USER MOD reduce.3.24.130724 H: found=0, std=0, add=1106, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1106 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 57 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 59 SER OG : rot 180:sc= 0.0277 USER MOD Set 2.1: A 52 THR OG1 : rot -42:sc= 1.52 USER MOD Set 2.2: A 55 GLN : amide:sc= 0.67 K(o=2.2,f=-3.1!) USER MOD Set 3.1: A 47 LYS NZ :NH3+ -148:sc= -0.128 (180deg=-1.27) USER MOD Set 3.2: A 51 LYS NZ :NH3+ -117:sc= -0.544 (180deg=-2.26!) USER MOD Set 4.1: A 27 THR OG1 : rot 73:sc= 0.294 USER MOD Set 4.2: A 30 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 5.1: A 9 GLN : amide:sc=-0.00201 K(o=-0.002,f=-1.3!) USER MOD Set 5.2: A 32 ASN : amide:sc= 0 K(o=-0.002,f=-0.75) USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 THR OG1 : rot -44:sc= 0.0133 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 GLN : amide:sc= -0.133 K(o=-0.13,f=-2.1!) USER MOD Single : A 31 MET CE :methyl -110:sc= -2.27 (180deg=-6.29!) USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 MET CE :methyl 169:sc= -3.1 (180deg=-3.93!) USER MOD Single : A 43 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ -137:sc= 0 (180deg=-0.375) USER MOD Single : A 45 LYS NZ :NH3+ -128:sc= 2.28 (180deg=-0.132) USER MOD Single : A 46 SER OG : rot 180:sc= -0.0761 USER MOD Single : A 53 ASN : amide:sc= 0 X(o=0,f=-0.48) USER MOD Single : A 54 LYS NZ :NH3+ 166:sc=-0.000619 (180deg=-0.0974) USER MOD Single : A 66 ASN :FLIP amide:sc= -0.173 F(o=-0.95,f=-0.17) USER MOD Single : A 72 MET CE :methyl -177:sc= -2.61 (180deg=-2.71) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 THR OG1 : rot -177:sc= 1.38 USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 THR OG1 : rot -170:sc= -1.53! USER MOD Single : A 92 MET CE :methyl -157:sc= -0.355 (180deg=-1.21) USER MOD Single : A 94 GLN : amide:sc= -3.21! C(o=-3.2!,f=-3.7!) USER MOD Single : A 100 SER OG : rot 150:sc= 0 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 CYS SG : rot 76:sc= -0.695 USER MOD Single : A 110 HIS : no HD1:sc= -0.0525 X(o=-0.052,f=-0.052) USER MOD Single : A 119 CYS SG : rot 133:sc= -2.25! USER MOD Single : A 123 THR OG1 : rot -27:sc= 0.41 USER MOD Single : A 125 TYR OH : rot 121:sc= -0.0253 USER MOD Single : A 126 TYR OH : rot -54:sc= -0.548 USER MOD ----------------------------------------------------------------- ATOM 44 N ILE A 4 8.305 -2.256 -2.839 1.00 2.45 N ATOM 45 CA ILE A 4 8.838 -2.748 -1.574 1.00 73.34 C ATOM 46 C ILE A 4 9.688 -3.996 -1.785 1.00 64.23 C ATOM 47 O ILE A 4 9.591 -4.659 -2.818 1.00 43.34 O ATOM 48 CB ILE A 4 7.710 -3.072 -0.576 1.00 62.04 C ATOM 49 CG1 ILE A 4 6.483 -3.608 -1.316 1.00 71.04 C ATOM 50 CG2 ILE A 4 7.349 -1.836 0.234 1.00 40.03 C ATOM 51 CD1 ILE A 4 6.757 -4.867 -2.109 1.00 22.13 C ATOM 0 HA ILE A 4 9.459 -1.953 -1.162 1.00 73.34 H new ATOM 0 HB ILE A 4 8.062 -3.842 0.110 1.00 62.04 H new ATOM 0 HG12 ILE A 4 5.692 -3.809 -0.593 1.00 71.04 H new ATOM 0 HG13 ILE A 4 6.110 -2.837 -1.991 1.00 71.04 H new ATOM 0 HG21 ILE A 4 6.551 -2.081 0.935 1.00 40.03 H new ATOM 0 HG22 ILE A 4 8.224 -1.494 0.786 1.00 40.03 H new ATOM 0 HG23 ILE A 4 7.013 -1.046 -0.438 1.00 40.03 H new ATOM 0 HD11 ILE A 4 5.843 -5.190 -2.607 1.00 22.13 H new ATOM 0 HD12 ILE A 4 7.526 -4.667 -2.856 1.00 22.13 H new ATOM 0 HD13 ILE A 4 7.101 -5.653 -1.437 1.00 22.13 H new ATOM 63 N ARG A 5 10.521 -4.312 -0.799 1.00 33.05 N ATOM 64 CA ARG A 5 11.388 -5.481 -0.876 1.00 23.25 C ATOM 65 C ARG A 5 10.617 -6.754 -0.536 1.00 44.51 C ATOM 66 O ARG A 5 9.453 -6.698 -0.140 1.00 31.23 O ATOM 67 CB ARG A 5 12.577 -5.324 0.074 1.00 3.12 C ATOM 68 CG ARG A 5 12.327 -5.890 1.462 1.00 22.42 C ATOM 69 CD ARG A 5 13.525 -5.679 2.374 1.00 3.24 C ATOM 70 NE ARG A 5 14.004 -4.300 2.338 1.00 2.40 N ATOM 71 CZ ARG A 5 13.438 -3.307 3.016 1.00 64.12 C ATOM 72 NH1 ARG A 5 12.379 -3.540 3.779 1.00 65.11 N ATOM 73 NH2 ARG A 5 13.932 -2.078 2.931 1.00 22.44 N ATOM 0 H ARG A 5 10.614 -3.774 0.063 1.00 33.05 H new ATOM 0 HA ARG A 5 11.756 -5.562 -1.899 1.00 23.25 H new ATOM 0 HB2 ARG A 5 13.446 -5.819 -0.360 1.00 3.12 H new ATOM 0 HB3 ARG A 5 12.824 -4.266 0.161 1.00 3.12 H new ATOM 0 HG2 ARG A 5 11.449 -5.414 1.897 1.00 22.42 H new ATOM 0 HG3 ARG A 5 12.108 -6.955 1.388 1.00 22.42 H new ATOM 0 HD2 ARG A 5 13.253 -5.942 3.396 1.00 3.24 H new ATOM 0 HD3 ARG A 5 14.330 -6.350 2.076 1.00 3.24 H new ATOM 0 HE ARG A 5 14.818 -4.087 1.761 1.00 2.40 H new ATOM 0 HH11 ARG A 5 11.997 -4.483 3.847 1.00 65.11 H new ATOM 0 HH12 ARG A 5 11.947 -2.776 4.298 1.00 65.11 H new ATOM 0 HH21 ARG A 5 14.747 -1.895 2.345 1.00 22.44 H new ATOM 0 HH22 ARG A 5 13.497 -1.316 3.452 1.00 22.44 H new ATOM 87 N ILE A 6 11.275 -7.897 -0.695 1.00 34.40 N ATOM 88 CA ILE A 6 10.651 -9.183 -0.405 1.00 2.41 C ATOM 89 C ILE A 6 11.417 -9.933 0.680 1.00 53.41 C ATOM 90 O ILE A 6 10.882 -10.838 1.319 1.00 34.33 O ATOM 91 CB ILE A 6 10.570 -10.066 -1.664 1.00 11.20 C ATOM 92 CG1 ILE A 6 11.861 -9.952 -2.477 1.00 71.33 C ATOM 93 CG2 ILE A 6 9.368 -9.673 -2.510 1.00 41.30 C ATOM 94 CD1 ILE A 6 11.859 -8.798 -3.456 1.00 23.55 C ATOM 0 H ILE A 6 12.239 -7.960 -1.023 1.00 34.40 H new ATOM 0 HA ILE A 6 9.641 -8.972 -0.054 1.00 2.41 H new ATOM 0 HB ILE A 6 10.448 -11.104 -1.355 1.00 11.20 H new ATOM 0 HG12 ILE A 6 12.702 -9.837 -1.794 1.00 71.33 H new ATOM 0 HG13 ILE A 6 12.020 -10.881 -3.024 1.00 71.33 H new ATOM 0 HG21 ILE A 6 9.324 -10.306 -3.396 1.00 41.30 H new ATOM 0 HG22 ILE A 6 8.456 -9.801 -1.927 1.00 41.30 H new ATOM 0 HG23 ILE A 6 9.462 -8.630 -2.813 1.00 41.30 H new ATOM 0 HD11 ILE A 6 12.805 -8.778 -3.997 1.00 23.55 H new ATOM 0 HD12 ILE A 6 11.039 -8.922 -4.163 1.00 23.55 H new ATOM 0 HD13 ILE A 6 11.732 -7.861 -2.914 1.00 23.55 H new ATOM 106 N VAL A 7 12.673 -9.548 0.884 1.00 53.13 N ATOM 107 CA VAL A 7 13.512 -10.182 1.894 1.00 40.44 C ATOM 108 C VAL A 7 14.588 -9.224 2.394 1.00 71.13 C ATOM 109 O VAL A 7 15.595 -8.980 1.728 1.00 32.25 O ATOM 110 CB VAL A 7 14.187 -11.453 1.345 1.00 35.24 C ATOM 111 CG1 VAL A 7 13.161 -12.559 1.148 1.00 20.12 C ATOM 112 CG2 VAL A 7 14.914 -11.151 0.044 1.00 20.11 C ATOM 0 H VAL A 7 13.132 -8.800 0.363 1.00 53.13 H new ATOM 0 HA VAL A 7 12.859 -10.455 2.723 1.00 40.44 H new ATOM 0 HB VAL A 7 14.922 -11.797 2.073 1.00 35.24 H new ATOM 0 HG11 VAL A 7 13.656 -13.449 0.760 1.00 20.12 H new ATOM 0 HG12 VAL A 7 12.690 -12.793 2.103 1.00 20.12 H new ATOM 0 HG13 VAL A 7 12.401 -12.228 0.440 1.00 20.12 H new ATOM 0 HG21 VAL A 7 15.385 -12.060 -0.329 1.00 20.11 H new ATOM 0 HG22 VAL A 7 14.201 -10.782 -0.694 1.00 20.11 H new ATOM 0 HG23 VAL A 7 15.678 -10.394 0.221 1.00 20.11 H new ATOM 122 N PRO A 8 14.373 -8.667 3.595 1.00 75.51 N ATOM 123 CA PRO A 8 15.313 -7.728 4.212 1.00 25.11 C ATOM 124 C PRO A 8 16.607 -8.407 4.649 1.00 1.45 C ATOM 125 O PRO A 8 16.606 -9.576 5.033 1.00 73.15 O ATOM 126 CB PRO A 8 14.546 -7.205 5.429 1.00 31.40 C ATOM 127 CG PRO A 8 13.574 -8.286 5.756 1.00 15.42 C ATOM 128 CD PRO A 8 13.194 -8.913 4.443 1.00 2.22 C ATOM 0 HA PRO A 8 15.622 -6.946 3.518 1.00 25.11 H new ATOM 0 HB2 PRO A 8 15.217 -7.009 6.266 1.00 31.40 H new ATOM 0 HB3 PRO A 8 14.036 -6.269 5.203 1.00 31.40 H new ATOM 0 HG2 PRO A 8 14.020 -9.022 6.425 1.00 15.42 H new ATOM 0 HG3 PRO A 8 12.698 -7.882 6.264 1.00 15.42 H new ATOM 0 HD2 PRO A 8 12.991 -9.979 4.550 1.00 2.22 H new ATOM 0 HD3 PRO A 8 12.296 -8.458 4.025 1.00 2.22 H new ATOM 136 N GLN A 9 17.708 -7.665 4.590 1.00 44.12 N ATOM 137 CA GLN A 9 19.009 -8.197 4.980 1.00 51.40 C ATOM 138 C GLN A 9 18.942 -8.841 6.360 1.00 35.35 C ATOM 139 O GLN A 9 17.965 -8.667 7.090 1.00 4.25 O ATOM 140 CB GLN A 9 20.060 -7.086 4.974 1.00 44.43 C ATOM 141 CG GLN A 9 19.683 -5.886 5.828 1.00 40.03 C ATOM 142 CD GLN A 9 20.614 -4.707 5.622 1.00 22.45 C ATOM 143 OE1 GLN A 9 21.373 -4.662 4.654 1.00 71.33 O ATOM 144 NE2 GLN A 9 20.561 -3.745 6.536 1.00 43.24 N ATOM 0 H GLN A 9 17.726 -6.695 4.276 1.00 44.12 H new ATOM 0 HA GLN A 9 19.293 -8.961 4.256 1.00 51.40 H new ATOM 0 HB2 GLN A 9 21.007 -7.491 5.330 1.00 44.43 H new ATOM 0 HB3 GLN A 9 20.221 -6.755 3.948 1.00 44.43 H new ATOM 0 HG2 GLN A 9 18.663 -5.584 5.593 1.00 40.03 H new ATOM 0 HG3 GLN A 9 19.696 -6.175 6.879 1.00 40.03 H new ATOM 0 HE21 GLN A 9 19.916 -3.824 7.323 1.00 43.24 H new ATOM 0 HE22 GLN A 9 21.165 -2.927 6.451 1.00 43.24 H new ATOM 153 N ILE A 10 19.984 -9.587 6.711 1.00 1.54 N ATOM 154 CA ILE A 10 20.043 -10.256 8.005 1.00 72.44 C ATOM 155 C ILE A 10 21.195 -9.723 8.848 1.00 3.55 C ATOM 156 O ILE A 10 22.319 -9.578 8.366 1.00 60.44 O ATOM 157 CB ILE A 10 20.203 -11.780 7.843 1.00 55.32 C ATOM 158 CG1 ILE A 10 21.563 -12.109 7.225 1.00 21.03 C ATOM 159 CG2 ILE A 10 19.077 -12.342 6.988 1.00 33.53 C ATOM 160 CD1 ILE A 10 21.735 -13.574 6.888 1.00 51.52 C ATOM 0 H ILE A 10 20.799 -9.743 6.118 1.00 1.54 H new ATOM 0 HA ILE A 10 19.100 -10.048 8.511 1.00 72.44 H new ATOM 0 HB ILE A 10 20.151 -12.243 8.828 1.00 55.32 H new ATOM 0 HG12 ILE A 10 21.694 -11.518 6.318 1.00 21.03 H new ATOM 0 HG13 ILE A 10 22.350 -11.809 7.917 1.00 21.03 H new ATOM 0 HG21 ILE A 10 19.203 -13.419 6.882 1.00 33.53 H new ATOM 0 HG22 ILE A 10 18.119 -12.134 7.465 1.00 33.53 H new ATOM 0 HG23 ILE A 10 19.100 -11.876 6.003 1.00 33.53 H new ATOM 0 HD11 ILE A 10 22.722 -13.734 6.454 1.00 51.52 H new ATOM 0 HD12 ILE A 10 21.637 -14.170 7.795 1.00 51.52 H new ATOM 0 HD13 ILE A 10 20.970 -13.875 6.172 1.00 51.52 H new ATOM 172 N THR A 11 20.910 -9.432 10.114 1.00 51.40 N ATOM 173 CA THR A 11 21.922 -8.914 11.026 1.00 31.42 C ATOM 174 C THR A 11 22.370 -9.985 12.014 1.00 21.14 C ATOM 175 O THR A 11 21.987 -11.149 11.899 1.00 63.43 O ATOM 176 CB THR A 11 21.401 -7.695 11.810 1.00 44.54 C ATOM 177 OG1 THR A 11 20.115 -7.307 11.315 1.00 73.22 O ATOM 178 CG2 THR A 11 22.368 -6.525 11.695 1.00 75.14 C ATOM 0 H THR A 11 19.986 -9.547 10.531 1.00 51.40 H new ATOM 0 HA THR A 11 22.771 -8.608 10.415 1.00 31.42 H new ATOM 0 HB THR A 11 21.316 -7.975 12.860 1.00 44.54 H new ATOM 0 HG1 THR A 11 19.790 -6.532 11.820 1.00 73.22 H new ATOM 0 HG21 THR A 11 21.979 -5.675 12.256 1.00 75.14 H new ATOM 0 HG22 THR A 11 23.338 -6.814 12.099 1.00 75.14 H new ATOM 0 HG23 THR A 11 22.480 -6.247 10.647 1.00 75.14 H new ATOM 186 N ASP A 12 23.182 -9.584 12.986 1.00 4.20 N ATOM 187 CA ASP A 12 23.681 -10.509 13.996 1.00 25.44 C ATOM 188 C ASP A 12 22.528 -11.185 14.732 1.00 41.22 C ATOM 189 O ASP A 12 22.696 -12.252 15.322 1.00 40.45 O ATOM 190 CB ASP A 12 24.578 -9.774 14.994 1.00 71.21 C ATOM 191 CG ASP A 12 25.962 -10.385 15.087 1.00 4.35 C ATOM 192 OD1 ASP A 12 26.071 -11.542 15.546 1.00 43.44 O ATOM 193 OD2 ASP A 12 26.937 -9.706 14.702 1.00 71.12 O ATOM 0 H ASP A 12 23.509 -8.624 13.096 1.00 4.20 H new ATOM 0 HA ASP A 12 24.266 -11.277 13.491 1.00 25.44 H new ATOM 0 HB2 ASP A 12 24.665 -8.728 14.699 1.00 71.21 H new ATOM 0 HB3 ASP A 12 24.110 -9.789 15.978 1.00 71.21 H new ATOM 198 N GLU A 13 21.358 -10.555 14.693 1.00 41.23 N ATOM 199 CA GLU A 13 20.178 -11.095 15.357 1.00 11.24 C ATOM 200 C GLU A 13 19.703 -12.372 14.670 1.00 53.40 C ATOM 201 O GLU A 13 19.126 -13.253 15.306 1.00 24.13 O ATOM 202 CB GLU A 13 19.052 -10.059 15.367 1.00 0.35 C ATOM 203 CG GLU A 13 19.492 -8.686 15.849 1.00 61.33 C ATOM 204 CD GLU A 13 18.345 -7.697 15.918 1.00 1.12 C ATOM 205 OE1 GLU A 13 17.231 -8.047 15.475 1.00 4.30 O ATOM 206 OE2 GLU A 13 18.562 -6.572 16.417 1.00 71.45 O ATOM 0 H GLU A 13 21.202 -9.671 14.209 1.00 41.23 H new ATOM 0 HA GLU A 13 20.450 -11.336 16.385 1.00 11.24 H new ATOM 0 HB2 GLU A 13 18.645 -9.968 14.360 1.00 0.35 H new ATOM 0 HB3 GLU A 13 18.245 -10.418 16.006 1.00 0.35 H new ATOM 0 HG2 GLU A 13 19.946 -8.780 16.836 1.00 61.33 H new ATOM 0 HG3 GLU A 13 20.261 -8.299 15.180 1.00 61.33 H new ATOM 213 N GLU A 14 19.949 -12.462 13.367 1.00 51.13 N ATOM 214 CA GLU A 14 19.545 -13.630 12.593 1.00 51.12 C ATOM 215 C GLU A 14 20.746 -14.519 12.282 1.00 52.51 C ATOM 216 O GLU A 14 20.695 -15.736 12.461 1.00 13.42 O ATOM 217 CB GLU A 14 18.866 -13.197 11.291 1.00 22.25 C ATOM 218 CG GLU A 14 17.666 -12.290 11.503 1.00 31.04 C ATOM 219 CD GLU A 14 16.604 -12.923 12.382 1.00 42.22 C ATOM 220 OE1 GLU A 14 15.731 -13.632 11.840 1.00 32.24 O ATOM 221 OE2 GLU A 14 16.647 -12.708 13.611 1.00 24.45 O ATOM 0 H GLU A 14 20.426 -11.741 12.825 1.00 51.13 H new ATOM 0 HA GLU A 14 18.836 -14.203 13.191 1.00 51.12 H new ATOM 0 HB2 GLU A 14 19.594 -12.681 10.665 1.00 22.25 H new ATOM 0 HB3 GLU A 14 18.548 -14.085 10.744 1.00 22.25 H new ATOM 0 HG2 GLU A 14 17.997 -11.355 11.956 1.00 31.04 H new ATOM 0 HG3 GLU A 14 17.230 -12.039 10.536 1.00 31.04 H new ATOM 228 N PHE A 15 21.826 -13.901 11.814 1.00 32.33 N ATOM 229 CA PHE A 15 23.040 -14.635 11.476 1.00 33.35 C ATOM 230 C PHE A 15 23.493 -15.504 12.646 1.00 22.11 C ATOM 231 O PHE A 15 24.049 -16.585 12.453 1.00 61.54 O ATOM 232 CB PHE A 15 24.156 -13.665 11.085 1.00 53.43 C ATOM 233 CG PHE A 15 25.516 -14.301 11.040 1.00 15.15 C ATOM 234 CD1 PHE A 15 26.277 -14.420 12.192 1.00 43.43 C ATOM 235 CD2 PHE A 15 26.032 -14.780 9.847 1.00 2.14 C ATOM 236 CE1 PHE A 15 27.529 -15.005 12.155 1.00 51.05 C ATOM 237 CE2 PHE A 15 27.283 -15.367 9.804 1.00 11.52 C ATOM 238 CZ PHE A 15 28.033 -15.478 10.959 1.00 74.12 C ATOM 0 H PHE A 15 21.885 -12.894 11.660 1.00 32.33 H new ATOM 0 HA PHE A 15 22.819 -15.283 10.628 1.00 33.35 H new ATOM 0 HB2 PHE A 15 23.930 -13.240 10.107 1.00 53.43 H new ATOM 0 HB3 PHE A 15 24.174 -12.839 11.796 1.00 53.43 H new ATOM 0 HD1 PHE A 15 25.887 -14.051 13.129 1.00 43.43 H new ATOM 0 HD2 PHE A 15 25.451 -14.694 8.941 1.00 2.14 H new ATOM 0 HE1 PHE A 15 28.112 -15.092 13.060 1.00 51.05 H new ATOM 0 HE2 PHE A 15 27.674 -15.739 8.868 1.00 11.52 H new ATOM 0 HZ PHE A 15 29.012 -15.934 10.927 1.00 74.12 H new ATOM 248 N LYS A 16 23.252 -15.023 13.861 1.00 44.21 N ATOM 249 CA LYS A 16 23.634 -15.754 15.063 1.00 3.55 C ATOM 250 C LYS A 16 22.975 -17.129 15.097 1.00 12.51 C ATOM 251 O LYS A 16 23.444 -18.038 15.783 1.00 41.43 O ATOM 252 CB LYS A 16 23.246 -14.959 16.313 1.00 60.34 C ATOM 253 CG LYS A 16 21.751 -14.728 16.446 1.00 72.00 C ATOM 254 CD LYS A 16 21.104 -15.767 17.346 1.00 31.31 C ATOM 255 CE LYS A 16 21.091 -15.316 18.799 1.00 71.04 C ATOM 256 NZ LYS A 16 19.809 -15.658 19.474 1.00 33.22 N ATOM 0 H LYS A 16 22.794 -14.129 14.039 1.00 44.21 H new ATOM 0 HA LYS A 16 24.715 -15.890 15.047 1.00 3.55 H new ATOM 0 HB2 LYS A 16 23.603 -15.489 17.196 1.00 60.34 H new ATOM 0 HB3 LYS A 16 23.754 -13.995 16.292 1.00 60.34 H new ATOM 0 HG2 LYS A 16 21.570 -13.732 16.850 1.00 72.00 H new ATOM 0 HG3 LYS A 16 21.288 -14.760 15.460 1.00 72.00 H new ATOM 0 HD2 LYS A 16 20.083 -15.953 17.013 1.00 31.31 H new ATOM 0 HD3 LYS A 16 21.644 -16.710 17.262 1.00 31.31 H new ATOM 0 HE2 LYS A 16 21.918 -15.784 19.332 1.00 71.04 H new ATOM 0 HE3 LYS A 16 21.250 -14.239 18.846 1.00 71.04 H new ATOM 0 HZ1 LYS A 16 19.840 -15.334 20.462 1.00 33.22 H new ATOM 0 HZ2 LYS A 16 19.022 -15.191 18.981 1.00 33.22 H new ATOM 0 HZ3 LYS A 16 19.669 -16.688 19.452 1.00 33.22 H new ATOM 270 N THR A 17 21.884 -17.275 14.351 1.00 21.31 N ATOM 271 CA THR A 17 21.161 -18.539 14.295 1.00 34.25 C ATOM 272 C THR A 17 21.884 -19.548 13.411 1.00 20.31 C ATOM 273 O THR A 17 21.493 -20.713 13.335 1.00 71.41 O ATOM 274 CB THR A 17 19.728 -18.343 13.765 1.00 33.43 C ATOM 275 OG1 THR A 17 18.883 -19.399 14.236 1.00 34.22 O ATOM 276 CG2 THR A 17 19.713 -18.315 12.244 1.00 14.04 C ATOM 0 H THR A 17 21.482 -16.533 13.778 1.00 21.31 H new ATOM 0 HA THR A 17 21.115 -18.922 15.315 1.00 34.25 H new ATOM 0 HB THR A 17 19.355 -17.388 14.134 1.00 33.43 H new ATOM 0 HG1 THR A 17 19.350 -20.256 14.148 1.00 34.22 H new ATOM 0 HG21 THR A 17 18.691 -18.176 11.893 1.00 14.04 H new ATOM 0 HG22 THR A 17 20.334 -17.492 11.889 1.00 14.04 H new ATOM 0 HG23 THR A 17 20.104 -19.257 11.859 1.00 14.04 H new ATOM 284 N ILE A 18 22.940 -19.094 12.745 1.00 24.22 N ATOM 285 CA ILE A 18 23.719 -19.959 11.868 1.00 41.15 C ATOM 286 C ILE A 18 25.170 -20.048 12.329 1.00 13.13 C ATOM 287 O ILE A 18 26.007 -19.210 11.994 1.00 54.53 O ATOM 288 CB ILE A 18 23.686 -19.460 10.411 1.00 55.31 C ATOM 289 CG1 ILE A 18 22.242 -19.221 9.964 1.00 51.40 C ATOM 290 CG2 ILE A 18 24.371 -20.460 9.492 1.00 4.13 C ATOM 291 CD1 ILE A 18 21.966 -17.792 9.550 1.00 2.14 C ATOM 0 H ILE A 18 23.276 -18.132 12.796 1.00 24.22 H new ATOM 0 HA ILE A 18 23.264 -20.948 11.916 1.00 41.15 H new ATOM 0 HB ILE A 18 24.226 -18.515 10.354 1.00 55.31 H new ATOM 0 HG12 ILE A 18 22.015 -19.883 9.129 1.00 51.40 H new ATOM 0 HG13 ILE A 18 21.569 -19.491 10.778 1.00 51.40 H new ATOM 0 HG21 ILE A 18 24.339 -20.093 8.466 1.00 4.13 H new ATOM 0 HG22 ILE A 18 25.409 -20.586 9.800 1.00 4.13 H new ATOM 0 HG23 ILE A 18 23.856 -21.419 9.550 1.00 4.13 H new ATOM 0 HD11 ILE A 18 20.924 -17.696 9.246 1.00 2.14 H new ATOM 0 HD12 ILE A 18 22.161 -17.126 10.390 1.00 2.14 H new ATOM 0 HD13 ILE A 18 22.614 -17.523 8.716 1.00 2.14 H new ATOM 303 N PRO A 19 25.477 -21.089 13.117 1.00 62.32 N ATOM 304 CA PRO A 19 26.828 -21.315 13.640 1.00 51.42 C ATOM 305 C PRO A 19 27.811 -21.724 12.549 1.00 43.34 C ATOM 306 O PRO A 19 27.411 -22.094 11.445 1.00 43.25 O ATOM 307 CB PRO A 19 26.635 -22.456 14.641 1.00 72.20 C ATOM 308 CG PRO A 19 25.420 -23.175 14.166 1.00 73.43 C ATOM 309 CD PRO A 19 24.530 -22.127 13.557 1.00 71.33 C ATOM 0 HA PRO A 19 27.251 -20.412 14.079 1.00 51.42 H new ATOM 0 HB2 PRO A 19 27.503 -23.116 14.662 1.00 72.20 H new ATOM 0 HB3 PRO A 19 26.500 -22.076 15.653 1.00 72.20 H new ATOM 0 HG2 PRO A 19 25.680 -23.939 13.434 1.00 73.43 H new ATOM 0 HG3 PRO A 19 24.919 -23.681 14.991 1.00 73.43 H new ATOM 0 HD2 PRO A 19 23.954 -22.525 12.722 1.00 71.33 H new ATOM 0 HD3 PRO A 19 23.814 -21.737 14.281 1.00 71.33 H new ATOM 317 N LYS A 20 29.100 -21.655 12.864 1.00 22.31 N ATOM 318 CA LYS A 20 30.142 -22.020 11.912 1.00 61.24 C ATOM 319 C LYS A 20 29.885 -23.406 11.328 1.00 11.13 C ATOM 320 O LYS A 20 30.344 -23.723 10.231 1.00 52.13 O ATOM 321 CB LYS A 20 31.515 -21.986 12.588 1.00 75.42 C ATOM 322 CG LYS A 20 31.848 -20.647 13.222 1.00 55.14 C ATOM 323 CD LYS A 20 32.563 -19.730 12.244 1.00 41.11 C ATOM 324 CE LYS A 20 34.014 -20.144 12.051 1.00 73.45 C ATOM 325 NZ LYS A 20 34.583 -19.597 10.788 1.00 22.40 N ATOM 0 H LYS A 20 29.448 -21.349 13.773 1.00 22.31 H new ATOM 0 HA LYS A 20 30.126 -21.294 11.099 1.00 61.24 H new ATOM 0 HB2 LYS A 20 31.553 -22.761 13.354 1.00 75.42 H new ATOM 0 HB3 LYS A 20 32.280 -22.230 11.851 1.00 75.42 H new ATOM 0 HG2 LYS A 20 30.931 -20.169 13.567 1.00 55.14 H new ATOM 0 HG3 LYS A 20 32.475 -20.805 14.099 1.00 55.14 H new ATOM 0 HD2 LYS A 20 32.048 -19.748 11.284 1.00 41.11 H new ATOM 0 HD3 LYS A 20 32.522 -18.704 12.609 1.00 41.11 H new ATOM 0 HE2 LYS A 20 34.607 -19.796 12.897 1.00 73.45 H new ATOM 0 HE3 LYS A 20 34.083 -21.232 12.039 1.00 73.45 H new ATOM 0 HZ1 LYS A 20 35.573 -19.901 10.693 1.00 22.40 H new ATOM 0 HZ2 LYS A 20 34.033 -19.949 9.978 1.00 22.40 H new ATOM 0 HZ3 LYS A 20 34.541 -18.558 10.810 1.00 22.40 H new ATOM 339 N TYR A 21 29.148 -24.227 12.068 1.00 0.34 N ATOM 340 CA TYR A 21 28.831 -25.579 11.625 1.00 53.14 C ATOM 341 C TYR A 21 28.033 -25.552 10.324 1.00 30.45 C ATOM 342 O TYR A 21 28.010 -26.531 9.578 1.00 11.15 O ATOM 343 CB TYR A 21 28.042 -26.321 12.705 1.00 50.20 C ATOM 344 CG TYR A 21 28.685 -26.262 14.072 1.00 11.22 C ATOM 345 CD1 TYR A 21 30.020 -26.601 14.249 1.00 5.10 C ATOM 346 CD2 TYR A 21 27.956 -25.866 15.187 1.00 4.43 C ATOM 347 CE1 TYR A 21 30.611 -26.549 15.497 1.00 65.15 C ATOM 348 CE2 TYR A 21 28.540 -25.809 16.438 1.00 34.44 C ATOM 349 CZ TYR A 21 29.867 -26.153 16.588 1.00 41.40 C ATOM 350 OH TYR A 21 30.453 -26.098 17.832 1.00 34.31 O ATOM 0 H TYR A 21 28.759 -23.979 12.978 1.00 0.34 H new ATOM 0 HA TYR A 21 29.769 -26.104 11.445 1.00 53.14 H new ATOM 0 HB2 TYR A 21 27.039 -25.898 12.766 1.00 50.20 H new ATOM 0 HB3 TYR A 21 27.931 -27.364 12.410 1.00 50.20 H new ATOM 0 HD1 TYR A 21 30.606 -26.911 13.397 1.00 5.10 H new ATOM 0 HD2 TYR A 21 26.916 -25.598 15.074 1.00 4.43 H new ATOM 0 HE1 TYR A 21 31.650 -26.817 15.617 1.00 65.15 H new ATOM 0 HE2 TYR A 21 27.960 -25.497 17.294 1.00 34.44 H new ATOM 0 HH TYR A 21 29.793 -25.799 18.492 1.00 34.31 H new ATOM 360 N GLN A 22 27.381 -24.425 10.061 1.00 51.32 N ATOM 361 CA GLN A 22 26.582 -24.270 8.851 1.00 13.21 C ATOM 362 C GLN A 22 27.169 -23.193 7.945 1.00 64.45 C ATOM 363 O GLN A 22 27.071 -23.277 6.720 1.00 41.15 O ATOM 364 CB GLN A 22 25.137 -23.918 9.210 1.00 1.25 C ATOM 365 CG GLN A 22 24.496 -24.895 10.182 1.00 25.54 C ATOM 366 CD GLN A 22 23.817 -26.055 9.481 1.00 55.31 C ATOM 367 OE1 GLN A 22 23.438 -25.953 8.313 1.00 23.34 O ATOM 368 NE2 GLN A 22 23.658 -27.166 10.191 1.00 55.42 N ATOM 0 H GLN A 22 27.390 -23.606 10.669 1.00 51.32 H new ATOM 0 HA GLN A 22 26.595 -25.218 8.314 1.00 13.21 H new ATOM 0 HB2 GLN A 22 25.112 -22.918 9.644 1.00 1.25 H new ATOM 0 HB3 GLN A 22 24.543 -23.884 8.297 1.00 1.25 H new ATOM 0 HG2 GLN A 22 25.258 -25.281 10.859 1.00 25.54 H new ATOM 0 HG3 GLN A 22 23.765 -24.366 10.793 1.00 25.54 H new ATOM 0 HE21 GLN A 22 23.987 -27.206 11.156 1.00 55.42 H new ATOM 0 HE22 GLN A 22 23.207 -27.979 9.772 1.00 55.42 H new ATOM 377 N LEU A 23 27.780 -22.183 8.553 1.00 10.14 N ATOM 378 CA LEU A 23 28.384 -21.089 7.801 1.00 11.40 C ATOM 379 C LEU A 23 29.493 -21.602 6.888 1.00 33.32 C ATOM 380 O LEU A 23 29.448 -21.414 5.673 1.00 35.22 O ATOM 381 CB LEU A 23 28.943 -20.033 8.757 1.00 33.52 C ATOM 382 CG LEU A 23 27.945 -19.428 9.745 1.00 3.33 C ATOM 383 CD1 LEU A 23 28.668 -18.585 10.785 1.00 64.51 C ATOM 384 CD2 LEU A 23 26.906 -18.594 9.010 1.00 33.23 C ATOM 0 H LEU A 23 27.870 -22.099 9.565 1.00 10.14 H new ATOM 0 HA LEU A 23 27.609 -20.636 7.182 1.00 11.40 H new ATOM 0 HB2 LEU A 23 29.759 -20.481 9.324 1.00 33.52 H new ATOM 0 HB3 LEU A 23 29.372 -19.225 8.164 1.00 33.52 H new ATOM 0 HG LEU A 23 27.432 -20.242 10.258 1.00 3.33 H new ATOM 0 HD11 LEU A 23 27.942 -18.162 11.480 1.00 64.51 H new ATOM 0 HD12 LEU A 23 29.374 -19.209 11.333 1.00 64.51 H new ATOM 0 HD13 LEU A 23 29.207 -17.778 10.289 1.00 64.51 H new ATOM 0 HD21 LEU A 23 26.204 -18.171 9.729 1.00 33.23 H new ATOM 0 HD22 LEU A 23 27.402 -17.788 8.470 1.00 33.23 H new ATOM 0 HD23 LEU A 23 26.366 -19.225 8.304 1.00 33.23 H new ATOM 396 N GLY A 24 30.488 -22.254 7.483 1.00 75.23 N ATOM 397 CA GLY A 24 31.593 -22.787 6.708 1.00 51.01 C ATOM 398 C GLY A 24 32.395 -21.701 6.019 1.00 53.31 C ATOM 399 O GLY A 24 32.256 -21.487 4.815 1.00 52.45 O ATOM 0 H GLY A 24 30.548 -22.422 8.487 1.00 75.23 H new ATOM 0 HA2 GLY A 24 32.250 -23.359 7.363 1.00 51.01 H new ATOM 0 HA3 GLY A 24 31.207 -23.480 5.960 1.00 51.01 H new ATOM 403 N ARG A 25 33.235 -21.012 6.784 1.00 11.12 N ATOM 404 CA ARG A 25 34.060 -19.940 6.240 1.00 12.34 C ATOM 405 C ARG A 25 33.200 -18.751 5.823 1.00 53.52 C ATOM 406 O ARG A 25 33.671 -17.839 5.141 1.00 15.13 O ATOM 407 CB ARG A 25 34.866 -20.445 5.043 1.00 61.23 C ATOM 408 CG ARG A 25 36.237 -19.800 4.915 1.00 34.43 C ATOM 409 CD ARG A 25 37.275 -20.793 4.415 1.00 53.42 C ATOM 410 NE ARG A 25 36.997 -21.233 3.050 1.00 24.23 N ATOM 411 CZ ARG A 25 37.716 -22.151 2.414 1.00 24.31 C ATOM 412 NH1 ARG A 25 38.750 -22.723 3.016 1.00 31.23 N ATOM 413 NH2 ARG A 25 37.402 -22.500 1.173 1.00 15.50 N ATOM 0 H ARG A 25 33.362 -21.177 7.782 1.00 11.12 H new ATOM 0 HA ARG A 25 34.748 -19.613 7.020 1.00 12.34 H new ATOM 0 HB2 ARG A 25 34.988 -21.525 5.128 1.00 61.23 H new ATOM 0 HB3 ARG A 25 34.300 -20.259 4.130 1.00 61.23 H new ATOM 0 HG2 ARG A 25 36.180 -18.955 4.229 1.00 34.43 H new ATOM 0 HG3 ARG A 25 36.546 -19.405 5.883 1.00 34.43 H new ATOM 0 HD2 ARG A 25 38.263 -20.335 4.454 1.00 53.42 H new ATOM 0 HD3 ARG A 25 37.298 -21.658 5.077 1.00 53.42 H new ATOM 0 HE ARG A 25 36.208 -20.813 2.559 1.00 24.23 H new ATOM 0 HH11 ARG A 25 38.995 -22.458 3.970 1.00 31.23 H new ATOM 0 HH12 ARG A 25 39.300 -23.428 2.525 1.00 31.23 H new ATOM 0 HH21 ARG A 25 36.607 -22.063 0.706 1.00 15.50 H new ATOM 0 HH22 ARG A 25 37.955 -23.205 0.686 1.00 15.50 H new ATOM 427 N LEU A 26 31.937 -18.767 6.235 1.00 0.43 N ATOM 428 CA LEU A 26 31.010 -17.690 5.904 1.00 41.11 C ATOM 429 C LEU A 26 31.013 -16.617 6.988 1.00 55.44 C ATOM 430 O LEU A 26 31.620 -16.787 8.045 1.00 22.22 O ATOM 431 CB LEU A 26 29.596 -18.245 5.723 1.00 23.11 C ATOM 432 CG LEU A 26 29.124 -18.422 4.280 1.00 41.04 C ATOM 433 CD1 LEU A 26 27.958 -19.396 4.215 1.00 54.50 C ATOM 434 CD2 LEU A 26 28.735 -17.080 3.678 1.00 51.35 C ATOM 0 H LEU A 26 31.531 -19.514 6.799 1.00 0.43 H new ATOM 0 HA LEU A 26 31.338 -17.236 4.969 1.00 41.11 H new ATOM 0 HB2 LEU A 26 29.540 -19.212 6.224 1.00 23.11 H new ATOM 0 HB3 LEU A 26 28.899 -17.581 6.233 1.00 23.11 H new ATOM 0 HG LEU A 26 29.947 -18.834 3.697 1.00 41.04 H new ATOM 0 HD11 LEU A 26 27.636 -19.509 3.180 1.00 54.50 H new ATOM 0 HD12 LEU A 26 28.271 -20.364 4.606 1.00 54.50 H new ATOM 0 HD13 LEU A 26 27.131 -19.014 4.813 1.00 54.50 H new ATOM 0 HD21 LEU A 26 28.402 -17.225 2.650 1.00 51.35 H new ATOM 0 HD22 LEU A 26 27.928 -16.639 4.263 1.00 51.35 H new ATOM 0 HD23 LEU A 26 29.597 -16.413 3.689 1.00 51.35 H new ATOM 446 N THR A 27 30.327 -15.510 6.719 1.00 50.33 N ATOM 447 CA THR A 27 30.249 -14.409 7.671 1.00 51.25 C ATOM 448 C THR A 27 29.010 -13.556 7.424 1.00 11.30 C ATOM 449 O THR A 27 28.395 -13.629 6.359 1.00 35.25 O ATOM 450 CB THR A 27 31.499 -13.512 7.596 1.00 50.11 C ATOM 451 OG1 THR A 27 32.010 -13.494 6.258 1.00 23.55 O ATOM 452 CG2 THR A 27 32.576 -14.005 8.550 1.00 45.02 C ATOM 0 H THR A 27 29.818 -15.353 5.849 1.00 50.33 H new ATOM 0 HA THR A 27 30.189 -14.854 8.664 1.00 51.25 H new ATOM 0 HB THR A 27 31.213 -12.502 7.888 1.00 50.11 H new ATOM 0 HG1 THR A 27 31.421 -12.955 5.690 1.00 23.55 H new ATOM 0 HG21 THR A 27 33.449 -13.356 8.480 1.00 45.02 H new ATOM 0 HG22 THR A 27 32.193 -13.989 9.570 1.00 45.02 H new ATOM 0 HG23 THR A 27 32.859 -15.024 8.285 1.00 45.02 H new ATOM 460 N LEU A 28 28.649 -12.746 8.413 1.00 14.02 N ATOM 461 CA LEU A 28 27.482 -11.877 8.303 1.00 0.13 C ATOM 462 C LEU A 28 27.568 -11.005 7.055 1.00 45.30 C ATOM 463 O LEU A 28 26.576 -10.809 6.354 1.00 44.50 O ATOM 464 CB LEU A 28 27.359 -10.996 9.548 1.00 51.34 C ATOM 465 CG LEU A 28 25.969 -10.919 10.181 1.00 43.11 C ATOM 466 CD1 LEU A 28 26.074 -10.909 11.698 1.00 32.10 C ATOM 467 CD2 LEU A 28 25.226 -9.686 9.688 1.00 72.23 C ATOM 0 H LEU A 28 29.147 -12.673 9.300 1.00 14.02 H new ATOM 0 HA LEU A 28 26.596 -12.507 8.222 1.00 0.13 H new ATOM 0 HB2 LEU A 28 28.058 -11.363 10.299 1.00 51.34 H new ATOM 0 HB3 LEU A 28 27.674 -9.986 9.286 1.00 51.34 H new ATOM 0 HG LEU A 28 25.405 -11.802 9.882 1.00 43.11 H new ATOM 0 HD11 LEU A 28 25.075 -10.854 12.131 1.00 32.10 H new ATOM 0 HD12 LEU A 28 26.566 -11.822 12.035 1.00 32.10 H new ATOM 0 HD13 LEU A 28 26.656 -10.044 12.017 1.00 32.10 H new ATOM 0 HD21 LEU A 28 24.239 -9.648 10.149 1.00 72.23 H new ATOM 0 HD22 LEU A 28 25.787 -8.791 9.957 1.00 72.23 H new ATOM 0 HD23 LEU A 28 25.119 -9.735 8.604 1.00 72.23 H new ATOM 479 N GLU A 29 28.762 -10.486 6.783 1.00 11.12 N ATOM 480 CA GLU A 29 28.977 -9.636 5.618 1.00 2.11 C ATOM 481 C GLU A 29 28.666 -10.391 4.329 1.00 45.11 C ATOM 482 O GLU A 29 28.111 -9.828 3.386 1.00 44.31 O ATOM 483 CB GLU A 29 30.420 -9.128 5.589 1.00 2.14 C ATOM 484 CG GLU A 29 30.751 -8.305 4.356 1.00 65.35 C ATOM 485 CD GLU A 29 31.166 -6.886 4.694 1.00 34.52 C ATOM 486 OE1 GLU A 29 30.367 -6.171 5.334 1.00 74.31 O ATOM 487 OE2 GLU A 29 32.290 -6.492 4.319 1.00 14.32 O ATOM 0 H GLU A 29 29.594 -10.639 7.353 1.00 11.12 H new ATOM 0 HA GLU A 29 28.301 -8.784 5.692 1.00 2.11 H new ATOM 0 HB2 GLU A 29 30.602 -8.524 6.478 1.00 2.14 H new ATOM 0 HB3 GLU A 29 31.097 -9.980 5.639 1.00 2.14 H new ATOM 0 HG2 GLU A 29 31.554 -8.792 3.804 1.00 65.35 H new ATOM 0 HG3 GLU A 29 29.882 -8.278 3.698 1.00 65.35 H new ATOM 494 N MET A 30 29.029 -11.669 4.297 1.00 44.05 N ATOM 495 CA MET A 30 28.789 -12.502 3.124 1.00 40.23 C ATOM 496 C MET A 30 27.295 -12.627 2.843 1.00 50.33 C ATOM 497 O MET A 30 26.853 -12.466 1.706 1.00 54.03 O ATOM 498 CB MET A 30 29.400 -13.890 3.324 1.00 61.04 C ATOM 499 CG MET A 30 30.784 -14.038 2.713 1.00 61.54 C ATOM 500 SD MET A 30 31.927 -12.756 3.261 1.00 54.22 S ATOM 501 CE MET A 30 33.474 -13.657 3.258 1.00 23.32 C ATOM 0 H MET A 30 29.490 -12.150 5.069 1.00 44.05 H new ATOM 0 HA MET A 30 29.263 -12.024 2.267 1.00 40.23 H new ATOM 0 HB2 MET A 30 29.458 -14.102 4.392 1.00 61.04 H new ATOM 0 HB3 MET A 30 28.737 -14.636 2.887 1.00 61.04 H new ATOM 0 HG2 MET A 30 31.189 -15.016 2.974 1.00 61.54 H new ATOM 0 HG3 MET A 30 30.702 -14.006 1.627 1.00 61.54 H new ATOM 0 HE1 MET A 30 34.281 -12.996 3.576 1.00 23.32 H new ATOM 0 HE2 MET A 30 33.405 -14.501 3.944 1.00 23.32 H new ATOM 0 HE3 MET A 30 33.680 -14.023 2.252 1.00 23.32 H new ATOM 511 N MET A 31 26.523 -12.915 3.886 1.00 42.44 N ATOM 512 CA MET A 31 25.079 -13.060 3.750 1.00 74.12 C ATOM 513 C MET A 31 24.406 -11.698 3.607 1.00 61.41 C ATOM 514 O MET A 31 23.411 -11.559 2.897 1.00 11.14 O ATOM 515 CB MET A 31 24.503 -13.802 4.958 1.00 43.21 C ATOM 516 CG MET A 31 24.876 -15.275 5.001 1.00 40.24 C ATOM 517 SD MET A 31 23.788 -16.236 6.070 1.00 52.12 S ATOM 518 CE MET A 31 24.922 -16.705 7.374 1.00 45.01 C ATOM 0 H MET A 31 26.873 -13.052 4.834 1.00 42.44 H new ATOM 0 HA MET A 31 24.881 -13.640 2.848 1.00 74.12 H new ATOM 0 HB2 MET A 31 24.853 -13.320 5.871 1.00 43.21 H new ATOM 0 HB3 MET A 31 23.417 -13.711 4.946 1.00 43.21 H new ATOM 0 HG2 MET A 31 24.841 -15.684 3.991 1.00 40.24 H new ATOM 0 HG3 MET A 31 25.904 -15.376 5.350 1.00 40.24 H new ATOM 0 HE1 MET A 31 25.123 -17.775 7.314 1.00 45.01 H new ATOM 0 HE2 MET A 31 25.855 -16.154 7.260 1.00 45.01 H new ATOM 0 HE3 MET A 31 24.479 -16.472 8.342 1.00 45.01 H new ATOM 528 N ASN A 32 24.957 -10.697 4.286 1.00 34.31 N ATOM 529 CA ASN A 32 24.409 -9.347 4.235 1.00 12.30 C ATOM 530 C ASN A 32 24.335 -8.843 2.797 1.00 64.54 C ATOM 531 O ASN A 32 23.346 -8.235 2.392 1.00 54.31 O ATOM 532 CB ASN A 32 25.262 -8.396 5.077 1.00 50.31 C ATOM 533 CG ASN A 32 24.699 -6.988 5.108 1.00 11.02 C ATOM 534 OD1 ASN A 32 23.492 -6.793 5.255 1.00 22.30 O ATOM 535 ND2 ASN A 32 25.573 -5.998 4.969 1.00 21.05 N ATOM 0 H ASN A 32 25.782 -10.795 4.878 1.00 34.31 H new ATOM 0 HA ASN A 32 23.399 -9.377 4.643 1.00 12.30 H new ATOM 0 HB2 ASN A 32 25.331 -8.779 6.095 1.00 50.31 H new ATOM 0 HB3 ASN A 32 26.275 -8.370 4.677 1.00 50.31 H new ATOM 0 HD21 ASN A 32 25.253 -5.030 4.982 1.00 21.05 H new ATOM 0 HD22 ASN A 32 26.564 -6.206 4.850 1.00 21.05 H new ATOM 542 N GLU A 33 25.390 -9.103 2.030 1.00 71.31 N ATOM 543 CA GLU A 33 25.444 -8.676 0.637 1.00 62.33 C ATOM 544 C GLU A 33 24.660 -9.633 -0.257 1.00 25.43 C ATOM 545 O GLU A 33 24.039 -9.217 -1.235 1.00 61.51 O ATOM 546 CB GLU A 33 26.896 -8.592 0.162 1.00 25.12 C ATOM 547 CG GLU A 33 27.670 -9.888 0.339 1.00 45.35 C ATOM 548 CD GLU A 33 29.172 -9.675 0.342 1.00 52.52 C ATOM 549 OE1 GLU A 33 29.715 -9.270 -0.708 1.00 22.15 O ATOM 550 OE2 GLU A 33 29.803 -9.912 1.392 1.00 21.25 O ATOM 0 H GLU A 33 26.217 -9.607 2.350 1.00 71.31 H new ATOM 0 HA GLU A 33 24.989 -7.688 0.569 1.00 62.33 H new ATOM 0 HB2 GLU A 33 26.909 -8.312 -0.891 1.00 25.12 H new ATOM 0 HB3 GLU A 33 27.403 -7.798 0.710 1.00 25.12 H new ATOM 0 HG2 GLU A 33 27.372 -10.360 1.275 1.00 45.35 H new ATOM 0 HG3 GLU A 33 27.406 -10.577 -0.463 1.00 45.35 H new ATOM 557 N ILE A 34 24.695 -10.916 0.087 1.00 64.51 N ATOM 558 CA ILE A 34 23.989 -11.932 -0.683 1.00 35.40 C ATOM 559 C ILE A 34 22.480 -11.716 -0.625 1.00 2.31 C ATOM 560 O ILE A 34 21.795 -11.765 -1.647 1.00 2.24 O ATOM 561 CB ILE A 34 24.312 -13.350 -0.175 1.00 41.03 C ATOM 562 CG1 ILE A 34 25.719 -13.763 -0.611 1.00 45.43 C ATOM 563 CG2 ILE A 34 23.280 -14.344 -0.687 1.00 24.21 C ATOM 564 CD1 ILE A 34 26.325 -14.849 0.250 1.00 53.10 C ATOM 0 H ILE A 34 25.205 -11.276 0.894 1.00 64.51 H new ATOM 0 HA ILE A 34 24.329 -11.838 -1.714 1.00 35.40 H new ATOM 0 HB ILE A 34 24.276 -13.347 0.914 1.00 41.03 H new ATOM 0 HG12 ILE A 34 25.684 -14.108 -1.645 1.00 45.43 H new ATOM 0 HG13 ILE A 34 26.369 -12.888 -0.589 1.00 45.43 H new ATOM 0 HG21 ILE A 34 23.522 -15.341 -0.320 1.00 24.21 H new ATOM 0 HG22 ILE A 34 22.290 -14.057 -0.332 1.00 24.21 H new ATOM 0 HG23 ILE A 34 23.287 -14.347 -1.777 1.00 24.21 H new ATOM 0 HD11 ILE A 34 27.322 -15.091 -0.118 1.00 53.10 H new ATOM 0 HD12 ILE A 34 26.393 -14.501 1.281 1.00 53.10 H new ATOM 0 HD13 ILE A 34 25.697 -15.739 0.208 1.00 53.10 H new ATOM 576 N VAL A 35 21.968 -11.474 0.578 1.00 45.11 N ATOM 577 CA VAL A 35 20.541 -11.246 0.770 1.00 62.22 C ATOM 578 C VAL A 35 20.138 -9.854 0.296 1.00 61.41 C ATOM 579 O VAL A 35 19.000 -9.634 -0.118 1.00 0.20 O ATOM 580 CB VAL A 35 20.141 -11.409 2.248 1.00 34.31 C ATOM 581 CG1 VAL A 35 18.628 -11.500 2.385 1.00 64.32 C ATOM 582 CG2 VAL A 35 20.813 -12.634 2.850 1.00 42.20 C ATOM 0 H VAL A 35 22.521 -11.431 1.434 1.00 45.11 H new ATOM 0 HA VAL A 35 20.018 -11.995 0.175 1.00 62.22 H new ATOM 0 HB VAL A 35 20.480 -10.530 2.797 1.00 34.31 H new ATOM 0 HG11 VAL A 35 18.364 -11.615 3.436 1.00 64.32 H new ATOM 0 HG12 VAL A 35 18.172 -10.591 1.994 1.00 64.32 H new ATOM 0 HG13 VAL A 35 18.263 -12.360 1.823 1.00 64.32 H new ATOM 0 HG21 VAL A 35 20.519 -12.734 3.895 1.00 42.20 H new ATOM 0 HG22 VAL A 35 20.507 -13.524 2.300 1.00 42.20 H new ATOM 0 HG23 VAL A 35 21.895 -12.523 2.787 1.00 42.20 H new ATOM 592 N SER A 36 21.079 -8.918 0.359 1.00 24.11 N ATOM 593 CA SER A 36 20.822 -7.546 -0.061 1.00 13.44 C ATOM 594 C SER A 36 20.732 -7.450 -1.581 1.00 22.03 C ATOM 595 O SER A 36 19.806 -6.847 -2.124 1.00 3.15 O ATOM 596 CB SER A 36 21.922 -6.617 0.456 1.00 10.33 C ATOM 597 OG SER A 36 22.041 -5.464 -0.359 1.00 51.12 O ATOM 0 H SER A 36 22.027 -9.085 0.697 1.00 24.11 H new ATOM 0 HA SER A 36 19.866 -7.236 0.362 1.00 13.44 H new ATOM 0 HB2 SER A 36 21.700 -6.320 1.481 1.00 10.33 H new ATOM 0 HB3 SER A 36 22.872 -7.150 0.478 1.00 10.33 H new ATOM 0 HG SER A 36 22.750 -4.886 -0.006 1.00 51.12 H new ATOM 603 N LYS A 37 21.702 -8.050 -2.263 1.00 11.22 N ATOM 604 CA LYS A 37 21.735 -8.035 -3.720 1.00 74.15 C ATOM 605 C LYS A 37 20.565 -8.825 -4.299 1.00 20.00 C ATOM 606 O LYS A 37 19.786 -8.304 -5.096 1.00 14.52 O ATOM 607 CB LYS A 37 23.057 -8.616 -4.227 1.00 54.04 C ATOM 608 CG LYS A 37 23.991 -7.575 -4.819 1.00 62.22 C ATOM 609 CD LYS A 37 24.715 -6.795 -3.735 1.00 11.41 C ATOM 610 CE LYS A 37 25.854 -5.967 -4.310 1.00 22.11 C ATOM 611 NZ LYS A 37 26.084 -4.721 -3.528 1.00 25.03 N ATOM 0 H LYS A 37 22.476 -8.553 -1.829 1.00 11.22 H new ATOM 0 HA LYS A 37 21.650 -7.000 -4.050 1.00 74.15 H new ATOM 0 HB2 LYS A 37 23.563 -9.119 -3.403 1.00 54.04 H new ATOM 0 HB3 LYS A 37 22.846 -9.374 -4.982 1.00 54.04 H new ATOM 0 HG2 LYS A 37 24.720 -8.064 -5.465 1.00 62.22 H new ATOM 0 HG3 LYS A 37 23.422 -6.888 -5.444 1.00 62.22 H new ATOM 0 HD2 LYS A 37 24.010 -6.140 -3.224 1.00 11.41 H new ATOM 0 HD3 LYS A 37 25.107 -7.486 -2.988 1.00 11.41 H new ATOM 0 HE2 LYS A 37 26.767 -6.563 -4.320 1.00 22.11 H new ATOM 0 HE3 LYS A 37 25.629 -5.710 -5.345 1.00 22.11 H new ATOM 0 HZ1 LYS A 37 26.868 -4.185 -3.952 1.00 25.03 H new ATOM 0 HZ2 LYS A 37 25.221 -4.140 -3.539 1.00 25.03 H new ATOM 0 HZ3 LYS A 37 26.324 -4.967 -2.546 1.00 25.03 H new ATOM 625 N MET A 38 20.448 -10.085 -3.891 1.00 43.43 N ATOM 626 CA MET A 38 19.372 -10.945 -4.368 1.00 15.12 C ATOM 627 C MET A 38 18.013 -10.284 -4.155 1.00 42.04 C ATOM 628 O MET A 38 17.122 -10.391 -4.998 1.00 50.20 O ATOM 629 CB MET A 38 19.413 -12.295 -3.649 1.00 53.03 C ATOM 630 CG MET A 38 19.030 -12.214 -2.180 1.00 51.45 C ATOM 631 SD MET A 38 17.286 -12.573 -1.896 1.00 61.42 S ATOM 632 CE MET A 38 17.197 -14.275 -2.447 1.00 63.24 C ATOM 0 H MET A 38 21.085 -10.532 -3.232 1.00 43.43 H new ATOM 0 HA MET A 38 19.515 -11.106 -5.437 1.00 15.12 H new ATOM 0 HB2 MET A 38 18.739 -12.987 -4.154 1.00 53.03 H new ATOM 0 HB3 MET A 38 20.417 -12.711 -3.732 1.00 53.03 H new ATOM 0 HG2 MET A 38 19.639 -12.916 -1.611 1.00 51.45 H new ATOM 0 HG3 MET A 38 19.258 -11.217 -1.804 1.00 51.45 H new ATOM 0 HE1 MET A 38 16.237 -14.702 -2.156 1.00 63.24 H new ATOM 0 HE2 MET A 38 17.297 -14.312 -3.532 1.00 63.24 H new ATOM 0 HE3 MET A 38 18.003 -14.848 -1.989 1.00 63.24 H new ATOM 642 N ASP A 39 17.862 -9.602 -3.025 1.00 64.14 N ATOM 643 CA ASP A 39 16.613 -8.923 -2.703 1.00 73.21 C ATOM 644 C ASP A 39 16.389 -7.730 -3.626 1.00 52.43 C ATOM 645 O ASP A 39 15.250 -7.354 -3.907 1.00 64.43 O ATOM 646 CB ASP A 39 16.620 -8.462 -1.245 1.00 14.31 C ATOM 647 CG ASP A 39 15.316 -7.802 -0.840 1.00 71.22 C ATOM 648 OD1 ASP A 39 14.278 -8.104 -1.467 1.00 4.22 O ATOM 649 OD2 ASP A 39 15.333 -6.985 0.104 1.00 71.03 O ATOM 0 H ASP A 39 18.589 -9.505 -2.317 1.00 64.14 H new ATOM 0 HA ASP A 39 15.796 -9.630 -2.849 1.00 73.21 H new ATOM 0 HB2 ASP A 39 16.807 -9.318 -0.597 1.00 14.31 H new ATOM 0 HB3 ASP A 39 17.441 -7.762 -1.092 1.00 14.31 H new ATOM 654 N ASP A 40 17.482 -7.137 -4.094 1.00 11.22 N ATOM 655 CA ASP A 40 17.405 -5.985 -4.985 1.00 63.35 C ATOM 656 C ASP A 40 16.821 -6.383 -6.337 1.00 54.23 C ATOM 657 O ASP A 40 15.872 -5.764 -6.821 1.00 62.51 O ATOM 658 CB ASP A 40 18.792 -5.369 -5.177 1.00 13.40 C ATOM 659 CG ASP A 40 18.758 -4.129 -6.049 1.00 4.44 C ATOM 660 OD1 ASP A 40 18.580 -4.271 -7.277 1.00 3.23 O ATOM 661 OD2 ASP A 40 18.909 -3.016 -5.503 1.00 5.13 O ATOM 0 H ASP A 40 18.432 -7.435 -3.871 1.00 11.22 H new ATOM 0 HA ASP A 40 16.747 -5.246 -4.528 1.00 63.35 H new ATOM 0 HB2 ASP A 40 19.211 -5.114 -4.204 1.00 13.40 H new ATOM 0 HB3 ASP A 40 19.456 -6.108 -5.626 1.00 13.40 H new ATOM 666 N PHE A 41 17.393 -7.418 -6.943 1.00 3.23 N ATOM 667 CA PHE A 41 16.930 -7.897 -8.240 1.00 5.30 C ATOM 668 C PHE A 41 15.495 -8.407 -8.151 1.00 22.12 C ATOM 669 O PHE A 41 14.680 -8.161 -9.041 1.00 0.32 O ATOM 670 CB PHE A 41 17.848 -9.008 -8.754 1.00 71.01 C ATOM 671 CG PHE A 41 17.440 -9.550 -10.094 1.00 70.21 C ATOM 672 CD1 PHE A 41 16.810 -8.737 -11.023 1.00 22.04 C ATOM 673 CD2 PHE A 41 17.687 -10.873 -10.425 1.00 53.35 C ATOM 674 CE1 PHE A 41 16.433 -9.234 -12.256 1.00 42.30 C ATOM 675 CE2 PHE A 41 17.312 -11.375 -11.658 1.00 2.14 C ATOM 676 CZ PHE A 41 16.686 -10.554 -12.574 1.00 55.14 C ATOM 0 H PHE A 41 18.178 -7.941 -6.556 1.00 3.23 H new ATOM 0 HA PHE A 41 16.956 -7.061 -8.939 1.00 5.30 H new ATOM 0 HB2 PHE A 41 18.866 -8.625 -8.820 1.00 71.01 H new ATOM 0 HB3 PHE A 41 17.860 -9.823 -8.030 1.00 71.01 H new ATOM 0 HD1 PHE A 41 16.612 -7.703 -10.781 1.00 22.04 H new ATOM 0 HD2 PHE A 41 18.178 -11.519 -9.712 1.00 53.35 H new ATOM 0 HE1 PHE A 41 15.941 -8.591 -12.970 1.00 42.30 H new ATOM 0 HE2 PHE A 41 17.509 -12.408 -11.904 1.00 2.14 H new ATOM 0 HZ PHE A 41 16.394 -10.943 -13.538 1.00 55.14 H new ATOM 686 N LEU A 42 15.193 -9.120 -7.071 1.00 64.13 N ATOM 687 CA LEU A 42 13.857 -9.667 -6.865 1.00 12.34 C ATOM 688 C LEU A 42 12.862 -8.561 -6.526 1.00 45.31 C ATOM 689 O LEU A 42 11.683 -8.648 -6.866 1.00 40.43 O ATOM 690 CB LEU A 42 13.878 -10.709 -5.745 1.00 62.01 C ATOM 691 CG LEU A 42 13.211 -12.048 -6.062 1.00 23.10 C ATOM 692 CD1 LEU A 42 11.697 -11.913 -6.023 1.00 41.33 C ATOM 693 CD2 LEU A 42 13.668 -12.563 -7.419 1.00 21.50 C ATOM 0 H LEU A 42 15.855 -9.333 -6.325 1.00 64.13 H new ATOM 0 HA LEU A 42 13.540 -10.145 -7.792 1.00 12.34 H new ATOM 0 HB2 LEU A 42 14.916 -10.899 -5.472 1.00 62.01 H new ATOM 0 HB3 LEU A 42 13.391 -10.281 -4.869 1.00 62.01 H new ATOM 0 HG LEU A 42 13.510 -12.770 -5.302 1.00 23.10 H new ATOM 0 HD11 LEU A 42 11.240 -12.876 -6.251 1.00 41.33 H new ATOM 0 HD12 LEU A 42 11.386 -11.590 -5.030 1.00 41.33 H new ATOM 0 HD13 LEU A 42 11.378 -11.176 -6.760 1.00 41.33 H new ATOM 0 HD21 LEU A 42 13.183 -13.517 -7.628 1.00 21.50 H new ATOM 0 HD22 LEU A 42 13.399 -11.842 -8.191 1.00 21.50 H new ATOM 0 HD23 LEU A 42 14.749 -12.700 -7.411 1.00 21.50 H new ATOM 705 N MET A 43 13.348 -7.521 -5.856 1.00 53.51 N ATOM 706 CA MET A 43 12.502 -6.395 -5.475 1.00 32.51 C ATOM 707 C MET A 43 12.007 -5.645 -6.707 1.00 70.35 C ATOM 708 O MET A 43 10.849 -5.233 -6.773 1.00 34.22 O ATOM 709 CB MET A 43 13.268 -5.442 -4.557 1.00 2.35 C ATOM 710 CG MET A 43 12.519 -4.153 -4.258 1.00 24.15 C ATOM 711 SD MET A 43 13.155 -3.302 -2.801 1.00 23.34 S ATOM 712 CE MET A 43 14.557 -2.434 -3.500 1.00 61.33 C ATOM 0 H MET A 43 14.322 -7.434 -5.566 1.00 53.51 H new ATOM 0 HA MET A 43 11.638 -6.787 -4.939 1.00 32.51 H new ATOM 0 HB2 MET A 43 13.486 -5.952 -3.619 1.00 2.35 H new ATOM 0 HB3 MET A 43 14.225 -5.198 -5.018 1.00 2.35 H new ATOM 0 HG2 MET A 43 12.587 -3.489 -5.120 1.00 24.15 H new ATOM 0 HG3 MET A 43 11.462 -4.377 -4.111 1.00 24.15 H new ATOM 0 HE1 MET A 43 15.056 -1.860 -2.719 1.00 61.33 H new ATOM 0 HE2 MET A 43 15.257 -3.155 -3.924 1.00 61.33 H new ATOM 0 HE3 MET A 43 14.213 -1.759 -4.283 1.00 61.33 H new ATOM 722 N LYS A 44 12.892 -5.471 -7.683 1.00 52.22 N ATOM 723 CA LYS A 44 12.546 -4.771 -8.915 1.00 35.13 C ATOM 724 C LYS A 44 11.651 -5.635 -9.798 1.00 52.30 C ATOM 725 O LYS A 44 10.740 -5.132 -10.457 1.00 64.33 O ATOM 726 CB LYS A 44 13.813 -4.383 -9.679 1.00 64.40 C ATOM 727 CG LYS A 44 14.225 -5.400 -10.730 1.00 21.13 C ATOM 728 CD LYS A 44 15.618 -5.115 -11.266 1.00 20.23 C ATOM 729 CE LYS A 44 15.632 -3.880 -12.153 1.00 51.01 C ATOM 730 NZ LYS A 44 16.010 -2.656 -11.394 1.00 13.21 N ATOM 0 H LYS A 44 13.855 -5.805 -7.645 1.00 52.22 H new ATOM 0 HA LYS A 44 11.999 -3.866 -8.648 1.00 35.13 H new ATOM 0 HB2 LYS A 44 13.655 -3.418 -10.161 1.00 64.40 H new ATOM 0 HB3 LYS A 44 14.630 -4.255 -8.969 1.00 64.40 H new ATOM 0 HG2 LYS A 44 14.198 -6.401 -10.299 1.00 21.13 H new ATOM 0 HG3 LYS A 44 13.508 -5.387 -11.551 1.00 21.13 H new ATOM 0 HD2 LYS A 44 16.307 -4.974 -10.434 1.00 20.23 H new ATOM 0 HD3 LYS A 44 15.974 -5.975 -11.833 1.00 20.23 H new ATOM 0 HE2 LYS A 44 16.334 -4.030 -12.973 1.00 51.01 H new ATOM 0 HE3 LYS A 44 14.647 -3.741 -12.598 1.00 51.01 H new ATOM 0 HZ1 LYS A 44 15.388 -1.870 -11.671 1.00 13.21 H new ATOM 0 HZ2 LYS A 44 15.909 -2.835 -10.374 1.00 13.21 H new ATOM 0 HZ3 LYS A 44 16.998 -2.408 -11.605 1.00 13.21 H new ATOM 744 N LYS A 45 11.915 -6.937 -9.806 1.00 15.02 N ATOM 745 CA LYS A 45 11.132 -7.872 -10.606 1.00 0.15 C ATOM 746 C LYS A 45 9.662 -7.836 -10.201 1.00 32.23 C ATOM 747 O LYS A 45 8.781 -7.662 -11.042 1.00 54.32 O ATOM 748 CB LYS A 45 11.681 -9.292 -10.449 1.00 54.04 C ATOM 749 CG LYS A 45 12.859 -9.592 -11.360 1.00 30.24 C ATOM 750 CD LYS A 45 12.811 -11.018 -11.882 1.00 74.14 C ATOM 751 CE LYS A 45 13.867 -11.890 -11.221 1.00 71.32 C ATOM 752 NZ LYS A 45 14.528 -12.798 -12.199 1.00 73.41 N ATOM 0 H LYS A 45 12.666 -7.369 -9.267 1.00 15.02 H new ATOM 0 HA LYS A 45 11.210 -7.572 -11.651 1.00 0.15 H new ATOM 0 HB2 LYS A 45 11.986 -9.442 -9.413 1.00 54.04 H new ATOM 0 HB3 LYS A 45 10.883 -10.006 -10.653 1.00 54.04 H new ATOM 0 HG2 LYS A 45 12.858 -8.896 -12.199 1.00 30.24 H new ATOM 0 HG3 LYS A 45 13.790 -9.434 -10.816 1.00 30.24 H new ATOM 0 HD2 LYS A 45 11.823 -11.440 -11.699 1.00 74.14 H new ATOM 0 HD3 LYS A 45 12.963 -11.017 -12.961 1.00 74.14 H new ATOM 0 HE2 LYS A 45 14.618 -11.256 -10.749 1.00 71.32 H new ATOM 0 HE3 LYS A 45 13.406 -12.482 -10.430 1.00 71.32 H new ATOM 0 HZ1 LYS A 45 14.492 -13.775 -11.845 1.00 73.41 H new ATOM 0 HZ2 LYS A 45 14.034 -12.743 -13.113 1.00 73.41 H new ATOM 0 HZ3 LYS A 45 15.520 -12.511 -12.324 1.00 73.41 H new ATOM 766 N SER A 46 9.405 -8.001 -8.907 1.00 73.21 N ATOM 767 CA SER A 46 8.041 -7.990 -8.391 1.00 72.03 C ATOM 768 C SER A 46 7.401 -6.618 -8.578 1.00 14.20 C ATOM 769 O SER A 46 6.194 -6.507 -8.794 1.00 15.44 O ATOM 770 CB SER A 46 8.030 -8.373 -6.910 1.00 70.22 C ATOM 771 OG SER A 46 6.735 -8.773 -6.496 1.00 51.32 O ATOM 0 H SER A 46 10.123 -8.144 -8.197 1.00 73.21 H new ATOM 0 HA SER A 46 7.461 -8.722 -8.952 1.00 72.03 H new ATOM 0 HB2 SER A 46 8.737 -9.184 -6.736 1.00 70.22 H new ATOM 0 HB3 SER A 46 8.362 -7.526 -6.310 1.00 70.22 H new ATOM 0 HG SER A 46 6.755 -9.014 -5.546 1.00 51.32 H new ATOM 777 N LYS A 47 8.218 -5.574 -8.493 1.00 64.15 N ATOM 778 CA LYS A 47 7.735 -4.208 -8.654 1.00 1.21 C ATOM 779 C LYS A 47 7.170 -3.991 -10.054 1.00 70.50 C ATOM 780 O LYS A 47 6.260 -3.185 -10.248 1.00 51.02 O ATOM 781 CB LYS A 47 8.865 -3.211 -8.389 1.00 4.30 C ATOM 782 CG LYS A 47 9.358 -2.503 -9.640 1.00 30.25 C ATOM 783 CD LYS A 47 9.770 -1.071 -9.344 1.00 44.11 C ATOM 784 CE LYS A 47 8.790 -0.074 -9.943 1.00 1.13 C ATOM 785 NZ LYS A 47 8.679 -0.224 -11.420 1.00 72.20 N ATOM 0 H LYS A 47 9.219 -5.648 -8.313 1.00 64.15 H new ATOM 0 HA LYS A 47 6.937 -4.045 -7.930 1.00 1.21 H new ATOM 0 HB2 LYS A 47 8.520 -2.466 -7.672 1.00 4.30 H new ATOM 0 HB3 LYS A 47 9.700 -3.736 -7.926 1.00 4.30 H new ATOM 0 HG2 LYS A 47 10.205 -3.047 -10.057 1.00 30.25 H new ATOM 0 HG3 LYS A 47 8.572 -2.508 -10.396 1.00 30.25 H new ATOM 0 HD2 LYS A 47 9.827 -0.923 -8.266 1.00 44.11 H new ATOM 0 HD3 LYS A 47 10.767 -0.888 -9.744 1.00 44.11 H new ATOM 0 HE2 LYS A 47 7.809 -0.212 -9.489 1.00 1.13 H new ATOM 0 HE3 LYS A 47 9.112 0.940 -9.704 1.00 1.13 H new ATOM 0 HZ1 LYS A 47 8.487 0.703 -11.850 1.00 72.20 H new ATOM 0 HZ2 LYS A 47 9.570 -0.603 -11.798 1.00 72.20 H new ATOM 0 HZ3 LYS A 47 7.902 -0.877 -11.645 1.00 72.20 H new ATOM 799 N ILE A 48 7.714 -4.717 -11.025 1.00 72.12 N ATOM 800 CA ILE A 48 7.261 -4.606 -12.406 1.00 43.43 C ATOM 801 C ILE A 48 6.032 -5.473 -12.654 1.00 13.14 C ATOM 802 O ILE A 48 5.169 -5.130 -13.463 1.00 12.21 O ATOM 803 CB ILE A 48 8.369 -5.011 -13.396 1.00 62.22 C ATOM 804 CG1 ILE A 48 9.281 -3.818 -13.692 1.00 74.32 C ATOM 805 CG2 ILE A 48 7.760 -5.551 -14.682 1.00 14.45 C ATOM 806 CD1 ILE A 48 10.584 -3.849 -12.925 1.00 62.04 C ATOM 0 H ILE A 48 8.469 -5.388 -10.881 1.00 72.12 H new ATOM 0 HA ILE A 48 7.003 -3.560 -12.570 1.00 43.43 H new ATOM 0 HB ILE A 48 8.970 -5.799 -12.942 1.00 62.22 H new ATOM 0 HG12 ILE A 48 9.498 -3.793 -14.760 1.00 74.32 H new ATOM 0 HG13 ILE A 48 8.750 -2.897 -13.453 1.00 74.32 H new ATOM 0 HG21 ILE A 48 8.556 -5.833 -15.371 1.00 14.45 H new ATOM 0 HG22 ILE A 48 7.149 -6.425 -14.456 1.00 14.45 H new ATOM 0 HG23 ILE A 48 7.138 -4.782 -15.141 1.00 14.45 H new ATOM 0 HD11 ILE A 48 11.180 -2.974 -13.184 1.00 62.04 H new ATOM 0 HD12 ILE A 48 10.377 -3.843 -11.855 1.00 62.04 H new ATOM 0 HD13 ILE A 48 11.136 -4.753 -13.182 1.00 62.04 H new ATOM 818 N LEU A 49 5.957 -6.597 -11.950 1.00 73.45 N ATOM 819 CA LEU A 49 4.831 -7.515 -12.092 1.00 0.54 C ATOM 820 C LEU A 49 3.530 -6.852 -11.651 1.00 0.45 C ATOM 821 O LEU A 49 2.441 -7.323 -11.973 1.00 74.32 O ATOM 822 CB LEU A 49 5.075 -8.782 -11.271 1.00 35.30 C ATOM 823 CG LEU A 49 6.423 -9.472 -11.485 1.00 15.30 C ATOM 824 CD1 LEU A 49 6.335 -10.943 -11.110 1.00 71.05 C ATOM 825 CD2 LEU A 49 6.880 -9.313 -12.928 1.00 13.03 C ATOM 0 H LEU A 49 6.662 -6.895 -11.275 1.00 73.45 H new ATOM 0 HA LEU A 49 4.742 -7.783 -13.145 1.00 0.54 H new ATOM 0 HB2 LEU A 49 4.982 -8.530 -10.215 1.00 35.30 H new ATOM 0 HB3 LEU A 49 4.284 -9.496 -11.499 1.00 35.30 H new ATOM 0 HG LEU A 49 7.160 -8.997 -10.837 1.00 15.30 H new ATOM 0 HD11 LEU A 49 7.303 -11.418 -11.269 1.00 71.05 H new ATOM 0 HD12 LEU A 49 6.054 -11.035 -10.061 1.00 71.05 H new ATOM 0 HD13 LEU A 49 5.585 -11.433 -11.731 1.00 71.05 H new ATOM 0 HD21 LEU A 49 7.841 -9.810 -13.062 1.00 13.03 H new ATOM 0 HD22 LEU A 49 6.143 -9.761 -13.594 1.00 13.03 H new ATOM 0 HD23 LEU A 49 6.984 -8.254 -13.162 1.00 13.03 H new ATOM 837 N GLY A 50 3.652 -5.753 -10.912 1.00 3.31 N ATOM 838 CA GLY A 50 2.478 -5.041 -10.440 1.00 65.44 C ATOM 839 C GLY A 50 2.282 -3.715 -11.146 1.00 41.45 C ATOM 840 O GLY A 50 1.152 -3.301 -11.404 1.00 55.13 O ATOM 0 H GLY A 50 4.543 -5.343 -10.632 1.00 3.31 H new ATOM 0 HA2 GLY A 50 1.595 -5.663 -10.590 1.00 65.44 H new ATOM 0 HA3 GLY A 50 2.568 -4.868 -9.368 1.00 65.44 H new ATOM 844 N LYS A 51 3.386 -3.044 -11.459 1.00 55.32 N ATOM 845 CA LYS A 51 3.331 -1.755 -12.139 1.00 62.14 C ATOM 846 C LYS A 51 2.542 -1.860 -13.441 1.00 2.44 C ATOM 847 O LYS A 51 2.142 -2.950 -13.851 1.00 14.43 O ATOM 848 CB LYS A 51 4.746 -1.247 -12.428 1.00 32.33 C ATOM 849 CG LYS A 51 5.107 0.014 -11.663 1.00 11.15 C ATOM 850 CD LYS A 51 5.073 -0.216 -10.161 1.00 2.31 C ATOM 851 CE LYS A 51 5.095 1.098 -9.395 1.00 51.53 C ATOM 852 NZ LYS A 51 6.250 1.951 -9.790 1.00 50.41 N ATOM 0 H LYS A 51 4.330 -3.372 -11.252 1.00 55.32 H new ATOM 0 HA LYS A 51 2.824 -1.048 -11.483 1.00 62.14 H new ATOM 0 HB2 LYS A 51 5.462 -2.030 -12.179 1.00 32.33 H new ATOM 0 HB3 LYS A 51 4.843 -1.054 -13.496 1.00 32.33 H new ATOM 0 HG2 LYS A 51 6.102 0.348 -11.958 1.00 11.15 H new ATOM 0 HG3 LYS A 51 4.412 0.812 -11.926 1.00 11.15 H new ATOM 0 HD2 LYS A 51 4.176 -0.777 -9.898 1.00 2.31 H new ATOM 0 HD3 LYS A 51 5.928 -0.825 -9.866 1.00 2.31 H new ATOM 0 HE2 LYS A 51 4.166 1.639 -9.575 1.00 51.53 H new ATOM 0 HE3 LYS A 51 5.143 0.894 -8.325 1.00 51.53 H new ATOM 0 HZ1 LYS A 51 6.875 2.091 -8.970 1.00 50.41 H new ATOM 0 HZ2 LYS A 51 6.780 1.486 -10.554 1.00 50.41 H new ATOM 0 HZ3 LYS A 51 5.903 2.874 -10.122 1.00 50.41 H new ATOM 866 N THR A 52 2.323 -0.719 -14.088 1.00 33.12 N ATOM 867 CA THR A 52 1.582 -0.683 -15.342 1.00 42.45 C ATOM 868 C THR A 52 2.431 -0.097 -16.465 1.00 63.52 C ATOM 869 O THR A 52 3.569 0.316 -16.245 1.00 32.13 O ATOM 870 CB THR A 52 0.289 0.144 -15.208 1.00 23.21 C ATOM 871 OG1 THR A 52 0.582 1.538 -15.350 1.00 3.35 O ATOM 872 CG2 THR A 52 -0.375 -0.106 -13.862 1.00 40.04 C ATOM 0 H THR A 52 2.648 0.192 -13.764 1.00 33.12 H new ATOM 0 HA THR A 52 1.322 -1.713 -15.585 1.00 42.45 H new ATOM 0 HB THR A 52 -0.397 -0.164 -15.997 1.00 23.21 H new ATOM 0 HG1 THR A 52 1.403 1.751 -14.860 1.00 3.35 H new ATOM 0 HG21 THR A 52 -1.286 0.488 -13.790 1.00 40.04 H new ATOM 0 HG22 THR A 52 -0.623 -1.163 -13.770 1.00 40.04 H new ATOM 0 HG23 THR A 52 0.308 0.178 -13.061 1.00 40.04 H new ATOM 880 N ASN A 53 1.870 -0.065 -17.670 1.00 25.13 N ATOM 881 CA ASN A 53 2.577 0.470 -18.828 1.00 2.23 C ATOM 882 C ASN A 53 2.965 1.928 -18.602 1.00 1.40 C ATOM 883 O ASN A 53 3.869 2.450 -19.255 1.00 3.34 O ATOM 884 CB ASN A 53 1.709 0.350 -20.082 1.00 13.14 C ATOM 885 CG ASN A 53 0.547 1.325 -20.076 1.00 42.00 C ATOM 886 OD1 ASN A 53 -0.398 1.177 -19.301 1.00 51.23 O ATOM 887 ND2 ASN A 53 0.613 2.329 -20.943 1.00 61.53 N ATOM 0 H ASN A 53 0.929 -0.403 -17.870 1.00 25.13 H new ATOM 0 HA ASN A 53 3.488 -0.113 -18.968 1.00 2.23 H new ATOM 0 HB2 ASN A 53 2.324 0.527 -20.964 1.00 13.14 H new ATOM 0 HB3 ASN A 53 1.326 -0.667 -20.159 1.00 13.14 H new ATOM 0 HD21 ASN A 53 -0.139 3.017 -20.985 1.00 61.53 H new ATOM 0 HD22 ASN A 53 1.416 2.412 -21.567 1.00 61.53 H new ATOM 894 N LYS A 54 2.275 2.581 -17.673 1.00 4.23 N ATOM 895 CA LYS A 54 2.548 3.979 -17.358 1.00 35.31 C ATOM 896 C LYS A 54 3.865 4.120 -16.602 1.00 61.43 C ATOM 897 O LYS A 54 4.563 5.124 -16.738 1.00 24.22 O ATOM 898 CB LYS A 54 1.405 4.567 -16.527 1.00 3.42 C ATOM 899 CG LYS A 54 0.050 4.479 -17.207 1.00 31.43 C ATOM 900 CD LYS A 54 -1.085 4.684 -16.217 1.00 62.32 C ATOM 901 CE LYS A 54 -1.283 6.157 -15.894 1.00 30.31 C ATOM 902 NZ LYS A 54 -1.917 6.892 -17.023 1.00 44.02 N ATOM 0 H LYS A 54 1.522 2.165 -17.125 1.00 4.23 H new ATOM 0 HA LYS A 54 2.628 4.528 -18.296 1.00 35.31 H new ATOM 0 HB2 LYS A 54 1.357 4.046 -15.571 1.00 3.42 H new ATOM 0 HB3 LYS A 54 1.626 5.612 -16.309 1.00 3.42 H new ATOM 0 HG2 LYS A 54 -0.013 5.230 -17.994 1.00 31.43 H new ATOM 0 HG3 LYS A 54 -0.055 3.506 -17.686 1.00 31.43 H new ATOM 0 HD2 LYS A 54 -2.007 4.273 -16.629 1.00 62.32 H new ATOM 0 HD3 LYS A 54 -0.873 4.134 -15.300 1.00 62.32 H new ATOM 0 HE2 LYS A 54 -1.904 6.253 -15.004 1.00 30.31 H new ATOM 0 HE3 LYS A 54 -0.320 6.610 -15.661 1.00 30.31 H new ATOM 0 HZ1 LYS A 54 -2.250 7.819 -16.690 1.00 44.02 H new ATOM 0 HZ2 LYS A 54 -1.221 7.027 -17.784 1.00 44.02 H new ATOM 0 HZ3 LYS A 54 -2.723 6.344 -17.385 1.00 44.02 H new ATOM 916 N GLN A 55 4.198 3.107 -15.809 1.00 21.13 N ATOM 917 CA GLN A 55 5.433 3.119 -15.033 1.00 13.12 C ATOM 918 C GLN A 55 6.515 2.293 -15.720 1.00 4.33 C ATOM 919 O GLN A 55 7.709 2.528 -15.522 1.00 75.44 O ATOM 920 CB GLN A 55 5.180 2.579 -13.624 1.00 52.40 C ATOM 921 CG GLN A 55 4.373 3.523 -12.747 1.00 4.24 C ATOM 922 CD GLN A 55 2.888 3.470 -13.044 1.00 52.30 C ATOM 923 OE1 GLN A 55 2.393 2.504 -13.625 1.00 22.45 O ATOM 924 NE2 GLN A 55 2.167 4.512 -12.647 1.00 12.15 N ATOM 0 H GLN A 55 3.631 2.268 -15.687 1.00 21.13 H new ATOM 0 HA GLN A 55 5.778 4.150 -14.963 1.00 13.12 H new ATOM 0 HB2 GLN A 55 4.655 1.627 -13.698 1.00 52.40 H new ATOM 0 HB3 GLN A 55 6.137 2.379 -13.143 1.00 52.40 H new ATOM 0 HG2 GLN A 55 4.539 3.271 -11.700 1.00 4.24 H new ATOM 0 HG3 GLN A 55 4.732 4.542 -12.890 1.00 4.24 H new ATOM 0 HE21 GLN A 55 2.618 5.292 -12.169 1.00 12.15 H new ATOM 0 HE22 GLN A 55 1.162 4.533 -12.820 1.00 12.15 H new ATOM 933 N LEU A 56 6.092 1.326 -16.526 1.00 44.43 N ATOM 934 CA LEU A 56 7.026 0.465 -17.243 1.00 62.30 C ATOM 935 C LEU A 56 8.063 1.292 -17.996 1.00 11.41 C ATOM 936 O LEU A 56 7.722 2.082 -18.877 1.00 44.32 O ATOM 937 CB LEU A 56 6.271 -0.438 -18.220 1.00 32.33 C ATOM 938 CG LEU A 56 7.122 -1.148 -19.273 1.00 50.13 C ATOM 939 CD1 LEU A 56 6.506 -2.488 -19.643 1.00 30.30 C ATOM 940 CD2 LEU A 56 7.281 -0.273 -20.508 1.00 74.03 C ATOM 0 H LEU A 56 5.109 1.118 -16.700 1.00 44.43 H new ATOM 0 HA LEU A 56 7.545 -0.154 -16.511 1.00 62.30 H new ATOM 0 HB2 LEU A 56 5.735 -1.193 -17.645 1.00 32.33 H new ATOM 0 HB3 LEU A 56 5.521 0.163 -18.733 1.00 32.33 H new ATOM 0 HG LEU A 56 8.110 -1.330 -18.851 1.00 50.13 H new ATOM 0 HD11 LEU A 56 7.126 -2.978 -20.394 1.00 30.30 H new ATOM 0 HD12 LEU A 56 6.445 -3.118 -18.755 1.00 30.30 H new ATOM 0 HD13 LEU A 56 5.506 -2.330 -20.046 1.00 30.30 H new ATOM 0 HD21 LEU A 56 7.890 -0.794 -21.247 1.00 74.03 H new ATOM 0 HD22 LEU A 56 6.300 -0.059 -20.931 1.00 74.03 H new ATOM 0 HD23 LEU A 56 7.768 0.662 -20.231 1.00 74.03 H new ATOM 952 N THR A 57 9.331 1.105 -17.644 1.00 63.14 N ATOM 953 CA THR A 57 10.418 1.833 -18.287 1.00 21.20 C ATOM 954 C THR A 57 11.460 0.876 -18.855 1.00 5.34 C ATOM 955 O THR A 57 11.257 -0.338 -18.875 1.00 54.34 O ATOM 956 CB THR A 57 11.106 2.799 -17.304 1.00 32.22 C ATOM 957 OG1 THR A 57 11.800 2.058 -16.294 1.00 33.02 O ATOM 958 CG2 THR A 57 10.088 3.723 -16.653 1.00 2.43 C ATOM 0 H THR A 57 9.631 0.455 -16.917 1.00 63.14 H new ATOM 0 HA THR A 57 9.976 2.408 -19.100 1.00 21.20 H new ATOM 0 HB THR A 57 11.819 3.405 -17.863 1.00 32.22 H new ATOM 0 HG1 THR A 57 12.236 2.679 -15.674 1.00 33.02 H new ATOM 0 HG21 THR A 57 10.597 4.396 -15.963 1.00 2.43 H new ATOM 0 HG22 THR A 57 9.582 4.306 -17.422 1.00 2.43 H new ATOM 0 HG23 THR A 57 9.355 3.129 -16.107 1.00 2.43 H new ATOM 966 N ARG A 58 12.578 1.431 -19.314 1.00 33.43 N ATOM 967 CA ARG A 58 13.652 0.626 -19.882 1.00 62.33 C ATOM 968 C ARG A 58 14.025 -0.521 -18.948 1.00 22.34 C ATOM 969 O ARG A 58 14.231 -1.652 -19.388 1.00 60.20 O ATOM 970 CB ARG A 58 14.881 1.496 -20.155 1.00 34.23 C ATOM 971 CG ARG A 58 16.037 0.737 -20.784 1.00 24.44 C ATOM 972 CD ARG A 58 17.379 1.316 -20.362 1.00 73.11 C ATOM 973 NE ARG A 58 18.476 0.807 -21.180 1.00 22.40 N ATOM 974 CZ ARG A 58 18.687 1.175 -22.439 1.00 32.32 C ATOM 975 NH1 ARG A 58 17.879 2.050 -23.021 1.00 3.52 N ATOM 976 NH2 ARG A 58 19.707 0.667 -23.118 1.00 24.20 N ATOM 0 H ARG A 58 12.763 2.434 -19.303 1.00 33.43 H new ATOM 0 HA ARG A 58 13.297 0.205 -20.823 1.00 62.33 H new ATOM 0 HB2 ARG A 58 14.596 2.317 -20.813 1.00 34.23 H new ATOM 0 HB3 ARG A 58 15.216 1.940 -19.218 1.00 34.23 H new ATOM 0 HG2 ARG A 58 15.985 -0.313 -20.494 1.00 24.44 H new ATOM 0 HG3 ARG A 58 15.949 0.773 -21.870 1.00 24.44 H new ATOM 0 HD2 ARG A 58 17.345 2.403 -20.437 1.00 73.11 H new ATOM 0 HD3 ARG A 58 17.565 1.075 -19.315 1.00 73.11 H new ATOM 0 HE ARG A 58 19.116 0.132 -20.762 1.00 22.40 H new ATOM 0 HH11 ARG A 58 17.093 2.442 -22.502 1.00 3.52 H new ATOM 0 HH12 ARG A 58 18.043 2.331 -23.988 1.00 3.52 H new ATOM 0 HH21 ARG A 58 20.330 -0.007 -22.674 1.00 24.20 H new ATOM 0 HH22 ARG A 58 19.868 0.950 -24.085 1.00 24.20 H new ATOM 990 N SER A 59 14.111 -0.221 -17.656 1.00 30.14 N ATOM 991 CA SER A 59 14.463 -1.226 -16.659 1.00 45.32 C ATOM 992 C SER A 59 13.380 -2.296 -16.560 1.00 4.43 C ATOM 993 O SER A 59 13.658 -3.446 -16.220 1.00 10.23 O ATOM 994 CB SER A 59 14.674 -0.568 -15.294 1.00 30.42 C ATOM 995 OG SER A 59 15.138 0.763 -15.435 1.00 23.01 O ATOM 0 H SER A 59 13.942 0.710 -17.275 1.00 30.14 H new ATOM 0 HA SER A 59 15.392 -1.703 -16.972 1.00 45.32 H new ATOM 0 HB2 SER A 59 13.738 -0.573 -14.736 1.00 30.42 H new ATOM 0 HB3 SER A 59 15.393 -1.147 -14.715 1.00 30.42 H new ATOM 0 HG SER A 59 15.263 1.161 -14.548 1.00 23.01 H new ATOM 1001 N ASP A 60 12.146 -1.908 -16.859 1.00 14.33 N ATOM 1002 CA ASP A 60 11.019 -2.833 -16.804 1.00 44.45 C ATOM 1003 C ASP A 60 11.048 -3.794 -17.989 1.00 12.51 C ATOM 1004 O ASP A 60 10.670 -4.959 -17.865 1.00 14.51 O ATOM 1005 CB ASP A 60 9.699 -2.061 -16.789 1.00 73.31 C ATOM 1006 CG ASP A 60 8.492 -2.978 -16.833 1.00 62.21 C ATOM 1007 OD1 ASP A 60 8.364 -3.744 -17.811 1.00 71.14 O ATOM 1008 OD2 ASP A 60 7.677 -2.931 -15.889 1.00 13.41 O ATOM 0 H ASP A 60 11.900 -0.960 -17.142 1.00 14.33 H new ATOM 0 HA ASP A 60 11.101 -3.414 -15.886 1.00 44.45 H new ATOM 0 HB2 ASP A 60 9.652 -1.445 -15.891 1.00 73.31 H new ATOM 0 HB3 ASP A 60 9.668 -1.383 -17.642 1.00 73.31 H new ATOM 1013 N ARG A 61 11.497 -3.297 -19.137 1.00 5.23 N ATOM 1014 CA ARG A 61 11.573 -4.111 -20.344 1.00 11.40 C ATOM 1015 C ARG A 61 12.786 -5.035 -20.301 1.00 71.34 C ATOM 1016 O ARG A 61 12.731 -6.168 -20.778 1.00 31.40 O ATOM 1017 CB ARG A 61 11.643 -3.217 -21.584 1.00 11.25 C ATOM 1018 CG ARG A 61 10.531 -3.478 -22.587 1.00 22.34 C ATOM 1019 CD ARG A 61 9.605 -2.279 -22.717 1.00 63.22 C ATOM 1020 NE ARG A 61 8.804 -2.337 -23.937 1.00 13.04 N ATOM 1021 CZ ARG A 61 8.255 -1.270 -24.507 1.00 1.13 C ATOM 1022 NH1 ARG A 61 8.421 -0.069 -23.971 1.00 2.33 N ATOM 1023 NH2 ARG A 61 7.539 -1.403 -25.616 1.00 31.22 N ATOM 0 H ARG A 61 11.814 -2.335 -19.256 1.00 5.23 H new ATOM 0 HA ARG A 61 10.673 -4.724 -20.396 1.00 11.40 H new ATOM 0 HB2 ARG A 61 11.602 -2.173 -21.272 1.00 11.25 H new ATOM 0 HB3 ARG A 61 12.605 -3.365 -22.074 1.00 11.25 H new ATOM 0 HG2 ARG A 61 10.964 -3.712 -23.560 1.00 22.34 H new ATOM 0 HG3 ARG A 61 9.957 -4.351 -22.276 1.00 22.34 H new ATOM 0 HD2 ARG A 61 8.944 -2.235 -21.851 1.00 63.22 H new ATOM 0 HD3 ARG A 61 10.195 -1.363 -22.714 1.00 63.22 H new ATOM 0 HE ARG A 61 8.658 -3.246 -24.375 1.00 13.04 H new ATOM 0 HH11 ARG A 61 8.971 0.038 -23.119 1.00 2.33 H new ATOM 0 HH12 ARG A 61 7.998 0.749 -24.411 1.00 2.33 H new ATOM 0 HH21 ARG A 61 7.410 -2.325 -26.032 1.00 31.22 H new ATOM 0 HH22 ARG A 61 7.118 -0.583 -26.053 1.00 31.22 H new ATOM 1037 N GLU A 62 13.879 -4.543 -19.728 1.00 4.30 N ATOM 1038 CA GLU A 62 15.106 -5.325 -19.625 1.00 73.00 C ATOM 1039 C GLU A 62 14.935 -6.476 -18.638 1.00 62.42 C ATOM 1040 O GLU A 62 15.462 -7.570 -18.845 1.00 43.42 O ATOM 1041 CB GLU A 62 16.271 -4.434 -19.189 1.00 54.34 C ATOM 1042 CG GLU A 62 16.421 -4.322 -17.682 1.00 20.45 C ATOM 1043 CD GLU A 62 17.201 -5.479 -17.086 1.00 51.42 C ATOM 1044 OE1 GLU A 62 17.628 -6.365 -17.856 1.00 55.52 O ATOM 1045 OE2 GLU A 62 17.384 -5.498 -15.851 1.00 43.22 O ATOM 0 H GLU A 62 13.941 -3.607 -19.328 1.00 4.30 H new ATOM 0 HA GLU A 62 15.325 -5.741 -20.608 1.00 73.00 H new ATOM 0 HB2 GLU A 62 17.196 -4.829 -19.609 1.00 54.34 H new ATOM 0 HB3 GLU A 62 16.131 -3.437 -19.607 1.00 54.34 H new ATOM 0 HG2 GLU A 62 16.924 -3.386 -17.439 1.00 20.45 H new ATOM 0 HG3 GLU A 62 15.433 -4.281 -17.224 1.00 20.45 H new ATOM 1052 N VAL A 63 14.195 -6.222 -17.563 1.00 63.35 N ATOM 1053 CA VAL A 63 13.954 -7.236 -16.544 1.00 62.51 C ATOM 1054 C VAL A 63 12.943 -8.270 -17.026 1.00 34.22 C ATOM 1055 O VAL A 63 13.109 -9.470 -16.801 1.00 43.13 O ATOM 1056 CB VAL A 63 13.444 -6.606 -15.235 1.00 13.02 C ATOM 1057 CG1 VAL A 63 14.492 -5.674 -14.646 1.00 63.52 C ATOM 1058 CG2 VAL A 63 12.136 -5.867 -15.474 1.00 41.55 C ATOM 0 H VAL A 63 13.752 -5.322 -17.376 1.00 63.35 H new ATOM 0 HA VAL A 63 14.908 -7.727 -16.354 1.00 62.51 H new ATOM 0 HB VAL A 63 13.258 -7.404 -14.517 1.00 13.02 H new ATOM 0 HG11 VAL A 63 14.113 -5.238 -13.721 1.00 63.52 H new ATOM 0 HG12 VAL A 63 15.402 -6.236 -14.436 1.00 63.52 H new ATOM 0 HG13 VAL A 63 14.713 -4.879 -15.358 1.00 63.52 H new ATOM 0 HG21 VAL A 63 11.790 -5.428 -14.538 1.00 41.55 H new ATOM 0 HG22 VAL A 63 12.293 -5.078 -16.209 1.00 41.55 H new ATOM 0 HG23 VAL A 63 11.386 -6.565 -15.846 1.00 41.55 H new ATOM 1068 N LEU A 64 11.893 -7.798 -17.689 1.00 62.15 N ATOM 1069 CA LEU A 64 10.853 -8.682 -18.205 1.00 11.34 C ATOM 1070 C LEU A 64 11.424 -9.656 -19.230 1.00 43.41 C ATOM 1071 O LEU A 64 11.138 -10.852 -19.191 1.00 61.32 O ATOM 1072 CB LEU A 64 9.726 -7.862 -18.836 1.00 2.25 C ATOM 1073 CG LEU A 64 8.379 -7.905 -18.113 1.00 42.50 C ATOM 1074 CD1 LEU A 64 8.583 -7.998 -16.609 1.00 21.21 C ATOM 1075 CD2 LEU A 64 7.546 -6.681 -18.465 1.00 41.30 C ATOM 0 H LEU A 64 11.739 -6.808 -17.882 1.00 62.15 H new ATOM 0 HA LEU A 64 10.453 -9.257 -17.370 1.00 11.34 H new ATOM 0 HB2 LEU A 64 10.050 -6.823 -18.897 1.00 2.25 H new ATOM 0 HB3 LEU A 64 9.578 -8.211 -19.858 1.00 2.25 H new ATOM 0 HG LEU A 64 7.840 -8.794 -18.441 1.00 42.50 H new ATOM 0 HD11 LEU A 64 7.614 -8.028 -16.111 1.00 21.21 H new ATOM 0 HD12 LEU A 64 9.140 -8.905 -16.373 1.00 21.21 H new ATOM 0 HD13 LEU A 64 9.142 -7.128 -16.263 1.00 21.21 H new ATOM 0 HD21 LEU A 64 6.591 -6.728 -17.942 1.00 41.30 H new ATOM 0 HD22 LEU A 64 8.080 -5.779 -18.165 1.00 41.30 H new ATOM 0 HD23 LEU A 64 7.370 -6.658 -19.540 1.00 41.30 H new ATOM 1087 N ASP A 65 12.235 -9.135 -20.145 1.00 54.00 N ATOM 1088 CA ASP A 65 12.850 -9.959 -21.179 1.00 55.14 C ATOM 1089 C ASP A 65 13.833 -10.953 -20.569 1.00 40.43 C ATOM 1090 O ASP A 65 13.884 -12.115 -20.968 1.00 74.24 O ATOM 1091 CB ASP A 65 13.565 -9.078 -22.205 1.00 3.15 C ATOM 1092 CG ASP A 65 13.131 -9.374 -23.626 1.00 73.44 C ATOM 1093 OD1 ASP A 65 11.986 -9.025 -23.981 1.00 73.24 O ATOM 1094 OD2 ASP A 65 13.935 -9.956 -24.384 1.00 24.40 O ATOM 0 H ASP A 65 12.481 -8.146 -20.191 1.00 54.00 H new ATOM 0 HA ASP A 65 12.060 -10.519 -21.680 1.00 55.14 H new ATOM 0 HB2 ASP A 65 13.368 -8.030 -21.979 1.00 3.15 H new ATOM 0 HB3 ASP A 65 14.641 -9.226 -22.119 1.00 3.15 H new ATOM 1099 N ASN A 66 14.614 -10.486 -19.600 1.00 53.33 N ATOM 1100 CA ASN A 66 15.597 -11.333 -18.936 1.00 64.21 C ATOM 1101 C ASN A 66 14.912 -12.428 -18.124 1.00 23.10 C ATOM 1102 O ASN A 66 15.291 -13.597 -18.196 1.00 20.21 O ATOM 1103 CB ASN A 66 16.494 -10.492 -18.025 1.00 32.10 C ATOM 1104 CG ASN A 66 17.645 -11.293 -17.447 1.00 15.01 C ATOM 1105 OD1 ASN A 66 17.400 -11.951 -16.319 1.00 1.01 O flip ATOM 1106 ND2 ASN A 66 18.740 -11.320 -18.008 1.00 40.45 N flip ATOM 0 H ASN A 66 14.585 -9.526 -19.258 1.00 53.33 H new ATOM 0 HA ASN A 66 16.211 -11.805 -19.704 1.00 64.21 H new ATOM 0 HB2 ASN A 66 16.890 -9.647 -18.589 1.00 32.10 H new ATOM 0 HB3 ASN A 66 15.897 -10.080 -17.211 1.00 32.10 H new ATOM 0 HD21 ASN A 66 18.883 -10.799 -18.873 1.00 40.45 H new ATOM 0 HD22 ASN A 66 19.505 -11.863 -17.608 1.00 40.45 H new ATOM 1113 N TRP A 67 13.903 -12.041 -17.353 1.00 54.21 N ATOM 1114 CA TRP A 67 13.164 -12.990 -16.528 1.00 11.33 C ATOM 1115 C TRP A 67 12.612 -14.132 -17.373 1.00 71.21 C ATOM 1116 O TRP A 67 12.766 -15.303 -17.026 1.00 72.43 O ATOM 1117 CB TRP A 67 12.022 -12.281 -15.798 1.00 13.12 C ATOM 1118 CG TRP A 67 10.719 -13.018 -15.875 1.00 62.41 C ATOM 1119 CD1 TRP A 67 9.650 -12.712 -16.668 1.00 31.34 C ATOM 1120 CD2 TRP A 67 10.349 -14.184 -15.130 1.00 54.43 C ATOM 1121 NE1 TRP A 67 8.637 -13.617 -16.460 1.00 72.12 N ATOM 1122 CE2 TRP A 67 9.041 -14.530 -15.523 1.00 32.25 C ATOM 1123 CE3 TRP A 67 10.995 -14.969 -14.172 1.00 13.01 C ATOM 1124 CZ2 TRP A 67 8.370 -15.627 -14.988 1.00 13.42 C ATOM 1125 CZ3 TRP A 67 10.327 -16.057 -13.642 1.00 41.40 C ATOM 1126 CH2 TRP A 67 9.026 -16.378 -14.051 1.00 41.02 C ATOM 0 H TRP A 67 13.577 -11.077 -17.282 1.00 54.21 H new ATOM 0 HA TRP A 67 13.852 -13.407 -15.793 1.00 11.33 H new ATOM 0 HB2 TRP A 67 12.296 -12.150 -14.751 1.00 13.12 H new ATOM 0 HB3 TRP A 67 11.893 -11.285 -16.221 1.00 13.12 H new ATOM 0 HD1 TRP A 67 9.607 -11.881 -17.357 1.00 31.34 H new ATOM 0 HE1 TRP A 67 7.731 -13.610 -16.928 1.00 72.12 H new ATOM 0 HE3 TRP A 67 11.998 -14.730 -13.851 1.00 13.01 H new ATOM 0 HZ2 TRP A 67 7.367 -15.876 -15.302 1.00 13.42 H new ATOM 0 HZ3 TRP A 67 10.816 -16.670 -12.900 1.00 41.40 H new ATOM 0 HH2 TRP A 67 8.531 -17.235 -13.618 1.00 41.02 H new ATOM 1137 N ARG A 68 11.969 -13.784 -18.483 1.00 62.41 N ATOM 1138 CA ARG A 68 11.394 -14.782 -19.377 1.00 53.11 C ATOM 1139 C ARG A 68 12.485 -15.644 -20.005 1.00 3.32 C ATOM 1140 O ARG A 68 12.234 -16.774 -20.420 1.00 60.34 O ATOM 1141 CB ARG A 68 10.572 -14.101 -20.474 1.00 25.51 C ATOM 1142 CG ARG A 68 11.353 -13.855 -21.755 1.00 13.03 C ATOM 1143 CD ARG A 68 10.844 -12.624 -22.488 1.00 45.24 C ATOM 1144 NE ARG A 68 9.981 -12.974 -23.613 1.00 34.34 N ATOM 1145 CZ ARG A 68 8.676 -13.196 -23.496 1.00 1.02 C ATOM 1146 NH1 ARG A 68 8.088 -13.103 -22.311 1.00 61.50 N ATOM 1147 NH2 ARG A 68 7.957 -13.510 -24.566 1.00 31.44 N ATOM 0 H ARG A 68 11.833 -12.819 -18.785 1.00 62.41 H new ATOM 0 HA ARG A 68 10.741 -15.426 -18.789 1.00 53.11 H new ATOM 0 HB2 ARG A 68 9.703 -14.718 -20.701 1.00 25.51 H new ATOM 0 HB3 ARG A 68 10.198 -13.149 -20.098 1.00 25.51 H new ATOM 0 HG2 ARG A 68 12.410 -13.729 -21.520 1.00 13.03 H new ATOM 0 HG3 ARG A 68 11.273 -14.726 -22.405 1.00 13.03 H new ATOM 0 HD2 ARG A 68 10.294 -11.990 -21.793 1.00 45.24 H new ATOM 0 HD3 ARG A 68 11.691 -12.041 -22.849 1.00 45.24 H new ATOM 0 HE ARG A 68 10.403 -13.052 -24.538 1.00 34.34 H new ATOM 0 HH11 ARG A 68 8.638 -12.861 -21.487 1.00 61.50 H new ATOM 0 HH12 ARG A 68 7.086 -13.274 -22.224 1.00 61.50 H new ATOM 0 HH21 ARG A 68 8.406 -13.581 -25.479 1.00 31.44 H new ATOM 0 HH22 ARG A 68 6.955 -13.680 -24.475 1.00 31.44 H new ATOM 1161 N GLU A 69 13.697 -15.100 -20.070 1.00 71.41 N ATOM 1162 CA GLU A 69 14.826 -15.820 -20.648 1.00 53.35 C ATOM 1163 C GLU A 69 15.294 -16.935 -19.719 1.00 22.25 C ATOM 1164 O GLU A 69 15.763 -17.980 -20.171 1.00 63.40 O ATOM 1165 CB GLU A 69 15.981 -14.858 -20.931 1.00 44.52 C ATOM 1166 CG GLU A 69 17.157 -15.024 -19.984 1.00 5.34 C ATOM 1167 CD GLU A 69 18.019 -16.223 -20.327 1.00 73.54 C ATOM 1168 OE1 GLU A 69 18.440 -16.334 -21.498 1.00 24.32 O ATOM 1169 OE2 GLU A 69 18.271 -17.051 -19.427 1.00 73.21 O ATOM 0 H GLU A 69 13.922 -14.165 -19.730 1.00 71.41 H new ATOM 0 HA GLU A 69 14.497 -16.267 -21.586 1.00 53.35 H new ATOM 0 HB2 GLU A 69 16.325 -15.008 -21.954 1.00 44.52 H new ATOM 0 HB3 GLU A 69 15.614 -13.834 -20.865 1.00 44.52 H new ATOM 0 HG2 GLU A 69 17.769 -14.122 -20.010 1.00 5.34 H new ATOM 0 HG3 GLU A 69 16.786 -15.128 -18.965 1.00 5.34 H new ATOM 1176 N LEU A 70 15.164 -16.705 -18.417 1.00 23.44 N ATOM 1177 CA LEU A 70 15.574 -17.690 -17.421 1.00 43.02 C ATOM 1178 C LEU A 70 14.536 -18.800 -17.294 1.00 23.32 C ATOM 1179 O LEU A 70 14.882 -19.974 -17.163 1.00 44.13 O ATOM 1180 CB LEU A 70 15.785 -17.015 -16.065 1.00 24.33 C ATOM 1181 CG LEU A 70 16.468 -15.647 -16.094 1.00 74.24 C ATOM 1182 CD1 LEU A 70 15.882 -14.735 -15.027 1.00 70.44 C ATOM 1183 CD2 LEU A 70 17.970 -15.796 -15.905 1.00 62.30 C ATOM 0 H LEU A 70 14.778 -15.846 -18.026 1.00 23.44 H new ATOM 0 HA LEU A 70 16.514 -18.133 -17.749 1.00 43.02 H new ATOM 0 HB2 LEU A 70 14.814 -16.904 -15.582 1.00 24.33 H new ATOM 0 HB3 LEU A 70 16.378 -17.681 -15.438 1.00 24.33 H new ATOM 0 HG LEU A 70 16.289 -15.194 -17.069 1.00 74.24 H new ATOM 0 HD11 LEU A 70 16.380 -13.766 -15.063 1.00 70.44 H new ATOM 0 HD12 LEU A 70 14.816 -14.601 -15.208 1.00 70.44 H new ATOM 0 HD13 LEU A 70 16.030 -15.183 -14.044 1.00 70.44 H new ATOM 0 HD21 LEU A 70 18.439 -14.812 -15.928 1.00 62.30 H new ATOM 0 HD22 LEU A 70 18.171 -16.271 -14.945 1.00 62.30 H new ATOM 0 HD23 LEU A 70 18.378 -16.412 -16.706 1.00 62.30 H new ATOM 1195 N GLU A 71 13.263 -18.421 -17.335 1.00 11.43 N ATOM 1196 CA GLU A 71 12.175 -19.385 -17.225 1.00 70.31 C ATOM 1197 C GLU A 71 12.126 -20.292 -18.452 1.00 1.14 C ATOM 1198 O GLU A 71 11.685 -21.438 -18.372 1.00 13.10 O ATOM 1199 CB GLU A 71 10.837 -18.662 -17.058 1.00 41.14 C ATOM 1200 CG GLU A 71 9.664 -19.598 -16.821 1.00 23.25 C ATOM 1201 CD GLU A 71 8.327 -18.940 -17.098 1.00 13.01 C ATOM 1202 OE1 GLU A 71 8.200 -18.269 -18.143 1.00 64.03 O ATOM 1203 OE2 GLU A 71 7.406 -19.097 -16.269 1.00 11.43 O ATOM 0 H GLU A 71 12.960 -17.453 -17.444 1.00 11.43 H new ATOM 0 HA GLU A 71 12.358 -20.002 -16.345 1.00 70.31 H new ATOM 0 HB2 GLU A 71 10.911 -17.967 -16.221 1.00 41.14 H new ATOM 0 HB3 GLU A 71 10.641 -18.067 -17.950 1.00 41.14 H new ATOM 0 HG2 GLU A 71 9.771 -20.477 -17.457 1.00 23.25 H new ATOM 0 HG3 GLU A 71 9.686 -19.947 -15.789 1.00 23.25 H new ATOM 1210 N MET A 72 12.582 -19.769 -19.585 1.00 63.20 N ATOM 1211 CA MET A 72 12.591 -20.531 -20.828 1.00 63.14 C ATOM 1212 C MET A 72 13.871 -21.351 -20.954 1.00 64.03 C ATOM 1213 O MET A 72 13.916 -22.344 -21.680 1.00 70.44 O ATOM 1214 CB MET A 72 12.453 -19.592 -22.028 1.00 43.12 C ATOM 1215 CG MET A 72 13.737 -18.855 -22.374 1.00 11.45 C ATOM 1216 SD MET A 72 13.610 -17.921 -23.911 1.00 34.02 S ATOM 1217 CE MET A 72 12.234 -16.837 -23.536 1.00 2.35 C ATOM 0 H MET A 72 12.950 -18.821 -19.668 1.00 63.20 H new ATOM 0 HA MET A 72 11.743 -21.215 -20.812 1.00 63.14 H new ATOM 0 HB2 MET A 72 12.130 -20.169 -22.895 1.00 43.12 H new ATOM 0 HB3 MET A 72 11.670 -18.863 -21.820 1.00 43.12 H new ATOM 0 HG2 MET A 72 13.992 -18.176 -21.561 1.00 11.45 H new ATOM 0 HG3 MET A 72 14.553 -19.573 -22.456 1.00 11.45 H new ATOM 0 HE1 MET A 72 11.998 -16.232 -24.411 1.00 2.35 H new ATOM 0 HE2 MET A 72 11.364 -17.434 -23.263 1.00 2.35 H new ATOM 0 HE3 MET A 72 12.501 -16.184 -22.705 1.00 2.35 H new ATOM 1227 N LYS A 73 14.911 -20.929 -20.243 1.00 44.12 N ATOM 1228 CA LYS A 73 16.193 -21.624 -20.274 1.00 72.00 C ATOM 1229 C LYS A 73 16.197 -22.801 -19.304 1.00 74.31 C ATOM 1230 O LYS A 73 17.047 -23.686 -19.391 1.00 60.53 O ATOM 1231 CB LYS A 73 17.328 -20.659 -19.926 1.00 3.02 C ATOM 1232 CG LYS A 73 17.898 -19.930 -21.130 1.00 55.44 C ATOM 1233 CD LYS A 73 19.401 -20.119 -21.238 1.00 23.23 C ATOM 1234 CE LYS A 73 19.942 -19.557 -22.544 1.00 21.34 C ATOM 1235 NZ LYS A 73 21.069 -18.611 -22.316 1.00 12.43 N ATOM 0 H LYS A 73 14.891 -20.108 -19.638 1.00 44.12 H new ATOM 0 HA LYS A 73 16.346 -22.007 -21.283 1.00 72.00 H new ATOM 0 HB2 LYS A 73 16.962 -19.925 -19.207 1.00 3.02 H new ATOM 0 HB3 LYS A 73 18.128 -21.214 -19.436 1.00 3.02 H new ATOM 0 HG2 LYS A 73 17.419 -20.296 -22.038 1.00 55.44 H new ATOM 0 HG3 LYS A 73 17.669 -18.867 -21.055 1.00 55.44 H new ATOM 0 HD2 LYS A 73 19.892 -19.627 -20.398 1.00 23.23 H new ATOM 0 HD3 LYS A 73 19.641 -21.180 -21.170 1.00 23.23 H new ATOM 0 HE2 LYS A 73 20.278 -20.376 -23.180 1.00 21.34 H new ATOM 0 HE3 LYS A 73 19.141 -19.046 -23.079 1.00 21.34 H new ATOM 0 HZ1 LYS A 73 21.410 -18.250 -23.230 1.00 12.43 H new ATOM 0 HZ2 LYS A 73 20.742 -17.816 -21.730 1.00 12.43 H new ATOM 0 HZ3 LYS A 73 21.844 -19.105 -21.828 1.00 12.43 H new ATOM 1249 N ALA A 74 15.240 -22.805 -18.382 1.00 30.34 N ATOM 1250 CA ALA A 74 15.132 -23.876 -17.398 1.00 54.41 C ATOM 1251 C ALA A 74 14.550 -25.139 -18.024 1.00 25.14 C ATOM 1252 O ALA A 74 14.371 -26.152 -17.347 1.00 42.02 O ATOM 1253 CB ALA A 74 14.278 -23.426 -16.221 1.00 63.52 C ATOM 0 H ALA A 74 14.529 -22.079 -18.296 1.00 30.34 H new ATOM 0 HA ALA A 74 16.134 -24.109 -17.038 1.00 54.41 H new ATOM 0 HB1 ALA A 74 14.205 -24.235 -15.494 1.00 63.52 H new ATOM 0 HB2 ALA A 74 14.736 -22.556 -15.751 1.00 63.52 H new ATOM 0 HB3 ALA A 74 13.280 -23.165 -16.574 1.00 63.52 H new ATOM 1259 N ARG A 75 14.257 -25.072 -19.318 1.00 65.02 N ATOM 1260 CA ARG A 75 13.695 -26.211 -20.034 1.00 54.51 C ATOM 1261 C ARG A 75 12.517 -26.806 -19.268 1.00 71.11 C ATOM 1262 O ARG A 75 12.302 -28.018 -19.283 1.00 33.23 O ATOM 1263 CB ARG A 75 14.765 -27.280 -20.257 1.00 23.23 C ATOM 1264 CG ARG A 75 14.496 -28.171 -21.459 1.00 11.24 C ATOM 1265 CD ARG A 75 14.830 -27.463 -22.762 1.00 53.04 C ATOM 1266 NE ARG A 75 14.305 -28.178 -23.923 1.00 43.31 N ATOM 1267 CZ ARG A 75 14.407 -27.730 -25.170 1.00 3.05 C ATOM 1268 NH1 ARG A 75 15.011 -26.576 -25.416 1.00 4.35 N ATOM 1269 NH2 ARG A 75 13.905 -28.438 -26.173 1.00 52.32 N ATOM 0 H ARG A 75 14.399 -24.241 -19.892 1.00 65.02 H new ATOM 0 HA ARG A 75 13.337 -25.859 -21.002 1.00 54.51 H new ATOM 0 HB2 ARG A 75 15.732 -26.793 -20.386 1.00 23.23 H new ATOM 0 HB3 ARG A 75 14.837 -27.901 -19.364 1.00 23.23 H new ATOM 0 HG2 ARG A 75 15.087 -29.083 -21.377 1.00 11.24 H new ATOM 0 HG3 ARG A 75 13.448 -28.470 -21.464 1.00 11.24 H new ATOM 0 HD2 ARG A 75 14.419 -26.453 -22.742 1.00 53.04 H new ATOM 0 HD3 ARG A 75 15.912 -27.365 -22.855 1.00 53.04 H new ATOM 0 HE ARG A 75 13.835 -29.070 -23.768 1.00 43.31 H new ATOM 0 HH11 ARG A 75 15.399 -26.029 -24.647 1.00 4.35 H new ATOM 0 HH12 ARG A 75 15.088 -26.235 -26.374 1.00 4.35 H new ATOM 0 HH21 ARG A 75 13.440 -29.327 -25.987 1.00 52.32 H new ATOM 0 HH22 ARG A 75 13.984 -28.094 -27.130 1.00 52.32 H new ATOM 1283 N LYS A 76 11.757 -25.946 -18.599 1.00 1.40 N ATOM 1284 CA LYS A 76 10.601 -26.385 -17.827 1.00 54.32 C ATOM 1285 C LYS A 76 9.906 -25.199 -17.165 1.00 42.11 C ATOM 1286 O LYS A 76 10.364 -24.061 -17.272 1.00 11.02 O ATOM 1287 CB LYS A 76 11.027 -27.399 -16.763 1.00 52.13 C ATOM 1288 CG LYS A 76 10.118 -28.613 -16.681 1.00 55.24 C ATOM 1289 CD LYS A 76 9.464 -28.729 -15.314 1.00 43.14 C ATOM 1290 CE LYS A 76 9.023 -30.156 -15.027 1.00 54.21 C ATOM 1291 NZ LYS A 76 8.080 -30.224 -13.876 1.00 43.40 N ATOM 0 H LYS A 76 11.921 -24.940 -18.576 1.00 1.40 H new ATOM 0 HA LYS A 76 9.898 -26.860 -18.511 1.00 54.32 H new ATOM 0 HB2 LYS A 76 12.043 -27.730 -16.975 1.00 52.13 H new ATOM 0 HB3 LYS A 76 11.049 -26.906 -15.791 1.00 52.13 H new ATOM 0 HG2 LYS A 76 9.348 -28.544 -17.449 1.00 55.24 H new ATOM 0 HG3 LYS A 76 10.694 -29.515 -16.887 1.00 55.24 H new ATOM 0 HD2 LYS A 76 10.164 -28.402 -14.545 1.00 43.14 H new ATOM 0 HD3 LYS A 76 8.602 -28.064 -15.264 1.00 43.14 H new ATOM 0 HE2 LYS A 76 8.545 -30.574 -15.913 1.00 54.21 H new ATOM 0 HE3 LYS A 76 9.898 -30.771 -14.817 1.00 54.21 H new ATOM 0 HZ1 LYS A 76 7.803 -31.213 -13.712 1.00 43.40 H new ATOM 0 HZ2 LYS A 76 8.544 -29.849 -13.024 1.00 43.40 H new ATOM 0 HZ3 LYS A 76 7.234 -29.658 -14.087 1.00 43.40 H new ATOM 1305 N ARG A 77 8.801 -25.473 -16.481 1.00 34.25 N ATOM 1306 CA ARG A 77 8.044 -24.429 -15.801 1.00 11.41 C ATOM 1307 C ARG A 77 8.159 -24.572 -14.286 1.00 75.31 C ATOM 1308 O ARG A 77 7.410 -25.328 -13.665 1.00 13.31 O ATOM 1309 CB ARG A 77 6.573 -24.481 -16.219 1.00 43.50 C ATOM 1310 CG ARG A 77 5.991 -25.885 -16.226 1.00 2.45 C ATOM 1311 CD ARG A 77 4.559 -25.891 -16.735 1.00 75.35 C ATOM 1312 NE ARG A 77 4.479 -25.534 -18.149 1.00 62.14 N ATOM 1313 CZ ARG A 77 3.347 -25.528 -18.843 1.00 55.13 C ATOM 1314 NH1 ARG A 77 2.204 -25.857 -18.257 1.00 20.42 N ATOM 1315 NH2 ARG A 77 3.355 -25.191 -20.127 1.00 22.12 N ATOM 0 H ARG A 77 8.409 -26.410 -16.383 1.00 34.25 H new ATOM 0 HA ARG A 77 8.463 -23.465 -16.090 1.00 11.41 H new ATOM 0 HB2 ARG A 77 5.989 -23.858 -15.541 1.00 43.50 H new ATOM 0 HB3 ARG A 77 6.472 -24.050 -17.215 1.00 43.50 H new ATOM 0 HG2 ARG A 77 6.604 -26.531 -16.854 1.00 2.45 H new ATOM 0 HG3 ARG A 77 6.022 -26.298 -15.218 1.00 2.45 H new ATOM 0 HD2 ARG A 77 4.125 -26.880 -16.586 1.00 75.35 H new ATOM 0 HD3 ARG A 77 3.963 -25.190 -16.150 1.00 75.35 H new ATOM 0 HE ARG A 77 5.340 -25.275 -18.630 1.00 62.14 H new ATOM 0 HH11 ARG A 77 2.193 -26.116 -17.270 1.00 20.42 H new ATOM 0 HH12 ARG A 77 1.336 -25.851 -18.793 1.00 20.42 H new ATOM 0 HH21 ARG A 77 4.232 -24.936 -20.582 1.00 22.12 H new ATOM 0 HH22 ARG A 77 2.485 -25.187 -20.659 1.00 22.12 H new ATOM 1329 N LEU A 78 9.100 -23.844 -13.698 1.00 5.53 N ATOM 1330 CA LEU A 78 9.314 -23.890 -12.255 1.00 41.33 C ATOM 1331 C LEU A 78 8.005 -23.672 -11.504 1.00 12.43 C ATOM 1332 O LEU A 78 7.025 -23.162 -12.048 1.00 62.14 O ATOM 1333 CB LEU A 78 10.337 -22.832 -11.837 1.00 64.34 C ATOM 1334 CG LEU A 78 11.797 -23.287 -11.805 1.00 41.22 C ATOM 1335 CD1 LEU A 78 12.181 -23.944 -13.122 1.00 34.21 C ATOM 1336 CD2 LEU A 78 12.715 -22.111 -11.507 1.00 4.41 C ATOM 0 H LEU A 78 9.728 -23.214 -14.197 1.00 5.53 H new ATOM 0 HA LEU A 78 9.698 -24.878 -12.001 1.00 41.33 H new ATOM 0 HB2 LEU A 78 10.256 -21.986 -12.520 1.00 64.34 H new ATOM 0 HB3 LEU A 78 10.069 -22.468 -10.845 1.00 64.34 H new ATOM 0 HG LEU A 78 11.911 -24.023 -11.009 1.00 41.22 H new ATOM 0 HD11 LEU A 78 13.223 -24.261 -13.080 1.00 34.21 H new ATOM 0 HD12 LEU A 78 11.544 -24.812 -13.295 1.00 34.21 H new ATOM 0 HD13 LEU A 78 12.051 -23.231 -13.936 1.00 34.21 H new ATOM 0 HD21 LEU A 78 13.750 -22.453 -11.488 1.00 4.41 H new ATOM 0 HD22 LEU A 78 12.598 -21.353 -12.281 1.00 4.41 H new ATOM 0 HD23 LEU A 78 12.456 -21.684 -10.538 1.00 4.41 H new ATOM 1348 N PRO A 79 7.986 -24.064 -10.221 1.00 71.12 N ATOM 1349 CA PRO A 79 6.804 -23.919 -9.366 1.00 60.13 C ATOM 1350 C PRO A 79 6.509 -22.462 -9.027 1.00 4.02 C ATOM 1351 O PRO A 79 5.350 -22.050 -8.962 1.00 25.32 O ATOM 1352 CB PRO A 79 7.182 -24.696 -8.103 1.00 64.41 C ATOM 1353 CG PRO A 79 8.671 -24.665 -8.071 1.00 25.02 C ATOM 1354 CD PRO A 79 9.117 -24.679 -9.507 1.00 22.11 C ATOM 0 HA PRO A 79 5.901 -24.286 -9.854 1.00 60.13 H new ATOM 0 HB2 PRO A 79 6.757 -24.234 -7.212 1.00 64.41 H new ATOM 0 HB3 PRO A 79 6.808 -25.719 -8.141 1.00 64.41 H new ATOM 0 HG2 PRO A 79 9.032 -23.773 -7.559 1.00 25.02 H new ATOM 0 HG3 PRO A 79 9.068 -25.525 -7.531 1.00 25.02 H new ATOM 0 HD2 PRO A 79 10.037 -24.112 -9.648 1.00 22.11 H new ATOM 0 HD3 PRO A 79 9.310 -25.693 -9.858 1.00 22.11 H new ATOM 1362 N THR A 80 7.566 -21.684 -8.811 1.00 53.12 N ATOM 1363 CA THR A 80 7.420 -20.273 -8.478 1.00 1.32 C ATOM 1364 C THR A 80 7.507 -19.401 -9.725 1.00 60.14 C ATOM 1365 O THR A 80 7.824 -19.885 -10.813 1.00 13.51 O ATOM 1366 CB THR A 80 8.496 -19.819 -7.473 1.00 34.14 C ATOM 1367 OG1 THR A 80 9.240 -20.951 -7.008 1.00 1.41 O ATOM 1368 CG2 THR A 80 7.863 -19.102 -6.290 1.00 14.32 C ATOM 0 H THR A 80 8.532 -22.008 -8.861 1.00 53.12 H new ATOM 0 HA THR A 80 6.436 -20.156 -8.024 1.00 1.32 H new ATOM 0 HB THR A 80 9.167 -19.126 -7.981 1.00 34.14 H new ATOM 0 HG1 THR A 80 9.892 -20.661 -6.336 1.00 1.41 H new ATOM 0 HG21 THR A 80 8.642 -18.791 -5.594 1.00 14.32 H new ATOM 0 HG22 THR A 80 7.321 -18.225 -6.644 1.00 14.32 H new ATOM 0 HG23 THR A 80 7.172 -19.776 -5.784 1.00 14.32 H new ATOM 1376 N THR A 81 7.224 -18.112 -9.562 1.00 65.33 N ATOM 1377 CA THR A 81 7.270 -17.173 -10.676 1.00 3.03 C ATOM 1378 C THR A 81 8.270 -16.053 -10.409 1.00 74.03 C ATOM 1379 O THR A 81 8.732 -15.386 -11.336 1.00 72.10 O ATOM 1380 CB THR A 81 5.885 -16.556 -10.948 1.00 4.15 C ATOM 1381 OG1 THR A 81 4.950 -17.584 -11.293 1.00 2.04 O ATOM 1382 CG2 THR A 81 5.960 -15.533 -12.071 1.00 73.11 C ATOM 0 H THR A 81 6.961 -17.695 -8.669 1.00 65.33 H new ATOM 0 HA THR A 81 7.586 -17.737 -11.553 1.00 3.03 H new ATOM 0 HB THR A 81 5.551 -16.052 -10.041 1.00 4.15 H new ATOM 0 HG1 THR A 81 4.072 -17.184 -11.463 1.00 2.04 H new ATOM 0 HG21 THR A 81 4.970 -15.111 -12.245 1.00 73.11 H new ATOM 0 HG22 THR A 81 6.650 -14.737 -11.792 1.00 73.11 H new ATOM 0 HG23 THR A 81 6.313 -16.017 -12.981 1.00 73.11 H new ATOM 1390 N LEU A 82 8.600 -15.851 -9.139 1.00 21.34 N ATOM 1391 CA LEU A 82 9.546 -14.811 -8.750 1.00 25.40 C ATOM 1392 C LEU A 82 10.886 -15.418 -8.344 1.00 72.12 C ATOM 1393 O LEU A 82 11.214 -15.489 -7.160 1.00 11.44 O ATOM 1394 CB LEU A 82 8.979 -13.983 -7.596 1.00 54.34 C ATOM 1395 CG LEU A 82 8.172 -12.745 -7.992 1.00 64.23 C ATOM 1396 CD1 LEU A 82 7.628 -12.045 -6.757 1.00 33.31 C ATOM 1397 CD2 LEU A 82 9.028 -11.792 -8.814 1.00 53.11 C ATOM 0 H LEU A 82 8.227 -16.394 -8.360 1.00 21.34 H new ATOM 0 HA LEU A 82 9.707 -14.161 -9.610 1.00 25.40 H new ATOM 0 HB2 LEU A 82 8.343 -14.628 -6.990 1.00 54.34 H new ATOM 0 HB3 LEU A 82 9.807 -13.665 -6.962 1.00 54.34 H new ATOM 0 HG LEU A 82 7.329 -13.065 -8.604 1.00 64.23 H new ATOM 0 HD11 LEU A 82 7.057 -11.167 -7.058 1.00 33.31 H new ATOM 0 HD12 LEU A 82 6.980 -12.728 -6.207 1.00 33.31 H new ATOM 0 HD13 LEU A 82 8.456 -11.738 -6.119 1.00 33.31 H new ATOM 0 HD21 LEU A 82 8.438 -10.917 -9.087 1.00 53.11 H new ATOM 0 HD22 LEU A 82 9.891 -11.479 -8.226 1.00 53.11 H new ATOM 0 HD23 LEU A 82 9.369 -12.297 -9.718 1.00 53.11 H new ATOM 1409 N PHE A 83 11.657 -15.853 -9.335 1.00 60.12 N ATOM 1410 CA PHE A 83 12.962 -16.453 -9.082 1.00 11.33 C ATOM 1411 C PHE A 83 14.019 -15.868 -10.014 1.00 23.33 C ATOM 1412 O PHE A 83 13.696 -15.254 -11.030 1.00 54.51 O ATOM 1413 CB PHE A 83 12.892 -17.971 -9.259 1.00 43.12 C ATOM 1414 CG PHE A 83 12.386 -18.394 -10.608 1.00 74.13 C ATOM 1415 CD1 PHE A 83 13.139 -18.167 -11.749 1.00 23.04 C ATOM 1416 CD2 PHE A 83 11.155 -19.018 -10.736 1.00 63.43 C ATOM 1417 CE1 PHE A 83 12.676 -18.556 -12.992 1.00 1.54 C ATOM 1418 CE2 PHE A 83 10.687 -19.409 -11.976 1.00 62.54 C ATOM 1419 CZ PHE A 83 11.448 -19.177 -13.106 1.00 11.34 C ATOM 0 H PHE A 83 11.401 -15.801 -10.321 1.00 60.12 H new ATOM 0 HA PHE A 83 13.245 -16.227 -8.054 1.00 11.33 H new ATOM 0 HB2 PHE A 83 13.885 -18.393 -9.103 1.00 43.12 H new ATOM 0 HB3 PHE A 83 12.244 -18.389 -8.489 1.00 43.12 H new ATOM 0 HD1 PHE A 83 14.099 -17.680 -11.666 1.00 23.04 H new ATOM 0 HD2 PHE A 83 10.555 -19.201 -9.857 1.00 63.43 H new ATOM 0 HE1 PHE A 83 13.274 -18.374 -13.873 1.00 1.54 H new ATOM 0 HE2 PHE A 83 9.727 -19.896 -12.062 1.00 62.54 H new ATOM 0 HZ PHE A 83 11.083 -19.481 -14.076 1.00 11.34 H new ATOM 1429 N PHE A 84 15.285 -16.064 -9.659 1.00 60.24 N ATOM 1430 CA PHE A 84 16.391 -15.556 -10.462 1.00 41.23 C ATOM 1431 C PHE A 84 17.522 -16.577 -10.539 1.00 71.42 C ATOM 1432 O PHE A 84 17.468 -17.628 -9.899 1.00 3.45 O ATOM 1433 CB PHE A 84 16.914 -14.243 -9.875 1.00 52.15 C ATOM 1434 CG PHE A 84 17.529 -14.398 -8.514 1.00 41.31 C ATOM 1435 CD1 PHE A 84 18.710 -15.103 -8.349 1.00 43.12 C ATOM 1436 CD2 PHE A 84 16.926 -13.838 -7.399 1.00 71.51 C ATOM 1437 CE1 PHE A 84 19.279 -15.247 -7.098 1.00 4.01 C ATOM 1438 CE2 PHE A 84 17.491 -13.979 -6.145 1.00 55.24 C ATOM 1439 CZ PHE A 84 18.668 -14.685 -5.994 1.00 50.04 C ATOM 0 H PHE A 84 15.570 -16.571 -8.821 1.00 60.24 H new ATOM 0 HA PHE A 84 16.021 -15.374 -11.471 1.00 41.23 H new ATOM 0 HB2 PHE A 84 17.655 -13.820 -10.554 1.00 52.15 H new ATOM 0 HB3 PHE A 84 16.093 -13.529 -9.815 1.00 52.15 H new ATOM 0 HD1 PHE A 84 19.192 -15.545 -9.208 1.00 43.12 H new ATOM 0 HD2 PHE A 84 16.005 -13.285 -7.511 1.00 71.51 H new ATOM 0 HE1 PHE A 84 20.201 -15.798 -6.984 1.00 4.01 H new ATOM 0 HE2 PHE A 84 17.012 -13.537 -5.284 1.00 55.24 H new ATOM 0 HZ PHE A 84 19.110 -14.798 -5.015 1.00 50.04 H new ATOM 1449 N ILE A 85 18.544 -16.262 -11.328 1.00 14.32 N ATOM 1450 CA ILE A 85 19.687 -17.151 -11.488 1.00 62.14 C ATOM 1451 C ILE A 85 20.910 -16.612 -10.754 1.00 43.15 C ATOM 1452 O ILE A 85 21.108 -15.401 -10.665 1.00 44.24 O ATOM 1453 CB ILE A 85 20.041 -17.351 -12.974 1.00 53.10 C ATOM 1454 CG1 ILE A 85 20.509 -16.032 -13.591 1.00 51.53 C ATOM 1455 CG2 ILE A 85 18.843 -17.902 -13.734 1.00 24.11 C ATOM 1456 CD1 ILE A 85 21.016 -16.174 -15.009 1.00 73.14 C ATOM 0 H ILE A 85 18.603 -15.398 -11.866 1.00 14.32 H new ATOM 0 HA ILE A 85 19.402 -18.111 -11.058 1.00 62.14 H new ATOM 0 HB ILE A 85 20.855 -18.072 -13.045 1.00 53.10 H new ATOM 0 HG12 ILE A 85 19.683 -15.321 -13.579 1.00 51.53 H new ATOM 0 HG13 ILE A 85 21.301 -15.611 -12.971 1.00 51.53 H new ATOM 0 HG21 ILE A 85 19.108 -18.038 -14.782 1.00 24.11 H new ATOM 0 HG22 ILE A 85 18.551 -18.861 -13.306 1.00 24.11 H new ATOM 0 HG23 ILE A 85 18.011 -17.202 -13.658 1.00 24.11 H new ATOM 0 HD11 ILE A 85 21.331 -15.199 -15.382 1.00 73.14 H new ATOM 0 HD12 ILE A 85 21.863 -16.860 -15.026 1.00 73.14 H new ATOM 0 HD13 ILE A 85 20.220 -16.565 -15.643 1.00 73.14 H new ATOM 1468 N GLU A 86 21.728 -17.520 -10.232 1.00 23.30 N ATOM 1469 CA GLU A 86 22.933 -17.135 -9.507 1.00 2.04 C ATOM 1470 C GLU A 86 23.835 -16.263 -10.375 1.00 4.43 C ATOM 1471 O GLU A 86 24.613 -15.454 -9.867 1.00 13.33 O ATOM 1472 CB GLU A 86 23.697 -18.378 -9.046 1.00 3.01 C ATOM 1473 CG GLU A 86 24.914 -18.063 -8.192 1.00 11.21 C ATOM 1474 CD GLU A 86 24.897 -18.790 -6.862 1.00 23.54 C ATOM 1475 OE1 GLU A 86 23.976 -18.537 -6.058 1.00 20.53 O ATOM 1476 OE2 GLU A 86 25.806 -19.614 -6.625 1.00 44.41 O ATOM 0 H GLU A 86 21.578 -18.527 -10.298 1.00 23.30 H new ATOM 0 HA GLU A 86 22.631 -16.558 -8.633 1.00 2.04 H new ATOM 0 HB2 GLU A 86 23.022 -19.019 -8.479 1.00 3.01 H new ATOM 0 HB3 GLU A 86 24.015 -18.944 -9.921 1.00 3.01 H new ATOM 0 HG2 GLU A 86 25.817 -18.335 -8.739 1.00 11.21 H new ATOM 0 HG3 GLU A 86 24.960 -16.989 -8.014 1.00 11.21 H new ATOM 1483 N THR A 87 23.727 -16.433 -11.689 1.00 31.02 N ATOM 1484 CA THR A 87 24.533 -15.664 -12.628 1.00 52.14 C ATOM 1485 C THR A 87 24.018 -14.234 -12.752 1.00 62.44 C ATOM 1486 O THR A 87 24.644 -13.393 -13.398 1.00 30.04 O ATOM 1487 CB THR A 87 24.544 -16.316 -14.024 1.00 25.12 C ATOM 1488 OG1 THR A 87 23.661 -17.443 -14.045 1.00 63.11 O ATOM 1489 CG2 THR A 87 25.950 -16.759 -14.402 1.00 74.32 C ATOM 0 H THR A 87 23.089 -17.097 -12.127 1.00 31.02 H new ATOM 0 HA THR A 87 25.549 -15.649 -12.234 1.00 52.14 H new ATOM 0 HB THR A 87 24.205 -15.577 -14.750 1.00 25.12 H new ATOM 0 HG1 THR A 87 23.790 -17.944 -14.877 1.00 63.11 H new ATOM 0 HG21 THR A 87 25.934 -17.216 -15.391 1.00 74.32 H new ATOM 0 HG22 THR A 87 26.613 -15.894 -14.413 1.00 74.32 H new ATOM 0 HG23 THR A 87 26.311 -17.484 -13.673 1.00 74.32 H new ATOM 1497 N ASP A 88 22.875 -13.966 -12.130 1.00 45.05 N ATOM 1498 CA ASP A 88 22.277 -12.637 -12.170 1.00 4.41 C ATOM 1499 C ASP A 88 22.636 -11.842 -10.918 1.00 35.23 C ATOM 1500 O ASP A 88 22.575 -10.612 -10.913 1.00 23.31 O ATOM 1501 CB ASP A 88 20.758 -12.742 -12.305 1.00 15.40 C ATOM 1502 CG ASP A 88 20.136 -11.473 -12.856 1.00 63.45 C ATOM 1503 OD1 ASP A 88 20.067 -10.473 -12.111 1.00 71.51 O ATOM 1504 OD2 ASP A 88 19.720 -11.480 -14.034 1.00 23.43 O ATOM 0 H ASP A 88 22.344 -14.651 -11.592 1.00 45.05 H new ATOM 0 HA ASP A 88 22.675 -12.112 -13.038 1.00 4.41 H new ATOM 0 HB2 ASP A 88 20.511 -13.578 -12.960 1.00 15.40 H new ATOM 0 HB3 ASP A 88 20.324 -12.962 -11.330 1.00 15.40 H new ATOM 1509 N ILE A 89 23.007 -12.553 -9.858 1.00 72.14 N ATOM 1510 CA ILE A 89 23.374 -11.914 -8.601 1.00 23.21 C ATOM 1511 C ILE A 89 24.873 -12.029 -8.344 1.00 0.45 C ATOM 1512 O ILE A 89 25.479 -11.143 -7.739 1.00 73.43 O ATOM 1513 CB ILE A 89 22.612 -12.530 -7.413 1.00 23.13 C ATOM 1514 CG1 ILE A 89 21.149 -12.772 -7.787 1.00 53.14 C ATOM 1515 CG2 ILE A 89 22.710 -11.625 -6.194 1.00 41.41 C ATOM 1516 CD1 ILE A 89 20.414 -11.514 -8.195 1.00 34.22 C ATOM 0 H ILE A 89 23.061 -13.571 -9.845 1.00 72.14 H new ATOM 0 HA ILE A 89 23.102 -10.862 -8.690 1.00 23.21 H new ATOM 0 HB ILE A 89 23.068 -13.489 -7.167 1.00 23.13 H new ATOM 0 HG12 ILE A 89 21.106 -13.490 -8.606 1.00 53.14 H new ATOM 0 HG13 ILE A 89 20.635 -13.224 -6.939 1.00 53.14 H new ATOM 0 HG21 ILE A 89 22.166 -12.074 -5.363 1.00 41.41 H new ATOM 0 HG22 ILE A 89 23.757 -11.499 -5.917 1.00 41.41 H new ATOM 0 HG23 ILE A 89 22.277 -10.652 -6.427 1.00 41.41 H new ATOM 0 HD11 ILE A 89 19.383 -11.761 -8.447 1.00 34.22 H new ATOM 0 HD12 ILE A 89 20.426 -10.802 -7.370 1.00 34.22 H new ATOM 0 HD13 ILE A 89 20.903 -11.072 -9.063 1.00 34.22 H new ATOM 1528 N ARG A 90 25.466 -13.124 -8.808 1.00 14.13 N ATOM 1529 CA ARG A 90 26.894 -13.354 -8.628 1.00 60.15 C ATOM 1530 C ARG A 90 27.699 -12.128 -9.050 1.00 23.33 C ATOM 1531 O ARG A 90 28.454 -11.552 -8.266 1.00 40.33 O ATOM 1532 CB ARG A 90 27.341 -14.574 -9.437 1.00 1.44 C ATOM 1533 CG ARG A 90 28.774 -14.482 -9.935 1.00 40.12 C ATOM 1534 CD ARG A 90 29.330 -15.853 -10.288 1.00 52.33 C ATOM 1535 NE ARG A 90 29.237 -16.129 -11.719 1.00 41.24 N ATOM 1536 CZ ARG A 90 30.079 -15.634 -12.619 1.00 42.44 C ATOM 1537 NH1 ARG A 90 31.072 -14.842 -12.238 1.00 52.42 N ATOM 1538 NH2 ARG A 90 29.930 -15.931 -13.904 1.00 14.11 N ATOM 0 H ARG A 90 24.979 -13.866 -9.311 1.00 14.13 H new ATOM 0 HA ARG A 90 27.077 -13.541 -7.570 1.00 60.15 H new ATOM 0 HB2 ARG A 90 27.236 -15.467 -8.820 1.00 1.44 H new ATOM 0 HB3 ARG A 90 26.675 -14.697 -10.291 1.00 1.44 H new ATOM 0 HG2 ARG A 90 28.815 -13.835 -10.811 1.00 40.12 H new ATOM 0 HG3 ARG A 90 29.398 -14.021 -9.169 1.00 40.12 H new ATOM 0 HD2 ARG A 90 30.372 -15.913 -9.974 1.00 52.33 H new ATOM 0 HD3 ARG A 90 28.786 -16.618 -9.735 1.00 52.33 H new ATOM 0 HE ARG A 90 28.484 -16.735 -12.045 1.00 41.24 H new ATOM 0 HH11 ARG A 90 31.191 -14.612 -11.252 1.00 52.42 H new ATOM 0 HH12 ARG A 90 31.717 -14.463 -12.931 1.00 52.42 H new ATOM 0 HH21 ARG A 90 29.168 -16.540 -14.202 1.00 14.11 H new ATOM 0 HH22 ARG A 90 30.578 -15.550 -14.594 1.00 14.11 H new ATOM 1552 N PRO A 91 27.537 -11.720 -10.317 1.00 33.00 N ATOM 1553 CA PRO A 91 28.240 -10.559 -10.871 1.00 71.31 C ATOM 1554 C PRO A 91 27.743 -9.244 -10.280 1.00 61.23 C ATOM 1555 O PRO A 91 28.165 -8.167 -10.699 1.00 53.41 O ATOM 1556 CB PRO A 91 27.918 -10.630 -12.366 1.00 14.42 C ATOM 1557 CG PRO A 91 26.629 -11.373 -12.441 1.00 31.21 C ATOM 1558 CD PRO A 91 26.653 -12.360 -11.306 1.00 44.23 C ATOM 0 HA PRO A 91 29.307 -10.584 -10.649 1.00 71.31 H new ATOM 0 HB2 PRO A 91 27.827 -9.634 -12.799 1.00 14.42 H new ATOM 0 HB3 PRO A 91 28.705 -11.146 -12.916 1.00 14.42 H new ATOM 0 HG2 PRO A 91 25.781 -10.694 -12.350 1.00 31.21 H new ATOM 0 HG3 PRO A 91 26.527 -11.883 -13.399 1.00 31.21 H new ATOM 0 HD2 PRO A 91 25.655 -12.532 -10.902 1.00 44.23 H new ATOM 0 HD3 PRO A 91 27.040 -13.328 -11.624 1.00 44.23 H new ATOM 1566 N MET A 92 26.845 -9.341 -9.305 1.00 44.42 N ATOM 1567 CA MET A 92 26.293 -8.157 -8.656 1.00 32.40 C ATOM 1568 C MET A 92 26.864 -7.991 -7.251 1.00 73.52 C ATOM 1569 O MET A 92 27.036 -6.871 -6.768 1.00 75.42 O ATOM 1570 CB MET A 92 24.767 -8.251 -8.591 1.00 41.43 C ATOM 1571 CG MET A 92 24.061 -7.375 -9.614 1.00 30.12 C ATOM 1572 SD MET A 92 22.628 -6.523 -8.927 1.00 2.30 S ATOM 1573 CE MET A 92 21.844 -7.854 -8.022 1.00 32.32 C ATOM 0 H MET A 92 26.484 -10.226 -8.947 1.00 44.42 H new ATOM 0 HA MET A 92 26.572 -7.285 -9.248 1.00 32.40 H new ATOM 0 HB2 MET A 92 24.468 -9.288 -8.744 1.00 41.43 H new ATOM 0 HB3 MET A 92 24.436 -7.968 -7.592 1.00 41.43 H new ATOM 0 HG2 MET A 92 24.764 -6.639 -10.004 1.00 30.12 H new ATOM 0 HG3 MET A 92 23.744 -7.990 -10.456 1.00 30.12 H new ATOM 0 HE1 MET A 92 20.786 -7.630 -7.890 1.00 32.32 H new ATOM 0 HE2 MET A 92 21.951 -8.785 -8.579 1.00 32.32 H new ATOM 0 HE3 MET A 92 22.318 -7.959 -7.046 1.00 32.32 H new ATOM 1583 N LEU A 93 27.156 -9.112 -6.600 1.00 53.10 N ATOM 1584 CA LEU A 93 27.707 -9.091 -5.250 1.00 4.53 C ATOM 1585 C LEU A 93 29.087 -8.441 -5.236 1.00 4.14 C ATOM 1586 O LEU A 93 29.224 -7.247 -5.500 1.00 13.33 O ATOM 1587 CB LEU A 93 27.794 -10.512 -4.691 1.00 4.34 C ATOM 1588 CG LEU A 93 26.469 -11.260 -4.551 1.00 35.41 C ATOM 1589 CD1 LEU A 93 26.714 -12.717 -4.191 1.00 34.52 C ATOM 1590 CD2 LEU A 93 25.586 -10.592 -3.507 1.00 21.23 C ATOM 0 H LEU A 93 27.020 -10.047 -6.985 1.00 53.10 H new ATOM 0 HA LEU A 93 27.041 -8.500 -4.621 1.00 4.53 H new ATOM 0 HB2 LEU A 93 28.451 -11.095 -5.336 1.00 4.34 H new ATOM 0 HB3 LEU A 93 28.268 -10.467 -3.711 1.00 4.34 H new ATOM 0 HG LEU A 93 25.952 -11.226 -5.510 1.00 35.41 H new ATOM 0 HD11 LEU A 93 25.759 -13.234 -4.095 1.00 34.52 H new ATOM 0 HD12 LEU A 93 27.306 -13.191 -4.974 1.00 34.52 H new ATOM 0 HD13 LEU A 93 27.253 -12.772 -3.245 1.00 34.52 H new ATOM 0 HD21 LEU A 93 24.647 -11.139 -3.421 1.00 21.23 H new ATOM 0 HD22 LEU A 93 26.096 -10.594 -2.544 1.00 21.23 H new ATOM 0 HD23 LEU A 93 25.381 -9.564 -3.807 1.00 21.23 H new ATOM 1602 N GLN A 94 30.107 -9.236 -4.928 1.00 11.03 N ATOM 1603 CA GLN A 94 31.477 -8.738 -4.881 1.00 55.21 C ATOM 1604 C GLN A 94 32.451 -9.771 -5.437 1.00 32.11 C ATOM 1605 O GLN A 94 32.252 -10.975 -5.277 1.00 30.54 O ATOM 1606 CB GLN A 94 31.862 -8.377 -3.445 1.00 54.24 C ATOM 1607 CG GLN A 94 33.362 -8.263 -3.228 1.00 51.23 C ATOM 1608 CD GLN A 94 33.724 -7.209 -2.200 1.00 64.14 C ATOM 1609 OE1 GLN A 94 33.723 -7.472 -0.998 1.00 22.45 O ATOM 1610 NE2 GLN A 94 34.038 -6.007 -2.670 1.00 33.04 N ATOM 0 H GLN A 94 30.011 -10.227 -4.707 1.00 11.03 H new ATOM 0 HA GLN A 94 31.533 -7.843 -5.500 1.00 55.21 H new ATOM 0 HB2 GLN A 94 31.392 -7.430 -3.179 1.00 54.24 H new ATOM 0 HB3 GLN A 94 31.462 -9.133 -2.769 1.00 54.24 H new ATOM 0 HG2 GLN A 94 33.753 -9.228 -2.907 1.00 51.23 H new ATOM 0 HG3 GLN A 94 33.845 -8.023 -4.175 1.00 51.23 H new ATOM 0 HE21 GLN A 94 34.026 -5.833 -3.675 1.00 33.04 H new ATOM 0 HE22 GLN A 94 34.291 -5.258 -2.026 1.00 33.04 H new ATOM 1619 N ASP A 95 33.503 -9.293 -6.091 1.00 5.53 N ATOM 1620 CA ASP A 95 34.510 -10.175 -6.670 1.00 53.11 C ATOM 1621 C ASP A 95 35.321 -10.864 -5.578 1.00 24.50 C ATOM 1622 O ASP A 95 35.655 -12.044 -5.690 1.00 71.21 O ATOM 1623 CB ASP A 95 35.440 -9.386 -7.593 1.00 71.11 C ATOM 1624 CG ASP A 95 34.704 -8.767 -8.765 1.00 11.31 C ATOM 1625 OD1 ASP A 95 33.481 -8.990 -8.882 1.00 11.44 O ATOM 1626 OD2 ASP A 95 35.351 -8.060 -9.566 1.00 1.22 O ATOM 0 H ASP A 95 33.681 -8.299 -6.234 1.00 5.53 H new ATOM 0 HA ASP A 95 33.996 -10.940 -7.253 1.00 53.11 H new ATOM 0 HB2 ASP A 95 35.933 -8.600 -7.021 1.00 71.11 H new ATOM 0 HB3 ASP A 95 36.222 -10.047 -7.967 1.00 71.11 H new ATOM 1631 N ARG A 96 35.637 -10.120 -4.523 1.00 33.30 N ATOM 1632 CA ARG A 96 36.411 -10.659 -3.412 1.00 24.42 C ATOM 1633 C ARG A 96 35.502 -11.354 -2.402 1.00 5.33 C ATOM 1634 O ARG A 96 35.918 -11.656 -1.282 1.00 74.52 O ATOM 1635 CB ARG A 96 37.199 -9.544 -2.723 1.00 10.44 C ATOM 1636 CG ARG A 96 36.335 -8.620 -1.879 1.00 25.45 C ATOM 1637 CD ARG A 96 36.934 -8.407 -0.497 1.00 34.12 C ATOM 1638 NE ARG A 96 37.153 -9.669 0.205 1.00 2.23 N ATOM 1639 CZ ARG A 96 37.843 -9.770 1.336 1.00 31.20 C ATOM 1640 NH1 ARG A 96 38.377 -8.690 1.890 1.00 72.41 N ATOM 1641 NH2 ARG A 96 37.999 -10.954 1.915 1.00 2.33 N ATOM 0 H ARG A 96 35.369 -9.142 -4.415 1.00 33.30 H new ATOM 0 HA ARG A 96 37.109 -11.394 -3.812 1.00 24.42 H new ATOM 0 HB2 ARG A 96 37.965 -9.990 -2.089 1.00 10.44 H new ATOM 0 HB3 ARG A 96 37.715 -8.954 -3.480 1.00 10.44 H new ATOM 0 HG2 ARG A 96 36.228 -7.659 -2.383 1.00 25.45 H new ATOM 0 HG3 ARG A 96 35.335 -9.042 -1.782 1.00 25.45 H new ATOM 0 HD2 ARG A 96 37.881 -7.875 -0.590 1.00 34.12 H new ATOM 0 HD3 ARG A 96 36.270 -7.775 0.092 1.00 34.12 H new ATOM 0 HE ARG A 96 36.755 -10.519 -0.195 1.00 2.23 H new ATOM 0 HH11 ARG A 96 38.259 -7.778 1.448 1.00 72.41 H new ATOM 0 HH12 ARG A 96 38.906 -8.771 2.758 1.00 72.41 H new ATOM 0 HH21 ARG A 96 37.589 -11.787 1.492 1.00 2.33 H new ATOM 0 HH22 ARG A 96 38.529 -11.031 2.783 1.00 2.33 H new ATOM 1655 N LEU A 97 34.261 -11.603 -2.804 1.00 42.21 N ATOM 1656 CA LEU A 97 33.293 -12.261 -1.934 1.00 74.14 C ATOM 1657 C LEU A 97 33.543 -13.765 -1.880 1.00 41.23 C ATOM 1658 O LEU A 97 33.154 -14.435 -0.924 1.00 15.12 O ATOM 1659 CB LEU A 97 31.869 -11.987 -2.424 1.00 4.04 C ATOM 1660 CG LEU A 97 30.741 -12.456 -1.504 1.00 5.12 C ATOM 1661 CD1 LEU A 97 31.036 -12.076 -0.061 1.00 45.00 C ATOM 1662 CD2 LEU A 97 29.410 -11.869 -1.950 1.00 44.13 C ATOM 0 H LEU A 97 33.901 -11.359 -3.727 1.00 42.21 H new ATOM 0 HA LEU A 97 33.410 -11.855 -0.929 1.00 74.14 H new ATOM 0 HB2 LEU A 97 31.760 -10.914 -2.581 1.00 4.04 H new ATOM 0 HB3 LEU A 97 31.742 -12.466 -3.395 1.00 4.04 H new ATOM 0 HG LEU A 97 30.676 -13.542 -1.566 1.00 5.12 H new ATOM 0 HD11 LEU A 97 30.222 -12.418 0.579 1.00 45.00 H new ATOM 0 HD12 LEU A 97 31.968 -12.545 0.255 1.00 45.00 H new ATOM 0 HD13 LEU A 97 31.129 -10.993 0.018 1.00 45.00 H new ATOM 0 HD21 LEU A 97 28.619 -12.213 -1.284 1.00 44.13 H new ATOM 0 HD22 LEU A 97 29.463 -10.781 -1.918 1.00 44.13 H new ATOM 0 HD23 LEU A 97 29.193 -12.192 -2.968 1.00 44.13 H new ATOM 1674 N ARG A 98 34.197 -14.288 -2.912 1.00 4.11 N ATOM 1675 CA ARG A 98 34.501 -15.712 -2.981 1.00 61.23 C ATOM 1676 C ARG A 98 33.220 -16.538 -3.065 1.00 4.41 C ATOM 1677 O ARG A 98 32.123 -16.056 -2.784 1.00 32.15 O ATOM 1678 CB ARG A 98 35.318 -16.141 -1.761 1.00 63.23 C ATOM 1679 CG ARG A 98 36.794 -16.353 -2.060 1.00 55.42 C ATOM 1680 CD ARG A 98 37.669 -15.858 -0.920 1.00 4.32 C ATOM 1681 NE ARG A 98 37.561 -16.708 0.263 1.00 73.04 N ATOM 1682 CZ ARG A 98 38.398 -16.646 1.292 1.00 64.44 C ATOM 1683 NH1 ARG A 98 39.401 -15.779 1.284 1.00 51.34 N ATOM 1684 NH2 ARG A 98 38.234 -17.454 2.332 1.00 51.41 N ATOM 0 H ARG A 98 34.526 -13.747 -3.712 1.00 4.11 H new ATOM 0 HA ARG A 98 35.087 -15.889 -3.883 1.00 61.23 H new ATOM 0 HB2 ARG A 98 35.219 -15.384 -0.983 1.00 63.23 H new ATOM 0 HB3 ARG A 98 34.901 -17.065 -1.361 1.00 63.23 H new ATOM 0 HG2 ARG A 98 36.983 -17.413 -2.232 1.00 55.42 H new ATOM 0 HG3 ARG A 98 37.059 -15.829 -2.978 1.00 55.42 H new ATOM 0 HD2 ARG A 98 38.708 -15.825 -1.249 1.00 4.32 H new ATOM 0 HD3 ARG A 98 37.384 -14.838 -0.661 1.00 4.32 H new ATOM 0 HE ARG A 98 36.801 -17.387 0.301 1.00 73.04 H new ATOM 0 HH11 ARG A 98 39.531 -15.157 0.486 1.00 51.34 H new ATOM 0 HH12 ARG A 98 40.042 -15.734 2.076 1.00 51.34 H new ATOM 0 HH21 ARG A 98 37.464 -18.123 2.341 1.00 51.41 H new ATOM 0 HH22 ARG A 98 38.878 -17.406 3.122 1.00 51.41 H new ATOM 1698 N PRO A 99 33.362 -17.811 -3.461 1.00 72.24 N ATOM 1699 CA PRO A 99 32.227 -18.730 -3.591 1.00 63.43 C ATOM 1700 C PRO A 99 31.634 -19.114 -2.240 1.00 25.22 C ATOM 1701 O PRO A 99 31.781 -20.249 -1.787 1.00 74.41 O ATOM 1702 CB PRO A 99 32.840 -19.956 -4.274 1.00 1.12 C ATOM 1703 CG PRO A 99 34.284 -19.910 -3.910 1.00 10.31 C ATOM 1704 CD PRO A 99 34.640 -18.452 -3.813 1.00 22.02 C ATOM 0 HA PRO A 99 31.402 -18.283 -4.146 1.00 63.43 H new ATOM 0 HB2 PRO A 99 32.373 -20.878 -3.926 1.00 1.12 H new ATOM 0 HB3 PRO A 99 32.703 -19.917 -5.355 1.00 1.12 H new ATOM 0 HG2 PRO A 99 34.464 -20.420 -2.963 1.00 10.31 H new ATOM 0 HG3 PRO A 99 34.892 -20.411 -4.663 1.00 10.31 H new ATOM 0 HD2 PRO A 99 35.401 -18.274 -3.054 1.00 22.02 H new ATOM 0 HD3 PRO A 99 35.034 -18.071 -4.755 1.00 22.02 H new ATOM 1712 N SER A 100 30.965 -18.161 -1.600 1.00 53.43 N ATOM 1713 CA SER A 100 30.352 -18.398 -0.298 1.00 63.45 C ATOM 1714 C SER A 100 28.863 -18.695 -0.445 1.00 31.22 C ATOM 1715 O SER A 100 28.264 -19.357 0.403 1.00 12.23 O ATOM 1716 CB SER A 100 30.555 -17.187 0.613 1.00 2.41 C ATOM 1717 OG SER A 100 31.687 -17.360 1.448 1.00 32.42 O ATOM 0 H SER A 100 30.833 -17.217 -1.962 1.00 53.43 H new ATOM 0 HA SER A 100 30.835 -19.266 0.151 1.00 63.45 H new ATOM 0 HB2 SER A 100 30.680 -16.289 0.007 1.00 2.41 H new ATOM 0 HB3 SER A 100 29.667 -17.037 1.226 1.00 2.41 H new ATOM 0 HG SER A 100 32.083 -16.486 1.647 1.00 32.42 H new ATOM 1723 N PHE A 101 28.271 -18.201 -1.527 1.00 1.20 N ATOM 1724 CA PHE A 101 26.851 -18.411 -1.786 1.00 24.35 C ATOM 1725 C PHE A 101 26.494 -19.891 -1.686 1.00 61.50 C ATOM 1726 O PHE A 101 25.551 -20.268 -0.991 1.00 3.15 O ATOM 1727 CB PHE A 101 26.479 -17.877 -3.170 1.00 72.10 C ATOM 1728 CG PHE A 101 25.114 -17.251 -3.224 1.00 24.32 C ATOM 1729 CD1 PHE A 101 24.011 -17.920 -2.719 1.00 12.44 C ATOM 1730 CD2 PHE A 101 24.935 -15.995 -3.780 1.00 44.01 C ATOM 1731 CE1 PHE A 101 22.754 -17.346 -2.766 1.00 71.41 C ATOM 1732 CE2 PHE A 101 23.681 -15.417 -3.830 1.00 41.31 C ATOM 1733 CZ PHE A 101 22.589 -16.094 -3.324 1.00 11.34 C ATOM 0 H PHE A 101 28.753 -17.652 -2.239 1.00 1.20 H new ATOM 0 HA PHE A 101 26.284 -17.867 -1.030 1.00 24.35 H new ATOM 0 HB2 PHE A 101 27.221 -17.140 -3.478 1.00 72.10 H new ATOM 0 HB3 PHE A 101 26.524 -18.694 -3.890 1.00 72.10 H new ATOM 0 HD1 PHE A 101 24.134 -18.901 -2.284 1.00 12.44 H new ATOM 0 HD2 PHE A 101 25.785 -15.462 -4.179 1.00 44.01 H new ATOM 0 HE1 PHE A 101 21.902 -17.876 -2.367 1.00 71.41 H new ATOM 0 HE2 PHE A 101 23.555 -14.436 -4.265 1.00 41.31 H new ATOM 0 HZ PHE A 101 21.608 -15.645 -3.365 1.00 11.34 H new ATOM 1743 N ALA A 102 27.254 -20.726 -2.387 1.00 44.13 N ATOM 1744 CA ALA A 102 27.020 -22.165 -2.378 1.00 12.55 C ATOM 1745 C ALA A 102 27.005 -22.709 -0.953 1.00 40.41 C ATOM 1746 O ALA A 102 26.444 -23.772 -0.689 1.00 62.53 O ATOM 1747 CB ALA A 102 28.078 -22.878 -3.206 1.00 2.50 C ATOM 0 H ALA A 102 28.038 -20.430 -2.969 1.00 44.13 H new ATOM 0 HA ALA A 102 26.042 -22.352 -2.821 1.00 12.55 H new ATOM 0 HB1 ALA A 102 27.890 -23.952 -3.190 1.00 2.50 H new ATOM 0 HB2 ALA A 102 28.039 -22.518 -4.234 1.00 2.50 H new ATOM 0 HB3 ALA A 102 29.064 -22.676 -2.788 1.00 2.50 H new ATOM 1753 N LYS A 103 27.626 -21.973 -0.037 1.00 54.22 N ATOM 1754 CA LYS A 103 27.684 -22.380 1.362 1.00 71.45 C ATOM 1755 C LYS A 103 26.633 -21.645 2.187 1.00 74.42 C ATOM 1756 O LYS A 103 26.265 -22.086 3.276 1.00 44.24 O ATOM 1757 CB LYS A 103 29.077 -22.112 1.935 1.00 42.42 C ATOM 1758 CG LYS A 103 30.029 -23.287 1.797 1.00 71.23 C ATOM 1759 CD LYS A 103 30.699 -23.305 0.433 1.00 4.33 C ATOM 1760 CE LYS A 103 31.924 -24.207 0.426 1.00 75.54 C ATOM 1761 NZ LYS A 103 31.559 -25.634 0.201 1.00 3.20 N ATOM 0 H LYS A 103 28.097 -21.091 -0.239 1.00 54.22 H new ATOM 0 HA LYS A 103 27.477 -23.449 1.412 1.00 71.45 H new ATOM 0 HB2 LYS A 103 29.507 -21.246 1.432 1.00 42.42 H new ATOM 0 HB3 LYS A 103 28.983 -21.854 2.990 1.00 42.42 H new ATOM 0 HG2 LYS A 103 30.789 -23.234 2.576 1.00 71.23 H new ATOM 0 HG3 LYS A 103 29.483 -24.218 1.948 1.00 71.23 H new ATOM 0 HD2 LYS A 103 29.988 -23.649 -0.318 1.00 4.33 H new ATOM 0 HD3 LYS A 103 30.990 -22.292 0.156 1.00 4.33 H new ATOM 0 HE2 LYS A 103 32.612 -23.880 -0.354 1.00 75.54 H new ATOM 0 HE3 LYS A 103 32.451 -24.112 1.375 1.00 75.54 H new ATOM 0 HZ1 LYS A 103 32.420 -26.217 0.203 1.00 3.20 H new ATOM 0 HZ2 LYS A 103 30.923 -25.953 0.959 1.00 3.20 H new ATOM 0 HZ3 LYS A 103 31.079 -25.729 -0.717 1.00 3.20 H new ATOM 1775 N ALA A 104 26.151 -20.524 1.660 1.00 22.12 N ATOM 1776 CA ALA A 104 25.140 -19.731 2.347 1.00 54.52 C ATOM 1777 C ALA A 104 23.737 -20.246 2.042 1.00 23.22 C ATOM 1778 O ALA A 104 22.784 -19.938 2.758 1.00 74.32 O ATOM 1779 CB ALA A 104 25.262 -18.266 1.954 1.00 1.45 C ATOM 0 H ALA A 104 26.445 -20.145 0.760 1.00 22.12 H new ATOM 0 HA ALA A 104 25.308 -19.824 3.420 1.00 54.52 H new ATOM 0 HB1 ALA A 104 24.501 -17.685 2.475 1.00 1.45 H new ATOM 0 HB2 ALA A 104 26.250 -17.897 2.228 1.00 1.45 H new ATOM 0 HB3 ALA A 104 25.122 -18.165 0.878 1.00 1.45 H new ATOM 1785 N ILE A 105 23.619 -21.031 0.977 1.00 61.14 N ATOM 1786 CA ILE A 105 22.333 -21.589 0.578 1.00 32.34 C ATOM 1787 C ILE A 105 21.592 -22.174 1.777 1.00 45.53 C ATOM 1788 O ILE A 105 20.432 -21.856 2.036 1.00 13.40 O ATOM 1789 CB ILE A 105 22.501 -22.685 -0.491 1.00 3.13 C ATOM 1790 CG1 ILE A 105 22.993 -22.074 -1.805 1.00 31.52 C ATOM 1791 CG2 ILE A 105 21.189 -23.425 -0.702 1.00 52.34 C ATOM 1792 CD1 ILE A 105 22.188 -20.875 -2.252 1.00 53.33 C ATOM 0 H ILE A 105 24.399 -21.295 0.375 1.00 61.14 H new ATOM 0 HA ILE A 105 21.751 -20.769 0.157 1.00 32.34 H new ATOM 0 HB ILE A 105 23.246 -23.401 -0.143 1.00 3.13 H new ATOM 0 HG12 ILE A 105 24.036 -21.779 -1.691 1.00 31.52 H new ATOM 0 HG13 ILE A 105 22.960 -22.835 -2.585 1.00 31.52 H new ATOM 0 HG21 ILE A 105 21.324 -24.196 -1.460 1.00 52.34 H new ATOM 0 HG22 ILE A 105 20.877 -23.888 0.235 1.00 52.34 H new ATOM 0 HG23 ILE A 105 20.424 -22.722 -1.032 1.00 52.34 H new ATOM 0 HD11 ILE A 105 22.593 -20.494 -3.190 1.00 53.33 H new ATOM 0 HD12 ILE A 105 21.149 -21.169 -2.398 1.00 53.33 H new ATOM 0 HD13 ILE A 105 22.241 -20.097 -1.491 1.00 53.33 H new ATOM 1804 N PRO A 106 22.279 -23.048 2.527 1.00 12.24 N ATOM 1805 CA PRO A 106 21.707 -23.693 3.713 1.00 70.42 C ATOM 1806 C PRO A 106 21.503 -22.715 4.864 1.00 3.13 C ATOM 1807 O PRO A 106 20.566 -22.854 5.651 1.00 52.10 O ATOM 1808 CB PRO A 106 22.755 -24.745 4.084 1.00 30.51 C ATOM 1809 CG PRO A 106 24.034 -24.218 3.531 1.00 73.25 C ATOM 1810 CD PRO A 106 23.666 -23.473 2.277 1.00 23.11 C ATOM 0 HA PRO A 106 20.718 -24.107 3.515 1.00 70.42 H new ATOM 0 HB2 PRO A 106 22.816 -24.879 5.164 1.00 30.51 H new ATOM 0 HB3 PRO A 106 22.509 -25.717 3.656 1.00 30.51 H new ATOM 0 HG2 PRO A 106 24.527 -23.559 4.246 1.00 73.25 H new ATOM 0 HG3 PRO A 106 24.729 -25.029 3.314 1.00 73.25 H new ATOM 0 HD2 PRO A 106 24.323 -22.620 2.109 1.00 23.11 H new ATOM 0 HD3 PRO A 106 23.738 -24.110 1.395 1.00 23.11 H new ATOM 1818 N CYS A 107 22.385 -21.726 4.957 1.00 24.23 N ATOM 1819 CA CYS A 107 22.302 -20.724 6.014 1.00 42.02 C ATOM 1820 C CYS A 107 21.161 -19.748 5.749 1.00 54.13 C ATOM 1821 O CYS A 107 20.715 -19.037 6.650 1.00 2.34 O ATOM 1822 CB CYS A 107 23.624 -19.963 6.129 1.00 53.13 C ATOM 1823 SG CYS A 107 25.091 -21.019 6.075 1.00 14.33 S ATOM 0 H CYS A 107 23.166 -21.596 4.313 1.00 24.23 H new ATOM 0 HA CYS A 107 22.105 -21.239 6.954 1.00 42.02 H new ATOM 0 HB2 CYS A 107 23.683 -19.235 5.320 1.00 53.13 H new ATOM 0 HB3 CYS A 107 23.628 -19.402 7.063 1.00 53.13 H new ATOM 0 HG CYS A 107 25.304 -21.404 4.852 1.00 14.33 H new ATOM 1829 N LEU A 108 20.692 -19.718 4.506 1.00 11.40 N ATOM 1830 CA LEU A 108 19.603 -18.827 4.121 1.00 75.13 C ATOM 1831 C LEU A 108 18.254 -19.528 4.251 1.00 22.13 C ATOM 1832 O LEU A 108 17.270 -18.927 4.682 1.00 1.14 O ATOM 1833 CB LEU A 108 19.800 -18.340 2.684 1.00 12.32 C ATOM 1834 CG LEU A 108 20.499 -16.989 2.524 1.00 61.43 C ATOM 1835 CD1 LEU A 108 19.576 -15.857 2.946 1.00 4.21 C ATOM 1836 CD2 LEU A 108 21.789 -16.958 3.330 1.00 2.32 C ATOM 0 H LEU A 108 21.049 -20.300 3.748 1.00 11.40 H new ATOM 0 HA LEU A 108 19.613 -17.970 4.794 1.00 75.13 H new ATOM 0 HB2 LEU A 108 20.375 -19.091 2.143 1.00 12.32 H new ATOM 0 HB3 LEU A 108 18.823 -18.280 2.204 1.00 12.32 H new ATOM 0 HG LEU A 108 20.748 -16.852 1.472 1.00 61.43 H new ATOM 0 HD11 LEU A 108 20.091 -14.904 2.825 1.00 4.21 H new ATOM 0 HD12 LEU A 108 18.680 -15.867 2.325 1.00 4.21 H new ATOM 0 HD13 LEU A 108 19.294 -15.987 3.991 1.00 4.21 H new ATOM 0 HD21 LEU A 108 22.273 -15.990 3.205 1.00 2.32 H new ATOM 0 HD22 LEU A 108 21.563 -17.117 4.384 1.00 2.32 H new ATOM 0 HD23 LEU A 108 22.456 -17.745 2.979 1.00 2.32 H new ATOM 1848 N ARG A 109 18.217 -20.803 3.878 1.00 23.12 N ATOM 1849 CA ARG A 109 16.990 -21.586 3.955 1.00 60.44 C ATOM 1850 C ARG A 109 16.735 -22.060 5.383 1.00 64.14 C ATOM 1851 O ARG A 109 15.588 -22.212 5.802 1.00 34.31 O ATOM 1852 CB ARG A 109 17.068 -22.790 3.013 1.00 3.40 C ATOM 1853 CG ARG A 109 18.222 -23.730 3.321 1.00 10.10 C ATOM 1854 CD ARG A 109 18.623 -24.539 2.098 1.00 73.43 C ATOM 1855 NE ARG A 109 17.528 -25.376 1.612 1.00 3.04 N ATOM 1856 CZ ARG A 109 17.686 -26.350 0.723 1.00 4.10 C ATOM 1857 NH1 ARG A 109 18.888 -26.609 0.225 1.00 54.42 N ATOM 1858 NH2 ARG A 109 16.642 -27.068 0.331 1.00 53.34 N ATOM 0 H ARG A 109 19.023 -21.316 3.520 1.00 23.12 H new ATOM 0 HA ARG A 109 16.162 -20.947 3.650 1.00 60.44 H new ATOM 0 HB2 ARG A 109 16.132 -23.346 3.070 1.00 3.40 H new ATOM 0 HB3 ARG A 109 17.165 -22.433 1.988 1.00 3.40 H new ATOM 0 HG2 ARG A 109 19.077 -23.154 3.674 1.00 10.10 H new ATOM 0 HG3 ARG A 109 17.937 -24.405 4.128 1.00 10.10 H new ATOM 0 HD2 ARG A 109 18.942 -23.863 1.305 1.00 73.43 H new ATOM 0 HD3 ARG A 109 19.479 -25.168 2.344 1.00 73.43 H new ATOM 0 HE ARG A 109 16.591 -25.203 1.976 1.00 3.04 H new ATOM 0 HH11 ARG A 109 19.693 -26.060 0.525 1.00 54.42 H new ATOM 0 HH12 ARG A 109 19.007 -27.358 -0.458 1.00 54.42 H new ATOM 0 HH21 ARG A 109 15.716 -26.872 0.712 1.00 53.34 H new ATOM 0 HH22 ARG A 109 16.765 -27.816 -0.352 1.00 53.34 H new ATOM 1872 N HIS A 110 17.814 -22.292 6.125 1.00 75.13 N ATOM 1873 CA HIS A 110 17.707 -22.749 7.506 1.00 40.40 C ATOM 1874 C HIS A 110 16.873 -21.777 8.336 1.00 23.54 C ATOM 1875 O HIS A 110 16.344 -22.141 9.387 1.00 2.43 O ATOM 1876 CB HIS A 110 19.097 -22.902 8.123 1.00 24.22 C ATOM 1877 CG HIS A 110 19.071 -23.300 9.567 1.00 43.21 C ATOM 1878 ND1 HIS A 110 18.743 -24.570 9.992 1.00 52.20 N ATOM 1879 CD2 HIS A 110 19.337 -22.587 10.686 1.00 11.15 C ATOM 1880 CE1 HIS A 110 18.806 -24.620 11.311 1.00 72.55 C ATOM 1881 NE2 HIS A 110 19.165 -23.430 11.757 1.00 73.14 N ATOM 0 H HIS A 110 18.771 -22.171 5.793 1.00 75.13 H new ATOM 0 HA HIS A 110 17.209 -23.719 7.505 1.00 40.40 H new ATOM 0 HB2 HIS A 110 19.656 -23.649 7.559 1.00 24.22 H new ATOM 0 HB3 HIS A 110 19.635 -21.959 8.024 1.00 24.22 H new ATOM 0 HD2 HIS A 110 19.630 -21.548 10.729 1.00 11.15 H new ATOM 0 HE1 HIS A 110 18.599 -25.487 11.921 1.00 72.55 H new ATOM 0 HE2 HIS A 110 19.294 -23.178 12.737 1.00 73.14 H new ATOM 1889 N ILE A 111 16.762 -20.543 7.858 1.00 14.23 N ATOM 1890 CA ILE A 111 15.992 -19.521 8.557 1.00 43.53 C ATOM 1891 C ILE A 111 14.676 -19.238 7.840 1.00 2.32 C ATOM 1892 O ILE A 111 13.824 -18.510 8.350 1.00 20.01 O ATOM 1893 CB ILE A 111 16.787 -18.207 8.685 1.00 73.35 C ATOM 1894 CG1 ILE A 111 17.257 -17.734 7.308 1.00 54.15 C ATOM 1895 CG2 ILE A 111 17.972 -18.394 9.619 1.00 23.44 C ATOM 1896 CD1 ILE A 111 17.590 -16.259 7.257 1.00 75.23 C ATOM 0 H ILE A 111 17.195 -20.226 6.990 1.00 14.23 H new ATOM 0 HA ILE A 111 15.784 -19.909 9.554 1.00 43.53 H new ATOM 0 HB ILE A 111 16.133 -17.444 9.107 1.00 73.35 H new ATOM 0 HG12 ILE A 111 18.137 -18.307 7.017 1.00 54.15 H new ATOM 0 HG13 ILE A 111 16.480 -17.948 6.574 1.00 54.15 H new ATOM 0 HG21 ILE A 111 18.524 -17.457 9.699 1.00 23.44 H new ATOM 0 HG22 ILE A 111 17.615 -18.690 10.605 1.00 23.44 H new ATOM 0 HG23 ILE A 111 18.629 -19.169 9.223 1.00 23.44 H new ATOM 0 HD11 ILE A 111 17.916 -15.994 6.251 1.00 75.23 H new ATOM 0 HD12 ILE A 111 16.706 -15.677 7.517 1.00 75.23 H new ATOM 0 HD13 ILE A 111 18.389 -16.042 7.966 1.00 75.23 H new ATOM 1908 N ARG A 112 14.517 -19.819 6.656 1.00 74.30 N ATOM 1909 CA ARG A 112 13.304 -19.631 5.869 1.00 12.53 C ATOM 1910 C ARG A 112 13.242 -18.218 5.295 1.00 4.04 C ATOM 1911 O ARG A 112 12.285 -17.481 5.535 1.00 64.35 O ATOM 1912 CB ARG A 112 12.066 -19.898 6.728 1.00 5.23 C ATOM 1913 CG ARG A 112 12.180 -21.146 7.588 1.00 73.34 C ATOM 1914 CD ARG A 112 12.178 -20.805 9.069 1.00 13.35 C ATOM 1915 NE ARG A 112 11.600 -21.875 9.877 1.00 34.42 N ATOM 1916 CZ ARG A 112 11.428 -21.793 11.192 1.00 61.41 C ATOM 1917 NH1 ARG A 112 11.788 -20.696 11.844 1.00 71.34 N ATOM 1918 NH2 ARG A 112 10.895 -22.810 11.857 1.00 30.23 N ATOM 0 H ARG A 112 15.213 -20.424 6.220 1.00 74.30 H new ATOM 0 HA ARG A 112 13.324 -20.341 5.042 1.00 12.53 H new ATOM 0 HB2 ARG A 112 11.889 -19.037 7.373 1.00 5.23 H new ATOM 0 HB3 ARG A 112 11.196 -19.993 6.078 1.00 5.23 H new ATOM 0 HG2 ARG A 112 11.351 -21.818 7.367 1.00 73.34 H new ATOM 0 HG3 ARG A 112 13.097 -21.679 7.338 1.00 73.34 H new ATOM 0 HD2 ARG A 112 13.199 -20.614 9.398 1.00 13.35 H new ATOM 0 HD3 ARG A 112 11.614 -19.886 9.228 1.00 13.35 H new ATOM 0 HE ARG A 112 11.312 -22.733 9.406 1.00 34.42 H new ATOM 0 HH11 ARG A 112 12.198 -19.912 11.336 1.00 71.34 H new ATOM 0 HH12 ARG A 112 11.655 -20.636 12.853 1.00 71.34 H new ATOM 0 HH21 ARG A 112 10.617 -23.655 11.359 1.00 30.23 H new ATOM 0 HH22 ARG A 112 10.763 -22.746 12.866 1.00 30.23 H new ATOM 1932 N ARG A 113 14.270 -17.847 4.538 1.00 33.32 N ATOM 1933 CA ARG A 113 14.333 -16.523 3.932 1.00 44.01 C ATOM 1934 C ARG A 113 14.310 -16.620 2.409 1.00 24.43 C ATOM 1935 O ARG A 113 13.771 -15.746 1.730 1.00 64.32 O ATOM 1936 CB ARG A 113 15.597 -15.790 4.388 1.00 75.23 C ATOM 1937 CG ARG A 113 15.759 -14.413 3.767 1.00 40.54 C ATOM 1938 CD ARG A 113 14.977 -13.359 4.536 1.00 62.03 C ATOM 1939 NE ARG A 113 13.539 -13.473 4.312 1.00 74.23 N ATOM 1940 CZ ARG A 113 12.625 -12.925 5.106 1.00 65.13 C ATOM 1941 NH1 ARG A 113 13.000 -12.228 6.170 1.00 72.23 N ATOM 1942 NH2 ARG A 113 11.335 -13.073 4.836 1.00 72.33 N ATOM 0 H ARG A 113 15.070 -18.445 4.330 1.00 33.32 H new ATOM 0 HA ARG A 113 13.457 -15.960 4.256 1.00 44.01 H new ATOM 0 HB2 ARG A 113 15.577 -15.690 5.473 1.00 75.23 H new ATOM 0 HB3 ARG A 113 16.468 -16.396 4.140 1.00 75.23 H new ATOM 0 HG2 ARG A 113 16.815 -14.143 3.749 1.00 40.54 H new ATOM 0 HG3 ARG A 113 15.418 -14.437 2.732 1.00 40.54 H new ATOM 0 HD2 ARG A 113 15.187 -13.457 5.601 1.00 62.03 H new ATOM 0 HD3 ARG A 113 15.313 -12.367 4.235 1.00 62.03 H new ATOM 0 HE ARG A 113 13.218 -14.002 3.501 1.00 74.23 H new ATOM 0 HH11 ARG A 113 13.991 -12.112 6.380 1.00 72.23 H new ATOM 0 HH12 ARG A 113 12.297 -11.808 6.778 1.00 72.23 H new ATOM 0 HH21 ARG A 113 11.043 -13.608 4.018 1.00 72.33 H new ATOM 0 HH22 ARG A 113 10.635 -12.652 5.446 1.00 72.33 H new ATOM 1956 N ILE A 114 14.899 -17.688 1.881 1.00 32.20 N ATOM 1957 CA ILE A 114 14.945 -17.899 0.440 1.00 61.54 C ATOM 1958 C ILE A 114 14.951 -19.387 0.102 1.00 44.51 C ATOM 1959 O ILE A 114 14.904 -20.236 0.992 1.00 54.21 O ATOM 1960 CB ILE A 114 16.186 -17.237 -0.187 1.00 42.00 C ATOM 1961 CG1 ILE A 114 17.442 -18.048 0.137 1.00 65.22 C ATOM 1962 CG2 ILE A 114 16.330 -15.806 0.310 1.00 64.24 C ATOM 1963 CD1 ILE A 114 17.909 -18.922 -1.006 1.00 73.23 C ATOM 0 H ILE A 114 15.351 -18.420 2.430 1.00 32.20 H new ATOM 0 HA ILE A 114 14.049 -17.438 0.025 1.00 61.54 H new ATOM 0 HB ILE A 114 16.060 -17.215 -1.269 1.00 42.00 H new ATOM 0 HG12 ILE A 114 18.245 -17.364 0.412 1.00 65.22 H new ATOM 0 HG13 ILE A 114 17.245 -18.675 1.006 1.00 65.22 H new ATOM 0 HG21 ILE A 114 17.211 -15.351 -0.142 1.00 64.24 H new ATOM 0 HG22 ILE A 114 15.444 -15.234 0.034 1.00 64.24 H new ATOM 0 HG23 ILE A 114 16.438 -15.807 1.395 1.00 64.24 H new ATOM 0 HD11 ILE A 114 18.803 -19.468 -0.705 1.00 73.23 H new ATOM 0 HD12 ILE A 114 17.123 -19.630 -1.267 1.00 73.23 H new ATOM 0 HD13 ILE A 114 18.138 -18.299 -1.870 1.00 73.23 H new ATOM 1975 N ARG A 115 15.013 -19.694 -1.190 1.00 35.24 N ATOM 1976 CA ARG A 115 15.026 -21.079 -1.645 1.00 40.03 C ATOM 1977 C ARG A 115 15.884 -21.231 -2.898 1.00 55.33 C ATOM 1978 O ARG A 115 16.368 -20.245 -3.453 1.00 1.12 O ATOM 1979 CB ARG A 115 13.601 -21.559 -1.928 1.00 63.02 C ATOM 1980 CG ARG A 115 12.944 -22.248 -0.743 1.00 41.42 C ATOM 1981 CD ARG A 115 12.306 -23.567 -1.149 1.00 51.22 C ATOM 1982 NE ARG A 115 12.493 -24.601 -0.135 1.00 1.53 N ATOM 1983 CZ ARG A 115 11.851 -25.763 -0.143 1.00 31.30 C ATOM 1984 NH1 ARG A 115 10.985 -26.039 -1.108 1.00 74.01 N ATOM 1985 NH2 ARG A 115 12.075 -26.653 0.815 1.00 20.33 N ATOM 0 H ARG A 115 15.055 -19.003 -1.939 1.00 35.24 H new ATOM 0 HA ARG A 115 15.457 -21.691 -0.853 1.00 40.03 H new ATOM 0 HB2 ARG A 115 12.991 -20.706 -2.225 1.00 63.02 H new ATOM 0 HB3 ARG A 115 13.619 -22.247 -2.773 1.00 63.02 H new ATOM 0 HG2 ARG A 115 13.688 -22.426 0.034 1.00 41.42 H new ATOM 0 HG3 ARG A 115 12.186 -21.593 -0.314 1.00 41.42 H new ATOM 0 HD2 ARG A 115 11.240 -23.416 -1.321 1.00 51.22 H new ATOM 0 HD3 ARG A 115 12.737 -23.903 -2.092 1.00 51.22 H new ATOM 0 HE ARG A 115 13.153 -24.421 0.621 1.00 1.53 H new ATOM 0 HH11 ARG A 115 10.811 -25.358 -1.847 1.00 74.01 H new ATOM 0 HH12 ARG A 115 10.493 -26.933 -1.112 1.00 74.01 H new ATOM 0 HH21 ARG A 115 12.741 -26.445 1.559 1.00 20.33 H new ATOM 0 HH22 ARG A 115 11.581 -27.545 0.808 1.00 20.33 H new ATOM 1999 N GLU A 116 16.066 -22.472 -3.337 1.00 63.14 N ATOM 2000 CA GLU A 116 16.867 -22.752 -4.524 1.00 15.21 C ATOM 2001 C GLU A 116 16.254 -23.888 -5.338 1.00 30.02 C ATOM 2002 O GLU A 116 15.911 -24.938 -4.796 1.00 24.22 O ATOM 2003 CB GLU A 116 18.300 -23.110 -4.127 1.00 2.25 C ATOM 2004 CG GLU A 116 18.417 -23.688 -2.726 1.00 44.41 C ATOM 2005 CD GLU A 116 17.553 -24.918 -2.528 1.00 52.44 C ATOM 2006 OE1 GLU A 116 17.826 -25.947 -3.181 1.00 11.42 O ATOM 2007 OE2 GLU A 116 16.603 -24.851 -1.720 1.00 51.42 O ATOM 0 H GLU A 116 15.671 -23.299 -2.890 1.00 63.14 H new ATOM 0 HA GLU A 116 16.883 -21.853 -5.141 1.00 15.21 H new ATOM 0 HB2 GLU A 116 18.697 -23.830 -4.842 1.00 2.25 H new ATOM 0 HB3 GLU A 116 18.921 -22.217 -4.196 1.00 2.25 H new ATOM 0 HG2 GLU A 116 19.458 -23.944 -2.529 1.00 44.41 H new ATOM 0 HG3 GLU A 116 18.132 -22.928 -1.999 1.00 44.41 H new ATOM 2014 N GLU A 117 16.119 -23.668 -6.642 1.00 22.10 N ATOM 2015 CA GLU A 117 15.547 -24.673 -7.530 1.00 53.12 C ATOM 2016 C GLU A 117 16.601 -25.212 -8.493 1.00 31.33 C ATOM 2017 O GLU A 117 16.979 -24.543 -9.454 1.00 43.01 O ATOM 2018 CB GLU A 117 14.376 -24.082 -8.318 1.00 51.51 C ATOM 2019 CG GLU A 117 13.201 -25.033 -8.468 1.00 52.00 C ATOM 2020 CD GLU A 117 11.936 -24.505 -7.820 1.00 11.42 C ATOM 2021 OE1 GLU A 117 11.571 -23.342 -8.093 1.00 42.31 O ATOM 2022 OE2 GLU A 117 11.311 -25.253 -7.040 1.00 1.14 O ATOM 0 H GLU A 117 16.398 -22.804 -7.106 1.00 22.10 H new ATOM 0 HA GLU A 117 15.184 -25.498 -6.917 1.00 53.12 H new ATOM 0 HB2 GLU A 117 14.036 -23.174 -7.821 1.00 51.51 H new ATOM 0 HB3 GLU A 117 14.726 -23.791 -9.309 1.00 51.51 H new ATOM 0 HG2 GLU A 117 13.015 -25.210 -9.527 1.00 52.00 H new ATOM 0 HG3 GLU A 117 13.458 -25.995 -8.024 1.00 52.00 H new ATOM 2029 N ARG A 118 17.071 -26.426 -8.226 1.00 60.51 N ATOM 2030 CA ARG A 118 18.083 -27.056 -9.067 1.00 14.44 C ATOM 2031 C ARG A 118 17.464 -27.586 -10.357 1.00 43.50 C ATOM 2032 O ARG A 118 16.836 -28.645 -10.367 1.00 14.44 O ATOM 2033 CB ARG A 118 18.767 -28.196 -8.311 1.00 0.03 C ATOM 2034 CG ARG A 118 17.805 -29.266 -7.821 1.00 70.13 C ATOM 2035 CD ARG A 118 18.156 -30.633 -8.389 1.00 0.51 C ATOM 2036 NE ARG A 118 19.319 -31.218 -7.727 1.00 42.54 N ATOM 2037 CZ ARG A 118 19.875 -32.366 -8.098 1.00 2.30 C ATOM 2038 NH1 ARG A 118 19.377 -33.048 -9.120 1.00 32.13 N ATOM 2039 NH2 ARG A 118 20.932 -32.833 -7.446 1.00 62.22 N ATOM 0 H ARG A 118 16.768 -26.993 -7.434 1.00 60.51 H new ATOM 0 HA ARG A 118 18.827 -26.302 -9.324 1.00 14.44 H new ATOM 0 HB2 ARG A 118 19.510 -28.658 -8.962 1.00 0.03 H new ATOM 0 HB3 ARG A 118 19.304 -27.783 -7.457 1.00 0.03 H new ATOM 0 HG2 ARG A 118 17.828 -29.306 -6.732 1.00 70.13 H new ATOM 0 HG3 ARG A 118 16.787 -29.001 -8.109 1.00 70.13 H new ATOM 0 HD2 ARG A 118 17.302 -31.301 -8.279 1.00 0.51 H new ATOM 0 HD3 ARG A 118 18.354 -30.542 -9.457 1.00 0.51 H new ATOM 0 HE ARG A 118 19.726 -30.718 -6.937 1.00 42.54 H new ATOM 0 HH11 ARG A 118 18.565 -32.692 -9.624 1.00 32.13 H new ATOM 0 HH12 ARG A 118 19.806 -33.929 -9.403 1.00 32.13 H new ATOM 0 HH21 ARG A 118 21.318 -32.311 -6.660 1.00 62.22 H new ATOM 0 HH22 ARG A 118 21.359 -33.715 -7.731 1.00 62.22 H new ATOM 2053 N CYS A 119 17.647 -26.842 -11.443 1.00 33.32 N ATOM 2054 CA CYS A 119 17.106 -27.236 -12.739 1.00 33.42 C ATOM 2055 C CYS A 119 18.226 -27.476 -13.746 1.00 21.15 C ATOM 2056 O CYS A 119 18.550 -26.602 -14.549 1.00 24.54 O ATOM 2057 CB CYS A 119 16.152 -26.162 -13.265 1.00 23.53 C ATOM 2058 SG CYS A 119 14.950 -25.581 -12.045 1.00 62.44 S ATOM 0 H CYS A 119 18.165 -25.964 -11.452 1.00 33.32 H new ATOM 0 HA CYS A 119 16.555 -28.167 -12.607 1.00 33.42 H new ATOM 0 HB2 CYS A 119 16.737 -25.312 -13.616 1.00 23.53 H new ATOM 0 HB3 CYS A 119 15.616 -26.558 -14.127 1.00 23.53 H new ATOM 0 HG CYS A 119 14.912 -24.282 -12.058 1.00 62.44 H new ATOM 2064 N GLY A 120 18.816 -28.667 -13.695 1.00 14.11 N ATOM 2065 CA GLY A 120 19.895 -29.000 -14.606 1.00 51.32 C ATOM 2066 C GLY A 120 21.163 -28.223 -14.311 1.00 71.23 C ATOM 2067 O GLY A 120 21.537 -28.020 -13.156 1.00 43.23 O ATOM 0 H GLY A 120 18.566 -29.407 -13.039 1.00 14.11 H new ATOM 0 HA2 GLY A 120 20.104 -30.068 -14.542 1.00 51.32 H new ATOM 0 HA3 GLY A 120 19.578 -28.798 -15.629 1.00 51.32 H new ATOM 2071 N PRO A 121 21.848 -27.776 -15.374 1.00 41.11 N ATOM 2072 CA PRO A 121 23.093 -27.011 -15.249 1.00 34.40 C ATOM 2073 C PRO A 121 22.860 -25.613 -14.687 1.00 50.02 C ATOM 2074 O PRO A 121 23.799 -24.832 -14.530 1.00 3.22 O ATOM 2075 CB PRO A 121 23.606 -26.931 -16.689 1.00 13.31 C ATOM 2076 CG PRO A 121 22.386 -27.067 -17.534 1.00 22.43 C ATOM 2077 CD PRO A 121 21.460 -27.982 -16.780 1.00 5.53 C ATOM 0 HA PRO A 121 23.793 -27.481 -14.559 1.00 34.40 H new ATOM 0 HB2 PRO A 121 24.114 -25.985 -16.876 1.00 13.31 H new ATOM 0 HB3 PRO A 121 24.323 -27.725 -16.898 1.00 13.31 H new ATOM 0 HG2 PRO A 121 21.921 -26.097 -17.707 1.00 22.43 H new ATOM 0 HG3 PRO A 121 22.633 -27.481 -18.512 1.00 22.43 H new ATOM 0 HD2 PRO A 121 20.414 -27.725 -16.950 1.00 5.53 H new ATOM 0 HD3 PRO A 121 21.586 -29.021 -17.084 1.00 5.53 H new ATOM 2085 N LEU A 122 21.604 -25.303 -14.386 1.00 72.01 N ATOM 2086 CA LEU A 122 21.248 -23.998 -13.841 1.00 14.33 C ATOM 2087 C LEU A 122 20.735 -24.127 -12.410 1.00 53.10 C ATOM 2088 O LEU A 122 20.588 -25.233 -11.889 1.00 14.24 O ATOM 2089 CB LEU A 122 20.186 -23.329 -14.717 1.00 24.43 C ATOM 2090 CG LEU A 122 20.616 -22.979 -16.142 1.00 0.34 C ATOM 2091 CD1 LEU A 122 19.418 -22.989 -17.078 1.00 71.32 C ATOM 2092 CD2 LEU A 122 21.307 -21.623 -16.172 1.00 30.20 C ATOM 0 H LEU A 122 20.815 -25.938 -14.510 1.00 72.01 H new ATOM 0 HA LEU A 122 22.145 -23.379 -13.832 1.00 14.33 H new ATOM 0 HB2 LEU A 122 19.320 -23.989 -14.772 1.00 24.43 H new ATOM 0 HB3 LEU A 122 19.859 -22.414 -14.222 1.00 24.43 H new ATOM 0 HG LEU A 122 21.324 -23.734 -16.484 1.00 0.34 H new ATOM 0 HD11 LEU A 122 19.743 -22.738 -18.088 1.00 71.32 H new ATOM 0 HD12 LEU A 122 18.965 -23.980 -17.079 1.00 71.32 H new ATOM 0 HD13 LEU A 122 18.686 -22.256 -16.740 1.00 71.32 H new ATOM 0 HD21 LEU A 122 21.606 -21.390 -17.194 1.00 30.20 H new ATOM 0 HD22 LEU A 122 20.621 -20.857 -15.811 1.00 30.20 H new ATOM 0 HD23 LEU A 122 22.189 -21.650 -15.533 1.00 30.20 H new ATOM 2104 N THR A 123 20.461 -22.989 -11.780 1.00 5.34 N ATOM 2105 CA THR A 123 19.964 -22.974 -10.410 1.00 31.11 C ATOM 2106 C THR A 123 19.224 -21.676 -10.107 1.00 42.15 C ATOM 2107 O THR A 123 19.815 -20.596 -10.119 1.00 1.21 O ATOM 2108 CB THR A 123 21.109 -23.148 -9.394 1.00 51.23 C ATOM 2109 OG1 THR A 123 21.921 -24.269 -9.759 1.00 30.43 O ATOM 2110 CG2 THR A 123 20.560 -23.347 -7.989 1.00 65.34 C ATOM 0 H THR A 123 20.575 -22.065 -12.197 1.00 5.34 H new ATOM 0 HA THR A 123 19.274 -23.813 -10.316 1.00 31.11 H new ATOM 0 HB THR A 123 21.716 -22.243 -9.404 1.00 51.23 H new ATOM 0 HG1 THR A 123 21.382 -24.912 -10.266 1.00 30.43 H new ATOM 0 HG21 THR A 123 21.387 -23.468 -7.289 1.00 65.34 H new ATOM 0 HG22 THR A 123 19.967 -22.478 -7.704 1.00 65.34 H new ATOM 0 HG23 THR A 123 19.933 -24.238 -7.966 1.00 65.34 H new ATOM 2118 N PHE A 124 17.928 -21.788 -9.836 1.00 61.23 N ATOM 2119 CA PHE A 124 17.107 -20.622 -9.531 1.00 21.42 C ATOM 2120 C PHE A 124 16.953 -20.446 -8.023 1.00 1.20 C ATOM 2121 O PHE A 124 17.394 -21.288 -7.240 1.00 41.51 O ATOM 2122 CB PHE A 124 15.730 -20.757 -10.183 1.00 53.13 C ATOM 2123 CG PHE A 124 15.788 -20.967 -11.669 1.00 43.34 C ATOM 2124 CD1 PHE A 124 15.968 -22.235 -12.197 1.00 33.43 C ATOM 2125 CD2 PHE A 124 15.663 -19.895 -12.539 1.00 65.30 C ATOM 2126 CE1 PHE A 124 16.023 -22.431 -13.564 1.00 13.13 C ATOM 2127 CE2 PHE A 124 15.717 -20.085 -13.907 1.00 43.22 C ATOM 2128 CZ PHE A 124 15.896 -21.355 -14.420 1.00 42.51 C ATOM 0 H PHE A 124 17.424 -22.674 -9.821 1.00 61.23 H new ATOM 0 HA PHE A 124 17.607 -19.741 -9.933 1.00 21.42 H new ATOM 0 HB2 PHE A 124 15.201 -21.594 -9.726 1.00 53.13 H new ATOM 0 HB3 PHE A 124 15.148 -19.859 -9.973 1.00 53.13 H new ATOM 0 HD1 PHE A 124 16.067 -23.081 -11.532 1.00 33.43 H new ATOM 0 HD2 PHE A 124 15.522 -18.900 -12.143 1.00 65.30 H new ATOM 0 HE1 PHE A 124 16.165 -23.425 -13.962 1.00 13.13 H new ATOM 0 HE2 PHE A 124 15.619 -19.241 -14.574 1.00 43.22 H new ATOM 0 HZ PHE A 124 15.937 -21.506 -15.489 1.00 42.51 H new ATOM 2138 N TYR A 125 16.325 -19.346 -7.624 1.00 10.44 N ATOM 2139 CA TYR A 125 16.115 -19.056 -6.210 1.00 51.11 C ATOM 2140 C TYR A 125 14.848 -18.231 -6.006 1.00 2.44 C ATOM 2141 O TYR A 125 14.701 -17.147 -6.572 1.00 21.30 O ATOM 2142 CB TYR A 125 17.321 -18.311 -5.636 1.00 11.50 C ATOM 2143 CG TYR A 125 18.647 -18.958 -5.966 1.00 75.33 C ATOM 2144 CD1 TYR A 125 19.314 -18.657 -7.148 1.00 34.45 C ATOM 2145 CD2 TYR A 125 19.231 -19.872 -5.098 1.00 45.22 C ATOM 2146 CE1 TYR A 125 20.525 -19.247 -7.454 1.00 73.31 C ATOM 2147 CE2 TYR A 125 20.443 -20.465 -5.396 1.00 32.32 C ATOM 2148 CZ TYR A 125 21.085 -20.150 -6.575 1.00 24.02 C ATOM 2149 OH TYR A 125 22.292 -20.740 -6.876 1.00 34.24 O ATOM 0 H TYR A 125 15.952 -18.640 -8.259 1.00 10.44 H new ATOM 0 HA TYR A 125 15.998 -20.003 -5.684 1.00 51.11 H new ATOM 0 HB2 TYR A 125 17.321 -17.289 -6.016 1.00 11.50 H new ATOM 0 HB3 TYR A 125 17.217 -18.248 -4.553 1.00 11.50 H new ATOM 0 HD1 TYR A 125 18.878 -17.950 -7.839 1.00 34.45 H new ATOM 0 HD2 TYR A 125 18.729 -20.123 -4.175 1.00 45.22 H new ATOM 0 HE1 TYR A 125 21.030 -19.002 -8.377 1.00 73.31 H new ATOM 0 HE2 TYR A 125 20.885 -21.171 -4.709 1.00 32.32 H new ATOM 0 HH TYR A 125 22.943 -20.531 -6.174 1.00 34.24 H new ATOM 2159 N TYR A 126 13.936 -18.751 -5.192 1.00 4.34 N ATOM 2160 CA TYR A 126 12.681 -18.064 -4.912 1.00 73.23 C ATOM 2161 C TYR A 126 12.525 -17.799 -3.418 1.00 24.10 C ATOM 2162 O TYR A 126 13.141 -18.455 -2.578 1.00 4.25 O ATOM 2163 CB TYR A 126 11.499 -18.892 -5.420 1.00 52.23 C ATOM 2164 CG TYR A 126 11.594 -20.360 -5.073 1.00 64.45 C ATOM 2165 CD1 TYR A 126 12.431 -21.210 -5.786 1.00 45.12 C ATOM 2166 CD2 TYR A 126 10.848 -20.898 -4.032 1.00 61.20 C ATOM 2167 CE1 TYR A 126 12.521 -22.552 -5.473 1.00 62.31 C ATOM 2168 CE2 TYR A 126 10.933 -22.239 -3.711 1.00 33.31 C ATOM 2169 CZ TYR A 126 11.770 -23.062 -4.435 1.00 21.23 C ATOM 2170 OH TYR A 126 11.858 -24.399 -4.119 1.00 12.32 O ATOM 0 H TYR A 126 14.042 -19.646 -4.715 1.00 4.34 H new ATOM 0 HA TYR A 126 12.697 -17.106 -5.432 1.00 73.23 H new ATOM 0 HB2 TYR A 126 10.577 -18.488 -5.002 1.00 52.23 H new ATOM 0 HB3 TYR A 126 11.431 -18.787 -6.503 1.00 52.23 H new ATOM 0 HD1 TYR A 126 13.021 -20.814 -6.599 1.00 45.12 H new ATOM 0 HD2 TYR A 126 10.190 -20.257 -3.464 1.00 61.20 H new ATOM 0 HE1 TYR A 126 13.176 -23.199 -6.038 1.00 62.31 H new ATOM 0 HE2 TYR A 126 10.347 -22.641 -2.897 1.00 33.31 H new ATOM 0 HH TYR A 126 11.681 -24.937 -4.919 1.00 12.32 H new ATOM 2180 N PRO A 127 11.681 -16.814 -3.078 1.00 1.04 N ATOM 2181 CA PRO A 127 11.423 -16.439 -1.684 1.00 52.12 C ATOM 2182 C PRO A 127 10.635 -17.507 -0.933 1.00 11.40 C ATOM 2183 O PRO A 127 9.433 -17.667 -1.141 1.00 41.24 O ATOM 2184 CB PRO A 127 10.599 -15.155 -1.809 1.00 74.14 C ATOM 2185 CG PRO A 127 9.944 -15.254 -3.144 1.00 43.32 C ATOM 2186 CD PRO A 127 10.913 -15.991 -4.027 1.00 1.22 C ATOM 0 HA PRO A 127 12.346 -16.316 -1.117 1.00 52.12 H new ATOM 0 HB2 PRO A 127 9.861 -15.079 -1.011 1.00 74.14 H new ATOM 0 HB3 PRO A 127 11.232 -14.270 -1.743 1.00 74.14 H new ATOM 0 HG2 PRO A 127 8.996 -15.787 -3.075 1.00 43.32 H new ATOM 0 HG3 PRO A 127 9.725 -14.265 -3.546 1.00 43.32 H new ATOM 0 HD2 PRO A 127 10.397 -16.605 -4.765 1.00 1.22 H new ATOM 0 HD3 PRO A 127 11.557 -15.305 -4.577 1.00 1.22 H new ATOM 2194 N GLY A 128 11.321 -18.235 -0.057 1.00 74.32 N ATOM 2195 CA GLY A 128 10.668 -19.278 0.712 1.00 31.51 C ATOM 2196 C GLY A 128 9.864 -20.224 -0.158 1.00 53.33 C ATOM 2197 O GLY A 128 10.313 -20.624 -1.232 1.00 44.20 O ATOM 0 H GLY A 128 12.317 -18.121 0.134 1.00 74.32 H new ATOM 0 HA2 GLY A 128 11.420 -19.845 1.261 1.00 31.51 H new ATOM 0 HA3 GLY A 128 10.010 -18.822 1.452 1.00 31.51 H new