USER MOD reduce.3.24.130724 H: found=0, std=0, add=775, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 775 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 89 HIS : no HD1:sc= 0.754 K(o=2,f=-4.3!) USER MOD Set 1.2: A 119 THR OG1 : rot 68:sc= 1.29 USER MOD Set 2.1: A 73 CYS SG : rot 168:sc= 0.161 USER MOD Set 2.2: A 97 TYR OH : rot 70:sc= 0.00199 USER MOD Set 3.1: A 47 TYR OH : rot -20:sc= 1.78 USER MOD Set 3.2: A 59 LYS NZ :NH3+ 174:sc= 0.625 (180deg=0.00253) USER MOD Set 4.1: A 53 HIS : no HD1:sc= 0.826 K(o=0.63,f=-3.6!) USER MOD Set 4.2: A 94 SER OG : rot -20:sc= -0.198 USER MOD Set 5.1: A 28 HIS : no HD1:sc= 1.01 K(o=2.3,f=-4.7!) USER MOD Set 5.2: A 40 SER OG : rot -128:sc= 1.34 USER MOD Set 6.1: A 22 TYR OH : rot -80:sc= 0.956 USER MOD Set 6.2: A 102 HIS : no HE2:sc= -0.0885 X(o=2.1,f=1.9) USER MOD Set 6.3: A 105 SER OG : rot 159:sc= 1.25 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 1.2 (180deg=1.2) USER MOD Single : A 29 SER OG : rot -73:sc= 1.2 USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ 176:sc= 1.78 (180deg=1.75) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 61 SER OG : rot -86:sc= 1.22 USER MOD Single : A 64 MET CE :methyl -176:sc= -0.13 (180deg=-0.189) USER MOD Single : A 65 GLN : amide:sc= 0.589 K(o=0.59,f=0) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 GLN : amide:sc= 1.08 K(o=1.1,f=-0.38) USER MOD Single : A 69 CYS SG : rot 18:sc= 0.261 USER MOD Single : A 71 CYS SG : rot 180:sc= -0.319 USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 95 MET CE :methyl -176:sc= 0 (180deg=-0.0275) USER MOD Single : A 101 GLN : amide:sc= 0.615 K(o=0.62,f=-7.4!) USER MOD Single : A 106 THR OG1 : rot -75:sc= 1.13 USER MOD Single : A 108 LYS NZ :NH3+ 161:sc= 2.27 (180deg=1.14) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 LYS NZ :NH3+ -161:sc= 1.33 (180deg=1.08) USER MOD ----------------------------------------------------------------- ATOM 46 N ALA A 4 5.320 -2.890 3.182 1.00 10.00 N ATOM 47 CA ALA A 4 5.332 -2.090 4.404 1.00 10.00 C ATOM 48 C ALA A 4 6.764 -1.831 4.904 1.00 10.00 C ATOM 49 O ALA A 4 7.713 -2.488 4.481 1.00 10.00 O ATOM 50 CB ALA A 4 4.501 -2.799 5.483 1.00 10.00 C ATOM 0 HA ALA A 4 4.891 -1.118 4.183 1.00 10.00 H new ATOM 0 HB1 ALA A 4 4.508 -2.205 6.397 1.00 10.00 H new ATOM 0 HB2 ALA A 4 3.475 -2.916 5.134 1.00 10.00 H new ATOM 0 HB3 ALA A 4 4.929 -3.781 5.686 1.00 10.00 H new ATOM 56 N ASP A 5 6.888 -0.934 5.880 1.00 10.00 N ATOM 57 CA ASP A 5 8.116 -0.686 6.633 1.00 10.00 C ATOM 58 C ASP A 5 7.697 -0.119 7.988 1.00 10.00 C ATOM 59 O ASP A 5 6.658 0.544 8.081 1.00 10.00 O ATOM 60 CB ASP A 5 9.018 0.316 5.897 1.00 10.00 C ATOM 61 CG ASP A 5 10.347 0.526 6.642 1.00 10.00 C ATOM 62 OD1 ASP A 5 10.371 1.389 7.550 1.00 10.00 O ATOM 63 OD2 ASP A 5 11.304 -0.207 6.336 1.00 10.00 O ATOM 0 H ASP A 5 6.113 -0.341 6.178 1.00 10.00 H new ATOM 0 HA ASP A 5 8.685 -1.608 6.749 1.00 10.00 H new ATOM 0 HB2 ASP A 5 9.218 -0.045 4.888 1.00 10.00 H new ATOM 0 HB3 ASP A 5 8.500 1.270 5.798 1.00 10.00 H new ATOM 68 N LEU A 6 8.461 -0.379 9.054 1.00 10.00 N ATOM 69 CA LEU A 6 8.131 0.076 10.401 1.00 10.00 C ATOM 70 C LEU A 6 7.992 1.597 10.492 1.00 10.00 C ATOM 71 O LEU A 6 7.236 2.074 11.341 1.00 10.00 O ATOM 72 CB LEU A 6 9.197 -0.405 11.398 1.00 10.00 C ATOM 73 CG LEU A 6 9.260 -1.927 11.615 1.00 10.00 C ATOM 74 CD1 LEU A 6 10.403 -2.239 12.577 1.00 10.00 C ATOM 75 CD2 LEU A 6 7.953 -2.493 12.195 1.00 10.00 C ATOM 0 H LEU A 6 9.328 -0.913 9.002 1.00 10.00 H new ATOM 0 HA LEU A 6 7.162 -0.356 10.652 1.00 10.00 H new ATOM 0 HB2 LEU A 6 10.173 -0.064 11.053 1.00 10.00 H new ATOM 0 HB3 LEU A 6 9.013 0.075 12.359 1.00 10.00 H new ATOM 0 HG LEU A 6 9.419 -2.394 10.643 1.00 10.00 H new ATOM 0 HD11 LEU A 6 10.458 -3.315 12.739 1.00 10.00 H new ATOM 0 HD12 LEU A 6 11.343 -1.887 12.152 1.00 10.00 H new ATOM 0 HD13 LEU A 6 10.225 -1.737 13.528 1.00 10.00 H new ATOM 0 HD21 LEU A 6 8.051 -3.570 12.329 1.00 10.00 H new ATOM 0 HD22 LEU A 6 7.750 -2.025 13.158 1.00 10.00 H new ATOM 0 HD23 LEU A 6 7.131 -2.285 11.510 1.00 10.00 H new ATOM 87 N ALA A 7 8.695 2.361 9.653 1.00 10.00 N ATOM 88 CA ALA A 7 8.579 3.813 9.622 1.00 10.00 C ATOM 89 C ALA A 7 7.183 4.271 9.181 1.00 10.00 C ATOM 90 O ALA A 7 6.764 5.367 9.548 1.00 10.00 O ATOM 91 CB ALA A 7 9.639 4.398 8.686 1.00 10.00 C ATOM 0 H ALA A 7 9.360 1.986 8.977 1.00 10.00 H new ATOM 0 HA ALA A 7 8.738 4.178 10.637 1.00 10.00 H new ATOM 0 HB1 ALA A 7 9.548 5.484 8.667 1.00 10.00 H new ATOM 0 HB2 ALA A 7 10.631 4.124 9.044 1.00 10.00 H new ATOM 0 HB3 ALA A 7 9.494 4.004 7.680 1.00 10.00 H new ATOM 97 N LEU A 8 6.469 3.452 8.399 1.00 10.00 N ATOM 98 CA LEU A 8 5.123 3.776 7.928 1.00 10.00 C ATOM 99 C LEU A 8 4.087 3.541 9.031 1.00 10.00 C ATOM 100 O LEU A 8 3.020 4.150 8.999 1.00 10.00 O ATOM 101 CB LEU A 8 4.751 2.942 6.686 1.00 10.00 C ATOM 102 CG LEU A 8 5.692 3.111 5.476 1.00 10.00 C ATOM 103 CD1 LEU A 8 5.216 2.216 4.326 1.00 10.00 C ATOM 104 CD2 LEU A 8 5.768 4.563 4.984 1.00 10.00 C ATOM 0 H LEU A 8 6.811 2.547 8.077 1.00 10.00 H new ATOM 0 HA LEU A 8 5.120 4.831 7.655 1.00 10.00 H new ATOM 0 HB2 LEU A 8 4.732 1.889 6.967 1.00 10.00 H new ATOM 0 HB3 LEU A 8 3.739 3.208 6.379 1.00 10.00 H new ATOM 0 HG LEU A 8 6.690 2.822 5.804 1.00 10.00 H new ATOM 0 HD11 LEU A 8 5.882 2.337 3.472 1.00 10.00 H new ATOM 0 HD12 LEU A 8 5.224 1.175 4.648 1.00 10.00 H new ATOM 0 HD13 LEU A 8 4.203 2.500 4.039 1.00 10.00 H new ATOM 0 HD21 LEU A 8 6.444 4.623 4.131 1.00 10.00 H new ATOM 0 HD22 LEU A 8 4.775 4.898 4.684 1.00 10.00 H new ATOM 0 HD23 LEU A 8 6.139 5.200 5.787 1.00 10.00 H new ATOM 116 N ILE A 9 4.382 2.661 9.997 1.00 10.00 N ATOM 117 CA ILE A 9 3.503 2.404 11.132 1.00 10.00 C ATOM 118 C ILE A 9 3.559 3.653 12.030 1.00 10.00 C ATOM 119 O ILE A 9 4.657 3.981 12.503 1.00 10.00 O ATOM 120 CB ILE A 9 3.938 1.117 11.874 1.00 10.00 C ATOM 121 CG1 ILE A 9 3.878 -0.097 10.916 1.00 10.00 C ATOM 122 CG2 ILE A 9 3.056 0.889 13.117 1.00 10.00 C ATOM 123 CD1 ILE A 9 4.332 -1.417 11.543 1.00 10.00 C ATOM 0 H ILE A 9 5.240 2.109 10.008 1.00 10.00 H new ATOM 0 HA ILE A 9 2.475 2.230 10.814 1.00 10.00 H new ATOM 0 HB ILE A 9 4.968 1.234 12.211 1.00 10.00 H new ATOM 0 HG12 ILE A 9 2.855 -0.212 10.557 1.00 10.00 H new ATOM 0 HG13 ILE A 9 4.500 0.111 10.045 1.00 10.00 H new ATOM 0 HG21 ILE A 9 3.375 -0.020 13.628 1.00 10.00 H new ATOM 0 HG22 ILE A 9 3.154 1.738 13.793 1.00 10.00 H new ATOM 0 HG23 ILE A 9 2.015 0.787 12.811 1.00 10.00 H new ATOM 0 HD11 ILE A 9 4.259 -2.215 10.804 1.00 10.00 H new ATOM 0 HD12 ILE A 9 5.366 -1.325 11.876 1.00 10.00 H new ATOM 0 HD13 ILE A 9 3.695 -1.653 12.396 1.00 10.00 H new ATOM 135 N PRO A 10 2.417 4.318 12.314 1.00 10.00 N ATOM 136 CA PRO A 10 2.356 5.430 13.255 1.00 10.00 C ATOM 137 C PRO A 10 3.024 5.044 14.568 1.00 10.00 C ATOM 138 O PRO A 10 2.772 3.959 15.097 1.00 10.00 O ATOM 139 CB PRO A 10 0.868 5.744 13.455 1.00 10.00 C ATOM 140 CG PRO A 10 0.230 5.248 12.161 1.00 10.00 C ATOM 141 CD PRO A 10 1.084 4.034 11.800 1.00 10.00 C ATOM 0 HA PRO A 10 2.885 6.306 12.880 1.00 10.00 H new ATOM 0 HB2 PRO A 10 0.462 5.231 14.327 1.00 10.00 H new ATOM 0 HB3 PRO A 10 0.698 6.810 13.605 1.00 10.00 H new ATOM 0 HG2 PRO A 10 -0.816 4.977 12.305 1.00 10.00 H new ATOM 0 HG3 PRO A 10 0.258 6.008 11.380 1.00 10.00 H new ATOM 0 HD2 PRO A 10 0.679 3.125 12.245 1.00 10.00 H new ATOM 0 HD3 PRO A 10 1.106 3.878 10.721 1.00 10.00 H new ATOM 149 N ASP A 11 3.881 5.907 15.105 1.00 10.00 N ATOM 150 CA ASP A 11 4.689 5.573 16.280 1.00 10.00 C ATOM 151 C ASP A 11 3.880 5.708 17.572 1.00 10.00 C ATOM 152 O ASP A 11 4.064 4.960 18.530 1.00 10.00 O ATOM 153 CB ASP A 11 5.922 6.480 16.310 1.00 10.00 C ATOM 154 CG ASP A 11 7.099 5.796 16.994 1.00 10.00 C ATOM 155 OD1 ASP A 11 7.476 4.696 16.534 1.00 10.00 O ATOM 156 OD2 ASP A 11 7.732 6.405 17.891 1.00 10.00 O ATOM 0 H ASP A 11 4.036 6.849 14.745 1.00 10.00 H new ATOM 0 HA ASP A 11 5.004 4.532 16.209 1.00 10.00 H new ATOM 0 HB2 ASP A 11 6.199 6.753 15.292 1.00 10.00 H new ATOM 0 HB3 ASP A 11 5.682 7.405 16.834 1.00 10.00 H new ATOM 161 N VAL A 12 2.901 6.613 17.551 1.00 10.00 N ATOM 162 CA VAL A 12 1.961 6.916 18.619 1.00 10.00 C ATOM 163 C VAL A 12 0.599 7.076 17.940 1.00 10.00 C ATOM 164 O VAL A 12 0.520 7.698 16.882 1.00 10.00 O ATOM 165 CB VAL A 12 2.394 8.215 19.337 1.00 10.00 C ATOM 166 CG1 VAL A 12 1.466 8.554 20.513 1.00 10.00 C ATOM 167 CG2 VAL A 12 3.830 8.115 19.867 1.00 10.00 C ATOM 0 H VAL A 12 2.737 7.192 16.727 1.00 10.00 H new ATOM 0 HA VAL A 12 1.923 6.134 19.377 1.00 10.00 H new ATOM 0 HB VAL A 12 2.334 9.006 18.590 1.00 10.00 H new ATOM 0 HG11 VAL A 12 1.805 9.473 20.991 1.00 10.00 H new ATOM 0 HG12 VAL A 12 0.448 8.689 20.146 1.00 10.00 H new ATOM 0 HG13 VAL A 12 1.485 7.740 21.238 1.00 10.00 H new ATOM 0 HG21 VAL A 12 4.100 9.046 20.365 1.00 10.00 H new ATOM 0 HG22 VAL A 12 3.899 7.290 20.576 1.00 10.00 H new ATOM 0 HG23 VAL A 12 4.513 7.937 19.036 1.00 10.00 H new ATOM 177 N ASP A 13 -0.446 6.496 18.522 1.00 10.00 N ATOM 178 CA ASP A 13 -1.824 6.676 18.068 1.00 10.00 C ATOM 179 C ASP A 13 -2.723 6.523 19.289 1.00 10.00 C ATOM 180 O ASP A 13 -2.917 5.410 19.787 1.00 10.00 O ATOM 181 CB ASP A 13 -2.197 5.676 16.963 1.00 10.00 C ATOM 182 CG ASP A 13 -3.638 5.863 16.455 1.00 10.00 C ATOM 183 OD1 ASP A 13 -4.217 6.947 16.667 1.00 10.00 O ATOM 184 OD2 ASP A 13 -4.162 4.879 15.871 1.00 10.00 O ATOM 0 H ASP A 13 -0.361 5.881 19.331 1.00 10.00 H new ATOM 0 HA ASP A 13 -1.948 7.664 17.625 1.00 10.00 H new ATOM 0 HB2 ASP A 13 -1.505 5.788 16.129 1.00 10.00 H new ATOM 0 HB3 ASP A 13 -2.078 4.661 17.342 1.00 10.00 H new ATOM 189 N ILE A 14 -3.145 7.658 19.846 1.00 10.00 N ATOM 190 CA ILE A 14 -3.816 7.759 21.140 1.00 10.00 C ATOM 191 C ILE A 14 -5.085 8.626 21.022 1.00 10.00 C ATOM 192 O ILE A 14 -5.371 9.446 21.893 1.00 10.00 O ATOM 193 CB ILE A 14 -2.812 8.218 22.229 1.00 10.00 C ATOM 194 CG1 ILE A 14 -2.164 9.591 21.919 1.00 10.00 C ATOM 195 CG2 ILE A 14 -1.743 7.127 22.464 1.00 10.00 C ATOM 196 CD1 ILE A 14 -1.383 10.178 23.102 1.00 10.00 C ATOM 0 H ILE A 14 -3.024 8.563 19.392 1.00 10.00 H new ATOM 0 HA ILE A 14 -4.168 6.779 21.463 1.00 10.00 H new ATOM 0 HB ILE A 14 -3.379 8.360 23.149 1.00 10.00 H new ATOM 0 HG12 ILE A 14 -1.492 9.483 21.067 1.00 10.00 H new ATOM 0 HG13 ILE A 14 -2.943 10.294 21.623 1.00 10.00 H new ATOM 0 HG21 ILE A 14 -1.044 7.461 23.231 1.00 10.00 H new ATOM 0 HG22 ILE A 14 -2.228 6.207 22.791 1.00 10.00 H new ATOM 0 HG23 ILE A 14 -1.202 6.942 21.536 1.00 10.00 H new ATOM 0 HD11 ILE A 14 -0.956 11.139 22.815 1.00 10.00 H new ATOM 0 HD12 ILE A 14 -2.055 10.318 23.948 1.00 10.00 H new ATOM 0 HD13 ILE A 14 -0.582 9.495 23.384 1.00 10.00 H new ATOM 250 N VAL A 19 -9.733 9.461 30.717 1.00 10.00 N ATOM 251 CA VAL A 19 -8.995 8.217 30.929 1.00 10.00 C ATOM 252 C VAL A 19 -9.395 7.288 29.776 1.00 10.00 C ATOM 253 O VAL A 19 -10.591 7.034 29.616 1.00 10.00 O ATOM 254 CB VAL A 19 -9.332 7.614 32.313 1.00 10.00 C ATOM 255 CG1 VAL A 19 -8.470 6.372 32.590 1.00 10.00 C ATOM 256 CG2 VAL A 19 -9.104 8.609 33.465 1.00 10.00 C ATOM 0 HA VAL A 19 -7.917 8.376 30.931 1.00 10.00 H new ATOM 0 HB VAL A 19 -10.390 7.354 32.274 1.00 10.00 H new ATOM 0 HG11 VAL A 19 -8.723 5.964 33.568 1.00 10.00 H new ATOM 0 HG12 VAL A 19 -8.658 5.620 31.824 1.00 10.00 H new ATOM 0 HG13 VAL A 19 -7.416 6.650 32.575 1.00 10.00 H new ATOM 0 HG21 VAL A 19 -9.356 8.133 34.412 1.00 10.00 H new ATOM 0 HG22 VAL A 19 -8.058 8.915 33.480 1.00 10.00 H new ATOM 0 HG23 VAL A 19 -9.736 9.485 33.320 1.00 10.00 H new ATOM 266 N PHE A 20 -8.445 6.780 28.979 1.00 10.00 N ATOM 267 CA PHE A 20 -8.791 6.047 27.750 1.00 10.00 C ATOM 268 C PHE A 20 -8.017 4.752 27.505 1.00 10.00 C ATOM 269 O PHE A 20 -8.129 4.174 26.429 1.00 10.00 O ATOM 270 CB PHE A 20 -8.766 6.996 26.539 1.00 10.00 C ATOM 271 CG PHE A 20 -7.441 7.648 26.180 1.00 10.00 C ATOM 272 CD1 PHE A 20 -6.425 6.906 25.550 1.00 10.00 C ATOM 273 CD2 PHE A 20 -7.260 9.029 26.372 1.00 10.00 C ATOM 274 CE1 PHE A 20 -5.221 7.523 25.172 1.00 10.00 C ATOM 275 CE2 PHE A 20 -6.057 9.651 25.995 1.00 10.00 C ATOM 276 CZ PHE A 20 -5.034 8.898 25.399 1.00 10.00 C ATOM 0 H PHE A 20 -7.444 6.860 29.158 1.00 10.00 H new ATOM 0 HA PHE A 20 -9.809 5.688 27.901 1.00 10.00 H new ATOM 0 HB2 PHE A 20 -9.112 6.438 25.669 1.00 10.00 H new ATOM 0 HB3 PHE A 20 -9.492 7.789 26.719 1.00 10.00 H new ATOM 0 HD1 PHE A 20 -6.572 5.854 25.356 1.00 10.00 H new ATOM 0 HD2 PHE A 20 -8.052 9.617 26.813 1.00 10.00 H new ATOM 0 HE1 PHE A 20 -4.439 6.941 24.707 1.00 10.00 H new ATOM 0 HE2 PHE A 20 -5.920 10.709 26.164 1.00 10.00 H new ATOM 0 HZ PHE A 20 -4.106 9.373 25.116 1.00 10.00 H new ATOM 286 N LYS A 21 -7.331 4.238 28.534 1.00 10.00 N ATOM 287 CA LYS A 21 -6.402 3.090 28.489 1.00 10.00 C ATOM 288 C LYS A 21 -5.267 3.279 27.470 1.00 10.00 C ATOM 289 O LYS A 21 -5.353 4.076 26.549 1.00 10.00 O ATOM 290 CB LYS A 21 -7.148 1.772 28.204 1.00 10.00 C ATOM 291 CG LYS A 21 -8.270 1.444 29.199 1.00 10.00 C ATOM 292 CD LYS A 21 -8.843 0.048 28.904 1.00 10.00 C ATOM 293 CE LYS A 21 -10.056 -0.287 29.785 1.00 10.00 C ATOM 294 NZ LYS A 21 -11.283 0.439 29.373 1.00 10.00 N ATOM 0 H LYS A 21 -7.410 4.629 29.473 1.00 10.00 H new ATOM 0 HA LYS A 21 -5.949 3.036 29.479 1.00 10.00 H new ATOM 0 HB2 LYS A 21 -7.572 1.820 27.201 1.00 10.00 H new ATOM 0 HB3 LYS A 21 -6.427 0.954 28.207 1.00 10.00 H new ATOM 0 HG2 LYS A 21 -7.885 1.480 30.218 1.00 10.00 H new ATOM 0 HG3 LYS A 21 -9.059 2.192 29.129 1.00 10.00 H new ATOM 0 HD2 LYS A 21 -9.133 -0.008 27.855 1.00 10.00 H new ATOM 0 HD3 LYS A 21 -8.066 -0.701 29.060 1.00 10.00 H new ATOM 0 HE2 LYS A 21 -10.243 -1.360 29.745 1.00 10.00 H new ATOM 0 HE3 LYS A 21 -9.825 -0.042 30.822 1.00 10.00 H new ATOM 0 HZ1 LYS A 21 -12.069 0.176 30.001 1.00 10.00 H new ATOM 0 HZ2 LYS A 21 -11.118 1.464 29.436 1.00 10.00 H new ATOM 0 HZ3 LYS A 21 -11.523 0.187 28.393 1.00 10.00 H new ATOM 308 N TYR A 22 -4.168 2.544 27.627 1.00 10.00 N ATOM 309 CA TYR A 22 -3.130 2.470 26.602 1.00 10.00 C ATOM 310 C TYR A 22 -2.274 1.227 26.833 1.00 10.00 C ATOM 311 O TYR A 22 -2.224 0.691 27.939 1.00 10.00 O ATOM 312 CB TYR A 22 -2.290 3.767 26.542 1.00 10.00 C ATOM 313 CG TYR A 22 -0.881 3.654 27.079 1.00 10.00 C ATOM 314 CD1 TYR A 22 -0.674 3.638 28.464 1.00 10.00 C ATOM 315 CD2 TYR A 22 0.210 3.504 26.203 1.00 10.00 C ATOM 316 CE1 TYR A 22 0.615 3.470 28.986 1.00 10.00 C ATOM 317 CE2 TYR A 22 1.510 3.363 26.717 1.00 10.00 C ATOM 318 CZ TYR A 22 1.720 3.367 28.114 1.00 10.00 C ATOM 319 OH TYR A 22 2.983 3.322 28.615 1.00 10.00 O ATOM 0 H TYR A 22 -3.973 1.988 28.460 1.00 10.00 H new ATOM 0 HA TYR A 22 -3.602 2.380 25.624 1.00 10.00 H new ATOM 0 HB2 TYR A 22 -2.240 4.099 25.505 1.00 10.00 H new ATOM 0 HB3 TYR A 22 -2.812 4.544 27.101 1.00 10.00 H new ATOM 0 HD1 TYR A 22 -1.513 3.756 29.134 1.00 10.00 H new ATOM 0 HD2 TYR A 22 0.048 3.497 25.135 1.00 10.00 H new ATOM 0 HE1 TYR A 22 0.763 3.419 30.055 1.00 10.00 H new ATOM 0 HE2 TYR A 22 2.348 3.252 26.045 1.00 10.00 H new ATOM 0 HH TYR A 22 3.278 4.229 28.839 1.00 10.00 H new ATOM 329 N VAL A 23 -1.600 0.767 25.788 1.00 10.00 N ATOM 330 CA VAL A 23 -0.697 -0.370 25.821 1.00 10.00 C ATOM 331 C VAL A 23 0.544 -0.013 24.990 1.00 10.00 C ATOM 332 O VAL A 23 0.466 0.769 24.033 1.00 10.00 O ATOM 333 CB VAL A 23 -1.474 -1.638 25.394 1.00 10.00 C ATOM 334 CG1 VAL A 23 -2.068 -1.536 23.982 1.00 10.00 C ATOM 335 CG2 VAL A 23 -0.659 -2.927 25.520 1.00 10.00 C ATOM 0 H VAL A 23 -1.671 1.191 24.863 1.00 10.00 H new ATOM 0 HA VAL A 23 -0.322 -0.602 26.818 1.00 10.00 H new ATOM 0 HB VAL A 23 -2.297 -1.693 26.107 1.00 10.00 H new ATOM 0 HG11 VAL A 23 -2.600 -2.457 23.744 1.00 10.00 H new ATOM 0 HG12 VAL A 23 -2.761 -0.695 23.938 1.00 10.00 H new ATOM 0 HG13 VAL A 23 -1.266 -1.383 23.260 1.00 10.00 H new ATOM 0 HG21 VAL A 23 -1.267 -3.774 25.204 1.00 10.00 H new ATOM 0 HG22 VAL A 23 0.227 -2.860 24.889 1.00 10.00 H new ATOM 0 HG23 VAL A 23 -0.355 -3.066 26.558 1.00 10.00 H new ATOM 345 N LEU A 24 1.692 -0.565 25.383 1.00 10.00 N ATOM 346 CA LEU A 24 2.979 -0.372 24.731 1.00 10.00 C ATOM 347 C LEU A 24 3.307 -1.704 24.072 1.00 10.00 C ATOM 348 O LEU A 24 3.398 -2.720 24.765 1.00 10.00 O ATOM 349 CB LEU A 24 4.031 0.032 25.783 1.00 10.00 C ATOM 350 CG LEU A 24 5.475 0.119 25.243 1.00 10.00 C ATOM 351 CD1 LEU A 24 5.613 1.116 24.085 1.00 10.00 C ATOM 352 CD2 LEU A 24 6.417 0.538 26.374 1.00 10.00 C ATOM 0 H LEU A 24 1.749 -1.181 26.194 1.00 10.00 H new ATOM 0 HA LEU A 24 2.964 0.424 23.987 1.00 10.00 H new ATOM 0 HB2 LEU A 24 3.754 0.999 26.202 1.00 10.00 H new ATOM 0 HB3 LEU A 24 4.005 -0.689 26.600 1.00 10.00 H new ATOM 0 HG LEU A 24 5.737 -0.868 24.863 1.00 10.00 H new ATOM 0 HD11 LEU A 24 6.648 1.137 23.744 1.00 10.00 H new ATOM 0 HD12 LEU A 24 4.966 0.810 23.263 1.00 10.00 H new ATOM 0 HD13 LEU A 24 5.323 2.110 24.424 1.00 10.00 H new ATOM 0 HD21 LEU A 24 7.437 0.600 25.994 1.00 10.00 H new ATOM 0 HD22 LEU A 24 6.113 1.512 26.758 1.00 10.00 H new ATOM 0 HD23 LEU A 24 6.373 -0.199 27.176 1.00 10.00 H new ATOM 364 N ILE A 25 3.447 -1.721 22.748 1.00 10.00 N ATOM 365 CA ILE A 25 3.536 -2.960 21.989 1.00 10.00 C ATOM 366 C ILE A 25 4.839 -2.919 21.192 1.00 10.00 C ATOM 367 O ILE A 25 5.101 -1.959 20.465 1.00 10.00 O ATOM 368 CB ILE A 25 2.271 -3.142 21.113 1.00 10.00 C ATOM 369 CG1 ILE A 25 0.970 -3.043 21.950 1.00 10.00 C ATOM 370 CG2 ILE A 25 2.323 -4.494 20.386 1.00 10.00 C ATOM 371 CD1 ILE A 25 -0.328 -3.318 21.174 1.00 10.00 C ATOM 0 H ILE A 25 3.501 -0.878 22.176 1.00 10.00 H new ATOM 0 HA ILE A 25 3.565 -3.834 22.639 1.00 10.00 H new ATOM 0 HB ILE A 25 2.258 -2.334 20.382 1.00 10.00 H new ATOM 0 HG12 ILE A 25 1.035 -3.748 22.779 1.00 10.00 H new ATOM 0 HG13 ILE A 25 0.911 -2.045 22.384 1.00 10.00 H new ATOM 0 HG21 ILE A 25 1.429 -4.612 19.773 1.00 10.00 H new ATOM 0 HG22 ILE A 25 3.207 -4.531 19.750 1.00 10.00 H new ATOM 0 HG23 ILE A 25 2.369 -5.300 21.119 1.00 10.00 H new ATOM 0 HD11 ILE A 25 -1.181 -3.224 21.846 1.00 10.00 H new ATOM 0 HD12 ILE A 25 -0.426 -2.598 20.362 1.00 10.00 H new ATOM 0 HD13 ILE A 25 -0.299 -4.327 20.763 1.00 10.00 H new ATOM 383 N ARG A 26 5.669 -3.945 21.349 1.00 10.00 N ATOM 384 CA ARG A 26 6.815 -4.184 20.488 1.00 10.00 C ATOM 385 C ARG A 26 6.233 -4.772 19.212 1.00 10.00 C ATOM 386 O ARG A 26 5.429 -5.698 19.282 1.00 10.00 O ATOM 387 CB ARG A 26 7.787 -5.137 21.218 1.00 10.00 C ATOM 388 CG ARG A 26 8.717 -6.014 20.360 1.00 10.00 C ATOM 389 CD ARG A 26 9.742 -5.284 19.486 1.00 10.00 C ATOM 390 NE ARG A 26 10.691 -4.461 20.251 1.00 10.00 N ATOM 391 CZ ARG A 26 11.796 -4.869 20.885 1.00 10.00 C ATOM 392 NH1 ARG A 26 12.114 -6.164 20.978 1.00 10.00 N ATOM 393 NH2 ARG A 26 12.594 -3.950 21.407 1.00 10.00 N ATOM 0 H ARG A 26 5.561 -4.640 22.087 1.00 10.00 H new ATOM 0 HA ARG A 26 7.392 -3.291 20.247 1.00 10.00 H new ATOM 0 HB2 ARG A 26 8.411 -4.536 21.880 1.00 10.00 H new ATOM 0 HB3 ARG A 26 7.195 -5.798 21.851 1.00 10.00 H new ATOM 0 HG2 ARG A 26 9.256 -6.689 21.025 1.00 10.00 H new ATOM 0 HG3 ARG A 26 8.097 -6.633 19.712 1.00 10.00 H new ATOM 0 HD2 ARG A 26 10.299 -6.018 18.904 1.00 10.00 H new ATOM 0 HD3 ARG A 26 9.214 -4.648 18.776 1.00 10.00 H new ATOM 0 HE ARG A 26 10.482 -3.464 20.304 1.00 10.00 H new ATOM 0 HH11 ARG A 26 11.508 -6.869 20.559 1.00 10.00 H new ATOM 0 HH12 ARG A 26 12.963 -6.447 21.467 1.00 10.00 H new ATOM 0 HH21 ARG A 26 12.359 -2.961 21.320 1.00 10.00 H new ATOM 0 HH22 ARG A 26 13.444 -4.231 21.896 1.00 10.00 H new ATOM 407 N VAL A 27 6.633 -4.256 18.061 1.00 10.00 N ATOM 408 CA VAL A 27 6.173 -4.693 16.758 1.00 10.00 C ATOM 409 C VAL A 27 7.402 -5.173 15.993 1.00 10.00 C ATOM 410 O VAL A 27 8.444 -4.513 16.022 1.00 10.00 O ATOM 411 CB VAL A 27 5.363 -3.566 16.078 1.00 10.00 C ATOM 412 CG1 VAL A 27 6.093 -2.213 16.004 1.00 10.00 C ATOM 413 CG2 VAL A 27 4.917 -3.965 14.664 1.00 10.00 C ATOM 0 H VAL A 27 7.310 -3.495 18.009 1.00 10.00 H new ATOM 0 HA VAL A 27 5.474 -5.528 16.808 1.00 10.00 H new ATOM 0 HB VAL A 27 4.497 -3.431 16.725 1.00 10.00 H new ATOM 0 HG11 VAL A 27 5.453 -1.481 15.512 1.00 10.00 H new ATOM 0 HG12 VAL A 27 6.328 -1.871 17.012 1.00 10.00 H new ATOM 0 HG13 VAL A 27 7.016 -2.328 15.435 1.00 10.00 H new ATOM 0 HG21 VAL A 27 4.350 -3.148 14.217 1.00 10.00 H new ATOM 0 HG22 VAL A 27 5.794 -4.176 14.052 1.00 10.00 H new ATOM 0 HG23 VAL A 27 4.290 -4.855 14.718 1.00 10.00 H new ATOM 423 N HIS A 28 7.282 -6.318 15.330 1.00 10.00 N ATOM 424 CA HIS A 28 8.318 -6.977 14.547 1.00 10.00 C ATOM 425 C HIS A 28 7.866 -6.968 13.090 1.00 10.00 C ATOM 426 O HIS A 28 6.663 -7.021 12.835 1.00 10.00 O ATOM 427 CB HIS A 28 8.458 -8.438 14.999 1.00 10.00 C ATOM 428 CG HIS A 28 8.703 -8.644 16.473 1.00 10.00 C ATOM 429 ND1 HIS A 28 9.897 -8.454 17.130 1.00 10.00 N ATOM 430 CD2 HIS A 28 7.814 -9.151 17.384 1.00 10.00 C ATOM 431 CE1 HIS A 28 9.739 -8.859 18.399 1.00 10.00 C ATOM 432 NE2 HIS A 28 8.484 -9.273 18.608 1.00 10.00 N ATOM 0 H HIS A 28 6.406 -6.841 15.325 1.00 10.00 H new ATOM 0 HA HIS A 28 9.271 -6.464 14.675 1.00 10.00 H new ATOM 0 HB2 HIS A 28 7.550 -8.974 14.722 1.00 10.00 H new ATOM 0 HB3 HIS A 28 9.279 -8.894 14.445 1.00 10.00 H new ATOM 0 HD2 HIS A 28 6.783 -9.410 17.193 1.00 10.00 H new ATOM 0 HE1 HIS A 28 10.517 -8.852 19.148 1.00 10.00 H new ATOM 0 HE2 HIS A 28 8.092 -9.611 19.487 1.00 10.00 H new ATOM 440 N SER A 29 8.802 -6.946 12.137 1.00 10.00 N ATOM 441 CA SER A 29 8.475 -6.774 10.720 1.00 10.00 C ATOM 442 C SER A 29 8.738 -8.023 9.875 1.00 10.00 C ATOM 443 O SER A 29 9.742 -8.713 10.046 1.00 10.00 O ATOM 444 CB SER A 29 9.220 -5.557 10.163 1.00 10.00 C ATOM 445 OG SER A 29 10.614 -5.643 10.351 1.00 10.00 O ATOM 0 H SER A 29 9.800 -7.046 12.324 1.00 10.00 H new ATOM 0 HA SER A 29 7.400 -6.605 10.657 1.00 10.00 H new ATOM 0 HB2 SER A 29 9.006 -5.460 9.099 1.00 10.00 H new ATOM 0 HB3 SER A 29 8.847 -4.654 10.647 1.00 10.00 H new ATOM 0 HG SER A 29 10.826 -5.499 11.297 1.00 10.00 H new ATOM 451 N ALA A 30 7.851 -8.274 8.914 1.00 10.00 N ATOM 452 CA ALA A 30 7.996 -9.240 7.835 1.00 10.00 C ATOM 453 C ALA A 30 7.127 -8.731 6.669 1.00 10.00 C ATOM 454 O ALA A 30 6.082 -9.321 6.389 1.00 10.00 O ATOM 455 CB ALA A 30 7.595 -10.640 8.310 1.00 10.00 C ATOM 0 H ALA A 30 6.961 -7.778 8.868 1.00 10.00 H new ATOM 0 HA ALA A 30 9.031 -9.330 7.505 1.00 10.00 H new ATOM 0 HB1 ALA A 30 7.710 -11.349 7.490 1.00 10.00 H new ATOM 0 HB2 ALA A 30 8.234 -10.939 9.141 1.00 10.00 H new ATOM 0 HB3 ALA A 30 6.555 -10.629 8.638 1.00 10.00 H new ATOM 461 N PRO A 31 7.489 -7.577 6.070 1.00 10.00 N ATOM 462 CA PRO A 31 6.672 -6.820 5.125 1.00 10.00 C ATOM 463 C PRO A 31 5.928 -7.684 4.108 1.00 10.00 C ATOM 464 O PRO A 31 6.516 -8.569 3.486 1.00 10.00 O ATOM 465 CB PRO A 31 7.630 -5.839 4.449 1.00 10.00 C ATOM 466 CG PRO A 31 8.686 -5.582 5.520 1.00 10.00 C ATOM 467 CD PRO A 31 8.780 -6.923 6.242 1.00 10.00 C ATOM 0 HA PRO A 31 5.867 -6.311 5.656 1.00 10.00 H new ATOM 0 HB2 PRO A 31 8.069 -6.263 3.546 1.00 10.00 H new ATOM 0 HB3 PRO A 31 7.123 -4.920 4.156 1.00 10.00 H new ATOM 0 HG2 PRO A 31 9.641 -5.292 5.083 1.00 10.00 H new ATOM 0 HG3 PRO A 31 8.388 -4.780 6.196 1.00 10.00 H new ATOM 0 HD2 PRO A 31 9.582 -7.532 5.826 1.00 10.00 H new ATOM 0 HD3 PRO A 31 9.004 -6.780 7.299 1.00 10.00 H new ATOM 475 N ARG A 32 4.632 -7.398 3.920 1.00 10.00 N ATOM 476 CA ARG A 32 3.725 -8.117 3.017 1.00 10.00 C ATOM 477 C ARG A 32 3.761 -9.648 3.216 1.00 10.00 C ATOM 478 O ARG A 32 3.396 -10.383 2.303 1.00 10.00 O ATOM 479 CB ARG A 32 3.995 -7.622 1.574 1.00 10.00 C ATOM 480 CG ARG A 32 3.012 -8.032 0.457 1.00 10.00 C ATOM 481 CD ARG A 32 1.523 -7.934 0.817 1.00 10.00 C ATOM 482 NE ARG A 32 1.155 -6.597 1.324 1.00 10.00 N ATOM 483 CZ ARG A 32 0.481 -6.336 2.453 1.00 10.00 C ATOM 484 NH1 ARG A 32 -0.025 -7.317 3.194 1.00 10.00 N ATOM 485 NH2 ARG A 32 0.296 -5.083 2.847 1.00 10.00 N ATOM 0 H ARG A 32 4.171 -6.632 4.411 1.00 10.00 H new ATOM 0 HA ARG A 32 2.687 -7.885 3.256 1.00 10.00 H new ATOM 0 HB2 ARG A 32 4.032 -6.533 1.599 1.00 10.00 H new ATOM 0 HB3 ARG A 32 4.987 -7.968 1.285 1.00 10.00 H new ATOM 0 HG2 ARG A 32 3.199 -7.405 -0.415 1.00 10.00 H new ATOM 0 HG3 ARG A 32 3.230 -9.059 0.164 1.00 10.00 H new ATOM 0 HD2 ARG A 32 0.923 -8.164 -0.063 1.00 10.00 H new ATOM 0 HD3 ARG A 32 1.284 -8.684 1.571 1.00 10.00 H new ATOM 0 HE ARG A 32 1.441 -5.796 0.762 1.00 10.00 H new ATOM 0 HH11 ARG A 32 0.097 -8.288 2.907 1.00 10.00 H new ATOM 0 HH12 ARG A 32 -0.535 -7.099 4.050 1.00 10.00 H new ATOM 0 HH21 ARG A 32 0.667 -4.313 2.290 1.00 10.00 H new ATOM 0 HH22 ARG A 32 -0.218 -4.889 3.707 1.00 10.00 H new ATOM 499 N SER A 33 4.161 -10.119 4.400 1.00 10.00 N ATOM 500 CA SER A 33 4.367 -11.528 4.713 1.00 10.00 C ATOM 501 C SER A 33 5.286 -12.216 3.685 1.00 10.00 C ATOM 502 O SER A 33 5.111 -13.397 3.389 1.00 10.00 O ATOM 503 CB SER A 33 3.008 -12.218 4.911 1.00 10.00 C ATOM 504 OG SER A 33 2.189 -11.476 5.805 1.00 10.00 O ATOM 0 H SER A 33 4.356 -9.506 5.191 1.00 10.00 H new ATOM 0 HA SER A 33 4.905 -11.617 5.657 1.00 10.00 H new ATOM 0 HB2 SER A 33 2.504 -12.321 3.950 1.00 10.00 H new ATOM 0 HB3 SER A 33 3.160 -13.225 5.301 1.00 10.00 H new ATOM 0 HG SER A 33 1.329 -11.932 5.915 1.00 10.00 H new ATOM 510 N GLY A 34 6.257 -11.479 3.129 1.00 10.00 N ATOM 511 CA GLY A 34 7.078 -11.937 2.016 1.00 10.00 C ATOM 512 C GLY A 34 8.405 -11.188 1.911 1.00 10.00 C ATOM 513 O GLY A 34 8.965 -11.101 0.821 1.00 10.00 O ATOM 0 H GLY A 34 6.492 -10.539 3.448 1.00 10.00 H new ATOM 0 HA2 GLY A 34 7.276 -13.003 2.131 1.00 10.00 H new ATOM 0 HA3 GLY A 34 6.522 -11.814 1.086 1.00 10.00 H new ATOM 517 N ALA A 35 8.924 -10.652 3.023 1.00 10.00 N ATOM 518 CA ALA A 35 10.245 -10.042 3.100 1.00 10.00 C ATOM 519 C ALA A 35 10.830 -10.353 4.486 1.00 10.00 C ATOM 520 O ALA A 35 10.140 -10.136 5.484 1.00 10.00 O ATOM 521 CB ALA A 35 10.136 -8.529 2.881 1.00 10.00 C ATOM 0 H ALA A 35 8.421 -10.633 3.910 1.00 10.00 H new ATOM 0 HA ALA A 35 10.899 -10.443 2.326 1.00 10.00 H new ATOM 0 HB1 ALA A 35 11.128 -8.080 2.940 1.00 10.00 H new ATOM 0 HB2 ALA A 35 9.707 -8.334 1.898 1.00 10.00 H new ATOM 0 HB3 ALA A 35 9.495 -8.095 3.649 1.00 10.00 H new ATOM 527 N PRO A 36 12.083 -10.835 4.586 1.00 10.00 N ATOM 528 CA PRO A 36 12.682 -11.347 5.823 1.00 10.00 C ATOM 529 C PRO A 36 13.327 -10.240 6.674 1.00 10.00 C ATOM 530 O PRO A 36 14.371 -10.454 7.283 1.00 10.00 O ATOM 531 CB PRO A 36 13.718 -12.363 5.319 1.00 10.00 C ATOM 532 CG PRO A 36 14.272 -11.623 4.101 1.00 10.00 C ATOM 533 CD PRO A 36 12.994 -11.078 3.473 1.00 10.00 C ATOM 0 HA PRO A 36 11.942 -11.787 6.491 1.00 10.00 H new ATOM 0 HB2 PRO A 36 14.488 -12.572 6.062 1.00 10.00 H new ATOM 0 HB3 PRO A 36 13.265 -13.318 5.052 1.00 10.00 H new ATOM 0 HG2 PRO A 36 14.963 -10.828 4.383 1.00 10.00 H new ATOM 0 HG3 PRO A 36 14.810 -12.288 3.426 1.00 10.00 H new ATOM 0 HD2 PRO A 36 13.190 -10.160 2.919 1.00 10.00 H new ATOM 0 HD3 PRO A 36 12.569 -11.791 2.767 1.00 10.00 H new ATOM 541 N ALA A 37 12.752 -9.038 6.636 1.00 10.00 N ATOM 542 CA ALA A 37 13.361 -7.833 7.190 1.00 10.00 C ATOM 543 C ALA A 37 13.689 -7.977 8.684 1.00 10.00 C ATOM 544 O ALA A 37 14.806 -7.673 9.089 1.00 10.00 O ATOM 545 CB ALA A 37 12.430 -6.653 6.915 1.00 10.00 C ATOM 0 H ALA A 37 11.838 -8.874 6.214 1.00 10.00 H new ATOM 0 HA ALA A 37 14.320 -7.659 6.703 1.00 10.00 H new ATOM 0 HB1 ALA A 37 12.868 -5.742 7.322 1.00 10.00 H new ATOM 0 HB2 ALA A 37 12.293 -6.541 5.840 1.00 10.00 H new ATOM 0 HB3 ALA A 37 11.464 -6.834 7.387 1.00 10.00 H new ATOM 551 N ALA A 38 12.734 -8.506 9.464 1.00 10.00 N ATOM 552 CA ALA A 38 12.857 -8.848 10.880 1.00 10.00 C ATOM 553 C ALA A 38 13.454 -7.742 11.764 1.00 10.00 C ATOM 554 O ALA A 38 14.044 -8.026 12.810 1.00 10.00 O ATOM 555 CB ALA A 38 13.562 -10.204 11.022 1.00 10.00 C ATOM 0 H ALA A 38 11.805 -8.716 9.098 1.00 10.00 H new ATOM 0 HA ALA A 38 11.847 -8.941 11.278 1.00 10.00 H new ATOM 0 HB1 ALA A 38 13.653 -10.458 12.078 1.00 10.00 H new ATOM 0 HB2 ALA A 38 12.979 -10.972 10.513 1.00 10.00 H new ATOM 0 HB3 ALA A 38 14.555 -10.146 10.576 1.00 10.00 H new ATOM 561 N GLU A 39 13.269 -6.478 11.382 1.00 10.00 N ATOM 562 CA GLU A 39 13.552 -5.341 12.246 1.00 10.00 C ATOM 563 C GLU A 39 12.376 -5.228 13.218 1.00 10.00 C ATOM 564 O GLU A 39 11.286 -5.741 12.933 1.00 10.00 O ATOM 565 CB GLU A 39 13.711 -4.053 11.417 1.00 10.00 C ATOM 566 CG GLU A 39 14.961 -4.081 10.522 1.00 10.00 C ATOM 567 CD GLU A 39 15.190 -2.734 9.807 1.00 10.00 C ATOM 568 OE1 GLU A 39 15.822 -1.847 10.425 1.00 10.00 O ATOM 569 OE2 GLU A 39 14.749 -2.603 8.646 1.00 10.00 O ATOM 0 H GLU A 39 12.917 -6.217 10.461 1.00 10.00 H new ATOM 0 HA GLU A 39 14.488 -5.482 12.786 1.00 10.00 H new ATOM 0 HB2 GLU A 39 12.826 -3.913 10.796 1.00 10.00 H new ATOM 0 HB3 GLU A 39 13.768 -3.197 12.089 1.00 10.00 H new ATOM 0 HG2 GLU A 39 15.835 -4.323 11.127 1.00 10.00 H new ATOM 0 HG3 GLU A 39 14.858 -4.872 9.780 1.00 10.00 H new ATOM 576 N SER A 40 12.548 -4.543 14.350 1.00 10.00 N ATOM 577 CA SER A 40 11.470 -4.335 15.313 1.00 10.00 C ATOM 578 C SER A 40 11.572 -2.940 15.944 1.00 10.00 C ATOM 579 O SER A 40 12.656 -2.365 15.986 1.00 10.00 O ATOM 580 CB SER A 40 11.503 -5.430 16.390 1.00 10.00 C ATOM 581 OG SER A 40 11.795 -6.728 15.887 1.00 10.00 O ATOM 0 H SER A 40 13.435 -4.119 14.622 1.00 10.00 H new ATOM 0 HA SER A 40 10.516 -4.397 14.790 1.00 10.00 H new ATOM 0 HB2 SER A 40 12.249 -5.166 17.139 1.00 10.00 H new ATOM 0 HB3 SER A 40 10.538 -5.456 16.896 1.00 10.00 H new ATOM 0 HG SER A 40 11.117 -7.361 16.202 1.00 10.00 H new ATOM 587 N LYS A 41 10.456 -2.406 16.448 1.00 10.00 N ATOM 588 CA LYS A 41 10.392 -1.152 17.210 1.00 10.00 C ATOM 589 C LYS A 41 9.297 -1.257 18.271 1.00 10.00 C ATOM 590 O LYS A 41 8.658 -2.302 18.375 1.00 10.00 O ATOM 591 CB LYS A 41 10.212 0.072 16.283 1.00 10.00 C ATOM 592 CG LYS A 41 8.820 0.243 15.640 1.00 10.00 C ATOM 593 CD LYS A 41 8.687 1.642 15.017 1.00 10.00 C ATOM 594 CE LYS A 41 7.280 1.886 14.452 1.00 10.00 C ATOM 595 NZ LYS A 41 7.075 3.309 14.092 1.00 10.00 N ATOM 0 H LYS A 41 9.543 -2.847 16.334 1.00 10.00 H new ATOM 0 HA LYS A 41 11.342 -0.995 17.721 1.00 10.00 H new ATOM 0 HB2 LYS A 41 10.437 0.971 16.856 1.00 10.00 H new ATOM 0 HB3 LYS A 41 10.952 0.009 15.485 1.00 10.00 H new ATOM 0 HG2 LYS A 41 8.669 -0.519 14.875 1.00 10.00 H new ATOM 0 HG3 LYS A 41 8.044 0.097 16.392 1.00 10.00 H new ATOM 0 HD2 LYS A 41 8.912 2.397 15.770 1.00 10.00 H new ATOM 0 HD3 LYS A 41 9.423 1.756 14.221 1.00 10.00 H new ATOM 0 HE2 LYS A 41 7.128 1.262 13.571 1.00 10.00 H new ATOM 0 HE3 LYS A 41 6.535 1.585 15.188 1.00 10.00 H new ATOM 0 HZ1 LYS A 41 6.140 3.424 13.652 1.00 10.00 H new ATOM 0 HZ2 LYS A 41 7.129 3.895 14.949 1.00 10.00 H new ATOM 0 HZ3 LYS A 41 7.812 3.607 13.422 1.00 10.00 H new ATOM 609 N GLU A 42 9.016 -0.190 19.010 1.00 10.00 N ATOM 610 CA GLU A 42 7.907 -0.138 19.952 1.00 10.00 C ATOM 611 C GLU A 42 6.935 0.935 19.475 1.00 10.00 C ATOM 612 O GLU A 42 7.364 1.953 18.919 1.00 10.00 O ATOM 613 CB GLU A 42 8.385 0.170 21.381 1.00 10.00 C ATOM 614 CG GLU A 42 9.329 -0.880 21.987 1.00 10.00 C ATOM 615 CD GLU A 42 10.768 -0.796 21.451 1.00 10.00 C ATOM 616 OE1 GLU A 42 11.472 0.176 21.782 1.00 10.00 O ATOM 617 OE2 GLU A 42 11.170 -1.733 20.718 1.00 10.00 O ATOM 0 H GLU A 42 9.559 0.673 18.971 1.00 10.00 H new ATOM 0 HA GLU A 42 7.419 -1.112 19.987 1.00 10.00 H new ATOM 0 HB2 GLU A 42 8.892 1.135 21.379 1.00 10.00 H new ATOM 0 HB3 GLU A 42 7.513 0.269 22.027 1.00 10.00 H new ATOM 0 HG2 GLU A 42 9.346 -0.759 23.070 1.00 10.00 H new ATOM 0 HG3 GLU A 42 8.932 -1.874 21.783 1.00 10.00 H new ATOM 624 N ILE A 43 5.645 0.729 19.734 1.00 10.00 N ATOM 625 CA ILE A 43 4.566 1.643 19.370 1.00 10.00 C ATOM 626 C ILE A 43 3.624 1.846 20.560 1.00 10.00 C ATOM 627 O ILE A 43 3.419 0.934 21.364 1.00 10.00 O ATOM 628 CB ILE A 43 3.808 1.138 18.116 1.00 10.00 C ATOM 629 CG1 ILE A 43 3.306 -0.319 18.248 1.00 10.00 C ATOM 630 CG2 ILE A 43 4.695 1.307 16.872 1.00 10.00 C ATOM 631 CD1 ILE A 43 2.327 -0.770 17.158 1.00 10.00 C ATOM 0 H ILE A 43 5.312 -0.105 20.218 1.00 10.00 H new ATOM 0 HA ILE A 43 4.997 2.611 19.113 1.00 10.00 H new ATOM 0 HB ILE A 43 2.912 1.750 18.013 1.00 10.00 H new ATOM 0 HG12 ILE A 43 4.168 -0.986 18.239 1.00 10.00 H new ATOM 0 HG13 ILE A 43 2.823 -0.434 19.219 1.00 10.00 H new ATOM 0 HG21 ILE A 43 4.159 0.951 15.992 1.00 10.00 H new ATOM 0 HG22 ILE A 43 4.945 2.360 16.743 1.00 10.00 H new ATOM 0 HG23 ILE A 43 5.611 0.730 16.997 1.00 10.00 H new ATOM 0 HD11 ILE A 43 2.033 -1.804 17.338 1.00 10.00 H new ATOM 0 HD12 ILE A 43 1.443 -0.133 17.177 1.00 10.00 H new ATOM 0 HD13 ILE A 43 2.808 -0.694 16.183 1.00 10.00 H new ATOM 643 N VAL A 44 3.048 3.043 20.660 1.00 10.00 N ATOM 644 CA VAL A 44 2.163 3.451 21.751 1.00 10.00 C ATOM 645 C VAL A 44 0.747 3.504 21.175 1.00 10.00 C ATOM 646 O VAL A 44 0.529 4.170 20.154 1.00 10.00 O ATOM 647 CB VAL A 44 2.624 4.830 22.279 1.00 10.00 C ATOM 648 CG1 VAL A 44 1.803 5.299 23.486 1.00 10.00 C ATOM 649 CG2 VAL A 44 4.104 4.847 22.697 1.00 10.00 C ATOM 0 H VAL A 44 3.188 3.776 19.965 1.00 10.00 H new ATOM 0 HA VAL A 44 2.187 2.756 22.590 1.00 10.00 H new ATOM 0 HB VAL A 44 2.473 5.505 21.436 1.00 10.00 H new ATOM 0 HG11 VAL A 44 2.167 6.271 23.818 1.00 10.00 H new ATOM 0 HG12 VAL A 44 0.754 5.381 23.202 1.00 10.00 H new ATOM 0 HG13 VAL A 44 1.904 4.578 24.297 1.00 10.00 H new ATOM 0 HG21 VAL A 44 4.369 5.841 23.059 1.00 10.00 H new ATOM 0 HG22 VAL A 44 4.266 4.117 23.490 1.00 10.00 H new ATOM 0 HG23 VAL A 44 4.727 4.595 21.839 1.00 10.00 H new ATOM 659 N ARG A 45 -0.213 2.807 21.787 1.00 10.00 N ATOM 660 CA ARG A 45 -1.579 2.654 21.284 1.00 10.00 C ATOM 661 C ARG A 45 -2.517 2.901 22.454 1.00 10.00 C ATOM 662 O ARG A 45 -2.223 2.409 23.542 1.00 10.00 O ATOM 663 CB ARG A 45 -1.787 1.209 20.788 1.00 10.00 C ATOM 664 CG ARG A 45 -0.854 0.707 19.673 1.00 10.00 C ATOM 665 CD ARG A 45 -1.177 1.285 18.287 1.00 10.00 C ATOM 666 NE ARG A 45 -0.481 2.557 18.097 1.00 10.00 N ATOM 667 CZ ARG A 45 0.381 2.860 17.131 1.00 10.00 C ATOM 668 NH1 ARG A 45 0.429 2.207 15.971 1.00 10.00 N ATOM 669 NH2 ARG A 45 1.237 3.835 17.365 1.00 10.00 N ATOM 0 H ARG A 45 -0.057 2.321 22.670 1.00 10.00 H new ATOM 0 HA ARG A 45 -1.767 3.348 20.464 1.00 10.00 H new ATOM 0 HB2 ARG A 45 -1.682 0.540 21.642 1.00 10.00 H new ATOM 0 HB3 ARG A 45 -2.814 1.118 20.435 1.00 10.00 H new ATOM 0 HG2 ARG A 45 0.174 0.960 19.931 1.00 10.00 H new ATOM 0 HG3 ARG A 45 -0.912 -0.380 19.625 1.00 10.00 H new ATOM 0 HD2 ARG A 45 -0.879 0.579 17.512 1.00 10.00 H new ATOM 0 HD3 ARG A 45 -2.252 1.432 18.188 1.00 10.00 H new ATOM 0 HE ARG A 45 -0.678 3.290 18.778 1.00 10.00 H new ATOM 0 HH11 ARG A 45 -0.215 1.436 15.793 1.00 10.00 H new ATOM 0 HH12 ARG A 45 1.109 2.478 15.261 1.00 10.00 H new ATOM 0 HH21 ARG A 45 1.221 4.324 18.260 1.00 10.00 H new ATOM 0 HH22 ARG A 45 1.916 4.100 16.651 1.00 10.00 H new ATOM 683 N GLY A 46 -3.652 3.565 22.272 1.00 10.00 N ATOM 684 CA GLY A 46 -4.635 3.689 23.340 1.00 10.00 C ATOM 685 C GLY A 46 -5.925 4.304 22.839 1.00 10.00 C ATOM 686 O GLY A 46 -5.892 5.394 22.279 1.00 10.00 O ATOM 0 H GLY A 46 -3.913 4.024 21.399 1.00 10.00 H new ATOM 0 HA2 GLY A 46 -4.840 2.706 23.763 1.00 10.00 H new ATOM 0 HA3 GLY A 46 -4.226 4.303 24.143 1.00 10.00 H new ATOM 690 N TYR A 47 -7.052 3.618 23.049 1.00 10.00 N ATOM 691 CA TYR A 47 -8.353 4.088 22.585 1.00 10.00 C ATOM 692 C TYR A 47 -9.454 3.715 23.577 1.00 10.00 C ATOM 693 O TYR A 47 -9.522 2.570 24.034 1.00 10.00 O ATOM 694 CB TYR A 47 -8.691 3.472 21.224 1.00 10.00 C ATOM 695 CG TYR A 47 -7.556 3.348 20.222 1.00 10.00 C ATOM 696 CD1 TYR A 47 -7.289 4.382 19.306 1.00 10.00 C ATOM 697 CD2 TYR A 47 -6.804 2.158 20.175 1.00 10.00 C ATOM 698 CE1 TYR A 47 -6.287 4.216 18.332 1.00 10.00 C ATOM 699 CE2 TYR A 47 -5.806 1.982 19.202 1.00 10.00 C ATOM 700 CZ TYR A 47 -5.548 3.011 18.271 1.00 10.00 C ATOM 701 OH TYR A 47 -4.633 2.783 17.285 1.00 10.00 O ATOM 0 H TYR A 47 -7.085 2.726 23.543 1.00 10.00 H new ATOM 0 HA TYR A 47 -8.298 5.173 22.497 1.00 10.00 H new ATOM 0 HB2 TYR A 47 -9.102 2.477 21.395 1.00 10.00 H new ATOM 0 HB3 TYR A 47 -9.481 4.069 20.769 1.00 10.00 H new ATOM 0 HD1 TYR A 47 -7.853 5.302 19.350 1.00 10.00 H new ATOM 0 HD2 TYR A 47 -6.996 1.374 20.893 1.00 10.00 H new ATOM 0 HE1 TYR A 47 -6.082 5.010 17.629 1.00 10.00 H new ATOM 0 HE2 TYR A 47 -5.239 1.064 19.167 1.00 10.00 H new ATOM 0 HH TYR A 47 -4.814 3.377 16.527 1.00 10.00 H new ATOM 711 N LYS A 48 -10.354 4.665 23.867 1.00 10.00 N ATOM 712 CA LYS A 48 -11.345 4.528 24.937 1.00 10.00 C ATOM 713 C LYS A 48 -12.369 3.425 24.667 1.00 10.00 C ATOM 714 O LYS A 48 -12.938 2.912 25.626 1.00 10.00 O ATOM 715 CB LYS A 48 -12.024 5.887 25.193 1.00 10.00 C ATOM 716 CG LYS A 48 -12.758 5.928 26.546 1.00 10.00 C ATOM 717 CD LYS A 48 -12.955 7.353 27.085 1.00 10.00 C ATOM 718 CE LYS A 48 -13.784 8.243 26.147 1.00 10.00 C ATOM 719 NZ LYS A 48 -13.893 9.627 26.666 1.00 10.00 N ATOM 0 H LYS A 48 -10.413 5.550 23.364 1.00 10.00 H new ATOM 0 HA LYS A 48 -10.817 4.218 25.839 1.00 10.00 H new ATOM 0 HB2 LYS A 48 -11.273 6.677 25.165 1.00 10.00 H new ATOM 0 HB3 LYS A 48 -12.733 6.093 24.391 1.00 10.00 H new ATOM 0 HG2 LYS A 48 -13.731 5.449 26.439 1.00 10.00 H new ATOM 0 HG3 LYS A 48 -12.195 5.345 27.275 1.00 10.00 H new ATOM 0 HD2 LYS A 48 -13.446 7.303 28.057 1.00 10.00 H new ATOM 0 HD3 LYS A 48 -11.980 7.813 27.244 1.00 10.00 H new ATOM 0 HE2 LYS A 48 -13.324 8.259 25.159 1.00 10.00 H new ATOM 0 HE3 LYS A 48 -14.781 7.819 26.028 1.00 10.00 H new ATOM 0 HZ1 LYS A 48 -14.459 10.201 26.009 1.00 10.00 H new ATOM 0 HZ2 LYS A 48 -14.354 9.613 27.598 1.00 10.00 H new ATOM 0 HZ3 LYS A 48 -12.943 10.040 26.756 1.00 10.00 H new ATOM 733 N TRP A 49 -12.638 3.082 23.402 1.00 10.00 N ATOM 734 CA TRP A 49 -13.604 2.039 23.067 1.00 10.00 C ATOM 735 C TRP A 49 -13.185 0.654 23.584 1.00 10.00 C ATOM 736 O TRP A 49 -14.047 -0.207 23.714 1.00 10.00 O ATOM 737 CB TRP A 49 -13.898 2.023 21.555 1.00 10.00 C ATOM 738 CG TRP A 49 -12.725 2.056 20.614 1.00 10.00 C ATOM 739 CD1 TRP A 49 -12.396 3.101 19.821 1.00 10.00 C ATOM 740 CD2 TRP A 49 -11.705 1.035 20.357 1.00 10.00 C ATOM 741 NE1 TRP A 49 -11.251 2.813 19.110 1.00 10.00 N ATOM 742 CE2 TRP A 49 -10.752 1.575 19.444 1.00 10.00 C ATOM 743 CE3 TRP A 49 -11.458 -0.277 20.814 1.00 10.00 C ATOM 744 CZ2 TRP A 49 -9.575 0.902 19.091 1.00 10.00 C ATOM 745 CZ3 TRP A 49 -10.267 -0.956 20.489 1.00 10.00 C ATOM 746 CH2 TRP A 49 -9.310 -0.353 19.657 1.00 10.00 C ATOM 0 H TRP A 49 -12.196 3.517 22.592 1.00 10.00 H new ATOM 0 HA TRP A 49 -14.531 2.285 23.585 1.00 10.00 H new ATOM 0 HB2 TRP A 49 -14.479 1.127 21.336 1.00 10.00 H new ATOM 0 HB3 TRP A 49 -14.534 2.879 21.328 1.00 10.00 H new ATOM 0 HD1 TRP A 49 -12.950 4.026 19.755 1.00 10.00 H new ATOM 0 HE1 TRP A 49 -10.828 3.438 18.424 1.00 10.00 H new ATOM 0 HE3 TRP A 49 -12.198 -0.771 21.426 1.00 10.00 H new ATOM 0 HZ2 TRP A 49 -8.881 1.344 18.392 1.00 10.00 H new ATOM 0 HZ3 TRP A 49 -10.089 -1.946 20.882 1.00 10.00 H new ATOM 0 HH2 TRP A 49 -8.375 -0.853 19.454 1.00 10.00 H new ATOM 757 N ALA A 50 -11.898 0.429 23.882 1.00 10.00 N ATOM 758 CA ALA A 50 -11.421 -0.858 24.357 1.00 10.00 C ATOM 759 C ALA A 50 -11.978 -1.130 25.754 1.00 10.00 C ATOM 760 O ALA A 50 -11.697 -0.385 26.706 1.00 10.00 O ATOM 761 CB ALA A 50 -9.892 -0.877 24.359 1.00 10.00 C ATOM 0 H ALA A 50 -11.168 1.137 23.798 1.00 10.00 H new ATOM 0 HA ALA A 50 -11.769 -1.647 23.690 1.00 10.00 H new ATOM 0 HB1 ALA A 50 -9.541 -1.845 24.716 1.00 10.00 H new ATOM 0 HB2 ALA A 50 -9.525 -0.709 23.347 1.00 10.00 H new ATOM 0 HB3 ALA A 50 -9.519 -0.091 25.016 1.00 10.00 H new ATOM 767 N GLU A 51 -12.725 -2.227 25.901 1.00 10.00 N ATOM 768 CA GLU A 51 -13.266 -2.656 27.191 1.00 10.00 C ATOM 769 C GLU A 51 -12.128 -3.079 28.126 1.00 10.00 C ATOM 770 O GLU A 51 -12.167 -2.796 29.324 1.00 10.00 O ATOM 771 CB GLU A 51 -14.260 -3.815 27.000 1.00 10.00 C ATOM 772 CG GLU A 51 -15.518 -3.392 26.223 1.00 10.00 C ATOM 773 CD GLU A 51 -16.546 -4.537 26.128 1.00 10.00 C ATOM 774 OE1 GLU A 51 -16.463 -5.346 25.178 1.00 10.00 O ATOM 775 OE2 GLU A 51 -17.431 -4.602 27.009 1.00 10.00 O ATOM 0 H GLU A 51 -12.972 -2.843 25.127 1.00 10.00 H new ATOM 0 HA GLU A 51 -13.797 -1.818 27.642 1.00 10.00 H new ATOM 0 HB2 GLU A 51 -13.766 -4.629 26.469 1.00 10.00 H new ATOM 0 HB3 GLU A 51 -14.553 -4.202 27.976 1.00 10.00 H new ATOM 0 HG2 GLU A 51 -15.976 -2.533 26.713 1.00 10.00 H new ATOM 0 HG3 GLU A 51 -15.235 -3.074 25.220 1.00 10.00 H new ATOM 782 N TYR A 52 -11.068 -3.667 27.562 1.00 10.00 N ATOM 783 CA TYR A 52 -9.865 -4.128 28.240 1.00 10.00 C ATOM 784 C TYR A 52 -8.701 -3.946 27.268 1.00 10.00 C ATOM 785 O TYR A 52 -8.902 -3.908 26.057 1.00 10.00 O ATOM 786 CB TYR A 52 -9.999 -5.613 28.620 1.00 10.00 C ATOM 787 CG TYR A 52 -11.150 -5.934 29.557 1.00 10.00 C ATOM 788 CD1 TYR A 52 -11.011 -5.722 30.943 1.00 10.00 C ATOM 789 CD2 TYR A 52 -12.362 -6.437 29.044 1.00 10.00 C ATOM 790 CE1 TYR A 52 -12.082 -6.002 31.812 1.00 10.00 C ATOM 791 CE2 TYR A 52 -13.438 -6.719 29.907 1.00 10.00 C ATOM 792 CZ TYR A 52 -13.303 -6.498 31.298 1.00 10.00 C ATOM 793 OH TYR A 52 -14.333 -6.769 32.148 1.00 10.00 O ATOM 0 H TYR A 52 -11.031 -3.842 26.558 1.00 10.00 H new ATOM 0 HA TYR A 52 -9.703 -3.561 29.157 1.00 10.00 H new ATOM 0 HB2 TYR A 52 -10.120 -6.197 27.707 1.00 10.00 H new ATOM 0 HB3 TYR A 52 -9.069 -5.939 29.086 1.00 10.00 H new ATOM 0 HD1 TYR A 52 -10.080 -5.344 31.339 1.00 10.00 H new ATOM 0 HD2 TYR A 52 -12.466 -6.607 27.983 1.00 10.00 H new ATOM 0 HE1 TYR A 52 -11.971 -5.838 32.874 1.00 10.00 H new ATOM 0 HE2 TYR A 52 -14.365 -7.103 29.508 1.00 10.00 H new ATOM 0 HH TYR A 52 -15.100 -7.101 31.637 1.00 10.00 H new ATOM 803 N HIS A 53 -7.470 -3.873 27.776 1.00 10.00 N ATOM 804 CA HIS A 53 -6.277 -3.623 26.963 1.00 10.00 C ATOM 805 C HIS A 53 -6.073 -4.672 25.864 1.00 10.00 C ATOM 806 O HIS A 53 -5.540 -4.340 24.806 1.00 10.00 O ATOM 807 CB HIS A 53 -5.048 -3.555 27.875 1.00 10.00 C ATOM 808 CG HIS A 53 -5.176 -2.497 28.939 1.00 10.00 C ATOM 809 ND1 HIS A 53 -5.819 -2.651 30.172 1.00 10.00 N ATOM 810 CD2 HIS A 53 -4.675 -1.234 28.859 1.00 10.00 C ATOM 811 CE1 HIS A 53 -5.682 -1.473 30.804 1.00 10.00 C ATOM 812 NE2 HIS A 53 -4.988 -0.611 30.042 1.00 10.00 N ATOM 0 H HIS A 53 -7.270 -3.986 28.770 1.00 10.00 H new ATOM 0 HA HIS A 53 -6.419 -2.670 26.454 1.00 10.00 H new ATOM 0 HB2 HIS A 53 -4.897 -4.525 28.348 1.00 10.00 H new ATOM 0 HB3 HIS A 53 -4.163 -3.354 27.272 1.00 10.00 H new ATOM 0 HD2 HIS A 53 -4.136 -0.805 28.027 1.00 10.00 H new ATOM 0 HE1 HIS A 53 -6.074 -1.251 31.785 1.00 10.00 H new ATOM 0 HE2 HIS A 53 -4.736 0.344 30.299 1.00 10.00 H new ATOM 820 N ALA A 54 -6.533 -5.905 26.090 1.00 10.00 N ATOM 821 CA ALA A 54 -6.503 -6.963 25.090 1.00 10.00 C ATOM 822 C ALA A 54 -7.252 -6.581 23.807 1.00 10.00 C ATOM 823 O ALA A 54 -6.882 -7.055 22.743 1.00 10.00 O ATOM 824 CB ALA A 54 -7.079 -8.251 25.689 1.00 10.00 C ATOM 0 H ALA A 54 -6.939 -6.194 26.980 1.00 10.00 H new ATOM 0 HA ALA A 54 -5.463 -7.122 24.806 1.00 10.00 H new ATOM 0 HB1 ALA A 54 -7.056 -9.043 24.940 1.00 10.00 H new ATOM 0 HB2 ALA A 54 -6.483 -8.550 26.551 1.00 10.00 H new ATOM 0 HB3 ALA A 54 -8.108 -8.078 26.003 1.00 10.00 H new ATOM 830 N ASP A 55 -8.271 -5.722 23.893 1.00 10.00 N ATOM 831 CA ASP A 55 -9.023 -5.287 22.709 1.00 10.00 C ATOM 832 C ASP A 55 -8.205 -4.296 21.873 1.00 10.00 C ATOM 833 O ASP A 55 -8.298 -4.270 20.648 1.00 10.00 O ATOM 834 CB ASP A 55 -10.359 -4.648 23.121 1.00 10.00 C ATOM 835 CG ASP A 55 -11.364 -4.554 21.956 1.00 10.00 C ATOM 836 OD1 ASP A 55 -11.483 -5.539 21.201 1.00 10.00 O ATOM 837 OD2 ASP A 55 -12.065 -3.522 21.887 1.00 10.00 O ATOM 0 H ASP A 55 -8.596 -5.313 24.769 1.00 10.00 H new ATOM 0 HA ASP A 55 -9.226 -6.168 22.100 1.00 10.00 H new ATOM 0 HB2 ASP A 55 -10.801 -5.231 23.929 1.00 10.00 H new ATOM 0 HB3 ASP A 55 -10.172 -3.649 23.514 1.00 10.00 H new ATOM 842 N ILE A 56 -7.335 -3.503 22.527 1.00 10.00 N ATOM 843 CA ILE A 56 -6.381 -2.640 21.833 1.00 10.00 C ATOM 844 C ILE A 56 -5.400 -3.552 21.095 1.00 10.00 C ATOM 845 O ILE A 56 -5.187 -3.380 19.894 1.00 10.00 O ATOM 846 CB ILE A 56 -5.630 -1.672 22.790 1.00 10.00 C ATOM 847 CG1 ILE A 56 -6.564 -0.914 23.759 1.00 10.00 C ATOM 848 CG2 ILE A 56 -4.810 -0.684 21.931 1.00 10.00 C ATOM 849 CD1 ILE A 56 -5.828 -0.159 24.875 1.00 10.00 C ATOM 0 H ILE A 56 -7.279 -3.448 23.544 1.00 10.00 H new ATOM 0 HA ILE A 56 -6.920 -1.996 21.139 1.00 10.00 H new ATOM 0 HB ILE A 56 -4.977 -2.267 23.428 1.00 10.00 H new ATOM 0 HG12 ILE A 56 -7.163 -0.204 23.189 1.00 10.00 H new ATOM 0 HG13 ILE A 56 -7.256 -1.625 24.211 1.00 10.00 H new ATOM 0 HG21 ILE A 56 -4.274 0.006 22.582 1.00 10.00 H new ATOM 0 HG22 ILE A 56 -4.095 -1.238 21.322 1.00 10.00 H new ATOM 0 HG23 ILE A 56 -5.482 -0.122 21.282 1.00 10.00 H new ATOM 0 HD11 ILE A 56 -6.554 0.347 25.512 1.00 10.00 H new ATOM 0 HD12 ILE A 56 -5.250 -0.865 25.472 1.00 10.00 H new ATOM 0 HD13 ILE A 56 -5.157 0.578 24.434 1.00 10.00 H new ATOM 861 N TYR A 57 -4.799 -4.515 21.810 1.00 10.00 N ATOM 862 CA TYR A 57 -3.884 -5.478 21.209 1.00 10.00 C ATOM 863 C TYR A 57 -4.532 -6.187 20.020 1.00 10.00 C ATOM 864 O TYR A 57 -3.878 -6.324 18.988 1.00 10.00 O ATOM 865 CB TYR A 57 -3.410 -6.488 22.260 1.00 10.00 C ATOM 866 CG TYR A 57 -2.690 -7.693 21.677 1.00 10.00 C ATOM 867 CD1 TYR A 57 -1.377 -7.570 21.187 1.00 10.00 C ATOM 868 CD2 TYR A 57 -3.355 -8.932 21.584 1.00 10.00 C ATOM 869 CE1 TYR A 57 -0.719 -8.681 20.631 1.00 10.00 C ATOM 870 CE2 TYR A 57 -2.709 -10.044 21.014 1.00 10.00 C ATOM 871 CZ TYR A 57 -1.385 -9.924 20.532 1.00 10.00 C ATOM 872 OH TYR A 57 -0.745 -10.993 19.984 1.00 10.00 O ATOM 0 H TYR A 57 -4.937 -4.642 22.813 1.00 10.00 H new ATOM 0 HA TYR A 57 -3.015 -4.937 20.834 1.00 10.00 H new ATOM 0 HB2 TYR A 57 -2.744 -5.983 22.960 1.00 10.00 H new ATOM 0 HB3 TYR A 57 -4.271 -6.834 22.832 1.00 10.00 H new ATOM 0 HD1 TYR A 57 -0.872 -6.617 21.238 1.00 10.00 H new ATOM 0 HD2 TYR A 57 -4.366 -9.028 21.952 1.00 10.00 H new ATOM 0 HE1 TYR A 57 0.297 -8.585 20.279 1.00 10.00 H new ATOM 0 HE2 TYR A 57 -3.225 -10.990 20.944 1.00 10.00 H new ATOM 0 HH TYR A 57 -1.341 -11.771 19.992 1.00 10.00 H new ATOM 882 N ASP A 58 -5.791 -6.603 20.132 1.00 10.00 N ATOM 883 CA ASP A 58 -6.491 -7.321 19.061 1.00 10.00 C ATOM 884 C ASP A 58 -6.654 -6.455 17.809 1.00 10.00 C ATOM 885 O ASP A 58 -6.316 -6.886 16.704 1.00 10.00 O ATOM 886 CB ASP A 58 -7.867 -7.804 19.531 1.00 10.00 C ATOM 887 CG ASP A 58 -8.612 -8.524 18.389 1.00 10.00 C ATOM 888 OD1 ASP A 58 -8.281 -9.701 18.129 1.00 10.00 O ATOM 889 OD2 ASP A 58 -9.494 -7.899 17.765 1.00 10.00 O ATOM 0 H ASP A 58 -6.358 -6.454 20.967 1.00 10.00 H new ATOM 0 HA ASP A 58 -5.876 -8.184 18.806 1.00 10.00 H new ATOM 0 HB2 ASP A 58 -7.751 -8.479 20.379 1.00 10.00 H new ATOM 0 HB3 ASP A 58 -8.457 -6.955 19.878 1.00 10.00 H new ATOM 894 N LYS A 59 -7.049 -5.185 17.981 1.00 10.00 N ATOM 895 CA LYS A 59 -7.167 -4.230 16.877 1.00 10.00 C ATOM 896 C LYS A 59 -5.807 -4.065 16.212 1.00 10.00 C ATOM 897 O LYS A 59 -5.692 -4.114 14.988 1.00 10.00 O ATOM 898 CB LYS A 59 -7.754 -2.916 17.433 1.00 10.00 C ATOM 899 CG LYS A 59 -7.956 -1.780 16.411 1.00 10.00 C ATOM 900 CD LYS A 59 -6.731 -0.862 16.235 1.00 10.00 C ATOM 901 CE LYS A 59 -7.092 0.344 15.355 1.00 10.00 C ATOM 902 NZ LYS A 59 -5.934 1.241 15.110 1.00 10.00 N ATOM 0 H LYS A 59 -7.295 -4.794 18.891 1.00 10.00 H new ATOM 0 HA LYS A 59 -7.846 -4.583 16.101 1.00 10.00 H new ATOM 0 HB2 LYS A 59 -8.716 -3.138 17.895 1.00 10.00 H new ATOM 0 HB3 LYS A 59 -7.097 -2.554 18.224 1.00 10.00 H new ATOM 0 HG2 LYS A 59 -8.210 -2.217 15.445 1.00 10.00 H new ATOM 0 HG3 LYS A 59 -8.808 -1.175 16.721 1.00 10.00 H new ATOM 0 HD2 LYS A 59 -6.382 -0.519 17.209 1.00 10.00 H new ATOM 0 HD3 LYS A 59 -5.912 -1.420 15.781 1.00 10.00 H new ATOM 0 HE2 LYS A 59 -7.480 -0.011 14.400 1.00 10.00 H new ATOM 0 HE3 LYS A 59 -7.891 0.911 15.833 1.00 10.00 H new ATOM 0 HZ1 LYS A 59 -6.205 1.980 14.431 1.00 10.00 H new ATOM 0 HZ2 LYS A 59 -5.642 1.683 16.005 1.00 10.00 H new ATOM 0 HZ3 LYS A 59 -5.143 0.688 14.723 1.00 10.00 H new ATOM 916 N VAL A 60 -4.779 -3.784 17.013 1.00 10.00 N ATOM 917 CA VAL A 60 -3.467 -3.409 16.513 1.00 10.00 C ATOM 918 C VAL A 60 -2.805 -4.610 15.835 1.00 10.00 C ATOM 919 O VAL A 60 -2.344 -4.474 14.709 1.00 10.00 O ATOM 920 CB VAL A 60 -2.655 -2.806 17.673 1.00 10.00 C ATOM 921 CG1 VAL A 60 -1.205 -2.498 17.278 1.00 10.00 C ATOM 922 CG2 VAL A 60 -3.319 -1.491 18.133 1.00 10.00 C ATOM 0 H VAL A 60 -4.839 -3.812 18.031 1.00 10.00 H new ATOM 0 HA VAL A 60 -3.535 -2.642 15.742 1.00 10.00 H new ATOM 0 HB VAL A 60 -2.641 -3.547 18.472 1.00 10.00 H new ATOM 0 HG11 VAL A 60 -0.677 -2.075 18.133 1.00 10.00 H new ATOM 0 HG12 VAL A 60 -0.710 -3.417 16.965 1.00 10.00 H new ATOM 0 HG13 VAL A 60 -1.196 -1.783 16.455 1.00 10.00 H new ATOM 0 HG21 VAL A 60 -2.746 -1.062 18.955 1.00 10.00 H new ATOM 0 HG22 VAL A 60 -3.345 -0.786 17.302 1.00 10.00 H new ATOM 0 HG23 VAL A 60 -4.336 -1.695 18.468 1.00 10.00 H new ATOM 932 N SER A 61 -2.796 -5.791 16.455 1.00 10.00 N ATOM 933 CA SER A 61 -2.225 -6.986 15.836 1.00 10.00 C ATOM 934 C SER A 61 -2.947 -7.343 14.528 1.00 10.00 C ATOM 935 O SER A 61 -2.304 -7.846 13.607 1.00 10.00 O ATOM 936 CB SER A 61 -2.190 -8.158 16.829 1.00 10.00 C ATOM 937 OG SER A 61 -3.453 -8.415 17.399 1.00 10.00 O ATOM 0 H SER A 61 -3.179 -5.945 17.388 1.00 10.00 H new ATOM 0 HA SER A 61 -1.192 -6.767 15.567 1.00 10.00 H new ATOM 0 HB2 SER A 61 -1.836 -9.053 16.318 1.00 10.00 H new ATOM 0 HB3 SER A 61 -1.474 -7.939 17.621 1.00 10.00 H new ATOM 0 HG SER A 61 -3.582 -7.839 18.182 1.00 10.00 H new ATOM 943 N GLY A 62 -4.248 -7.058 14.414 1.00 10.00 N ATOM 944 CA GLY A 62 -4.975 -7.189 13.162 1.00 10.00 C ATOM 945 C GLY A 62 -4.372 -6.283 12.089 1.00 10.00 C ATOM 946 O GLY A 62 -4.053 -6.750 10.994 1.00 10.00 O ATOM 0 H GLY A 62 -4.821 -6.730 15.192 1.00 10.00 H new ATOM 0 HA2 GLY A 62 -4.948 -8.226 12.827 1.00 10.00 H new ATOM 0 HA3 GLY A 62 -6.023 -6.931 13.316 1.00 10.00 H new ATOM 950 N ASP A 63 -4.165 -5.001 12.404 1.00 10.00 N ATOM 951 CA ASP A 63 -3.585 -4.050 11.455 1.00 10.00 C ATOM 952 C ASP A 63 -2.156 -4.434 11.081 1.00 10.00 C ATOM 953 O ASP A 63 -1.839 -4.481 9.896 1.00 10.00 O ATOM 954 CB ASP A 63 -3.608 -2.616 11.990 1.00 10.00 C ATOM 955 CG ASP A 63 -3.161 -1.640 10.884 1.00 10.00 C ATOM 956 OD1 ASP A 63 -1.943 -1.361 10.784 1.00 10.00 O ATOM 957 OD2 ASP A 63 -4.049 -1.161 10.148 1.00 10.00 O ATOM 0 H ASP A 63 -4.392 -4.598 13.313 1.00 10.00 H new ATOM 0 HA ASP A 63 -4.208 -4.092 10.561 1.00 10.00 H new ATOM 0 HB2 ASP A 63 -4.612 -2.361 12.329 1.00 10.00 H new ATOM 0 HB3 ASP A 63 -2.948 -2.529 12.853 1.00 10.00 H new ATOM 962 N MET A 64 -1.317 -4.812 12.053 1.00 10.00 N ATOM 963 CA MET A 64 0.053 -5.234 11.796 1.00 10.00 C ATOM 964 C MET A 64 0.080 -6.434 10.857 1.00 10.00 C ATOM 965 O MET A 64 0.912 -6.463 9.949 1.00 10.00 O ATOM 966 CB MET A 64 0.782 -5.563 13.105 1.00 10.00 C ATOM 967 CG MET A 64 1.502 -4.354 13.710 1.00 10.00 C ATOM 968 SD MET A 64 0.480 -3.075 14.473 1.00 10.00 S ATOM 969 CE MET A 64 0.530 -1.759 13.241 1.00 10.00 C ATOM 0 H MET A 64 -1.576 -4.832 13.039 1.00 10.00 H new ATOM 0 HA MET A 64 0.574 -4.406 11.315 1.00 10.00 H new ATOM 0 HB2 MET A 64 0.063 -5.950 13.827 1.00 10.00 H new ATOM 0 HB3 MET A 64 1.507 -6.356 12.921 1.00 10.00 H new ATOM 0 HG2 MET A 64 2.201 -4.720 14.462 1.00 10.00 H new ATOM 0 HG3 MET A 64 2.095 -3.887 12.924 1.00 10.00 H new ATOM 0 HE1 MET A 64 -0.001 -0.886 13.620 1.00 10.00 H new ATOM 0 HE2 MET A 64 1.567 -1.492 13.036 1.00 10.00 H new ATOM 0 HE3 MET A 64 0.055 -2.103 12.322 1.00 10.00 H new ATOM 979 N GLN A 65 -0.832 -7.397 11.006 1.00 10.00 N ATOM 980 CA GLN A 65 -0.886 -8.535 10.096 1.00 10.00 C ATOM 981 C GLN A 65 -1.212 -8.085 8.668 1.00 10.00 C ATOM 982 O GLN A 65 -0.658 -8.637 7.716 1.00 10.00 O ATOM 983 CB GLN A 65 -1.892 -9.565 10.615 1.00 10.00 C ATOM 984 CG GLN A 65 -1.280 -10.375 11.768 1.00 10.00 C ATOM 985 CD GLN A 65 -2.331 -11.223 12.481 1.00 10.00 C ATOM 986 OE1 GLN A 65 -2.480 -12.412 12.226 1.00 10.00 O ATOM 987 NE2 GLN A 65 -3.087 -10.614 13.380 1.00 10.00 N ATOM 0 H GLN A 65 -1.537 -7.409 11.743 1.00 10.00 H new ATOM 0 HA GLN A 65 0.096 -9.008 10.059 1.00 10.00 H new ATOM 0 HB2 GLN A 65 -2.796 -9.060 10.956 1.00 10.00 H new ATOM 0 HB3 GLN A 65 -2.186 -10.235 9.807 1.00 10.00 H new ATOM 0 HG2 GLN A 65 -0.492 -11.021 11.381 1.00 10.00 H new ATOM 0 HG3 GLN A 65 -0.814 -9.697 12.482 1.00 10.00 H new ATOM 0 HE21 GLN A 65 -2.947 -9.623 13.577 1.00 10.00 H new ATOM 0 HE22 GLN A 65 -3.810 -11.135 13.876 1.00 10.00 H new ATOM 996 N LYS A 66 -2.059 -7.060 8.489 1.00 10.00 N ATOM 997 CA LYS A 66 -2.300 -6.470 7.169 1.00 10.00 C ATOM 998 C LYS A 66 -1.045 -5.786 6.617 1.00 10.00 C ATOM 999 O LYS A 66 -0.883 -5.779 5.390 1.00 10.00 O ATOM 1000 CB LYS A 66 -3.494 -5.499 7.189 1.00 10.00 C ATOM 1001 CG LYS A 66 -4.820 -6.207 7.518 1.00 10.00 C ATOM 1002 CD LYS A 66 -6.000 -5.231 7.666 1.00 10.00 C ATOM 1003 CE LYS A 66 -6.337 -4.427 6.397 1.00 10.00 C ATOM 1004 NZ LYS A 66 -6.853 -5.273 5.290 1.00 10.00 N ATOM 0 H LYS A 66 -2.588 -6.624 9.244 1.00 10.00 H new ATOM 0 HA LYS A 66 -2.552 -7.290 6.497 1.00 10.00 H new ATOM 0 HB2 LYS A 66 -3.310 -4.717 7.926 1.00 10.00 H new ATOM 0 HB3 LYS A 66 -3.577 -5.010 6.218 1.00 10.00 H new ATOM 0 HG2 LYS A 66 -5.047 -6.926 6.731 1.00 10.00 H new ATOM 0 HG3 LYS A 66 -4.704 -6.772 8.443 1.00 10.00 H new ATOM 0 HD2 LYS A 66 -6.883 -5.794 7.967 1.00 10.00 H new ATOM 0 HD3 LYS A 66 -5.777 -4.533 8.473 1.00 10.00 H new ATOM 0 HE2 LYS A 66 -7.079 -3.667 6.642 1.00 10.00 H new ATOM 0 HE3 LYS A 66 -5.444 -3.902 6.059 1.00 10.00 H new ATOM 0 HZ1 LYS A 66 -7.061 -4.676 4.465 1.00 10.00 H new ATOM 0 HZ2 LYS A 66 -6.137 -5.982 5.032 1.00 10.00 H new ATOM 0 HZ3 LYS A 66 -7.722 -5.754 5.597 1.00 10.00 H new ATOM 1018 N GLN A 67 -0.166 -5.235 7.457 1.00 10.00 N ATOM 1019 CA GLN A 67 1.102 -4.659 7.004 1.00 10.00 C ATOM 1020 C GLN A 67 2.106 -5.760 6.630 1.00 10.00 C ATOM 1021 O GLN A 67 2.863 -5.637 5.663 1.00 10.00 O ATOM 1022 CB GLN A 67 1.742 -3.755 8.080 1.00 10.00 C ATOM 1023 CG GLN A 67 0.856 -2.666 8.710 1.00 10.00 C ATOM 1024 CD GLN A 67 0.142 -1.738 7.722 1.00 10.00 C ATOM 1025 OE1 GLN A 67 0.576 -1.546 6.589 1.00 10.00 O ATOM 1026 NE2 GLN A 67 -0.961 -1.140 8.133 1.00 10.00 N ATOM 0 H GLN A 67 -0.312 -5.176 8.465 1.00 10.00 H new ATOM 0 HA GLN A 67 0.869 -4.056 6.127 1.00 10.00 H new ATOM 0 HB2 GLN A 67 2.110 -4.395 8.882 1.00 10.00 H new ATOM 0 HB3 GLN A 67 2.611 -3.268 7.637 1.00 10.00 H new ATOM 0 HG2 GLN A 67 0.104 -3.150 9.333 1.00 10.00 H new ATOM 0 HG3 GLN A 67 1.474 -2.057 9.370 1.00 10.00 H new ATOM 0 HE21 GLN A 67 -1.311 -1.308 9.076 1.00 10.00 H new ATOM 0 HE22 GLN A 67 -1.463 -0.510 7.507 1.00 10.00 H new ATOM 1035 N GLY A 68 2.112 -6.846 7.398 1.00 10.00 N ATOM 1036 CA GLY A 68 3.137 -7.875 7.364 1.00 10.00 C ATOM 1037 C GLY A 68 4.056 -7.634 8.552 1.00 10.00 C ATOM 1038 O GLY A 68 5.229 -7.313 8.386 1.00 10.00 O ATOM 0 H GLY A 68 1.379 -7.036 8.081 1.00 10.00 H new ATOM 0 HA2 GLY A 68 2.688 -8.867 7.420 1.00 10.00 H new ATOM 0 HA3 GLY A 68 3.696 -7.830 6.430 1.00 10.00 H new ATOM 1042 N CYS A 69 3.489 -7.631 9.757 1.00 10.00 N ATOM 1043 CA CYS A 69 4.164 -7.401 11.025 1.00 10.00 C ATOM 1044 C CYS A 69 3.476 -8.262 12.095 1.00 10.00 C ATOM 1045 O CYS A 69 2.391 -8.793 11.862 1.00 10.00 O ATOM 1046 CB CYS A 69 4.078 -5.906 11.384 1.00 10.00 C ATOM 1047 SG CYS A 69 5.174 -4.903 10.336 1.00 10.00 S ATOM 0 H CYS A 69 2.490 -7.799 9.877 1.00 10.00 H new ATOM 0 HA CYS A 69 5.217 -7.675 10.962 1.00 10.00 H new ATOM 0 HB2 CYS A 69 3.050 -5.562 11.270 1.00 10.00 H new ATOM 0 HB3 CYS A 69 4.347 -5.766 12.431 1.00 10.00 H new ATOM 0 HG CYS A 69 5.500 -5.581 9.276 1.00 10.00 H new ATOM 1053 N ASP A 70 4.086 -8.360 13.272 1.00 10.00 N ATOM 1054 CA ASP A 70 3.601 -9.138 14.419 1.00 10.00 C ATOM 1055 C ASP A 70 3.846 -8.331 15.696 1.00 10.00 C ATOM 1056 O ASP A 70 4.667 -7.408 15.670 1.00 10.00 O ATOM 1057 CB ASP A 70 4.324 -10.496 14.478 1.00 10.00 C ATOM 1058 CG ASP A 70 3.874 -11.366 15.669 1.00 10.00 C ATOM 1059 OD1 ASP A 70 2.653 -11.382 15.950 1.00 10.00 O ATOM 1060 OD2 ASP A 70 4.755 -11.985 16.299 1.00 10.00 O ATOM 0 H ASP A 70 4.966 -7.883 13.466 1.00 10.00 H new ATOM 0 HA ASP A 70 2.533 -9.333 14.317 1.00 10.00 H new ATOM 0 HB2 ASP A 70 4.143 -11.038 13.550 1.00 10.00 H new ATOM 0 HB3 ASP A 70 5.399 -10.327 14.544 1.00 10.00 H new ATOM 1065 N CYS A 71 3.158 -8.644 16.797 1.00 10.00 N ATOM 1066 CA CYS A 71 3.109 -7.823 18.002 1.00 10.00 C ATOM 1067 C CYS A 71 3.378 -8.635 19.270 1.00 10.00 C ATOM 1068 O CYS A 71 3.037 -9.810 19.348 1.00 10.00 O ATOM 1069 CB CYS A 71 1.705 -7.217 18.117 1.00 10.00 C ATOM 1070 SG CYS A 71 1.409 -5.985 16.823 1.00 10.00 S ATOM 0 H CYS A 71 2.606 -9.499 16.873 1.00 10.00 H new ATOM 0 HA CYS A 71 3.882 -7.059 17.917 1.00 10.00 H new ATOM 0 HB2 CYS A 71 0.959 -8.008 18.046 1.00 10.00 H new ATOM 0 HB3 CYS A 71 1.586 -6.754 19.097 1.00 10.00 H new ATOM 0 HG CYS A 71 0.211 -5.498 16.954 1.00 10.00 H new ATOM 1076 N GLU A 72 3.857 -7.953 20.312 1.00 10.00 N ATOM 1077 CA GLU A 72 3.998 -8.457 21.668 1.00 10.00 C ATOM 1078 C GLU A 72 3.834 -7.255 22.604 1.00 10.00 C ATOM 1079 O GLU A 72 4.576 -6.277 22.494 1.00 10.00 O ATOM 1080 CB GLU A 72 5.377 -9.123 21.824 1.00 10.00 C ATOM 1081 CG GLU A 72 5.626 -9.580 23.266 1.00 10.00 C ATOM 1082 CD GLU A 72 6.903 -10.437 23.389 1.00 10.00 C ATOM 1083 OE1 GLU A 72 7.990 -9.849 23.592 1.00 10.00 O ATOM 1084 OE2 GLU A 72 6.788 -11.679 23.316 1.00 10.00 O ATOM 0 H GLU A 72 4.171 -6.987 20.222 1.00 10.00 H new ATOM 0 HA GLU A 72 3.250 -9.213 21.907 1.00 10.00 H new ATOM 0 HB2 GLU A 72 5.445 -9.980 21.154 1.00 10.00 H new ATOM 0 HB3 GLU A 72 6.156 -8.422 21.525 1.00 10.00 H new ATOM 0 HG2 GLU A 72 5.712 -8.707 23.913 1.00 10.00 H new ATOM 0 HG3 GLU A 72 4.769 -10.154 23.617 1.00 10.00 H new ATOM 1091 N CYS A 73 2.830 -7.261 23.484 1.00 10.00 N ATOM 1092 CA CYS A 73 2.663 -6.205 24.480 1.00 10.00 C ATOM 1093 C CYS A 73 3.806 -6.286 25.494 1.00 10.00 C ATOM 1094 O CYS A 73 3.984 -7.321 26.130 1.00 10.00 O ATOM 1095 CB CYS A 73 1.307 -6.345 25.176 1.00 10.00 C ATOM 1096 SG CYS A 73 -0.010 -6.197 23.943 1.00 10.00 S ATOM 0 H CYS A 73 2.118 -7.990 23.525 1.00 10.00 H new ATOM 0 HA CYS A 73 2.691 -5.231 23.991 1.00 10.00 H new ATOM 0 HB2 CYS A 73 1.242 -7.308 25.682 1.00 10.00 H new ATOM 0 HB3 CYS A 73 1.195 -5.575 25.940 1.00 10.00 H new ATOM 0 HG CYS A 73 -1.139 -6.570 24.468 1.00 10.00 H new ATOM 1102 N LEU A 74 4.544 -5.188 25.665 1.00 10.00 N ATOM 1103 CA LEU A 74 5.587 -5.084 26.683 1.00 10.00 C ATOM 1104 C LEU A 74 4.978 -4.757 28.053 1.00 10.00 C ATOM 1105 O LEU A 74 5.588 -5.046 29.083 1.00 10.00 O ATOM 1106 CB LEU A 74 6.616 -4.008 26.294 1.00 10.00 C ATOM 1107 CG LEU A 74 7.372 -4.247 24.973 1.00 10.00 C ATOM 1108 CD1 LEU A 74 8.401 -3.127 24.777 1.00 10.00 C ATOM 1109 CD2 LEU A 74 8.090 -5.601 24.949 1.00 10.00 C ATOM 0 H LEU A 74 4.434 -4.346 25.100 1.00 10.00 H new ATOM 0 HA LEU A 74 6.093 -6.047 26.748 1.00 10.00 H new ATOM 0 HB2 LEU A 74 6.103 -3.049 26.228 1.00 10.00 H new ATOM 0 HB3 LEU A 74 7.347 -3.924 27.098 1.00 10.00 H new ATOM 0 HG LEU A 74 6.639 -4.249 24.166 1.00 10.00 H new ATOM 0 HD11 LEU A 74 8.941 -3.288 23.844 1.00 10.00 H new ATOM 0 HD12 LEU A 74 7.889 -2.165 24.739 1.00 10.00 H new ATOM 0 HD13 LEU A 74 9.105 -3.130 25.609 1.00 10.00 H new ATOM 0 HD21 LEU A 74 8.608 -5.722 23.997 1.00 10.00 H new ATOM 0 HD22 LEU A 74 8.813 -5.644 25.763 1.00 10.00 H new ATOM 0 HD23 LEU A 74 7.360 -6.402 25.069 1.00 10.00 H new ATOM 1121 N GLY A 75 3.787 -4.151 28.064 1.00 10.00 N ATOM 1122 CA GLY A 75 3.039 -3.780 29.256 1.00 10.00 C ATOM 1123 C GLY A 75 1.936 -2.796 28.871 1.00 10.00 C ATOM 1124 O GLY A 75 1.853 -2.386 27.710 1.00 10.00 O ATOM 0 H GLY A 75 3.302 -3.897 27.203 1.00 10.00 H new ATOM 0 HA2 GLY A 75 2.606 -4.667 29.719 1.00 10.00 H new ATOM 0 HA3 GLY A 75 3.705 -3.329 29.992 1.00 10.00 H new ATOM 1128 N GLY A 76 1.096 -2.388 29.821 1.00 10.00 N ATOM 1129 CA GLY A 76 0.086 -1.360 29.585 1.00 10.00 C ATOM 1130 C GLY A 76 -0.156 -0.498 30.821 1.00 10.00 C ATOM 1131 O GLY A 76 0.461 -0.710 31.866 1.00 10.00 O ATOM 0 H GLY A 76 1.097 -2.759 30.771 1.00 10.00 H new ATOM 0 HA2 GLY A 76 0.402 -0.725 28.757 1.00 10.00 H new ATOM 0 HA3 GLY A 76 -0.849 -1.833 29.285 1.00 10.00 H new ATOM 1135 N GLY A 77 -1.043 0.486 30.680 1.00 10.00 N ATOM 1136 CA GLY A 77 -1.408 1.449 31.703 1.00 10.00 C ATOM 1137 C GLY A 77 -2.587 2.264 31.183 1.00 10.00 C ATOM 1138 O GLY A 77 -3.463 1.738 30.482 1.00 10.00 O ATOM 0 H GLY A 77 -1.547 0.635 29.806 1.00 10.00 H new ATOM 0 HA2 GLY A 77 -1.676 0.939 32.628 1.00 10.00 H new ATOM 0 HA3 GLY A 77 -0.565 2.101 31.931 1.00 10.00 H new ATOM 1142 N ARG A 78 -2.658 3.551 31.514 1.00 10.00 N ATOM 1143 CA ARG A 78 -3.656 4.453 30.945 1.00 10.00 C ATOM 1144 C ARG A 78 -3.128 5.875 30.913 1.00 10.00 C ATOM 1145 O ARG A 78 -2.340 6.254 31.772 1.00 10.00 O ATOM 1146 CB ARG A 78 -4.990 4.331 31.703 1.00 10.00 C ATOM 1147 CG ARG A 78 -4.952 4.724 33.191 1.00 10.00 C ATOM 1148 CD ARG A 78 -6.079 4.013 33.953 1.00 10.00 C ATOM 1149 NE ARG A 78 -5.764 2.581 34.140 1.00 10.00 N ATOM 1150 CZ ARG A 78 -5.434 1.978 35.294 1.00 10.00 C ATOM 1151 NH1 ARG A 78 -5.552 2.610 36.455 1.00 10.00 N ATOM 1152 NH2 ARG A 78 -4.982 0.732 35.283 1.00 10.00 N ATOM 0 H ARG A 78 -2.028 3.997 32.181 1.00 10.00 H new ATOM 0 HA ARG A 78 -3.853 4.165 29.913 1.00 10.00 H new ATOM 0 HB2 ARG A 78 -5.730 4.954 31.201 1.00 10.00 H new ATOM 0 HB3 ARG A 78 -5.337 3.300 31.627 1.00 10.00 H new ATOM 0 HG2 ARG A 78 -3.987 4.457 33.621 1.00 10.00 H new ATOM 0 HG3 ARG A 78 -5.059 5.804 33.293 1.00 10.00 H new ATOM 0 HD2 ARG A 78 -6.224 4.488 34.923 1.00 10.00 H new ATOM 0 HD3 ARG A 78 -7.016 4.115 33.405 1.00 10.00 H new ATOM 0 HE ARG A 78 -5.801 1.991 33.309 1.00 10.00 H new ATOM 0 HH11 ARG A 78 -5.898 3.569 36.481 1.00 10.00 H new ATOM 0 HH12 ARG A 78 -5.297 2.137 37.322 1.00 10.00 H new ATOM 0 HH21 ARG A 78 -4.885 0.232 34.399 1.00 10.00 H new ATOM 0 HH22 ARG A 78 -4.731 0.273 36.159 1.00 10.00 H new ATOM 1166 N ILE A 79 -3.585 6.635 29.926 1.00 10.00 N ATOM 1167 CA ILE A 79 -3.238 8.032 29.702 1.00 10.00 C ATOM 1168 C ILE A 79 -4.499 8.820 30.066 1.00 10.00 C ATOM 1169 O ILE A 79 -5.613 8.311 29.900 1.00 10.00 O ATOM 1170 CB ILE A 79 -2.818 8.241 28.220 1.00 10.00 C ATOM 1171 CG1 ILE A 79 -1.602 7.367 27.823 1.00 10.00 C ATOM 1172 CG2 ILE A 79 -2.506 9.723 27.923 1.00 10.00 C ATOM 1173 CD1 ILE A 79 -1.372 7.246 26.312 1.00 10.00 C ATOM 0 H ILE A 79 -4.237 6.278 29.228 1.00 10.00 H new ATOM 0 HA ILE A 79 -2.391 8.363 30.303 1.00 10.00 H new ATOM 0 HB ILE A 79 -3.672 7.929 27.619 1.00 10.00 H new ATOM 0 HG12 ILE A 79 -0.706 7.784 28.282 1.00 10.00 H new ATOM 0 HG13 ILE A 79 -1.737 6.368 28.238 1.00 10.00 H new ATOM 0 HG21 ILE A 79 -2.216 9.831 26.878 1.00 10.00 H new ATOM 0 HG22 ILE A 79 -3.392 10.328 28.118 1.00 10.00 H new ATOM 0 HG23 ILE A 79 -1.690 10.058 28.563 1.00 10.00 H new ATOM 0 HD11 ILE A 79 -0.501 6.617 26.126 1.00 10.00 H new ATOM 0 HD12 ILE A 79 -2.249 6.798 25.845 1.00 10.00 H new ATOM 0 HD13 ILE A 79 -1.202 8.236 25.889 1.00 10.00 H new ATOM 1185 N SER A 80 -4.321 10.036 30.578 1.00 10.00 N ATOM 1186 CA SER A 80 -5.394 10.988 30.823 1.00 10.00 C ATOM 1187 C SER A 80 -4.835 12.412 30.721 1.00 10.00 C ATOM 1188 O SER A 80 -3.635 12.600 30.506 1.00 10.00 O ATOM 1189 CB SER A 80 -6.014 10.701 32.199 1.00 10.00 C ATOM 1190 OG SER A 80 -7.249 11.377 32.353 1.00 10.00 O ATOM 0 H SER A 80 -3.402 10.392 30.840 1.00 10.00 H new ATOM 0 HA SER A 80 -6.182 10.889 30.077 1.00 10.00 H new ATOM 0 HB2 SER A 80 -6.166 9.628 32.316 1.00 10.00 H new ATOM 0 HB3 SER A 80 -5.325 11.013 32.984 1.00 10.00 H new ATOM 0 HG SER A 80 -7.624 11.177 33.236 1.00 10.00 H new ATOM 1314 N ILE A 88 -1.050 16.326 29.870 1.00 10.00 N ATOM 1315 CA ILE A 88 -1.324 14.888 29.813 1.00 10.00 C ATOM 1316 C ILE A 88 -0.351 14.115 30.707 1.00 10.00 C ATOM 1317 O ILE A 88 0.804 14.498 30.886 1.00 10.00 O ATOM 1318 CB ILE A 88 -1.357 14.365 28.360 1.00 10.00 C ATOM 1319 CG1 ILE A 88 -0.023 14.571 27.612 1.00 10.00 C ATOM 1320 CG2 ILE A 88 -2.542 15.004 27.614 1.00 10.00 C ATOM 1321 CD1 ILE A 88 -0.011 13.981 26.195 1.00 10.00 C ATOM 0 HA ILE A 88 -2.324 14.716 30.210 1.00 10.00 H new ATOM 0 HB ILE A 88 -1.498 13.285 28.395 1.00 10.00 H new ATOM 0 HG12 ILE A 88 0.189 15.639 27.553 1.00 10.00 H new ATOM 0 HG13 ILE A 88 0.782 14.118 28.191 1.00 10.00 H new ATOM 0 HG21 ILE A 88 -2.567 14.636 26.588 1.00 10.00 H new ATOM 0 HG22 ILE A 88 -3.473 14.741 28.117 1.00 10.00 H new ATOM 0 HG23 ILE A 88 -2.426 16.088 27.608 1.00 10.00 H new ATOM 0 HD11 ILE A 88 0.959 14.165 25.733 1.00 10.00 H new ATOM 0 HD12 ILE A 88 -0.191 12.907 26.246 1.00 10.00 H new ATOM 0 HD13 ILE A 88 -0.793 14.451 25.598 1.00 10.00 H new ATOM 1333 N HIS A 89 -0.805 12.996 31.272 1.00 10.00 N ATOM 1334 CA HIS A 89 -0.038 12.184 32.210 1.00 10.00 C ATOM 1335 C HIS A 89 -0.456 10.721 32.060 1.00 10.00 C ATOM 1336 O HIS A 89 -1.513 10.438 31.488 1.00 10.00 O ATOM 1337 CB HIS A 89 -0.292 12.708 33.632 1.00 10.00 C ATOM 1338 CG HIS A 89 0.635 12.158 34.689 1.00 10.00 C ATOM 1339 ND1 HIS A 89 1.925 12.575 34.945 1.00 10.00 N ATOM 1340 CD2 HIS A 89 0.323 11.212 35.629 1.00 10.00 C ATOM 1341 CE1 HIS A 89 2.368 11.904 36.020 1.00 10.00 C ATOM 1342 NE2 HIS A 89 1.430 11.062 36.469 1.00 10.00 N ATOM 0 H HIS A 89 -1.736 12.623 31.085 1.00 10.00 H new ATOM 0 HA HIS A 89 1.031 12.250 32.006 1.00 10.00 H new ATOM 0 HB2 HIS A 89 -0.205 13.795 33.624 1.00 10.00 H new ATOM 0 HB3 HIS A 89 -1.319 12.472 33.912 1.00 10.00 H new ATOM 0 HD2 HIS A 89 -0.612 10.677 35.707 1.00 10.00 H new ATOM 0 HE1 HIS A 89 3.346 12.027 36.461 1.00 10.00 H new ATOM 0 HE2 HIS A 89 1.508 10.433 37.268 1.00 10.00 H new ATOM 1350 N VAL A 90 0.351 9.794 32.573 1.00 10.00 N ATOM 1351 CA VAL A 90 0.183 8.357 32.359 1.00 10.00 C ATOM 1352 C VAL A 90 0.399 7.633 33.695 1.00 10.00 C ATOM 1353 O VAL A 90 1.274 8.026 34.467 1.00 10.00 O ATOM 1354 CB VAL A 90 1.164 7.871 31.263 1.00 10.00 C ATOM 1355 CG1 VAL A 90 0.738 6.508 30.707 1.00 10.00 C ATOM 1356 CG2 VAL A 90 1.298 8.846 30.074 1.00 10.00 C ATOM 0 H VAL A 90 1.154 10.024 33.159 1.00 10.00 H new ATOM 0 HA VAL A 90 -0.825 8.134 32.008 1.00 10.00 H new ATOM 0 HB VAL A 90 2.131 7.805 31.762 1.00 10.00 H new ATOM 0 HG11 VAL A 90 1.444 6.191 29.940 1.00 10.00 H new ATOM 0 HG12 VAL A 90 0.725 5.774 31.513 1.00 10.00 H new ATOM 0 HG13 VAL A 90 -0.258 6.588 30.272 1.00 10.00 H new ATOM 0 HG21 VAL A 90 2.001 8.439 29.347 1.00 10.00 H new ATOM 0 HG22 VAL A 90 0.325 8.980 29.602 1.00 10.00 H new ATOM 0 HG23 VAL A 90 1.663 9.809 30.432 1.00 10.00 H new ATOM 1366 N TYR A 91 -0.392 6.602 33.991 1.00 10.00 N ATOM 1367 CA TYR A 91 -0.322 5.854 35.241 1.00 10.00 C ATOM 1368 C TYR A 91 -0.927 4.459 35.051 1.00 10.00 C ATOM 1369 O TYR A 91 -1.360 4.110 33.948 1.00 10.00 O ATOM 1370 CB TYR A 91 -1.032 6.640 36.364 1.00 10.00 C ATOM 1371 CG TYR A 91 -2.546 6.746 36.258 1.00 10.00 C ATOM 1372 CD1 TYR A 91 -3.139 7.653 35.354 1.00 10.00 C ATOM 1373 CD2 TYR A 91 -3.366 5.960 37.093 1.00 10.00 C ATOM 1374 CE1 TYR A 91 -4.538 7.777 35.285 1.00 10.00 C ATOM 1375 CE2 TYR A 91 -4.764 6.084 37.039 1.00 10.00 C ATOM 1376 CZ TYR A 91 -5.353 7.000 36.141 1.00 10.00 C ATOM 1377 OH TYR A 91 -6.710 7.099 36.075 1.00 10.00 O ATOM 0 H TYR A 91 -1.112 6.259 33.355 1.00 10.00 H new ATOM 0 HA TYR A 91 0.720 5.725 35.534 1.00 10.00 H new ATOM 0 HB2 TYR A 91 -0.788 6.171 37.317 1.00 10.00 H new ATOM 0 HB3 TYR A 91 -0.619 7.648 36.390 1.00 10.00 H new ATOM 0 HD1 TYR A 91 -2.514 8.256 34.711 1.00 10.00 H new ATOM 0 HD2 TYR A 91 -2.916 5.258 37.779 1.00 10.00 H new ATOM 0 HE1 TYR A 91 -4.988 8.462 34.582 1.00 10.00 H new ATOM 0 HE2 TYR A 91 -5.387 5.480 37.683 1.00 10.00 H new ATOM 0 HH TYR A 91 -7.114 6.495 36.732 1.00 10.00 H new ATOM 1387 N GLY A 92 -1.024 3.684 36.133 1.00 10.00 N ATOM 1388 CA GLY A 92 -1.728 2.413 36.146 1.00 10.00 C ATOM 1389 C GLY A 92 -0.884 1.258 35.614 1.00 10.00 C ATOM 1390 O GLY A 92 0.280 1.430 35.251 1.00 10.00 O ATOM 0 H GLY A 92 -0.609 3.930 37.032 1.00 10.00 H new ATOM 0 HA2 GLY A 92 -2.041 2.188 37.166 1.00 10.00 H new ATOM 0 HA3 GLY A 92 -2.634 2.500 35.546 1.00 10.00 H new ATOM 1394 N TYR A 93 -1.493 0.076 35.556 1.00 10.00 N ATOM 1395 CA TYR A 93 -0.944 -1.094 34.881 1.00 10.00 C ATOM 1396 C TYR A 93 -2.045 -1.822 34.107 1.00 10.00 C ATOM 1397 O TYR A 93 -3.212 -1.404 34.123 1.00 10.00 O ATOM 1398 CB TYR A 93 -0.168 -1.998 35.864 1.00 10.00 C ATOM 1399 CG TYR A 93 -0.892 -2.829 36.922 1.00 10.00 C ATOM 1400 CD1 TYR A 93 -2.277 -2.731 37.177 1.00 10.00 C ATOM 1401 CD2 TYR A 93 -0.123 -3.734 37.683 1.00 10.00 C ATOM 1402 CE1 TYR A 93 -2.878 -3.507 38.186 1.00 10.00 C ATOM 1403 CE2 TYR A 93 -0.714 -4.513 38.693 1.00 10.00 C ATOM 1404 CZ TYR A 93 -2.095 -4.393 38.960 1.00 10.00 C ATOM 1405 OH TYR A 93 -2.659 -5.138 39.949 1.00 10.00 O ATOM 0 H TYR A 93 -2.401 -0.097 35.987 1.00 10.00 H new ATOM 0 HA TYR A 93 -0.207 -0.773 34.145 1.00 10.00 H new ATOM 0 HB2 TYR A 93 0.418 -2.692 35.262 1.00 10.00 H new ATOM 0 HB3 TYR A 93 0.539 -1.359 36.392 1.00 10.00 H new ATOM 0 HD1 TYR A 93 -2.882 -2.054 36.592 1.00 10.00 H new ATOM 0 HD2 TYR A 93 0.935 -3.830 37.487 1.00 10.00 H new ATOM 0 HE1 TYR A 93 -3.939 -3.425 38.369 1.00 10.00 H new ATOM 0 HE2 TYR A 93 -0.111 -5.203 39.265 1.00 10.00 H new ATOM 0 HH TYR A 93 -1.971 -5.691 40.375 1.00 10.00 H new ATOM 1415 N SER A 94 -1.688 -2.930 33.454 1.00 10.00 N ATOM 1416 CA SER A 94 -2.604 -3.818 32.756 1.00 10.00 C ATOM 1417 C SER A 94 -2.229 -5.230 33.176 1.00 10.00 C ATOM 1418 O SER A 94 -1.184 -5.731 32.769 1.00 10.00 O ATOM 1419 CB SER A 94 -2.459 -3.638 31.240 1.00 10.00 C ATOM 1420 OG SER A 94 -2.636 -2.290 30.879 1.00 10.00 O ATOM 0 H SER A 94 -0.718 -3.239 33.398 1.00 10.00 H new ATOM 0 HA SER A 94 -3.643 -3.603 33.005 1.00 10.00 H new ATOM 0 HB2 SER A 94 -1.474 -3.978 30.921 1.00 10.00 H new ATOM 0 HB3 SER A 94 -3.193 -4.257 30.724 1.00 10.00 H new ATOM 0 HG SER A 94 -3.117 -1.821 31.592 1.00 10.00 H new ATOM 1426 N MET A 95 -3.057 -5.870 34.007 1.00 10.00 N ATOM 1427 CA MET A 95 -2.746 -7.171 34.612 1.00 10.00 C ATOM 1428 C MET A 95 -2.509 -8.272 33.567 1.00 10.00 C ATOM 1429 O MET A 95 -1.855 -9.262 33.870 1.00 10.00 O ATOM 1430 CB MET A 95 -3.866 -7.586 35.581 1.00 10.00 C ATOM 1431 CG MET A 95 -3.971 -6.641 36.785 1.00 10.00 C ATOM 1432 SD MET A 95 -5.225 -7.096 38.016 1.00 10.00 S ATOM 1433 CE MET A 95 -6.750 -6.750 37.097 1.00 10.00 C ATOM 0 H MET A 95 -3.967 -5.499 34.281 1.00 10.00 H new ATOM 0 HA MET A 95 -1.812 -7.052 35.161 1.00 10.00 H new ATOM 0 HB2 MET A 95 -4.817 -7.601 35.049 1.00 10.00 H new ATOM 0 HB3 MET A 95 -3.682 -8.601 35.933 1.00 10.00 H new ATOM 0 HG2 MET A 95 -3.000 -6.597 37.278 1.00 10.00 H new ATOM 0 HG3 MET A 95 -4.189 -5.637 36.421 1.00 10.00 H new ATOM 0 HE1 MET A 95 -7.611 -6.913 37.746 1.00 10.00 H new ATOM 0 HE2 MET A 95 -6.743 -5.715 36.757 1.00 10.00 H new ATOM 0 HE3 MET A 95 -6.814 -7.415 36.235 1.00 10.00 H new ATOM 1443 N ALA A 96 -3.014 -8.094 32.339 1.00 10.00 N ATOM 1444 CA ALA A 96 -2.767 -8.997 31.222 1.00 10.00 C ATOM 1445 C ALA A 96 -1.276 -9.105 30.860 1.00 10.00 C ATOM 1446 O ALA A 96 -0.878 -10.120 30.294 1.00 10.00 O ATOM 1447 CB ALA A 96 -3.573 -8.524 30.003 1.00 10.00 C ATOM 0 H ALA A 96 -3.614 -7.305 32.097 1.00 10.00 H new ATOM 0 HA ALA A 96 -3.087 -9.993 31.527 1.00 10.00 H new ATOM 0 HB1 ALA A 96 -3.392 -9.196 29.164 1.00 10.00 H new ATOM 0 HB2 ALA A 96 -4.635 -8.525 30.246 1.00 10.00 H new ATOM 0 HB3 ALA A 96 -3.264 -7.514 29.732 1.00 10.00 H new ATOM 1453 N TYR A 97 -0.467 -8.074 31.147 1.00 10.00 N ATOM 1454 CA TYR A 97 0.910 -7.968 30.661 1.00 10.00 C ATOM 1455 C TYR A 97 1.862 -7.534 31.781 1.00 10.00 C ATOM 1456 O TYR A 97 2.887 -8.170 32.004 1.00 10.00 O ATOM 1457 CB TYR A 97 0.968 -6.948 29.506 1.00 10.00 C ATOM 1458 CG TYR A 97 -0.086 -7.092 28.421 1.00 10.00 C ATOM 1459 CD1 TYR A 97 -0.253 -8.317 27.745 1.00 10.00 C ATOM 1460 CD2 TYR A 97 -0.903 -5.992 28.086 1.00 10.00 C ATOM 1461 CE1 TYR A 97 -1.248 -8.457 26.762 1.00 10.00 C ATOM 1462 CE2 TYR A 97 -1.888 -6.119 27.092 1.00 10.00 C ATOM 1463 CZ TYR A 97 -2.073 -7.358 26.439 1.00 10.00 C ATOM 1464 OH TYR A 97 -3.014 -7.474 25.467 1.00 10.00 O ATOM 0 H TYR A 97 -0.756 -7.286 31.727 1.00 10.00 H new ATOM 0 HA TYR A 97 1.227 -8.949 30.308 1.00 10.00 H new ATOM 0 HB2 TYR A 97 0.886 -5.947 29.930 1.00 10.00 H new ATOM 0 HB3 TYR A 97 1.950 -7.017 29.039 1.00 10.00 H new ATOM 0 HD1 TYR A 97 0.387 -9.153 27.984 1.00 10.00 H new ATOM 0 HD2 TYR A 97 -0.771 -5.049 28.595 1.00 10.00 H new ATOM 0 HE1 TYR A 97 -1.381 -9.402 26.256 1.00 10.00 H new ATOM 0 HE2 TYR A 97 -2.502 -5.271 26.828 1.00 10.00 H new ATOM 0 HH TYR A 97 -3.733 -8.063 25.777 1.00 10.00 H new ATOM 1474 N GLY A 98 1.514 -6.455 32.488 1.00 10.00 N ATOM 1475 CA GLY A 98 2.314 -5.806 33.514 1.00 10.00 C ATOM 1476 C GLY A 98 2.267 -4.291 33.298 1.00 10.00 C ATOM 1477 O GLY A 98 1.652 -3.828 32.329 1.00 10.00 O ATOM 0 H GLY A 98 0.617 -5.991 32.347 1.00 10.00 H new ATOM 0 HA2 GLY A 98 1.933 -6.057 34.504 1.00 10.00 H new ATOM 0 HA3 GLY A 98 3.344 -6.161 33.469 1.00 10.00 H new ATOM 1481 N PRO A 99 2.866 -3.493 34.198 1.00 10.00 N ATOM 1482 CA PRO A 99 3.066 -2.066 33.969 1.00 10.00 C ATOM 1483 C PRO A 99 3.814 -1.840 32.654 1.00 10.00 C ATOM 1484 O PRO A 99 4.824 -2.500 32.401 1.00 10.00 O ATOM 1485 CB PRO A 99 3.892 -1.555 35.157 1.00 10.00 C ATOM 1486 CG PRO A 99 3.688 -2.611 36.241 1.00 10.00 C ATOM 1487 CD PRO A 99 3.484 -3.902 35.449 1.00 10.00 C ATOM 0 HA PRO A 99 2.117 -1.536 33.893 1.00 10.00 H new ATOM 0 HB2 PRO A 99 4.945 -1.453 34.895 1.00 10.00 H new ATOM 0 HB3 PRO A 99 3.549 -0.574 35.487 1.00 10.00 H new ATOM 0 HG2 PRO A 99 4.551 -2.679 36.903 1.00 10.00 H new ATOM 0 HG3 PRO A 99 2.824 -2.383 36.866 1.00 10.00 H new ATOM 0 HD2 PRO A 99 4.433 -4.408 35.272 1.00 10.00 H new ATOM 0 HD3 PRO A 99 2.847 -4.600 35.992 1.00 10.00 H new ATOM 1495 N ALA A 100 3.344 -0.904 31.831 1.00 10.00 N ATOM 1496 CA ALA A 100 4.108 -0.454 30.684 1.00 10.00 C ATOM 1497 C ALA A 100 5.390 0.222 31.162 1.00 10.00 C ATOM 1498 O ALA A 100 5.476 0.781 32.258 1.00 10.00 O ATOM 1499 CB ALA A 100 3.292 0.510 29.825 1.00 10.00 C ATOM 0 H ALA A 100 2.439 -0.447 31.942 1.00 10.00 H new ATOM 0 HA ALA A 100 4.359 -1.319 30.070 1.00 10.00 H new ATOM 0 HB1 ALA A 100 3.889 0.832 28.972 1.00 10.00 H new ATOM 0 HB2 ALA A 100 2.392 0.008 29.469 1.00 10.00 H new ATOM 0 HB3 ALA A 100 3.012 1.379 30.420 1.00 10.00 H new ATOM 1505 N GLN A 101 6.378 0.229 30.277 1.00 10.00 N ATOM 1506 CA GLN A 101 7.640 0.912 30.429 1.00 10.00 C ATOM 1507 C GLN A 101 7.392 2.367 30.024 1.00 10.00 C ATOM 1508 O GLN A 101 7.893 2.845 29.006 1.00 10.00 O ATOM 1509 CB GLN A 101 8.719 0.172 29.616 1.00 10.00 C ATOM 1510 CG GLN A 101 8.906 -1.291 30.087 1.00 10.00 C ATOM 1511 CD GLN A 101 7.838 -2.291 29.598 1.00 10.00 C ATOM 1512 OE1 GLN A 101 7.005 -1.991 28.746 1.00 10.00 O ATOM 1513 NE2 GLN A 101 7.826 -3.500 30.133 1.00 10.00 N ATOM 0 H GLN A 101 6.309 -0.270 29.390 1.00 10.00 H new ATOM 0 HA GLN A 101 8.022 0.915 31.450 1.00 10.00 H new ATOM 0 HB2 GLN A 101 8.446 0.180 28.561 1.00 10.00 H new ATOM 0 HB3 GLN A 101 9.666 0.704 29.704 1.00 10.00 H new ATOM 0 HG2 GLN A 101 9.884 -1.639 29.753 1.00 10.00 H new ATOM 0 HG3 GLN A 101 8.918 -1.304 31.177 1.00 10.00 H new ATOM 0 HE21 GLN A 101 8.516 -3.752 30.840 1.00 10.00 H new ATOM 0 HE22 GLN A 101 7.126 -4.181 29.838 1.00 10.00 H new ATOM 1522 N HIS A 102 6.558 3.048 30.817 1.00 10.00 N ATOM 1523 CA HIS A 102 5.976 4.358 30.540 1.00 10.00 C ATOM 1524 C HIS A 102 7.002 5.426 30.151 1.00 10.00 C ATOM 1525 O HIS A 102 6.629 6.381 29.475 1.00 10.00 O ATOM 1526 CB HIS A 102 5.200 4.859 31.766 1.00 10.00 C ATOM 1527 CG HIS A 102 4.075 3.985 32.263 1.00 10.00 C ATOM 1528 ND1 HIS A 102 4.070 3.244 33.424 1.00 10.00 N ATOM 1529 CD2 HIS A 102 2.829 3.863 31.713 1.00 10.00 C ATOM 1530 CE1 HIS A 102 2.858 2.676 33.551 1.00 10.00 C ATOM 1531 NE2 HIS A 102 2.062 3.033 32.529 1.00 10.00 N ATOM 0 H HIS A 102 6.257 2.676 31.718 1.00 10.00 H new ATOM 0 HA HIS A 102 5.319 4.210 29.683 1.00 10.00 H new ATOM 0 HB2 HIS A 102 5.908 4.998 32.583 1.00 10.00 H new ATOM 0 HB3 HIS A 102 4.789 5.840 31.530 1.00 10.00 H new ATOM 0 HD1 HIS A 102 4.850 3.144 34.074 1.00 10.00 H new ATOM 0 HD2 HIS A 102 2.495 4.331 30.799 1.00 10.00 H new ATOM 0 HE1 HIS A 102 2.565 2.024 34.361 1.00 10.00 H new ATOM 1539 N ALA A 103 8.273 5.307 30.545 1.00 10.00 N ATOM 1540 CA ALA A 103 9.304 6.252 30.125 1.00 10.00 C ATOM 1541 C ALA A 103 9.469 6.259 28.598 1.00 10.00 C ATOM 1542 O ALA A 103 9.577 7.322 28.000 1.00 10.00 O ATOM 1543 CB ALA A 103 10.628 5.908 30.813 1.00 10.00 C ATOM 0 H ALA A 103 8.610 4.563 31.156 1.00 10.00 H new ATOM 0 HA ALA A 103 8.996 7.255 30.422 1.00 10.00 H new ATOM 0 HB1 ALA A 103 11.396 6.614 30.498 1.00 10.00 H new ATOM 0 HB2 ALA A 103 10.502 5.967 31.894 1.00 10.00 H new ATOM 0 HB3 ALA A 103 10.930 4.898 30.537 1.00 10.00 H new ATOM 1549 N ILE A 104 9.409 5.083 27.964 1.00 10.00 N ATOM 1550 CA ILE A 104 9.488 4.956 26.512 1.00 10.00 C ATOM 1551 C ILE A 104 8.270 5.672 25.924 1.00 10.00 C ATOM 1552 O ILE A 104 8.394 6.521 25.042 1.00 10.00 O ATOM 1553 CB ILE A 104 9.552 3.459 26.101 1.00 10.00 C ATOM 1554 CG1 ILE A 104 10.736 2.739 26.794 1.00 10.00 C ATOM 1555 CG2 ILE A 104 9.646 3.319 24.569 1.00 10.00 C ATOM 1556 CD1 ILE A 104 10.826 1.238 26.493 1.00 10.00 C ATOM 0 H ILE A 104 9.304 4.192 28.449 1.00 10.00 H new ATOM 0 HA ILE A 104 10.397 5.415 26.123 1.00 10.00 H new ATOM 0 HB ILE A 104 8.631 2.980 26.433 1.00 10.00 H new ATOM 0 HG12 ILE A 104 11.666 3.216 26.486 1.00 10.00 H new ATOM 0 HG13 ILE A 104 10.649 2.877 27.872 1.00 10.00 H new ATOM 0 HG21 ILE A 104 9.690 2.263 24.302 1.00 10.00 H new ATOM 0 HG22 ILE A 104 8.769 3.774 24.108 1.00 10.00 H new ATOM 0 HG23 ILE A 104 10.545 3.821 24.212 1.00 10.00 H new ATOM 0 HD11 ILE A 104 11.682 0.812 27.017 1.00 10.00 H new ATOM 0 HD12 ILE A 104 9.914 0.744 26.828 1.00 10.00 H new ATOM 0 HD13 ILE A 104 10.947 1.089 25.420 1.00 10.00 H new ATOM 1568 N SER A 105 7.077 5.343 26.430 1.00 10.00 N ATOM 1569 CA SER A 105 5.826 5.871 25.921 1.00 10.00 C ATOM 1570 C SER A 105 5.751 7.391 26.060 1.00 10.00 C ATOM 1571 O SER A 105 5.373 8.056 25.104 1.00 10.00 O ATOM 1572 CB SER A 105 4.662 5.200 26.652 1.00 10.00 C ATOM 1573 OG SER A 105 4.884 3.799 26.744 1.00 10.00 O ATOM 0 H SER A 105 6.961 4.697 27.211 1.00 10.00 H new ATOM 0 HA SER A 105 5.765 5.649 24.856 1.00 10.00 H new ATOM 0 HB2 SER A 105 4.556 5.625 27.650 1.00 10.00 H new ATOM 0 HB3 SER A 105 3.730 5.394 26.122 1.00 10.00 H new ATOM 0 HG SER A 105 4.349 3.431 27.478 1.00 10.00 H new ATOM 1579 N THR A 106 6.102 7.946 27.218 1.00 10.00 N ATOM 1580 CA THR A 106 5.954 9.374 27.460 1.00 10.00 C ATOM 1581 C THR A 106 6.874 10.183 26.543 1.00 10.00 C ATOM 1582 O THR A 106 6.433 11.201 26.006 1.00 10.00 O ATOM 1583 CB THR A 106 6.147 9.709 28.950 1.00 10.00 C ATOM 1584 OG1 THR A 106 7.251 9.037 29.522 1.00 10.00 O ATOM 1585 CG2 THR A 106 4.909 9.308 29.759 1.00 10.00 C ATOM 0 H THR A 106 6.492 7.425 28.003 1.00 10.00 H new ATOM 0 HA THR A 106 4.933 9.663 27.210 1.00 10.00 H new ATOM 0 HB THR A 106 6.318 10.785 28.990 1.00 10.00 H new ATOM 0 HG1 THR A 106 7.023 8.094 29.663 1.00 10.00 H new ATOM 0 HG21 THR A 106 5.066 9.553 30.809 1.00 10.00 H new ATOM 0 HG22 THR A 106 4.040 9.849 29.386 1.00 10.00 H new ATOM 0 HG23 THR A 106 4.740 8.236 29.658 1.00 10.00 H new ATOM 1593 N GLU A 107 8.099 9.719 26.276 1.00 10.00 N ATOM 1594 CA GLU A 107 8.982 10.409 25.347 1.00 10.00 C ATOM 1595 C GLU A 107 8.461 10.300 23.912 1.00 10.00 C ATOM 1596 O GLU A 107 8.463 11.294 23.181 1.00 10.00 O ATOM 1597 CB GLU A 107 10.416 9.872 25.428 1.00 10.00 C ATOM 1598 CG GLU A 107 11.121 10.254 26.740 1.00 10.00 C ATOM 1599 CD GLU A 107 12.612 9.842 26.736 1.00 10.00 C ATOM 1600 OE1 GLU A 107 13.428 10.663 26.261 1.00 10.00 O ATOM 1601 OE2 GLU A 107 12.931 8.733 27.216 1.00 10.00 O ATOM 0 H GLU A 107 8.494 8.874 26.689 1.00 10.00 H new ATOM 0 HA GLU A 107 8.996 11.460 25.636 1.00 10.00 H new ATOM 0 HB2 GLU A 107 10.399 8.786 25.333 1.00 10.00 H new ATOM 0 HB3 GLU A 107 10.991 10.257 24.586 1.00 10.00 H new ATOM 0 HG2 GLU A 107 11.042 11.330 26.894 1.00 10.00 H new ATOM 0 HG3 GLU A 107 10.614 9.774 27.577 1.00 10.00 H new ATOM 1608 N LYS A 108 7.979 9.118 23.508 1.00 10.00 N ATOM 1609 CA LYS A 108 7.399 8.920 22.179 1.00 10.00 C ATOM 1610 C LYS A 108 6.198 9.842 21.987 1.00 10.00 C ATOM 1611 O LYS A 108 6.132 10.520 20.962 1.00 10.00 O ATOM 1612 CB LYS A 108 7.011 7.445 21.985 1.00 10.00 C ATOM 1613 CG LYS A 108 8.189 6.599 21.484 1.00 10.00 C ATOM 1614 CD LYS A 108 7.785 5.126 21.319 1.00 10.00 C ATOM 1615 CE LYS A 108 8.936 4.310 20.710 1.00 10.00 C ATOM 1616 NZ LYS A 108 8.887 4.277 19.229 1.00 10.00 N ATOM 0 H LYS A 108 7.981 8.280 24.090 1.00 10.00 H new ATOM 0 HA LYS A 108 8.141 9.174 21.422 1.00 10.00 H new ATOM 0 HB2 LYS A 108 6.649 7.039 22.930 1.00 10.00 H new ATOM 0 HB3 LYS A 108 6.188 7.378 21.273 1.00 10.00 H new ATOM 0 HG2 LYS A 108 8.542 6.991 20.530 1.00 10.00 H new ATOM 0 HG3 LYS A 108 9.019 6.675 22.186 1.00 10.00 H new ATOM 0 HD2 LYS A 108 7.510 4.709 22.288 1.00 10.00 H new ATOM 0 HD3 LYS A 108 6.905 5.055 20.680 1.00 10.00 H new ATOM 0 HE2 LYS A 108 9.887 4.735 21.029 1.00 10.00 H new ATOM 0 HE3 LYS A 108 8.898 3.291 21.094 1.00 10.00 H new ATOM 0 HZ1 LYS A 108 9.820 4.008 18.857 1.00 10.00 H new ATOM 0 HZ2 LYS A 108 8.178 3.582 18.921 1.00 10.00 H new ATOM 0 HZ3 LYS A 108 8.629 5.218 18.869 1.00 10.00 H new ATOM 1630 N ILE A 109 5.284 9.888 22.959 1.00 10.00 N ATOM 1631 CA ILE A 109 4.141 10.791 22.949 1.00 10.00 C ATOM 1632 C ILE A 109 4.666 12.220 22.830 1.00 10.00 C ATOM 1633 O ILE A 109 4.260 12.913 21.909 1.00 10.00 O ATOM 1634 CB ILE A 109 3.253 10.573 24.198 1.00 10.00 C ATOM 1635 CG1 ILE A 109 2.560 9.190 24.170 1.00 10.00 C ATOM 1636 CG2 ILE A 109 2.171 11.662 24.320 1.00 10.00 C ATOM 1637 CD1 ILE A 109 2.012 8.764 25.542 1.00 10.00 C ATOM 0 H ILE A 109 5.321 9.289 23.784 1.00 10.00 H new ATOM 0 HA ILE A 109 3.496 10.588 22.094 1.00 10.00 H new ATOM 0 HB ILE A 109 3.919 10.626 25.059 1.00 10.00 H new ATOM 0 HG12 ILE A 109 1.742 9.214 23.450 1.00 10.00 H new ATOM 0 HG13 ILE A 109 3.270 8.441 23.820 1.00 10.00 H new ATOM 0 HG21 ILE A 109 1.567 11.477 25.208 1.00 10.00 H new ATOM 0 HG22 ILE A 109 2.646 12.640 24.402 1.00 10.00 H new ATOM 0 HG23 ILE A 109 1.533 11.642 23.436 1.00 10.00 H new ATOM 0 HD11 ILE A 109 1.538 7.786 25.457 1.00 10.00 H new ATOM 0 HD12 ILE A 109 2.831 8.709 26.260 1.00 10.00 H new ATOM 0 HD13 ILE A 109 1.278 9.494 25.884 1.00 10.00 H new ATOM 1649 N LYS A 110 5.600 12.648 23.686 1.00 10.00 N ATOM 1650 CA LYS A 110 6.105 14.020 23.673 1.00 10.00 C ATOM 1651 C LYS A 110 6.661 14.393 22.298 1.00 10.00 C ATOM 1652 O LYS A 110 6.456 15.517 21.852 1.00 10.00 O ATOM 1653 CB LYS A 110 7.134 14.191 24.804 1.00 10.00 C ATOM 1654 CG LYS A 110 7.516 15.667 25.003 1.00 10.00 C ATOM 1655 CD LYS A 110 8.222 15.929 26.345 1.00 10.00 C ATOM 1656 CE LYS A 110 9.549 15.175 26.540 1.00 10.00 C ATOM 1657 NZ LYS A 110 10.628 15.645 25.630 1.00 10.00 N ATOM 0 H LYS A 110 6.023 12.056 24.401 1.00 10.00 H new ATOM 0 HA LYS A 110 5.286 14.715 23.858 1.00 10.00 H new ATOM 0 HB2 LYS A 110 6.725 13.792 25.732 1.00 10.00 H new ATOM 0 HB3 LYS A 110 8.028 13.611 24.574 1.00 10.00 H new ATOM 0 HG2 LYS A 110 8.168 15.981 24.188 1.00 10.00 H new ATOM 0 HG3 LYS A 110 6.617 16.280 24.946 1.00 10.00 H new ATOM 0 HD2 LYS A 110 8.413 16.998 26.435 1.00 10.00 H new ATOM 0 HD3 LYS A 110 7.544 15.656 27.154 1.00 10.00 H new ATOM 0 HE2 LYS A 110 9.877 15.291 27.573 1.00 10.00 H new ATOM 0 HE3 LYS A 110 9.382 14.110 26.376 1.00 10.00 H new ATOM 0 HZ1 LYS A 110 11.495 15.100 25.809 1.00 10.00 H new ATOM 0 HZ2 LYS A 110 10.332 15.510 24.642 1.00 10.00 H new ATOM 0 HZ3 LYS A 110 10.812 16.654 25.802 1.00 10.00 H new ATOM 1671 N ALA A 111 7.376 13.476 21.639 1.00 10.00 N ATOM 1672 CA ALA A 111 7.938 13.708 20.320 1.00 10.00 C ATOM 1673 C ALA A 111 6.847 13.816 19.246 1.00 10.00 C ATOM 1674 O ALA A 111 6.884 14.745 18.445 1.00 10.00 O ATOM 1675 CB ALA A 111 8.934 12.586 19.991 1.00 10.00 C ATOM 0 H ALA A 111 7.578 12.549 22.014 1.00 10.00 H new ATOM 0 HA ALA A 111 8.462 14.664 20.327 1.00 10.00 H new ATOM 0 HB1 ALA A 111 9.359 12.755 19.002 1.00 10.00 H new ATOM 0 HB2 ALA A 111 9.733 12.579 20.733 1.00 10.00 H new ATOM 0 HB3 ALA A 111 8.418 11.626 20.005 1.00 10.00 H new ATOM 1681 N LYS A 112 5.914 12.857 19.171 1.00 10.00 N ATOM 1682 CA LYS A 112 4.970 12.767 18.045 1.00 10.00 C ATOM 1683 C LYS A 112 3.713 13.621 18.255 1.00 10.00 C ATOM 1684 O LYS A 112 3.075 14.003 17.277 1.00 10.00 O ATOM 1685 CB LYS A 112 4.572 11.302 17.778 1.00 10.00 C ATOM 1686 CG LYS A 112 5.557 10.556 16.862 1.00 10.00 C ATOM 1687 CD LYS A 112 6.885 10.185 17.538 1.00 10.00 C ATOM 1688 CE LYS A 112 7.834 9.527 16.526 1.00 10.00 C ATOM 1689 NZ LYS A 112 8.938 8.788 17.186 1.00 10.00 N ATOM 0 H LYS A 112 5.792 12.131 19.877 1.00 10.00 H new ATOM 0 HA LYS A 112 5.491 13.165 17.174 1.00 10.00 H new ATOM 0 HB2 LYS A 112 4.501 10.774 18.729 1.00 10.00 H new ATOM 0 HB3 LYS A 112 3.580 11.280 17.326 1.00 10.00 H new ATOM 0 HG2 LYS A 112 5.080 9.646 16.499 1.00 10.00 H new ATOM 0 HG3 LYS A 112 5.766 11.176 15.990 1.00 10.00 H new ATOM 0 HD2 LYS A 112 7.350 11.078 17.955 1.00 10.00 H new ATOM 0 HD3 LYS A 112 6.700 9.504 18.369 1.00 10.00 H new ATOM 0 HE2 LYS A 112 7.269 8.842 15.894 1.00 10.00 H new ATOM 0 HE3 LYS A 112 8.252 10.293 15.873 1.00 10.00 H new ATOM 0 HZ1 LYS A 112 9.711 8.640 16.507 1.00 10.00 H new ATOM 0 HZ2 LYS A 112 9.289 9.339 17.995 1.00 10.00 H new ATOM 0 HZ3 LYS A 112 8.589 7.867 17.519 1.00 10.00 H new ATOM 1786 N VAL A 118 4.475 15.928 29.363 1.00 10.00 N ATOM 1787 CA VAL A 118 4.102 14.522 29.302 1.00 10.00 C ATOM 1788 C VAL A 118 4.977 13.803 30.332 1.00 10.00 C ATOM 1789 O VAL A 118 6.192 13.724 30.162 1.00 10.00 O ATOM 1790 CB VAL A 118 4.301 13.949 27.878 1.00 10.00 C ATOM 1791 CG1 VAL A 118 3.621 12.575 27.755 1.00 10.00 C ATOM 1792 CG2 VAL A 118 3.779 14.862 26.760 1.00 10.00 C ATOM 0 HA VAL A 118 3.045 14.383 29.529 1.00 10.00 H new ATOM 0 HB VAL A 118 5.380 13.864 27.746 1.00 10.00 H new ATOM 0 HG11 VAL A 118 3.769 12.184 26.748 1.00 10.00 H new ATOM 0 HG12 VAL A 118 4.057 11.887 28.479 1.00 10.00 H new ATOM 0 HG13 VAL A 118 2.554 12.678 27.950 1.00 10.00 H new ATOM 0 HG21 VAL A 118 3.955 14.391 25.793 1.00 10.00 H new ATOM 0 HG22 VAL A 118 2.710 15.027 26.894 1.00 10.00 H new ATOM 0 HG23 VAL A 118 4.301 15.818 26.798 1.00 10.00 H new ATOM 1802 N THR A 119 4.365 13.269 31.390 1.00 10.00 N ATOM 1803 CA THR A 119 5.054 12.569 32.470 1.00 10.00 C ATOM 1804 C THR A 119 4.252 11.329 32.865 1.00 10.00 C ATOM 1805 O THR A 119 3.139 11.120 32.375 1.00 10.00 O ATOM 1806 CB THR A 119 5.267 13.529 33.661 1.00 10.00 C ATOM 1807 OG1 THR A 119 4.087 14.268 33.962 1.00 10.00 O ATOM 1808 CG2 THR A 119 6.417 14.505 33.410 1.00 10.00 C ATOM 0 H THR A 119 3.354 13.313 31.521 1.00 10.00 H new ATOM 0 HA THR A 119 6.038 12.237 32.138 1.00 10.00 H new ATOM 0 HB THR A 119 5.519 12.898 34.514 1.00 10.00 H new ATOM 0 HG1 THR A 119 3.403 13.662 34.316 1.00 10.00 H new ATOM 0 HG21 THR A 119 6.532 15.161 34.273 1.00 10.00 H new ATOM 0 HG22 THR A 119 7.340 13.947 33.253 1.00 10.00 H new ATOM 0 HG23 THR A 119 6.200 15.103 32.525 1.00 10.00 H new ATOM 1816 N TRP A 120 4.795 10.509 33.764 1.00 10.00 N ATOM 1817 CA TRP A 120 4.097 9.363 34.321 1.00 10.00 C ATOM 1818 C TRP A 120 4.459 9.206 35.795 1.00 10.00 C ATOM 1819 O TRP A 120 5.493 9.713 36.234 1.00 10.00 O ATOM 1820 CB TRP A 120 4.454 8.096 33.531 1.00 10.00 C ATOM 1821 CG TRP A 120 5.869 7.620 33.670 1.00 10.00 C ATOM 1822 CD1 TRP A 120 6.931 8.050 32.951 1.00 10.00 C ATOM 1823 CD2 TRP A 120 6.398 6.619 34.595 1.00 10.00 C ATOM 1824 NE1 TRP A 120 8.070 7.396 33.367 1.00 10.00 N ATOM 1825 CE2 TRP A 120 7.802 6.494 34.374 1.00 10.00 C ATOM 1826 CE3 TRP A 120 5.824 5.781 35.577 1.00 10.00 C ATOM 1827 CZ2 TRP A 120 8.597 5.592 35.099 1.00 10.00 C ATOM 1828 CZ3 TRP A 120 6.612 4.875 36.312 1.00 10.00 C ATOM 1829 CH2 TRP A 120 7.996 4.780 36.076 1.00 10.00 C ATOM 0 H TRP A 120 5.741 10.627 34.126 1.00 10.00 H new ATOM 0 HA TRP A 120 3.021 9.521 34.244 1.00 10.00 H new ATOM 0 HB2 TRP A 120 3.787 7.293 33.847 1.00 10.00 H new ATOM 0 HB3 TRP A 120 4.254 8.280 32.475 1.00 10.00 H new ATOM 0 HD1 TRP A 120 6.892 8.794 32.169 1.00 10.00 H new ATOM 0 HE1 TRP A 120 8.998 7.559 32.977 1.00 10.00 H new ATOM 0 HE3 TRP A 120 4.762 5.836 35.767 1.00 10.00 H new ATOM 0 HZ2 TRP A 120 9.658 5.523 34.908 1.00 10.00 H new ATOM 0 HZ3 TRP A 120 6.151 4.249 37.062 1.00 10.00 H new ATOM 0 HH2 TRP A 120 8.595 4.084 36.645 1.00 10.00 H new ATOM 1840 N ALA A 121 3.621 8.495 36.544 1.00 10.00 N ATOM 1841 CA ALA A 121 3.856 8.092 37.922 1.00 10.00 C ATOM 1842 C ALA A 121 2.947 6.902 38.227 1.00 10.00 C ATOM 1843 O ALA A 121 1.947 6.692 37.543 1.00 10.00 O ATOM 1844 CB ALA A 121 3.523 9.252 38.873 1.00 10.00 C ATOM 0 H ALA A 121 2.721 8.171 36.189 1.00 10.00 H new ATOM 0 HA ALA A 121 4.902 7.820 38.060 1.00 10.00 H new ATOM 0 HB1 ALA A 121 3.702 8.941 39.902 1.00 10.00 H new ATOM 0 HB2 ALA A 121 4.155 10.108 38.637 1.00 10.00 H new ATOM 0 HB3 ALA A 121 2.476 9.530 38.755 1.00 10.00 H new