USER MOD reduce.3.24.130724 H: found=0, std=0, add=775, rem=0, adj=29 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= 0.674 K(o=1.8,f=-4.5!) USER MOD Set 1.2: A 119 THR OG1 : rot 85:sc= 1.12 USER MOD Set 2.1: A 53 HIS : no HD1:sc= -0.221 K(o=-0.64,f=-2.7!) USER MOD Set 2.2: A 94 SER OG : rot -160:sc= -0.423 USER MOD Set 3.1: A 28 HIS : no HE2:sc= 0.873 K(o=1.6,f=-10!) USER MOD Set 3.2: A 40 SER OG : rot -33:sc= 0.773 USER MOD Set 4.1: A 22 TYR OH : rot -64:sc= 1.02 USER MOD Set 4.2: A 102 HIS : no HE2:sc= -0.316 K(o=1.9,f=1.3) USER MOD Set 4.3: A 105 SER OG : rot 178:sc= 1.18 USER MOD Single : A 21 LYS NZ :NH3+ -160:sc= 2.04 (180deg=1.53) USER MOD Single : A 29 SER OG : rot -78:sc= 1.26 USER MOD Single : A 33 SER OG : rot 180:sc= 0.043 USER MOD Single : A 41 LYS NZ :NH3+ 179:sc= 1.76 (180deg=1.7) USER MOD Single : A 47 TYR OH : rot -27:sc= 1.29 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 -8:sc= 0.359 USER MOD Single : A 59 LYS NZ :NH3+ 166:sc= 0.0238 (180deg=0.00355) USER MOD Single : A 61 SER OG : rot -80:sc= 1.24 USER MOD Single : A 64 MET CE :methyl -162:sc= -0.04 (180deg=-0.749) USER MOD Single : A 65 GLN : amide:sc= 0.892 K(o=0.89,f=0) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 GLN : amide:sc= 0.821 K(o=0.82,f=-0.32) USER MOD Single : A 69 CYS SG : rot 18:sc= -0.745 USER MOD Single : A 71 CYS SG : rot -170:sc= -1.13 USER MOD Single : A 73 CYS SG : rot 153:sc= 1.29 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 172:sc= 0 (180deg=-0.0783) USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 106 THR OG1 : rot 7:sc= 0.0852 USER MOD Single : A 108 LYS NZ :NH3+ 160:sc= 1.6 (180deg=0.38) USER MOD Single : A 110 LYS NZ :NH3+ 155:sc= 1.27 (180deg=0.902) USER MOD Single : A 112 LYS NZ :NH3+ -155:sc= 0.946 (180deg=0.4) USER MOD ----------------------------------------------------------------- ATOM 46 N ALA A 4 3.852 -2.933 3.952 1.00 10.00 N ATOM 47 CA ALA A 4 4.211 -1.834 4.836 1.00 10.00 C ATOM 48 C ALA A 4 5.717 -1.821 5.130 1.00 10.00 C ATOM 49 O ALA A 4 6.466 -2.720 4.740 1.00 10.00 O ATOM 50 CB ALA A 4 3.417 -1.947 6.143 1.00 10.00 C ATOM 0 HA ALA A 4 3.963 -0.897 4.337 1.00 10.00 H new ATOM 0 HB1 ALA A 4 3.686 -1.124 6.805 1.00 10.00 H new ATOM 0 HB2 ALA A 4 2.350 -1.903 5.925 1.00 10.00 H new ATOM 0 HB3 ALA A 4 3.650 -2.894 6.629 1.00 10.00 H new ATOM 56 N ASP A 5 6.124 -0.820 5.912 1.00 10.00 N ATOM 57 CA ASP A 5 7.454 -0.685 6.501 1.00 10.00 C ATOM 58 C ASP A 5 7.259 0.021 7.845 1.00 10.00 C ATOM 59 O ASP A 5 6.292 0.777 8.023 1.00 10.00 O ATOM 60 CB ASP A 5 8.373 0.122 5.573 1.00 10.00 C ATOM 61 CG ASP A 5 9.768 0.267 6.168 1.00 10.00 C ATOM 62 OD1 ASP A 5 9.948 1.245 6.930 1.00 10.00 O ATOM 63 OD2 ASP A 5 10.563 -0.669 5.954 1.00 10.00 O ATOM 0 H ASP A 5 5.507 -0.048 6.162 1.00 10.00 H new ATOM 0 HA ASP A 5 7.930 -1.655 6.642 1.00 10.00 H new ATOM 0 HB2 ASP A 5 8.438 -0.371 4.603 1.00 10.00 H new ATOM 0 HB3 ASP A 5 7.944 1.109 5.401 1.00 10.00 H new ATOM 68 N LEU A 6 8.140 -0.231 8.817 1.00 10.00 N ATOM 69 CA LEU A 6 8.041 0.371 10.149 1.00 10.00 C ATOM 70 C LEU A 6 8.095 1.902 10.145 1.00 10.00 C ATOM 71 O LEU A 6 7.605 2.496 11.115 1.00 10.00 O ATOM 72 CB LEU A 6 9.133 -0.198 11.070 1.00 10.00 C ATOM 73 CG LEU A 6 8.811 -1.621 11.565 1.00 10.00 C ATOM 74 CD1 LEU A 6 10.060 -2.244 12.192 1.00 10.00 C ATOM 75 CD2 LEU A 6 7.675 -1.627 12.598 1.00 10.00 C ATOM 0 H LEU A 6 8.939 -0.855 8.703 1.00 10.00 H new ATOM 0 HA LEU A 6 7.054 0.106 10.529 1.00 10.00 H new ATOM 0 HB2 LEU A 6 10.083 -0.210 10.536 1.00 10.00 H new ATOM 0 HB3 LEU A 6 9.258 0.461 11.929 1.00 10.00 H new ATOM 0 HG LEU A 6 8.487 -2.202 10.702 1.00 10.00 H new ATOM 0 HD11 LEU A 6 9.829 -3.250 12.541 1.00 10.00 H new ATOM 0 HD12 LEU A 6 10.855 -2.292 11.448 1.00 10.00 H new ATOM 0 HD13 LEU A 6 10.387 -1.634 13.034 1.00 10.00 H new ATOM 0 HD21 LEU A 6 7.481 -2.650 12.920 1.00 10.00 H new ATOM 0 HD22 LEU A 6 7.963 -1.024 13.459 1.00 10.00 H new ATOM 0 HD23 LEU A 6 6.773 -1.211 12.149 1.00 10.00 H new ATOM 87 N ALA A 7 8.662 2.530 9.106 1.00 10.00 N ATOM 88 CA ALA A 7 8.626 3.976 8.937 1.00 10.00 C ATOM 89 C ALA A 7 7.206 4.476 8.657 1.00 10.00 C ATOM 90 O ALA A 7 6.866 5.579 9.077 1.00 10.00 O ATOM 91 CB ALA A 7 9.544 4.388 7.782 1.00 10.00 C ATOM 0 H ALA A 7 9.158 2.042 8.361 1.00 10.00 H new ATOM 0 HA ALA A 7 8.970 4.427 9.868 1.00 10.00 H new ATOM 0 HB1 ALA A 7 9.513 5.471 7.661 1.00 10.00 H new ATOM 0 HB2 ALA A 7 10.566 4.077 8.000 1.00 10.00 H new ATOM 0 HB3 ALA A 7 9.208 3.910 6.862 1.00 10.00 H new ATOM 97 N LEU A 8 6.388 3.683 7.951 1.00 10.00 N ATOM 98 CA LEU A 8 5.026 4.071 7.580 1.00 10.00 C ATOM 99 C LEU A 8 4.080 3.885 8.766 1.00 10.00 C ATOM 100 O LEU A 8 3.104 4.617 8.917 1.00 10.00 O ATOM 101 CB LEU A 8 4.531 3.219 6.391 1.00 10.00 C ATOM 102 CG LEU A 8 5.375 3.338 5.106 1.00 10.00 C ATOM 103 CD1 LEU A 8 4.802 2.412 4.025 1.00 10.00 C ATOM 104 CD2 LEU A 8 5.423 4.775 4.565 1.00 10.00 C ATOM 0 H LEU A 8 6.655 2.755 7.622 1.00 10.00 H new ATOM 0 HA LEU A 8 5.036 5.122 7.290 1.00 10.00 H new ATOM 0 HB2 LEU A 8 4.509 2.173 6.697 1.00 10.00 H new ATOM 0 HB3 LEU A 8 3.505 3.505 6.161 1.00 10.00 H new ATOM 0 HG LEU A 8 6.394 3.046 5.362 1.00 10.00 H new ATOM 0 HD11 LEU A 8 5.400 2.498 3.118 1.00 10.00 H new ATOM 0 HD12 LEU A 8 4.826 1.381 4.379 1.00 10.00 H new ATOM 0 HD13 LEU A 8 3.773 2.698 3.809 1.00 10.00 H new ATOM 0 HD21 LEU A 8 6.030 4.803 3.660 1.00 10.00 H new ATOM 0 HD22 LEU A 8 4.412 5.111 4.335 1.00 10.00 H new ATOM 0 HD23 LEU A 8 5.861 5.432 5.316 1.00 10.00 H new ATOM 116 N ILE A 9 4.332 2.859 9.584 1.00 10.00 N ATOM 117 CA ILE A 9 3.521 2.553 10.754 1.00 10.00 C ATOM 118 C ILE A 9 3.673 3.718 11.750 1.00 10.00 C ATOM 119 O ILE A 9 4.802 3.997 12.174 1.00 10.00 O ATOM 120 CB ILE A 9 3.952 1.175 11.317 1.00 10.00 C ATOM 121 CG1 ILE A 9 3.456 0.077 10.340 1.00 10.00 C ATOM 122 CG2 ILE A 9 3.420 0.925 12.745 1.00 10.00 C ATOM 123 CD1 ILE A 9 4.158 -1.275 10.491 1.00 10.00 C ATOM 0 H ILE A 9 5.112 2.216 9.447 1.00 10.00 H new ATOM 0 HA ILE A 9 2.460 2.465 10.519 1.00 10.00 H new ATOM 0 HB ILE A 9 5.039 1.153 11.396 1.00 10.00 H new ATOM 0 HG12 ILE A 9 2.386 -0.066 10.488 1.00 10.00 H new ATOM 0 HG13 ILE A 9 3.592 0.430 9.318 1.00 10.00 H new ATOM 0 HG21 ILE A 9 3.751 -0.054 13.090 1.00 10.00 H new ATOM 0 HG22 ILE A 9 3.802 1.695 13.416 1.00 10.00 H new ATOM 0 HG23 ILE A 9 2.331 0.958 12.738 1.00 10.00 H new ATOM 0 HD11 ILE A 9 3.748 -1.981 9.769 1.00 10.00 H new ATOM 0 HD12 ILE A 9 5.226 -1.152 10.312 1.00 10.00 H new ATOM 0 HD13 ILE A 9 4.001 -1.656 11.500 1.00 10.00 H new ATOM 135 N PRO A 10 2.577 4.356 12.208 1.00 10.00 N ATOM 136 CA PRO A 10 2.660 5.503 13.100 1.00 10.00 C ATOM 137 C PRO A 10 3.253 5.076 14.441 1.00 10.00 C ATOM 138 O PRO A 10 2.959 3.988 14.945 1.00 10.00 O ATOM 139 CB PRO A 10 1.233 6.042 13.238 1.00 10.00 C ATOM 140 CG PRO A 10 0.352 4.837 12.917 1.00 10.00 C ATOM 141 CD PRO A 10 1.186 4.044 11.910 1.00 10.00 C ATOM 0 HA PRO A 10 3.315 6.284 12.713 1.00 10.00 H new ATOM 0 HB2 PRO A 10 1.044 6.419 14.243 1.00 10.00 H new ATOM 0 HB3 PRO A 10 1.049 6.866 12.549 1.00 10.00 H new ATOM 0 HG2 PRO A 10 0.135 4.250 13.809 1.00 10.00 H new ATOM 0 HG3 PRO A 10 -0.606 5.141 12.494 1.00 10.00 H new ATOM 0 HD2 PRO A 10 0.997 2.975 12.003 1.00 10.00 H new ATOM 0 HD3 PRO A 10 0.934 4.324 10.887 1.00 10.00 H new ATOM 149 N ASP A 11 4.117 5.912 15.012 1.00 10.00 N ATOM 150 CA ASP A 11 4.911 5.586 16.200 1.00 10.00 C ATOM 151 C ASP A 11 4.079 5.683 17.478 1.00 10.00 C ATOM 152 O ASP A 11 4.219 4.874 18.392 1.00 10.00 O ATOM 153 CB ASP A 11 6.108 6.538 16.277 1.00 10.00 C ATOM 154 CG ASP A 11 7.126 6.032 17.290 1.00 10.00 C ATOM 155 OD1 ASP A 11 7.693 4.942 17.046 1.00 10.00 O ATOM 156 OD2 ASP A 11 7.329 6.681 18.337 1.00 10.00 O ATOM 0 H ASP A 11 4.290 6.853 14.658 1.00 10.00 H new ATOM 0 HA ASP A 11 5.257 4.556 16.114 1.00 10.00 H new ATOM 0 HB2 ASP A 11 6.575 6.625 15.296 1.00 10.00 H new ATOM 0 HB3 ASP A 11 5.770 7.535 16.559 1.00 10.00 H new ATOM 161 N VAL A 12 3.102 6.591 17.481 1.00 10.00 N ATOM 162 CA VAL A 12 2.168 6.861 18.563 1.00 10.00 C ATOM 163 C VAL A 12 0.822 7.106 17.877 1.00 10.00 C ATOM 164 O VAL A 12 0.792 7.811 16.868 1.00 10.00 O ATOM 165 CB VAL A 12 2.644 8.104 19.349 1.00 10.00 C ATOM 166 CG1 VAL A 12 1.695 8.468 20.504 1.00 10.00 C ATOM 167 CG2 VAL A 12 4.057 7.921 19.917 1.00 10.00 C ATOM 0 H VAL A 12 2.936 7.193 16.674 1.00 10.00 H new ATOM 0 HA VAL A 12 2.094 6.044 19.280 1.00 10.00 H new ATOM 0 HB VAL A 12 2.648 8.917 18.624 1.00 10.00 H new ATOM 0 HG11 VAL A 12 2.075 9.348 21.024 1.00 10.00 H new ATOM 0 HG12 VAL A 12 0.703 8.682 20.106 1.00 10.00 H new ATOM 0 HG13 VAL A 12 1.634 7.633 21.202 1.00 10.00 H new ATOM 0 HG21 VAL A 12 4.350 8.819 20.461 1.00 10.00 H new ATOM 0 HG22 VAL A 12 4.069 7.067 20.594 1.00 10.00 H new ATOM 0 HG23 VAL A 12 4.758 7.747 19.100 1.00 10.00 H new ATOM 177 N ASP A 13 -0.257 6.533 18.412 1.00 10.00 N ATOM 178 CA ASP A 13 -1.627 6.798 17.961 1.00 10.00 C ATOM 179 C ASP A 13 -2.539 6.603 19.162 1.00 10.00 C ATOM 180 O ASP A 13 -2.722 5.480 19.631 1.00 10.00 O ATOM 181 CB ASP A 13 -2.042 5.885 16.803 1.00 10.00 C ATOM 182 CG ASP A 13 -3.499 6.119 16.410 1.00 10.00 C ATOM 183 OD1 ASP A 13 -3.950 7.272 16.583 1.00 10.00 O ATOM 184 OD2 ASP A 13 -4.129 5.115 16.002 1.00 10.00 O ATOM 0 H ASP A 13 -0.205 5.864 19.180 1.00 10.00 H new ATOM 0 HA ASP A 13 -1.698 7.816 17.577 1.00 10.00 H new ATOM 0 HB2 ASP A 13 -1.397 6.067 15.943 1.00 10.00 H new ATOM 0 HB3 ASP A 13 -1.903 4.843 17.090 1.00 10.00 H new ATOM 189 N ILE A 14 -2.969 7.708 19.762 1.00 10.00 N ATOM 190 CA ILE A 14 -3.643 7.749 21.055 1.00 10.00 C ATOM 191 C ILE A 14 -4.914 8.609 20.944 1.00 10.00 C ATOM 192 O ILE A 14 -5.150 9.475 21.787 1.00 10.00 O ATOM 193 CB ILE A 14 -2.652 8.172 22.170 1.00 10.00 C ATOM 194 CG1 ILE A 14 -2.000 9.554 21.922 1.00 10.00 C ATOM 195 CG2 ILE A 14 -1.580 7.079 22.372 1.00 10.00 C ATOM 196 CD1 ILE A 14 -1.331 10.136 23.174 1.00 10.00 C ATOM 0 H ILE A 14 -2.854 8.632 19.347 1.00 10.00 H new ATOM 0 HA ILE A 14 -3.983 6.756 21.351 1.00 10.00 H new ATOM 0 HB ILE A 14 -3.234 8.279 23.085 1.00 10.00 H new ATOM 0 HG12 ILE A 14 -1.257 9.462 21.130 1.00 10.00 H new ATOM 0 HG13 ILE A 14 -2.760 10.250 21.567 1.00 10.00 H new ATOM 0 HG21 ILE A 14 -0.890 7.387 23.157 1.00 10.00 H new ATOM 0 HG22 ILE A 14 -2.063 6.145 22.659 1.00 10.00 H new ATOM 0 HG23 ILE A 14 -1.030 6.933 21.442 1.00 10.00 H new ATOM 0 HD11 ILE A 14 -0.893 11.105 22.935 1.00 10.00 H new ATOM 0 HD12 ILE A 14 -2.075 10.258 23.961 1.00 10.00 H new ATOM 0 HD13 ILE A 14 -0.549 9.459 23.517 1.00 10.00 H new ATOM 250 N VAL A 19 -9.233 10.358 30.588 1.00 10.00 N ATOM 251 CA VAL A 19 -8.498 9.125 30.864 1.00 10.00 C ATOM 252 C VAL A 19 -8.896 8.087 29.804 1.00 10.00 C ATOM 253 O VAL A 19 -10.079 7.996 29.464 1.00 10.00 O ATOM 254 CB VAL A 19 -8.795 8.625 32.295 1.00 10.00 C ATOM 255 CG1 VAL A 19 -7.924 7.408 32.645 1.00 10.00 C ATOM 256 CG2 VAL A 19 -8.565 9.722 33.349 1.00 10.00 C ATOM 0 HA VAL A 19 -7.424 9.301 30.810 1.00 10.00 H new ATOM 0 HB VAL A 19 -9.847 8.341 32.311 1.00 10.00 H new ATOM 0 HG11 VAL A 19 -8.153 7.076 33.658 1.00 10.00 H new ATOM 0 HG12 VAL A 19 -8.129 6.600 31.943 1.00 10.00 H new ATOM 0 HG13 VAL A 19 -6.871 7.684 32.583 1.00 10.00 H new ATOM 0 HG21 VAL A 19 -8.786 9.326 34.340 1.00 10.00 H new ATOM 0 HG22 VAL A 19 -7.526 10.050 33.312 1.00 10.00 H new ATOM 0 HG23 VAL A 19 -9.220 10.568 33.142 1.00 10.00 H new ATOM 266 N PHE A 20 -7.949 7.294 29.292 1.00 10.00 N ATOM 267 CA PHE A 20 -8.214 6.164 28.410 1.00 10.00 C ATOM 268 C PHE A 20 -7.120 5.094 28.534 1.00 10.00 C ATOM 269 O PHE A 20 -5.971 5.359 28.885 1.00 10.00 O ATOM 270 CB PHE A 20 -8.381 6.648 26.965 1.00 10.00 C ATOM 271 CG PHE A 20 -7.218 7.416 26.373 1.00 10.00 C ATOM 272 CD1 PHE A 20 -6.205 6.740 25.667 1.00 10.00 C ATOM 273 CD2 PHE A 20 -7.183 8.819 26.470 1.00 10.00 C ATOM 274 CE1 PHE A 20 -5.161 7.463 25.067 1.00 10.00 C ATOM 275 CE2 PHE A 20 -6.137 9.543 25.877 1.00 10.00 C ATOM 276 CZ PHE A 20 -5.127 8.866 25.176 1.00 10.00 C ATOM 0 H PHE A 20 -6.957 7.427 29.487 1.00 10.00 H new ATOM 0 HA PHE A 20 -9.149 5.695 28.716 1.00 10.00 H new ATOM 0 HB2 PHE A 20 -8.574 5.780 26.334 1.00 10.00 H new ATOM 0 HB3 PHE A 20 -9.268 7.280 26.917 1.00 10.00 H new ATOM 0 HD1 PHE A 20 -6.231 5.663 25.587 1.00 10.00 H new ATOM 0 HD2 PHE A 20 -7.964 9.341 27.003 1.00 10.00 H new ATOM 0 HE1 PHE A 20 -4.386 6.944 24.523 1.00 10.00 H new ATOM 0 HE2 PHE A 20 -6.109 10.619 25.960 1.00 10.00 H new ATOM 0 HZ PHE A 20 -4.322 9.423 24.719 1.00 10.00 H new ATOM 286 N LYS A 21 -7.513 3.838 28.341 1.00 10.00 N ATOM 287 CA LYS A 21 -6.615 2.687 28.399 1.00 10.00 C ATOM 288 C LYS A 21 -5.583 2.811 27.272 1.00 10.00 C ATOM 289 O LYS A 21 -5.935 3.232 26.169 1.00 10.00 O ATOM 290 CB LYS A 21 -7.455 1.407 28.239 1.00 10.00 C ATOM 291 CG LYS A 21 -8.447 1.199 29.402 1.00 10.00 C ATOM 292 CD LYS A 21 -9.542 0.178 29.057 1.00 10.00 C ATOM 293 CE LYS A 21 -10.660 0.238 30.110 1.00 10.00 C ATOM 294 NZ LYS A 21 -11.907 -0.438 29.670 1.00 10.00 N ATOM 0 H LYS A 21 -8.480 3.587 28.137 1.00 10.00 H new ATOM 0 HA LYS A 21 -6.087 2.647 29.352 1.00 10.00 H new ATOM 0 HB2 LYS A 21 -8.006 1.454 27.300 1.00 10.00 H new ATOM 0 HB3 LYS A 21 -6.790 0.546 28.175 1.00 10.00 H new ATOM 0 HG2 LYS A 21 -7.904 0.862 30.285 1.00 10.00 H new ATOM 0 HG3 LYS A 21 -8.909 2.152 29.657 1.00 10.00 H new ATOM 0 HD2 LYS A 21 -9.950 0.388 28.068 1.00 10.00 H new ATOM 0 HD3 LYS A 21 -9.118 -0.825 29.020 1.00 10.00 H new ATOM 0 HE2 LYS A 21 -10.308 -0.224 31.032 1.00 10.00 H new ATOM 0 HE3 LYS A 21 -10.880 1.281 30.340 1.00 10.00 H new ATOM 0 HZ1 LYS A 21 -12.708 -0.091 30.236 1.00 10.00 H new ATOM 0 HZ2 LYS A 21 -12.078 -0.232 28.665 1.00 10.00 H new ATOM 0 HZ3 LYS A 21 -11.810 -1.465 29.801 1.00 10.00 H new ATOM 308 N TYR A 22 -4.351 2.352 27.510 1.00 10.00 N ATOM 309 CA TYR A 22 -3.296 2.310 26.498 1.00 10.00 C ATOM 310 C TYR A 22 -2.431 1.064 26.690 1.00 10.00 C ATOM 311 O TYR A 22 -2.419 0.478 27.774 1.00 10.00 O ATOM 312 CB TYR A 22 -2.464 3.611 26.508 1.00 10.00 C ATOM 313 CG TYR A 22 -1.042 3.469 27.025 1.00 10.00 C ATOM 314 CD1 TYR A 22 -0.810 3.442 28.406 1.00 10.00 C ATOM 315 CD2 TYR A 22 0.033 3.279 26.136 1.00 10.00 C ATOM 316 CE1 TYR A 22 0.481 3.225 28.910 1.00 10.00 C ATOM 317 CE2 TYR A 22 1.337 3.076 26.628 1.00 10.00 C ATOM 318 CZ TYR A 22 1.566 3.065 28.020 1.00 10.00 C ATOM 319 OH TYR A 22 2.834 2.919 28.497 1.00 10.00 O ATOM 0 H TYR A 22 -4.057 1.996 28.420 1.00 10.00 H new ATOM 0 HA TYR A 22 -3.755 2.243 25.512 1.00 10.00 H new ATOM 0 HB2 TYR A 22 -2.426 4.006 25.493 1.00 10.00 H new ATOM 0 HB3 TYR A 22 -2.983 4.350 27.119 1.00 10.00 H new ATOM 0 HD1 TYR A 22 -1.633 3.590 29.089 1.00 10.00 H new ATOM 0 HD2 TYR A 22 -0.143 3.289 25.071 1.00 10.00 H new ATOM 0 HE1 TYR A 22 0.645 3.180 29.977 1.00 10.00 H new ATOM 0 HE2 TYR A 22 2.158 2.929 25.942 1.00 10.00 H new ATOM 0 HH TYR A 22 3.103 3.736 28.968 1.00 10.00 H new ATOM 329 N VAL A 23 -1.699 0.674 25.649 1.00 10.00 N ATOM 330 CA VAL A 23 -0.782 -0.454 25.635 1.00 10.00 C ATOM 331 C VAL A 23 0.480 -0.035 24.864 1.00 10.00 C ATOM 332 O VAL A 23 0.419 0.750 23.909 1.00 10.00 O ATOM 333 CB VAL A 23 -1.517 -1.694 25.073 1.00 10.00 C ATOM 334 CG1 VAL A 23 -2.071 -1.467 23.661 1.00 10.00 C ATOM 335 CG2 VAL A 23 -0.658 -2.964 25.083 1.00 10.00 C ATOM 0 H VAL A 23 -1.733 1.161 24.753 1.00 10.00 H new ATOM 0 HA VAL A 23 -0.450 -0.742 26.632 1.00 10.00 H new ATOM 0 HB VAL A 23 -2.353 -1.844 25.756 1.00 10.00 H new ATOM 0 HG11 VAL A 23 -2.576 -2.370 23.319 1.00 10.00 H new ATOM 0 HG12 VAL A 23 -2.780 -0.639 23.677 1.00 10.00 H new ATOM 0 HG13 VAL A 23 -1.252 -1.230 22.982 1.00 10.00 H new ATOM 0 HG21 VAL A 23 -1.233 -3.796 24.676 1.00 10.00 H new ATOM 0 HG22 VAL A 23 0.232 -2.806 24.474 1.00 10.00 H new ATOM 0 HG23 VAL A 23 -0.361 -3.194 26.106 1.00 10.00 H new ATOM 345 N LEU A 24 1.625 -0.567 25.292 1.00 10.00 N ATOM 346 CA LEU A 24 2.920 -0.392 24.652 1.00 10.00 C ATOM 347 C LEU A 24 3.223 -1.728 23.975 1.00 10.00 C ATOM 348 O LEU A 24 3.208 -2.766 24.639 1.00 10.00 O ATOM 349 CB LEU A 24 3.947 -0.033 25.741 1.00 10.00 C ATOM 350 CG LEU A 24 5.218 0.663 25.219 1.00 10.00 C ATOM 351 CD1 LEU A 24 6.164 0.875 26.405 1.00 10.00 C ATOM 352 CD2 LEU A 24 5.959 -0.101 24.120 1.00 10.00 C ATOM 0 H LEU A 24 1.673 -1.153 26.126 1.00 10.00 H new ATOM 0 HA LEU A 24 2.946 0.408 23.912 1.00 10.00 H new ATOM 0 HB2 LEU A 24 3.468 0.616 26.474 1.00 10.00 H new ATOM 0 HB3 LEU A 24 4.236 -0.945 26.264 1.00 10.00 H new ATOM 0 HG LEU A 24 4.899 1.601 24.764 1.00 10.00 H new ATOM 0 HD11 LEU A 24 7.074 1.367 26.061 1.00 10.00 H new ATOM 0 HD12 LEU A 24 5.675 1.498 27.154 1.00 10.00 H new ATOM 0 HD13 LEU A 24 6.418 -0.089 26.845 1.00 10.00 H new ATOM 0 HD21 LEU A 24 6.840 0.464 23.815 1.00 10.00 H new ATOM 0 HD22 LEU A 24 6.267 -1.076 24.499 1.00 10.00 H new ATOM 0 HD23 LEU A 24 5.299 -0.236 23.263 1.00 10.00 H new ATOM 364 N ILE A 25 3.441 -1.741 22.664 1.00 10.00 N ATOM 365 CA ILE A 25 3.561 -2.971 21.889 1.00 10.00 C ATOM 366 C ILE A 25 4.886 -2.894 21.131 1.00 10.00 C ATOM 367 O ILE A 25 5.188 -1.881 20.501 1.00 10.00 O ATOM 368 CB ILE A 25 2.327 -3.124 20.959 1.00 10.00 C ATOM 369 CG1 ILE A 25 0.992 -3.101 21.746 1.00 10.00 C ATOM 370 CG2 ILE A 25 2.416 -4.424 20.141 1.00 10.00 C ATOM 371 CD1 ILE A 25 -0.269 -3.170 20.872 1.00 10.00 C ATOM 0 H ILE A 25 3.540 -0.893 22.106 1.00 10.00 H new ATOM 0 HA ILE A 25 3.572 -3.860 22.519 1.00 10.00 H new ATOM 0 HB ILE A 25 2.337 -2.267 20.285 1.00 10.00 H new ATOM 0 HG12 ILE A 25 0.982 -3.940 22.442 1.00 10.00 H new ATOM 0 HG13 ILE A 25 0.954 -2.190 22.344 1.00 10.00 H new ATOM 0 HG21 ILE A 25 1.541 -4.509 19.497 1.00 10.00 H new ATOM 0 HG22 ILE A 25 3.317 -4.407 19.528 1.00 10.00 H new ATOM 0 HG23 ILE A 25 2.453 -5.278 20.818 1.00 10.00 H new ATOM 0 HD11 ILE A 25 -1.154 -3.148 21.508 1.00 10.00 H new ATOM 0 HD12 ILE A 25 -0.289 -2.317 20.194 1.00 10.00 H new ATOM 0 HD13 ILE A 25 -0.261 -4.094 20.293 1.00 10.00 H new ATOM 383 N ARG A 26 5.680 -3.966 21.157 1.00 10.00 N ATOM 384 CA ARG A 26 6.819 -4.109 20.257 1.00 10.00 C ATOM 385 C ARG A 26 6.280 -4.703 18.972 1.00 10.00 C ATOM 386 O ARG A 26 5.469 -5.625 19.041 1.00 10.00 O ATOM 387 CB ARG A 26 7.874 -5.037 20.875 1.00 10.00 C ATOM 388 CG ARG A 26 9.241 -4.932 20.171 1.00 10.00 C ATOM 389 CD ARG A 26 10.053 -6.231 20.247 1.00 10.00 C ATOM 390 NE ARG A 26 10.214 -6.742 21.624 1.00 10.00 N ATOM 391 CZ ARG A 26 9.700 -7.889 22.109 1.00 10.00 C ATOM 392 NH1 ARG A 26 9.177 -8.803 21.302 1.00 10.00 N ATOM 393 NH2 ARG A 26 9.709 -8.113 23.416 1.00 10.00 N ATOM 0 H ARG A 26 5.551 -4.750 21.796 1.00 10.00 H new ATOM 0 HA ARG A 26 7.300 -3.148 20.074 1.00 10.00 H new ATOM 0 HB2 ARG A 26 7.993 -4.793 21.931 1.00 10.00 H new ATOM 0 HB3 ARG A 26 7.521 -6.067 20.824 1.00 10.00 H new ATOM 0 HG2 ARG A 26 9.086 -4.667 19.125 1.00 10.00 H new ATOM 0 HG3 ARG A 26 9.816 -4.123 20.623 1.00 10.00 H new ATOM 0 HD2 ARG A 26 9.564 -6.993 19.640 1.00 10.00 H new ATOM 0 HD3 ARG A 26 11.038 -6.061 19.813 1.00 10.00 H new ATOM 0 HE ARG A 26 10.765 -6.174 22.267 1.00 10.00 H new ATOM 0 HH11 ARG A 26 9.159 -8.644 20.295 1.00 10.00 H new ATOM 0 HH12 ARG A 26 8.793 -9.665 21.689 1.00 10.00 H new ATOM 0 HH21 ARG A 26 10.104 -7.418 24.050 1.00 10.00 H new ATOM 0 HH22 ARG A 26 9.321 -8.980 23.788 1.00 10.00 H new ATOM 407 N VAL A 27 6.735 -4.238 17.819 1.00 10.00 N ATOM 408 CA VAL A 27 6.379 -4.773 16.516 1.00 10.00 C ATOM 409 C VAL A 27 7.655 -5.288 15.856 1.00 10.00 C ATOM 410 O VAL A 27 8.705 -4.648 15.978 1.00 10.00 O ATOM 411 CB VAL A 27 5.664 -3.708 15.653 1.00 10.00 C ATOM 412 CG1 VAL A 27 4.159 -3.718 15.937 1.00 10.00 C ATOM 413 CG2 VAL A 27 6.198 -2.276 15.824 1.00 10.00 C ATOM 0 H VAL A 27 7.383 -3.452 17.764 1.00 10.00 H new ATOM 0 HA VAL A 27 5.672 -5.596 16.623 1.00 10.00 H new ATOM 0 HB VAL A 27 5.873 -3.992 14.622 1.00 10.00 H new ATOM 0 HG11 VAL A 27 3.668 -2.963 15.323 1.00 10.00 H new ATOM 0 HG12 VAL A 27 3.751 -4.701 15.700 1.00 10.00 H new ATOM 0 HG13 VAL A 27 3.986 -3.497 16.990 1.00 10.00 H new ATOM 0 HG21 VAL A 27 5.637 -1.599 15.180 1.00 10.00 H new ATOM 0 HG22 VAL A 27 6.084 -1.967 16.863 1.00 10.00 H new ATOM 0 HG23 VAL A 27 7.253 -2.246 15.550 1.00 10.00 H new ATOM 423 N HIS A 28 7.561 -6.422 15.170 1.00 10.00 N ATOM 424 CA HIS A 28 8.627 -7.016 14.377 1.00 10.00 C ATOM 425 C HIS A 28 8.133 -6.987 12.934 1.00 10.00 C ATOM 426 O HIS A 28 7.004 -7.406 12.680 1.00 10.00 O ATOM 427 CB HIS A 28 8.871 -8.462 14.830 1.00 10.00 C ATOM 428 CG HIS A 28 9.366 -8.618 16.248 1.00 10.00 C ATOM 429 ND1 HIS A 28 10.599 -8.238 16.717 1.00 10.00 N ATOM 430 CD2 HIS A 28 8.718 -9.239 17.283 1.00 10.00 C ATOM 431 CE1 HIS A 28 10.711 -8.653 17.987 1.00 10.00 C ATOM 432 NE2 HIS A 28 9.570 -9.225 18.401 1.00 10.00 N ATOM 0 H HIS A 28 6.703 -6.974 15.152 1.00 10.00 H new ATOM 0 HA HIS A 28 9.567 -6.476 14.488 1.00 10.00 H new ATOM 0 HB2 HIS A 28 7.941 -9.021 14.723 1.00 10.00 H new ATOM 0 HB3 HIS A 28 9.596 -8.919 14.157 1.00 10.00 H new ATOM 0 HD1 HIS A 28 11.308 -7.728 16.190 1.00 10.00 H new ATOM 0 HD2 HIS A 28 7.726 -9.665 17.246 1.00 10.00 H new ATOM 0 HE1 HIS A 28 11.598 -8.542 18.593 1.00 10.00 H new ATOM 440 N SER A 29 8.923 -6.437 12.015 1.00 10.00 N ATOM 441 CA SER A 29 8.535 -6.355 10.616 1.00 10.00 C ATOM 442 C SER A 29 8.634 -7.717 9.929 1.00 10.00 C ATOM 443 O SER A 29 9.539 -8.503 10.200 1.00 10.00 O ATOM 444 CB SER A 29 9.347 -5.272 9.897 1.00 10.00 C ATOM 445 OG SER A 29 10.743 -5.470 9.978 1.00 10.00 O ATOM 0 H SER A 29 9.840 -6.040 12.219 1.00 10.00 H new ATOM 0 HA SER A 29 7.486 -6.062 10.563 1.00 10.00 H new ATOM 0 HB2 SER A 29 9.052 -5.244 8.848 1.00 10.00 H new ATOM 0 HB3 SER A 29 9.100 -4.300 10.324 1.00 10.00 H new ATOM 0 HG SER A 29 11.063 -5.187 10.860 1.00 10.00 H new ATOM 451 N ALA A 30 7.710 -7.970 9.008 1.00 10.00 N ATOM 452 CA ALA A 30 7.714 -9.058 8.050 1.00 10.00 C ATOM 453 C ALA A 30 6.816 -8.612 6.881 1.00 10.00 C ATOM 454 O ALA A 30 5.698 -9.108 6.747 1.00 10.00 O ATOM 455 CB ALA A 30 7.230 -10.349 8.716 1.00 10.00 C ATOM 0 H ALA A 30 6.885 -7.378 8.909 1.00 10.00 H new ATOM 0 HA ALA A 30 8.714 -9.276 7.676 1.00 10.00 H new ATOM 0 HB1 ALA A 30 7.237 -11.159 7.987 1.00 10.00 H new ATOM 0 HB2 ALA A 30 7.891 -10.601 9.545 1.00 10.00 H new ATOM 0 HB3 ALA A 30 6.216 -10.207 9.091 1.00 10.00 H new ATOM 461 N PRO A 31 7.264 -7.638 6.060 1.00 10.00 N ATOM 462 CA PRO A 31 6.468 -7.061 4.973 1.00 10.00 C ATOM 463 C PRO A 31 5.835 -8.134 4.072 1.00 10.00 C ATOM 464 O PRO A 31 4.704 -8.020 3.618 1.00 10.00 O ATOM 465 CB PRO A 31 7.436 -6.157 4.195 1.00 10.00 C ATOM 466 CG PRO A 31 8.501 -5.789 5.223 1.00 10.00 C ATOM 467 CD PRO A 31 8.579 -7.021 6.115 1.00 10.00 C ATOM 0 HA PRO A 31 5.619 -6.500 5.364 1.00 10.00 H new ATOM 0 HB2 PRO A 31 7.869 -6.677 3.340 1.00 10.00 H new ATOM 0 HB3 PRO A 31 6.932 -5.272 3.808 1.00 10.00 H new ATOM 0 HG2 PRO A 31 9.459 -5.576 4.749 1.00 10.00 H new ATOM 0 HG3 PRO A 31 8.221 -4.901 5.790 1.00 10.00 H new ATOM 0 HD2 PRO A 31 9.348 -7.709 5.764 1.00 10.00 H new ATOM 0 HD3 PRO A 31 8.839 -6.747 7.137 1.00 10.00 H new ATOM 475 N ARG A 32 6.576 -9.205 3.799 1.00 10.00 N ATOM 476 CA ARG A 32 6.112 -10.421 3.144 1.00 10.00 C ATOM 477 C ARG A 32 6.919 -11.552 3.778 1.00 10.00 C ATOM 478 O ARG A 32 7.984 -11.284 4.334 1.00 10.00 O ATOM 479 CB ARG A 32 6.340 -10.300 1.624 1.00 10.00 C ATOM 480 CG ARG A 32 5.602 -11.365 0.798 1.00 10.00 C ATOM 481 CD ARG A 32 5.783 -11.099 -0.701 1.00 10.00 C ATOM 482 NE ARG A 32 5.085 -12.109 -1.517 1.00 10.00 N ATOM 483 CZ ARG A 32 5.090 -12.166 -2.857 1.00 10.00 C ATOM 484 NH1 ARG A 32 5.788 -11.285 -3.575 1.00 10.00 N ATOM 485 NH2 ARG A 32 4.409 -13.128 -3.478 1.00 10.00 N ATOM 0 H ARG A 32 7.566 -9.248 4.042 1.00 10.00 H new ATOM 0 HA ARG A 32 5.046 -10.606 3.274 1.00 10.00 H new ATOM 0 HB2 ARG A 32 6.018 -9.312 1.296 1.00 10.00 H new ATOM 0 HB3 ARG A 32 7.408 -10.371 1.420 1.00 10.00 H new ATOM 0 HG2 ARG A 32 5.983 -12.356 1.047 1.00 10.00 H new ATOM 0 HG3 ARG A 32 4.541 -11.359 1.049 1.00 10.00 H new ATOM 0 HD2 ARG A 32 5.402 -10.107 -0.944 1.00 10.00 H new ATOM 0 HD3 ARG A 32 6.845 -11.102 -0.947 1.00 10.00 H new ATOM 0 HE ARG A 32 4.554 -12.825 -1.021 1.00 10.00 H new ATOM 0 HH11 ARG A 32 6.326 -10.557 -3.106 1.00 10.00 H new ATOM 0 HH12 ARG A 32 5.783 -11.339 -4.594 1.00 10.00 H new ATOM 0 HH21 ARG A 32 3.888 -13.816 -2.935 1.00 10.00 H new ATOM 0 HH22 ARG A 32 4.409 -13.177 -4.497 1.00 10.00 H new ATOM 499 N SER A 33 6.468 -12.798 3.630 1.00 10.00 N ATOM 500 CA SER A 33 7.031 -13.972 4.289 1.00 10.00 C ATOM 501 C SER A 33 8.532 -14.182 4.043 1.00 10.00 C ATOM 502 O SER A 33 9.172 -14.858 4.837 1.00 10.00 O ATOM 503 CB SER A 33 6.238 -15.208 3.837 1.00 10.00 C ATOM 504 OG SER A 33 4.846 -14.918 3.797 1.00 10.00 O ATOM 0 H SER A 33 5.675 -13.023 3.029 1.00 10.00 H new ATOM 0 HA SER A 33 6.941 -13.810 5.363 1.00 10.00 H new ATOM 0 HB2 SER A 33 6.578 -15.525 2.851 1.00 10.00 H new ATOM 0 HB3 SER A 33 6.424 -16.037 4.520 1.00 10.00 H new ATOM 0 HG SER A 33 4.354 -15.714 3.506 1.00 10.00 H new ATOM 510 N GLY A 34 9.089 -13.641 2.955 1.00 10.00 N ATOM 511 CA GLY A 34 10.514 -13.690 2.639 1.00 10.00 C ATOM 512 C GLY A 34 11.055 -12.317 2.230 1.00 10.00 C ATOM 513 O GLY A 34 11.977 -12.245 1.424 1.00 10.00 O ATOM 0 H GLY A 34 8.543 -13.143 2.252 1.00 10.00 H new ATOM 0 HA2 GLY A 34 11.066 -14.054 3.506 1.00 10.00 H new ATOM 0 HA3 GLY A 34 10.683 -14.402 1.831 1.00 10.00 H new ATOM 517 N ALA A 35 10.427 -11.222 2.672 1.00 10.00 N ATOM 518 CA ALA A 35 10.943 -9.878 2.428 1.00 10.00 C ATOM 519 C ALA A 35 12.316 -9.684 3.103 1.00 10.00 C ATOM 520 O ALA A 35 12.548 -10.247 4.171 1.00 10.00 O ATOM 521 CB ALA A 35 9.943 -8.845 2.955 1.00 10.00 C ATOM 0 H ALA A 35 9.556 -11.245 3.203 1.00 10.00 H new ATOM 0 HA ALA A 35 11.074 -9.742 1.355 1.00 10.00 H new ATOM 0 HB1 ALA A 35 10.327 -7.841 2.773 1.00 10.00 H new ATOM 0 HB2 ALA A 35 8.989 -8.967 2.442 1.00 10.00 H new ATOM 0 HB3 ALA A 35 9.800 -8.991 4.026 1.00 10.00 H new ATOM 527 N PRO A 36 13.204 -8.840 2.545 1.00 10.00 N ATOM 528 CA PRO A 36 14.557 -8.619 3.056 1.00 10.00 C ATOM 529 C PRO A 36 14.570 -7.659 4.261 1.00 10.00 C ATOM 530 O PRO A 36 15.422 -6.775 4.330 1.00 10.00 O ATOM 531 CB PRO A 36 15.341 -8.103 1.838 1.00 10.00 C ATOM 532 CG PRO A 36 14.293 -7.286 1.086 1.00 10.00 C ATOM 533 CD PRO A 36 13.028 -8.118 1.289 1.00 10.00 C ATOM 0 HA PRO A 36 15.012 -9.524 3.459 1.00 10.00 H new ATOM 0 HB2 PRO A 36 16.194 -7.493 2.134 1.00 10.00 H new ATOM 0 HB3 PRO A 36 15.730 -8.920 1.231 1.00 10.00 H new ATOM 0 HG2 PRO A 36 14.189 -6.281 1.496 1.00 10.00 H new ATOM 0 HG3 PRO A 36 14.543 -7.176 0.031 1.00 10.00 H new ATOM 0 HD2 PRO A 36 12.146 -7.479 1.329 1.00 10.00 H new ATOM 0 HD3 PRO A 36 12.882 -8.811 0.460 1.00 10.00 H new ATOM 541 N ALA A 37 13.621 -7.787 5.193 1.00 10.00 N ATOM 542 CA ALA A 37 13.482 -6.910 6.348 1.00 10.00 C ATOM 543 C ALA A 37 12.967 -7.723 7.529 1.00 10.00 C ATOM 544 O ALA A 37 12.040 -8.511 7.362 1.00 10.00 O ATOM 545 CB ALA A 37 12.495 -5.792 6.012 1.00 10.00 C ATOM 0 H ALA A 37 12.914 -8.522 5.160 1.00 10.00 H new ATOM 0 HA ALA A 37 14.446 -6.471 6.606 1.00 10.00 H new ATOM 0 HB1 ALA A 37 12.386 -5.132 6.872 1.00 10.00 H new ATOM 0 HB2 ALA A 37 12.868 -5.221 5.161 1.00 10.00 H new ATOM 0 HB3 ALA A 37 11.526 -6.225 5.762 1.00 10.00 H new ATOM 551 N ALA A 38 13.574 -7.518 8.700 1.00 10.00 N ATOM 552 CA ALA A 38 13.209 -8.137 9.974 1.00 10.00 C ATOM 553 C ALA A 38 13.561 -7.182 11.132 1.00 10.00 C ATOM 554 O ALA A 38 13.890 -7.608 12.240 1.00 10.00 O ATOM 555 CB ALA A 38 13.927 -9.489 10.103 1.00 10.00 C ATOM 0 H ALA A 38 14.370 -6.887 8.789 1.00 10.00 H new ATOM 0 HA ALA A 38 12.136 -8.322 10.015 1.00 10.00 H new ATOM 0 HB1 ALA A 38 13.658 -9.955 11.051 1.00 10.00 H new ATOM 0 HB2 ALA A 38 13.628 -10.140 9.281 1.00 10.00 H new ATOM 0 HB3 ALA A 38 15.005 -9.333 10.068 1.00 10.00 H new ATOM 561 N GLU A 39 13.566 -5.873 10.866 1.00 10.00 N ATOM 562 CA GLU A 39 13.780 -4.829 11.868 1.00 10.00 C ATOM 563 C GLU A 39 12.577 -4.779 12.822 1.00 10.00 C ATOM 564 O GLU A 39 11.518 -5.337 12.522 1.00 10.00 O ATOM 565 CB GLU A 39 13.995 -3.468 11.180 1.00 10.00 C ATOM 566 CG GLU A 39 15.294 -3.435 10.365 1.00 10.00 C ATOM 567 CD GLU A 39 15.567 -2.055 9.779 1.00 10.00 C ATOM 568 OE1 GLU A 39 16.181 -1.261 10.528 1.00 10.00 O ATOM 569 OE2 GLU A 39 15.158 -1.847 8.615 1.00 10.00 O ATOM 0 H GLU A 39 13.418 -5.503 9.927 1.00 10.00 H new ATOM 0 HA GLU A 39 14.675 -5.058 12.447 1.00 10.00 H new ATOM 0 HB2 GLU A 39 13.150 -3.256 10.525 1.00 10.00 H new ATOM 0 HB3 GLU A 39 14.020 -2.681 11.933 1.00 10.00 H new ATOM 0 HG2 GLU A 39 16.128 -3.730 11.001 1.00 10.00 H new ATOM 0 HG3 GLU A 39 15.234 -4.166 9.558 1.00 10.00 H new ATOM 576 N SER A 40 12.702 -4.089 13.957 1.00 10.00 N ATOM 577 CA SER A 40 11.651 -4.000 14.970 1.00 10.00 C ATOM 578 C SER A 40 11.515 -2.559 15.476 1.00 10.00 C ATOM 579 O SER A 40 12.440 -1.767 15.332 1.00 10.00 O ATOM 580 CB SER A 40 11.984 -4.953 16.126 1.00 10.00 C ATOM 581 OG SER A 40 12.350 -6.249 15.669 1.00 10.00 O ATOM 0 H SER A 40 13.546 -3.571 14.201 1.00 10.00 H new ATOM 0 HA SER A 40 10.697 -4.291 14.530 1.00 10.00 H new ATOM 0 HB2 SER A 40 12.800 -4.534 16.716 1.00 10.00 H new ATOM 0 HB3 SER A 40 11.121 -5.034 16.787 1.00 10.00 H new ATOM 0 HG SER A 40 11.852 -6.461 14.852 1.00 10.00 H new ATOM 587 N LYS A 41 10.388 -2.214 16.098 1.00 10.00 N ATOM 588 CA LYS A 41 10.113 -0.898 16.687 1.00 10.00 C ATOM 589 C LYS A 41 9.231 -1.115 17.915 1.00 10.00 C ATOM 590 O LYS A 41 8.692 -2.206 18.073 1.00 10.00 O ATOM 591 CB LYS A 41 9.429 0.003 15.633 1.00 10.00 C ATOM 592 CG LYS A 41 9.564 1.505 15.930 1.00 10.00 C ATOM 593 CD LYS A 41 9.074 2.422 14.795 1.00 10.00 C ATOM 594 CE LYS A 41 7.545 2.447 14.622 1.00 10.00 C ATOM 595 NZ LYS A 41 7.128 3.485 13.651 1.00 10.00 N ATOM 0 H LYS A 41 9.611 -2.865 16.211 1.00 10.00 H new ATOM 0 HA LYS A 41 11.030 -0.396 16.994 1.00 10.00 H new ATOM 0 HB2 LYS A 41 9.860 -0.206 14.654 1.00 10.00 H new ATOM 0 HB3 LYS A 41 8.371 -0.255 15.578 1.00 10.00 H new ATOM 0 HG2 LYS A 41 9.003 1.736 16.836 1.00 10.00 H new ATOM 0 HG3 LYS A 41 10.610 1.730 16.137 1.00 10.00 H new ATOM 0 HD2 LYS A 41 9.424 3.437 14.986 1.00 10.00 H new ATOM 0 HD3 LYS A 41 9.529 2.099 13.859 1.00 10.00 H new ATOM 0 HE2 LYS A 41 7.200 1.470 14.283 1.00 10.00 H new ATOM 0 HE3 LYS A 41 7.071 2.636 15.585 1.00 10.00 H new ATOM 0 HZ1 LYS A 41 6.094 3.465 13.544 1.00 10.00 H new ATOM 0 HZ2 LYS A 41 7.422 4.421 13.996 1.00 10.00 H new ATOM 0 HZ3 LYS A 41 7.575 3.299 12.731 1.00 10.00 H new ATOM 609 N GLU A 42 9.000 -0.092 18.726 1.00 10.00 N ATOM 610 CA GLU A 42 8.049 -0.117 19.830 1.00 10.00 C ATOM 611 C GLU A 42 7.080 1.023 19.550 1.00 10.00 C ATOM 612 O GLU A 42 7.502 2.078 19.069 1.00 10.00 O ATOM 613 CB GLU A 42 8.783 0.051 21.170 1.00 10.00 C ATOM 614 CG GLU A 42 9.545 -1.222 21.570 1.00 10.00 C ATOM 615 CD GLU A 42 10.504 -0.982 22.729 1.00 10.00 C ATOM 616 OE1 GLU A 42 9.982 -0.663 23.820 1.00 10.00 O ATOM 617 OE2 GLU A 42 11.727 -1.091 22.487 1.00 10.00 O ATOM 0 H GLU A 42 9.481 0.802 18.632 1.00 10.00 H new ATOM 0 HA GLU A 42 7.515 -1.064 19.905 1.00 10.00 H new ATOM 0 HB2 GLU A 42 9.481 0.885 21.099 1.00 10.00 H new ATOM 0 HB3 GLU A 42 8.063 0.303 21.949 1.00 10.00 H new ATOM 0 HG2 GLU A 42 8.831 -1.998 21.847 1.00 10.00 H new ATOM 0 HG3 GLU A 42 10.103 -1.594 20.711 1.00 10.00 H new ATOM 624 N ILE A 43 5.795 0.819 19.816 1.00 10.00 N ATOM 625 CA ILE A 43 4.729 1.747 19.474 1.00 10.00 C ATOM 626 C ILE A 43 3.776 1.912 20.657 1.00 10.00 C ATOM 627 O ILE A 43 3.627 1.013 21.486 1.00 10.00 O ATOM 628 CB ILE A 43 3.994 1.286 18.191 1.00 10.00 C ATOM 629 CG1 ILE A 43 3.435 -0.154 18.289 1.00 10.00 C ATOM 630 CG2 ILE A 43 4.913 1.448 16.966 1.00 10.00 C ATOM 631 CD1 ILE A 43 2.468 -0.544 17.165 1.00 10.00 C ATOM 0 H ILE A 43 5.459 -0.020 20.289 1.00 10.00 H new ATOM 0 HA ILE A 43 5.160 2.725 19.260 1.00 10.00 H new ATOM 0 HB ILE A 43 3.124 1.932 18.073 1.00 10.00 H new ATOM 0 HG12 ILE A 43 4.270 -0.854 18.290 1.00 10.00 H new ATOM 0 HG13 ILE A 43 2.924 -0.266 19.245 1.00 10.00 H new ATOM 0 HG21 ILE A 43 4.386 1.121 16.070 1.00 10.00 H new ATOM 0 HG22 ILE A 43 5.195 2.495 16.859 1.00 10.00 H new ATOM 0 HG23 ILE A 43 5.809 0.843 17.101 1.00 10.00 H new ATOM 0 HD11 ILE A 43 2.128 -1.569 17.316 1.00 10.00 H new ATOM 0 HD12 ILE A 43 1.610 0.128 17.174 1.00 10.00 H new ATOM 0 HD13 ILE A 43 2.978 -0.469 16.204 1.00 10.00 H new ATOM 643 N VAL A 44 3.110 3.062 20.706 1.00 10.00 N ATOM 644 CA VAL A 44 2.178 3.421 21.770 1.00 10.00 C ATOM 645 C VAL A 44 0.797 3.471 21.125 1.00 10.00 C ATOM 646 O VAL A 44 0.628 4.140 20.097 1.00 10.00 O ATOM 647 CB VAL A 44 2.595 4.785 22.361 1.00 10.00 C ATOM 648 CG1 VAL A 44 1.671 5.242 23.497 1.00 10.00 C ATOM 649 CG2 VAL A 44 4.036 4.789 22.899 1.00 10.00 C ATOM 0 H VAL A 44 3.205 3.785 19.993 1.00 10.00 H new ATOM 0 HA VAL A 44 2.175 2.705 22.592 1.00 10.00 H new ATOM 0 HB VAL A 44 2.519 5.476 21.522 1.00 10.00 H new ATOM 0 HG11 VAL A 44 2.010 6.206 23.876 1.00 10.00 H new ATOM 0 HG12 VAL A 44 0.652 5.337 23.121 1.00 10.00 H new ATOM 0 HG13 VAL A 44 1.693 4.508 24.302 1.00 10.00 H new ATOM 0 HG21 VAL A 44 4.271 5.774 23.301 1.00 10.00 H new ATOM 0 HG22 VAL A 44 4.132 4.043 23.688 1.00 10.00 H new ATOM 0 HG23 VAL A 44 4.727 4.553 22.090 1.00 10.00 H new ATOM 659 N ARG A 45 -0.192 2.784 21.697 1.00 10.00 N ATOM 660 CA ARG A 45 -1.565 2.697 21.187 1.00 10.00 C ATOM 661 C ARG A 45 -2.495 2.926 22.369 1.00 10.00 C ATOM 662 O ARG A 45 -2.177 2.433 23.452 1.00 10.00 O ATOM 663 CB ARG A 45 -1.833 1.287 20.627 1.00 10.00 C ATOM 664 CG ARG A 45 -0.929 0.786 19.488 1.00 10.00 C ATOM 665 CD ARG A 45 -1.208 1.431 18.124 1.00 10.00 C ATOM 666 NE ARG A 45 -0.397 2.640 17.971 1.00 10.00 N ATOM 667 CZ ARG A 45 0.485 2.892 17.003 1.00 10.00 C ATOM 668 NH1 ARG A 45 0.494 2.224 15.853 1.00 10.00 N ATOM 669 NH2 ARG A 45 1.400 3.821 17.214 1.00 10.00 N ATOM 0 H ARG A 45 -0.057 2.254 22.558 1.00 10.00 H new ATOM 0 HA ARG A 45 -1.721 3.430 20.396 1.00 10.00 H new ATOM 0 HB2 ARG A 45 -1.757 0.579 21.452 1.00 10.00 H new ATOM 0 HB3 ARG A 45 -2.864 1.256 20.275 1.00 10.00 H new ATOM 0 HG2 ARG A 45 0.111 0.972 19.758 1.00 10.00 H new ATOM 0 HG3 ARG A 45 -1.046 -0.294 19.396 1.00 10.00 H new ATOM 0 HD2 ARG A 45 -0.980 0.726 17.325 1.00 10.00 H new ATOM 0 HD3 ARG A 45 -2.266 1.679 18.038 1.00 10.00 H new ATOM 0 HE ARG A 45 -0.519 3.365 18.678 1.00 10.00 H new ATOM 0 HH11 ARG A 45 -0.191 1.487 15.686 1.00 10.00 H new ATOM 0 HH12 ARG A 45 1.186 2.448 15.138 1.00 10.00 H new ATOM 0 HH21 ARG A 45 1.420 4.325 18.100 1.00 10.00 H new ATOM 0 HH22 ARG A 45 2.087 4.034 16.491 1.00 10.00 H new ATOM 683 N GLY A 46 -3.637 3.585 22.203 1.00 10.00 N ATOM 684 CA GLY A 46 -4.597 3.668 23.289 1.00 10.00 C ATOM 685 C GLY A 46 -5.858 4.361 22.844 1.00 10.00 C ATOM 686 O GLY A 46 -5.785 5.438 22.265 1.00 10.00 O ATOM 0 H GLY A 46 -3.914 4.060 21.344 1.00 10.00 H new ATOM 0 HA2 GLY A 46 -4.835 2.666 23.646 1.00 10.00 H new ATOM 0 HA3 GLY A 46 -4.157 4.209 24.127 1.00 10.00 H new ATOM 690 N TYR A 47 -7.013 3.769 23.140 1.00 10.00 N ATOM 691 CA TYR A 47 -8.303 4.297 22.718 1.00 10.00 C ATOM 692 C TYR A 47 -9.357 3.974 23.774 1.00 10.00 C ATOM 693 O TYR A 47 -9.385 2.864 24.315 1.00 10.00 O ATOM 694 CB TYR A 47 -8.712 3.677 21.378 1.00 10.00 C ATOM 695 CG TYR A 47 -7.613 3.551 20.337 1.00 10.00 C ATOM 696 CD1 TYR A 47 -7.332 4.610 19.449 1.00 10.00 C ATOM 697 CD2 TYR A 47 -6.862 2.359 20.275 1.00 10.00 C ATOM 698 CE1 TYR A 47 -6.302 4.476 18.496 1.00 10.00 C ATOM 699 CE2 TYR A 47 -5.836 2.222 19.327 1.00 10.00 C ATOM 700 CZ TYR A 47 -5.550 3.280 18.438 1.00 10.00 C ATOM 701 OH TYR A 47 -4.550 3.107 17.536 1.00 10.00 O ATOM 0 H TYR A 47 -7.078 2.907 23.681 1.00 10.00 H new ATOM 0 HA TYR A 47 -8.224 5.378 22.600 1.00 10.00 H new ATOM 0 HB2 TYR A 47 -9.119 2.684 21.569 1.00 10.00 H new ATOM 0 HB3 TYR A 47 -9.518 4.276 20.955 1.00 10.00 H new ATOM 0 HD1 TYR A 47 -7.906 5.524 19.499 1.00 10.00 H new ATOM 0 HD2 TYR A 47 -7.077 1.550 20.958 1.00 10.00 H new ATOM 0 HE1 TYR A 47 -6.088 5.284 17.812 1.00 10.00 H new ATOM 0 HE2 TYR A 47 -5.265 1.306 19.278 1.00 10.00 H new ATOM 0 HH TYR A 47 -4.724 3.659 16.745 1.00 10.00 H new ATOM 711 N LYS A 48 -10.247 4.929 24.056 1.00 10.00 N ATOM 712 CA LYS A 48 -11.222 4.814 25.138 1.00 10.00 C ATOM 713 C LYS A 48 -12.329 3.802 24.878 1.00 10.00 C ATOM 714 O LYS A 48 -12.983 3.436 25.846 1.00 10.00 O ATOM 715 CB LYS A 48 -11.781 6.198 25.511 1.00 10.00 C ATOM 716 CG LYS A 48 -12.713 6.848 24.474 1.00 10.00 C ATOM 717 CD LYS A 48 -12.899 8.354 24.744 1.00 10.00 C ATOM 718 CE LYS A 48 -13.503 8.644 26.131 1.00 10.00 C ATOM 719 NZ LYS A 48 -13.505 10.090 26.459 1.00 10.00 N ATOM 0 H LYS A 48 -10.310 5.805 23.538 1.00 10.00 H new ATOM 0 HA LYS A 48 -10.680 4.413 25.994 1.00 10.00 H new ATOM 0 HB2 LYS A 48 -12.323 6.108 26.452 1.00 10.00 H new ATOM 0 HB3 LYS A 48 -10.942 6.871 25.690 1.00 10.00 H new ATOM 0 HG2 LYS A 48 -12.302 6.705 23.475 1.00 10.00 H new ATOM 0 HG3 LYS A 48 -13.683 6.352 24.494 1.00 10.00 H new ATOM 0 HD2 LYS A 48 -11.934 8.855 24.661 1.00 10.00 H new ATOM 0 HD3 LYS A 48 -13.545 8.779 23.976 1.00 10.00 H new ATOM 0 HE2 LYS A 48 -14.525 8.266 26.165 1.00 10.00 H new ATOM 0 HE3 LYS A 48 -12.938 8.103 26.890 1.00 10.00 H new ATOM 0 HZ1 LYS A 48 -13.921 10.232 27.402 1.00 10.00 H new ATOM 0 HZ2 LYS A 48 -12.529 10.448 26.454 1.00 10.00 H new ATOM 0 HZ3 LYS A 48 -14.067 10.606 25.752 1.00 10.00 H new ATOM 733 N TRP A 49 -12.563 3.373 23.635 1.00 10.00 N ATOM 734 CA TRP A 49 -13.563 2.352 23.342 1.00 10.00 C ATOM 735 C TRP A 49 -13.157 0.978 23.885 1.00 10.00 C ATOM 736 O TRP A 49 -14.022 0.116 23.951 1.00 10.00 O ATOM 737 CB TRP A 49 -13.876 2.305 21.831 1.00 10.00 C ATOM 738 CG TRP A 49 -12.714 2.218 20.878 1.00 10.00 C ATOM 739 CD1 TRP A 49 -12.322 3.201 20.034 1.00 10.00 C ATOM 740 CD2 TRP A 49 -11.758 1.127 20.674 1.00 10.00 C ATOM 741 NE1 TRP A 49 -11.199 2.810 19.336 1.00 10.00 N ATOM 742 CE2 TRP A 49 -10.764 1.569 19.747 1.00 10.00 C ATOM 743 CE3 TRP A 49 -11.611 -0.186 21.173 1.00 10.00 C ATOM 744 CZ2 TRP A 49 -9.631 0.801 19.434 1.00 10.00 C ATOM 745 CZ3 TRP A 49 -10.452 -0.940 20.911 1.00 10.00 C ATOM 746 CH2 TRP A 49 -9.443 -0.434 20.076 1.00 10.00 C ATOM 0 H TRP A 49 -12.069 3.721 22.814 1.00 10.00 H new ATOM 0 HA TRP A 49 -14.480 2.631 23.861 1.00 10.00 H new ATOM 0 HB2 TRP A 49 -14.524 1.447 21.649 1.00 10.00 H new ATOM 0 HB3 TRP A 49 -14.450 3.197 21.580 1.00 10.00 H new ATOM 0 HD1 TRP A 49 -12.817 4.154 19.923 1.00 10.00 H new ATOM 0 HE1 TRP A 49 -10.749 3.367 18.610 1.00 10.00 H new ATOM 0 HE3 TRP A 49 -12.402 -0.619 21.766 1.00 10.00 H new ATOM 0 HZ2 TRP A 49 -8.913 1.155 18.709 1.00 10.00 H new ATOM 0 HZ3 TRP A 49 -10.338 -1.917 21.356 1.00 10.00 H new ATOM 0 HH2 TRP A 49 -8.529 -0.990 19.928 1.00 10.00 H new ATOM 757 N ALA A 50 -11.882 0.745 24.224 1.00 10.00 N ATOM 758 CA ALA A 50 -11.389 -0.575 24.593 1.00 10.00 C ATOM 759 C ALA A 50 -12.126 -1.128 25.816 1.00 10.00 C ATOM 760 O ALA A 50 -12.126 -0.499 26.890 1.00 10.00 O ATOM 761 CB ALA A 50 -9.882 -0.489 24.845 1.00 10.00 C ATOM 0 H ALA A 50 -11.167 1.473 24.248 1.00 10.00 H new ATOM 0 HA ALA A 50 -11.579 -1.269 23.774 1.00 10.00 H new ATOM 0 HB1 ALA A 50 -9.503 -1.473 25.122 1.00 10.00 H new ATOM 0 HB2 ALA A 50 -9.380 -0.149 23.939 1.00 10.00 H new ATOM 0 HB3 ALA A 50 -9.688 0.216 25.654 1.00 10.00 H new ATOM 767 N GLU A 51 -12.653 -2.349 25.680 1.00 10.00 N ATOM 768 CA GLU A 51 -13.339 -3.058 26.761 1.00 10.00 C ATOM 769 C GLU A 51 -12.328 -3.378 27.872 1.00 10.00 C ATOM 770 O GLU A 51 -12.514 -3.028 29.042 1.00 10.00 O ATOM 771 CB GLU A 51 -14.019 -4.316 26.190 1.00 10.00 C ATOM 772 CG GLU A 51 -14.926 -5.002 27.218 1.00 10.00 C ATOM 773 CD GLU A 51 -15.665 -6.206 26.625 1.00 10.00 C ATOM 774 OE1 GLU A 51 -15.043 -7.297 26.619 1.00 10.00 O ATOM 775 OE2 GLU A 51 -16.851 -6.025 26.257 1.00 10.00 O ATOM 0 H GLU A 51 -12.614 -2.876 24.808 1.00 10.00 H new ATOM 0 HA GLU A 51 -14.122 -2.440 27.202 1.00 10.00 H new ATOM 0 HB2 GLU A 51 -14.607 -4.043 25.314 1.00 10.00 H new ATOM 0 HB3 GLU A 51 -13.256 -5.019 25.855 1.00 10.00 H new ATOM 0 HG2 GLU A 51 -14.327 -5.328 28.068 1.00 10.00 H new ATOM 0 HG3 GLU A 51 -15.652 -4.283 27.597 1.00 10.00 H new ATOM 782 N TYR A 52 -11.149 -3.856 27.479 1.00 10.00 N ATOM 783 CA TYR A 52 -9.975 -4.097 28.309 1.00 10.00 C ATOM 784 C TYR A 52 -8.752 -3.816 27.440 1.00 10.00 C ATOM 785 O TYR A 52 -8.872 -3.681 26.228 1.00 10.00 O ATOM 786 CB TYR A 52 -9.946 -5.553 28.801 1.00 10.00 C ATOM 787 CG TYR A 52 -11.061 -5.927 29.760 1.00 10.00 C ATOM 788 CD1 TYR A 52 -11.016 -5.486 31.098 1.00 10.00 C ATOM 789 CD2 TYR A 52 -12.138 -6.721 29.321 1.00 10.00 C ATOM 790 CE1 TYR A 52 -12.048 -5.823 31.991 1.00 10.00 C ATOM 791 CE2 TYR A 52 -13.172 -7.062 30.207 1.00 10.00 C ATOM 792 CZ TYR A 52 -13.135 -6.609 31.542 1.00 10.00 C ATOM 793 OH TYR A 52 -14.139 -6.945 32.395 1.00 10.00 O ATOM 0 H TYR A 52 -10.979 -4.102 26.504 1.00 10.00 H new ATOM 0 HA TYR A 52 -9.991 -3.454 29.189 1.00 10.00 H new ATOM 0 HB2 TYR A 52 -9.994 -6.214 27.936 1.00 10.00 H new ATOM 0 HB3 TYR A 52 -8.989 -5.737 29.290 1.00 10.00 H new ATOM 0 HD1 TYR A 52 -10.185 -4.886 31.439 1.00 10.00 H new ATOM 0 HD2 TYR A 52 -12.169 -7.069 28.299 1.00 10.00 H new ATOM 0 HE1 TYR A 52 -12.011 -5.483 33.016 1.00 10.00 H new ATOM 0 HE2 TYR A 52 -13.996 -7.671 29.866 1.00 10.00 H new ATOM 0 HH TYR A 52 -14.804 -7.486 31.920 1.00 10.00 H new ATOM 803 N HIS A 53 -7.555 -3.744 28.024 1.00 10.00 N ATOM 804 CA HIS A 53 -6.343 -3.437 27.266 1.00 10.00 C ATOM 805 C HIS A 53 -6.110 -4.417 26.120 1.00 10.00 C ATOM 806 O HIS A 53 -5.633 -4.000 25.069 1.00 10.00 O ATOM 807 CB HIS A 53 -5.138 -3.431 28.210 1.00 10.00 C ATOM 808 CG HIS A 53 -5.290 -2.429 29.321 1.00 10.00 C ATOM 809 ND1 HIS A 53 -5.853 -2.673 30.577 1.00 10.00 N ATOM 810 CD2 HIS A 53 -4.893 -1.130 29.262 1.00 10.00 C ATOM 811 CE1 HIS A 53 -5.749 -1.515 31.254 1.00 10.00 C ATOM 812 NE2 HIS A 53 -5.170 -0.576 30.484 1.00 10.00 N ATOM 0 H HIS A 53 -7.400 -3.894 29.021 1.00 10.00 H new ATOM 0 HA HIS A 53 -6.472 -2.451 26.820 1.00 10.00 H new ATOM 0 HB2 HIS A 53 -5.008 -4.426 28.636 1.00 10.00 H new ATOM 0 HB3 HIS A 53 -4.235 -3.207 27.642 1.00 10.00 H new ATOM 0 HD2 HIS A 53 -4.446 -0.631 28.415 1.00 10.00 H new ATOM 0 HE1 HIS A 53 -6.082 -1.361 32.270 1.00 10.00 H new ATOM 0 HE2 HIS A 53 -4.971 0.385 30.763 1.00 10.00 H new ATOM 820 N ALA A 54 -6.442 -5.695 26.321 1.00 10.00 N ATOM 821 CA ALA A 54 -6.329 -6.726 25.296 1.00 10.00 C ATOM 822 C ALA A 54 -7.168 -6.414 24.048 1.00 10.00 C ATOM 823 O ALA A 54 -6.812 -6.892 22.980 1.00 10.00 O ATOM 824 CB ALA A 54 -6.723 -8.081 25.890 1.00 10.00 C ATOM 0 H ALA A 54 -6.800 -6.043 27.211 1.00 10.00 H new ATOM 0 HA ALA A 54 -5.290 -6.756 24.968 1.00 10.00 H new ATOM 0 HB1 ALA A 54 -6.639 -8.852 25.124 1.00 10.00 H new ATOM 0 HB2 ALA A 54 -6.060 -8.321 26.721 1.00 10.00 H new ATOM 0 HB3 ALA A 54 -7.752 -8.036 26.248 1.00 10.00 H new ATOM 830 N ASP A 55 -8.233 -5.608 24.176 1.00 10.00 N ATOM 831 CA ASP A 55 -9.084 -5.191 23.048 1.00 10.00 C ATOM 832 C ASP A 55 -8.273 -4.293 22.095 1.00 10.00 C ATOM 833 O ASP A 55 -8.374 -4.355 20.871 1.00 10.00 O ATOM 834 CB ASP A 55 -10.305 -4.429 23.604 1.00 10.00 C ATOM 835 CG ASP A 55 -11.482 -4.261 22.637 1.00 10.00 C ATOM 836 OD1 ASP A 55 -11.495 -4.920 21.575 1.00 10.00 O ATOM 837 OD2 ASP A 55 -12.326 -3.397 22.977 1.00 10.00 O ATOM 0 H ASP A 55 -8.531 -5.223 25.072 1.00 10.00 H new ATOM 0 HA ASP A 55 -9.427 -6.063 22.491 1.00 10.00 H new ATOM 0 HB2 ASP A 55 -10.661 -4.950 24.493 1.00 10.00 H new ATOM 0 HB3 ASP A 55 -9.978 -3.440 23.924 1.00 10.00 H new ATOM 842 N ILE A 56 -7.389 -3.460 22.663 1.00 10.00 N ATOM 843 CA ILE A 56 -6.478 -2.642 21.870 1.00 10.00 C ATOM 844 C ILE A 56 -5.508 -3.570 21.133 1.00 10.00 C ATOM 845 O ILE A 56 -5.332 -3.443 19.920 1.00 10.00 O ATOM 846 CB ILE A 56 -5.705 -1.610 22.737 1.00 10.00 C ATOM 847 CG1 ILE A 56 -6.606 -0.804 23.700 1.00 10.00 C ATOM 848 CG2 ILE A 56 -4.941 -0.652 21.798 1.00 10.00 C ATOM 849 CD1 ILE A 56 -5.829 -0.092 24.815 1.00 10.00 C ATOM 0 H ILE A 56 -7.290 -3.339 23.671 1.00 10.00 H new ATOM 0 HA ILE A 56 -7.062 -2.063 21.155 1.00 10.00 H new ATOM 0 HB ILE A 56 -5.019 -2.170 23.373 1.00 10.00 H new ATOM 0 HG12 ILE A 56 -7.165 -0.063 23.128 1.00 10.00 H new ATOM 0 HG13 ILE A 56 -7.336 -1.477 24.150 1.00 10.00 H new ATOM 0 HG21 ILE A 56 -4.393 0.079 22.392 1.00 10.00 H new ATOM 0 HG22 ILE A 56 -4.241 -1.222 21.188 1.00 10.00 H new ATOM 0 HG23 ILE A 56 -5.649 -0.136 21.150 1.00 10.00 H new ATOM 0 HD11 ILE A 56 -6.525 0.454 25.452 1.00 10.00 H new ATOM 0 HD12 ILE A 56 -5.292 -0.829 25.412 1.00 10.00 H new ATOM 0 HD13 ILE A 56 -5.117 0.606 24.374 1.00 10.00 H new ATOM 861 N TYR A 57 -4.831 -4.453 21.881 1.00 10.00 N ATOM 862 CA TYR A 57 -3.879 -5.390 21.294 1.00 10.00 C ATOM 863 C TYR A 57 -4.523 -6.218 20.177 1.00 10.00 C ATOM 864 O TYR A 57 -3.870 -6.402 19.151 1.00 10.00 O ATOM 865 CB TYR A 57 -3.252 -6.286 22.372 1.00 10.00 C ATOM 866 CG TYR A 57 -2.305 -7.344 21.823 1.00 10.00 C ATOM 867 CD1 TYR A 57 -0.963 -7.021 21.523 1.00 10.00 C ATOM 868 CD2 TYR A 57 -2.779 -8.650 21.585 1.00 10.00 C ATOM 869 CE1 TYR A 57 -0.096 -7.993 20.984 1.00 10.00 C ATOM 870 CE2 TYR A 57 -1.921 -9.622 21.038 1.00 10.00 C ATOM 871 CZ TYR A 57 -0.579 -9.297 20.726 1.00 10.00 C ATOM 872 OH TYR A 57 0.234 -10.259 20.205 1.00 10.00 O ATOM 0 H TYR A 57 -4.929 -4.533 22.893 1.00 10.00 H new ATOM 0 HA TYR A 57 -3.076 -4.808 20.841 1.00 10.00 H new ATOM 0 HB2 TYR A 57 -2.710 -5.660 23.080 1.00 10.00 H new ATOM 0 HB3 TYR A 57 -4.049 -6.780 22.928 1.00 10.00 H new ATOM 0 HD1 TYR A 57 -0.598 -6.021 21.708 1.00 10.00 H new ATOM 0 HD2 TYR A 57 -3.801 -8.905 21.823 1.00 10.00 H new ATOM 0 HE1 TYR A 57 0.932 -7.743 20.769 1.00 10.00 H new ATOM 0 HE2 TYR A 57 -2.288 -10.621 20.855 1.00 10.00 H new ATOM 0 HH TYR A 57 1.091 -9.859 19.948 1.00 10.00 H new ATOM 882 N ASP A 58 -5.773 -6.668 20.332 1.00 10.00 N ATOM 883 CA ASP A 58 -6.490 -7.472 19.328 1.00 10.00 C ATOM 884 C ASP A 58 -6.668 -6.708 18.009 1.00 10.00 C ATOM 885 O ASP A 58 -6.292 -7.201 16.940 1.00 10.00 O ATOM 886 CB ASP A 58 -7.848 -7.933 19.874 1.00 10.00 C ATOM 887 CG ASP A 58 -8.601 -8.749 18.821 1.00 10.00 C ATOM 888 OD1 ASP A 58 -8.217 -9.930 18.658 1.00 10.00 O ATOM 889 OD2 ASP A 58 -9.489 -8.166 18.159 1.00 10.00 O ATOM 0 H ASP A 58 -6.325 -6.483 21.169 1.00 10.00 H new ATOM 0 HA ASP A 58 -5.882 -8.352 19.117 1.00 10.00 H new ATOM 0 HB2 ASP A 58 -7.701 -8.534 20.771 1.00 10.00 H new ATOM 0 HB3 ASP A 58 -8.443 -7.067 20.165 1.00 10.00 H new ATOM 894 N LYS A 59 -7.095 -5.436 18.072 1.00 10.00 N ATOM 895 CA LYS A 59 -7.213 -4.647 16.844 1.00 10.00 C ATOM 896 C LYS A 59 -5.839 -4.435 16.238 1.00 10.00 C ATOM 897 O LYS A 59 -5.671 -4.580 15.026 1.00 10.00 O ATOM 898 CB LYS A 59 -7.881 -3.278 17.060 1.00 10.00 C ATOM 899 CG LYS A 59 -9.340 -3.392 17.527 1.00 10.00 C ATOM 900 CD LYS A 59 -10.142 -2.133 17.162 1.00 10.00 C ATOM 901 CE LYS A 59 -11.526 -2.185 17.820 1.00 10.00 C ATOM 902 NZ LYS A 59 -12.328 -0.967 17.549 1.00 10.00 N ATOM 0 H LYS A 59 -7.355 -4.949 18.930 1.00 10.00 H new ATOM 0 HA LYS A 59 -7.854 -5.217 16.171 1.00 10.00 H new ATOM 0 HB2 LYS A 59 -7.311 -2.714 17.799 1.00 10.00 H new ATOM 0 HB3 LYS A 59 -7.846 -2.711 16.130 1.00 10.00 H new ATOM 0 HG2 LYS A 59 -9.803 -4.266 17.070 1.00 10.00 H new ATOM 0 HG3 LYS A 59 -9.368 -3.544 18.606 1.00 10.00 H new ATOM 0 HD2 LYS A 59 -9.607 -1.242 17.491 1.00 10.00 H new ATOM 0 HD3 LYS A 59 -10.247 -2.060 16.080 1.00 10.00 H new ATOM 0 HE2 LYS A 59 -12.065 -3.060 17.457 1.00 10.00 H new ATOM 0 HE3 LYS A 59 -11.409 -2.307 18.897 1.00 10.00 H new ATOM 0 HZ1 LYS A 59 -13.321 -1.141 17.804 1.00 10.00 H new ATOM 0 HZ2 LYS A 59 -11.959 -0.176 18.114 1.00 10.00 H new ATOM 0 HZ3 LYS A 59 -12.267 -0.729 16.538 1.00 10.00 H new ATOM 916 N VAL A 60 -4.877 -4.020 17.062 1.00 10.00 N ATOM 917 CA VAL A 60 -3.590 -3.583 16.543 1.00 10.00 C ATOM 918 C VAL A 60 -2.854 -4.776 15.927 1.00 10.00 C ATOM 919 O VAL A 60 -2.269 -4.628 14.861 1.00 10.00 O ATOM 920 CB VAL A 60 -2.789 -2.870 17.648 1.00 10.00 C ATOM 921 CG1 VAL A 60 -1.359 -2.525 17.194 1.00 10.00 C ATOM 922 CG2 VAL A 60 -3.499 -1.563 18.055 1.00 10.00 C ATOM 0 H VAL A 60 -4.966 -3.979 18.077 1.00 10.00 H new ATOM 0 HA VAL A 60 -3.728 -2.852 15.746 1.00 10.00 H new ATOM 0 HB VAL A 60 -2.731 -3.557 18.493 1.00 10.00 H new ATOM 0 HG11 VAL A 60 -0.831 -2.023 18.005 1.00 10.00 H new ATOM 0 HG12 VAL A 60 -0.831 -3.441 16.929 1.00 10.00 H new ATOM 0 HG13 VAL A 60 -1.402 -1.866 16.327 1.00 10.00 H new ATOM 0 HG21 VAL A 60 -2.925 -1.066 18.837 1.00 10.00 H new ATOM 0 HG22 VAL A 60 -3.577 -0.906 17.189 1.00 10.00 H new ATOM 0 HG23 VAL A 60 -4.497 -1.792 18.428 1.00 10.00 H new ATOM 932 N SER A 61 -2.863 -5.952 16.557 1.00 10.00 N ATOM 933 CA SER A 61 -2.207 -7.125 15.986 1.00 10.00 C ATOM 934 C SER A 61 -2.885 -7.565 14.681 1.00 10.00 C ATOM 935 O SER A 61 -2.185 -8.010 13.766 1.00 10.00 O ATOM 936 CB SER A 61 -2.115 -8.255 17.020 1.00 10.00 C ATOM 937 OG SER A 61 -3.365 -8.540 17.604 1.00 10.00 O ATOM 0 H SER A 61 -3.315 -6.115 17.457 1.00 10.00 H new ATOM 0 HA SER A 61 -1.185 -6.855 15.722 1.00 10.00 H new ATOM 0 HB2 SER A 61 -1.725 -9.153 16.541 1.00 10.00 H new ATOM 0 HB3 SER A 61 -1.406 -7.976 17.799 1.00 10.00 H new ATOM 0 HG SER A 61 -3.554 -7.885 18.309 1.00 10.00 H new ATOM 943 N GLY A 62 -4.212 -7.419 14.562 1.00 10.00 N ATOM 944 CA GLY A 62 -4.903 -7.700 13.313 1.00 10.00 C ATOM 945 C GLY A 62 -4.443 -6.743 12.213 1.00 10.00 C ATOM 946 O GLY A 62 -4.125 -7.176 11.103 1.00 10.00 O ATOM 0 H GLY A 62 -4.821 -7.108 15.319 1.00 10.00 H new ATOM 0 HA2 GLY A 62 -4.712 -8.729 13.010 1.00 10.00 H new ATOM 0 HA3 GLY A 62 -5.979 -7.605 13.458 1.00 10.00 H new ATOM 950 N ASP A 63 -4.401 -5.440 12.510 1.00 10.00 N ATOM 951 CA ASP A 63 -3.929 -4.432 11.559 1.00 10.00 C ATOM 952 C ASP A 63 -2.472 -4.668 11.188 1.00 10.00 C ATOM 953 O ASP A 63 -2.152 -4.743 10.009 1.00 10.00 O ATOM 954 CB ASP A 63 -4.096 -3.013 12.105 1.00 10.00 C ATOM 955 CG ASP A 63 -3.565 -1.982 11.107 1.00 10.00 C ATOM 956 OD1 ASP A 63 -4.005 -2.049 9.933 1.00 10.00 O ATOM 957 OD2 ASP A 63 -2.704 -1.176 11.520 1.00 10.00 O ATOM 0 H ASP A 63 -4.691 -5.058 13.410 1.00 10.00 H new ATOM 0 HA ASP A 63 -4.545 -4.531 10.665 1.00 10.00 H new ATOM 0 HB2 ASP A 63 -5.149 -2.819 12.310 1.00 10.00 H new ATOM 0 HB3 ASP A 63 -3.564 -2.918 13.051 1.00 10.00 H new ATOM 962 N MET A 64 -1.596 -4.897 12.166 1.00 10.00 N ATOM 963 CA MET A 64 -0.178 -5.077 11.903 1.00 10.00 C ATOM 964 C MET A 64 0.049 -6.276 11.000 1.00 10.00 C ATOM 965 O MET A 64 0.900 -6.186 10.123 1.00 10.00 O ATOM 966 CB MET A 64 0.616 -5.218 13.206 1.00 10.00 C ATOM 967 CG MET A 64 0.817 -3.863 13.892 1.00 10.00 C ATOM 968 SD MET A 64 1.713 -2.627 12.909 1.00 10.00 S ATOM 969 CE MET A 64 0.489 -1.288 12.975 1.00 10.00 C ATOM 0 H MET A 64 -1.851 -4.962 13.152 1.00 10.00 H new ATOM 0 HA MET A 64 0.184 -4.186 11.390 1.00 10.00 H new ATOM 0 HB2 MET A 64 0.092 -5.894 13.881 1.00 10.00 H new ATOM 0 HB3 MET A 64 1.586 -5.667 12.995 1.00 10.00 H new ATOM 0 HG2 MET A 64 -0.160 -3.457 14.154 1.00 10.00 H new ATOM 0 HG3 MET A 64 1.356 -4.022 14.826 1.00 10.00 H new ATOM 0 HE1 MET A 64 0.695 -0.567 12.183 1.00 10.00 H new ATOM 0 HE2 MET A 64 -0.510 -1.701 12.838 1.00 10.00 H new ATOM 0 HE3 MET A 64 0.546 -0.790 13.943 1.00 10.00 H new ATOM 979 N GLN A 65 -0.719 -7.357 11.142 1.00 10.00 N ATOM 980 CA GLN A 65 -0.598 -8.489 10.233 1.00 10.00 C ATOM 981 C GLN A 65 -0.995 -8.095 8.806 1.00 10.00 C ATOM 982 O GLN A 65 -0.327 -8.526 7.871 1.00 10.00 O ATOM 983 CB GLN A 65 -1.426 -9.665 10.765 1.00 10.00 C ATOM 984 CG GLN A 65 -0.696 -10.335 11.942 1.00 10.00 C ATOM 985 CD GLN A 65 -1.595 -11.339 12.653 1.00 10.00 C ATOM 986 OE1 GLN A 65 -1.556 -12.538 12.409 1.00 10.00 O ATOM 987 NE2 GLN A 65 -2.476 -10.854 13.509 1.00 10.00 N ATOM 0 H GLN A 65 -1.424 -7.469 11.871 1.00 10.00 H new ATOM 0 HA GLN A 65 0.444 -8.805 10.186 1.00 10.00 H new ATOM 0 HB2 GLN A 65 -2.406 -9.314 11.087 1.00 10.00 H new ATOM 0 HB3 GLN A 65 -1.593 -10.391 9.970 1.00 10.00 H new ATOM 0 HG2 GLN A 65 0.199 -10.839 11.578 1.00 10.00 H new ATOM 0 HG3 GLN A 65 -0.367 -9.574 12.649 1.00 10.00 H new ATOM 0 HE21 GLN A 65 -2.499 -9.853 13.705 1.00 10.00 H new ATOM 0 HE22 GLN A 65 -3.133 -11.480 13.974 1.00 10.00 H new ATOM 996 N LYS A 66 -2.043 -7.282 8.607 1.00 10.00 N ATOM 997 CA LYS A 66 -2.378 -6.815 7.259 1.00 10.00 C ATOM 998 C LYS A 66 -1.345 -5.804 6.732 1.00 10.00 C ATOM 999 O LYS A 66 -1.213 -5.695 5.516 1.00 10.00 O ATOM 1000 CB LYS A 66 -3.848 -6.343 7.169 1.00 10.00 C ATOM 1001 CG LYS A 66 -4.128 -4.841 7.375 1.00 10.00 C ATOM 1002 CD LYS A 66 -5.608 -4.477 7.183 1.00 10.00 C ATOM 1003 CE LYS A 66 -6.514 -5.102 8.254 1.00 10.00 C ATOM 1004 NZ LYS A 66 -7.934 -4.718 8.073 1.00 10.00 N ATOM 0 H LYS A 66 -2.659 -6.942 9.345 1.00 10.00 H new ATOM 0 HA LYS A 66 -2.312 -7.662 6.576 1.00 10.00 H new ATOM 0 HB2 LYS A 66 -4.232 -6.625 6.189 1.00 10.00 H new ATOM 0 HB3 LYS A 66 -4.425 -6.897 7.909 1.00 10.00 H new ATOM 0 HG2 LYS A 66 -3.815 -4.553 8.379 1.00 10.00 H new ATOM 0 HG3 LYS A 66 -3.523 -4.264 6.675 1.00 10.00 H new ATOM 0 HD2 LYS A 66 -5.718 -3.393 7.207 1.00 10.00 H new ATOM 0 HD3 LYS A 66 -5.935 -4.808 6.197 1.00 10.00 H new ATOM 0 HE2 LYS A 66 -6.424 -6.188 8.216 1.00 10.00 H new ATOM 0 HE3 LYS A 66 -6.177 -4.789 9.242 1.00 10.00 H new ATOM 0 HZ1 LYS A 66 -8.511 -5.161 8.816 1.00 10.00 H new ATOM 0 HZ2 LYS A 66 -8.025 -3.684 8.135 1.00 10.00 H new ATOM 0 HZ3 LYS A 66 -8.264 -5.039 7.141 1.00 10.00 H new ATOM 1018 N GLN A 67 -0.654 -5.056 7.604 1.00 10.00 N ATOM 1019 CA GLN A 67 0.414 -4.148 7.197 1.00 10.00 C ATOM 1020 C GLN A 67 1.615 -4.978 6.717 1.00 10.00 C ATOM 1021 O GLN A 67 2.124 -4.779 5.613 1.00 10.00 O ATOM 1022 CB GLN A 67 0.839 -3.219 8.367 1.00 10.00 C ATOM 1023 CG GLN A 67 -0.195 -2.192 8.867 1.00 10.00 C ATOM 1024 CD GLN A 67 -0.922 -1.454 7.752 1.00 10.00 C ATOM 1025 OE1 GLN A 67 -0.295 -0.956 6.824 1.00 10.00 O ATOM 1026 NE2 GLN A 67 -2.243 -1.368 7.811 1.00 10.00 N ATOM 0 H GLN A 67 -0.824 -5.067 8.610 1.00 10.00 H new ATOM 0 HA GLN A 67 0.050 -3.514 6.388 1.00 10.00 H new ATOM 0 HB2 GLN A 67 1.124 -3.848 9.210 1.00 10.00 H new ATOM 0 HB3 GLN A 67 1.732 -2.675 8.058 1.00 10.00 H new ATOM 0 HG2 GLN A 67 -0.929 -2.704 9.489 1.00 10.00 H new ATOM 0 HG3 GLN A 67 0.309 -1.464 9.503 1.00 10.00 H new ATOM 0 HE21 GLN A 67 -2.747 -1.789 8.591 1.00 10.00 H new ATOM 0 HE22 GLN A 67 -2.756 -0.881 7.076 1.00 10.00 H new ATOM 1035 N GLY A 68 2.100 -5.879 7.575 1.00 10.00 N ATOM 1036 CA GLY A 68 3.311 -6.663 7.369 1.00 10.00 C ATOM 1037 C GLY A 68 4.192 -6.679 8.624 1.00 10.00 C ATOM 1038 O GLY A 68 5.401 -6.464 8.524 1.00 10.00 O ATOM 0 H GLY A 68 1.641 -6.087 8.462 1.00 10.00 H new ATOM 0 HA2 GLY A 68 3.043 -7.684 7.099 1.00 10.00 H new ATOM 0 HA3 GLY A 68 3.875 -6.250 6.533 1.00 10.00 H new ATOM 1042 N CYS A 69 3.603 -6.841 9.811 1.00 10.00 N ATOM 1043 CA CYS A 69 4.294 -6.904 11.091 1.00 10.00 C ATOM 1044 C CYS A 69 3.611 -7.940 11.991 1.00 10.00 C ATOM 1045 O CYS A 69 2.480 -8.343 11.732 1.00 10.00 O ATOM 1046 CB CYS A 69 4.264 -5.527 11.780 1.00 10.00 C ATOM 1047 SG CYS A 69 5.453 -4.374 11.036 1.00 10.00 S ATOM 0 H CYS A 69 2.592 -6.935 9.905 1.00 10.00 H new ATOM 0 HA CYS A 69 5.331 -7.193 10.920 1.00 10.00 H new ATOM 0 HB2 CYS A 69 3.260 -5.108 11.711 1.00 10.00 H new ATOM 0 HB3 CYS A 69 4.488 -5.646 12.840 1.00 10.00 H new ATOM 0 HG CYS A 69 5.801 -4.808 9.861 1.00 10.00 H new ATOM 1053 N ASP A 70 4.262 -8.294 13.094 1.00 10.00 N ATOM 1054 CA ASP A 70 3.725 -9.107 14.195 1.00 10.00 C ATOM 1055 C ASP A 70 3.970 -8.331 15.489 1.00 10.00 C ATOM 1056 O ASP A 70 4.790 -7.405 15.480 1.00 10.00 O ATOM 1057 CB ASP A 70 4.413 -10.479 14.233 1.00 10.00 C ATOM 1058 CG ASP A 70 3.917 -11.352 15.387 1.00 10.00 C ATOM 1059 OD1 ASP A 70 2.696 -11.272 15.665 1.00 10.00 O ATOM 1060 OD2 ASP A 70 4.780 -12.001 16.015 1.00 10.00 O ATOM 0 H ASP A 70 5.228 -8.011 13.259 1.00 10.00 H new ATOM 0 HA ASP A 70 2.659 -9.290 14.061 1.00 10.00 H new ATOM 0 HB2 ASP A 70 4.238 -10.996 13.289 1.00 10.00 H new ATOM 0 HB3 ASP A 70 5.490 -10.339 14.325 1.00 10.00 H new ATOM 1065 N CYS A 71 3.257 -8.637 16.576 1.00 10.00 N ATOM 1066 CA CYS A 71 3.184 -7.809 17.775 1.00 10.00 C ATOM 1067 C CYS A 71 3.458 -8.600 19.055 1.00 10.00 C ATOM 1068 O CYS A 71 3.024 -9.732 19.211 1.00 10.00 O ATOM 1069 CB CYS A 71 1.762 -7.236 17.899 1.00 10.00 C ATOM 1070 SG CYS A 71 1.371 -6.091 16.555 1.00 10.00 S ATOM 0 H CYS A 71 2.702 -9.490 16.645 1.00 10.00 H new ATOM 0 HA CYS A 71 3.942 -7.033 17.671 1.00 10.00 H new ATOM 0 HB2 CYS A 71 1.041 -8.053 17.900 1.00 10.00 H new ATOM 0 HB3 CYS A 71 1.661 -6.721 18.854 1.00 10.00 H new ATOM 0 HG CYS A 71 0.253 -5.481 16.816 1.00 10.00 H new ATOM 1076 N GLU A 72 3.950 -7.920 20.082 1.00 10.00 N ATOM 1077 CA GLU A 72 4.085 -8.442 21.437 1.00 10.00 C ATOM 1078 C GLU A 72 3.760 -7.275 22.370 1.00 10.00 C ATOM 1079 O GLU A 72 4.470 -6.270 22.369 1.00 10.00 O ATOM 1080 CB GLU A 72 5.509 -8.994 21.638 1.00 10.00 C ATOM 1081 CG GLU A 72 5.674 -9.617 23.036 1.00 10.00 C ATOM 1082 CD GLU A 72 7.088 -10.168 23.267 1.00 10.00 C ATOM 1083 OE1 GLU A 72 7.663 -10.797 22.351 1.00 10.00 O ATOM 1084 OE2 GLU A 72 7.727 -9.743 24.255 1.00 10.00 O ATOM 0 H GLU A 72 4.277 -6.958 19.993 1.00 10.00 H new ATOM 0 HA GLU A 72 3.410 -9.273 21.642 1.00 10.00 H new ATOM 0 HB2 GLU A 72 5.722 -9.744 20.876 1.00 10.00 H new ATOM 0 HB3 GLU A 72 6.235 -8.191 21.507 1.00 10.00 H new ATOM 0 HG2 GLU A 72 5.451 -8.866 23.794 1.00 10.00 H new ATOM 0 HG3 GLU A 72 4.949 -10.421 23.161 1.00 10.00 H new ATOM 1091 N CYS A 73 2.633 -7.324 23.078 1.00 10.00 N ATOM 1092 CA CYS A 73 2.337 -6.372 24.137 1.00 10.00 C ATOM 1093 C CYS A 73 3.405 -6.488 25.228 1.00 10.00 C ATOM 1094 O CYS A 73 3.605 -7.563 25.786 1.00 10.00 O ATOM 1095 CB CYS A 73 0.921 -6.617 24.686 1.00 10.00 C ATOM 1096 SG CYS A 73 0.507 -8.387 24.772 1.00 10.00 S ATOM 0 H CYS A 73 1.905 -8.023 22.932 1.00 10.00 H new ATOM 0 HA CYS A 73 2.359 -5.355 23.747 1.00 10.00 H new ATOM 0 HB2 CYS A 73 0.839 -6.179 25.681 1.00 10.00 H new ATOM 0 HB3 CYS A 73 0.195 -6.107 24.052 1.00 10.00 H new ATOM 0 HG CYS A 73 -0.363 -8.584 25.717 1.00 10.00 H new ATOM 1102 N LEU A 74 4.086 -5.383 25.537 1.00 10.00 N ATOM 1103 CA LEU A 74 5.100 -5.350 26.595 1.00 10.00 C ATOM 1104 C LEU A 74 4.450 -5.072 27.955 1.00 10.00 C ATOM 1105 O LEU A 74 5.024 -5.351 29.001 1.00 10.00 O ATOM 1106 CB LEU A 74 6.174 -4.287 26.284 1.00 10.00 C ATOM 1107 CG LEU A 74 6.923 -4.482 24.948 1.00 10.00 C ATOM 1108 CD1 LEU A 74 8.125 -3.533 24.892 1.00 10.00 C ATOM 1109 CD2 LEU A 74 7.430 -5.916 24.747 1.00 10.00 C ATOM 0 H LEU A 74 3.952 -4.489 25.064 1.00 10.00 H new ATOM 0 HA LEU A 74 5.583 -6.326 26.637 1.00 10.00 H new ATOM 0 HB2 LEU A 74 5.700 -3.306 26.277 1.00 10.00 H new ATOM 0 HB3 LEU A 74 6.903 -4.282 27.094 1.00 10.00 H new ATOM 0 HG LEU A 74 6.207 -4.267 24.155 1.00 10.00 H new ATOM 0 HD11 LEU A 74 8.654 -3.671 23.949 1.00 10.00 H new ATOM 0 HD12 LEU A 74 7.779 -2.502 24.967 1.00 10.00 H new ATOM 0 HD13 LEU A 74 8.799 -3.750 25.721 1.00 10.00 H new ATOM 0 HD21 LEU A 74 7.947 -5.988 23.790 1.00 10.00 H new ATOM 0 HD22 LEU A 74 8.118 -6.175 25.552 1.00 10.00 H new ATOM 0 HD23 LEU A 74 6.585 -6.605 24.756 1.00 10.00 H new ATOM 1121 N GLY A 75 3.264 -4.467 27.938 1.00 10.00 N ATOM 1122 CA GLY A 75 2.562 -3.985 29.111 1.00 10.00 C ATOM 1123 C GLY A 75 1.668 -2.827 28.689 1.00 10.00 C ATOM 1124 O GLY A 75 1.619 -2.465 27.514 1.00 10.00 O ATOM 0 H GLY A 75 2.753 -4.296 27.072 1.00 10.00 H new ATOM 0 HA2 GLY A 75 1.966 -4.784 29.552 1.00 10.00 H new ATOM 0 HA3 GLY A 75 3.272 -3.660 29.872 1.00 10.00 H new ATOM 1128 N GLY A 76 0.974 -2.198 29.627 1.00 10.00 N ATOM 1129 CA GLY A 76 0.201 -0.996 29.351 1.00 10.00 C ATOM 1130 C GLY A 76 -0.186 -0.297 30.644 1.00 10.00 C ATOM 1131 O GLY A 76 0.407 -0.552 31.695 1.00 10.00 O ATOM 0 H GLY A 76 0.931 -2.506 30.598 1.00 10.00 H new ATOM 0 HA2 GLY A 76 0.783 -0.319 28.726 1.00 10.00 H new ATOM 0 HA3 GLY A 76 -0.696 -1.256 28.790 1.00 10.00 H new ATOM 1135 N GLY A 77 -1.194 0.568 30.560 1.00 10.00 N ATOM 1136 CA GLY A 77 -1.656 1.421 31.637 1.00 10.00 C ATOM 1137 C GLY A 77 -2.795 2.295 31.114 1.00 10.00 C ATOM 1138 O GLY A 77 -3.684 1.829 30.391 1.00 10.00 O ATOM 0 H GLY A 77 -1.729 0.694 29.701 1.00 10.00 H new ATOM 0 HA2 GLY A 77 -1.998 0.817 32.477 1.00 10.00 H new ATOM 0 HA3 GLY A 77 -0.839 2.043 32.003 1.00 10.00 H new ATOM 1142 N ARG A 78 -2.807 3.567 31.492 1.00 10.00 N ATOM 1143 CA ARG A 78 -3.789 4.552 31.058 1.00 10.00 C ATOM 1144 C ARG A 78 -3.049 5.835 30.732 1.00 10.00 C ATOM 1145 O ARG A 78 -2.084 6.138 31.429 1.00 10.00 O ATOM 1146 CB ARG A 78 -4.793 4.837 32.181 1.00 10.00 C ATOM 1147 CG ARG A 78 -5.579 3.607 32.663 1.00 10.00 C ATOM 1148 CD ARG A 78 -6.409 3.928 33.912 1.00 10.00 C ATOM 1149 NE ARG A 78 -5.549 4.287 35.058 1.00 10.00 N ATOM 1150 CZ ARG A 78 -5.765 3.979 36.343 1.00 10.00 C ATOM 1151 NH1 ARG A 78 -6.849 3.319 36.731 1.00 10.00 N ATOM 1152 NH2 ARG A 78 -4.882 4.318 37.273 1.00 10.00 N ATOM 0 H ARG A 78 -2.111 3.954 32.130 1.00 10.00 H new ATOM 0 HA ARG A 78 -4.329 4.173 30.190 1.00 10.00 H new ATOM 0 HB2 ARG A 78 -4.258 5.265 33.029 1.00 10.00 H new ATOM 0 HB3 ARG A 78 -5.500 5.591 31.836 1.00 10.00 H new ATOM 0 HG2 ARG A 78 -6.237 3.259 31.867 1.00 10.00 H new ATOM 0 HG3 ARG A 78 -4.887 2.794 32.883 1.00 10.00 H new ATOM 0 HD2 ARG A 78 -7.090 4.751 33.695 1.00 10.00 H new ATOM 0 HD3 ARG A 78 -7.023 3.066 34.173 1.00 10.00 H new ATOM 0 HE ARG A 78 -4.707 4.823 34.850 1.00 10.00 H new ATOM 0 HH11 ARG A 78 -7.545 3.032 36.043 1.00 10.00 H new ATOM 0 HH12 ARG A 78 -6.986 3.099 37.717 1.00 10.00 H new ATOM 0 HH21 ARG A 78 -4.032 4.817 37.011 1.00 10.00 H new ATOM 0 HH22 ARG A 78 -5.053 4.080 38.250 1.00 10.00 H new ATOM 1166 N ILE A 79 -3.498 6.565 29.722 1.00 10.00 N ATOM 1167 CA ILE A 79 -3.058 7.917 29.417 1.00 10.00 C ATOM 1168 C ILE A 79 -4.230 8.808 29.831 1.00 10.00 C ATOM 1169 O ILE A 79 -5.384 8.380 29.794 1.00 10.00 O ATOM 1170 CB ILE A 79 -2.700 8.020 27.911 1.00 10.00 C ATOM 1171 CG1 ILE A 79 -1.482 7.127 27.573 1.00 10.00 C ATOM 1172 CG2 ILE A 79 -2.411 9.470 27.478 1.00 10.00 C ATOM 1173 CD1 ILE A 79 -1.231 6.932 26.073 1.00 10.00 C ATOM 0 H ILE A 79 -4.203 6.220 29.070 1.00 10.00 H new ATOM 0 HA ILE A 79 -2.154 8.220 29.946 1.00 10.00 H new ATOM 0 HB ILE A 79 -3.572 7.671 27.358 1.00 10.00 H new ATOM 0 HG12 ILE A 79 -0.591 7.565 28.023 1.00 10.00 H new ATOM 0 HG13 ILE A 79 -1.625 6.150 28.034 1.00 10.00 H new ATOM 0 HG21 ILE A 79 -2.165 9.491 26.416 1.00 10.00 H new ATOM 0 HG22 ILE A 79 -3.292 10.086 27.659 1.00 10.00 H new ATOM 0 HG23 ILE A 79 -1.571 9.861 28.052 1.00 10.00 H new ATOM 0 HD11 ILE A 79 -0.359 6.294 25.930 1.00 10.00 H new ATOM 0 HD12 ILE A 79 -2.103 6.464 25.616 1.00 10.00 H new ATOM 0 HD13 ILE A 79 -1.052 7.900 25.605 1.00 10.00 H new ATOM 1185 N SER A 80 -3.930 10.044 30.211 1.00 10.00 N ATOM 1186 CA SER A 80 -4.910 11.048 30.577 1.00 10.00 C ATOM 1187 C SER A 80 -4.549 12.327 29.827 1.00 10.00 C ATOM 1188 O SER A 80 -3.385 12.736 29.844 1.00 10.00 O ATOM 1189 CB SER A 80 -4.915 11.248 32.100 1.00 10.00 C ATOM 1190 OG SER A 80 -4.969 10.013 32.812 1.00 10.00 O ATOM 0 H SER A 80 -2.969 10.381 30.273 1.00 10.00 H new ATOM 0 HA SER A 80 -5.919 10.742 30.302 1.00 10.00 H new ATOM 0 HB2 SER A 80 -4.019 11.795 32.395 1.00 10.00 H new ATOM 0 HB3 SER A 80 -5.770 11.863 32.380 1.00 10.00 H new ATOM 0 HG SER A 80 -4.968 10.191 33.776 1.00 10.00 H new ATOM 1314 N ILE A 88 -0.352 16.144 29.544 1.00 10.00 N ATOM 1315 CA ILE A 88 -0.589 14.714 29.388 1.00 10.00 C ATOM 1316 C ILE A 88 0.062 14.016 30.590 1.00 10.00 C ATOM 1317 O ILE A 88 1.149 14.391 31.051 1.00 10.00 O ATOM 1318 CB ILE A 88 -0.066 14.216 28.013 1.00 10.00 C ATOM 1319 CG1 ILE A 88 -0.643 15.073 26.856 1.00 10.00 C ATOM 1320 CG2 ILE A 88 -0.421 12.727 27.808 1.00 10.00 C ATOM 1321 CD1 ILE A 88 -0.202 14.659 25.444 1.00 10.00 C ATOM 0 HA ILE A 88 -1.653 14.477 29.382 1.00 10.00 H new ATOM 0 HB ILE A 88 1.019 14.321 28.005 1.00 10.00 H new ATOM 0 HG12 ILE A 88 -1.731 15.032 26.905 1.00 10.00 H new ATOM 0 HG13 ILE A 88 -0.355 16.112 27.018 1.00 10.00 H new ATOM 0 HG21 ILE A 88 -0.047 12.394 26.840 1.00 10.00 H new ATOM 0 HG22 ILE A 88 0.037 12.132 28.598 1.00 10.00 H new ATOM 0 HG23 ILE A 88 -1.503 12.603 27.841 1.00 10.00 H new ATOM 0 HD11 ILE A 88 -0.661 15.322 24.710 1.00 10.00 H new ATOM 0 HD12 ILE A 88 0.883 14.729 25.367 1.00 10.00 H new ATOM 0 HD13 ILE A 88 -0.514 13.633 25.252 1.00 10.00 H new ATOM 1333 N HIS A 89 -0.575 12.968 31.097 1.00 10.00 N ATOM 1334 CA HIS A 89 -0.022 12.143 32.161 1.00 10.00 C ATOM 1335 C HIS A 89 -0.324 10.687 31.847 1.00 10.00 C ATOM 1336 O HIS A 89 -1.240 10.424 31.072 1.00 10.00 O ATOM 1337 CB HIS A 89 -0.594 12.581 33.513 1.00 10.00 C ATOM 1338 CG HIS A 89 0.188 12.036 34.678 1.00 10.00 C ATOM 1339 ND1 HIS A 89 1.409 12.494 35.118 1.00 10.00 N ATOM 1340 CD2 HIS A 89 -0.166 10.994 35.489 1.00 10.00 C ATOM 1341 CE1 HIS A 89 1.784 11.748 36.169 1.00 10.00 C ATOM 1342 NE2 HIS A 89 0.853 10.821 36.430 1.00 10.00 N ATOM 0 H HIS A 89 -1.496 12.666 30.779 1.00 10.00 H new ATOM 0 HA HIS A 89 1.060 12.263 32.224 1.00 10.00 H new ATOM 0 HB2 HIS A 89 -0.603 13.670 33.564 1.00 10.00 H new ATOM 0 HB3 HIS A 89 -1.630 12.250 33.589 1.00 10.00 H new ATOM 0 HD2 HIS A 89 -1.071 10.409 35.416 1.00 10.00 H new ATOM 0 HE1 HIS A 89 2.702 11.876 36.723 1.00 10.00 H new ATOM 0 HE2 HIS A 89 0.882 10.123 37.173 1.00 10.00 H new ATOM 1350 N VAL A 90 0.403 9.731 32.424 1.00 10.00 N ATOM 1351 CA VAL A 90 0.256 8.303 32.140 1.00 10.00 C ATOM 1352 C VAL A 90 0.427 7.544 33.465 1.00 10.00 C ATOM 1353 O VAL A 90 1.335 7.845 34.234 1.00 10.00 O ATOM 1354 CB VAL A 90 1.286 7.870 31.066 1.00 10.00 C ATOM 1355 CG1 VAL A 90 0.976 6.468 30.529 1.00 10.00 C ATOM 1356 CG2 VAL A 90 1.354 8.823 29.854 1.00 10.00 C ATOM 0 H VAL A 90 1.125 9.931 33.116 1.00 10.00 H new ATOM 0 HA VAL A 90 -0.729 8.075 31.732 1.00 10.00 H new ATOM 0 HB VAL A 90 2.246 7.891 31.582 1.00 10.00 H new ATOM 0 HG11 VAL A 90 1.717 6.194 29.778 1.00 10.00 H new ATOM 0 HG12 VAL A 90 1.007 5.750 31.348 1.00 10.00 H new ATOM 0 HG13 VAL A 90 -0.017 6.462 30.079 1.00 10.00 H new ATOM 0 HG21 VAL A 90 2.096 8.457 29.144 1.00 10.00 H new ATOM 0 HG22 VAL A 90 0.378 8.866 29.370 1.00 10.00 H new ATOM 0 HG23 VAL A 90 1.636 9.821 30.191 1.00 10.00 H new ATOM 1366 N TYR A 91 -0.455 6.602 33.788 1.00 10.00 N ATOM 1367 CA TYR A 91 -0.490 5.954 35.101 1.00 10.00 C ATOM 1368 C TYR A 91 -1.277 4.639 35.056 1.00 10.00 C ATOM 1369 O TYR A 91 -1.892 4.304 34.043 1.00 10.00 O ATOM 1370 CB TYR A 91 -1.065 6.920 36.165 1.00 10.00 C ATOM 1371 CG TYR A 91 -2.579 7.121 36.214 1.00 10.00 C ATOM 1372 CD1 TYR A 91 -3.344 7.313 35.043 1.00 10.00 C ATOM 1373 CD2 TYR A 91 -3.222 7.170 37.469 1.00 10.00 C ATOM 1374 CE1 TYR A 91 -4.728 7.541 35.123 1.00 10.00 C ATOM 1375 CE2 TYR A 91 -4.603 7.420 37.558 1.00 10.00 C ATOM 1376 CZ TYR A 91 -5.362 7.611 36.381 1.00 10.00 C ATOM 1377 OH TYR A 91 -6.699 7.843 36.442 1.00 10.00 O ATOM 0 H TYR A 91 -1.170 6.263 33.145 1.00 10.00 H new ATOM 0 HA TYR A 91 0.533 5.706 35.384 1.00 10.00 H new ATOM 0 HB2 TYR A 91 -0.744 6.566 37.145 1.00 10.00 H new ATOM 0 HB3 TYR A 91 -0.604 7.896 36.012 1.00 10.00 H new ATOM 0 HD1 TYR A 91 -2.861 7.284 34.077 1.00 10.00 H new ATOM 0 HD2 TYR A 91 -2.648 7.014 38.370 1.00 10.00 H new ATOM 0 HE1 TYR A 91 -5.307 7.663 34.220 1.00 10.00 H new ATOM 0 HE2 TYR A 91 -5.083 7.466 38.524 1.00 10.00 H new ATOM 0 HH TYR A 91 -6.985 7.861 37.379 1.00 10.00 H new ATOM 1387 N GLY A 92 -1.325 3.915 36.180 1.00 10.00 N ATOM 1388 CA GLY A 92 -1.975 2.611 36.262 1.00 10.00 C ATOM 1389 C GLY A 92 -1.100 1.508 35.667 1.00 10.00 C ATOM 1390 O GLY A 92 0.087 1.711 35.429 1.00 10.00 O ATOM 0 H GLY A 92 -0.911 4.222 37.060 1.00 10.00 H new ATOM 0 HA2 GLY A 92 -2.196 2.379 37.304 1.00 10.00 H new ATOM 0 HA3 GLY A 92 -2.928 2.645 35.734 1.00 10.00 H new ATOM 1394 N TYR A 93 -1.687 0.341 35.423 1.00 10.00 N ATOM 1395 CA TYR A 93 -1.052 -0.775 34.727 1.00 10.00 C ATOM 1396 C TYR A 93 -2.143 -1.568 34.010 1.00 10.00 C ATOM 1397 O TYR A 93 -3.317 -1.445 34.364 1.00 10.00 O ATOM 1398 CB TYR A 93 -0.279 -1.666 35.713 1.00 10.00 C ATOM 1399 CG TYR A 93 -1.120 -2.451 36.707 1.00 10.00 C ATOM 1400 CD1 TYR A 93 -1.573 -1.839 37.891 1.00 10.00 C ATOM 1401 CD2 TYR A 93 -1.422 -3.806 36.463 1.00 10.00 C ATOM 1402 CE1 TYR A 93 -2.334 -2.568 38.820 1.00 10.00 C ATOM 1403 CE2 TYR A 93 -2.184 -4.538 37.388 1.00 10.00 C ATOM 1404 CZ TYR A 93 -2.647 -3.919 38.570 1.00 10.00 C ATOM 1405 OH TYR A 93 -3.375 -4.618 39.483 1.00 10.00 O ATOM 0 H TYR A 93 -2.644 0.139 35.712 1.00 10.00 H new ATOM 0 HA TYR A 93 -0.329 -0.401 34.002 1.00 10.00 H new ATOM 0 HB2 TYR A 93 0.321 -2.372 35.139 1.00 10.00 H new ATOM 0 HB3 TYR A 93 0.415 -1.038 36.272 1.00 10.00 H new ATOM 0 HD1 TYR A 93 -1.334 -0.804 38.086 1.00 10.00 H new ATOM 0 HD2 TYR A 93 -1.066 -4.283 35.562 1.00 10.00 H new ATOM 0 HE1 TYR A 93 -2.679 -2.093 39.726 1.00 10.00 H new ATOM 0 HE2 TYR A 93 -2.416 -5.575 37.195 1.00 10.00 H new ATOM 0 HH TYR A 93 -3.507 -5.535 39.163 1.00 10.00 H new ATOM 1415 N SER A 94 -1.802 -2.371 33.007 1.00 10.00 N ATOM 1416 CA SER A 94 -2.754 -3.276 32.387 1.00 10.00 C ATOM 1417 C SER A 94 -2.794 -4.583 33.162 1.00 10.00 C ATOM 1418 O SER A 94 -1.820 -5.333 33.152 1.00 10.00 O ATOM 1419 CB SER A 94 -2.343 -3.562 30.945 1.00 10.00 C ATOM 1420 OG SER A 94 -2.352 -2.384 30.180 1.00 10.00 O ATOM 0 H SER A 94 -0.865 -2.410 32.606 1.00 10.00 H new ATOM 0 HA SER A 94 -3.740 -2.811 32.396 1.00 10.00 H new ATOM 0 HB2 SER A 94 -1.347 -4.005 30.927 1.00 10.00 H new ATOM 0 HB3 SER A 94 -3.024 -4.291 30.506 1.00 10.00 H new ATOM 0 HG SER A 94 -2.403 -2.612 29.228 1.00 10.00 H new ATOM 1426 N MET A 95 -3.944 -4.909 33.750 1.00 10.00 N ATOM 1427 CA MET A 95 -4.185 -6.220 34.349 1.00 10.00 C ATOM 1428 C MET A 95 -4.015 -7.329 33.303 1.00 10.00 C ATOM 1429 O MET A 95 -3.714 -8.457 33.665 1.00 10.00 O ATOM 1430 CB MET A 95 -5.593 -6.294 34.971 1.00 10.00 C ATOM 1431 CG MET A 95 -5.832 -5.317 36.133 1.00 10.00 C ATOM 1432 SD MET A 95 -5.996 -3.556 35.708 1.00 10.00 S ATOM 1433 CE MET A 95 -7.573 -3.549 34.816 1.00 10.00 C ATOM 0 H MET A 95 -4.736 -4.270 33.824 1.00 10.00 H new ATOM 0 HA MET A 95 -3.451 -6.365 35.141 1.00 10.00 H new ATOM 0 HB2 MET A 95 -6.330 -6.099 34.192 1.00 10.00 H new ATOM 0 HB3 MET A 95 -5.766 -7.310 35.326 1.00 10.00 H new ATOM 0 HG2 MET A 95 -6.738 -5.626 36.655 1.00 10.00 H new ATOM 0 HG3 MET A 95 -5.007 -5.420 36.838 1.00 10.00 H new ATOM 0 HE1 MET A 95 -7.874 -2.520 34.618 1.00 10.00 H new ATOM 0 HE2 MET A 95 -7.459 -4.082 33.872 1.00 10.00 H new ATOM 0 HE3 MET A 95 -8.335 -4.040 35.421 1.00 10.00 H new ATOM 1443 N ALA A 96 -4.206 -7.018 32.018 1.00 10.00 N ATOM 1444 CA ALA A 96 -4.060 -7.968 30.927 1.00 10.00 C ATOM 1445 C ALA A 96 -2.640 -8.532 30.791 1.00 10.00 C ATOM 1446 O ALA A 96 -2.514 -9.637 30.274 1.00 10.00 O ATOM 1447 CB ALA A 96 -4.480 -7.284 29.619 1.00 10.00 C ATOM 0 H ALA A 96 -4.470 -6.083 31.708 1.00 10.00 H new ATOM 0 HA ALA A 96 -4.703 -8.820 31.149 1.00 10.00 H new ATOM 0 HB1 ALA A 96 -4.375 -7.986 28.792 1.00 10.00 H new ATOM 0 HB2 ALA A 96 -5.519 -6.963 29.694 1.00 10.00 H new ATOM 0 HB3 ALA A 96 -3.844 -6.417 29.442 1.00 10.00 H new ATOM 1453 N TYR A 97 -1.587 -7.793 31.172 1.00 10.00 N ATOM 1454 CA TYR A 97 -0.202 -8.241 30.989 1.00 10.00 C ATOM 1455 C TYR A 97 0.689 -7.736 32.125 1.00 10.00 C ATOM 1456 O TYR A 97 1.325 -8.531 32.808 1.00 10.00 O ATOM 1457 CB TYR A 97 0.371 -7.801 29.619 1.00 10.00 C ATOM 1458 CG TYR A 97 -0.598 -7.189 28.619 1.00 10.00 C ATOM 1459 CD1 TYR A 97 -1.289 -8.014 27.711 1.00 10.00 C ATOM 1460 CD2 TYR A 97 -0.806 -5.796 28.603 1.00 10.00 C ATOM 1461 CE1 TYR A 97 -2.164 -7.449 26.769 1.00 10.00 C ATOM 1462 CE2 TYR A 97 -1.681 -5.219 27.669 1.00 10.00 C ATOM 1463 CZ TYR A 97 -2.347 -6.049 26.739 1.00 10.00 C ATOM 1464 OH TYR A 97 -3.151 -5.505 25.793 1.00 10.00 O ATOM 0 H TYR A 97 -1.672 -6.876 31.612 1.00 10.00 H new ATOM 0 HA TYR A 97 -0.212 -9.331 31.009 1.00 10.00 H new ATOM 0 HB2 TYR A 97 1.166 -7.079 29.803 1.00 10.00 H new ATOM 0 HB3 TYR A 97 0.832 -8.671 29.152 1.00 10.00 H new ATOM 0 HD1 TYR A 97 -1.146 -9.084 27.739 1.00 10.00 H new ATOM 0 HD2 TYR A 97 -0.289 -5.168 29.314 1.00 10.00 H new ATOM 0 HE1 TYR A 97 -2.694 -8.081 26.072 1.00 10.00 H new ATOM 0 HE2 TYR A 97 -1.844 -4.151 27.661 1.00 10.00 H new ATOM 0 HH TYR A 97 -3.176 -4.532 25.905 1.00 10.00 H new ATOM 1474 N GLY A 98 0.726 -6.426 32.361 1.00 10.00 N ATOM 1475 CA GLY A 98 1.521 -5.800 33.408 1.00 10.00 C ATOM 1476 C GLY A 98 1.707 -4.308 33.121 1.00 10.00 C ATOM 1477 O GLY A 98 1.155 -3.807 32.133 1.00 10.00 O ATOM 0 H GLY A 98 0.188 -5.755 31.813 1.00 10.00 H new ATOM 0 HA2 GLY A 98 1.031 -5.932 34.373 1.00 10.00 H new ATOM 0 HA3 GLY A 98 2.494 -6.287 33.475 1.00 10.00 H new ATOM 1481 N PRO A 99 2.438 -3.575 33.973 1.00 10.00 N ATOM 1482 CA PRO A 99 2.798 -2.190 33.713 1.00 10.00 C ATOM 1483 C PRO A 99 3.707 -2.110 32.488 1.00 10.00 C ATOM 1484 O PRO A 99 4.680 -2.851 32.383 1.00 10.00 O ATOM 1485 CB PRO A 99 3.510 -1.694 34.977 1.00 10.00 C ATOM 1486 CG PRO A 99 4.014 -2.972 35.651 1.00 10.00 C ATOM 1487 CD PRO A 99 3.003 -4.036 35.231 1.00 10.00 C ATOM 0 HA PRO A 99 1.927 -1.572 33.497 1.00 10.00 H new ATOM 0 HB2 PRO A 99 4.333 -1.022 34.733 1.00 10.00 H new ATOM 0 HB3 PRO A 99 2.830 -1.143 35.627 1.00 10.00 H new ATOM 0 HG2 PRO A 99 5.021 -3.226 35.321 1.00 10.00 H new ATOM 0 HG3 PRO A 99 4.052 -2.863 36.735 1.00 10.00 H new ATOM 0 HD2 PRO A 99 3.485 -5.006 35.110 1.00 10.00 H new ATOM 0 HD3 PRO A 99 2.227 -4.157 35.987 1.00 10.00 H new ATOM 1495 N ALA A 100 3.419 -1.166 31.594 1.00 10.00 N ATOM 1496 CA ALA A 100 4.367 -0.769 30.570 1.00 10.00 C ATOM 1497 C ALA A 100 5.535 -0.010 31.210 1.00 10.00 C ATOM 1498 O ALA A 100 5.423 0.557 32.301 1.00 10.00 O ATOM 1499 CB ALA A 100 3.662 0.114 29.541 1.00 10.00 C ATOM 0 H ALA A 100 2.532 -0.664 31.563 1.00 10.00 H new ATOM 0 HA ALA A 100 4.758 -1.656 30.071 1.00 10.00 H new ATOM 0 HB1 ALA A 100 4.373 0.413 28.771 1.00 10.00 H new ATOM 0 HB2 ALA A 100 2.844 -0.442 29.084 1.00 10.00 H new ATOM 0 HB3 ALA A 100 3.266 1.002 30.034 1.00 10.00 H new ATOM 1505 N GLN A 101 6.643 0.096 30.479 1.00 10.00 N ATOM 1506 CA GLN A 101 7.750 0.966 30.845 1.00 10.00 C ATOM 1507 C GLN A 101 7.370 2.388 30.416 1.00 10.00 C ATOM 1508 O GLN A 101 7.842 2.892 29.402 1.00 10.00 O ATOM 1509 CB GLN A 101 9.058 0.448 30.223 1.00 10.00 C ATOM 1510 CG GLN A 101 9.487 -0.876 30.876 1.00 10.00 C ATOM 1511 CD GLN A 101 10.792 -1.407 30.291 1.00 10.00 C ATOM 1512 OE1 GLN A 101 10.795 -2.250 29.410 1.00 10.00 O ATOM 1513 NE2 GLN A 101 11.932 -0.934 30.774 1.00 10.00 N ATOM 0 H GLN A 101 6.795 -0.422 29.614 1.00 10.00 H new ATOM 0 HA GLN A 101 7.932 0.974 31.920 1.00 10.00 H new ATOM 0 HB2 GLN A 101 8.924 0.303 29.151 1.00 10.00 H new ATOM 0 HB3 GLN A 101 9.845 1.192 30.348 1.00 10.00 H new ATOM 0 HG2 GLN A 101 9.605 -0.729 31.950 1.00 10.00 H new ATOM 0 HG3 GLN A 101 8.701 -1.618 30.740 1.00 10.00 H new ATOM 0 HE21 GLN A 101 11.920 -0.229 31.511 1.00 10.00 H new ATOM 0 HE22 GLN A 101 12.821 -1.275 30.409 1.00 10.00 H new ATOM 1522 N HIS A 102 6.465 3.013 31.174 1.00 10.00 N ATOM 1523 CA HIS A 102 5.812 4.277 30.838 1.00 10.00 C ATOM 1524 C HIS A 102 6.770 5.388 30.389 1.00 10.00 C ATOM 1525 O HIS A 102 6.385 6.168 29.529 1.00 10.00 O ATOM 1526 CB HIS A 102 4.972 4.761 32.025 1.00 10.00 C ATOM 1527 CG HIS A 102 3.857 3.821 32.410 1.00 10.00 C ATOM 1528 ND1 HIS A 102 3.818 2.958 33.481 1.00 10.00 N ATOM 1529 CD2 HIS A 102 2.677 3.667 31.744 1.00 10.00 C ATOM 1530 CE1 HIS A 102 2.644 2.302 33.451 1.00 10.00 C ATOM 1531 NE2 HIS A 102 1.908 2.703 32.399 1.00 10.00 N ATOM 0 H HIS A 102 6.157 2.637 32.071 1.00 10.00 H new ATOM 0 HA HIS A 102 5.179 4.065 29.976 1.00 10.00 H new ATOM 0 HB2 HIS A 102 5.626 4.905 32.885 1.00 10.00 H new ATOM 0 HB3 HIS A 102 4.546 5.734 31.783 1.00 10.00 H new ATOM 0 HD1 HIS A 102 4.553 2.837 34.178 1.00 10.00 H new ATOM 0 HD2 HIS A 102 2.385 4.204 30.854 1.00 10.00 H new ATOM 0 HE1 HIS A 102 2.336 1.558 34.170 1.00 10.00 H new ATOM 1539 N ALA A 103 8.010 5.424 30.895 1.00 10.00 N ATOM 1540 CA ALA A 103 9.008 6.410 30.490 1.00 10.00 C ATOM 1541 C ALA A 103 9.285 6.376 28.982 1.00 10.00 C ATOM 1542 O ALA A 103 9.474 7.426 28.372 1.00 10.00 O ATOM 1543 CB ALA A 103 10.308 6.174 31.265 1.00 10.00 C ATOM 0 H ALA A 103 8.345 4.766 31.599 1.00 10.00 H new ATOM 0 HA ALA A 103 8.607 7.397 30.722 1.00 10.00 H new ATOM 0 HB1 ALA A 103 11.052 6.911 30.961 1.00 10.00 H new ATOM 0 HB2 ALA A 103 10.117 6.270 32.334 1.00 10.00 H new ATOM 0 HB3 ALA A 103 10.682 5.172 31.052 1.00 10.00 H new ATOM 1549 N ILE A 104 9.282 5.181 28.380 1.00 10.00 N ATOM 1550 CA ILE A 104 9.473 5.016 26.944 1.00 10.00 C ATOM 1551 C ILE A 104 8.293 5.710 26.253 1.00 10.00 C ATOM 1552 O ILE A 104 8.474 6.559 25.379 1.00 10.00 O ATOM 1553 CB ILE A 104 9.601 3.505 26.592 1.00 10.00 C ATOM 1554 CG1 ILE A 104 10.749 2.845 27.398 1.00 10.00 C ATOM 1555 CG2 ILE A 104 9.798 3.307 25.078 1.00 10.00 C ATOM 1556 CD1 ILE A 104 10.987 1.360 27.089 1.00 10.00 C ATOM 0 H ILE A 104 9.146 4.303 28.881 1.00 10.00 H new ATOM 0 HA ILE A 104 10.399 5.474 26.595 1.00 10.00 H new ATOM 0 HB ILE A 104 8.670 3.012 26.873 1.00 10.00 H new ATOM 0 HG12 ILE A 104 11.671 3.393 27.204 1.00 10.00 H new ATOM 0 HG13 ILE A 104 10.533 2.950 28.461 1.00 10.00 H new ATOM 0 HG21 ILE A 104 9.885 2.243 24.858 1.00 10.00 H new ATOM 0 HG22 ILE A 104 8.943 3.719 24.543 1.00 10.00 H new ATOM 0 HG23 ILE A 104 10.706 3.818 24.759 1.00 10.00 H new ATOM 0 HD11 ILE A 104 11.809 0.988 27.701 1.00 10.00 H new ATOM 0 HD12 ILE A 104 10.083 0.793 27.311 1.00 10.00 H new ATOM 0 HD13 ILE A 104 11.238 1.243 26.035 1.00 10.00 H new ATOM 1568 N SER A 105 7.070 5.365 26.661 1.00 10.00 N ATOM 1569 CA SER A 105 5.857 5.908 26.087 1.00 10.00 C ATOM 1570 C SER A 105 5.809 7.427 26.224 1.00 10.00 C ATOM 1571 O SER A 105 5.468 8.089 25.248 1.00 10.00 O ATOM 1572 CB SER A 105 4.632 5.266 26.747 1.00 10.00 C ATOM 1573 OG SER A 105 4.834 3.876 26.895 1.00 10.00 O ATOM 0 H SER A 105 6.902 4.692 27.409 1.00 10.00 H new ATOM 0 HA SER A 105 5.849 5.674 25.022 1.00 10.00 H new ATOM 0 HB2 SER A 105 4.453 5.721 27.721 1.00 10.00 H new ATOM 0 HB3 SER A 105 3.744 5.450 26.142 1.00 10.00 H new ATOM 0 HG SER A 105 4.059 3.479 27.344 1.00 10.00 H new ATOM 1579 N THR A 106 6.144 7.999 27.387 1.00 10.00 N ATOM 1580 CA THR A 106 6.006 9.434 27.580 1.00 10.00 C ATOM 1581 C THR A 106 6.945 10.217 26.671 1.00 10.00 C ATOM 1582 O THR A 106 6.527 11.244 26.146 1.00 10.00 O ATOM 1583 CB THR A 106 6.185 9.829 29.055 1.00 10.00 C ATOM 1584 OG1 THR A 106 7.347 9.286 29.649 1.00 10.00 O ATOM 1585 CG2 THR A 106 4.994 9.337 29.875 1.00 10.00 C ATOM 0 H THR A 106 6.507 7.492 28.194 1.00 10.00 H new ATOM 0 HA THR A 106 4.987 9.700 27.297 1.00 10.00 H new ATOM 0 HB THR A 106 6.269 10.916 29.058 1.00 10.00 H new ATOM 0 HG1 THR A 106 7.887 8.841 28.963 1.00 10.00 H new ATOM 0 HG21 THR A 106 5.129 9.621 30.919 1.00 10.00 H new ATOM 0 HG22 THR A 106 4.078 9.787 29.492 1.00 10.00 H new ATOM 0 HG23 THR A 106 4.924 8.252 29.800 1.00 10.00 H new ATOM 1593 N GLU A 107 8.183 9.765 26.453 1.00 10.00 N ATOM 1594 CA GLU A 107 9.095 10.467 25.546 1.00 10.00 C ATOM 1595 C GLU A 107 8.554 10.404 24.113 1.00 10.00 C ATOM 1596 O GLU A 107 8.581 11.398 23.390 1.00 10.00 O ATOM 1597 CB GLU A 107 10.496 9.840 25.606 1.00 10.00 C ATOM 1598 CG GLU A 107 11.241 10.088 26.933 1.00 10.00 C ATOM 1599 CD GLU A 107 11.730 11.542 27.094 1.00 10.00 C ATOM 1600 OE1 GLU A 107 12.718 11.909 26.427 1.00 10.00 O ATOM 1601 OE2 GLU A 107 11.062 12.342 27.801 1.00 10.00 O ATOM 0 H GLU A 107 8.573 8.928 26.886 1.00 10.00 H new ATOM 0 HA GLU A 107 9.166 11.509 25.857 1.00 10.00 H new ATOM 0 HB2 GLU A 107 10.408 8.765 25.446 1.00 10.00 H new ATOM 0 HB3 GLU A 107 11.095 10.236 24.786 1.00 10.00 H new ATOM 0 HG2 GLU A 107 10.581 9.839 27.764 1.00 10.00 H new ATOM 0 HG3 GLU A 107 12.097 9.415 26.993 1.00 10.00 H new ATOM 1608 N LYS A 108 8.011 9.251 23.712 1.00 10.00 N ATOM 1609 CA LYS A 108 7.474 9.048 22.367 1.00 10.00 C ATOM 1610 C LYS A 108 6.241 9.919 22.158 1.00 10.00 C ATOM 1611 O LYS A 108 6.152 10.605 21.145 1.00 10.00 O ATOM 1612 CB LYS A 108 7.168 7.554 22.169 1.00 10.00 C ATOM 1613 CG LYS A 108 8.470 6.742 22.054 1.00 10.00 C ATOM 1614 CD LYS A 108 8.248 5.232 22.213 1.00 10.00 C ATOM 1615 CE LYS A 108 7.548 4.549 21.033 1.00 10.00 C ATOM 1616 NZ LYS A 108 8.348 4.602 19.793 1.00 10.00 N ATOM 0 H LYS A 108 7.932 8.431 24.314 1.00 10.00 H new ATOM 0 HA LYS A 108 8.208 9.347 21.618 1.00 10.00 H new ATOM 0 HB2 LYS A 108 6.576 7.185 23.007 1.00 10.00 H new ATOM 0 HB3 LYS A 108 6.568 7.417 21.270 1.00 10.00 H new ATOM 0 HG2 LYS A 108 8.929 6.937 21.085 1.00 10.00 H new ATOM 0 HG3 LYS A 108 9.173 7.083 22.814 1.00 10.00 H new ATOM 0 HD2 LYS A 108 9.215 4.753 22.368 1.00 10.00 H new ATOM 0 HD3 LYS A 108 7.659 5.060 23.114 1.00 10.00 H new ATOM 0 HE2 LYS A 108 7.346 3.508 21.287 1.00 10.00 H new ATOM 0 HE3 LYS A 108 6.584 5.027 20.860 1.00 10.00 H new ATOM 0 HZ1 LYS A 108 8.019 3.866 19.136 1.00 10.00 H new ATOM 0 HZ2 LYS A 108 8.239 5.536 19.349 1.00 10.00 H new ATOM 0 HZ3 LYS A 108 9.350 4.442 20.019 1.00 10.00 H new ATOM 1630 N ILE A 109 5.309 9.948 23.112 1.00 10.00 N ATOM 1631 CA ILE A 109 4.153 10.838 23.085 1.00 10.00 C ATOM 1632 C ILE A 109 4.646 12.285 22.998 1.00 10.00 C ATOM 1633 O ILE A 109 4.123 13.040 22.185 1.00 10.00 O ATOM 1634 CB ILE A 109 3.248 10.580 24.317 1.00 10.00 C ATOM 1635 CG1 ILE A 109 2.638 9.156 24.294 1.00 10.00 C ATOM 1636 CG2 ILE A 109 2.089 11.589 24.421 1.00 10.00 C ATOM 1637 CD1 ILE A 109 2.100 8.710 25.663 1.00 10.00 C ATOM 0 H ILE A 109 5.339 9.345 23.934 1.00 10.00 H new ATOM 0 HA ILE A 109 3.537 10.642 22.207 1.00 10.00 H new ATOM 0 HB ILE A 109 3.903 10.694 25.181 1.00 10.00 H new ATOM 0 HG12 ILE A 109 1.829 9.125 23.564 1.00 10.00 H new ATOM 0 HG13 ILE A 109 3.396 8.448 23.959 1.00 10.00 H new ATOM 0 HG21 ILE A 109 1.487 11.362 25.301 1.00 10.00 H new ATOM 0 HG22 ILE A 109 2.492 12.598 24.507 1.00 10.00 H new ATOM 0 HG23 ILE A 109 1.467 11.522 23.529 1.00 10.00 H new ATOM 0 HD11 ILE A 109 1.686 7.705 25.581 1.00 10.00 H new ATOM 0 HD12 ILE A 109 2.912 8.710 26.391 1.00 10.00 H new ATOM 0 HD13 ILE A 109 1.320 9.398 25.989 1.00 10.00 H new ATOM 1649 N LYS A 110 5.645 12.683 23.796 1.00 10.00 N ATOM 1650 CA LYS A 110 6.171 14.050 23.796 1.00 10.00 C ATOM 1651 C LYS A 110 6.743 14.412 22.426 1.00 10.00 C ATOM 1652 O LYS A 110 6.492 15.510 21.943 1.00 10.00 O ATOM 1653 CB LYS A 110 7.205 14.189 24.925 1.00 10.00 C ATOM 1654 CG LYS A 110 7.698 15.632 25.124 1.00 10.00 C ATOM 1655 CD LYS A 110 8.412 15.826 26.475 1.00 10.00 C ATOM 1656 CE LYS A 110 9.539 14.798 26.669 1.00 10.00 C ATOM 1657 NZ LYS A 110 10.210 14.884 27.981 1.00 10.00 N ATOM 0 H LYS A 110 6.110 12.064 24.460 1.00 10.00 H new ATOM 0 HA LYS A 110 5.366 14.760 23.986 1.00 10.00 H new ATOM 0 HB2 LYS A 110 6.766 13.831 25.856 1.00 10.00 H new ATOM 0 HB3 LYS A 110 8.059 13.547 24.707 1.00 10.00 H new ATOM 0 HG2 LYS A 110 8.379 15.896 24.315 1.00 10.00 H new ATOM 0 HG3 LYS A 110 6.850 16.315 25.062 1.00 10.00 H new ATOM 0 HD2 LYS A 110 8.824 16.834 26.529 1.00 10.00 H new ATOM 0 HD3 LYS A 110 7.690 15.733 27.286 1.00 10.00 H new ATOM 0 HE2 LYS A 110 9.128 13.796 26.548 1.00 10.00 H new ATOM 0 HE3 LYS A 110 10.281 14.935 25.883 1.00 10.00 H new ATOM 0 HZ1 LYS A 110 10.628 13.962 28.218 1.00 10.00 H new ATOM 0 HZ2 LYS A 110 10.959 15.604 27.941 1.00 10.00 H new ATOM 0 HZ3 LYS A 110 9.516 15.147 28.709 1.00 10.00 H new ATOM 1671 N ALA A 111 7.470 13.499 21.775 1.00 10.00 N ATOM 1672 CA ALA A 111 7.953 13.701 20.417 1.00 10.00 C ATOM 1673 C ALA A 111 6.786 13.845 19.428 1.00 10.00 C ATOM 1674 O ALA A 111 6.840 14.674 18.523 1.00 10.00 O ATOM 1675 CB ALA A 111 8.872 12.539 20.016 1.00 10.00 C ATOM 0 H ALA A 111 7.737 12.601 22.179 1.00 10.00 H new ATOM 0 HA ALA A 111 8.523 14.629 20.384 1.00 10.00 H new ATOM 0 HB1 ALA A 111 9.232 12.694 18.999 1.00 10.00 H new ATOM 0 HB2 ALA A 111 9.721 12.494 20.698 1.00 10.00 H new ATOM 0 HB3 ALA A 111 8.317 11.602 20.066 1.00 10.00 H new ATOM 1681 N LYS A 112 5.713 13.061 19.579 1.00 10.00 N ATOM 1682 CA LYS A 112 4.544 13.155 18.707 1.00 10.00 C ATOM 1683 C LYS A 112 3.764 14.457 18.923 1.00 10.00 C ATOM 1684 O LYS A 112 3.163 14.928 17.947 1.00 10.00 O ATOM 1685 CB LYS A 112 3.653 11.915 18.910 1.00 10.00 C ATOM 1686 CG LYS A 112 2.457 11.809 17.941 1.00 10.00 C ATOM 1687 CD LYS A 112 2.817 11.513 16.471 1.00 10.00 C ATOM 1688 CE LYS A 112 3.194 12.720 15.589 1.00 10.00 C ATOM 1689 NZ LYS A 112 2.171 13.792 15.572 1.00 10.00 N ATOM 0 H LYS A 112 5.633 12.349 20.305 1.00 10.00 H new ATOM 0 HA LYS A 112 4.886 13.179 17.672 1.00 10.00 H new ATOM 0 HB2 LYS A 112 4.269 11.022 18.803 1.00 10.00 H new ATOM 0 HB3 LYS A 112 3.274 11.921 19.932 1.00 10.00 H new ATOM 0 HG2 LYS A 112 1.791 11.024 18.299 1.00 10.00 H new ATOM 0 HG3 LYS A 112 1.898 12.744 17.979 1.00 10.00 H new ATOM 0 HD2 LYS A 112 3.651 10.811 16.461 1.00 10.00 H new ATOM 0 HD3 LYS A 112 1.969 11.007 16.009 1.00 10.00 H new ATOM 0 HE2 LYS A 112 4.137 13.136 15.943 1.00 10.00 H new ATOM 0 HE3 LYS A 112 3.361 12.374 14.569 1.00 10.00 H new ATOM 0 HZ1 LYS A 112 2.256 14.339 14.692 1.00 10.00 H new ATOM 0 HZ2 LYS A 112 1.223 13.368 15.625 1.00 10.00 H new ATOM 0 HZ3 LYS A 112 2.315 14.422 16.387 1.00 10.00 H new ATOM 1786 N VAL A 118 4.465 15.874 28.972 1.00 10.00 N ATOM 1787 CA VAL A 118 4.038 14.506 29.223 1.00 10.00 C ATOM 1788 C VAL A 118 4.803 14.025 30.457 1.00 10.00 C ATOM 1789 O VAL A 118 6.001 14.279 30.570 1.00 10.00 O ATOM 1790 CB VAL A 118 4.292 13.609 27.991 1.00 10.00 C ATOM 1791 CG1 VAL A 118 3.512 12.295 28.126 1.00 10.00 C ATOM 1792 CG2 VAL A 118 3.908 14.265 26.654 1.00 10.00 C ATOM 0 HA VAL A 118 2.965 14.455 29.406 1.00 10.00 H new ATOM 0 HB VAL A 118 5.368 13.433 27.972 1.00 10.00 H new ATOM 0 HG11 VAL A 118 3.698 11.670 27.252 1.00 10.00 H new ATOM 0 HG12 VAL A 118 3.837 11.770 29.024 1.00 10.00 H new ATOM 0 HG13 VAL A 118 2.446 12.510 28.198 1.00 10.00 H new ATOM 0 HG21 VAL A 118 4.115 13.574 25.837 1.00 10.00 H new ATOM 0 HG22 VAL A 118 2.846 14.511 26.661 1.00 10.00 H new ATOM 0 HG23 VAL A 118 4.490 15.176 26.515 1.00 10.00 H new ATOM 1802 N THR A 119 4.124 13.335 31.374 1.00 10.00 N ATOM 1803 CA THR A 119 4.690 12.819 32.621 1.00 10.00 C ATOM 1804 C THR A 119 4.068 11.451 32.927 1.00 10.00 C ATOM 1805 O THR A 119 3.096 11.075 32.272 1.00 10.00 O ATOM 1806 CB THR A 119 4.439 13.842 33.753 1.00 10.00 C ATOM 1807 OG1 THR A 119 3.134 14.420 33.694 1.00 10.00 O ATOM 1808 CG2 THR A 119 5.452 14.988 33.721 1.00 10.00 C ATOM 0 H THR A 119 3.134 13.113 31.266 1.00 10.00 H new ATOM 0 HA THR A 119 5.768 12.681 32.531 1.00 10.00 H new ATOM 0 HB THR A 119 4.542 13.271 34.675 1.00 10.00 H new ATOM 0 HG1 THR A 119 2.495 13.833 34.149 1.00 10.00 H new ATOM 0 HG21 THR A 119 5.240 15.684 34.533 1.00 10.00 H new ATOM 0 HG22 THR A 119 6.459 14.587 33.840 1.00 10.00 H new ATOM 0 HG23 THR A 119 5.380 15.510 32.767 1.00 10.00 H new ATOM 1816 N TRP A 120 4.572 10.714 33.918 1.00 10.00 N ATOM 1817 CA TRP A 120 3.960 9.458 34.331 1.00 10.00 C ATOM 1818 C TRP A 120 4.097 9.242 35.831 1.00 10.00 C ATOM 1819 O TRP A 120 4.890 9.915 36.489 1.00 10.00 O ATOM 1820 CB TRP A 120 4.550 8.279 33.539 1.00 10.00 C ATOM 1821 CG TRP A 120 6.018 8.026 33.703 1.00 10.00 C ATOM 1822 CD1 TRP A 120 7.008 8.676 33.051 1.00 10.00 C ATOM 1823 CD2 TRP A 120 6.687 7.049 34.562 1.00 10.00 C ATOM 1824 NE1 TRP A 120 8.230 8.196 33.466 1.00 10.00 N ATOM 1825 CE2 TRP A 120 8.097 7.188 34.395 1.00 10.00 C ATOM 1826 CE3 TRP A 120 6.244 6.046 35.452 1.00 10.00 C ATOM 1827 CZ2 TRP A 120 9.020 6.391 35.090 1.00 10.00 C ATOM 1828 CZ3 TRP A 120 7.161 5.229 36.144 1.00 10.00 C ATOM 1829 CH2 TRP A 120 8.546 5.403 35.970 1.00 10.00 C ATOM 0 H TRP A 120 5.405 10.969 34.449 1.00 10.00 H new ATOM 0 HA TRP A 120 2.895 9.513 34.108 1.00 10.00 H new ATOM 0 HB2 TRP A 120 4.015 7.374 33.826 1.00 10.00 H new ATOM 0 HB3 TRP A 120 4.349 8.446 32.481 1.00 10.00 H new ATOM 0 HD1 TRP A 120 6.862 9.454 32.316 1.00 10.00 H new ATOM 0 HE1 TRP A 120 9.126 8.545 33.126 1.00 10.00 H new ATOM 0 HE3 TRP A 120 5.185 5.902 35.605 1.00 10.00 H new ATOM 0 HZ2 TRP A 120 10.081 6.535 34.950 1.00 10.00 H new ATOM 0 HZ3 TRP A 120 6.797 4.463 36.813 1.00 10.00 H new ATOM 0 HH2 TRP A 120 9.243 4.780 36.511 1.00 10.00 H new ATOM 1840 N ALA A 121 3.344 8.275 36.351 1.00 10.00 N ATOM 1841 CA ALA A 121 3.373 7.770 37.716 1.00 10.00 C ATOM 1842 C ALA A 121 3.031 6.273 37.679 1.00 10.00 C ATOM 1843 O ALA A 121 2.671 5.738 36.631 1.00 10.00 O ATOM 1844 CB ALA A 121 2.367 8.547 38.576 1.00 10.00 C ATOM 0 H ALA A 121 2.647 7.790 35.785 1.00 10.00 H new ATOM 0 HA ALA A 121 4.361 7.904 38.157 1.00 10.00 H new ATOM 0 HB1 ALA A 121 2.391 8.167 39.597 1.00 10.00 H new ATOM 0 HB2 ALA A 121 2.630 9.605 38.577 1.00 10.00 H new ATOM 0 HB3 ALA A 121 1.365 8.422 38.166 1.00 10.00 H new