -7.627 -3.324 1.00 0.00 H new ATOM 0 HB3 SER A 39 23.827 -8.972 -2.886 1.00 0.00 H new ATOM 0 HG SER A 39 25.854 -9.022 -1.763 1.00 0.00 H new ATOM 591 N SER A 40 25.666 -8.811 -7.028 1.00 0.00 N ATOM 592 CA SER A 40 26.664 -8.480 -8.043 1.00 0.00 C ATOM 593 C SER A 40 26.680 -6.981 -8.367 1.00 0.00 C ATOM 594 O SER A 40 25.647 -6.312 -8.293 1.00 0.00 O ATOM 595 CB SER A 40 26.422 -9.348 -9.282 1.00 0.00 C ATOM 596 OG SER A 40 25.066 -9.275 -9.690 1.00 0.00 O ATOM 0 H SER A 40 24.896 -9.367 -7.401 1.00 0.00 H new ATOM 0 HA SER A 40 27.658 -8.701 -7.653 1.00 0.00 H new ATOM 0 HB2 SER A 40 27.069 -9.018 -10.095 1.00 0.00 H new ATOM 0 HB3 SER A 40 26.686 -10.383 -9.064 1.00 0.00 H new ATOM 0 HG SER A 40 24.561 -10.008 -9.279 1.00 0.00 H new ATOM 602 N ARG A 41 27.848 -6.434 -8.740 1.00 0.00 N ATOM 603 CA ARG A 41 28.006 -5.001 -9.077 1.00 0.00 C ATOM 604 C ARG A 41 27.085 -4.586 -10.224 1.00 0.00 C ATOM 605 O ARG A 41 26.776 -5.418 -11.070 1.00 0.00 O ATOM 606 CB ARG A 41 29.483 -4.681 -9.404 1.00 0.00 C ATOM 607 CG ARG A 41 29.935 -5.160 -10.802 1.00 0.00 C ATOM 608 CD ARG A 41 31.417 -4.868 -11.066 1.00 0.00 C ATOM 609 NE ARG A 41 32.311 -5.682 -10.212 1.00 0.00 N ATOM 610 CZ ARG A 41 33.619 -5.542 -10.075 1.00 0.00 C ATOM 611 NH1 ARG A 41 34.290 -4.633 -10.723 1.00 0.00 N ATOM 612 NH2 ARG A 41 34.287 -6.324 -9.275 1.00 0.00 N ATOM 0 H ARG A 41 28.713 -6.969 -8.818 1.00 0.00 H new ATOM 0 HA ARG A 41 27.713 -4.419 -8.203 1.00 0.00 H new ATOM 0 HB2 ARG A 41 29.635 -3.604 -9.334 1.00 0.00 H new ATOM 0 HB3 ARG A 41 30.120 -5.143 -8.649 1.00 0.00 H new ATOM 0 HG2 ARG A 41 29.756 -6.232 -10.892 1.00 0.00 H new ATOM 0 HG3 ARG A 41 29.329 -4.671 -11.565 1.00 0.00 H new ATOM 0 HD2 ARG A 41 31.642 -5.064 -12.114 1.00 0.00 H new ATOM 0 HD3 ARG A 41 31.614 -3.810 -10.890 1.00 0.00 H new ATOM 0 HE ARG A 41 31.873 -6.429 -9.673 1.00 0.00 H new ATOM 0 HH11 ARG A 41 33.807 -4.000 -11.361 1.00 0.00 H new ATOM 0 HH12 ARG A 41 35.299 -4.554 -10.593 1.00 0.00 H new ATOM 0 HH21 ARG A 41 33.801 -7.050 -8.749 1.00 0.00 H new ATOM 0 HH22 ARG A 41 35.296 -6.210 -9.175 1.00 0.00 H new ATOM 626 N VAL A 42 26.733 -3.301 -10.315 1.00 0.00 N ATOM 627 CA VAL A 42 26.036 -2.719 -11.478 1.00 0.00 C ATOM 628 C VAL A 42 26.805 -3.111 -12.749 1.00 0.00 C ATOM 629 O VAL A 42 27.942 -2.693 -12.962 1.00 0.00 O ATOM 630 CB VAL A 42 25.860 -1.199 -11.289 1.00 0.00 C ATOM 631 CG1 VAL A 42 24.792 -0.956 -10.216 1.00 0.00 C ATOM 632 CG2 VAL A 42 27.127 -0.446 -10.845 1.00 0.00 C ATOM 0 H VAL A 42 26.924 -2.623 -9.577 1.00 0.00 H new ATOM 0 HA VAL A 42 25.025 -3.115 -11.576 1.00 0.00 H new ATOM 0 HB VAL A 42 25.587 -0.815 -12.272 1.00 0.00 H new ATOM 0 HG11 VAL A 42 24.658 0.116 -10.073 1.00 0.00 H new ATOM 0 HG12 VAL A 42 23.849 -1.400 -10.534 1.00 0.00 H new ATOM 0 HG13 VAL A 42 25.109 -1.411 -9.278 1.00 0.00 H new ATOM 0 HG21 VAL A 42 26.901 0.615 -10.740 1.00 0.00 H new ATOM 0 HG22 VAL A 42 27.469 -0.841 -9.888 1.00 0.00 H new ATOM 0 HG23 VAL A 42 27.909 -0.578 -11.592 1.00 0.00 H new ATOM 642 N HIS A 43 26.210 -3.994 -13.562 1.00 0.00 N ATOM 643 CA HIS A 43 26.919 -4.651 -14.667 1.00 0.00 C ATOM 644 C HIS A 43 27.339 -3.658 -15.764 1.00 0.00 C ATOM 645 O HIS A 43 26.490 -2.890 -16.217 1.00 0.00 O ATOM 646 CB HIS A 43 26.078 -5.826 -15.200 1.00 0.00 C ATOM 647 CG HIS A 43 26.819 -6.655 -16.206 1.00 0.00 C ATOM 648 ND1 HIS A 43 27.135 -6.251 -17.505 1.00 0.00 N ATOM 649 CD2 HIS A 43 27.404 -7.857 -15.950 1.00 0.00 C ATOM 650 CE1 HIS A 43 27.912 -7.233 -18.000 1.00 0.00 C ATOM 651 NE2 HIS A 43 28.089 -8.203 -17.091 1.00 0.00 N ATOM 0 H HIS A 43 25.232 -4.271 -13.473 1.00 0.00 H new ATOM 0 HA HIS A 43 27.855 -5.060 -14.287 1.00 0.00 H new ATOM 0 HB2 HIS A 43 25.775 -6.459 -14.366 1.00 0.00 H new ATOM 0 HB3 HIS A 43 25.166 -5.439 -15.655 1.00 0.00 H new ATOM 0 HD2 HIS A 43 27.342 -8.425 -15.034 1.00 0.00 H new ATOM 0 HE1 HIS A 43 28.335 -7.239 -18.994 1.00 0.00 H new ATOM 0 HE2 HIS A 43 28.638 -9.052 -17.223 1.00 0.00 H new ATOM 659 N PRO A 44 28.606 -3.658 -16.226 1.00 0.00 N ATOM 660 CA PRO A 44 29.133 -2.642 -17.148 1.00 0.00 C ATOM 661 C PRO A 44 28.365 -2.565 -18.472 1.00 0.00 C ATOM 662 O PRO A 44 28.090 -1.469 -18.967 1.00 0.00 O ATOM 663 CB PRO A 44 30.601 -3.028 -17.377 1.00 0.00 C ATOM 664 CG PRO A 44 30.642 -4.521 -17.054 1.00 0.00 C ATOM 665 CD PRO A 44 29.656 -4.615 -15.899 1.00 0.00 C ATOM 0 HA PRO A 44 29.025 -1.646 -16.718 1.00 0.00 H new ATOM 0 HB2 PRO A 44 30.910 -2.833 -18.404 1.00 0.00 H new ATOM 0 HB3 PRO A 44 31.269 -2.460 -16.729 1.00 0.00 H new ATOM 0 HG2 PRO A 44 30.337 -5.132 -17.903 1.00 0.00 H new ATOM 0 HG3 PRO A 44 31.641 -4.850 -16.767 1.00 0.00 H new ATOM 0 HD2 PRO A 44 29.255 -5.624 -15.802 1.00 0.00 H new ATOM 0 HD3 PRO A 44 30.133 -4.369 -14.950 1.00 0.00 H new ATOM 673 N THR A 45 27.951 -3.715 -19.016 1.00 0.00 N ATOM 674 CA THR A 45 27.152 -3.766 -20.245 1.00 0.00 C ATOM 675 C THR A 45 25.696 -3.415 -19.956 1.00 0.00 C ATOM 676 O THR A 45 25.079 -2.717 -20.753 1.00 0.00 O ATOM 677 CB THR A 45 27.297 -5.126 -20.948 1.00 0.00 C ATOM 678 OG1 THR A 45 28.671 -5.424 -21.114 1.00 0.00 O ATOM 679 CG2 THR A 45 26.658 -5.137 -22.337 1.00 0.00 C ATOM 0 H THR A 45 28.159 -4.631 -18.619 1.00 0.00 H new ATOM 0 HA THR A 45 27.534 -3.015 -20.936 1.00 0.00 H new ATOM 0 HB THR A 45 26.792 -5.861 -20.321 1.00 0.00 H new ATOM 0 HG1 THR A 45 28.766 -6.291 -21.560 1.00 0.00 H new ATOM 0 HG21 THR A 45 26.788 -6.120 -22.790 1.00 0.00 H new ATOM 0 HG22 THR A 45 25.594 -4.916 -22.250 1.00 0.00 H new ATOM 0 HG23 THR A 45 27.135 -4.383 -22.963 1.00 0.00 H new ATOM 687 N ALA A 46 25.148 -3.771 -18.788 1.00 0.00 N ATOM 688 CA ALA A 46 23.807 -3.319 -18.409 1.00 0.00 C ATOM 689 C ALA A 46 23.738 -1.791 -18.250 1.00 0.00 C ATOM 690 O ALA A 46 22.815 -1.191 -18.788 1.00 0.00 O ATOM 691 CB ALA A 46 23.332 -4.046 -17.148 1.00 0.00 C ATOM 0 H ALA A 46 25.607 -4.364 -18.097 1.00 0.00 H new ATOM 0 HA ALA A 46 23.126 -3.575 -19.221 1.00 0.00 H new ATOM 0 HB1 ALA A 46 22.334 -3.698 -16.881 1.00 0.00 H new ATOM 0 HB2 ALA A 46 23.303 -5.119 -17.336 1.00 0.00 H new ATOM 0 HB3 ALA A 46 24.020 -3.839 -16.328 1.00 0.00 H new ATOM 697 N ILE A 47 24.709 -1.123 -17.612 1.00 0.00 N ATOM 698 CA ILE A 47 24.725 0.351 -17.517 1.00 0.00 C ATOM 699 C ILE A 47 24.639 0.980 -18.924 1.00 0.00 C ATOM 700 O ILE A 47 23.864 1.910 -19.129 1.00 0.00 O ATOM 701 CB ILE A 47 25.965 0.852 -16.731 1.00 0.00 C ATOM 702 CG1 ILE A 47 26.047 0.283 -15.293 1.00 0.00 C ATOM 703 CG2 ILE A 47 25.936 2.387 -16.606 1.00 0.00 C ATOM 704 CD1 ILE A 47 27.455 0.379 -14.693 1.00 0.00 C ATOM 0 H ILE A 47 25.497 -1.578 -17.152 1.00 0.00 H new ATOM 0 HA ILE A 47 23.848 0.671 -16.955 1.00 0.00 H new ATOM 0 HB ILE A 47 26.829 0.506 -17.299 1.00 0.00 H new ATOM 0 HG12 ILE A 47 25.348 0.822 -14.654 1.00 0.00 H new ATOM 0 HG13 ILE A 47 25.732 -0.760 -15.302 1.00 0.00 H new ATOM 0 HG21 ILE A 47 26.812 2.724 -16.052 1.00 0.00 H new ATOM 0 HG22 ILE A 47 25.942 2.833 -17.600 1.00 0.00 H new ATOM 0 HG23 ILE A 47 25.033 2.692 -16.077 1.00 0.00 H new ATOM 0 HD11 ILE A 47 27.450 -0.035 -13.685 1.00 0.00 H new ATOM 0 HD12 ILE A 47 28.154 -0.183 -15.313 1.00 0.00 H new ATOM 0 HD13 ILE A 47 27.764 1.424 -14.655 1.00 0.00 H new ATOM 716 N ALA A 48 25.335 0.415 -19.921 1.00 0.00 N ATOM 717 CA ALA A 48 25.235 0.836 -21.324 1.00 0.00 C ATOM 718 C ALA A 48 23.848 0.570 -21.939 1.00 0.00 C ATOM 719 O ALA A 48 23.134 1.495 -22.324 1.00 0.00 O ATOM 720 CB ALA A 48 26.344 0.141 -22.127 1.00 0.00 C ATOM 0 H ALA A 48 25.989 -0.354 -19.774 1.00 0.00 H new ATOM 0 HA ALA A 48 25.366 1.917 -21.364 1.00 0.00 H new ATOM 0 HB1 ALA A 48 26.282 0.445 -23.172 1.00 0.00 H new ATOM 0 HB2 ALA A 48 27.317 0.424 -21.724 1.00 0.00 H new ATOM 0 HB3 ALA A 48 26.222 -0.940 -22.056 1.00 0.00 H new ATOM 726 N MET A 49 23.444 -0.701 -22.026 1.00 0.00 N ATOM 727 CA MET A 49 22.221 -1.129 -22.725 1.00 0.00 C ATOM 728 C MET A 49 20.932 -0.646 -22.049 1.00 0.00 C ATOM 729 O MET A 49 19.901 -0.584 -22.710 1.00 0.00 O ATOM 730 CB MET A 49 22.176 -2.657 -22.842 1.00 0.00 C ATOM 731 CG MET A 49 23.407 -3.306 -23.489 1.00 0.00 C ATOM 732 SD MET A 49 23.769 -2.899 -25.213 1.00 0.00 S ATOM 733 CE MET A 49 24.873 -1.475 -25.024 1.00 0.00 C ATOM 0 H MET A 49 23.962 -1.474 -21.608 1.00 0.00 H new ATOM 0 HA MET A 49 22.267 -0.669 -23.712 1.00 0.00 H new ATOM 0 HB2 MET A 49 22.048 -3.077 -21.844 1.00 0.00 H new ATOM 0 HB3 MET A 49 21.295 -2.934 -23.420 1.00 0.00 H new ATOM 0 HG2 MET A 49 24.279 -3.039 -22.892 1.00 0.00 H new ATOM 0 HG3 MET A 49 23.291 -4.388 -23.418 1.00 0.00 H new ATOM 0 HE1 MET A 49 25.234 -1.162 -26.004 1.00 0.00 H new ATOM 0 HE2 MET A 49 24.330 -0.653 -24.557 1.00 0.00 H new ATOM 0 HE3 MET A 49 25.721 -1.752 -24.397 1.00 0.00 H new ATOM 743 N MET A 50 20.969 -0.312 -20.760 1.00 0.00 N ATOM 744 CA MET A 50 19.830 0.256 -20.037 1.00 0.00 C ATOM 745 C MET A 50 19.780 1.784 -20.223 1.00 0.00 C ATOM 746 O MET A 50 18.704 2.322 -20.468 1.00 0.00 O ATOM 747 CB MET A 50 19.888 -0.183 -18.564 1.00 0.00 C ATOM 748 CG MET A 50 19.862 -1.715 -18.400 1.00 0.00 C ATOM 749 SD MET A 50 18.336 -2.561 -18.900 1.00 0.00 S ATOM 750 CE MET A 50 17.132 -1.749 -17.820 1.00 0.00 C ATOM 0 H MET A 50 21.800 -0.429 -20.181 1.00 0.00 H new ATOM 0 HA MET A 50 18.894 -0.125 -20.447 1.00 0.00 H new ATOM 0 HB2 MET A 50 20.795 0.212 -18.107 1.00 0.00 H new ATOM 0 HB3 MET A 50 19.045 0.251 -18.026 1.00 0.00 H new ATOM 0 HG2 MET A 50 20.688 -2.133 -18.976 1.00 0.00 H new ATOM 0 HG3 MET A 50 20.053 -1.949 -17.353 1.00 0.00 H new ATOM 0 HE1 MET A 50 16.241 -2.371 -17.737 1.00 0.00 H new ATOM 0 HE2 MET A 50 17.568 -1.606 -16.831 1.00 0.00 H new ATOM 0 HE3 MET A 50 16.861 -0.781 -18.241 1.00 0.00 H new ATOM 760 N GLU A 51 20.917 2.488 -20.252 1.00 0.00 N ATOM 761 CA GLU A 51 20.952 3.927 -20.573 1.00 0.00 C ATOM 762 C GLU A 51 20.479 4.209 -22.015 1.00 0.00 C ATOM 763 O GLU A 51 19.786 5.198 -22.256 1.00 0.00 O ATOM 764 CB GLU A 51 22.370 4.472 -20.323 1.00 0.00 C ATOM 765 CG GLU A 51 22.533 5.983 -20.514 1.00 0.00 C ATOM 766 CD GLU A 51 21.844 6.793 -19.395 1.00 0.00 C ATOM 767 OE1 GLU A 51 20.606 6.989 -19.443 1.00 0.00 O ATOM 768 OE2 GLU A 51 22.548 7.264 -18.468 1.00 0.00 O ATOM 0 H GLU A 51 21.833 2.085 -20.056 1.00 0.00 H new ATOM 0 HA GLU A 51 20.253 4.446 -19.917 1.00 0.00 H new ATOM 0 HB2 GLU A 51 22.665 4.217 -19.305 1.00 0.00 H new ATOM 0 HB3 GLU A 51 23.061 3.961 -20.993 1.00 0.00 H new ATOM 0 HG2 GLU A 51 23.594 6.231 -20.539 1.00 0.00 H new ATOM 0 HG3 GLU A 51 22.115 6.272 -21.478 1.00 0.00 H new ATOM 775 N GLU A 52 20.747 3.301 -22.965 1.00 0.00 N ATOM 776 CA GLU A 52 20.185 3.348 -24.328 1.00 0.00 C ATOM 777 C GLU A 52 18.639 3.406 -24.359 1.00 0.00 C ATOM 778 O GLU A 52 18.065 3.979 -25.288 1.00 0.00 O ATOM 779 CB GLU A 52 20.632 2.107 -25.116 1.00 0.00 C ATOM 780 CG GLU A 52 22.085 2.174 -25.598 1.00 0.00 C ATOM 781 CD GLU A 52 22.501 0.925 -26.401 1.00 0.00 C ATOM 782 OE1 GLU A 52 21.770 -0.096 -26.414 1.00 0.00 O ATOM 783 OE2 GLU A 52 23.578 0.952 -27.038 1.00 0.00 O ATOM 0 H GLU A 52 21.365 2.505 -22.810 1.00 0.00 H new ATOM 0 HA GLU A 52 20.560 4.268 -24.777 1.00 0.00 H new ATOM 0 HB2 GLU A 52 20.507 1.225 -24.488 1.00 0.00 H new ATOM 0 HB3 GLU A 52 19.978 1.980 -25.979 1.00 0.00 H new ATOM 0 HG2 GLU A 52 22.218 3.061 -26.218 1.00 0.00 H new ATOM 0 HG3 GLU A 52 22.745 2.285 -24.737 1.00 0.00 H new ATOM 790 N VAL A 53 17.966 2.846 -23.342 1.00 0.00 N ATOM 791 CA VAL A 53 16.497 2.904 -23.151 1.00 0.00 C ATOM 792 C VAL A 53 16.061 3.842 -22.004 1.00 0.00 C ATOM 793 O VAL A 53 14.935 3.751 -21.515 1.00 0.00 O ATOM 794 CB VAL A 53 15.873 1.493 -23.062 1.00 0.00 C ATOM 795 CG1 VAL A 53 15.976 0.776 -24.409 1.00 0.00 C ATOM 796 CG2 VAL A 53 16.548 0.614 -22.005 1.00 0.00 C ATOM 0 H VAL A 53 18.438 2.323 -22.604 1.00 0.00 H new ATOM 0 HA VAL A 53 16.089 3.366 -24.050 1.00 0.00 H new ATOM 0 HB VAL A 53 14.831 1.641 -22.778 1.00 0.00 H new ATOM 0 HG11 VAL A 53 15.532 -0.216 -24.328 1.00 0.00 H new ATOM 0 HG12 VAL A 53 15.445 1.350 -25.168 1.00 0.00 H new ATOM 0 HG13 VAL A 53 17.024 0.682 -24.692 1.00 0.00 H new ATOM 0 HG21 VAL A 53 16.069 -0.365 -21.986 1.00 0.00 H new ATOM 0 HG22 VAL A 53 17.604 0.497 -22.249 1.00 0.00 H new ATOM 0 HG23 VAL A 53 16.452 1.084 -21.026 1.00 0.00 H new ATOM 806 N GLY A 54 16.928 4.772 -21.586 1.00 0.00 N ATOM 807 CA GLY A 54 16.619 5.822 -20.603 1.00 0.00 C ATOM 808 C GLY A 54 16.742 5.402 -19.131 1.00 0.00 C ATOM 809 O GLY A 54 16.233 6.102 -18.253 1.00 0.00 O ATOM 0 H GLY A 54 17.887 4.818 -21.929 1.00 0.00 H new ATOM 0 HA2 GLY A 54 17.284 6.668 -20.779 1.00 0.00 H new ATOM 0 HA3 GLY A 54 15.602 6.174 -20.779 1.00 0.00 H new ATOM 813 N ILE A 55 17.371 4.255 -18.854 1.00 0.00 N ATOM 814 CA ILE A 55 17.404 3.598 -17.543 1.00 0.00 C ATOM 815 C ILE A 55 18.849 3.525 -17.033 1.00 0.00 C ATOM 816 O ILE A 55 19.600 2.612 -17.362 1.00 0.00 O ATOM 817 CB ILE A 55 16.720 2.213 -17.642 1.00 0.00 C ATOM 818 CG1 ILE A 55 15.229 2.357 -18.019 1.00 0.00 C ATOM 819 CG2 ILE A 55 16.817 1.458 -16.304 1.00 0.00 C ATOM 820 CD1 ILE A 55 14.588 1.066 -18.535 1.00 0.00 C ATOM 0 H ILE A 55 17.891 3.739 -19.564 1.00 0.00 H new ATOM 0 HA ILE A 55 16.844 4.178 -16.810 1.00 0.00 H new ATOM 0 HB ILE A 55 17.239 1.652 -18.419 1.00 0.00 H new ATOM 0 HG12 ILE A 55 14.676 2.701 -17.145 1.00 0.00 H new ATOM 0 HG13 ILE A 55 15.131 3.129 -18.782 1.00 0.00 H new ATOM 0 HG21 ILE A 55 16.330 0.488 -16.398 1.00 0.00 H new ATOM 0 HG22 ILE A 55 17.865 1.314 -16.043 1.00 0.00 H new ATOM 0 HG23 ILE A 55 16.325 2.037 -15.523 1.00 0.00 H new ATOM 0 HD11 ILE A 55 13.542 1.251 -18.778 1.00 0.00 H new ATOM 0 HD12 ILE A 55 15.114 0.731 -19.429 1.00 0.00 H new ATOM 0 HD13 ILE A 55 14.651 0.296 -17.766 1.00 0.00 H new ATOM 832 N ASP A 56 19.248 4.466 -16.183 1.00 0.00 N ATOM 833 CA ASP A 56 20.539 4.393 -15.495 1.00 0.00 C ATOM 834 C ASP A 56 20.463 3.408 -14.310 1.00 0.00 C ATOM 835 O ASP A 56 19.795 3.691 -13.312 1.00 0.00 O ATOM 836 CB ASP A 56 20.959 5.800 -15.049 1.00 0.00 C ATOM 837 CG ASP A 56 22.272 5.795 -14.252 1.00 0.00 C ATOM 838 OD1 ASP A 56 23.075 4.839 -14.392 1.00 0.00 O ATOM 839 OD2 ASP A 56 22.503 6.741 -13.463 1.00 0.00 O ATOM 0 H ASP A 56 18.696 5.292 -15.951 1.00 0.00 H new ATOM 0 HA ASP A 56 21.300 4.013 -16.177 1.00 0.00 H new ATOM 0 HB2 ASP A 56 21.072 6.437 -15.926 1.00 0.00 H new ATOM 0 HB3 ASP A 56 20.168 6.236 -14.438 1.00 0.00 H new ATOM 844 N ILE A 57 21.166 2.265 -14.390 1.00 0.00 N ATOM 845 CA ILE A 57 21.297 1.331 -13.258 1.00 0.00 C ATOM 846 C ILE A 57 22.554 1.590 -12.412 1.00 0.00 C ATOM 847 O ILE A 57 22.732 0.925 -11.400 1.00 0.00 O ATOM 848 CB ILE A 57 21.221 -0.155 -13.691 1.00 0.00 C ATOM 849 CG1 ILE A 57 22.434 -0.618 -14.531 1.00 0.00 C ATOM 850 CG2 ILE A 57 19.908 -0.467 -14.433 1.00 0.00 C ATOM 851 CD1 ILE A 57 22.919 -2.014 -14.121 1.00 0.00 C ATOM 0 H ILE A 57 21.655 1.964 -15.233 1.00 0.00 H new ATOM 0 HA ILE A 57 20.432 1.530 -12.625 1.00 0.00 H new ATOM 0 HB ILE A 57 21.245 -0.724 -12.762 1.00 0.00 H new ATOM 0 HG12 ILE A 57 22.162 -0.624 -15.587 1.00 0.00 H new ATOM 0 HG13 ILE A 57 23.249 0.097 -14.416 1.00 0.00 H new ATOM 0 HG21 ILE A 57 19.893 -1.518 -14.720 1.00 0.00 H new ATOM 0 HG22 ILE A 57 19.062 -0.257 -13.779 1.00 0.00 H new ATOM 0 HG23 ILE A 57 19.839 0.154 -15.326 1.00 0.00 H new ATOM 0 HD11 ILE A 57 23.772 -2.298 -14.737 1.00 0.00 H new ATOM 0 HD12 ILE A 57 23.217 -2.002 -13.072 1.00 0.00 H new ATOM 0 HD13 ILE A 57 22.114 -2.735 -14.262 1.00 0.00 H new ATOM 863 N SER A 58 23.437 2.523 -12.780 1.00 0.00 N ATOM 864 CA SER A 58 24.760 2.662 -12.142 1.00 0.00 C ATOM 865 C SER A 58 24.731 3.093 -10.663 1.00 0.00 C ATOM 866 O SER A 58 25.633 2.739 -9.902 1.00 0.00 O ATOM 867 CB SER A 58 25.656 3.590 -12.958 1.00 0.00 C ATOM 868 OG SER A 58 25.202 4.926 -12.946 1.00 0.00 O ATOM 0 H SER A 58 23.262 3.201 -13.522 1.00 0.00 H new ATOM 0 HA SER A 58 25.177 1.655 -12.133 1.00 0.00 H new ATOM 0 HB2 SER A 58 26.671 3.551 -12.562 1.00 0.00 H new ATOM 0 HB3 SER A 58 25.701 3.234 -13.987 1.00 0.00 H new ATOM 0 HG SER A 58 24.637 5.087 -13.731 1.00 0.00 H new ATOM 874 N GLY A 59 23.674 3.801 -10.242 1.00 0.00 N ATOM 875 CA GLY A 59 23.395 4.166 -8.842 1.00 0.00 C ATOM 876 C GLY A 59 22.345 3.281 -8.151 1.00 0.00 C ATOM 877 O GLY A 59 21.873 3.622 -7.065 1.00 0.00 O ATOM 0 H GLY A 59 22.964 4.148 -10.887 1.00 0.00 H new ATOM 0 HA2 GLY A 59 24.324 4.116 -8.274 1.00 0.00 H new ATOM 0 HA3 GLY A 59 23.057 5.202 -8.810 1.00 0.00 H new ATOM 881 N GLN A 60 21.930 2.177 -8.784 1.00 0.00 N ATOM 882 CA GLN A 60 20.797 1.343 -8.366 1.00 0.00 C ATOM 883 C GLN A 60 21.209 0.271 -7.334 1.00 0.00 C ATOM 884 O GLN A 60 22.330 -0.241 -7.376 1.00 0.00 O ATOM 885 CB GLN A 60 20.183 0.737 -9.638 1.00 0.00 C ATOM 886 CG GLN A 60 18.776 0.155 -9.440 1.00 0.00 C ATOM 887 CD GLN A 60 18.224 -0.405 -10.743 1.00 0.00 C ATOM 888 OE1 GLN A 60 17.216 0.197 -11.344 1.00 0.00 O flip ATOM 889 NE2 GLN A 60 18.718 -1.386 -11.269 1.00 0.00 N flip ATOM 0 H GLN A 60 22.387 1.829 -9.627 1.00 0.00 H new ATOM 0 HA GLN A 60 20.053 1.949 -7.849 1.00 0.00 H new ATOM 0 HB2 GLN A 60 20.141 1.506 -10.410 1.00 0.00 H new ATOM 0 HB3 GLN A 60 20.841 -0.050 -10.007 1.00 0.00 H new ATOM 0 HG2 GLN A 60 18.808 -0.633 -8.687 1.00 0.00 H new ATOM 0 HG3 GLN A 60 18.109 0.930 -9.062 1.00 0.00 H new ATOM 0 HE21 GLN A 60 19.498 -1.866 -10.821 1.00 0.00 H new ATOM 0 HE22 GLN A 60 18.351 -1.727 -12.158 1.00 0.00 H new ATOM 898 N THR A 61 20.298 -0.112 -6.427 1.00 0.00 N ATOM 899 CA THR A 61 20.570 -1.166 -5.420 1.00 0.00 C ATOM 900 C THR A 61 20.825 -2.526 -6.066 1.00 0.00 C ATOM 901 O THR A 61 20.260 -2.827 -7.118 1.00 0.00 O ATOM 902 CB THR A 61 19.460 -1.283 -4.367 1.00 0.00 C ATOM 903 OG1 THR A 61 19.893 -2.161 -3.350 1.00 0.00 O ATOM 904 CG2 THR A 61 18.118 -1.806 -4.882 1.00 0.00 C ATOM 0 H THR A 61 19.362 0.289 -6.365 1.00 0.00 H new ATOM 0 HA THR A 61 21.480 -0.851 -4.909 1.00 0.00 H new ATOM 0 HB THR A 61 19.285 -0.265 -4.020 1.00 0.00 H new ATOM 0 HG1 THR A 61 19.193 -2.243 -2.669 1.00 0.00 H new ATOM 0 HG21 THR A 61 17.405 -1.850 -4.059 1.00 0.00 H new ATOM 0 HG22 THR A 61 17.739 -1.137 -5.655 1.00 0.00 H new ATOM 0 HG23 THR A 61 18.252 -2.804 -5.299 1.00 0.00 H new ATOM 912 N SER A 62 21.673 -3.351 -5.439 1.00 0.00 N ATOM 913 CA SER A 62 21.936 -4.727 -5.873 1.00 0.00 C ATOM 914 C SER A 62 22.029 -5.694 -4.676 1.00 0.00 C ATOM 915 O SER A 62 23.030 -6.375 -4.464 1.00 0.00 O ATOM 916 CB SER A 62 23.176 -4.769 -6.775 1.00 0.00 C ATOM 917 OG SER A 62 23.084 -5.863 -7.666 1.00 0.00 O ATOM 0 H SER A 62 22.200 -3.079 -4.609 1.00 0.00 H new ATOM 0 HA SER A 62 21.091 -5.075 -6.467 1.00 0.00 H new ATOM 0 HB2 SER A 62 23.261 -3.838 -7.335 1.00 0.00 H new ATOM 0 HB3 SER A 62 24.076 -4.858 -6.167 1.00 0.00 H new ATOM 0 HG SER A 62 23.982 -6.208 -7.854 1.00 0.00 H new ATOM 923 N ASP A 63 20.990 -5.717 -3.837 1.00 0.00 N ATOM 924 CA ASP A 63 20.962 -6.414 -2.538 1.00 0.00 C ATOM 925 C ASP A 63 20.974 -7.963 -2.674 1.00 0.00 C ATOM 926 O ASP A 63 20.422 -8.482 -3.653 1.00 0.00 O ATOM 927 CB ASP A 63 19.725 -5.927 -1.762 1.00 0.00 C ATOM 928 CG ASP A 63 19.925 -5.991 -0.240 1.00 0.00 C ATOM 929 OD1 ASP A 63 20.775 -5.238 0.286 1.00 0.00 O ATOM 930 OD2 ASP A 63 19.225 -6.771 0.446 1.00 0.00 O ATOM 0 H ASP A 63 20.114 -5.237 -4.045 1.00 0.00 H new ATOM 0 HA ASP A 63 21.874 -6.171 -1.993 1.00 0.00 H new ATOM 0 HB2 ASP A 63 19.498 -4.901 -2.053 1.00 0.00 H new ATOM 0 HB3 ASP A 63 18.864 -6.535 -2.038 1.00 0.00 H new ATOM 935 N PRO A 64 21.581 -8.729 -1.743 1.00 0.00 N ATOM 936 CA PRO A 64 21.589 -10.194 -1.807 1.00 0.00 C ATOM 937 C PRO A 64 20.303 -10.813 -1.238 1.00 0.00 C ATOM 938 O PRO A 64 19.715 -10.316 -0.273 1.00 0.00 O ATOM 939 CB PRO A 64 22.800 -10.649 -0.982 1.00 0.00 C ATOM 940 CG PRO A 64 22.924 -9.539 0.057 1.00 0.00 C ATOM 941 CD PRO A 64 22.454 -8.276 -0.669 1.00 0.00 C ATOM 0 HA PRO A 64 21.647 -10.521 -2.845 1.00 0.00 H new ATOM 0 HB2 PRO A 64 22.634 -11.622 -0.519 1.00 0.00 H new ATOM 0 HB3 PRO A 64 23.698 -10.736 -1.593 1.00 0.00 H new ATOM 0 HG2 PRO A 64 22.308 -9.745 0.933 1.00 0.00 H new ATOM 0 HG3 PRO A 64 23.951 -9.436 0.407 1.00 0.00 H new ATOM 0 HD2 PRO A 64 21.922 -7.611 0.011 1.00 0.00 H new ATOM 0 HD3 PRO A 64 23.301 -7.716 -1.065 1.00 0.00 H new ATOM 949 N ILE A 65 19.950 -11.993 -1.748 1.00 0.00 N ATOM 950 CA ILE A 65 18.757 -12.762 -1.333 1.00 0.00 C ATOM 951 C ILE A 65 18.742 -13.168 0.159 1.00 0.00 C ATOM 952 O ILE A 65 17.675 -13.413 0.720 1.00 0.00 O ATOM 953 CB ILE A 65 18.574 -13.975 -2.274 1.00 0.00 C ATOM 954 CG1 ILE A 65 17.179 -14.610 -2.111 1.00 0.00 C ATOM 955 CG2 ILE A 65 19.687 -15.023 -2.072 1.00 0.00 C ATOM 956 CD1 ILE A 65 16.833 -15.640 -3.192 1.00 0.00 C ATOM 0 H ILE A 65 20.491 -12.458 -2.477 1.00 0.00 H new ATOM 0 HA ILE A 65 17.899 -12.096 -1.429 1.00 0.00 H new ATOM 0 HB ILE A 65 18.652 -13.604 -3.296 1.00 0.00 H new ATOM 0 HG12 ILE A 65 17.122 -15.090 -1.134 1.00 0.00 H new ATOM 0 HG13 ILE A 65 16.428 -13.820 -2.122 1.00 0.00 H new ATOM 0 HG21 ILE A 65 19.525 -15.861 -2.750 1.00 0.00 H new ATOM 0 HG22 ILE A 65 20.656 -14.569 -2.280 1.00 0.00 H new ATOM 0 HG23 ILE A 65 19.668 -15.381 -1.042 1.00 0.00 H new ATOM 0 HD11 ILE A 65 15.836 -16.041 -3.007 1.00 0.00 H new ATOM 0 HD12 ILE A 65 16.856 -15.162 -4.171 1.00 0.00 H new ATOM 0 HD13 ILE A 65 17.560 -16.451 -3.168 1.00 0.00 H new ATOM 968 N GLU A 66 19.902 -13.217 0.825 1.00 0.00 N ATOM 969 CA GLU A 66 20.007 -13.544 2.259 1.00 0.00 C ATOM 970 C GLU A 66 19.973 -12.305 3.183 1.00 0.00 C ATOM 971 O GLU A 66 19.852 -12.459 4.400 1.00 0.00 O ATOM 972 CB GLU A 66 21.252 -14.408 2.508 1.00 0.00 C ATOM 973 CG GLU A 66 21.179 -15.754 1.775 1.00 0.00 C ATOM 974 CD GLU A 66 22.327 -16.682 2.218 1.00 0.00 C ATOM 975 OE1 GLU A 66 23.435 -16.619 1.627 1.00 0.00 O ATOM 976 OE2 GLU A 66 22.131 -17.492 3.158 1.00 0.00 O ATOM 0 H GLU A 66 20.803 -13.030 0.384 1.00 0.00 H new ATOM 0 HA GLU A 66 19.117 -14.115 2.523 1.00 0.00 H new ATOM 0 HB2 GLU A 66 22.140 -13.866 2.182 1.00 0.00 H new ATOM 0 HB3 GLU A 66 21.362 -14.584 3.578 1.00 0.00 H new ATOM 0 HG2 GLU A 66 20.220 -16.232 1.978 1.00 0.00 H new ATOM 0 HG3 GLU A 66 21.233 -15.590 0.699 1.00 0.00 H new ATOM 983 N ASN A 67 20.049 -11.083 2.631 1.00 0.00 N ATOM 984 CA ASN A 67 19.838 -9.832 3.379 1.00 0.00 C ATOM 985 C ASN A 67 18.407 -9.297 3.210 1.00 0.00 C ATOM 986 O ASN A 67 17.842 -8.743 4.156 1.00 0.00 O ATOM 987 CB ASN A 67 20.861 -8.786 2.924 1.00 0.00 C ATOM 988 CG ASN A 67 20.728 -7.488 3.699 1.00 0.00 C ATOM 989 OD1 ASN A 67 21.070 -7.395 4.870 1.00 0.00 O ATOM 990 ND2 ASN A 67 20.214 -6.457 3.074 1.00 0.00 N ATOM 0 H ASN A 67 20.260 -10.934 1.644 1.00 0.00 H new ATOM 0 HA ASN A 67 19.977 -10.042 4.439 1.00 0.00 H new ATOM 0 HB2 ASN A 67 21.868 -9.184 3.052 1.00 0.00 H new ATOM 0 HB3 ASN A 67 20.729 -8.588 1.860 1.00 0.00 H new ATOM 0 HD21 ASN A 67 20.097 -5.570 3.564 1.00 0.00 H new ATOM 0 HD22 ASN A 67 19.931 -6.542 2.098 1.00 0.00 H new ATOM 997 N PHE A 68 17.814 -9.472 2.023 1.00 0.00 N ATOM 998 CA PHE A 68 16.424 -9.106 1.762 1.00 0.00 C ATOM 999 C PHE A 68 15.443 -10.015 2.534 1.00 0.00 C ATOM 1000 O PHE A 68 15.795 -11.122 2.948 1.00 0.00 O ATOM 1001 CB PHE A 68 16.179 -9.079 0.241 1.00 0.00 C ATOM 1002 CG PHE A 68 14.975 -9.842 -0.275 1.00 0.00 C ATOM 1003 CD1 PHE A 68 15.104 -11.205 -0.585 1.00 0.00 C ATOM 1004 CD2 PHE A 68 13.742 -9.197 -0.472 1.00 0.00 C ATOM 1005 CE1 PHE A 68 14.033 -11.901 -1.162 1.00 0.00 C ATOM 1006 CE2 PHE A 68 12.673 -9.887 -1.068 1.00 0.00 C ATOM 1007 CZ PHE A 68 12.823 -11.239 -1.430 1.00 0.00 C ATOM 0 H PHE A 68 18.290 -9.874 1.215 1.00 0.00 H new ATOM 0 HA PHE A 68 16.232 -8.102 2.139 1.00 0.00 H new ATOM 0 HB2 PHE A 68 16.079 -8.038 -0.068 1.00 0.00 H new ATOM 0 HB3 PHE A 68 17.067 -9.474 -0.252 1.00 0.00 H new ATOM 0 HD1 PHE A 68 16.031 -11.719 -0.378 1.00 0.00 H new ATOM 0 HD2 PHE A 68 13.616 -8.169 -0.165 1.00 0.00 H new ATOM 0 HE1 PHE A 68 14.138 -12.949 -1.401 1.00 0.00 H new ATOM 0 HE2 PHE A 68 11.736 -9.380 -1.248 1.00 0.00 H new ATOM 0 HZ PHE A 68 12.012 -11.765 -1.911 1.00 0.00 H new ATOM 1017 N ASN A 69 14.200 -9.548 2.705 1.00 0.00 N ATOM 1018 CA ASN A 69 13.097 -10.352 3.230 1.00 0.00 C ATOM 1019 C ASN A 69 11.801 -10.134 2.440 1.00 0.00 C ATOM 1020 O ASN A 69 11.252 -9.036 2.445 1.00 0.00 O ATOM 1021 CB ASN A 69 12.940 -10.114 4.751 1.00 0.00 C ATOM 1022 CG ASN A 69 13.085 -8.667 5.217 1.00 0.00 C ATOM 1023 OD1 ASN A 69 13.932 -8.342 6.038 1.00 0.00 O ATOM 1024 ND2 ASN A 69 12.273 -7.752 4.735 1.00 0.00 N ATOM 0 H ASN A 69 13.932 -8.590 2.479 1.00 0.00 H new ATOM 0 HA ASN A 69 13.337 -11.407 3.094 1.00 0.00 H new ATOM 0 HB2 ASN A 69 11.959 -10.478 5.057 1.00 0.00 H new ATOM 0 HB3 ASN A 69 13.681 -10.720 5.273 1.00 0.00 H new ATOM 0 HD21 ASN A 69 12.353 -6.784 5.046 1.00 0.00 H new ATOM 0 HD22 ASN A 69 11.563 -8.010 4.050 1.00 0.00 H new ATOM 1031 N ALA A 70 11.250 -11.184 1.825 1.00 0.00 N ATOM 1032 CA ALA A 70 10.060 -11.109 0.963 1.00 0.00 C ATOM 1033 C ALA A 70 8.743 -10.729 1.682 1.00 0.00 C ATOM 1034 O ALA A 70 7.696 -10.647 1.045 1.00 0.00 O ATOM 1035 CB ALA A 70 9.904 -12.438 0.218 1.00 0.00 C ATOM 0 H ALA A 70 11.623 -12.129 1.912 1.00 0.00 H new ATOM 0 HA ALA A 70 10.236 -10.284 0.272 1.00 0.00 H new ATOM 0 HB1 ALA A 70 9.025 -12.394 -0.424 1.00 0.00 H new ATOM 0 HB2 ALA A 70 10.790 -12.620 -0.391 1.00 0.00 H new ATOM 0 HB3 ALA A 70 9.787 -13.247 0.939 1.00 0.00 H new ATOM 1041 N ASP A 71 8.780 -10.486 2.995 1.00 0.00 N ATOM 1042 CA ASP A 71 7.588 -10.204 3.812 1.00 0.00 C ATOM 1043 C ASP A 71 6.984 -8.820 3.503 1.00 0.00 C ATOM 1044 O ASP A 71 5.771 -8.620 3.587 1.00 0.00 O ATOM 1045 CB ASP A 71 7.970 -10.315 5.291 1.00 0.00 C ATOM 1046 CG ASP A 71 6.757 -10.112 6.217 1.00 0.00 C ATOM 1047 OD1 ASP A 71 5.878 -11.005 6.281 1.00 0.00 O ATOM 1048 OD2 ASP A 71 6.691 -9.067 6.909 1.00 0.00 O ATOM 0 H ASP A 71 9.648 -10.479 3.531 1.00 0.00 H new ATOM 0 HA ASP A 71 6.818 -10.936 3.569 1.00 0.00 H new ATOM 0 HB2 ASP A 71 8.410 -11.294 5.479 1.00 0.00 H new ATOM 0 HB3 ASP A 71 8.733 -9.573 5.525 1.00 0.00 H new ATOM 1053 N ASP A 72 7.838 -7.879 3.084 1.00 0.00 N ATOM 1054 CA ASP A 72 7.465 -6.515 2.691 1.00 0.00 C ATOM 1055 C ASP A 72 7.102 -6.387 1.193 1.00 0.00 C ATOM 1056 O ASP A 72 6.740 -5.303 0.732 1.00 0.00 O ATOM 1057 CB ASP A 72 8.617 -5.583 3.098 1.00 0.00 C ATOM 1058 CG ASP A 72 8.223 -4.099 3.185 1.00 0.00 C ATOM 1059 OD1 ASP A 72 7.118 -3.770 3.681 1.00 0.00 O ATOM 1060 OD2 ASP A 72 9.062 -3.235 2.836 1.00 0.00 O ATOM 0 H ASP A 72 8.840 -8.051 3.007 1.00 0.00 H new ATOM 0 HA ASP A 72 6.550 -6.229 3.210 1.00 0.00 H new ATOM 0 HB2 ASP A 72 9.004 -5.902 4.066 1.00 0.00 H new ATOM 0 HB3 ASP A 72 9.429 -5.691 2.379 1.00 0.00 H new ATOM 1065 N TYR A 73 7.208 -7.481 0.420 1.00 0.00 N ATOM 1066 CA TYR A 73 7.078 -7.513 -1.042 1.00 0.00 C ATOM 1067 C TYR A 73 5.999 -8.521 -1.464 1.00 0.00 C ATOM 1068 O TYR A 73 6.259 -9.714 -1.621 1.00 0.00 O ATOM 1069 CB TYR A 73 8.441 -7.820 -1.698 1.00 0.00 C ATOM 1070 CG TYR A 73 9.573 -6.933 -1.219 1.00 0.00 C ATOM 1071 CD1 TYR A 73 10.257 -7.285 -0.043 1.00 0.00 C ATOM 1072 CD2 TYR A 73 9.912 -5.747 -1.897 1.00 0.00 C ATOM 1073 CE1 TYR A 73 11.259 -6.459 0.479 1.00 0.00 C ATOM 1074 CE2 TYR A 73 10.887 -4.886 -1.356 1.00 0.00 C ATOM 1075 CZ TYR A 73 11.574 -5.244 -0.170 1.00 0.00 C ATOM 1076 OH TYR A 73 12.532 -4.426 0.351 1.00 0.00 O ATOM 0 H TYR A 73 7.394 -8.403 0.815 1.00 0.00 H new ATOM 0 HA TYR A 73 6.761 -6.530 -1.391 1.00 0.00 H new ATOM 0 HB2 TYR A 73 8.701 -8.860 -1.501 1.00 0.00 H new ATOM 0 HB3 TYR A 73 8.344 -7.715 -2.779 1.00 0.00 H new ATOM 0 HD1 TYR A 73 10.006 -8.205 0.465 1.00 0.00 H new ATOM 0 HD2 TYR A 73 9.426 -5.498 -2.829 1.00 0.00 H new ATOM 0 HE1 TYR A 73 11.789 -6.749 1.374 1.00 0.00 H new ATOM 0 HE2 TYR A 73 11.111 -3.950 -1.847 1.00 0.00 H new ATOM 0 HH TYR A 73 12.628 -3.632 -0.216 1.00 0.00 H new ATOM 1086 N ASP A 74 4.774 -8.032 -1.677 1.00 0.00 N ATOM 1087 CA ASP A 74 3.623 -8.824 -2.135 1.00 0.00 C ATOM 1088 C ASP A 74 3.903 -9.582 -3.444 1.00 0.00 C ATOM 1089 O ASP A 74 3.328 -10.644 -3.687 1.00 0.00 O ATOM 1090 CB ASP A 74 2.436 -7.879 -2.382 1.00 0.00 C ATOM 1091 CG ASP A 74 2.050 -7.043 -1.153 1.00 0.00 C ATOM 1092 OD1 ASP A 74 2.778 -6.072 -0.841 1.00 0.00 O ATOM 1093 OD2 ASP A 74 0.977 -7.310 -0.563 1.00 0.00 O ATOM 0 H ASP A 74 4.547 -7.048 -1.532 1.00 0.00 H new ATOM 0 HA ASP A 74 3.409 -9.558 -1.358 1.00 0.00 H new ATOM 0 HB2 ASP A 74 2.682 -7.208 -3.205 1.00 0.00 H new ATOM 0 HB3 ASP A 74 1.574 -8.467 -2.697 1.00 0.00 H new ATOM 1098 N VAL A 75 4.780 -9.028 -4.287 1.00 0.00 N ATOM 1099 CA VAL A 75 5.067 -9.509 -5.640 1.00 0.00 C ATOM 1100 C VAL A 75 6.551 -9.850 -5.775 1.00 0.00 C ATOM 1101 O VAL A 75 7.396 -8.963 -5.659 1.00 0.00 O ATOM 1102 CB VAL A 75 4.643 -8.440 -6.663 1.00 0.00 C ATOM 1103 CG1 VAL A 75 4.787 -8.970 -8.088 1.00 0.00 C ATOM 1104 CG2 VAL A 75 3.197 -7.962 -6.471 1.00 0.00 C ATOM 0 H VAL A 75 5.328 -8.205 -4.037 1.00 0.00 H new ATOM 0 HA VAL A 75 4.499 -10.419 -5.834 1.00 0.00 H new ATOM 0 HB VAL A 75 5.307 -7.592 -6.497 1.00 0.00 H new ATOM 0 HG11 VAL A 75 4.482 -8.199 -8.796 1.00 0.00 H new ATOM 0 HG12 VAL A 75 5.827 -9.241 -8.272 1.00 0.00 H new ATOM 0 HG13 VAL A 75 4.155 -9.849 -8.215 1.00 0.00 H new ATOM 0 HG21 VAL A 75 2.960 -7.209 -7.223 1.00 0.00 H new ATOM 0 HG22 VAL A 75 2.517 -8.807 -6.577 1.00 0.00 H new ATOM 0 HG23 VAL A 75 3.086 -7.529 -5.477 1.00 0.00 H new ATOM 1114 N VAL A 76 6.892 -11.110 -6.058 1.00 0.00 N ATOM 1115 CA VAL A 76 8.286 -11.565 -6.231 1.00 0.00 C ATOM 1116 C VAL A 76 8.435 -12.363 -7.523 1.00 0.00 C ATOM 1117 O VAL A 76 7.610 -13.223 -7.805 1.00 0.00 O ATOM 1118 CB VAL A 76 8.782 -12.392 -5.032 1.00 0.00 C ATOM 1119 CG1 VAL A 76 10.279 -12.703 -5.186 1.00 0.00 C ATOM 1120 CG2 VAL A 76 8.597 -11.656 -3.699 1.00 0.00 C ATOM 0 H VAL A 76 6.206 -11.855 -6.176 1.00 0.00 H new ATOM 0 HA VAL A 76 8.908 -10.672 -6.290 1.00 0.00 H new ATOM 0 HB VAL A 76 8.187 -13.305 -5.020 1.00 0.00 H new ATOM 0 HG11 VAL A 76 10.619 -13.289 -4.332 1.00 0.00 H new ATOM 0 HG12 VAL A 76 10.440 -13.271 -6.102 1.00 0.00 H new ATOM 0 HG13 VAL A 76 10.841 -11.770 -5.233 1.00 0.00 H new ATOM 0 HG21 VAL A 76 8.962 -12.281 -2.884 1.00 0.00 H new ATOM 0 HG22 VAL A 76 9.158 -10.721 -3.719 1.00 0.00 H new ATOM 0 HG23 VAL A 76 7.539 -11.441 -3.546 1.00 0.00 H new ATOM 1130 N ILE A 77 9.470 -12.104 -8.322 1.00 0.00 N ATOM 1131 CA ILE A 77 9.594 -12.673 -9.673 1.00 0.00 C ATOM 1132 C ILE A 77 10.957 -13.337 -9.876 1.00 0.00 C ATOM 1133 O ILE A 77 11.979 -12.713 -9.609 1.00 0.00 O ATOM 1134 CB ILE A 77 9.385 -11.567 -10.726 1.00 0.00 C ATOM 1135 CG1 ILE A 77 8.170 -10.643 -10.477 1.00 0.00 C ATOM 1136 CG2 ILE A 77 9.281 -12.185 -12.130 1.00 0.00 C ATOM 1137 CD1 ILE A 77 6.806 -11.346 -10.540 1.00 0.00 C ATOM 0 H ILE A 77 10.246 -11.497 -8.057 1.00 0.00 H new ATOM 0 HA ILE A 77 8.827 -13.439 -9.790 1.00 0.00 H new ATOM 0 HB ILE A 77 10.264 -10.928 -10.642 1.00 0.00 H new ATOM 0 HG12 ILE A 77 8.279 -10.178 -9.497 1.00 0.00 H new ATOM 0 HG13 ILE A 77 8.184 -9.840 -11.214 1.00 0.00 H new ATOM 0 HG21 ILE A 77 9.133 -11.394 -12.866 1.00 0.00 H new ATOM 0 HG22 ILE A 77 10.199 -12.726 -12.358 1.00 0.00 H new ATOM 0 HG23 ILE A 77 8.436 -12.873 -12.163 1.00 0.00 H new ATOM 0 HD11 ILE A 77 6.014 -10.621 -10.353 1.00 0.00 H new ATOM 0 HD12 ILE A 77 6.669 -11.787 -11.527 1.00 0.00 H new ATOM 0 HD13 ILE A 77 6.765 -12.130 -9.784 1.00 0.00 H new ATOM 1149 N SER A 78 10.981 -14.555 -10.418 1.00 0.00 N ATOM 1150 CA SER A 78 12.209 -15.217 -10.867 1.00 0.00 C ATOM 1151 C SER A 78 12.534 -14.851 -12.314 1.00 0.00 C ATOM 1152 O SER A 78 11.794 -15.191 -13.237 1.00 0.00 O ATOM 1153 CB SER A 78 12.077 -16.732 -10.737 1.00 0.00 C ATOM 1154 OG SER A 78 13.302 -17.335 -11.128 1.00 0.00 O ATOM 0 H SER A 78 10.141 -15.116 -10.560 1.00 0.00 H new ATOM 0 HA SER A 78 13.024 -14.872 -10.231 1.00 0.00 H new ATOM 0 HB2 SER A 78 11.835 -17.003 -9.709 1.00 0.00 H new ATOM 0 HB3 SER A 78 11.262 -17.095 -11.363 1.00 0.00 H new ATOM 0 HG SER A 78 13.228 -18.309 -11.047 1.00 0.00 H new ATOM 1160 N LEU A 79 13.676 -14.201 -12.538 1.00 0.00 N ATOM 1161 CA LEU A 79 14.240 -13.883 -13.862 1.00 0.00 C ATOM 1162 C LEU A 79 15.299 -14.940 -14.228 1.00 0.00 C ATOM 1163 O LEU A 79 16.337 -14.628 -14.804 1.00 0.00 O ATOM 1164 CB LEU A 79 14.739 -12.413 -13.870 1.00 0.00 C ATOM 1165 CG LEU A 79 13.681 -11.286 -13.903 1.00 0.00 C ATOM 1166 CD1 LEU A 79 12.413 -11.531 -13.108 1.00 0.00 C ATOM 1167 CD2 LEU A 79 14.323 -10.030 -13.358 1.00 0.00 C ATOM 0 H LEU A 79 14.262 -13.865 -11.774 1.00 0.00 H new ATOM 0 HA LEU A 79 13.488 -13.937 -14.649 1.00 0.00 H new ATOM 0 HB2 LEU A 79 15.356 -12.265 -12.984 1.00 0.00 H new ATOM 0 HB3 LEU A 79 15.389 -12.286 -14.736 1.00 0.00 H new ATOM 0 HG LEU A 79 13.367 -11.217 -14.945 1.00 0.00 H new ATOM 0 HD11 LEU A 79 11.749 -10.672 -13.208 1.00 0.00 H new ATOM 0 HD12 LEU A 79 11.913 -12.422 -13.487 1.00 0.00 H new ATOM 0 HD13 LEU A 79 12.664 -11.675 -12.057 1.00 0.00 H new ATOM 0 HD21 LEU A 79 13.598 -9.216 -13.369 1.00 0.00 H new ATOM 0 HD22 LEU A 79 14.655 -10.206 -12.335 1.00 0.00 H new ATOM 0 HD23 LEU A 79 15.179 -9.761 -13.976 1.00 0.00 H new ATOM 1179 N CYS A 80 15.046 -16.199 -13.857 1.00 0.00 N ATOM 1180 CA CYS A 80 15.923 -17.356 -14.065 1.00 0.00 C ATOM 1181 C CYS A 80 15.138 -18.580 -14.571 1.00 0.00 C ATOM 1182 O CYS A 80 13.998 -18.794 -14.165 1.00 0.00 O ATOM 1183 CB CYS A 80 16.617 -17.681 -12.727 1.00 0.00 C ATOM 1184 SG CYS A 80 18.022 -18.843 -12.805 1.00 0.00 S ATOM 0 H CYS A 80 14.181 -16.452 -13.380 1.00 0.00 H new ATOM 0 HA CYS A 80 16.661 -17.113 -14.829 1.00 0.00 H new ATOM 0 HB2 CYS A 80 16.969 -16.747 -12.289 1.00 0.00 H new ATOM 0 HB3 CYS A 80 15.871 -18.091 -12.046 1.00 0.00 H new ATOM 1189 N GLY A 81 15.756 -19.412 -15.421 1.00 0.00 N ATOM 1190 CA GLY A 81 15.209 -20.732 -15.795 1.00 0.00 C ATOM 1191 C GLY A 81 15.393 -21.790 -14.689 1.00 0.00 C ATOM 1192 O GLY A 81 14.720 -22.821 -14.696 1.00 0.00 O ATOM 0 H GLY A 81 16.646 -19.194 -15.869 1.00 0.00 H new ATOM 0 HA2 GLY A 81 14.148 -20.630 -16.021 1.00 0.00 H new ATOM 0 HA3 GLY A 81 15.697 -21.077 -16.707 1.00 0.00 H new ATOM 1196 N CYS A 82 16.284 -21.517 -13.725 1.00 0.00 N ATOM 1197 CA CYS A 82 16.640 -22.404 -12.616 1.00 0.00 C ATOM 1198 C CYS A 82 15.473 -22.711 -11.652 1.00 0.00 C ATOM 1199 O CYS A 82 15.154 -23.879 -11.435 1.00 0.00 O ATOM 1200 CB CYS A 82 17.866 -21.818 -11.888 1.00 0.00 C ATOM 1201 SG CYS A 82 17.792 -20.117 -11.211 1.00 0.00 S ATOM 0 H CYS A 82 16.796 -20.635 -13.699 1.00 0.00 H new ATOM 0 HA CYS A 82 16.892 -23.378 -13.035 1.00 0.00 H new ATOM 0 HB2 CYS A 82 18.105 -22.487 -11.062 1.00 0.00 H new ATOM 0 HB3 CYS A 82 18.706 -21.856 -12.582 1.00 0.00 H new ATOM 1206 N GLY A 83 14.839 -21.687 -11.065 1.00 0.00 N ATOM 1207 CA GLY A 83 13.717 -21.801 -10.111 1.00 0.00 C ATOM 1208 C GLY A 83 14.095 -22.364 -8.731 1.00 0.00 C ATOM 1209 O GLY A 83 13.969 -21.674 -7.718 1.00 0.00 O ATOM 0 H GLY A 83 15.100 -20.718 -11.246 1.00 0.00 H new ATOM 0 HA2 GLY A 83 13.273 -20.815 -9.976 1.00 0.00 H new ATOM 0 HA3 GLY A 83 12.950 -22.439 -10.550 1.00 0.00 H new ATOM 1213 N VAL A 84 14.609 -23.599 -8.686 1.00 0.00 N ATOM 1214 CA VAL A 84 14.863 -24.398 -7.464 1.00 0.00 C ATOM 1215 C VAL A 84 15.833 -23.770 -6.455 1.00 0.00 C ATOM 1216 O VAL A 84 15.809 -24.124 -5.277 1.00 0.00 O ATOM 1217 CB VAL A 84 15.382 -25.806 -7.818 1.00 0.00 C ATOM 1218 CG1 VAL A 84 14.300 -26.632 -8.522 1.00 0.00 C ATOM 1219 CG2 VAL A 84 16.650 -25.808 -8.682 1.00 0.00 C ATOM 0 H VAL A 84 14.874 -24.098 -9.535 1.00 0.00 H new ATOM 0 HA VAL A 84 13.888 -24.441 -6.979 1.00 0.00 H new ATOM 0 HB VAL A 84 15.643 -26.256 -6.860 1.00 0.00 H new ATOM 0 HG11 VAL A 84 14.694 -27.620 -8.760 1.00 0.00 H new ATOM 0 HG12 VAL A 84 13.436 -26.734 -7.866 1.00 0.00 H new ATOM 0 HG13 VAL A 84 14.000 -26.130 -9.442 1.00 0.00 H new ATOM 0 HG21 VAL A 84 16.949 -26.836 -8.886 1.00 0.00 H new ATOM 0 HG22 VAL A 84 16.450 -25.295 -9.622 1.00 0.00 H new ATOM 0 HG23 VAL A 84 17.452 -25.295 -8.152 1.00 0.00 H new ATOM 1229 N ASN A 85 16.684 -22.842 -6.899 1.00 0.00 N ATOM 1230 CA ASN A 85 17.664 -22.165 -6.048 1.00 0.00 C ATOM 1231 C ASN A 85 17.044 -21.066 -5.152 1.00 0.00 C ATOM 1232 O ASN A 85 17.713 -20.582 -4.237 1.00 0.00 O ATOM 1233 CB ASN A 85 18.787 -21.624 -6.951 1.00 0.00 C ATOM 1234 CG ASN A 85 19.584 -22.731 -7.626 1.00 0.00 C ATOM 1235 OD1 ASN A 85 19.344 -23.085 -8.770 1.00 0.00 O ATOM 1236 ND2 ASN A 85 20.538 -23.324 -6.939 1.00 0.00 N ATOM 0 H ASN A 85 16.712 -22.536 -7.872 1.00 0.00 H new ATOM 0 HA ASN A 85 18.073 -22.885 -5.340 1.00 0.00 H new ATOM 0 HB2 ASN A 85 18.354 -20.977 -7.714 1.00 0.00 H new ATOM 0 HB3 ASN A 85 19.461 -21.008 -6.356 1.00 0.00 H new ATOM 0 HD21 ASN A 85 21.077 -24.079 -7.362 1.00 0.00 H new ATOM 0 HD22 ASN A 85 20.738 -23.028 -5.984 1.00 0.00 H new ATOM 1243 N LEU A 86 15.779 -20.680 -5.382 1.00 0.00 N ATOM 1244 CA LEU A 86 15.017 -19.806 -4.477 1.00 0.00 C ATOM 1245 C LEU A 86 14.438 -20.616 -3.295 1.00 0.00 C ATOM 1246 O LEU A 86 13.877 -21.695 -3.522 1.00 0.00 O ATOM 1247 CB LEU A 86 13.886 -19.092 -5.246 1.00 0.00 C ATOM 1248 CG LEU A 86 14.333 -18.227 -6.440 1.00 0.00 C ATOM 1249 CD1 LEU A 86 13.109 -17.589 -7.093 1.00 0.00 C ATOM 1250 CD2 LEU A 86 15.262 -17.087 -6.024 1.00 0.00 C ATOM 0 H LEU A 86 15.253 -20.968 -6.207 1.00 0.00 H new ATOM 0 HA LEU A 86 15.695 -19.052 -4.076 1.00 0.00 H new ATOM 0 HB2 LEU A 86 13.186 -19.845 -5.608 1.00 0.00 H new ATOM 0 HB3 LEU A 86 13.339 -18.459 -4.547 1.00 0.00 H new ATOM 0 HG LEU A 86 14.866 -18.890 -7.122 1.00 0.00 H new ATOM 0 HD11 LEU A 86 13.425 -16.977 -7.938 1.00 0.00 H new ATOM 0 HD12 LEU A 86 12.435 -18.370 -7.443 1.00 0.00 H new ATOM 0 HD13 LEU A 86 12.593 -16.964 -6.365 1.00 0.00 H new ATOM 0 HD21 LEU A 86 15.546 -16.510 -6.904 1.00 0.00 H new ATOM 0 HD22 LEU A 86 14.747 -16.438 -5.315 1.00 0.00 H new ATOM 0 HD23 LEU A 86 16.156 -17.499 -5.556 1.00 0.00 H new ATOM 1262 N PRO A 87 14.517 -20.119 -2.042 1.00 0.00 N ATOM 1263 CA PRO A 87 13.891 -20.778 -0.894 1.00 0.00 C ATOM 1264 C PRO A 87 12.364 -20.584 -0.922 1.00 0.00 C ATOM 1265 O PRO A 87 11.891 -19.569 -1.442 1.00 0.00 O ATOM 1266 CB PRO A 87 14.546 -20.135 0.334 1.00 0.00 C ATOM 1267 CG PRO A 87 14.824 -18.708 -0.137 1.00 0.00 C ATOM 1268 CD PRO A 87 15.168 -18.883 -1.618 1.00 0.00 C ATOM 0 HA PRO A 87 14.040 -21.858 -0.893 1.00 0.00 H new ATOM 0 HB2 PRO A 87 13.885 -20.153 1.201 1.00 0.00 H new ATOM 0 HB3 PRO A 87 15.462 -20.652 0.621 1.00 0.00 H new ATOM 0 HG2 PRO A 87 13.956 -18.063 0.000 1.00 0.00 H new ATOM 0 HG3 PRO A 87 15.647 -18.256 0.416 1.00 0.00 H new ATOM 0 HD2 PRO A 87 14.813 -18.035 -2.203 1.00 0.00 H new ATOM 0 HD3 PRO A 87 16.247 -18.941 -1.763 1.00 0.00 H new ATOM 1276 N PRO A 88 11.568 -21.494 -0.322 1.00 0.00 N ATOM 1277 CA PRO A 88 10.104 -21.405 -0.339 1.00 0.00 C ATOM 1278 C PRO A 88 9.593 -20.108 0.308 1.00 0.00 C ATOM 1279 O PRO A 88 8.642 -19.512 -0.189 1.00 0.00 O ATOM 1280 CB PRO A 88 9.603 -22.664 0.383 1.00 0.00 C ATOM 1281 CG PRO A 88 10.787 -23.092 1.252 1.00 0.00 C ATOM 1282 CD PRO A 88 11.994 -22.680 0.413 1.00 0.00 C ATOM 0 HA PRO A 88 9.721 -21.364 -1.359 1.00 0.00 H new ATOM 0 HB2 PRO A 88 8.721 -22.452 0.987 1.00 0.00 H new ATOM 0 HB3 PRO A 88 9.325 -23.445 -0.324 1.00 0.00 H new ATOM 0 HG2 PRO A 88 10.779 -22.592 2.220 1.00 0.00 H new ATOM 0 HG3 PRO A 88 10.778 -24.164 1.447 1.00 0.00 H new ATOM 0 HD2 PRO A 88 12.856 -22.463 1.044 1.00 0.00 H new ATOM 0 HD3 PRO A 88 12.291 -23.478 -0.267 1.00 0.00 H new ATOM 1290 N GLU A 89 10.283 -19.608 1.340 1.00 0.00 N ATOM 1291 CA GLU A 89 9.991 -18.340 2.030 1.00 0.00 C ATOM 1292 C GLU A 89 9.791 -17.160 1.059 1.00 0.00 C ATOM 1293 O GLU A 89 8.835 -16.385 1.162 1.00 0.00 O ATOM 1294 CB GLU A 89 11.202 -18.032 2.933 1.00 0.00 C ATOM 1295 CG GLU A 89 10.924 -17.022 4.038 1.00 0.00 C ATOM 1296 CD GLU A 89 10.220 -17.675 5.242 1.00 0.00 C ATOM 1297 OE1 GLU A 89 8.966 -17.750 5.253 1.00 0.00 O ATOM 1298 OE2 GLU A 89 10.911 -18.121 6.191 1.00 0.00 O ATOM 0 H GLU A 89 11.090 -20.091 1.734 1.00 0.00 H new ATOM 0 HA GLU A 89 9.062 -18.454 2.588 1.00 0.00 H new ATOM 0 HB2 GLU A 89 11.547 -18.961 3.386 1.00 0.00 H new ATOM 0 HB3 GLU A 89 12.016 -17.658 2.312 1.00 0.00 H new ATOM 0 HG2 GLU A 89 11.862 -16.572 4.365 1.00 0.00 H new ATOM 0 HG3 GLU A 89 10.303 -16.216 3.647 1.00 0.00 H new ATOM 1305 N TRP A 90 10.694 -17.035 0.078 1.00 0.00 N ATOM 1306 CA TRP A 90 10.712 -15.951 -0.907 1.00 0.00 C ATOM 1307 C TRP A 90 9.904 -16.282 -2.183 1.00 0.00 C ATOM 1308 O TRP A 90 9.923 -15.516 -3.146 1.00 0.00 O ATOM 1309 CB TRP A 90 12.173 -15.554 -1.169 1.00 0.00 C ATOM 1310 CG TRP A 90 13.059 -15.218 0.011 1.00 0.00 C ATOM 1311 CD1 TRP A 90 14.400 -15.349 -0.032 1.00 0.00 C ATOM 1312 CD2 TRP A 90 12.785 -14.697 1.364 1.00 0.00 C ATOM 1313 NE1 TRP A 90 14.979 -14.848 1.111 1.00 0.00 N ATOM 1314 CE2 TRP A 90 14.031 -14.457 2.019 1.00 0.00 C ATOM 1315 CE3 TRP A 90 11.636 -14.415 2.134 1.00 0.00 C ATOM 1316 CZ2 TRP A 90 14.135 -13.949 3.321 1.00 0.00 C ATOM 1317 CZ3 TRP A 90 11.715 -13.910 3.447 1.00 0.00 C ATOM 1318 CH2 TRP A 90 12.963 -13.689 4.050 1.00 0.00 C ATOM 0 H TRP A 90 11.452 -17.705 -0.054 1.00 0.00 H new ATOM 0 HA TRP A 90 10.192 -15.082 -0.503 1.00 0.00 H new ATOM 0 HB2 TRP A 90 12.645 -16.372 -1.714 1.00 0.00 H new ATOM 0 HB3 TRP A 90 12.166 -14.690 -1.834 1.00 0.00 H new ATOM 0 HD1 TRP A 90 14.946 -15.788 -0.853 1.00 0.00 H new ATOM 0 HE1 TRP A 90 15.985 -14.777 1.263 1.00 0.00 H new ATOM 0 HE3 TRP A 90 10.662 -14.593 1.702 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 15.104 -13.760 3.758 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 10.809 -13.692 3.993 1.00 0.00 H new ATOM 0 HH2 TRP A 90 13.021 -13.323 5.064 1.00 0.00 H new ATOM 1329 N VAL A 91 9.165 -17.398 -2.179 1.00 0.00 N ATOM 1330 CA VAL A 91 8.325 -17.910 -3.276 1.00 0.00 C ATOM 1331 C VAL A 91 6.839 -17.909 -2.900 1.00 0.00 C ATOM 1332 O VAL A 91 6.006 -17.547 -3.725 1.00 0.00 O ATOM 1333 CB VAL A 91 8.806 -19.323 -3.682 1.00 0.00 C ATOM 1334 CG1 VAL A 91 7.822 -20.075 -4.586 1.00 0.00 C ATOM 1335 CG2 VAL A 91 10.160 -19.250 -4.400 1.00 0.00 C ATOM 0 H VAL A 91 9.134 -18.007 -1.361 1.00 0.00 H new ATOM 0 HA VAL A 91 8.429 -17.244 -4.133 1.00 0.00 H new ATOM 0 HB VAL A 91 8.889 -19.877 -2.747 1.00 0.00 H new ATOM 0 HG11 VAL A 91 8.228 -21.057 -4.828 1.00 0.00 H new ATOM 0 HG12 VAL A 91 6.870 -20.194 -4.068 1.00 0.00 H new ATOM 0 HG13 VAL A 91 7.667 -19.510 -5.505 1.00 0.00 H new ATOM 0 HG21 VAL A 91 10.480 -20.255 -4.677 1.00 0.00 H new ATOM 0 HG22 VAL A 91 10.063 -18.640 -5.298 1.00 0.00 H new ATOM 0 HG23 VAL A 91 10.900 -18.804 -3.736 1.00 0.00 H new ATOM 1345 N THR A 92 6.474 -18.240 -1.657 1.00 0.00 N ATOM 1346 CA THR A 92 5.070 -18.395 -1.205 1.00 0.00 C ATOM 1347 C THR A 92 4.360 -17.069 -0.856 1.00 0.00 C ATOM 1348 O THR A 92 3.420 -17.032 -0.059 1.00 0.00 O ATOM 1349 CB THR A 92 4.962 -19.432 -0.073 1.00 0.00 C ATOM 1350 OG1 THR A 92 5.763 -19.045 1.026 1.00 0.00 O ATOM 1351 CG2 THR A 92 5.415 -20.820 -0.545 1.00 0.00 C ATOM 0 H THR A 92 7.153 -18.413 -0.916 1.00 0.00 H new ATOM 0 HA THR A 92 4.523 -18.775 -2.068 1.00 0.00 H new ATOM 0 HB THR A 92 3.915 -19.480 0.226 1.00 0.00 H new ATOM 0 HG1 THR A 92 6.703 -19.246 0.833 1.00 0.00 H new ATOM 0 HG21 THR A 92 5.327 -21.530 0.277 1.00 0.00 H new ATOM 0 HG22 THR A 92 4.787 -21.145 -1.374 1.00 0.00 H new ATOM 0 HG23 THR A 92 6.453 -20.772 -0.873 1.00 0.00 H new ATOM 1359 N GLN A 93 4.795 -15.963 -1.471 1.00 0.00 N ATOM 1360 CA GLN A 93 4.176 -14.632 -1.366 1.00 0.00 C ATOM 1361 C GLN A 93 2.957 -14.491 -2.295 1.00 0.00 C ATOM 1362 O GLN A 93 2.696 -15.354 -3.136 1.00 0.00 O ATOM 1363 CB GLN A 93 5.249 -13.547 -1.590 1.00 0.00 C ATOM 1364 CG GLN A 93 6.450 -13.659 -0.631 1.00 0.00 C ATOM 1365 CD GLN A 93 6.070 -13.664 0.856 1.00 0.00 C ATOM 1366 OE1 GLN A 93 5.144 -12.998 1.301 1.00 0.00 O ATOM 1367 NE2 GLN A 93 6.752 -14.429 1.687 1.00 0.00 N ATOM 0 H GLN A 93 5.616 -15.968 -2.077 1.00 0.00 H new ATOM 0 HA GLN A 93 3.778 -14.498 -0.360 1.00 0.00 H new ATOM 0 HB2 GLN A 93 5.608 -13.610 -2.617 1.00 0.00 H new ATOM 0 HB3 GLN A 93 4.791 -12.565 -1.472 1.00 0.00 H new ATOM 0 HG2 GLN A 93 6.997 -14.574 -0.858 1.00 0.00 H new ATOM 0 HG3 GLN A 93 7.129 -12.827 -0.818 1.00 0.00 H new ATOM 0 HE21 GLN A 93 7.528 -14.993 1.341 1.00 0.00 H new ATOM 0 HE22 GLN A 93 6.503 -14.456 2.676 1.00 0.00 H new ATOM 1376 N GLU A 94 2.189 -13.410 -2.124 1.00 0.00 N ATOM 1377 CA GLU A 94 0.874 -13.223 -2.759 1.00 0.00 C ATOM 1378 C GLU A 94 0.880 -13.391 -4.292 1.00 0.00 C ATOM 1379 O GLU A 94 -0.008 -14.049 -4.844 1.00 0.00 O ATOM 1380 CB GLU A 94 0.327 -11.844 -2.360 1.00 0.00 C ATOM 1381 CG GLU A 94 -1.161 -11.734 -2.693 1.00 0.00 C ATOM 1382 CD GLU A 94 -1.715 -10.351 -2.303 1.00 0.00 C ATOM 1383 OE1 GLU A 94 -1.577 -9.394 -3.103 1.00 0.00 O ATOM 1384 OE2 GLU A 94 -2.291 -10.203 -1.199 1.00 0.00 O ATOM 0 H GLU A 94 2.465 -12.627 -1.532 1.00 0.00 H new ATOM 0 HA GLU A 94 0.224 -14.018 -2.395 1.00 0.00 H new ATOM 0 HB2 GLU A 94 0.478 -11.682 -1.293 1.00 0.00 H new ATOM 0 HB3 GLU A 94 0.880 -11.063 -2.882 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -1.312 -11.902 -3.759 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -1.713 -12.512 -2.166 1.00 0.00 H new ATOM 1391 N ILE A 95 1.901 -12.854 -4.972 1.00 0.00 N ATOM 1392 CA ILE A 95 2.173 -13.094 -6.396 1.00 0.00 C ATOM 1393 C ILE A 95 3.615 -13.591 -6.562 1.00 0.00 C ATOM 1394 O ILE A 95 4.564 -12.898 -6.184 1.00 0.00 O ATOM 1395 CB ILE A 95 1.895 -11.833 -7.249 1.00 0.00 C ATOM 1396 CG1 ILE A 95 0.411 -11.407 -7.136 1.00 0.00 C ATOM 1397 CG2 ILE A 95 2.280 -12.072 -8.725 1.00 0.00 C ATOM 1398 CD1 ILE A 95 0.014 -10.175 -7.961 1.00 0.00 C ATOM 0 H ILE A 95 2.577 -12.226 -4.538 1.00 0.00 H new ATOM 0 HA ILE A 95 1.495 -13.865 -6.761 1.00 0.00 H new ATOM 0 HB ILE A 95 2.513 -11.023 -6.862 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -0.214 -12.245 -7.443 1.00 0.00 H new ATOM 0 HG13 ILE A 95 0.186 -11.209 -6.088 1.00 0.00 H new ATOM 0 HG21 ILE A 95 2.076 -11.172 -9.305 1.00 0.00 H new ATOM 0 HG22 ILE A 95 3.341 -12.312 -8.790 1.00 0.00 H new ATOM 0 HG23 ILE A 95 1.695 -12.901 -9.124 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -1.044 -9.962 -7.811 1.00 0.00 H new ATOM 0 HD12 ILE A 95 0.606 -9.317 -7.641 1.00 0.00 H new ATOM 0 HD13 ILE A 95 0.199 -10.370 -9.017 1.00 0.00 H new ATOM 1410 N PHE A 96 3.777 -14.766 -7.180 1.00 0.00 N ATOM 1411 CA PHE A 96 5.072 -15.288 -7.620 1.00 0.00 C ATOM 1412 C PHE A 96 5.001 -15.828 -9.055 1.00 0.00 C ATOM 1413 O PHE A 96 4.057 -16.539 -9.412 1.00 0.00 O ATOM 1414 CB PHE A 96 5.644 -16.305 -6.622 1.00 0.00 C ATOM 1415 CG PHE A 96 6.971 -16.889 -7.072 1.00 0.00 C ATOM 1416 CD1 PHE A 96 8.176 -16.219 -6.790 1.00 0.00 C ATOM 1417 CD2 PHE A 96 6.994 -18.072 -7.833 1.00 0.00 C ATOM 1418 CE1 PHE A 96 9.394 -16.714 -7.288 1.00 0.00 C ATOM 1419 CE2 PHE A 96 8.211 -18.570 -8.327 1.00 0.00 C ATOM 1420 CZ PHE A 96 9.409 -17.888 -8.062 1.00 0.00 C ATOM 0 H PHE A 96 2.998 -15.390 -7.391 1.00 0.00 H new ATOM 0 HA PHE A 96 5.777 -14.457 -7.640 1.00 0.00 H new ATOM 0 HB2 PHE A 96 5.774 -15.823 -5.653 1.00 0.00 H new ATOM 0 HB3 PHE A 96 4.926 -17.113 -6.482 1.00 0.00 H new ATOM 0 HD1 PHE A 96 8.165 -15.322 -6.189 1.00 0.00 H new ATOM 0 HD2 PHE A 96 6.074 -18.599 -8.038 1.00 0.00 H new ATOM 0 HE1 PHE A 96 10.316 -16.194 -7.077 1.00 0.00 H new ATOM 0 HE2 PHE A 96 8.225 -19.478 -8.911 1.00 0.00 H new ATOM 0 HZ PHE A 96 10.343 -18.265 -8.453 1.00 0.00 H new ATOM 1430 N GLU A 97 5.997 -15.486 -9.879 1.00 0.00 N ATOM 1431 CA GLU A 97 6.055 -15.827 -11.311 1.00 0.00 C ATOM 1432 C GLU A 97 7.484 -16.160 -11.778 1.00 0.00 C ATOM 1433 O GLU A 97 8.464 -15.632 -11.247 1.00 0.00 O ATOM 1434 CB GLU A 97 5.520 -14.661 -12.167 1.00 0.00 C ATOM 1435 CG GLU A 97 4.050 -14.274 -11.939 1.00 0.00 C ATOM 1436 CD GLU A 97 3.041 -15.389 -12.297 1.00 0.00 C ATOM 1437 OE1 GLU A 97 3.373 -16.323 -13.072 1.00 0.00 O ATOM 1438 OE2 GLU A 97 1.871 -15.303 -11.849 1.00 0.00 O ATOM 0 H GLU A 97 6.807 -14.951 -9.564 1.00 0.00 H new ATOM 0 HA GLU A 97 5.433 -16.713 -11.442 1.00 0.00 H new ATOM 0 HB2 GLU A 97 6.139 -13.784 -11.978 1.00 0.00 H new ATOM 0 HB3 GLU A 97 5.648 -14.920 -13.218 1.00 0.00 H new ATOM 0 HG2 GLU A 97 3.916 -14.000 -10.893 1.00 0.00 H new ATOM 0 HG3 GLU A 97 3.822 -13.389 -12.532 1.00 0.00 H new ATOM 1445 N ASP A 98 7.598 -16.982 -12.827 1.00 0.00 N ATOM 1446 CA ASP A 98 8.857 -17.337 -13.493 1.00 0.00 C ATOM 1447 C ASP A 98 8.903 -16.779 -14.926 1.00 0.00 C ATOM 1448 O ASP A 98 8.014 -17.048 -15.735 1.00 0.00 O ATOM 1449 CB ASP A 98 9.037 -18.865 -13.528 1.00 0.00 C ATOM 1450 CG ASP A 98 9.100 -19.511 -12.132 1.00 0.00 C ATOM 1451 OD1 ASP A 98 10.194 -19.506 -11.517 1.00 0.00 O ATOM 1452 OD2 ASP A 98 8.074 -20.076 -11.680 1.00 0.00 O ATOM 0 H ASP A 98 6.788 -17.434 -13.251 1.00 0.00 H new ATOM 0 HA ASP A 98 9.671 -16.892 -12.920 1.00 0.00 H new ATOM 0 HB2 ASP A 98 8.212 -19.307 -14.087 1.00 0.00 H new ATOM 0 HB3 ASP A 98 9.952 -19.102 -14.070 1.00 0.00 H new ATOM 1457 N TRP A 99 9.956 -16.023 -15.260 1.00 0.00 N ATOM 1458 CA TRP A 99 10.183 -15.452 -16.603 1.00 0.00 C ATOM 1459 C TRP A 99 11.203 -16.227 -17.457 1.00 0.00 C ATOM 1460 O TRP A 99 11.402 -15.877 -18.615 1.00 0.00 O ATOM 1461 CB TRP A 99 10.605 -13.984 -16.463 1.00 0.00 C ATOM 1462 CG TRP A 99 9.599 -12.992 -15.967 1.00 0.00 C ATOM 1463 CD1 TRP A 99 8.351 -13.226 -15.492 1.00 0.00 C ATOM 1464 CD2 TRP A 99 9.796 -11.556 -15.854 1.00 0.00 C ATOM 1465 NE1 TRP A 99 7.761 -12.026 -15.137 1.00 0.00 N ATOM 1466 CE2 TRP A 99 8.635 -10.973 -15.282 1.00 0.00 C ATOM 1467 CE3 TRP A 99 10.879 -10.702 -16.135 1.00 0.00 C ATOM 1468 CZ2 TRP A 99 8.580 -9.622 -14.926 1.00 0.00 C ATOM 1469 CZ3 TRP A 99 10.847 -9.342 -15.774 1.00 0.00 C ATOM 1470 CH2 TRP A 99 9.713 -8.815 -15.137 1.00 0.00 C ATOM 0 H TRP A 99 10.691 -15.784 -14.595 1.00 0.00 H new ATOM 0 HA TRP A 99 9.238 -15.533 -17.140 1.00 0.00 H new ATOM 0 HB2 TRP A 99 11.463 -13.949 -15.791 1.00 0.00 H new ATOM 0 HB3 TRP A 99 10.951 -13.645 -17.439 1.00 0.00 H new ATOM 0 HD1 TRP A 99 7.889 -14.198 -15.404 1.00 0.00 H new ATOM 0 HE1 TRP A 99 6.800 -11.933 -14.809 1.00 0.00 H new ATOM 0 HE3 TRP A 99 11.750 -11.097 -16.637 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 7.682 -9.204 -14.496 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 11.693 -8.705 -15.987 1.00 0.00 H new ATOM 0 HH2 TRP A 99 9.710 -7.786 -14.808 1.00 0.00 H new ATOM 1481 N GLN A 100 11.877 -17.251 -16.911 1.00 0.00 N ATOM 1482 CA GLN A 100 12.860 -18.121 -17.595 1.00 0.00 C ATOM 1483 C GLN A 100 13.988 -17.409 -18.386 1.00 0.00 C ATOM 1484 O GLN A 100 14.481 -17.926 -19.386 1.00 0.00 O ATOM 1485 CB GLN A 100 12.163 -19.313 -18.300 1.00 0.00 C ATOM 1486 CG GLN A 100 11.111 -19.027 -19.388 1.00 0.00 C ATOM 1487 CD GLN A 100 11.680 -18.577 -20.736 1.00 0.00 C ATOM 1488 OE1 GLN A 100 12.072 -19.382 -21.572 1.00 0.00 O ATOM 1489 NE2 GLN A 100 11.715 -17.293 -21.023 1.00 0.00 N ATOM 0 H GLN A 100 11.749 -17.512 -15.933 1.00 0.00 H new ATOM 0 HA GLN A 100 13.468 -18.559 -16.803 1.00 0.00 H new ATOM 0 HB2 GLN A 100 12.941 -19.930 -18.749 1.00 0.00 H new ATOM 0 HB3 GLN A 100 11.683 -19.916 -17.529 1.00 0.00 H new ATOM 0 HG2 GLN A 100 10.517 -19.928 -19.544 1.00 0.00 H new ATOM 0 HG3 GLN A 100 10.432 -18.257 -19.022 1.00 0.00 H new ATOM 0 HE21 GLN A 100 11.393 -16.609 -20.339 1.00 0.00 H new ATOM 0 HE22 GLN A 100 12.065 -16.982 -21.930 1.00 0.00 H new ATOM 1498 N LEU A 101 14.421 -16.223 -17.926 1.00 0.00 N ATOM 1499 CA LEU A 101 15.452 -15.410 -18.596 1.00 0.00 C ATOM 1500 C LEU A 101 16.884 -15.948 -18.407 1.00 0.00 C ATOM 1501 O LEU A 101 17.218 -16.537 -17.378 1.00 0.00 O ATOM 1502 CB LEU A 101 15.377 -13.933 -18.145 1.00 0.00 C ATOM 1503 CG LEU A 101 14.058 -13.179 -18.393 1.00 0.00 C ATOM 1504 CD1 LEU A 101 14.285 -11.704 -18.091 1.00 0.00 C ATOM 1505 CD2 LEU A 101 13.572 -13.276 -19.831 1.00 0.00 C ATOM 0 H LEU A 101 14.062 -15.797 -17.071 1.00 0.00 H new ATOM 0 HA LEU A 101 15.230 -15.477 -19.661 1.00 0.00 H new ATOM 0 HB2 LEU A 101 15.589 -13.897 -17.076 1.00 0.00 H new ATOM 0 HB3 LEU A 101 16.176 -13.387 -18.647 1.00 0.00 H new ATOM 0 HG LEU A 101 13.305 -13.635 -17.750 1.00 0.00 H new ATOM 0 HD11 LEU A 101 13.361 -11.151 -18.261 1.00 0.00 H new ATOM 0 HD12 LEU A 101 14.591 -11.588 -17.051 1.00 0.00 H new ATOM 0 HD13 LEU A 101 15.066 -11.315 -18.744 1.00 0.00 H new ATOM 0 HD21 LEU A 101 12.639 -12.723 -19.938 1.00 0.00 H new ATOM 0 HD22 LEU A 101 14.323 -12.852 -20.498 1.00 0.00 H new ATOM 0 HD23 LEU A 101 13.406 -14.322 -20.089 1.00 0.00 H new ATOM 1517 N GLU A 102 17.746 -15.666 -19.385 1.00 0.00 N ATOM 1518 CA GLU A 102 19.176 -16.026 -19.431 1.00 0.00 C ATOM 1519 C GLU A 102 20.074 -14.972 -18.744 1.00 0.00 C ATOM 1520 O GLU A 102 19.661 -13.825 -18.579 1.00 0.00 O ATOM 1521 CB GLU A 102 19.532 -16.215 -20.921 1.00 0.00 C ATOM 1522 CG GLU A 102 20.956 -16.707 -21.231 1.00 0.00 C ATOM 1523 CD GLU A 102 21.282 -18.038 -20.523 1.00 0.00 C ATOM 1524 OE1 GLU A 102 21.702 -18.006 -19.341 1.00 0.00 O ATOM 1525 OE2 GLU A 102 21.108 -19.114 -21.144 1.00 0.00 O ATOM 0 H GLU A 102 17.455 -15.151 -20.216 1.00 0.00 H new ATOM 0 HA GLU A 102 19.356 -16.944 -18.872 1.00 0.00 H new ATOM 0 HB2 GLU A 102 18.825 -16.923 -21.353 1.00 0.00 H new ATOM 0 HB3 GLU A 102 19.382 -15.263 -21.431 1.00 0.00 H new ATOM 0 HG2 GLU A 102 21.068 -16.834 -22.308 1.00 0.00 H new ATOM 0 HG3 GLU A 102 21.675 -15.948 -20.923 1.00 0.00 H new ATOM 1532 N ASP A 103 21.306 -15.329 -18.361 1.00 0.00 N ATOM 1533 CA ASP A 103 22.319 -14.366 -17.897 1.00 0.00 C ATOM 1534 C ASP A 103 23.118 -13.773 -19.081 1.00 0.00 C ATOM 1535 O ASP A 103 23.827 -14.514 -19.769 1.00 0.00 O ATOM 1536 CB ASP A 103 23.242 -14.980 -16.831 1.00 0.00 C ATOM 1537 CG ASP A 103 23.681 -13.918 -15.816 1.00 0.00 C ATOM 1538 OD1 ASP A 103 22.878 -13.637 -14.898 1.00 0.00 O ATOM 1539 OD2 ASP A 103 24.796 -13.370 -15.938 1.00 0.00 O ATOM 0 H ASP A 103 21.632 -16.296 -18.363 1.00 0.00 H new ATOM 0 HA ASP A 103 21.791 -13.541 -17.420 1.00 0.00 H new ATOM 0 HB2 ASP A 103 22.724 -15.789 -16.317 1.00 0.00 H new ATOM 0 HB3 ASP A 103 24.118 -15.417 -17.310 1.00 0.00 H new ATOM 1544 N PRO A 104 23.016 -12.455 -19.356 1.00 0.00 N ATOM 1545 CA PRO A 104 23.580 -11.858 -20.572 1.00 0.00 C ATOM 1546 C PRO A 104 25.081 -11.519 -20.490 1.00 0.00 C ATOM 1547 O PRO A 104 25.706 -11.261 -21.518 1.00 0.00 O ATOM 1548 CB PRO A 104 22.736 -10.607 -20.787 1.00 0.00 C ATOM 1549 CG PRO A 104 22.453 -10.142 -19.358 1.00 0.00 C ATOM 1550 CD PRO A 104 22.184 -11.475 -18.660 1.00 0.00 C ATOM 0 HA PRO A 104 23.540 -12.566 -21.400 1.00 0.00 H new ATOM 0 HB2 PRO A 104 23.272 -9.851 -21.360 1.00 0.00 H new ATOM 0 HB3 PRO A 104 21.817 -10.827 -21.331 1.00 0.00 H new ATOM 0 HG2 PRO A 104 23.300 -9.613 -18.922 1.00 0.00 H new ATOM 0 HG3 PRO A 104 21.596 -9.470 -19.306 1.00 0.00 H new ATOM 0 HD2 PRO A 104 22.441 -11.423 -17.602 1.00 0.00 H new ATOM 0 HD3 PRO A 104 21.129 -11.743 -18.719 1.00 0.00 H new ATOM 1558 N ASP A 105 25.666 -11.521 -19.288 1.00 0.00 N ATOM 1559 CA ASP A 105 27.075 -11.231 -19.003 1.00 0.00 C ATOM 1560 C ASP A 105 28.053 -11.910 -19.980 1.00 0.00 C ATOM 1561 O ASP A 105 28.178 -13.138 -20.013 1.00 0.00 O ATOM 1562 CB ASP A 105 27.354 -11.678 -17.563 1.00 0.00 C ATOM 1563 CG ASP A 105 28.837 -11.604 -17.173 1.00 0.00 C ATOM 1564 OD1 ASP A 105 29.507 -10.601 -17.515 1.00 0.00 O ATOM 1565 OD2 ASP A 105 29.307 -12.541 -16.484 1.00 0.00 O ATOM 0 H ASP A 105 25.140 -11.737 -18.441 1.00 0.00 H new ATOM 0 HA ASP A 105 27.240 -10.161 -19.130 1.00 0.00 H new ATOM 0 HB2 ASP A 105 26.776 -11.056 -16.880 1.00 0.00 H new ATOM 0 HB3 ASP A 105 27.004 -12.702 -17.435 1.00 0.00 H new ATOM 1570 N GLY A 106 28.752 -11.093 -20.777 1.00 0.00 N ATOM 1571 CA GLY A 106 29.826 -11.535 -21.673 1.00 0.00 C ATOM 1572 C GLY A 106 29.387 -12.369 -22.883 1.00 0.00 C ATOM 1573 O GLY A 106 30.250 -12.880 -23.601 1.00 0.00 O ATOM 0 H GLY A 106 28.583 -10.088 -20.818 1.00 0.00 H new ATOM 0 HA2 GLY A 106 30.356 -10.654 -22.036 1.00 0.00 H new ATOM 0 HA3 GLY A 106 30.540 -12.120 -21.093 1.00 0.00 H new ATOM 1577 N GLN A 107 28.077 -12.528 -23.120 1.00 0.00 N ATOM 1578 CA GLN A 107 27.562 -13.346 -24.227 1.00 0.00 C ATOM 1579 C GLN A 107 27.664 -12.588 -25.563 1.00 0.00 C ATOM 1580 O GLN A 107 28.409 -12.986 -26.461 1.00 0.00 O ATOM 1581 CB GLN A 107 26.128 -13.835 -23.928 1.00 0.00 C ATOM 1582 CG GLN A 107 25.972 -14.591 -22.595 1.00 0.00 C ATOM 1583 CD GLN A 107 26.977 -15.727 -22.415 1.00 0.00 C ATOM 1584 OE1 GLN A 107 26.935 -16.747 -23.091 1.00 0.00 O ATOM 1585 NE2 GLN A 107 27.928 -15.595 -21.513 1.00 0.00 N ATOM 0 H GLN A 107 27.348 -12.095 -22.553 1.00 0.00 H new ATOM 0 HA GLN A 107 28.184 -14.236 -24.323 1.00 0.00 H new ATOM 0 HB2 GLN A 107 25.459 -12.975 -23.923 1.00 0.00 H new ATOM 0 HB3 GLN A 107 25.804 -14.486 -24.740 1.00 0.00 H new ATOM 0 HG2 GLN A 107 26.083 -13.885 -21.772 1.00 0.00 H new ATOM 0 HG3 GLN A 107 24.962 -14.997 -22.533 1.00 0.00 H new ATOM 0 HE21 GLN A 107 27.976 -14.751 -20.942 1.00 0.00 H new ATOM 0 HE22 GLN A 107 28.616 -16.337 -21.385 1.00 0.00 H new ATOM 1594 N SER A 108 26.933 -11.473 -25.663 1.00 0.00 N ATOM 1595 CA SER A 108 26.993 -10.456 -26.728 1.00 0.00 C ATOM 1596 C SER A 108 26.081 -9.293 -26.352 1.00 0.00 C ATOM 1597 O SER A 108 25.059 -9.505 -25.696 1.00 0.00 O ATOM 1598 CB SER A 108 26.539 -11.048 -28.074 1.00 0.00 C ATOM 1599 OG SER A 108 26.380 -10.034 -29.057 1.00 0.00 O ATOM 0 H SER A 108 26.236 -11.238 -24.957 1.00 0.00 H new ATOM 0 HA SER A 108 28.022 -10.112 -26.832 1.00 0.00 H new ATOM 0 HB2 SER A 108 27.271 -11.779 -28.418 1.00 0.00 H new ATOM 0 HB3 SER A 108 25.597 -11.579 -27.941 1.00 0.00 H new ATOM 0 HG SER A 108 26.093 -10.439 -29.902 1.00 0.00 H new ATOM 1605 N LEU A 109 26.371 -8.078 -26.823 1.00 0.00 N ATOM 1606 CA LEU A 109 25.461 -6.934 -26.663 1.00 0.00 C ATOM 1607 C LEU A 109 24.104 -7.204 -27.327 1.00 0.00 C ATOM 1608 O LEU A 109 23.083 -6.785 -26.803 1.00 0.00 O ATOM 1609 CB LEU A 109 26.116 -5.643 -27.198 1.00 0.00 C ATOM 1610 CG LEU A 109 27.064 -4.972 -26.184 1.00 0.00 C ATOM 1611 CD1 LEU A 109 28.380 -5.725 -25.977 1.00 0.00 C ATOM 1612 CD2 LEU A 109 27.405 -3.547 -26.624 1.00 0.00 C ATOM 0 H LEU A 109 27.233 -7.857 -27.321 1.00 0.00 H new ATOM 0 HA LEU A 109 25.271 -6.793 -25.599 1.00 0.00 H new ATOM 0 HB2 LEU A 109 26.673 -5.876 -28.106 1.00 0.00 H new ATOM 0 HB3 LEU A 109 25.334 -4.936 -27.476 1.00 0.00 H new ATOM 0 HG LEU A 109 26.519 -4.977 -25.240 1.00 0.00 H new ATOM 0 HD11 LEU A 109 28.994 -5.192 -25.251 1.00 0.00 H new ATOM 0 HD12 LEU A 109 28.171 -6.729 -25.608 1.00 0.00 H new ATOM 0 HD13 LEU A 109 28.915 -5.791 -26.925 1.00 0.00 H new ATOM 0 HD21 LEU A 109 28.075 -3.092 -25.895 1.00 0.00 H new ATOM 0 HD22 LEU A 109 27.893 -3.574 -27.598 1.00 0.00 H new ATOM 0 HD23 LEU A 109 26.490 -2.959 -26.693 1.00 0.00 H new ATOM 1624 N GLU A 110 24.052 -8.003 -28.392 1.00 0.00 N ATOM 1625 CA GLU A 110 22.794 -8.442 -29.017 1.00 0.00 C ATOM 1626 C GLU A 110 21.934 -9.294 -28.071 1.00 0.00 C ATOM 1627 O GLU A 110 20.722 -9.106 -27.981 1.00 0.00 O ATOM 1628 CB GLU A 110 23.151 -9.240 -30.275 1.00 0.00 C ATOM 1629 CG GLU A 110 21.931 -9.504 -31.164 1.00 0.00 C ATOM 1630 CD GLU A 110 22.339 -10.241 -32.454 1.00 0.00 C ATOM 1631 OE1 GLU A 110 22.407 -11.497 -32.444 1.00 0.00 O ATOM 1632 OE2 GLU A 110 22.594 -9.575 -33.488 1.00 0.00 O ATOM 0 H GLU A 110 24.885 -8.369 -28.853 1.00 0.00 H new ATOM 0 HA GLU A 110 22.197 -7.564 -29.265 1.00 0.00 H new ATOM 0 HB2 GLU A 110 23.903 -8.696 -30.846 1.00 0.00 H new ATOM 0 HB3 GLU A 110 23.598 -10.191 -29.984 1.00 0.00 H new ATOM 0 HG2 GLU A 110 21.199 -10.098 -30.617 1.00 0.00 H new ATOM 0 HG3 GLU A 110 21.449 -8.560 -31.417 1.00 0.00 H new ATOM 1639 N VAL A 111 22.566 -10.178 -27.292 1.00 0.00 N ATOM 1640 CA VAL A 111 21.893 -10.995 -26.260 1.00 0.00 C ATOM 1641 C VAL A 111 21.487 -10.109 -25.085 1.00 0.00 C ATOM 1642 O VAL A 111 20.391 -10.250 -24.547 1.00 0.00 O ATOM 1643 CB VAL A 111 22.791 -12.167 -25.805 1.00 0.00 C ATOM 1644 CG1 VAL A 111 22.172 -12.985 -24.666 1.00 0.00 C ATOM 1645 CG2 VAL A 111 23.052 -13.135 -26.966 1.00 0.00 C ATOM 0 H VAL A 111 23.569 -10.353 -27.356 1.00 0.00 H new ATOM 0 HA VAL A 111 20.992 -11.433 -26.688 1.00 0.00 H new ATOM 0 HB VAL A 111 23.715 -11.707 -25.455 1.00 0.00 H new ATOM 0 HG11 VAL A 111 22.848 -13.794 -24.390 1.00 0.00 H new ATOM 0 HG12 VAL A 111 22.006 -12.340 -23.803 1.00 0.00 H new ATOM 0 HG13 VAL A 111 21.221 -13.404 -24.994 1.00 0.00 H new ATOM 0 HG21 VAL A 111 23.686 -13.952 -26.623 1.00 0.00 H new ATOM 0 HG22 VAL A 111 22.104 -13.537 -27.325 1.00 0.00 H new ATOM 0 HG23 VAL A 111 23.551 -12.604 -27.777 1.00 0.00 H new ATOM 1655 N PHE A 112 22.324 -9.128 -24.744 1.00 0.00 N ATOM 1656 CA PHE A 112 22.066 -8.171 -23.663 1.00 0.00 C ATOM 1657 C PHE A 112 20.859 -7.268 -23.978 1.00 0.00 C ATOM 1658 O PHE A 112 19.976 -7.090 -23.140 1.00 0.00 O ATOM 1659 CB PHE A 112 23.368 -7.398 -23.369 1.00 0.00 C ATOM 1660 CG PHE A 112 23.695 -7.251 -21.898 1.00 0.00 C ATOM 1661 CD1 PHE A 112 22.807 -6.595 -21.029 1.00 0.00 C ATOM 1662 CD2 PHE A 112 24.867 -7.841 -21.391 1.00 0.00 C ATOM 1663 CE1 PHE A 112 23.097 -6.528 -19.656 1.00 0.00 C ATOM 1664 CE2 PHE A 112 25.150 -7.773 -20.020 1.00 0.00 C ATOM 1665 CZ PHE A 112 24.283 -7.094 -19.153 1.00 0.00 C ATOM 0 H PHE A 112 23.214 -8.972 -25.217 1.00 0.00 H new ATOM 0 HA PHE A 112 21.780 -8.698 -22.753 1.00 0.00 H new ATOM 0 HB2 PHE A 112 24.196 -7.906 -23.863 1.00 0.00 H new ATOM 0 HB3 PHE A 112 23.294 -6.405 -23.812 1.00 0.00 H new ATOM 0 HD1 PHE A 112 21.905 -6.144 -21.415 1.00 0.00 H new ATOM 0 HD2 PHE A 112 25.549 -8.347 -22.058 1.00 0.00 H new ATOM 0 HE1 PHE A 112 22.407 -6.040 -18.984 1.00 0.00 H new ATOM 0 HE2 PHE A 112 26.039 -8.246 -19.630 1.00 0.00 H new ATOM 0 HZ PHE A 112 24.524 -7.006 -18.104 1.00 0.00 H new ATOM 1675 N ARG A 113 20.740 -6.791 -25.224 1.00 0.00 N ATOM 1676 CA ARG A 113 19.547 -6.071 -25.715 1.00 0.00 C ATOM 1677 C ARG A 113 18.337 -7.000 -25.864 1.00 0.00 C ATOM 1678 O ARG A 113 17.240 -6.610 -25.486 1.00 0.00 O ATOM 1679 CB ARG A 113 19.870 -5.325 -27.027 1.00 0.00 C ATOM 1680 CG ARG A 113 20.944 -4.242 -26.830 1.00 0.00 C ATOM 1681 CD ARG A 113 21.130 -3.402 -28.099 1.00 0.00 C ATOM 1682 NE ARG A 113 22.225 -2.416 -27.955 1.00 0.00 N ATOM 1683 CZ ARG A 113 23.295 -2.287 -28.722 1.00 0.00 C ATOM 1684 NH1 ARG A 113 23.593 -3.131 -29.671 1.00 0.00 N ATOM 1685 NH2 ARG A 113 24.097 -1.285 -28.541 1.00 0.00 N ATOM 0 H ARG A 113 21.471 -6.892 -25.928 1.00 0.00 H new ATOM 0 HA ARG A 113 19.270 -5.328 -24.967 1.00 0.00 H new ATOM 0 HB2 ARG A 113 20.211 -6.040 -27.775 1.00 0.00 H new ATOM 0 HB3 ARG A 113 18.961 -4.866 -27.415 1.00 0.00 H new ATOM 0 HG2 ARG A 113 20.661 -3.594 -26.001 1.00 0.00 H new ATOM 0 HG3 ARG A 113 21.890 -4.711 -26.560 1.00 0.00 H new ATOM 0 HD2 ARG A 113 21.343 -4.060 -28.942 1.00 0.00 H new ATOM 0 HD3 ARG A 113 20.201 -2.881 -28.328 1.00 0.00 H new ATOM 0 HE ARG A 113 22.145 -1.762 -27.176 1.00 0.00 H new ATOM 0 HH11 ARG A 113 22.989 -3.934 -29.848 1.00 0.00 H new ATOM 0 HH12 ARG A 113 24.430 -2.988 -30.236 1.00 0.00 H new ATOM 0 HH21 ARG A 113 23.902 -0.601 -27.810 1.00 0.00 H new ATOM 0 HH22 ARG A 113 24.924 -1.181 -29.129 1.00 0.00 H new ATOM 1699 N THR A 114 18.528 -8.252 -26.288 1.00 0.00 N ATOM 1700 CA THR A 114 17.454 -9.272 -26.355 1.00 0.00 C ATOM 1701 C THR A 114 16.807 -9.501 -24.987 1.00 0.00 C ATOM 1702 O THR A 114 15.584 -9.407 -24.876 1.00 0.00 O ATOM 1703 CB THR A 114 17.955 -10.605 -26.947 1.00 0.00 C ATOM 1704 OG1 THR A 114 18.337 -10.415 -28.292 1.00 0.00 O ATOM 1705 CG2 THR A 114 16.894 -11.711 -26.937 1.00 0.00 C ATOM 0 H THR A 114 19.436 -8.598 -26.599 1.00 0.00 H new ATOM 0 HA THR A 114 16.694 -8.876 -27.029 1.00 0.00 H new ATOM 0 HB THR A 114 18.789 -10.915 -26.318 1.00 0.00 H new ATOM 0 HG1 THR A 114 19.136 -9.848 -28.328 1.00 0.00 H new ATOM 0 HG21 THR A 114 17.313 -12.621 -27.367 1.00 0.00 H new ATOM 0 HG22 THR A 114 16.581 -11.905 -25.911 1.00 0.00 H new ATOM 0 HG23 THR A 114 16.033 -11.394 -27.526 1.00 0.00 H new ATOM 1713 N VAL A 115 17.590 -9.709 -23.916 1.00 0.00 N ATOM 1714 CA VAL A 115 17.010 -9.855 -22.575 1.00 0.00 C ATOM 1715 C VAL A 115 16.396 -8.546 -22.067 1.00 0.00 C ATOM 1716 O VAL A 115 15.360 -8.615 -21.420 1.00 0.00 O ATOM 1717 CB VAL A 115 17.966 -10.501 -21.559 1.00 0.00 C ATOM 1718 CG1 VAL A 115 18.435 -11.884 -22.027 1.00 0.00 C ATOM 1719 CG2 VAL A 115 19.181 -9.651 -21.201 1.00 0.00 C ATOM 0 H VAL A 115 18.607 -9.779 -23.952 1.00 0.00 H new ATOM 0 HA VAL A 115 16.190 -10.565 -22.680 1.00 0.00 H new ATOM 0 HB VAL A 115 17.370 -10.595 -20.651 1.00 0.00 H new ATOM 0 HG11 VAL A 115 19.109 -12.310 -21.284 1.00 0.00 H new ATOM 0 HG12 VAL A 115 17.572 -12.538 -22.151 1.00 0.00 H new ATOM 0 HG13 VAL A 115 18.958 -11.788 -22.979 1.00 0.00 H new ATOM 0 HG21 VAL A 115 19.799 -10.185 -20.479 1.00 0.00 H new ATOM 0 HG22 VAL A 115 19.764 -9.452 -22.100 1.00 0.00 H new ATOM 0 HG23 VAL A 115 18.850 -8.707 -20.767 1.00 0.00 H new ATOM 1729 N ARG A 116 16.906 -7.355 -22.435 1.00 0.00 N ATOM 1730 CA ARG A 116 16.221 -6.071 -22.133 1.00 0.00 C ATOM 1731 C ARG A 116 14.835 -5.994 -22.795 1.00 0.00 C ATOM 1732 O ARG A 116 13.879 -5.604 -22.141 1.00 0.00 O ATOM 1733 CB ARG A 116 17.147 -4.853 -22.423 1.00 0.00 C ATOM 1734 CG ARG A 116 16.668 -3.877 -23.520 1.00 0.00 C ATOM 1735 CD ARG A 116 17.694 -2.782 -23.834 1.00 0.00 C ATOM 1736 NE ARG A 116 17.481 -2.238 -25.199 1.00 0.00 N ATOM 1737 CZ ARG A 116 18.354 -1.558 -25.922 1.00 0.00 C ATOM 1738 NH1 ARG A 116 19.453 -1.120 -25.397 1.00 0.00 N ATOM 1739 NH2 ARG A 116 18.140 -1.316 -27.179 1.00 0.00 N ATOM 0 H ARG A 116 17.786 -7.249 -22.940 1.00 0.00 H new ATOM 0 HA ARG A 116 16.020 -6.030 -21.063 1.00 0.00 H new ATOM 0 HB2 ARG A 116 17.275 -4.292 -21.497 1.00 0.00 H new ATOM 0 HB3 ARG A 116 18.130 -5.230 -22.705 1.00 0.00 H new ATOM 0 HG2 ARG A 116 16.453 -4.438 -24.430 1.00 0.00 H new ATOM 0 HG3 ARG A 116 15.734 -3.413 -23.204 1.00 0.00 H new ATOM 0 HD2 ARG A 116 17.613 -1.980 -23.101 1.00 0.00 H new ATOM 0 HD3 ARG A 116 18.702 -3.188 -23.752 1.00 0.00 H new ATOM 0 HE ARG A 116 16.568 -2.406 -25.622 1.00 0.00 H new ATOM 0 HH11 ARG A 116 19.655 -1.298 -24.413 1.00 0.00 H new ATOM 0 HH12 ARG A 116 20.117 -0.597 -25.967 1.00 0.00 H new ATOM 0 HH21 ARG A 116 17.287 -1.652 -27.625 1.00 0.00 H new ATOM 0 HH22 ARG A 116 18.825 -0.790 -27.721 1.00 0.00 H new ATOM 1753 N GLY A 117 14.708 -6.430 -24.050 1.00 0.00 N ATOM 1754 CA GLY A 117 13.435 -6.465 -24.791 1.00 0.00 C ATOM 1755 C GLY A 117 12.427 -7.450 -24.192 1.00 0.00 C ATOM 1756 O GLY A 117 11.270 -7.094 -23.965 1.00 0.00 O ATOM 0 H GLY A 117 15.498 -6.776 -24.594 1.00 0.00 H new ATOM 0 HA2 GLY A 117 12.998 -5.466 -24.801 1.00 0.00 H new ATOM 0 HA3 GLY A 117 13.631 -6.738 -25.828 1.00 0.00 H new ATOM 1760 N GLN A 118 12.888 -8.653 -23.825 1.00 0.00 N ATOM 1761 CA GLN A 118 12.083 -9.618 -23.061 1.00 0.00 C ATOM 1762 C GLN A 118 11.658 -9.062 -21.704 1.00 0.00 C ATOM 1763 O GLN A 118 10.493 -9.174 -21.327 1.00 0.00 O ATOM 1764 CB GLN A 118 12.874 -10.911 -22.834 1.00 0.00 C ATOM 1765 CG GLN A 118 12.972 -11.759 -24.114 1.00 0.00 C ATOM 1766 CD GLN A 118 13.624 -13.104 -23.820 1.00 0.00 C ATOM 1767 OE1 GLN A 118 14.636 -13.487 -24.388 1.00 0.00 O ATOM 1768 NE2 GLN A 118 13.067 -13.858 -22.894 1.00 0.00 N ATOM 0 H GLN A 118 13.826 -8.985 -24.048 1.00 0.00 H new ATOM 0 HA GLN A 118 11.189 -9.819 -23.650 1.00 0.00 H new ATOM 0 HB2 GLN A 118 13.877 -10.666 -22.484 1.00 0.00 H new ATOM 0 HB3 GLN A 118 12.396 -11.495 -22.048 1.00 0.00 H new ATOM 0 HG2 GLN A 118 11.977 -11.915 -24.530 1.00 0.00 H new ATOM 0 HG3 GLN A 118 13.552 -11.225 -24.867 1.00 0.00 H new ATOM 0 HE21 GLN A 118 12.222 -13.541 -22.418 1.00 0.00 H new ATOM 0 HE22 GLN A 118 13.481 -14.759 -22.653 1.00 0.00 H new ATOM 1777 N VAL A 119 12.590 -8.432 -20.976 1.00 0.00 N ATOM 1778 CA VAL A 119 12.295 -7.821 -19.675 1.00 0.00 C ATOM 1779 C VAL A 119 11.220 -6.753 -19.848 1.00 0.00 C ATOM 1780 O VAL A 119 10.224 -6.837 -19.148 1.00 0.00 O ATOM 1781 CB VAL A 119 13.560 -7.249 -18.995 1.00 0.00 C ATOM 1782 CG1 VAL A 119 13.268 -6.253 -17.868 1.00 0.00 C ATOM 1783 CG2 VAL A 119 14.379 -8.378 -18.370 1.00 0.00 C ATOM 0 H VAL A 119 13.562 -8.332 -21.270 1.00 0.00 H new ATOM 0 HA VAL A 119 11.921 -8.598 -19.009 1.00 0.00 H new ATOM 0 HB VAL A 119 14.094 -6.731 -19.791 1.00 0.00 H new ATOM 0 HG11 VAL A 119 14.207 -5.899 -17.443 1.00 0.00 H new ATOM 0 HG12 VAL A 119 12.708 -5.407 -18.266 1.00 0.00 H new ATOM 0 HG13 VAL A 119 12.681 -6.744 -17.092 1.00 0.00 H new ATOM 0 HG21 VAL A 119 15.267 -7.963 -17.894 1.00 0.00 H new ATOM 0 HG22 VAL A 119 13.776 -8.895 -17.624 1.00 0.00 H new ATOM 0 HG23 VAL A 119 14.679 -9.083 -19.146 1.00 0.00 H new ATOM 1793 N LYS A 120 11.354 -5.811 -20.797 1.00 0.00 N ATOM 1794 CA LYS A 120 10.368 -4.741 -21.062 1.00 0.00 C ATOM 1795 C LYS A 120 8.944 -5.296 -21.228 1.00 0.00 C ATOM 1796 O LYS A 120 8.023 -4.861 -20.543 1.00 0.00 O ATOM 1797 CB LYS A 120 10.817 -3.943 -22.298 1.00 0.00 C ATOM 1798 CG LYS A 120 9.920 -2.722 -22.543 1.00 0.00 C ATOM 1799 CD LYS A 120 10.381 -1.947 -23.784 1.00 0.00 C ATOM 1800 CE LYS A 120 9.440 -0.758 -24.038 1.00 0.00 C ATOM 1801 NZ LYS A 120 9.799 -0.020 -25.285 1.00 0.00 N ATOM 0 H LYS A 120 12.165 -5.768 -21.415 1.00 0.00 H new ATOM 0 HA LYS A 120 10.330 -4.075 -20.200 1.00 0.00 H new ATOM 0 HB2 LYS A 120 11.848 -3.616 -22.165 1.00 0.00 H new ATOM 0 HB3 LYS A 120 10.798 -4.590 -23.175 1.00 0.00 H new ATOM 0 HG2 LYS A 120 8.887 -3.044 -22.673 1.00 0.00 H new ATOM 0 HG3 LYS A 120 9.942 -2.068 -21.671 1.00 0.00 H new ATOM 0 HD2 LYS A 120 11.401 -1.591 -23.643 1.00 0.00 H new ATOM 0 HD3 LYS A 120 10.391 -2.606 -24.652 1.00 0.00 H new ATOM 0 HE2 LYS A 120 8.413 -1.117 -24.111 1.00 0.00 H new ATOM 0 HE3 LYS A 120 9.479 -0.076 -23.189 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 9.141 0.774 -25.420 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 10.770 0.345 -25.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 9.737 -0.664 -26.099 1.00 0.00 H new ATOM 1815 N GLU A 121 8.782 -6.314 -22.069 1.00 0.00 N ATOM 1816 CA GLU A 121 7.484 -6.954 -22.329 1.00 0.00 C ATOM 1817 C GLU A 121 6.854 -7.570 -21.065 1.00 0.00 C ATOM 1818 O GLU A 121 5.663 -7.374 -20.805 1.00 0.00 O ATOM 1819 CB GLU A 121 7.672 -8.001 -23.441 1.00 0.00 C ATOM 1820 CG GLU A 121 6.349 -8.626 -23.895 1.00 0.00 C ATOM 1821 CD GLU A 121 6.574 -9.566 -25.095 1.00 0.00 C ATOM 1822 OE1 GLU A 121 6.920 -10.754 -24.888 1.00 0.00 O ATOM 1823 OE2 GLU A 121 6.403 -9.125 -26.258 1.00 0.00 O ATOM 0 H GLU A 121 9.552 -6.726 -22.597 1.00 0.00 H new ATOM 0 HA GLU A 121 6.778 -6.190 -22.654 1.00 0.00 H new ATOM 0 HB2 GLU A 121 8.160 -7.533 -24.296 1.00 0.00 H new ATOM 0 HB3 GLU A 121 8.337 -8.788 -23.085 1.00 0.00 H new ATOM 0 HG2 GLU A 121 5.902 -9.181 -23.071 1.00 0.00 H new ATOM 0 HG3 GLU A 121 5.645 -7.840 -24.169 1.00 0.00 H new ATOM 1830 N ARG A 122 7.648 -8.280 -20.252 1.00 0.00 N ATOM 1831 CA ARG A 122 7.159 -8.979 -19.045 1.00 0.00 C ATOM 1832 C ARG A 122 7.019 -8.056 -17.827 1.00 0.00 C ATOM 1833 O ARG A 122 6.064 -8.169 -17.063 1.00 0.00 O ATOM 1834 CB ARG A 122 8.069 -10.189 -18.769 1.00 0.00 C ATOM 1835 CG ARG A 122 8.067 -11.208 -19.925 1.00 0.00 C ATOM 1836 CD ARG A 122 8.767 -12.510 -19.527 1.00 0.00 C ATOM 1837 NE ARG A 122 7.844 -13.376 -18.759 1.00 0.00 N ATOM 1838 CZ ARG A 122 7.160 -14.418 -19.210 1.00 0.00 C ATOM 1839 NH1 ARG A 122 7.248 -14.827 -20.442 1.00 0.00 N ATOM 1840 NH2 ARG A 122 6.362 -15.079 -18.425 1.00 0.00 N ATOM 0 H ARG A 122 8.650 -8.389 -20.409 1.00 0.00 H new ATOM 0 HA ARG A 122 6.145 -9.331 -19.236 1.00 0.00 H new ATOM 0 HB2 ARG A 122 9.088 -9.841 -18.598 1.00 0.00 H new ATOM 0 HB3 ARG A 122 7.743 -10.683 -17.854 1.00 0.00 H new ATOM 0 HG2 ARG A 122 7.040 -11.422 -20.221 1.00 0.00 H new ATOM 0 HG3 ARG A 122 8.566 -10.776 -20.793 1.00 0.00 H new ATOM 0 HD2 ARG A 122 9.110 -13.034 -20.419 1.00 0.00 H new ATOM 0 HD3 ARG A 122 9.650 -12.288 -18.928 1.00 0.00 H new ATOM 0 HE ARG A 122 7.721 -13.145 -17.773 1.00 0.00 H new ATOM 0 HH11 ARG A 122 7.860 -14.341 -21.098 1.00 0.00 H new ATOM 0 HH12 ARG A 122 6.705 -15.633 -20.752 1.00 0.00 H new ATOM 0 HH21 ARG A 122 6.257 -14.797 -17.450 1.00 0.00 H new ATOM 0 HH22 ARG A 122 5.841 -15.879 -18.784 1.00 0.00 H new ATOM 1854 N VAL A 123 7.920 -7.089 -17.677 1.00 0.00 N ATOM 1855 CA VAL A 123 7.937 -6.108 -16.578 1.00 0.00 C ATOM 1856 C VAL A 123 6.815 -5.071 -16.724 1.00 0.00 C ATOM 1857 O VAL A 123 6.236 -4.687 -15.710 1.00 0.00 O ATOM 1858 CB VAL A 123 9.330 -5.482 -16.441 1.00 0.00 C ATOM 1859 CG1 VAL A 123 9.630 -4.405 -17.470 1.00 0.00 C ATOM 1860 CG2 VAL A 123 9.520 -4.850 -15.071 1.00 0.00 C ATOM 0 H VAL A 123 8.687 -6.956 -18.336 1.00 0.00 H new ATOM 0 HA VAL A 123 7.731 -6.628 -15.643 1.00 0.00 H new ATOM 0 HB VAL A 123 10.013 -6.317 -16.598 1.00 0.00 H new ATOM 0 HG11 VAL A 123 10.634 -4.013 -17.305 1.00 0.00 H new ATOM 0 HG12 VAL A 123 9.567 -4.831 -18.471 1.00 0.00 H new ATOM 0 HG13 VAL A 123 8.905 -3.597 -17.373 1.00 0.00 H new ATOM 0 HG21 VAL A 123 10.517 -4.415 -15.006 1.00 0.00 H new ATOM 0 HG22 VAL A 123 8.774 -4.069 -14.924 1.00 0.00 H new ATOM 0 HG23 VAL A 123 9.405 -5.612 -14.300 1.00 0.00 H new ATOM 1870 N GLU A 124 6.441 -4.677 -17.953 1.00 0.00 N ATOM 1871 CA GLU A 124 5.238 -3.862 -18.214 1.00 0.00 C ATOM 1872 C GLU A 124 4.007 -4.571 -17.647 1.00 0.00 C ATOM 1873 O GLU A 124 3.326 -4.037 -16.777 1.00 0.00 O ATOM 1874 CB GLU A 124 5.003 -3.645 -19.728 1.00 0.00 C ATOM 1875 CG GLU A 124 5.740 -2.452 -20.338 1.00 0.00 C ATOM 1876 CD GLU A 124 5.310 -2.242 -21.807 1.00 0.00 C ATOM 1877 OE1 GLU A 124 4.326 -1.502 -22.050 1.00 0.00 O ATOM 1878 OE2 GLU A 124 5.944 -2.812 -22.729 1.00 0.00 O ATOM 0 H GLU A 124 6.964 -4.914 -18.796 1.00 0.00 H new ATOM 0 HA GLU A 124 5.395 -2.894 -17.738 1.00 0.00 H new ATOM 0 HB2 GLU A 124 5.305 -4.548 -20.259 1.00 0.00 H new ATOM 0 HB3 GLU A 124 3.934 -3.517 -19.899 1.00 0.00 H new ATOM 0 HG2 GLU A 124 5.529 -1.553 -19.759 1.00 0.00 H new ATOM 0 HG3 GLU A 124 6.816 -2.618 -20.288 1.00 0.00 H new ATOM 1885 N ASN A 125 3.778 -5.808 -18.095 1.00 0.00 N ATOM 1886 CA ASN A 125 2.654 -6.651 -17.687 1.00 0.00 C ATOM 1887 C ASN A 125 2.599 -6.835 -16.153 1.00 0.00 C ATOM 1888 O ASN A 125 1.517 -6.838 -15.573 1.00 0.00 O ATOM 1889 CB ASN A 125 2.795 -7.993 -18.439 1.00 0.00 C ATOM 1890 CG ASN A 125 1.586 -8.916 -18.338 1.00 0.00 C ATOM 1891 OD1 ASN A 125 0.472 -8.522 -18.037 1.00 0.00 O ATOM 1892 ND2 ASN A 125 1.771 -10.185 -18.620 1.00 0.00 N ATOM 0 H ASN A 125 4.389 -6.264 -18.773 1.00 0.00 H new ATOM 0 HA ASN A 125 1.707 -6.178 -17.947 1.00 0.00 H new ATOM 0 HB2 ASN A 125 2.988 -7.784 -19.491 1.00 0.00 H new ATOM 0 HB3 ASN A 125 3.668 -8.519 -18.053 1.00 0.00 H new ATOM 0 HD21 ASN A 125 0.985 -10.835 -18.587 1.00 0.00 H new ATOM 0 HD22 ASN A 125 2.700 -10.521 -18.873 1.00 0.00 H new ATOM 1899 N LEU A 126 3.755 -6.919 -15.483 1.00 0.00 N ATOM 1900 CA LEU A 126 3.830 -7.050 -14.024 1.00 0.00 C ATOM 1901 C LEU A 126 3.484 -5.737 -13.299 1.00 0.00 C ATOM 1902 O LEU A 126 2.556 -5.710 -12.492 1.00 0.00 O ATOM 1903 CB LEU A 126 5.221 -7.607 -13.659 1.00 0.00 C ATOM 1904 CG LEU A 126 5.433 -8.107 -12.217 1.00 0.00 C ATOM 1905 CD1 LEU A 126 5.692 -6.982 -11.213 1.00 0.00 C ATOM 1906 CD2 LEU A 126 4.266 -8.965 -11.736 1.00 0.00 C ATOM 0 H LEU A 126 4.667 -6.898 -15.940 1.00 0.00 H new ATOM 0 HA LEU A 126 3.073 -7.753 -13.677 1.00 0.00 H new ATOM 0 HB2 LEU A 126 5.441 -8.432 -14.336 1.00 0.00 H new ATOM 0 HB3 LEU A 126 5.957 -6.828 -13.856 1.00 0.00 H new ATOM 0 HG LEU A 126 6.334 -8.719 -12.261 1.00 0.00 H new ATOM 0 HD11 LEU A 126 5.832 -7.407 -10.219 1.00 0.00 H new ATOM 0 HD12 LEU A 126 6.589 -6.434 -11.503 1.00 0.00 H new ATOM 0 HD13 LEU A 126 4.840 -6.302 -11.200 1.00 0.00 H new ATOM 0 HD21 LEU A 126 4.455 -9.297 -10.715 1.00 0.00 H new ATOM 0 HD22 LEU A 126 3.348 -8.378 -11.762 1.00 0.00 H new ATOM 0 HD23 LEU A 126 4.160 -9.833 -12.386 1.00 0.00 H new ATOM 1918 N ILE A 127 4.194 -4.638 -13.581 1.00 0.00 N ATOM 1919 CA ILE A 127 4.009 -3.348 -12.903 1.00 0.00 C ATOM 1920 C ILE A 127 2.621 -2.738 -13.180 1.00 0.00 C ATOM 1921 O ILE A 127 2.024 -2.112 -12.308 1.00 0.00 O ATOM 1922 CB ILE A 127 5.190 -2.420 -13.299 1.00 0.00 C ATOM 1923 CG1 ILE A 127 5.810 -1.701 -12.088 1.00 0.00 C ATOM 1924 CG2 ILE A 127 4.888 -1.436 -14.442 1.00 0.00 C ATOM 1925 CD1 ILE A 127 4.831 -0.863 -11.258 1.00 0.00 C ATOM 0 H ILE A 127 4.922 -4.619 -14.295 1.00 0.00 H new ATOM 0 HA ILE A 127 4.026 -3.487 -11.822 1.00 0.00 H new ATOM 0 HB ILE A 127 5.935 -3.106 -13.701 1.00 0.00 H new ATOM 0 HG12 ILE A 127 6.268 -2.446 -11.438 1.00 0.00 H new ATOM 0 HG13 ILE A 127 6.611 -1.052 -12.442 1.00 0.00 H new ATOM 0 HG21 ILE A 127 5.772 -0.832 -14.646 1.00 0.00 H new ATOM 0 HG22 ILE A 127 4.614 -1.992 -15.338 1.00 0.00 H new ATOM 0 HG23 ILE A 127 4.063 -0.785 -14.153 1.00 0.00 H new ATOM 0 HD11 ILE A 127 5.363 -0.397 -10.429 1.00 0.00 H new ATOM 0 HD12 ILE A 127 4.390 -0.089 -11.887 1.00 0.00 H new ATOM 0 HD13 ILE A 127 4.042 -1.506 -10.867 1.00 0.00 H new ATOM 1937 N ALA A 128 2.070 -2.966 -14.373 1.00 0.00 N ATOM 1938 CA ALA A 128 0.825 -2.336 -14.821 1.00 0.00 C ATOM 1939 C ALA A 128 -0.438 -2.903 -14.130 1.00 0.00 C ATOM 1940 O ALA A 128 -1.435 -2.190 -14.002 1.00 0.00 O ATOM 1941 CB ALA A 128 0.767 -2.426 -16.350 1.00 0.00 C ATOM 0 H ALA A 128 2.478 -3.598 -15.062 1.00 0.00 H new ATOM 0 HA ALA A 128 0.831 -1.288 -14.520 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -0.153 -1.963 -16.707 1.00 0.00 H new ATOM 0 HB2 ALA A 128 1.625 -1.907 -16.778 1.00 0.00 H new ATOM 0 HB3 ALA A 128 0.788 -3.473 -16.654 1.00 0.00 H new ATOM 1947 N LYS A 129 -0.385 -4.139 -13.607 1.00 0.00 N ATOM 1948 CA LYS A 129 -1.466 -4.764 -12.806 1.00 0.00 C ATOM 1949 C LYS A 129 -1.672 -4.115 -11.429 1.00 0.00 C ATOM 1950 O LYS A 129 -2.744 -4.247 -10.839 1.00 0.00 O ATOM 1951 CB LYS A 129 -1.162 -6.259 -12.631 1.00 0.00 C ATOM 1952 CG LYS A 129 -1.412 -7.038 -13.923 1.00 0.00 C ATOM 1953 CD LYS A 129 -0.953 -8.495 -13.765 1.00 0.00 C ATOM 1954 CE LYS A 129 -0.771 -9.168 -15.130 1.00 0.00 C ATOM 1955 NZ LYS A 129 -2.057 -9.374 -15.860 1.00 0.00 N ATOM 0 H LYS A 129 0.424 -4.749 -13.728 1.00 0.00 H new ATOM 0 HA LYS A 129 -2.394 -4.612 -13.357 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -0.124 -6.386 -12.323 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -1.783 -6.667 -11.833 1.00 0.00 H new ATOM 0 HG2 LYS A 129 -2.472 -7.009 -14.174 1.00 0.00 H new ATOM 0 HG3 LYS A 129 -0.876 -6.568 -14.748 1.00 0.00 H new ATOM 0 HD2 LYS A 129 -0.014 -8.526 -13.213 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -1.686 -9.049 -13.178 1.00 0.00 H new ATOM 0 HE2 LYS A 129 -0.106 -8.559 -15.743 1.00 0.00 H new ATOM 0 HE3 LYS A 129 -0.281 -10.132 -14.990 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 -1.868 -9.832 -16.774 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 -2.685 -9.979 -15.293 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -2.515 -8.455 -16.022 1.00 0.00 H new ATOM 1969 N ILE A 130 -0.648 -3.417 -10.930 1.00 0.00 N ATOM 1970 CA ILE A 130 -0.597 -2.756 -9.611 1.00 0.00 C ATOM 1971 C ILE A 130 -0.430 -1.221 -9.720 1.00 0.00 C ATOM 1972 O ILE A 130 -0.116 -0.554 -8.732 1.00 0.00 O ATOM 1973 CB ILE A 130 0.462 -3.440 -8.710 1.00 0.00 C ATOM 1974 CG1 ILE A 130 1.858 -3.426 -9.367 1.00 0.00 C ATOM 1975 CG2 ILE A 130 0.012 -4.873 -8.369 1.00 0.00 C ATOM 1976 CD1 ILE A 130 2.961 -4.065 -8.526 1.00 0.00 C ATOM 0 H ILE A 130 0.215 -3.288 -11.458 1.00 0.00 H new ATOM 0 HA ILE A 130 -1.563 -2.887 -9.123 1.00 0.00 H new ATOM 0 HB ILE A 130 0.546 -2.874 -7.782 1.00 0.00 H new ATOM 0 HG12 ILE A 130 1.801 -3.946 -10.323 1.00 0.00 H new ATOM 0 HG13 ILE A 130 2.134 -2.394 -9.581 1.00 0.00 H new ATOM 0 HG21 ILE A 130 0.761 -5.348 -7.735 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -0.941 -4.839 -7.841 1.00 0.00 H new ATOM 0 HG23 ILE A 130 -0.102 -5.447 -9.289 1.00 0.00 H new ATOM 0 HD11 ILE A 130 3.907 -4.011 -9.065 1.00 0.00 H new ATOM 0 HD12 ILE A 130 3.052 -3.532 -7.579 1.00 0.00 H new ATOM 0 HD13 ILE A 130 2.713 -5.109 -8.333 1.00 0.00 H new ATOM 1988 N SER A 131 -0.668 -0.662 -10.917 1.00 0.00 N ATOM 1989 CA SER A 131 -0.702 0.780 -11.220 1.00 0.00 C ATOM 1990 C SER A 131 -2.046 1.413 -10.827 1.00 0.00 C ATOM 1991 O SER A 131 -2.057 2.346 -9.988 1.00 0.00 O ATOM 1992 CB SER A 131 -0.394 0.990 -12.701 1.00 0.00 C ATOM 1993 OG SER A 131 -0.247 2.375 -12.968 1.00 0.00 O ATOM 1994 OXT SER A 131 -3.103 0.947 -11.320 1.00 0.00 O ATOM 0 H SER A 131 -0.851 -1.232 -11.743 1.00 0.00 H new ATOM 0 HA SER A 131 0.060 1.283 -10.624 1.00 0.00 H new ATOM 0 HB2 SER A 131 0.519 0.459 -12.971 1.00 0.00 H new ATOM 0 HB3 SER A 131 -1.196 0.575 -13.311 1.00 0.00 H new ATOM 0 HG SER A 131 -0.048 2.506 -13.919 1.00 0.00 H new TER 2000 SER A 131