USER MOD reduce.3.24.130724 H: found=0, std=0, add=1047, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1047 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 40 THR OG1 : rot 149:sc= 1.39 USER MOD Set 1.2: A 128 TYR OH : rot 180:sc= 0.924 USER MOD Set 2.1: A 22 SER OG : rot -76:sc= 1.1 USER MOD Set 2.2: A 121 THR OG1 : rot 180:sc= -0.0414 USER MOD Set 3.1: A 100 GLN : amide:sc= -0.035 K(o=-1.1,f=-5.8!) USER MOD Set 3.2: A 119 HIS : no HD1:sc= -1.1 K(o=-1.1,f=-1.9) USER MOD Set 4.1: A 52 LYS NZ :NH3+ 173:sc= 1.2 (180deg=0) USER MOD Set 4.2: A 54 GLN : amide:sc= 0.919 K(o=4.9,f=-6.3!) USER MOD Set 4.3: A 59 ASN : amide:sc= 2.81 K(o=4.9,f=-9.7!) USER MOD Set 5.1: A 55 SER OG : rot 63:sc= 1.3 USER MOD Set 5.2: A 58 LYS NZ :NH3+ -175:sc= 1.03 (180deg=-0.514) USER MOD Set 6.1: A 9 LYS NZ :NH3+ -168:sc= 1.22 (180deg=0) USER MOD Set 6.2: A 39 THR OG1 : rot 180:sc= 0 USER MOD Set 6.3: A 131 GLN : amide:sc= 0.401 K(o=1.6,f=-6.2) USER MOD Set 7.1: A 19 TYR OH : rot -98:sc= 1.26 USER MOD Set 7.2: A 102 THR OG1 : rot 121:sc= 0.509 USER MOD Single : A 1 VAL N :NH3+ -176:sc= -0.234 (180deg=-0.307) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 SER OG : rot 25:sc= 0.665 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 ASN : amide:sc= 1.15 K(o=1.2,f=-0.59) USER MOD Single : A 20 MET CE :methyl 168:sc=-0.00797 (180deg=-0.204) USER MOD Single : A 21 LYS NZ :NH3+ -138:sc= 1.21 (180deg=0.493) USER MOD Single : A 29 THR OG1 : rot 180:sc= -0.135 USER MOD Single : A 31 GLN : amide:sc= 0.101 K(o=0.1,f=-2.3!) USER MOD Single : A 34 ASN : amide:sc= 0.517 K(o=0.52,f=-10!) USER MOD Single : A 35 MET CE :methyl -160:sc= -0.534 (180deg=-1.13) USER MOD Single : A 36 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00166) USER MOD Single : A 45 ASN : amide:sc= -0.031 K(o=-0.031,f=-0.98) USER MOD Single : A 48 THR OG1 : rot -41:sc= 1.12 USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot 180:sc= -0.126 USER MOD Single : A 60 THR OG1 : rot 180:sc= -0.0299 USER MOD Single : A 63 SER OG : rot 180:sc= 0.0829 USER MOD Single : A 65 LYS NZ :NH3+ -167:sc= 2.46 (180deg=1.46) USER MOD Single : A 73 THR OG1 : rot -43:sc= 1.23 USER MOD Single : A 74 THR OG1 : rot 166:sc= 1.35 USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 LYS NZ :NH3+ 178:sc= 1.22 (180deg=1.13) USER MOD Single : A 82 SER OG : rot 154:sc= 2.05 USER MOD Single : A 85 THR OG1 : rot 180:sc= 0.102 USER MOD Single : A 90 LYS NZ :NH3+ 140:sc= 0.624 (180deg=-3.96!) USER MOD Single : A 93 HIS : +bothHN:sc= 0.165 K(o=0.17,f=-6.7!) USER MOD Single : A 95 GLN : amide:sc= 1.27 K(o=1.3,f=-4.1!) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 ASN : amide:sc= -1.35 K(o=-1.3,f=-2.6!) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 108 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 118 THR OG1 : rot 170:sc= 0.414 USER MOD Single : A 124 CYS SG : rot 129:sc= -1.17 USER MOD Single : A 125 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 THR OG1 : rot -58:sc= 0.0784 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 2.48 (180deg=2.48) USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 9.908 -13.040 -3.000 1.00 0.00 N ATOM 2 CA VAL A 1 9.875 -11.985 -1.998 1.00 0.00 C ATOM 3 C VAL A 1 11.231 -11.274 -1.889 1.00 0.00 C ATOM 4 O VAL A 1 11.281 -10.065 -1.639 1.00 0.00 O ATOM 5 CB VAL A 1 9.361 -12.554 -0.661 1.00 0.00 C ATOM 6 CG1 VAL A 1 10.262 -13.646 -0.068 1.00 0.00 C ATOM 7 CG2 VAL A 1 9.143 -11.449 0.380 1.00 0.00 C ATOM 0 H1 VAL A 1 8.960 -13.456 -3.098 1.00 0.00 H new ATOM 0 H2 VAL A 1 10.208 -12.642 -3.913 1.00 0.00 H new ATOM 0 H3 VAL A 1 10.580 -13.777 -2.706 1.00 0.00 H new ATOM 0 HA VAL A 1 9.172 -11.211 -2.305 1.00 0.00 H new ATOM 0 HB VAL A 1 8.405 -13.018 -0.904 1.00 0.00 H new ATOM 0 HG11 VAL A 1 9.837 -13.998 0.872 1.00 0.00 H new ATOM 0 HG12 VAL A 1 10.334 -14.478 -0.768 1.00 0.00 H new ATOM 0 HG13 VAL A 1 11.256 -13.238 0.114 1.00 0.00 H new ATOM 0 HG21 VAL A 1 8.781 -11.890 1.308 1.00 0.00 H new ATOM 0 HG22 VAL A 1 10.085 -10.934 0.567 1.00 0.00 H new ATOM 0 HG23 VAL A 1 8.408 -10.736 0.006 1.00 0.00 H new ATOM 19 N ASP A 2 12.314 -12.032 -2.097 1.00 0.00 N ATOM 20 CA ASP A 2 13.724 -11.711 -1.886 1.00 0.00 C ATOM 21 C ASP A 2 14.234 -10.682 -2.901 1.00 0.00 C ATOM 22 O ASP A 2 15.176 -10.918 -3.655 1.00 0.00 O ATOM 23 CB ASP A 2 14.545 -13.013 -1.969 1.00 0.00 C ATOM 24 CG ASP A 2 13.904 -14.178 -1.228 1.00 0.00 C ATOM 25 OD1 ASP A 2 12.827 -14.602 -1.712 1.00 0.00 O ATOM 26 OD2 ASP A 2 14.474 -14.597 -0.200 1.00 0.00 O ATOM 0 H ASP A 2 12.210 -12.982 -2.454 1.00 0.00 H new ATOM 0 HA ASP A 2 13.838 -11.261 -0.900 1.00 0.00 H new ATOM 0 HB2 ASP A 2 14.676 -13.286 -3.016 1.00 0.00 H new ATOM 0 HB3 ASP A 2 15.539 -12.834 -1.560 1.00 0.00 H new ATOM 31 N ALA A 3 13.592 -9.520 -2.917 1.00 0.00 N ATOM 32 CA ALA A 3 13.808 -8.436 -3.856 1.00 0.00 C ATOM 33 C ALA A 3 13.095 -7.207 -3.309 1.00 0.00 C ATOM 34 O ALA A 3 13.687 -6.129 -3.227 1.00 0.00 O ATOM 35 CB ALA A 3 13.255 -8.813 -5.235 1.00 0.00 C ATOM 0 H ALA A 3 12.866 -9.301 -2.234 1.00 0.00 H new ATOM 0 HA ALA A 3 14.873 -8.233 -3.973 1.00 0.00 H new ATOM 0 HB1 ALA A 3 13.423 -7.991 -5.931 1.00 0.00 H new ATOM 0 HB2 ALA A 3 13.762 -9.706 -5.599 1.00 0.00 H new ATOM 0 HB3 ALA A 3 12.186 -9.010 -5.157 1.00 0.00 H new ATOM 41 N PHE A 4 11.830 -7.387 -2.913 1.00 0.00 N ATOM 42 CA PHE A 4 10.966 -6.331 -2.413 1.00 0.00 C ATOM 43 C PHE A 4 11.563 -5.669 -1.173 1.00 0.00 C ATOM 44 O PHE A 4 11.539 -4.447 -1.074 1.00 0.00 O ATOM 45 CB PHE A 4 9.574 -6.905 -2.122 1.00 0.00 C ATOM 46 CG PHE A 4 8.903 -7.634 -3.274 1.00 0.00 C ATOM 47 CD1 PHE A 4 9.003 -7.152 -4.594 1.00 0.00 C ATOM 48 CD2 PHE A 4 8.154 -8.798 -3.020 1.00 0.00 C ATOM 49 CE1 PHE A 4 8.435 -7.874 -5.656 1.00 0.00 C ATOM 50 CE2 PHE A 4 7.597 -9.528 -4.084 1.00 0.00 C ATOM 51 CZ PHE A 4 7.755 -9.076 -5.404 1.00 0.00 C ATOM 0 H PHE A 4 11.374 -8.299 -2.935 1.00 0.00 H new ATOM 0 HA PHE A 4 10.876 -5.557 -3.175 1.00 0.00 H new ATOM 0 HB2 PHE A 4 9.654 -7.592 -1.280 1.00 0.00 H new ATOM 0 HB3 PHE A 4 8.924 -6.089 -1.806 1.00 0.00 H new ATOM 0 HD1 PHE A 4 9.519 -6.223 -4.790 1.00 0.00 H new ATOM 0 HD2 PHE A 4 8.007 -9.132 -2.003 1.00 0.00 H new ATOM 0 HE1 PHE A 4 8.521 -7.504 -6.667 1.00 0.00 H new ATOM 0 HE2 PHE A 4 7.048 -10.437 -3.886 1.00 0.00 H new ATOM 0 HZ PHE A 4 7.354 -9.652 -6.224 1.00 0.00 H new ATOM 61 N VAL A 5 12.104 -6.482 -0.261 1.00 0.00 N ATOM 62 CA VAL A 5 12.730 -6.075 0.994 1.00 0.00 C ATOM 63 C VAL A 5 13.591 -4.816 0.820 1.00 0.00 C ATOM 64 O VAL A 5 14.709 -4.910 0.307 1.00 0.00 O ATOM 65 CB VAL A 5 13.560 -7.259 1.527 1.00 0.00 C ATOM 66 CG1 VAL A 5 14.431 -6.844 2.722 1.00 0.00 C ATOM 67 CG2 VAL A 5 12.645 -8.413 1.955 1.00 0.00 C ATOM 0 H VAL A 5 12.116 -7.494 -0.388 1.00 0.00 H new ATOM 0 HA VAL A 5 11.957 -5.813 1.717 1.00 0.00 H new ATOM 0 HB VAL A 5 14.209 -7.586 0.714 1.00 0.00 H new ATOM 0 HG11 VAL A 5 15.002 -7.704 3.072 1.00 0.00 H new ATOM 0 HG12 VAL A 5 15.116 -6.053 2.416 1.00 0.00 H new ATOM 0 HG13 VAL A 5 13.794 -6.480 3.528 1.00 0.00 H new ATOM 0 HG21 VAL A 5 13.251 -9.239 2.328 1.00 0.00 H new ATOM 0 HG22 VAL A 5 11.973 -8.072 2.742 1.00 0.00 H new ATOM 0 HG23 VAL A 5 12.060 -8.750 1.099 1.00 0.00 H new ATOM 77 N GLY A 6 13.089 -3.644 1.222 1.00 0.00 N ATOM 78 CA GLY A 6 13.831 -2.392 1.218 1.00 0.00 C ATOM 79 C GLY A 6 12.923 -1.183 0.988 1.00 0.00 C ATOM 80 O GLY A 6 11.731 -1.213 1.298 1.00 0.00 O ATOM 0 H GLY A 6 12.134 -3.544 1.566 1.00 0.00 H new ATOM 0 HA2 GLY A 6 14.352 -2.277 2.169 1.00 0.00 H new ATOM 0 HA3 GLY A 6 14.593 -2.426 0.439 1.00 0.00 H new ATOM 84 N THR A 7 13.510 -0.108 0.457 1.00 0.00 N ATOM 85 CA THR A 7 12.902 1.206 0.322 1.00 0.00 C ATOM 86 C THR A 7 12.815 1.582 -1.154 1.00 0.00 C ATOM 87 O THR A 7 13.843 1.691 -1.829 1.00 0.00 O ATOM 88 CB THR A 7 13.740 2.233 1.094 1.00 0.00 C ATOM 89 OG1 THR A 7 14.073 1.731 2.369 1.00 0.00 O ATOM 90 CG2 THR A 7 12.970 3.537 1.290 1.00 0.00 C ATOM 0 H THR A 7 14.463 -0.137 0.095 1.00 0.00 H new ATOM 0 HA THR A 7 11.893 1.192 0.735 1.00 0.00 H new ATOM 0 HB THR A 7 14.640 2.423 0.509 1.00 0.00 H new ATOM 0 HG1 THR A 7 14.609 2.394 2.852 1.00 0.00 H new ATOM 0 HG21 THR A 7 13.589 4.246 1.840 1.00 0.00 H new ATOM 0 HG22 THR A 7 12.713 3.958 0.318 1.00 0.00 H new ATOM 0 HG23 THR A 7 12.057 3.340 1.852 1.00 0.00 H new ATOM 98 N TRP A 8 11.592 1.804 -1.637 1.00 0.00 N ATOM 99 CA TRP A 8 11.301 2.127 -3.020 1.00 0.00 C ATOM 100 C TRP A 8 10.863 3.581 -3.139 1.00 0.00 C ATOM 101 O TRP A 8 10.146 4.082 -2.274 1.00 0.00 O ATOM 102 CB TRP A 8 10.197 1.196 -3.510 1.00 0.00 C ATOM 103 CG TRP A 8 10.571 -0.250 -3.489 1.00 0.00 C ATOM 104 CD1 TRP A 8 10.409 -1.079 -2.436 1.00 0.00 C ATOM 105 CD2 TRP A 8 11.269 -1.026 -4.507 1.00 0.00 C ATOM 106 NE1 TRP A 8 10.952 -2.308 -2.732 1.00 0.00 N ATOM 107 CE2 TRP A 8 11.520 -2.328 -3.988 1.00 0.00 C ATOM 108 CE3 TRP A 8 11.736 -0.757 -5.810 1.00 0.00 C ATOM 109 CZ2 TRP A 8 12.213 -3.305 -4.716 1.00 0.00 C ATOM 110 CZ3 TRP A 8 12.439 -1.726 -6.549 1.00 0.00 C ATOM 111 CH2 TRP A 8 12.677 -2.999 -6.004 1.00 0.00 C ATOM 0 H TRP A 8 10.757 1.761 -1.053 1.00 0.00 H new ATOM 0 HA TRP A 8 12.194 1.993 -3.631 1.00 0.00 H new ATOM 0 HB2 TRP A 8 9.312 1.341 -2.891 1.00 0.00 H new ATOM 0 HB3 TRP A 8 9.924 1.476 -4.528 1.00 0.00 H new ATOM 0 HD1 TRP A 8 9.928 -0.818 -1.505 1.00 0.00 H new ATOM 0 HE1 TRP A 8 10.936 -3.108 -2.099 1.00 0.00 H new ATOM 0 HE3 TRP A 8 11.550 0.212 -6.249 1.00 0.00 H new ATOM 0 HZ2 TRP A 8 12.388 -4.282 -4.290 1.00 0.00 H new ATOM 0 HZ3 TRP A 8 12.797 -1.490 -7.540 1.00 0.00 H new ATOM 0 HH2 TRP A 8 13.216 -3.740 -6.575 1.00 0.00 H new ATOM 122 N LYS A 9 11.286 4.252 -4.210 1.00 0.00 N ATOM 123 CA LYS A 9 10.816 5.577 -4.577 1.00 0.00 C ATOM 124 C LYS A 9 10.078 5.453 -5.901 1.00 0.00 C ATOM 125 O LYS A 9 10.523 4.718 -6.784 1.00 0.00 O ATOM 126 CB LYS A 9 12.008 6.532 -4.675 1.00 0.00 C ATOM 127 CG LYS A 9 11.582 7.996 -4.877 1.00 0.00 C ATOM 128 CD LYS A 9 12.506 8.946 -4.101 1.00 0.00 C ATOM 129 CE LYS A 9 13.966 8.870 -4.580 1.00 0.00 C ATOM 130 NZ LYS A 9 14.902 9.429 -3.583 1.00 0.00 N ATOM 0 H LYS A 9 11.980 3.877 -4.857 1.00 0.00 H new ATOM 0 HA LYS A 9 10.137 5.983 -3.827 1.00 0.00 H new ATOM 0 HB2 LYS A 9 12.606 6.454 -3.767 1.00 0.00 H new ATOM 0 HB3 LYS A 9 12.646 6.226 -5.504 1.00 0.00 H new ATOM 0 HG2 LYS A 9 11.607 8.243 -5.938 1.00 0.00 H new ATOM 0 HG3 LYS A 9 10.553 8.129 -4.543 1.00 0.00 H new ATOM 0 HD2 LYS A 9 12.144 9.968 -4.209 1.00 0.00 H new ATOM 0 HD3 LYS A 9 12.462 8.703 -3.039 1.00 0.00 H new ATOM 0 HE2 LYS A 9 14.228 7.832 -4.782 1.00 0.00 H new ATOM 0 HE3 LYS A 9 14.069 9.413 -5.519 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 15.840 9.548 -4.016 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 14.552 10.352 -3.257 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 14.974 8.781 -2.773 1.00 0.00 H new ATOM 144 N LEU A 10 8.938 6.134 -6.025 1.00 0.00 N ATOM 145 CA LEU A 10 8.205 6.177 -7.277 1.00 0.00 C ATOM 146 C LEU A 10 8.910 7.163 -8.202 1.00 0.00 C ATOM 147 O LEU A 10 9.172 8.294 -7.791 1.00 0.00 O ATOM 148 CB LEU A 10 6.764 6.588 -6.984 1.00 0.00 C ATOM 149 CG LEU A 10 5.862 6.562 -8.228 1.00 0.00 C ATOM 150 CD1 LEU A 10 4.493 6.009 -7.815 1.00 0.00 C ATOM 151 CD2 LEU A 10 5.705 7.953 -8.858 1.00 0.00 C ATOM 0 H LEU A 10 8.507 6.663 -5.267 1.00 0.00 H new ATOM 0 HA LEU A 10 8.179 5.204 -7.768 1.00 0.00 H new ATOM 0 HB2 LEU A 10 6.349 5.921 -6.228 1.00 0.00 H new ATOM 0 HB3 LEU A 10 6.758 7.592 -6.560 1.00 0.00 H new ATOM 0 HG LEU A 10 6.324 5.926 -8.984 1.00 0.00 H new ATOM 0 HD11 LEU A 10 3.835 5.981 -8.683 1.00 0.00 H new ATOM 0 HD12 LEU A 10 4.613 5.001 -7.418 1.00 0.00 H new ATOM 0 HD13 LEU A 10 4.057 6.651 -7.050 1.00 0.00 H new ATOM 0 HD21 LEU A 10 5.059 7.885 -9.734 1.00 0.00 H new ATOM 0 HD22 LEU A 10 5.261 8.633 -8.132 1.00 0.00 H new ATOM 0 HD23 LEU A 10 6.683 8.330 -9.157 1.00 0.00 H new ATOM 163 N VAL A 11 9.221 6.739 -9.430 1.00 0.00 N ATOM 164 CA VAL A 11 9.878 7.595 -10.414 1.00 0.00 C ATOM 165 C VAL A 11 8.878 8.052 -11.476 1.00 0.00 C ATOM 166 O VAL A 11 8.844 9.239 -11.797 1.00 0.00 O ATOM 167 CB VAL A 11 11.140 6.920 -10.979 1.00 0.00 C ATOM 168 CG1 VAL A 11 10.857 5.624 -11.742 1.00 0.00 C ATOM 169 CG2 VAL A 11 11.930 7.876 -11.878 1.00 0.00 C ATOM 0 H VAL A 11 9.024 5.796 -9.766 1.00 0.00 H new ATOM 0 HA VAL A 11 10.233 8.504 -9.928 1.00 0.00 H new ATOM 0 HB VAL A 11 11.736 6.657 -10.105 1.00 0.00 H new ATOM 0 HG11 VAL A 11 11.794 5.206 -12.110 1.00 0.00 H new ATOM 0 HG12 VAL A 11 10.377 4.907 -11.076 1.00 0.00 H new ATOM 0 HG13 VAL A 11 10.198 5.834 -12.584 1.00 0.00 H new ATOM 0 HG21 VAL A 11 12.815 7.368 -12.261 1.00 0.00 H new ATOM 0 HG22 VAL A 11 11.304 8.192 -12.712 1.00 0.00 H new ATOM 0 HG23 VAL A 11 12.234 8.750 -11.302 1.00 0.00 H new ATOM 179 N ASP A 12 8.057 7.129 -11.995 1.00 0.00 N ATOM 180 CA ASP A 12 7.042 7.422 -13.000 1.00 0.00 C ATOM 181 C ASP A 12 5.690 6.864 -12.556 1.00 0.00 C ATOM 182 O ASP A 12 5.636 5.871 -11.825 1.00 0.00 O ATOM 183 CB ASP A 12 7.455 6.847 -14.361 1.00 0.00 C ATOM 184 CG ASP A 12 6.386 7.087 -15.421 1.00 0.00 C ATOM 185 OD1 ASP A 12 5.722 8.144 -15.328 1.00 0.00 O ATOM 186 OD2 ASP A 12 6.224 6.190 -16.273 1.00 0.00 O ATOM 0 H ASP A 12 8.084 6.147 -11.721 1.00 0.00 H new ATOM 0 HA ASP A 12 6.949 8.503 -13.106 1.00 0.00 H new ATOM 0 HB2 ASP A 12 8.392 7.303 -14.680 1.00 0.00 H new ATOM 0 HB3 ASP A 12 7.638 5.777 -14.264 1.00 0.00 H new ATOM 191 N SER A 13 4.616 7.518 -13.004 1.00 0.00 N ATOM 192 CA SER A 13 3.222 7.146 -12.844 1.00 0.00 C ATOM 193 C SER A 13 2.372 8.050 -13.722 1.00 0.00 C ATOM 194 O SER A 13 2.710 9.216 -13.920 1.00 0.00 O ATOM 195 CB SER A 13 2.754 7.257 -11.385 1.00 0.00 C ATOM 196 OG SER A 13 1.454 6.689 -11.215 1.00 0.00 O ATOM 0 H SER A 13 4.714 8.388 -13.528 1.00 0.00 H new ATOM 0 HA SER A 13 3.113 6.103 -13.140 1.00 0.00 H new ATOM 0 HB2 SER A 13 3.464 6.749 -10.733 1.00 0.00 H new ATOM 0 HB3 SER A 13 2.738 8.304 -11.084 1.00 0.00 H new ATOM 0 HG SER A 13 1.297 6.017 -11.911 1.00 0.00 H new ATOM 202 N LYS A 14 1.233 7.533 -14.185 1.00 0.00 N ATOM 203 CA LYS A 14 0.228 8.336 -14.852 1.00 0.00 C ATOM 204 C LYS A 14 -1.143 7.882 -14.359 1.00 0.00 C ATOM 205 O LYS A 14 -1.312 6.717 -13.992 1.00 0.00 O ATOM 206 CB LYS A 14 0.410 8.226 -16.374 1.00 0.00 C ATOM 207 CG LYS A 14 -0.117 9.468 -17.104 1.00 0.00 C ATOM 208 CD LYS A 14 0.359 9.466 -18.562 1.00 0.00 C ATOM 209 CE LYS A 14 -0.107 10.743 -19.278 1.00 0.00 C ATOM 210 NZ LYS A 14 0.439 10.842 -20.648 1.00 0.00 N ATOM 0 H LYS A 14 0.989 6.546 -14.104 1.00 0.00 H new ATOM 0 HA LYS A 14 0.327 9.395 -14.615 1.00 0.00 H new ATOM 0 HB2 LYS A 14 1.467 8.090 -16.604 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -0.112 7.341 -16.739 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -1.206 9.485 -17.069 1.00 0.00 H new ATOM 0 HG3 LYS A 14 0.232 10.370 -16.601 1.00 0.00 H new ATOM 0 HD2 LYS A 14 1.446 9.398 -18.596 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -0.032 8.589 -19.078 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -1.196 10.758 -19.320 1.00 0.00 H new ATOM 0 HE3 LYS A 14 0.202 11.615 -18.701 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 0.100 11.718 -21.095 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 1.478 10.854 -20.608 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 0.124 10.024 -21.207 1.00 0.00 H new ATOM 224 N ASN A 15 -2.095 8.820 -14.311 1.00 0.00 N ATOM 225 CA ASN A 15 -3.475 8.598 -13.891 1.00 0.00 C ATOM 226 C ASN A 15 -3.550 8.145 -12.427 1.00 0.00 C ATOM 227 O ASN A 15 -4.303 7.231 -12.091 1.00 0.00 O ATOM 228 CB ASN A 15 -4.185 7.619 -14.843 1.00 0.00 C ATOM 229 CG ASN A 15 -4.339 8.171 -16.259 1.00 0.00 C ATOM 230 OD1 ASN A 15 -3.378 8.210 -17.023 1.00 0.00 O ATOM 231 ND2 ASN A 15 -5.537 8.609 -16.620 1.00 0.00 N ATOM 0 H ASN A 15 -1.915 9.789 -14.574 1.00 0.00 H new ATOM 0 HA ASN A 15 -4.006 9.548 -13.949 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -3.623 6.686 -14.882 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -5.170 7.381 -14.442 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -5.680 8.992 -17.555 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -6.316 8.563 -15.963 1.00 0.00 H new ATOM 238 N PHE A 16 -2.780 8.788 -11.539 1.00 0.00 N ATOM 239 CA PHE A 16 -2.787 8.453 -10.116 1.00 0.00 C ATOM 240 C PHE A 16 -4.045 9.027 -9.455 1.00 0.00 C ATOM 241 O PHE A 16 -4.928 8.269 -9.055 1.00 0.00 O ATOM 242 CB PHE A 16 -1.479 8.912 -9.436 1.00 0.00 C ATOM 243 CG PHE A 16 -1.092 8.218 -8.130 1.00 0.00 C ATOM 244 CD1 PHE A 16 -2.059 7.778 -7.199 1.00 0.00 C ATOM 245 CD2 PHE A 16 0.267 7.939 -7.884 1.00 0.00 C ATOM 246 CE1 PHE A 16 -1.680 6.987 -6.101 1.00 0.00 C ATOM 247 CE2 PHE A 16 0.649 7.184 -6.761 1.00 0.00 C ATOM 248 CZ PHE A 16 -0.326 6.690 -5.879 1.00 0.00 C ATOM 0 H PHE A 16 -2.143 9.545 -11.786 1.00 0.00 H new ATOM 0 HA PHE A 16 -2.824 7.371 -9.994 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -0.663 8.776 -10.146 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -1.557 9.982 -9.241 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -3.095 8.051 -7.332 1.00 0.00 H new ATOM 0 HD2 PHE A 16 1.021 8.308 -8.563 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -2.432 6.607 -5.426 1.00 0.00 H new ATOM 0 HE2 PHE A 16 1.694 6.984 -6.576 1.00 0.00 H new ATOM 0 HZ PHE A 16 -0.035 6.084 -5.034 1.00 0.00 H new ATOM 258 N ASP A 17 -4.119 10.357 -9.309 1.00 0.00 N ATOM 259 CA ASP A 17 -5.239 11.004 -8.630 1.00 0.00 C ATOM 260 C ASP A 17 -6.544 10.578 -9.299 1.00 0.00 C ATOM 261 O ASP A 17 -7.438 10.060 -8.633 1.00 0.00 O ATOM 262 CB ASP A 17 -5.066 12.527 -8.616 1.00 0.00 C ATOM 263 CG ASP A 17 -6.175 13.199 -7.806 1.00 0.00 C ATOM 264 OD1 ASP A 17 -7.333 13.128 -8.263 1.00 0.00 O ATOM 265 OD2 ASP A 17 -5.850 13.757 -6.733 1.00 0.00 O ATOM 0 H ASP A 17 -3.411 11.004 -9.655 1.00 0.00 H new ATOM 0 HA ASP A 17 -5.268 10.687 -7.588 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -4.095 12.782 -8.191 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -5.076 12.907 -9.638 1.00 0.00 H new ATOM 270 N ASP A 18 -6.564 10.692 -10.632 1.00 0.00 N ATOM 271 CA ASP A 18 -7.569 10.149 -11.538 1.00 0.00 C ATOM 272 C ASP A 18 -8.205 8.864 -11.006 1.00 0.00 C ATOM 273 O ASP A 18 -9.421 8.784 -10.871 1.00 0.00 O ATOM 274 CB ASP A 18 -6.919 9.898 -12.900 1.00 0.00 C ATOM 275 CG ASP A 18 -7.876 9.218 -13.868 1.00 0.00 C ATOM 276 OD1 ASP A 18 -9.087 9.503 -13.786 1.00 0.00 O ATOM 277 OD2 ASP A 18 -7.363 8.413 -14.672 1.00 0.00 O ATOM 0 H ASP A 18 -5.832 11.197 -11.132 1.00 0.00 H new ATOM 0 HA ASP A 18 -8.374 10.878 -11.629 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -6.586 10.846 -13.324 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -6.032 9.278 -12.770 1.00 0.00 H new ATOM 282 N TYR A 19 -7.391 7.862 -10.658 1.00 0.00 N ATOM 283 CA TYR A 19 -7.882 6.590 -10.137 1.00 0.00 C ATOM 284 C TYR A 19 -8.844 6.807 -8.961 1.00 0.00 C ATOM 285 O TYR A 19 -9.964 6.304 -8.967 1.00 0.00 O ATOM 286 CB TYR A 19 -6.682 5.719 -9.737 1.00 0.00 C ATOM 287 CG TYR A 19 -6.899 4.216 -9.629 1.00 0.00 C ATOM 288 CD1 TYR A 19 -7.439 3.482 -10.705 1.00 0.00 C ATOM 289 CD2 TYR A 19 -6.252 3.524 -8.590 1.00 0.00 C ATOM 290 CE1 TYR A 19 -7.213 2.095 -10.803 1.00 0.00 C ATOM 291 CE2 TYR A 19 -6.092 2.131 -8.653 1.00 0.00 C ATOM 292 CZ TYR A 19 -6.510 1.429 -9.787 1.00 0.00 C ATOM 293 OH TYR A 19 -6.190 0.107 -9.889 1.00 0.00 O ATOM 0 H TYR A 19 -6.375 7.914 -10.731 1.00 0.00 H new ATOM 0 HA TYR A 19 -8.450 6.075 -10.912 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -5.887 5.891 -10.463 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -6.317 6.075 -8.774 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -8.028 3.985 -11.457 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -5.875 4.069 -7.737 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -7.580 1.546 -11.658 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -5.646 1.601 -7.825 1.00 0.00 H new ATOM 0 HH TYR A 19 -6.849 -0.428 -9.399 1.00 0.00 H new ATOM 303 N MET A 20 -8.434 7.581 -7.954 1.00 0.00 N ATOM 304 CA MET A 20 -9.303 7.837 -6.812 1.00 0.00 C ATOM 305 C MET A 20 -10.432 8.818 -7.163 1.00 0.00 C ATOM 306 O MET A 20 -11.547 8.712 -6.640 1.00 0.00 O ATOM 307 CB MET A 20 -8.500 8.194 -5.553 1.00 0.00 C ATOM 308 CG MET A 20 -7.429 9.275 -5.699 1.00 0.00 C ATOM 309 SD MET A 20 -6.720 9.769 -4.103 1.00 0.00 S ATOM 310 CE MET A 20 -5.856 8.245 -3.636 1.00 0.00 C ATOM 0 H MET A 20 -7.521 8.033 -7.908 1.00 0.00 H new ATOM 0 HA MET A 20 -9.815 6.910 -6.556 1.00 0.00 H new ATOM 0 HB2 MET A 20 -9.202 8.514 -4.782 1.00 0.00 H new ATOM 0 HB3 MET A 20 -8.018 7.286 -5.189 1.00 0.00 H new ATOM 0 HG2 MET A 20 -6.634 8.909 -6.349 1.00 0.00 H new ATOM 0 HG3 MET A 20 -7.862 10.148 -6.186 1.00 0.00 H new ATOM 0 HE1 MET A 20 -5.197 8.445 -2.791 1.00 0.00 H new ATOM 0 HE2 MET A 20 -6.585 7.485 -3.356 1.00 0.00 H new ATOM 0 HE3 MET A 20 -5.266 7.888 -4.480 1.00 0.00 H new ATOM 320 N LYS A 21 -10.169 9.775 -8.055 1.00 0.00 N ATOM 321 CA LYS A 21 -11.186 10.669 -8.594 1.00 0.00 C ATOM 322 C LYS A 21 -12.324 9.882 -9.245 1.00 0.00 C ATOM 323 O LYS A 21 -13.476 10.294 -9.110 1.00 0.00 O ATOM 324 CB LYS A 21 -10.565 11.650 -9.604 1.00 0.00 C ATOM 325 CG LYS A 21 -10.334 13.064 -9.054 1.00 0.00 C ATOM 326 CD LYS A 21 -11.455 14.076 -9.348 1.00 0.00 C ATOM 327 CE LYS A 21 -12.771 13.877 -8.575 1.00 0.00 C ATOM 328 NZ LYS A 21 -13.723 12.964 -9.247 1.00 0.00 N ATOM 0 H LYS A 21 -9.234 9.950 -8.424 1.00 0.00 H new ATOM 0 HA LYS A 21 -11.602 11.241 -7.764 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -9.612 11.246 -9.946 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -11.215 11.714 -10.476 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -10.200 12.999 -7.974 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -9.402 13.449 -9.468 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -11.079 15.076 -9.132 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -11.676 14.042 -10.415 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -12.544 13.485 -7.583 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -13.249 14.846 -8.433 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -14.685 13.353 -9.178 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -13.460 12.864 -10.248 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -13.693 12.032 -8.787 1.00 0.00 H new ATOM 342 N SER A 22 -12.006 8.818 -9.979 1.00 0.00 N ATOM 343 CA SER A 22 -12.965 8.006 -10.711 1.00 0.00 C ATOM 344 C SER A 22 -13.624 6.991 -9.773 1.00 0.00 C ATOM 345 O SER A 22 -14.839 6.813 -9.828 1.00 0.00 O ATOM 346 CB SER A 22 -12.291 7.366 -11.933 1.00 0.00 C ATOM 347 OG SER A 22 -11.075 6.740 -11.583 1.00 0.00 O ATOM 0 H SER A 22 -11.045 8.491 -10.081 1.00 0.00 H new ATOM 0 HA SER A 22 -13.769 8.633 -11.096 1.00 0.00 H new ATOM 0 HB2 SER A 22 -12.964 6.633 -12.379 1.00 0.00 H new ATOM 0 HB3 SER A 22 -12.105 8.129 -12.689 1.00 0.00 H new ATOM 0 HG SER A 22 -10.382 7.421 -11.453 1.00 0.00 H new ATOM 353 N LEU A 23 -12.853 6.369 -8.871 1.00 0.00 N ATOM 354 CA LEU A 23 -13.413 5.498 -7.838 1.00 0.00 C ATOM 355 C LEU A 23 -14.444 6.229 -6.974 1.00 0.00 C ATOM 356 O LEU A 23 -15.444 5.635 -6.578 1.00 0.00 O ATOM 357 CB LEU A 23 -12.306 4.935 -6.938 1.00 0.00 C ATOM 358 CG LEU A 23 -11.464 3.850 -7.624 1.00 0.00 C ATOM 359 CD1 LEU A 23 -10.233 3.515 -6.774 1.00 0.00 C ATOM 360 CD2 LEU A 23 -12.297 2.582 -7.841 1.00 0.00 C ATOM 0 H LEU A 23 -11.837 6.456 -8.839 1.00 0.00 H new ATOM 0 HA LEU A 23 -13.913 4.679 -8.354 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -11.653 5.749 -6.624 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -12.756 4.521 -6.035 1.00 0.00 H new ATOM 0 HG LEU A 23 -11.139 4.232 -8.592 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -9.645 2.744 -7.273 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -9.624 4.410 -6.647 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -10.553 3.152 -5.797 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -11.685 1.823 -8.328 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -12.644 2.205 -6.879 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -13.156 2.814 -8.471 1.00 0.00 H new ATOM 372 N GLY A 24 -14.186 7.498 -6.647 1.00 0.00 N ATOM 373 CA GLY A 24 -15.057 8.287 -5.785 1.00 0.00 C ATOM 374 C GLY A 24 -14.443 8.389 -4.394 1.00 0.00 C ATOM 375 O GLY A 24 -15.050 8.034 -3.381 1.00 0.00 O ATOM 0 H GLY A 24 -13.364 8.005 -6.976 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -15.197 9.283 -6.206 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -16.042 7.825 -5.726 1.00 0.00 H new ATOM 379 N VAL A 25 -13.203 8.870 -4.359 1.00 0.00 N ATOM 380 CA VAL A 25 -12.443 9.111 -3.141 1.00 0.00 C ATOM 381 C VAL A 25 -11.352 10.175 -3.353 1.00 0.00 C ATOM 382 O VAL A 25 -10.749 10.633 -2.387 1.00 0.00 O ATOM 383 CB VAL A 25 -11.939 7.768 -2.568 1.00 0.00 C ATOM 384 CG1 VAL A 25 -11.544 6.739 -3.637 1.00 0.00 C ATOM 385 CG2 VAL A 25 -10.789 7.948 -1.577 1.00 0.00 C ATOM 0 H VAL A 25 -12.686 9.109 -5.205 1.00 0.00 H new ATOM 0 HA VAL A 25 -13.091 9.545 -2.379 1.00 0.00 H new ATOM 0 HB VAL A 25 -12.803 7.367 -2.038 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -11.201 5.825 -3.153 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -12.407 6.516 -4.264 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -10.743 7.145 -4.254 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -10.473 6.973 -1.205 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -9.951 8.435 -2.076 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -11.121 8.565 -0.742 1.00 0.00 H new ATOM 395 N GLY A 26 -11.095 10.603 -4.595 1.00 0.00 N ATOM 396 CA GLY A 26 -10.081 11.595 -4.924 1.00 0.00 C ATOM 397 C GLY A 26 -10.325 12.970 -4.306 1.00 0.00 C ATOM 398 O GLY A 26 -10.742 13.903 -4.990 1.00 0.00 O ATOM 0 H GLY A 26 -11.600 10.258 -5.411 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -9.109 11.228 -4.593 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -10.030 11.700 -6.008 1.00 0.00 H new ATOM 402 N PHE A 27 -9.990 13.094 -3.022 1.00 0.00 N ATOM 403 CA PHE A 27 -9.671 14.348 -2.364 1.00 0.00 C ATOM 404 C PHE A 27 -8.658 15.116 -3.217 1.00 0.00 C ATOM 405 O PHE A 27 -7.726 14.520 -3.759 1.00 0.00 O ATOM 406 CB PHE A 27 -9.123 14.067 -0.951 1.00 0.00 C ATOM 407 CG PHE A 27 -8.261 12.817 -0.809 1.00 0.00 C ATOM 408 CD1 PHE A 27 -6.939 12.798 -1.285 1.00 0.00 C ATOM 409 CD2 PHE A 27 -8.808 11.649 -0.244 1.00 0.00 C ATOM 410 CE1 PHE A 27 -6.163 11.629 -1.182 1.00 0.00 C ATOM 411 CE2 PHE A 27 -8.039 10.479 -0.152 1.00 0.00 C ATOM 412 CZ PHE A 27 -6.713 10.467 -0.617 1.00 0.00 C ATOM 0 H PHE A 27 -9.933 12.292 -2.394 1.00 0.00 H new ATOM 0 HA PHE A 27 -10.567 14.960 -2.259 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -8.536 14.928 -0.632 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -9.966 13.984 -0.265 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -6.516 13.686 -1.732 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -9.825 11.654 0.120 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -5.143 11.625 -1.538 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -8.467 9.585 0.277 1.00 0.00 H new ATOM 0 HZ PHE A 27 -6.119 9.568 -0.540 1.00 0.00 H new ATOM 422 N ALA A 28 -8.836 16.436 -3.328 1.00 0.00 N ATOM 423 CA ALA A 28 -8.027 17.304 -4.175 1.00 0.00 C ATOM 424 C ALA A 28 -6.631 17.504 -3.581 1.00 0.00 C ATOM 425 O ALA A 28 -6.238 18.617 -3.234 1.00 0.00 O ATOM 426 CB ALA A 28 -8.757 18.640 -4.354 1.00 0.00 C ATOM 0 H ALA A 28 -9.564 16.937 -2.818 1.00 0.00 H new ATOM 0 HA ALA A 28 -7.891 16.838 -5.151 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -8.161 19.298 -4.986 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -9.725 18.465 -4.823 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -8.904 19.108 -3.380 1.00 0.00 H new ATOM 432 N THR A 29 -5.850 16.434 -3.451 1.00 0.00 N ATOM 433 CA THR A 29 -4.537 16.472 -2.820 1.00 0.00 C ATOM 434 C THR A 29 -3.588 15.455 -3.453 1.00 0.00 C ATOM 435 O THR A 29 -2.407 15.756 -3.622 1.00 0.00 O ATOM 436 CB THR A 29 -4.682 16.288 -1.301 1.00 0.00 C ATOM 437 OG1 THR A 29 -5.640 17.203 -0.794 1.00 0.00 O ATOM 438 CG2 THR A 29 -3.352 16.472 -0.555 1.00 0.00 C ATOM 0 H THR A 29 -6.116 15.508 -3.785 1.00 0.00 H new ATOM 0 HA THR A 29 -4.086 17.450 -2.990 1.00 0.00 H new ATOM 0 HB THR A 29 -5.012 15.263 -1.133 1.00 0.00 H new ATOM 0 HG1 THR A 29 -5.729 17.080 0.174 1.00 0.00 H new ATOM 0 HG21 THR A 29 -3.512 16.331 0.514 1.00 0.00 H new ATOM 0 HG22 THR A 29 -2.629 15.739 -0.913 1.00 0.00 H new ATOM 0 HG23 THR A 29 -2.970 17.477 -0.735 1.00 0.00 H new ATOM 446 N ARG A 30 -4.066 14.261 -3.832 1.00 0.00 N ATOM 447 CA ARG A 30 -3.198 13.299 -4.505 1.00 0.00 C ATOM 448 C ARG A 30 -2.601 13.936 -5.766 1.00 0.00 C ATOM 449 O ARG A 30 -1.416 13.741 -6.037 1.00 0.00 O ATOM 450 CB ARG A 30 -3.944 11.980 -4.774 1.00 0.00 C ATOM 451 CG ARG A 30 -3.018 10.796 -5.087 1.00 0.00 C ATOM 452 CD ARG A 30 -2.379 10.264 -3.796 1.00 0.00 C ATOM 453 NE ARG A 30 -1.265 9.339 -4.043 1.00 0.00 N ATOM 454 CZ ARG A 30 -0.002 9.748 -4.234 1.00 0.00 C ATOM 455 NH1 ARG A 30 0.220 11.002 -4.627 1.00 0.00 N ATOM 456 NH2 ARG A 30 1.025 8.927 -3.997 1.00 0.00 N ATOM 0 H ARG A 30 -5.026 13.948 -3.686 1.00 0.00 H new ATOM 0 HA ARG A 30 -2.363 13.036 -3.856 1.00 0.00 H new ATOM 0 HB2 ARG A 30 -4.552 11.733 -3.903 1.00 0.00 H new ATOM 0 HB3 ARG A 30 -4.628 12.125 -5.610 1.00 0.00 H new ATOM 0 HG2 ARG A 30 -3.584 10.002 -5.575 1.00 0.00 H new ATOM 0 HG3 ARG A 30 -2.240 11.108 -5.784 1.00 0.00 H new ATOM 0 HD2 ARG A 30 -2.020 11.105 -3.202 1.00 0.00 H new ATOM 0 HD3 ARG A 30 -3.140 9.757 -3.203 1.00 0.00 H new ATOM 0 HE ARG A 30 -1.461 8.338 -4.071 1.00 0.00 H new ATOM 0 HH11 ARG A 30 -0.565 11.636 -4.778 1.00 0.00 H new ATOM 0 HH12 ARG A 30 1.175 11.328 -4.777 1.00 0.00 H new ATOM 0 HH21 ARG A 30 0.853 7.977 -3.667 1.00 0.00 H new ATOM 0 HH22 ARG A 30 1.981 9.250 -4.146 1.00 0.00 H new ATOM 470 N GLN A 31 -3.415 14.742 -6.455 1.00 0.00 N ATOM 471 CA GLN A 31 -3.088 15.617 -7.572 1.00 0.00 C ATOM 472 C GLN A 31 -1.788 16.414 -7.414 1.00 0.00 C ATOM 473 O GLN A 31 -1.138 16.652 -8.430 1.00 0.00 O ATOM 474 CB GLN A 31 -4.297 16.513 -7.912 1.00 0.00 C ATOM 475 CG GLN A 31 -4.867 17.358 -6.754 1.00 0.00 C ATOM 476 CD GLN A 31 -4.076 18.629 -6.451 1.00 0.00 C ATOM 477 OE1 GLN A 31 -3.274 19.076 -7.262 1.00 0.00 O ATOM 478 NE2 GLN A 31 -4.287 19.242 -5.287 1.00 0.00 N ATOM 0 H GLN A 31 -4.406 14.799 -6.220 1.00 0.00 H new ATOM 0 HA GLN A 31 -2.879 14.965 -8.420 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -4.007 17.188 -8.718 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -5.095 15.879 -8.298 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -5.895 17.632 -6.992 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -4.902 16.743 -5.855 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -4.958 18.857 -4.622 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -3.777 20.096 -5.061 1.00 0.00 H new ATOM 487 N VAL A 32 -1.414 16.814 -6.187 1.00 0.00 N ATOM 488 CA VAL A 32 -0.166 17.534 -5.917 1.00 0.00 C ATOM 489 C VAL A 32 0.828 16.658 -5.145 1.00 0.00 C ATOM 490 O VAL A 32 2.032 16.698 -5.407 1.00 0.00 O ATOM 491 CB VAL A 32 -0.441 18.894 -5.245 1.00 0.00 C ATOM 492 CG1 VAL A 32 -1.063 18.788 -3.849 1.00 0.00 C ATOM 493 CG2 VAL A 32 0.838 19.741 -5.176 1.00 0.00 C ATOM 0 H VAL A 32 -1.975 16.644 -5.352 1.00 0.00 H new ATOM 0 HA VAL A 32 0.315 17.761 -6.869 1.00 0.00 H new ATOM 0 HB VAL A 32 -1.180 19.382 -5.880 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -1.225 19.788 -3.446 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -2.017 18.264 -3.914 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -0.391 18.236 -3.192 1.00 0.00 H new ATOM 0 HG21 VAL A 32 0.617 20.695 -4.698 1.00 0.00 H new ATOM 0 HG22 VAL A 32 1.594 19.211 -4.597 1.00 0.00 H new ATOM 0 HG23 VAL A 32 1.212 19.918 -6.184 1.00 0.00 H new ATOM 503 N GLY A 33 0.350 15.797 -4.238 1.00 0.00 N ATOM 504 CA GLY A 33 1.179 14.900 -3.434 1.00 0.00 C ATOM 505 C GLY A 33 1.790 13.733 -4.229 1.00 0.00 C ATOM 506 O GLY A 33 2.023 12.654 -3.676 1.00 0.00 O ATOM 0 H GLY A 33 -0.647 15.705 -4.041 1.00 0.00 H new ATOM 0 HA2 GLY A 33 1.984 15.477 -2.978 1.00 0.00 H new ATOM 0 HA3 GLY A 33 0.576 14.496 -2.621 1.00 0.00 H new ATOM 510 N ASN A 34 1.993 13.923 -5.533 1.00 0.00 N ATOM 511 CA ASN A 34 2.430 12.985 -6.562 1.00 0.00 C ATOM 512 C ASN A 34 3.698 13.521 -7.240 1.00 0.00 C ATOM 513 O ASN A 34 4.600 12.754 -7.568 1.00 0.00 O ATOM 514 CB ASN A 34 1.302 12.790 -7.601 1.00 0.00 C ATOM 515 CG ASN A 34 0.736 14.104 -8.156 1.00 0.00 C ATOM 516 OD1 ASN A 34 1.154 15.186 -7.758 1.00 0.00 O ATOM 517 ND2 ASN A 34 -0.233 14.050 -9.060 1.00 0.00 N ATOM 0 H ASN A 34 1.836 14.846 -5.938 1.00 0.00 H new ATOM 0 HA ASN A 34 2.656 12.021 -6.107 1.00 0.00 H new ATOM 0 HB2 ASN A 34 1.683 12.191 -8.428 1.00 0.00 H new ATOM 0 HB3 ASN A 34 0.493 12.222 -7.142 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -0.635 14.912 -9.429 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -0.576 13.147 -9.387 1.00 0.00 H new ATOM 524 N MET A 35 3.759 14.837 -7.473 1.00 0.00 N ATOM 525 CA MET A 35 4.880 15.515 -8.096 1.00 0.00 C ATOM 526 C MET A 35 6.055 15.520 -7.119 1.00 0.00 C ATOM 527 O MET A 35 7.191 15.243 -7.506 1.00 0.00 O ATOM 528 CB MET A 35 4.432 16.927 -8.503 1.00 0.00 C ATOM 529 CG MET A 35 5.381 17.621 -9.489 1.00 0.00 C ATOM 530 SD MET A 35 4.978 17.465 -11.257 1.00 0.00 S ATOM 531 CE MET A 35 5.242 15.696 -11.549 1.00 0.00 C ATOM 0 H MET A 35 3.001 15.471 -7.222 1.00 0.00 H new ATOM 0 HA MET A 35 5.212 15.004 -8.999 1.00 0.00 H new ATOM 0 HB2 MET A 35 3.440 16.868 -8.950 1.00 0.00 H new ATOM 0 HB3 MET A 35 4.342 17.541 -7.607 1.00 0.00 H new ATOM 0 HG2 MET A 35 5.415 18.682 -9.240 1.00 0.00 H new ATOM 0 HG3 MET A 35 6.384 17.225 -9.332 1.00 0.00 H new ATOM 0 HE1 MET A 35 5.382 15.520 -12.616 1.00 0.00 H new ATOM 0 HE2 MET A 35 6.128 15.366 -11.007 1.00 0.00 H new ATOM 0 HE3 MET A 35 4.374 15.136 -11.200 1.00 0.00 H new ATOM 541 N THR A 36 5.760 15.794 -5.844 1.00 0.00 N ATOM 542 CA THR A 36 6.615 15.368 -4.747 1.00 0.00 C ATOM 543 C THR A 36 6.674 13.838 -4.819 1.00 0.00 C ATOM 544 O THR A 36 5.637 13.182 -4.749 1.00 0.00 O ATOM 545 CB THR A 36 6.073 15.914 -3.411 1.00 0.00 C ATOM 546 OG1 THR A 36 6.977 15.652 -2.360 1.00 0.00 O ATOM 547 CG2 THR A 36 4.708 15.353 -3.009 1.00 0.00 C ATOM 0 H THR A 36 4.931 16.311 -5.552 1.00 0.00 H new ATOM 0 HA THR A 36 7.628 15.763 -4.821 1.00 0.00 H new ATOM 0 HB THR A 36 5.955 16.985 -3.578 1.00 0.00 H new ATOM 0 HG1 THR A 36 6.616 16.008 -1.521 1.00 0.00 H new ATOM 0 HG21 THR A 36 4.401 15.789 -2.058 1.00 0.00 H new ATOM 0 HG22 THR A 36 3.973 15.600 -3.775 1.00 0.00 H new ATOM 0 HG23 THR A 36 4.776 14.270 -2.906 1.00 0.00 H new ATOM 555 N LYS A 37 7.861 13.275 -5.066 1.00 0.00 N ATOM 556 CA LYS A 37 8.003 11.866 -5.406 1.00 0.00 C ATOM 557 C LYS A 37 7.562 11.017 -4.208 1.00 0.00 C ATOM 558 O LYS A 37 8.228 11.081 -3.175 1.00 0.00 O ATOM 559 CB LYS A 37 9.463 11.537 -5.763 1.00 0.00 C ATOM 560 CG LYS A 37 9.968 12.143 -7.081 1.00 0.00 C ATOM 561 CD LYS A 37 10.306 13.640 -6.973 1.00 0.00 C ATOM 562 CE LYS A 37 11.171 14.132 -8.141 1.00 0.00 C ATOM 563 NZ LYS A 37 10.510 13.935 -9.447 1.00 0.00 N ATOM 0 H LYS A 37 8.744 13.785 -5.035 1.00 0.00 H new ATOM 0 HA LYS A 37 7.379 11.645 -6.272 1.00 0.00 H new ATOM 0 HB2 LYS A 37 10.105 11.884 -4.953 1.00 0.00 H new ATOM 0 HB3 LYS A 37 9.572 10.454 -5.815 1.00 0.00 H new ATOM 0 HG2 LYS A 37 10.855 11.600 -7.406 1.00 0.00 H new ATOM 0 HG3 LYS A 37 9.209 12.004 -7.851 1.00 0.00 H new ATOM 0 HD2 LYS A 37 9.382 14.217 -6.941 1.00 0.00 H new ATOM 0 HD3 LYS A 37 10.829 13.824 -6.035 1.00 0.00 H new ATOM 0 HE2 LYS A 37 11.394 15.190 -8.005 1.00 0.00 H new ATOM 0 HE3 LYS A 37 12.123 13.602 -8.134 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 11.123 14.297 -10.205 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 10.335 12.921 -9.598 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 9.605 14.448 -9.459 1.00 0.00 H new ATOM 577 N PRO A 38 6.476 10.233 -4.298 1.00 0.00 N ATOM 578 CA PRO A 38 6.060 9.408 -3.185 1.00 0.00 C ATOM 579 C PRO A 38 7.037 8.241 -3.015 1.00 0.00 C ATOM 580 O PRO A 38 7.746 7.845 -3.947 1.00 0.00 O ATOM 581 CB PRO A 38 4.629 8.975 -3.507 1.00 0.00 C ATOM 582 CG PRO A 38 4.619 8.934 -5.035 1.00 0.00 C ATOM 583 CD PRO A 38 5.586 10.053 -5.435 1.00 0.00 C ATOM 0 HA PRO A 38 6.071 9.931 -2.229 1.00 0.00 H new ATOM 0 HB2 PRO A 38 4.395 8.002 -3.075 1.00 0.00 H new ATOM 0 HB3 PRO A 38 3.896 9.681 -3.117 1.00 0.00 H new ATOM 0 HG2 PRO A 38 4.949 7.966 -5.412 1.00 0.00 H new ATOM 0 HG3 PRO A 38 3.619 9.107 -5.434 1.00 0.00 H new ATOM 0 HD2 PRO A 38 6.146 9.784 -6.331 1.00 0.00 H new ATOM 0 HD3 PRO A 38 5.047 10.974 -5.660 1.00 0.00 H new ATOM 591 N THR A 39 7.075 7.707 -1.797 1.00 0.00 N ATOM 592 CA THR A 39 8.021 6.688 -1.377 1.00 0.00 C ATOM 593 C THR A 39 7.247 5.570 -0.694 1.00 0.00 C ATOM 594 O THR A 39 6.143 5.788 -0.188 1.00 0.00 O ATOM 595 CB THR A 39 9.092 7.339 -0.480 1.00 0.00 C ATOM 596 OG1 THR A 39 9.942 8.129 -1.280 1.00 0.00 O ATOM 597 CG2 THR A 39 9.993 6.344 0.247 1.00 0.00 C ATOM 0 H THR A 39 6.429 7.982 -1.057 1.00 0.00 H new ATOM 0 HA THR A 39 8.550 6.245 -2.221 1.00 0.00 H new ATOM 0 HB THR A 39 8.539 7.909 0.267 1.00 0.00 H new ATOM 0 HG1 THR A 39 10.625 8.548 -0.716 1.00 0.00 H new ATOM 0 HG21 THR A 39 10.717 6.886 0.855 1.00 0.00 H new ATOM 0 HG22 THR A 39 9.386 5.705 0.888 1.00 0.00 H new ATOM 0 HG23 THR A 39 10.520 5.730 -0.483 1.00 0.00 H new ATOM 605 N THR A 40 7.794 4.356 -0.714 1.00 0.00 N ATOM 606 CA THR A 40 7.153 3.199 -0.127 1.00 0.00 C ATOM 607 C THR A 40 8.231 2.262 0.407 1.00 0.00 C ATOM 608 O THR A 40 9.051 1.765 -0.365 1.00 0.00 O ATOM 609 CB THR A 40 6.233 2.545 -1.169 1.00 0.00 C ATOM 610 OG1 THR A 40 5.383 3.536 -1.710 1.00 0.00 O ATOM 611 CG2 THR A 40 5.330 1.494 -0.532 1.00 0.00 C ATOM 0 H THR A 40 8.698 4.155 -1.141 1.00 0.00 H new ATOM 0 HA THR A 40 6.520 3.476 0.716 1.00 0.00 H new ATOM 0 HB THR A 40 6.864 2.080 -1.926 1.00 0.00 H new ATOM 0 HG1 THR A 40 5.164 3.309 -2.638 1.00 0.00 H new ATOM 0 HG21 THR A 40 4.692 1.051 -1.297 1.00 0.00 H new ATOM 0 HG22 THR A 40 5.943 0.717 -0.075 1.00 0.00 H new ATOM 0 HG23 THR A 40 4.709 1.962 0.232 1.00 0.00 H new ATOM 619 N ILE A 41 8.248 2.026 1.722 1.00 0.00 N ATOM 620 CA ILE A 41 9.042 0.926 2.258 1.00 0.00 C ATOM 621 C ILE A 41 8.245 -0.345 1.985 1.00 0.00 C ATOM 622 O ILE A 41 7.016 -0.290 2.038 1.00 0.00 O ATOM 623 CB ILE A 41 9.401 1.120 3.747 1.00 0.00 C ATOM 624 CG1 ILE A 41 8.359 0.506 4.696 1.00 0.00 C ATOM 625 CG2 ILE A 41 9.658 2.602 4.059 1.00 0.00 C ATOM 626 CD1 ILE A 41 8.607 0.832 6.172 1.00 0.00 C ATOM 0 H ILE A 41 7.734 2.568 2.417 1.00 0.00 H new ATOM 0 HA ILE A 41 10.015 0.872 1.770 1.00 0.00 H new ATOM 0 HB ILE A 41 10.326 0.572 3.926 1.00 0.00 H new ATOM 0 HG12 ILE A 41 7.368 0.864 4.415 1.00 0.00 H new ATOM 0 HG13 ILE A 41 8.356 -0.576 4.567 1.00 0.00 H new ATOM 0 HG21 ILE A 41 9.909 2.714 5.114 1.00 0.00 H new ATOM 0 HG22 ILE A 41 10.485 2.964 3.449 1.00 0.00 H new ATOM 0 HG23 ILE A 41 8.762 3.181 3.836 1.00 0.00 H new ATOM 0 HD11 ILE A 41 7.833 0.366 6.782 1.00 0.00 H new ATOM 0 HD12 ILE A 41 9.583 0.450 6.470 1.00 0.00 H new ATOM 0 HD13 ILE A 41 8.581 1.912 6.315 1.00 0.00 H new ATOM 638 N ILE A 42 8.919 -1.455 1.678 1.00 0.00 N ATOM 639 CA ILE A 42 8.312 -2.770 1.538 1.00 0.00 C ATOM 640 C ILE A 42 9.235 -3.739 2.275 1.00 0.00 C ATOM 641 O ILE A 42 10.363 -3.926 1.826 1.00 0.00 O ATOM 642 CB ILE A 42 8.151 -3.143 0.049 1.00 0.00 C ATOM 643 CG1 ILE A 42 7.276 -2.111 -0.688 1.00 0.00 C ATOM 644 CG2 ILE A 42 7.535 -4.545 -0.041 1.00 0.00 C ATOM 645 CD1 ILE A 42 7.050 -2.423 -2.172 1.00 0.00 C ATOM 0 H ILE A 42 9.926 -1.459 1.517 1.00 0.00 H new ATOM 0 HA ILE A 42 7.308 -2.800 1.961 1.00 0.00 H new ATOM 0 HB ILE A 42 9.128 -3.140 -0.434 1.00 0.00 H new ATOM 0 HG12 ILE A 42 6.308 -2.050 -0.190 1.00 0.00 H new ATOM 0 HG13 ILE A 42 7.741 -1.129 -0.602 1.00 0.00 H new ATOM 0 HG21 ILE A 42 7.415 -4.823 -1.088 1.00 0.00 H new ATOM 0 HG22 ILE A 42 8.191 -5.263 0.452 1.00 0.00 H new ATOM 0 HG23 ILE A 42 6.561 -4.547 0.449 1.00 0.00 H new ATOM 0 HD11 ILE A 42 6.425 -1.648 -2.616 1.00 0.00 H new ATOM 0 HD12 ILE A 42 8.010 -2.454 -2.688 1.00 0.00 H new ATOM 0 HD13 ILE A 42 6.555 -3.389 -2.269 1.00 0.00 H new ATOM 657 N GLU A 43 8.798 -4.312 3.404 1.00 0.00 N ATOM 658 CA GLU A 43 9.651 -5.130 4.267 1.00 0.00 C ATOM 659 C GLU A 43 8.995 -6.481 4.565 1.00 0.00 C ATOM 660 O GLU A 43 7.773 -6.555 4.702 1.00 0.00 O ATOM 661 CB GLU A 43 9.974 -4.337 5.545 1.00 0.00 C ATOM 662 CG GLU A 43 10.961 -5.055 6.476 1.00 0.00 C ATOM 663 CD GLU A 43 12.243 -5.440 5.751 1.00 0.00 C ATOM 664 OE1 GLU A 43 12.233 -6.547 5.168 1.00 0.00 O ATOM 665 OE2 GLU A 43 13.174 -4.609 5.744 1.00 0.00 O ATOM 0 H GLU A 43 7.840 -4.219 3.743 1.00 0.00 H new ATOM 0 HA GLU A 43 10.588 -5.355 3.758 1.00 0.00 H new ATOM 0 HB2 GLU A 43 10.388 -3.368 5.267 1.00 0.00 H new ATOM 0 HB3 GLU A 43 9.049 -4.145 6.088 1.00 0.00 H new ATOM 0 HG2 GLU A 43 11.201 -4.408 7.320 1.00 0.00 H new ATOM 0 HG3 GLU A 43 10.491 -5.950 6.884 1.00 0.00 H new ATOM 672 N VAL A 44 9.793 -7.551 4.652 1.00 0.00 N ATOM 673 CA VAL A 44 9.307 -8.911 4.861 1.00 0.00 C ATOM 674 C VAL A 44 8.921 -9.113 6.329 1.00 0.00 C ATOM 675 O VAL A 44 9.667 -9.661 7.138 1.00 0.00 O ATOM 676 CB VAL A 44 10.273 -9.961 4.272 1.00 0.00 C ATOM 677 CG1 VAL A 44 11.657 -10.041 4.933 1.00 0.00 C ATOM 678 CG2 VAL A 44 9.636 -11.355 4.288 1.00 0.00 C ATOM 0 H VAL A 44 10.809 -7.491 4.578 1.00 0.00 H new ATOM 0 HA VAL A 44 8.388 -9.067 4.297 1.00 0.00 H new ATOM 0 HB VAL A 44 10.447 -9.613 3.254 1.00 0.00 H new ATOM 0 HG11 VAL A 44 12.252 -10.810 4.440 1.00 0.00 H new ATOM 0 HG12 VAL A 44 12.161 -9.079 4.841 1.00 0.00 H new ATOM 0 HG13 VAL A 44 11.543 -10.291 5.988 1.00 0.00 H new ATOM 0 HG21 VAL A 44 10.334 -12.079 3.868 1.00 0.00 H new ATOM 0 HG22 VAL A 44 9.397 -11.634 5.314 1.00 0.00 H new ATOM 0 HG23 VAL A 44 8.723 -11.345 3.693 1.00 0.00 H new ATOM 688 N ASN A 45 7.724 -8.644 6.678 1.00 0.00 N ATOM 689 CA ASN A 45 7.131 -8.825 7.995 1.00 0.00 C ATOM 690 C ASN A 45 6.833 -10.306 8.277 1.00 0.00 C ATOM 691 O ASN A 45 5.692 -10.765 8.194 1.00 0.00 O ATOM 692 CB ASN A 45 5.881 -7.950 8.107 1.00 0.00 C ATOM 693 CG ASN A 45 5.214 -8.075 9.474 1.00 0.00 C ATOM 694 OD1 ASN A 45 5.845 -8.450 10.457 1.00 0.00 O ATOM 695 ND2 ASN A 45 3.931 -7.741 9.554 1.00 0.00 N ATOM 0 H ASN A 45 7.130 -8.117 6.037 1.00 0.00 H new ATOM 0 HA ASN A 45 7.842 -8.510 8.759 1.00 0.00 H new ATOM 0 HB2 ASN A 45 6.151 -6.909 7.929 1.00 0.00 H new ATOM 0 HB3 ASN A 45 5.170 -8.232 7.330 1.00 0.00 H new ATOM 0 HD21 ASN A 45 3.445 -7.793 10.449 1.00 0.00 H new ATOM 0 HD22 ASN A 45 3.431 -7.433 8.720 1.00 0.00 H new ATOM 702 N GLY A 46 7.877 -11.057 8.630 1.00 0.00 N ATOM 703 CA GLY A 46 7.783 -12.463 8.977 1.00 0.00 C ATOM 704 C GLY A 46 7.367 -13.273 7.754 1.00 0.00 C ATOM 705 O GLY A 46 8.119 -13.349 6.785 1.00 0.00 O ATOM 0 H GLY A 46 8.828 -10.691 8.682 1.00 0.00 H new ATOM 0 HA2 GLY A 46 8.743 -12.819 9.350 1.00 0.00 H new ATOM 0 HA3 GLY A 46 7.058 -12.601 9.779 1.00 0.00 H new ATOM 709 N ASP A 47 6.172 -13.869 7.788 1.00 0.00 N ATOM 710 CA ASP A 47 5.630 -14.599 6.652 1.00 0.00 C ATOM 711 C ASP A 47 4.882 -13.664 5.695 1.00 0.00 C ATOM 712 O ASP A 47 4.528 -14.088 4.590 1.00 0.00 O ATOM 713 CB ASP A 47 4.715 -15.724 7.154 1.00 0.00 C ATOM 714 CG ASP A 47 3.322 -15.202 7.459 1.00 0.00 C ATOM 715 OD1 ASP A 47 3.186 -14.545 8.508 1.00 0.00 O ATOM 716 OD2 ASP A 47 2.444 -15.427 6.594 1.00 0.00 O ATOM 0 H ASP A 47 5.559 -13.856 8.603 1.00 0.00 H new ATOM 0 HA ASP A 47 6.455 -15.038 6.091 1.00 0.00 H new ATOM 0 HB2 ASP A 47 4.655 -16.511 6.402 1.00 0.00 H new ATOM 0 HB3 ASP A 47 5.143 -16.172 8.051 1.00 0.00 H new ATOM 721 N THR A 48 4.602 -12.428 6.123 1.00 0.00 N ATOM 722 CA THR A 48 3.896 -11.429 5.342 1.00 0.00 C ATOM 723 C THR A 48 4.920 -10.440 4.787 1.00 0.00 C ATOM 724 O THR A 48 6.118 -10.555 5.050 1.00 0.00 O ATOM 725 CB THR A 48 2.815 -10.744 6.204 1.00 0.00 C ATOM 726 OG1 THR A 48 3.365 -9.871 7.161 1.00 0.00 O ATOM 727 CG2 THR A 48 1.962 -11.743 6.984 1.00 0.00 C ATOM 0 H THR A 48 4.871 -12.095 7.049 1.00 0.00 H new ATOM 0 HA THR A 48 3.374 -11.890 4.503 1.00 0.00 H new ATOM 0 HB THR A 48 2.206 -10.199 5.483 1.00 0.00 H new ATOM 0 HG1 THR A 48 4.161 -10.281 7.559 1.00 0.00 H new ATOM 0 HG21 THR A 48 1.219 -11.205 7.572 1.00 0.00 H new ATOM 0 HG22 THR A 48 1.458 -12.413 6.287 1.00 0.00 H new ATOM 0 HG23 THR A 48 2.600 -12.325 7.649 1.00 0.00 H new ATOM 735 N VAL A 49 4.447 -9.455 4.028 1.00 0.00 N ATOM 736 CA VAL A 49 5.208 -8.283 3.658 1.00 0.00 C ATOM 737 C VAL A 49 4.375 -7.084 4.104 1.00 0.00 C ATOM 738 O VAL A 49 3.151 -7.115 3.988 1.00 0.00 O ATOM 739 CB VAL A 49 5.531 -8.326 2.155 1.00 0.00 C ATOM 740 CG1 VAL A 49 4.321 -8.020 1.265 1.00 0.00 C ATOM 741 CG2 VAL A 49 6.680 -7.376 1.806 1.00 0.00 C ATOM 0 H VAL A 49 3.500 -9.457 3.648 1.00 0.00 H new ATOM 0 HA VAL A 49 6.182 -8.223 4.143 1.00 0.00 H new ATOM 0 HB VAL A 49 5.833 -9.353 1.951 1.00 0.00 H new ATOM 0 HG11 VAL A 49 4.619 -8.067 0.217 1.00 0.00 H new ATOM 0 HG12 VAL A 49 3.537 -8.753 1.453 1.00 0.00 H new ATOM 0 HG13 VAL A 49 3.946 -7.022 1.491 1.00 0.00 H new ATOM 0 HG21 VAL A 49 6.884 -7.429 0.737 1.00 0.00 H new ATOM 0 HG22 VAL A 49 6.402 -6.356 2.072 1.00 0.00 H new ATOM 0 HG23 VAL A 49 7.573 -7.665 2.361 1.00 0.00 H new ATOM 751 N ILE A 50 5.009 -6.056 4.664 1.00 0.00 N ATOM 752 CA ILE A 50 4.340 -4.824 5.052 1.00 0.00 C ATOM 753 C ILE A 50 4.848 -3.717 4.149 1.00 0.00 C ATOM 754 O ILE A 50 6.057 -3.644 3.919 1.00 0.00 O ATOM 755 CB ILE A 50 4.526 -4.542 6.556 1.00 0.00 C ATOM 756 CG1 ILE A 50 3.620 -3.376 6.994 1.00 0.00 C ATOM 757 CG2 ILE A 50 5.990 -4.267 6.928 1.00 0.00 C ATOM 758 CD1 ILE A 50 3.602 -3.181 8.512 1.00 0.00 C ATOM 0 H ILE A 50 6.010 -6.058 4.861 1.00 0.00 H new ATOM 0 HA ILE A 50 3.261 -4.902 4.918 1.00 0.00 H new ATOM 0 HB ILE A 50 4.233 -5.444 7.094 1.00 0.00 H new ATOM 0 HG12 ILE A 50 3.961 -2.457 6.518 1.00 0.00 H new ATOM 0 HG13 ILE A 50 2.604 -3.559 6.643 1.00 0.00 H new ATOM 0 HG21 ILE A 50 6.063 -4.075 7.998 1.00 0.00 H new ATOM 0 HG22 ILE A 50 6.599 -5.134 6.672 1.00 0.00 H new ATOM 0 HG23 ILE A 50 6.348 -3.397 6.378 1.00 0.00 H new ATOM 0 HD11 ILE A 50 2.948 -2.346 8.764 1.00 0.00 H new ATOM 0 HD12 ILE A 50 3.234 -4.088 8.991 1.00 0.00 H new ATOM 0 HD13 ILE A 50 4.612 -2.969 8.864 1.00 0.00 H new ATOM 770 N ILE A 51 3.935 -2.892 3.622 1.00 0.00 N ATOM 771 CA ILE A 51 4.298 -1.679 2.909 1.00 0.00 C ATOM 772 C ILE A 51 3.869 -0.471 3.729 1.00 0.00 C ATOM 773 O ILE A 51 2.825 -0.512 4.385 1.00 0.00 O ATOM 774 CB ILE A 51 3.827 -1.649 1.436 1.00 0.00 C ATOM 775 CG1 ILE A 51 2.563 -0.836 1.104 1.00 0.00 C ATOM 776 CG2 ILE A 51 3.764 -3.057 0.836 1.00 0.00 C ATOM 777 CD1 ILE A 51 1.266 -1.446 1.624 1.00 0.00 C ATOM 0 H ILE A 51 2.930 -3.053 3.682 1.00 0.00 H new ATOM 0 HA ILE A 51 5.383 -1.651 2.809 1.00 0.00 H new ATOM 0 HB ILE A 51 4.613 -1.071 0.950 1.00 0.00 H new ATOM 0 HG12 ILE A 51 2.671 0.166 1.519 1.00 0.00 H new ATOM 0 HG13 ILE A 51 2.490 -0.726 0.022 1.00 0.00 H new ATOM 0 HG21 ILE A 51 3.429 -2.997 -0.200 1.00 0.00 H new ATOM 0 HG22 ILE A 51 4.754 -3.512 0.871 1.00 0.00 H new ATOM 0 HG23 ILE A 51 3.064 -3.666 1.409 1.00 0.00 H new ATOM 0 HD11 ILE A 51 0.427 -0.809 1.345 1.00 0.00 H new ATOM 0 HD12 ILE A 51 1.130 -2.436 1.189 1.00 0.00 H new ATOM 0 HD13 ILE A 51 1.313 -1.530 2.710 1.00 0.00 H new ATOM 789 N LYS A 52 4.683 0.586 3.692 1.00 0.00 N ATOM 790 CA LYS A 52 4.421 1.842 4.380 1.00 0.00 C ATOM 791 C LYS A 52 4.656 2.959 3.370 1.00 0.00 C ATOM 792 O LYS A 52 5.784 3.143 2.912 1.00 0.00 O ATOM 793 CB LYS A 52 5.308 1.949 5.631 1.00 0.00 C ATOM 794 CG LYS A 52 4.624 2.652 6.805 1.00 0.00 C ATOM 795 CD LYS A 52 4.771 4.175 6.789 1.00 0.00 C ATOM 796 CE LYS A 52 4.084 4.715 8.051 1.00 0.00 C ATOM 797 NZ LYS A 52 4.340 6.151 8.259 1.00 0.00 N ATOM 0 H LYS A 52 5.560 0.588 3.171 1.00 0.00 H new ATOM 0 HA LYS A 52 3.395 1.910 4.742 1.00 0.00 H new ATOM 0 HB2 LYS A 52 5.607 0.948 5.941 1.00 0.00 H new ATOM 0 HB3 LYS A 52 6.220 2.489 5.375 1.00 0.00 H new ATOM 0 HG2 LYS A 52 3.564 2.399 6.799 1.00 0.00 H new ATOM 0 HG3 LYS A 52 5.038 2.267 7.737 1.00 0.00 H new ATOM 0 HD2 LYS A 52 5.823 4.459 6.773 1.00 0.00 H new ATOM 0 HD3 LYS A 52 4.314 4.595 5.893 1.00 0.00 H new ATOM 0 HE2 LYS A 52 3.010 4.547 7.976 1.00 0.00 H new ATOM 0 HE3 LYS A 52 4.434 4.157 8.919 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 3.762 6.495 9.052 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 5.347 6.296 8.475 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 4.092 6.676 7.397 1.00 0.00 H new ATOM 811 N THR A 53 3.573 3.636 2.981 1.00 0.00 N ATOM 812 CA THR A 53 3.503 4.549 1.853 1.00 0.00 C ATOM 813 C THR A 53 3.501 5.995 2.347 1.00 0.00 C ATOM 814 O THR A 53 2.689 6.365 3.199 1.00 0.00 O ATOM 815 CB THR A 53 2.239 4.237 1.041 1.00 0.00 C ATOM 816 OG1 THR A 53 2.238 2.870 0.688 1.00 0.00 O ATOM 817 CG2 THR A 53 2.158 5.062 -0.247 1.00 0.00 C ATOM 0 H THR A 53 2.682 3.554 3.472 1.00 0.00 H new ATOM 0 HA THR A 53 4.375 4.420 1.212 1.00 0.00 H new ATOM 0 HB THR A 53 1.382 4.489 1.666 1.00 0.00 H new ATOM 0 HG1 THR A 53 1.431 2.666 0.171 1.00 0.00 H new ATOM 0 HG21 THR A 53 1.246 4.805 -0.787 1.00 0.00 H new ATOM 0 HG22 THR A 53 2.147 6.123 0.001 1.00 0.00 H new ATOM 0 HG23 THR A 53 3.023 4.845 -0.873 1.00 0.00 H new ATOM 825 N GLN A 54 4.406 6.798 1.782 1.00 0.00 N ATOM 826 CA GLN A 54 4.609 8.208 2.061 1.00 0.00 C ATOM 827 C GLN A 54 4.048 9.034 0.902 1.00 0.00 C ATOM 828 O GLN A 54 4.455 8.837 -0.244 1.00 0.00 O ATOM 829 CB GLN A 54 6.117 8.474 2.175 1.00 0.00 C ATOM 830 CG GLN A 54 6.788 7.751 3.351 1.00 0.00 C ATOM 831 CD GLN A 54 6.496 8.407 4.698 1.00 0.00 C ATOM 832 OE1 GLN A 54 5.840 9.442 4.775 1.00 0.00 O ATOM 833 NE2 GLN A 54 7.009 7.824 5.777 1.00 0.00 N ATOM 0 H GLN A 54 5.054 6.452 1.074 1.00 0.00 H new ATOM 0 HA GLN A 54 4.105 8.481 2.988 1.00 0.00 H new ATOM 0 HB2 GLN A 54 6.601 8.167 1.248 1.00 0.00 H new ATOM 0 HB3 GLN A 54 6.280 9.547 2.280 1.00 0.00 H new ATOM 0 HG2 GLN A 54 6.448 6.716 3.376 1.00 0.00 H new ATOM 0 HG3 GLN A 54 7.866 7.729 3.190 1.00 0.00 H new ATOM 0 HE21 GLN A 54 7.550 6.964 5.684 1.00 0.00 H new ATOM 0 HE22 GLN A 54 6.862 8.236 6.698 1.00 0.00 H new ATOM 842 N SER A 55 3.147 9.977 1.196 1.00 0.00 N ATOM 843 CA SER A 55 2.687 10.978 0.243 1.00 0.00 C ATOM 844 C SER A 55 2.348 12.242 1.038 1.00 0.00 C ATOM 845 O SER A 55 1.176 12.596 1.153 1.00 0.00 O ATOM 846 CB SER A 55 1.513 10.412 -0.576 1.00 0.00 C ATOM 847 OG SER A 55 0.952 11.349 -1.494 1.00 0.00 O ATOM 0 H SER A 55 2.714 10.063 2.116 1.00 0.00 H new ATOM 0 HA SER A 55 3.450 11.240 -0.490 1.00 0.00 H new ATOM 0 HB2 SER A 55 1.855 9.536 -1.127 1.00 0.00 H new ATOM 0 HB3 SER A 55 0.734 10.075 0.107 1.00 0.00 H new ATOM 0 HG SER A 55 1.626 11.596 -2.162 1.00 0.00 H new ATOM 853 N THR A 56 3.395 12.875 1.581 1.00 0.00 N ATOM 854 CA THR A 56 3.391 14.174 2.250 1.00 0.00 C ATOM 855 C THR A 56 2.284 14.337 3.301 1.00 0.00 C ATOM 856 O THR A 56 1.158 14.712 2.978 1.00 0.00 O ATOM 857 CB THR A 56 3.423 15.321 1.221 1.00 0.00 C ATOM 858 OG1 THR A 56 2.578 15.074 0.115 1.00 0.00 O ATOM 859 CG2 THR A 56 4.836 15.500 0.659 1.00 0.00 C ATOM 0 H THR A 56 4.328 12.463 1.561 1.00 0.00 H new ATOM 0 HA THR A 56 4.311 14.225 2.832 1.00 0.00 H new ATOM 0 HB THR A 56 3.086 16.210 1.755 1.00 0.00 H new ATOM 0 HG1 THR A 56 2.629 15.827 -0.510 1.00 0.00 H new ATOM 0 HG21 THR A 56 4.839 16.314 -0.066 1.00 0.00 H new ATOM 0 HG22 THR A 56 5.524 15.735 1.471 1.00 0.00 H new ATOM 0 HG23 THR A 56 5.153 14.578 0.171 1.00 0.00 H new ATOM 867 N PHE A 57 2.628 14.096 4.576 1.00 0.00 N ATOM 868 CA PHE A 57 1.742 14.163 5.741 1.00 0.00 C ATOM 869 C PHE A 57 0.761 12.993 5.707 1.00 0.00 C ATOM 870 O PHE A 57 0.823 12.087 6.535 1.00 0.00 O ATOM 871 CB PHE A 57 1.050 15.534 5.865 1.00 0.00 C ATOM 872 CG PHE A 57 0.161 15.683 7.085 1.00 0.00 C ATOM 873 CD1 PHE A 57 0.700 16.139 8.301 1.00 0.00 C ATOM 874 CD2 PHE A 57 -1.219 15.421 6.990 1.00 0.00 C ATOM 875 CE1 PHE A 57 -0.138 16.348 9.410 1.00 0.00 C ATOM 876 CE2 PHE A 57 -2.055 15.625 8.100 1.00 0.00 C ATOM 877 CZ PHE A 57 -1.516 16.094 9.310 1.00 0.00 C ATOM 0 H PHE A 57 3.581 13.836 4.831 1.00 0.00 H new ATOM 0 HA PHE A 57 2.340 14.067 6.647 1.00 0.00 H new ATOM 0 HB2 PHE A 57 1.814 16.311 5.891 1.00 0.00 H new ATOM 0 HB3 PHE A 57 0.450 15.706 4.971 1.00 0.00 H new ATOM 0 HD1 PHE A 57 1.760 16.329 8.383 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -1.636 15.062 6.061 1.00 0.00 H new ATOM 0 HE1 PHE A 57 0.278 16.704 10.341 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -3.113 15.421 8.024 1.00 0.00 H new ATOM 0 HZ PHE A 57 -2.160 16.259 10.161 1.00 0.00 H new ATOM 887 N LYS A 58 -0.105 12.986 4.696 1.00 0.00 N ATOM 888 CA LYS A 58 -0.924 11.844 4.345 1.00 0.00 C ATOM 889 C LYS A 58 -0.005 10.631 4.140 1.00 0.00 C ATOM 890 O LYS A 58 1.056 10.730 3.517 1.00 0.00 O ATOM 891 CB LYS A 58 -1.718 12.235 3.094 1.00 0.00 C ATOM 892 CG LYS A 58 -2.507 11.092 2.446 1.00 0.00 C ATOM 893 CD LYS A 58 -3.125 11.529 1.108 1.00 0.00 C ATOM 894 CE LYS A 58 -2.172 11.393 -0.095 1.00 0.00 C ATOM 895 NZ LYS A 58 -1.077 12.389 -0.140 1.00 0.00 N ATOM 0 H LYS A 58 -0.255 13.793 4.090 1.00 0.00 H new ATOM 0 HA LYS A 58 -1.634 11.565 5.123 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -2.413 13.033 3.357 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -1.027 12.644 2.356 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -1.848 10.239 2.284 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -3.295 10.762 3.123 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -4.018 10.933 0.920 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -3.446 12.568 1.189 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -1.735 10.395 -0.082 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -2.755 11.474 -1.012 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -0.540 12.275 -1.023 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -1.478 13.348 -0.100 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -0.443 12.245 0.672 1.00 0.00 H new ATOM 909 N ASN A 59 -0.393 9.487 4.703 1.00 0.00 N ATOM 910 CA ASN A 59 0.401 8.268 4.758 1.00 0.00 C ATOM 911 C ASN A 59 -0.579 7.102 4.811 1.00 0.00 C ATOM 912 O ASN A 59 -1.713 7.292 5.248 1.00 0.00 O ATOM 913 CB ASN A 59 1.261 8.266 6.034 1.00 0.00 C ATOM 914 CG ASN A 59 2.740 8.529 5.782 1.00 0.00 C ATOM 915 OD1 ASN A 59 3.587 7.764 6.243 1.00 0.00 O ATOM 916 ND2 ASN A 59 3.079 9.612 5.093 1.00 0.00 N ATOM 0 H ASN A 59 -1.304 9.384 5.149 1.00 0.00 H new ATOM 0 HA ASN A 59 1.060 8.194 3.893 1.00 0.00 H new ATOM 0 HB2 ASN A 59 0.879 9.023 6.719 1.00 0.00 H new ATOM 0 HB3 ASN A 59 1.153 7.302 6.532 1.00 0.00 H new ATOM 0 HD21 ASN A 59 4.063 9.828 4.934 1.00 0.00 H new ATOM 0 HD22 ASN A 59 2.355 10.228 4.723 1.00 0.00 H new ATOM 923 N THR A 60 -0.147 5.913 4.390 1.00 0.00 N ATOM 924 CA THR A 60 -0.917 4.676 4.501 1.00 0.00 C ATOM 925 C THR A 60 0.061 3.534 4.793 1.00 0.00 C ATOM 926 O THR A 60 1.258 3.676 4.540 1.00 0.00 O ATOM 927 CB THR A 60 -1.737 4.428 3.219 1.00 0.00 C ATOM 928 OG1 THR A 60 -1.052 4.926 2.091 1.00 0.00 O ATOM 929 CG2 THR A 60 -3.094 5.135 3.261 1.00 0.00 C ATOM 0 H THR A 60 0.766 5.781 3.954 1.00 0.00 H new ATOM 0 HA THR A 60 -1.638 4.744 5.316 1.00 0.00 H new ATOM 0 HB THR A 60 -1.882 3.350 3.154 1.00 0.00 H new ATOM 0 HG1 THR A 60 -1.584 4.760 1.285 1.00 0.00 H new ATOM 0 HG21 THR A 60 -3.638 4.933 2.338 1.00 0.00 H new ATOM 0 HG22 THR A 60 -3.670 4.767 4.110 1.00 0.00 H new ATOM 0 HG23 THR A 60 -2.942 6.209 3.365 1.00 0.00 H new ATOM 937 N GLU A 61 -0.433 2.430 5.363 1.00 0.00 N ATOM 938 CA GLU A 61 0.375 1.311 5.822 1.00 0.00 C ATOM 939 C GLU A 61 -0.488 0.055 5.734 1.00 0.00 C ATOM 940 O GLU A 61 -1.647 0.110 6.145 1.00 0.00 O ATOM 941 CB GLU A 61 0.830 1.599 7.260 1.00 0.00 C ATOM 942 CG GLU A 61 1.818 0.556 7.804 1.00 0.00 C ATOM 943 CD GLU A 61 2.475 1.013 9.105 1.00 0.00 C ATOM 944 OE1 GLU A 61 2.780 2.224 9.200 1.00 0.00 O ATOM 945 OE2 GLU A 61 2.682 0.141 9.973 1.00 0.00 O ATOM 0 H GLU A 61 -1.432 2.293 5.519 1.00 0.00 H new ATOM 0 HA GLU A 61 1.267 1.166 5.213 1.00 0.00 H new ATOM 0 HB2 GLU A 61 1.295 2.584 7.296 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -0.044 1.635 7.910 1.00 0.00 H new ATOM 0 HG2 GLU A 61 1.295 -0.385 7.973 1.00 0.00 H new ATOM 0 HG3 GLU A 61 2.588 0.363 7.057 1.00 0.00 H new ATOM 952 N ILE A 62 0.031 -1.037 5.158 1.00 0.00 N ATOM 953 CA ILE A 62 -0.725 -2.276 4.981 1.00 0.00 C ATOM 954 C ILE A 62 0.230 -3.468 5.084 1.00 0.00 C ATOM 955 O ILE A 62 1.236 -3.517 4.373 1.00 0.00 O ATOM 956 CB ILE A 62 -1.473 -2.314 3.625 1.00 0.00 C ATOM 957 CG1 ILE A 62 -2.217 -1.008 3.282 1.00 0.00 C ATOM 958 CG2 ILE A 62 -2.445 -3.501 3.605 1.00 0.00 C ATOM 959 CD1 ILE A 62 -2.861 -1.033 1.891 1.00 0.00 C ATOM 0 H ILE A 62 0.986 -1.083 4.803 1.00 0.00 H new ATOM 0 HA ILE A 62 -1.478 -2.327 5.767 1.00 0.00 H new ATOM 0 HB ILE A 62 -0.711 -2.432 2.855 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -2.989 -0.829 4.030 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -1.519 -0.173 3.338 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -2.970 -3.525 2.650 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -1.889 -4.429 3.737 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -3.168 -3.393 4.414 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -3.369 -0.086 1.708 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -2.090 -1.182 1.136 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -3.583 -1.848 1.839 1.00 0.00 H new ATOM 971 N SER A 63 -0.093 -4.439 5.941 1.00 0.00 N ATOM 972 CA SER A 63 0.501 -5.765 5.956 1.00 0.00 C ATOM 973 C SER A 63 -0.308 -6.669 5.024 1.00 0.00 C ATOM 974 O SER A 63 -1.536 -6.649 5.068 1.00 0.00 O ATOM 975 CB SER A 63 0.498 -6.271 7.402 1.00 0.00 C ATOM 976 OG SER A 63 -0.713 -5.896 8.038 1.00 0.00 O ATOM 0 H SER A 63 -0.800 -4.313 6.666 1.00 0.00 H new ATOM 0 HA SER A 63 1.531 -5.756 5.600 1.00 0.00 H new ATOM 0 HB2 SER A 63 0.608 -7.355 7.418 1.00 0.00 H new ATOM 0 HB3 SER A 63 1.348 -5.857 7.944 1.00 0.00 H new ATOM 0 HG SER A 63 -0.712 -6.223 8.962 1.00 0.00 H new ATOM 982 N PHE A 64 0.353 -7.447 4.162 1.00 0.00 N ATOM 983 CA PHE A 64 -0.318 -8.379 3.270 1.00 0.00 C ATOM 984 C PHE A 64 0.575 -9.588 3.011 1.00 0.00 C ATOM 985 O PHE A 64 1.777 -9.531 3.246 1.00 0.00 O ATOM 986 CB PHE A 64 -0.768 -7.660 1.990 1.00 0.00 C ATOM 987 CG PHE A 64 0.306 -7.213 1.016 1.00 0.00 C ATOM 988 CD1 PHE A 64 0.943 -8.150 0.183 1.00 0.00 C ATOM 989 CD2 PHE A 64 0.529 -5.839 0.810 1.00 0.00 C ATOM 990 CE1 PHE A 64 1.844 -7.720 -0.805 1.00 0.00 C ATOM 991 CE2 PHE A 64 1.382 -5.409 -0.220 1.00 0.00 C ATOM 992 CZ PHE A 64 2.061 -6.349 -1.012 1.00 0.00 C ATOM 0 H PHE A 64 1.369 -7.444 4.068 1.00 0.00 H new ATOM 0 HA PHE A 64 -1.225 -8.760 3.739 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -1.450 -8.322 1.456 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -1.341 -6.781 2.283 1.00 0.00 H new ATOM 0 HD1 PHE A 64 0.739 -9.204 0.303 1.00 0.00 H new ATOM 0 HD2 PHE A 64 0.043 -5.113 1.445 1.00 0.00 H new ATOM 0 HE1 PHE A 64 2.371 -8.446 -1.407 1.00 0.00 H new ATOM 0 HE2 PHE A 64 1.516 -4.353 -0.403 1.00 0.00 H new ATOM 0 HZ PHE A 64 2.747 -6.018 -1.777 1.00 0.00 H new ATOM 1002 N LYS A 65 -0.003 -10.700 2.556 1.00 0.00 N ATOM 1003 CA LYS A 65 0.700 -11.966 2.403 1.00 0.00 C ATOM 1004 C LYS A 65 0.461 -12.460 0.979 1.00 0.00 C ATOM 1005 O LYS A 65 -0.686 -12.553 0.547 1.00 0.00 O ATOM 1006 CB LYS A 65 0.149 -12.942 3.456 1.00 0.00 C ATOM 1007 CG LYS A 65 1.052 -14.126 3.833 1.00 0.00 C ATOM 1008 CD LYS A 65 1.484 -14.999 2.648 1.00 0.00 C ATOM 1009 CE LYS A 65 2.038 -16.357 3.093 1.00 0.00 C ATOM 1010 NZ LYS A 65 3.021 -16.228 4.185 1.00 0.00 N ATOM 0 H LYS A 65 -0.984 -10.743 2.281 1.00 0.00 H new ATOM 0 HA LYS A 65 1.775 -11.870 2.557 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -0.070 -12.378 4.363 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -0.798 -13.338 3.091 1.00 0.00 H new ATOM 0 HG2 LYS A 65 1.943 -13.743 4.330 1.00 0.00 H new ATOM 0 HG3 LYS A 65 0.528 -14.751 4.556 1.00 0.00 H new ATOM 0 HD2 LYS A 65 0.632 -15.156 1.987 1.00 0.00 H new ATOM 0 HD3 LYS A 65 2.243 -14.472 2.070 1.00 0.00 H new ATOM 0 HE2 LYS A 65 1.216 -16.993 3.420 1.00 0.00 H new ATOM 0 HE3 LYS A 65 2.506 -16.853 2.242 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 3.528 -17.128 4.304 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 3.701 -15.476 3.953 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 2.528 -15.988 5.069 1.00 0.00 H new ATOM 1024 N LEU A 66 1.532 -12.784 0.250 1.00 0.00 N ATOM 1025 CA LEU A 66 1.428 -13.478 -1.024 1.00 0.00 C ATOM 1026 C LEU A 66 0.808 -14.868 -0.820 1.00 0.00 C ATOM 1027 O LEU A 66 1.520 -15.854 -0.652 1.00 0.00 O ATOM 1028 CB LEU A 66 2.785 -13.536 -1.750 1.00 0.00 C ATOM 1029 CG LEU A 66 3.981 -13.957 -0.874 1.00 0.00 C ATOM 1030 CD1 LEU A 66 4.870 -14.950 -1.629 1.00 0.00 C ATOM 1031 CD2 LEU A 66 4.837 -12.743 -0.490 1.00 0.00 C ATOM 0 H LEU A 66 2.489 -12.571 0.530 1.00 0.00 H new ATOM 0 HA LEU A 66 0.762 -12.913 -1.676 1.00 0.00 H new ATOM 0 HB2 LEU A 66 2.703 -14.233 -2.584 1.00 0.00 H new ATOM 0 HB3 LEU A 66 2.994 -12.554 -2.174 1.00 0.00 H new ATOM 0 HG LEU A 66 3.578 -14.419 0.027 1.00 0.00 H new ATOM 0 HD11 LEU A 66 5.711 -15.238 -0.998 1.00 0.00 H new ATOM 0 HD12 LEU A 66 4.289 -15.836 -1.887 1.00 0.00 H new ATOM 0 HD13 LEU A 66 5.244 -14.484 -2.540 1.00 0.00 H new ATOM 0 HD21 LEU A 66 5.674 -13.069 0.128 1.00 0.00 H new ATOM 0 HD22 LEU A 66 5.217 -12.265 -1.393 1.00 0.00 H new ATOM 0 HD23 LEU A 66 4.229 -12.031 0.068 1.00 0.00 H new ATOM 1043 N GLY A 67 -0.524 -14.924 -0.832 1.00 0.00 N ATOM 1044 CA GLY A 67 -1.331 -16.134 -0.895 1.00 0.00 C ATOM 1045 C GLY A 67 -2.442 -16.121 0.155 1.00 0.00 C ATOM 1046 O GLY A 67 -2.670 -17.143 0.797 1.00 0.00 O ATOM 0 H GLY A 67 -1.095 -14.080 -0.796 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -1.769 -16.229 -1.889 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -0.695 -17.006 -0.742 1.00 0.00 H new ATOM 1050 N VAL A 68 -3.117 -14.980 0.354 1.00 0.00 N ATOM 1051 CA VAL A 68 -4.144 -14.816 1.386 1.00 0.00 C ATOM 1052 C VAL A 68 -5.215 -13.833 0.894 1.00 0.00 C ATOM 1053 O VAL A 68 -4.918 -12.959 0.075 1.00 0.00 O ATOM 1054 CB VAL A 68 -3.494 -14.350 2.711 1.00 0.00 C ATOM 1055 CG1 VAL A 68 -4.501 -14.079 3.839 1.00 0.00 C ATOM 1056 CG2 VAL A 68 -2.511 -15.397 3.255 1.00 0.00 C ATOM 0 H VAL A 68 -2.962 -14.140 -0.203 1.00 0.00 H new ATOM 0 HA VAL A 68 -4.631 -15.771 1.580 1.00 0.00 H new ATOM 0 HB VAL A 68 -2.992 -13.420 2.443 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -3.968 -13.757 4.733 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -5.194 -13.297 3.528 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -5.057 -14.991 4.057 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -2.074 -15.036 4.186 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -3.041 -16.331 3.441 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -1.720 -15.568 2.525 1.00 0.00 H new ATOM 1066 N GLU A 69 -6.442 -13.988 1.416 1.00 0.00 N ATOM 1067 CA GLU A 69 -7.553 -13.047 1.327 1.00 0.00 C ATOM 1068 C GLU A 69 -7.821 -12.518 2.738 1.00 0.00 C ATOM 1069 O GLU A 69 -7.849 -13.318 3.673 1.00 0.00 O ATOM 1070 CB GLU A 69 -8.795 -13.762 0.761 1.00 0.00 C ATOM 1071 CG GLU A 69 -10.012 -12.827 0.650 1.00 0.00 C ATOM 1072 CD GLU A 69 -11.241 -13.486 0.035 1.00 0.00 C ATOM 1073 OE1 GLU A 69 -11.086 -14.543 -0.606 1.00 0.00 O ATOM 1074 OE2 GLU A 69 -12.336 -12.915 0.252 1.00 0.00 O ATOM 0 H GLU A 69 -6.693 -14.826 1.941 1.00 0.00 H new ATOM 0 HA GLU A 69 -7.315 -12.219 0.659 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -8.560 -14.167 -0.224 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -9.047 -14.607 1.401 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -10.268 -12.459 1.644 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -9.738 -11.959 0.050 1.00 0.00 H new ATOM 1081 N PHE A 70 -7.996 -11.203 2.922 1.00 0.00 N ATOM 1082 CA PHE A 70 -8.195 -10.613 4.249 1.00 0.00 C ATOM 1083 C PHE A 70 -8.774 -9.192 4.143 1.00 0.00 C ATOM 1084 O PHE A 70 -9.073 -8.733 3.041 1.00 0.00 O ATOM 1085 CB PHE A 70 -6.890 -10.666 5.065 1.00 0.00 C ATOM 1086 CG PHE A 70 -5.778 -9.774 4.551 1.00 0.00 C ATOM 1087 CD1 PHE A 70 -5.050 -10.129 3.399 1.00 0.00 C ATOM 1088 CD2 PHE A 70 -5.511 -8.552 5.193 1.00 0.00 C ATOM 1089 CE1 PHE A 70 -4.118 -9.233 2.852 1.00 0.00 C ATOM 1090 CE2 PHE A 70 -4.605 -7.643 4.627 1.00 0.00 C ATOM 1091 CZ PHE A 70 -3.938 -7.969 3.438 1.00 0.00 C ATOM 0 H PHE A 70 -8.003 -10.524 2.161 1.00 0.00 H new ATOM 0 HA PHE A 70 -8.933 -11.205 4.790 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -7.112 -10.388 6.095 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -6.531 -11.695 5.083 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -5.209 -11.092 2.936 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -6.004 -8.313 6.124 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -3.541 -9.515 1.983 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -4.422 -6.693 5.107 1.00 0.00 H new ATOM 0 HZ PHE A 70 -3.284 -7.247 2.971 1.00 0.00 H new ATOM 1101 N ASP A 71 -8.996 -8.523 5.283 1.00 0.00 N ATOM 1102 CA ASP A 71 -9.509 -7.155 5.338 1.00 0.00 C ATOM 1103 C ASP A 71 -8.341 -6.175 5.234 1.00 0.00 C ATOM 1104 O ASP A 71 -7.412 -6.228 6.038 1.00 0.00 O ATOM 1105 CB ASP A 71 -10.297 -6.923 6.634 1.00 0.00 C ATOM 1106 CG ASP A 71 -11.052 -5.595 6.605 1.00 0.00 C ATOM 1107 OD1 ASP A 71 -10.391 -4.530 6.590 1.00 0.00 O ATOM 1108 OD2 ASP A 71 -12.301 -5.668 6.606 1.00 0.00 O ATOM 0 H ASP A 71 -8.821 -8.926 6.203 1.00 0.00 H new ATOM 0 HA ASP A 71 -10.190 -6.993 4.502 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -11.003 -7.740 6.782 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -9.613 -6.935 7.483 1.00 0.00 H new ATOM 1113 N GLU A 72 -8.382 -5.314 4.223 1.00 0.00 N ATOM 1114 CA GLU A 72 -7.396 -4.299 3.917 1.00 0.00 C ATOM 1115 C GLU A 72 -8.100 -2.955 4.085 1.00 0.00 C ATOM 1116 O GLU A 72 -8.992 -2.604 3.317 1.00 0.00 O ATOM 1117 CB GLU A 72 -6.884 -4.583 2.502 1.00 0.00 C ATOM 1118 CG GLU A 72 -5.917 -3.546 1.929 1.00 0.00 C ATOM 1119 CD GLU A 72 -5.316 -4.052 0.625 1.00 0.00 C ATOM 1120 OE1 GLU A 72 -5.974 -3.903 -0.429 1.00 0.00 O ATOM 1121 OE2 GLU A 72 -4.237 -4.684 0.662 1.00 0.00 O ATOM 0 H GLU A 72 -9.155 -5.311 3.558 1.00 0.00 H new ATOM 0 HA GLU A 72 -6.522 -4.292 4.569 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -6.389 -5.554 2.502 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -7.741 -4.662 1.834 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -6.441 -2.606 1.756 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -5.124 -3.341 2.648 1.00 0.00 H new ATOM 1128 N THR A 73 -7.757 -2.239 5.153 1.00 0.00 N ATOM 1129 CA THR A 73 -8.542 -1.121 5.643 1.00 0.00 C ATOM 1130 C THR A 73 -7.900 0.219 5.260 1.00 0.00 C ATOM 1131 O THR A 73 -7.641 1.049 6.131 1.00 0.00 O ATOM 1132 CB THR A 73 -8.707 -1.312 7.163 1.00 0.00 C ATOM 1133 OG1 THR A 73 -8.703 -2.685 7.516 1.00 0.00 O ATOM 1134 CG2 THR A 73 -10.007 -0.701 7.676 1.00 0.00 C ATOM 0 H THR A 73 -6.919 -2.424 5.704 1.00 0.00 H new ATOM 0 HA THR A 73 -9.529 -1.097 5.181 1.00 0.00 H new ATOM 0 HB THR A 73 -7.858 -0.804 7.622 1.00 0.00 H new ATOM 0 HG1 THR A 73 -9.250 -3.189 6.877 1.00 0.00 H new ATOM 0 HG21 THR A 73 -10.083 -0.858 8.752 1.00 0.00 H new ATOM 0 HG22 THR A 73 -10.015 0.368 7.464 1.00 0.00 H new ATOM 0 HG23 THR A 73 -10.853 -1.176 7.179 1.00 0.00 H new ATOM 1142 N THR A 74 -7.614 0.445 3.974 1.00 0.00 N ATOM 1143 CA THR A 74 -6.883 1.638 3.563 1.00 0.00 C ATOM 1144 C THR A 74 -7.746 2.893 3.728 1.00 0.00 C ATOM 1145 O THR A 74 -8.960 2.853 3.536 1.00 0.00 O ATOM 1146 CB THR A 74 -6.369 1.519 2.119 1.00 0.00 C ATOM 1147 OG1 THR A 74 -6.228 0.160 1.733 1.00 0.00 O ATOM 1148 CG2 THR A 74 -5.042 2.279 1.973 1.00 0.00 C ATOM 0 H THR A 74 -7.876 -0.178 3.210 1.00 0.00 H new ATOM 0 HA THR A 74 -6.015 1.729 4.216 1.00 0.00 H new ATOM 0 HB THR A 74 -7.103 1.969 1.451 1.00 0.00 H new ATOM 0 HG1 THR A 74 -6.115 0.106 0.761 1.00 0.00 H new ATOM 0 HG21 THR A 74 -4.683 2.191 0.948 1.00 0.00 H new ATOM 0 HG22 THR A 74 -5.197 3.331 2.214 1.00 0.00 H new ATOM 0 HG23 THR A 74 -4.303 1.856 2.654 1.00 0.00 H new ATOM 1156 N ALA A 75 -7.110 4.020 4.060 1.00 0.00 N ATOM 1157 CA ALA A 75 -7.774 5.301 4.263 1.00 0.00 C ATOM 1158 C ALA A 75 -8.678 5.679 3.086 1.00 0.00 C ATOM 1159 O ALA A 75 -9.798 6.145 3.286 1.00 0.00 O ATOM 1160 CB ALA A 75 -6.717 6.385 4.501 1.00 0.00 C ATOM 0 H ALA A 75 -6.100 4.063 4.197 1.00 0.00 H new ATOM 0 HA ALA A 75 -8.419 5.214 5.137 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -7.209 7.346 4.653 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -6.130 6.133 5.385 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -6.059 6.448 3.634 1.00 0.00 H new ATOM 1166 N ASP A 76 -8.172 5.505 1.865 1.00 0.00 N ATOM 1167 CA ASP A 76 -8.823 5.859 0.617 1.00 0.00 C ATOM 1168 C ASP A 76 -9.558 4.647 0.039 1.00 0.00 C ATOM 1169 O ASP A 76 -10.743 4.749 -0.282 1.00 0.00 O ATOM 1170 CB ASP A 76 -7.794 6.453 -0.362 1.00 0.00 C ATOM 1171 CG ASP A 76 -6.490 5.676 -0.486 1.00 0.00 C ATOM 1172 OD1 ASP A 76 -6.383 4.619 0.176 1.00 0.00 O ATOM 1173 OD2 ASP A 76 -5.606 6.215 -1.193 1.00 0.00 O ATOM 0 H ASP A 76 -7.251 5.092 1.719 1.00 0.00 H new ATOM 0 HA ASP A 76 -9.575 6.627 0.799 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -8.253 6.521 -1.348 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -7.563 7.471 -0.047 1.00 0.00 H new ATOM 1178 N ASP A 77 -8.887 3.496 -0.073 1.00 0.00 N ATOM 1179 CA ASP A 77 -9.542 2.277 -0.569 1.00 0.00 C ATOM 1180 C ASP A 77 -10.779 1.914 0.266 1.00 0.00 C ATOM 1181 O ASP A 77 -11.680 1.244 -0.236 1.00 0.00 O ATOM 1182 CB ASP A 77 -8.621 1.048 -0.619 1.00 0.00 C ATOM 1183 CG ASP A 77 -7.298 1.237 -1.343 1.00 0.00 C ATOM 1184 OD1 ASP A 77 -7.282 1.980 -2.345 1.00 0.00 O ATOM 1185 OD2 ASP A 77 -6.329 0.578 -0.893 1.00 0.00 O ATOM 0 H ASP A 77 -7.903 3.381 0.169 1.00 0.00 H new ATOM 0 HA ASP A 77 -9.830 2.526 -1.590 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -8.411 0.734 0.403 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -9.162 0.232 -1.099 1.00 0.00 H new ATOM 1190 N ARG A 78 -10.810 2.341 1.535 1.00 0.00 N ATOM 1191 CA ARG A 78 -11.836 2.054 2.530 1.00 0.00 C ATOM 1192 C ARG A 78 -11.627 0.633 3.068 1.00 0.00 C ATOM 1193 O ARG A 78 -10.568 0.040 2.873 1.00 0.00 O ATOM 1194 CB ARG A 78 -13.264 2.331 2.009 1.00 0.00 C ATOM 1195 CG ARG A 78 -13.444 3.747 1.423 1.00 0.00 C ATOM 1196 CD ARG A 78 -13.931 3.688 -0.037 1.00 0.00 C ATOM 1197 NE ARG A 78 -14.241 5.016 -0.603 1.00 0.00 N ATOM 1198 CZ ARG A 78 -15.396 5.677 -0.419 1.00 0.00 C ATOM 1199 NH1 ARG A 78 -16.272 5.217 0.481 1.00 0.00 N ATOM 1200 NH2 ARG A 78 -15.692 6.779 -1.119 1.00 0.00 N ATOM 0 H ARG A 78 -10.070 2.933 1.912 1.00 0.00 H new ATOM 0 HA ARG A 78 -11.731 2.743 3.368 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -13.511 1.596 1.243 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -13.973 2.192 2.825 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -14.161 4.304 2.026 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -12.498 4.287 1.472 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -13.166 3.209 -0.649 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -14.821 3.061 -0.091 1.00 0.00 H new ATOM 0 HE ARG A 78 -13.526 5.464 -1.176 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -16.059 4.375 1.016 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -17.153 5.708 0.632 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -15.033 7.136 -1.812 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -16.576 7.262 -0.960 1.00 0.00 H new ATOM 1214 N LYS A 79 -12.622 0.082 3.772 1.00 0.00 N ATOM 1215 CA LYS A 79 -12.553 -1.289 4.252 1.00 0.00 C ATOM 1216 C LYS A 79 -12.791 -2.236 3.078 1.00 0.00 C ATOM 1217 O LYS A 79 -13.936 -2.593 2.798 1.00 0.00 O ATOM 1218 CB LYS A 79 -13.541 -1.507 5.407 1.00 0.00 C ATOM 1219 CG LYS A 79 -13.213 -2.844 6.083 1.00 0.00 C ATOM 1220 CD LYS A 79 -14.091 -3.146 7.299 1.00 0.00 C ATOM 1221 CE LYS A 79 -15.490 -3.596 6.867 1.00 0.00 C ATOM 1222 NZ LYS A 79 -16.221 -4.221 7.985 1.00 0.00 N ATOM 0 H LYS A 79 -13.483 0.571 4.019 1.00 0.00 H new ATOM 0 HA LYS A 79 -11.563 -1.500 4.657 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -13.469 -0.691 6.126 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -14.565 -1.513 5.033 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -13.326 -3.647 5.355 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -12.168 -2.839 6.392 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -13.625 -3.924 7.904 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -14.168 -2.258 7.926 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -16.052 -2.739 6.496 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -15.408 -4.304 6.042 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -17.165 -4.515 7.661 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -15.695 -5.053 8.322 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -16.319 -3.536 8.762 1.00 0.00 H new ATOM 1236 N VAL A 80 -11.719 -2.617 2.385 1.00 0.00 N ATOM 1237 CA VAL A 80 -11.777 -3.441 1.191 1.00 0.00 C ATOM 1238 C VAL A 80 -11.280 -4.852 1.512 1.00 0.00 C ATOM 1239 O VAL A 80 -10.447 -5.020 2.395 1.00 0.00 O ATOM 1240 CB VAL A 80 -10.999 -2.734 0.068 1.00 0.00 C ATOM 1241 CG1 VAL A 80 -9.538 -2.380 0.354 1.00 0.00 C ATOM 1242 CG2 VAL A 80 -11.032 -3.583 -1.190 1.00 0.00 C ATOM 0 H VAL A 80 -10.769 -2.353 2.648 1.00 0.00 H new ATOM 0 HA VAL A 80 -12.800 -3.564 0.836 1.00 0.00 H new ATOM 0 HB VAL A 80 -11.516 -1.781 -0.039 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -9.106 -1.887 -0.517 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -9.487 -1.710 1.213 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -8.979 -3.290 0.570 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -10.480 -3.079 -1.983 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -10.574 -4.551 -0.988 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -12.066 -3.729 -1.503 1.00 0.00 H new ATOM 1252 N LYS A 81 -11.781 -5.884 0.821 1.00 0.00 N ATOM 1253 CA LYS A 81 -11.208 -7.215 0.944 1.00 0.00 C ATOM 1254 C LYS A 81 -10.032 -7.308 -0.027 1.00 0.00 C ATOM 1255 O LYS A 81 -10.219 -7.221 -1.241 1.00 0.00 O ATOM 1256 CB LYS A 81 -12.260 -8.302 0.671 1.00 0.00 C ATOM 1257 CG LYS A 81 -11.735 -9.694 1.061 1.00 0.00 C ATOM 1258 CD LYS A 81 -11.825 -9.955 2.575 1.00 0.00 C ATOM 1259 CE LYS A 81 -13.106 -10.693 2.982 1.00 0.00 C ATOM 1260 NZ LYS A 81 -13.056 -12.125 2.617 1.00 0.00 N ATOM 0 H LYS A 81 -12.572 -5.817 0.181 1.00 0.00 H new ATOM 0 HA LYS A 81 -10.858 -7.382 1.963 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -13.168 -8.082 1.233 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -12.529 -8.295 -0.385 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -12.305 -10.456 0.530 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -10.698 -9.791 0.740 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -10.960 -10.540 2.889 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -11.776 -9.004 3.105 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -13.254 -10.597 4.058 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -13.964 -10.225 2.499 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -13.926 -12.596 2.939 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -12.974 -12.217 1.584 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -12.233 -12.570 3.071 1.00 0.00 H new ATOM 1274 N SER A 82 -8.824 -7.499 0.490 1.00 0.00 N ATOM 1275 CA SER A 82 -7.664 -7.804 -0.322 1.00 0.00 C ATOM 1276 C SER A 82 -7.693 -9.288 -0.652 1.00 0.00 C ATOM 1277 O SER A 82 -8.095 -10.087 0.193 1.00 0.00 O ATOM 1278 CB SER A 82 -6.423 -7.495 0.511 1.00 0.00 C ATOM 1279 OG SER A 82 -6.670 -7.919 1.837 1.00 0.00 O ATOM 0 H SER A 82 -8.626 -7.445 1.489 1.00 0.00 H new ATOM 0 HA SER A 82 -7.657 -7.221 -1.243 1.00 0.00 H new ATOM 0 HB2 SER A 82 -5.552 -8.008 0.103 1.00 0.00 H new ATOM 0 HB3 SER A 82 -6.204 -6.428 0.487 1.00 0.00 H new ATOM 0 HG SER A 82 -5.820 -8.127 2.278 1.00 0.00 H new ATOM 1285 N ILE A 83 -7.203 -9.661 -1.837 1.00 0.00 N ATOM 1286 CA ILE A 83 -6.725 -11.012 -2.081 1.00 0.00 C ATOM 1287 C ILE A 83 -5.460 -10.914 -2.921 1.00 0.00 C ATOM 1288 O ILE A 83 -5.441 -10.223 -3.940 1.00 0.00 O ATOM 1289 CB ILE A 83 -7.813 -11.933 -2.664 1.00 0.00 C ATOM 1290 CG1 ILE A 83 -7.263 -13.365 -2.790 1.00 0.00 C ATOM 1291 CG2 ILE A 83 -8.353 -11.441 -4.009 1.00 0.00 C ATOM 1292 CD1 ILE A 83 -8.333 -14.370 -3.227 1.00 0.00 C ATOM 0 H ILE A 83 -7.129 -9.039 -2.642 1.00 0.00 H new ATOM 0 HA ILE A 83 -6.473 -11.500 -1.140 1.00 0.00 H new ATOM 0 HB ILE A 83 -8.656 -11.920 -1.974 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -6.445 -13.374 -3.511 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -6.847 -13.676 -1.832 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -9.116 -12.131 -4.369 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -8.789 -10.450 -3.885 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -7.539 -11.391 -4.732 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -7.891 -15.364 -3.300 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -9.139 -14.385 -2.494 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -8.731 -14.078 -4.199 1.00 0.00 H new ATOM 1304 N VAL A 84 -4.375 -11.527 -2.444 1.00 0.00 N ATOM 1305 CA VAL A 84 -3.047 -11.283 -2.978 1.00 0.00 C ATOM 1306 C VAL A 84 -2.232 -12.569 -2.968 1.00 0.00 C ATOM 1307 O VAL A 84 -2.380 -13.395 -2.065 1.00 0.00 O ATOM 1308 CB VAL A 84 -2.387 -10.098 -2.241 1.00 0.00 C ATOM 1309 CG1 VAL A 84 -2.762 -10.022 -0.758 1.00 0.00 C ATOM 1310 CG2 VAL A 84 -0.857 -10.061 -2.368 1.00 0.00 C ATOM 0 H VAL A 84 -4.399 -12.202 -1.680 1.00 0.00 H new ATOM 0 HA VAL A 84 -3.106 -10.982 -4.024 1.00 0.00 H new ATOM 0 HB VAL A 84 -2.794 -9.226 -2.754 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -2.264 -9.167 -0.300 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -3.842 -9.908 -0.661 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -2.447 -10.937 -0.256 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -0.467 -9.201 -1.824 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -0.435 -10.975 -1.951 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -0.581 -9.981 -3.419 1.00 0.00 H new ATOM 1320 N THR A 85 -1.400 -12.732 -4.001 1.00 0.00 N ATOM 1321 CA THR A 85 -0.573 -13.895 -4.269 1.00 0.00 C ATOM 1322 C THR A 85 0.614 -13.451 -5.129 1.00 0.00 C ATOM 1323 O THR A 85 0.804 -12.256 -5.359 1.00 0.00 O ATOM 1324 CB THR A 85 -1.412 -15.012 -4.914 1.00 0.00 C ATOM 1325 OG1 THR A 85 -0.624 -16.174 -5.066 1.00 0.00 O ATOM 1326 CG2 THR A 85 -1.972 -14.633 -6.287 1.00 0.00 C ATOM 0 H THR A 85 -1.285 -12.008 -4.710 1.00 0.00 H new ATOM 0 HA THR A 85 -0.179 -14.318 -3.345 1.00 0.00 H new ATOM 0 HB THR A 85 -2.255 -15.184 -4.245 1.00 0.00 H new ATOM 0 HG1 THR A 85 -1.162 -16.883 -5.475 1.00 0.00 H new ATOM 0 HG21 THR A 85 -2.553 -15.465 -6.685 1.00 0.00 H new ATOM 0 HG22 THR A 85 -2.613 -13.757 -6.189 1.00 0.00 H new ATOM 0 HG23 THR A 85 -1.150 -14.407 -6.966 1.00 0.00 H new ATOM 1334 N LEU A 86 1.408 -14.411 -5.601 1.00 0.00 N ATOM 1335 CA LEU A 86 2.552 -14.183 -6.467 1.00 0.00 C ATOM 1336 C LEU A 86 2.495 -15.234 -7.577 1.00 0.00 C ATOM 1337 O LEU A 86 2.623 -16.421 -7.283 1.00 0.00 O ATOM 1338 CB LEU A 86 3.837 -14.245 -5.625 1.00 0.00 C ATOM 1339 CG LEU A 86 5.060 -13.577 -6.274 1.00 0.00 C ATOM 1340 CD1 LEU A 86 6.176 -13.438 -5.232 1.00 0.00 C ATOM 1341 CD2 LEU A 86 5.608 -14.361 -7.470 1.00 0.00 C ATOM 0 H LEU A 86 1.264 -15.397 -5.382 1.00 0.00 H new ATOM 0 HA LEU A 86 2.540 -13.198 -6.933 1.00 0.00 H new ATOM 0 HB2 LEU A 86 3.648 -13.770 -4.662 1.00 0.00 H new ATOM 0 HB3 LEU A 86 4.074 -15.290 -5.424 1.00 0.00 H new ATOM 0 HG LEU A 86 4.730 -12.604 -6.639 1.00 0.00 H new ATOM 0 HD11 LEU A 86 7.044 -12.965 -5.690 1.00 0.00 H new ATOM 0 HD12 LEU A 86 5.824 -12.825 -4.402 1.00 0.00 H new ATOM 0 HD13 LEU A 86 6.454 -14.425 -4.862 1.00 0.00 H new ATOM 0 HD21 LEU A 86 6.470 -13.838 -7.884 1.00 0.00 H new ATOM 0 HD22 LEU A 86 5.909 -15.357 -7.145 1.00 0.00 H new ATOM 0 HD23 LEU A 86 4.835 -14.447 -8.234 1.00 0.00 H new ATOM 1353 N ASP A 87 2.262 -14.817 -8.827 1.00 0.00 N ATOM 1354 CA ASP A 87 2.213 -15.719 -9.975 1.00 0.00 C ATOM 1355 C ASP A 87 3.571 -15.669 -10.671 1.00 0.00 C ATOM 1356 O ASP A 87 4.056 -14.582 -10.969 1.00 0.00 O ATOM 1357 CB ASP A 87 1.050 -15.366 -10.921 1.00 0.00 C ATOM 1358 CG ASP A 87 1.421 -14.385 -12.031 1.00 0.00 C ATOM 1359 OD1 ASP A 87 1.969 -14.865 -13.048 1.00 0.00 O ATOM 1360 OD2 ASP A 87 1.140 -13.182 -11.851 1.00 0.00 O ATOM 0 H ASP A 87 2.102 -13.839 -9.068 1.00 0.00 H new ATOM 0 HA ASP A 87 2.018 -16.739 -9.645 1.00 0.00 H new ATOM 0 HB2 ASP A 87 0.673 -16.283 -11.373 1.00 0.00 H new ATOM 0 HB3 ASP A 87 0.235 -14.942 -10.334 1.00 0.00 H new ATOM 1365 N GLY A 88 4.215 -16.821 -10.878 1.00 0.00 N ATOM 1366 CA GLY A 88 5.487 -16.938 -11.585 1.00 0.00 C ATOM 1367 C GLY A 88 6.618 -16.123 -10.946 1.00 0.00 C ATOM 1368 O GLY A 88 7.470 -16.675 -10.255 1.00 0.00 O ATOM 0 H GLY A 88 3.855 -17.717 -10.550 1.00 0.00 H new ATOM 0 HA2 GLY A 88 5.780 -17.987 -11.619 1.00 0.00 H new ATOM 0 HA3 GLY A 88 5.352 -16.612 -12.616 1.00 0.00 H new ATOM 1372 N GLY A 89 6.631 -14.813 -11.200 1.00 0.00 N ATOM 1373 CA GLY A 89 7.557 -13.849 -10.624 1.00 0.00 C ATOM 1374 C GLY A 89 6.925 -12.456 -10.503 1.00 0.00 C ATOM 1375 O GLY A 89 7.646 -11.462 -10.532 1.00 0.00 O ATOM 0 H GLY A 89 5.966 -14.381 -11.841 1.00 0.00 H new ATOM 0 HA2 GLY A 89 7.873 -14.192 -9.639 1.00 0.00 H new ATOM 0 HA3 GLY A 89 8.452 -13.790 -11.243 1.00 0.00 H new ATOM 1379 N LYS A 90 5.593 -12.372 -10.388 1.00 0.00 N ATOM 1380 CA LYS A 90 4.837 -11.130 -10.298 1.00 0.00 C ATOM 1381 C LYS A 90 3.922 -11.187 -9.077 1.00 0.00 C ATOM 1382 O LYS A 90 3.210 -12.167 -8.881 1.00 0.00 O ATOM 1383 CB LYS A 90 4.005 -10.899 -11.569 1.00 0.00 C ATOM 1384 CG LYS A 90 4.857 -10.916 -12.843 1.00 0.00 C ATOM 1385 CD LYS A 90 4.780 -12.261 -13.584 1.00 0.00 C ATOM 1386 CE LYS A 90 6.086 -12.546 -14.338 1.00 0.00 C ATOM 1387 NZ LYS A 90 6.426 -11.487 -15.309 1.00 0.00 N ATOM 0 H LYS A 90 4.998 -13.200 -10.355 1.00 0.00 H new ATOM 0 HA LYS A 90 5.535 -10.299 -10.198 1.00 0.00 H new ATOM 0 HB2 LYS A 90 3.236 -11.668 -11.640 1.00 0.00 H new ATOM 0 HB3 LYS A 90 3.491 -9.941 -11.493 1.00 0.00 H new ATOM 0 HG2 LYS A 90 4.526 -10.119 -13.508 1.00 0.00 H new ATOM 0 HG3 LYS A 90 5.895 -10.706 -12.585 1.00 0.00 H new ATOM 0 HD2 LYS A 90 4.584 -13.063 -12.872 1.00 0.00 H new ATOM 0 HD3 LYS A 90 3.946 -12.247 -14.286 1.00 0.00 H new ATOM 0 HE2 LYS A 90 6.900 -12.650 -13.620 1.00 0.00 H new ATOM 0 HE3 LYS A 90 5.998 -13.498 -14.861 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 7.450 -11.309 -15.285 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 6.150 -11.791 -16.265 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 5.917 -10.614 -15.063 1.00 0.00 H new ATOM 1401 N LEU A 91 3.954 -10.139 -8.254 1.00 0.00 N ATOM 1402 CA LEU A 91 3.115 -9.967 -7.079 1.00 0.00 C ATOM 1403 C LEU A 91 1.739 -9.508 -7.564 1.00 0.00 C ATOM 1404 O LEU A 91 1.621 -8.397 -8.080 1.00 0.00 O ATOM 1405 CB LEU A 91 3.798 -8.928 -6.171 1.00 0.00 C ATOM 1406 CG LEU A 91 3.287 -8.825 -4.725 1.00 0.00 C ATOM 1407 CD1 LEU A 91 1.821 -8.393 -4.635 1.00 0.00 C ATOM 1408 CD2 LEU A 91 3.504 -10.127 -3.949 1.00 0.00 C ATOM 0 H LEU A 91 4.593 -9.357 -8.398 1.00 0.00 H new ATOM 0 HA LEU A 91 2.985 -10.885 -6.505 1.00 0.00 H new ATOM 0 HB2 LEU A 91 4.864 -9.154 -6.139 1.00 0.00 H new ATOM 0 HB3 LEU A 91 3.694 -7.949 -6.638 1.00 0.00 H new ATOM 0 HG LEU A 91 3.884 -8.040 -4.261 1.00 0.00 H new ATOM 0 HD11 LEU A 91 1.521 -8.339 -3.588 1.00 0.00 H new ATOM 0 HD12 LEU A 91 1.701 -7.413 -5.098 1.00 0.00 H new ATOM 0 HD13 LEU A 91 1.195 -9.119 -5.155 1.00 0.00 H new ATOM 0 HD21 LEU A 91 3.129 -10.011 -2.932 1.00 0.00 H new ATOM 0 HD22 LEU A 91 2.969 -10.938 -4.443 1.00 0.00 H new ATOM 0 HD23 LEU A 91 4.568 -10.360 -3.919 1.00 0.00 H new ATOM 1420 N VAL A 92 0.708 -10.342 -7.408 1.00 0.00 N ATOM 1421 CA VAL A 92 -0.654 -10.059 -7.847 1.00 0.00 C ATOM 1422 C VAL A 92 -1.474 -9.648 -6.627 1.00 0.00 C ATOM 1423 O VAL A 92 -1.495 -10.386 -5.645 1.00 0.00 O ATOM 1424 CB VAL A 92 -1.264 -11.315 -8.495 1.00 0.00 C ATOM 1425 CG1 VAL A 92 -2.563 -10.982 -9.243 1.00 0.00 C ATOM 1426 CG2 VAL A 92 -0.281 -11.980 -9.463 1.00 0.00 C ATOM 0 H VAL A 92 0.803 -11.254 -6.962 1.00 0.00 H new ATOM 0 HA VAL A 92 -0.654 -9.256 -8.584 1.00 0.00 H new ATOM 0 HB VAL A 92 -1.487 -12.009 -7.685 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -2.969 -11.890 -9.689 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -3.289 -10.565 -8.544 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -2.355 -10.254 -10.027 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -0.744 -12.863 -9.902 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -0.017 -11.277 -10.254 1.00 0.00 H new ATOM 0 HG23 VAL A 92 0.619 -12.273 -8.923 1.00 0.00 H new ATOM 1436 N HIS A 93 -2.148 -8.494 -6.668 1.00 0.00 N ATOM 1437 CA HIS A 93 -2.978 -8.006 -5.571 1.00 0.00 C ATOM 1438 C HIS A 93 -4.307 -7.487 -6.116 1.00 0.00 C ATOM 1439 O HIS A 93 -4.378 -6.361 -6.615 1.00 0.00 O ATOM 1440 CB HIS A 93 -2.204 -6.934 -4.794 1.00 0.00 C ATOM 1441 CG HIS A 93 -3.016 -6.173 -3.772 1.00 0.00 C ATOM 1442 ND1 HIS A 93 -3.901 -5.150 -4.062 1.00 0.00 N ATOM 1443 CD2 HIS A 93 -2.920 -6.282 -2.410 1.00 0.00 C ATOM 1444 CE1 HIS A 93 -4.313 -4.629 -2.890 1.00 0.00 C ATOM 1445 NE2 HIS A 93 -3.745 -5.310 -1.879 1.00 0.00 N ATOM 0 H HIS A 93 -2.130 -7.869 -7.474 1.00 0.00 H new ATOM 0 HA HIS A 93 -3.211 -8.816 -4.879 1.00 0.00 H new ATOM 0 HB2 HIS A 93 -1.364 -7.410 -4.287 1.00 0.00 H new ATOM 0 HB3 HIS A 93 -1.785 -6.223 -5.506 1.00 0.00 H new ATOM 0 HD1 HIS A 93 -4.189 -4.846 -4.992 1.00 0.00 H new ATOM 0 HD2 HIS A 93 -2.317 -6.989 -1.859 1.00 0.00 H new ATOM 0 HE1 HIS A 93 -4.992 -3.796 -2.780 1.00 0.00 H new ATOM 0 HE2 HIS A 93 -3.898 -5.137 -0.885 1.00 0.00 H new ATOM 1454 N VAL A 94 -5.363 -8.288 -5.968 1.00 0.00 N ATOM 1455 CA VAL A 94 -6.732 -7.897 -6.260 1.00 0.00 C ATOM 1456 C VAL A 94 -7.329 -7.279 -4.991 1.00 0.00 C ATOM 1457 O VAL A 94 -6.935 -7.626 -3.875 1.00 0.00 O ATOM 1458 CB VAL A 94 -7.518 -9.107 -6.787 1.00 0.00 C ATOM 1459 CG1 VAL A 94 -8.973 -8.758 -7.121 1.00 0.00 C ATOM 1460 CG2 VAL A 94 -6.853 -9.684 -8.043 1.00 0.00 C ATOM 0 H VAL A 94 -5.282 -9.248 -5.634 1.00 0.00 H new ATOM 0 HA VAL A 94 -6.779 -7.146 -7.048 1.00 0.00 H new ATOM 0 HB VAL A 94 -7.514 -9.846 -5.985 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -9.485 -9.647 -7.489 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -9.475 -8.395 -6.224 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -8.995 -7.983 -7.887 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -7.427 -10.540 -8.398 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -6.820 -8.921 -8.821 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -5.838 -10.002 -7.804 1.00 0.00 H new ATOM 1470 N GLN A 95 -8.221 -6.303 -5.170 1.00 0.00 N ATOM 1471 CA GLN A 95 -8.685 -5.420 -4.116 1.00 0.00 C ATOM 1472 C GLN A 95 -10.184 -5.162 -4.327 1.00 0.00 C ATOM 1473 O GLN A 95 -10.573 -4.375 -5.187 1.00 0.00 O ATOM 1474 CB GLN A 95 -7.799 -4.169 -4.176 1.00 0.00 C ATOM 1475 CG GLN A 95 -8.229 -3.100 -3.179 1.00 0.00 C ATOM 1476 CD GLN A 95 -7.270 -1.921 -3.097 1.00 0.00 C ATOM 1477 OE1 GLN A 95 -7.235 -1.096 -4.003 1.00 0.00 O ATOM 1478 NE2 GLN A 95 -6.508 -1.826 -2.015 1.00 0.00 N ATOM 0 H GLN A 95 -8.646 -6.106 -6.076 1.00 0.00 H new ATOM 0 HA GLN A 95 -8.597 -5.837 -3.113 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -6.765 -4.451 -3.978 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -7.829 -3.754 -5.184 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -9.218 -2.734 -3.455 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -8.321 -3.552 -2.191 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -6.569 -2.535 -1.284 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -5.861 -1.044 -1.914 1.00 0.00 H new ATOM 1487 N LYS A 96 -11.020 -5.885 -3.578 1.00 0.00 N ATOM 1488 CA LYS A 96 -12.432 -6.126 -3.844 1.00 0.00 C ATOM 1489 C LYS A 96 -13.273 -5.582 -2.689 1.00 0.00 C ATOM 1490 O LYS A 96 -13.227 -6.136 -1.591 1.00 0.00 O ATOM 1491 CB LYS A 96 -12.569 -7.647 -4.031 1.00 0.00 C ATOM 1492 CG LYS A 96 -13.999 -8.201 -4.120 1.00 0.00 C ATOM 1493 CD LYS A 96 -14.393 -8.931 -2.829 1.00 0.00 C ATOM 1494 CE LYS A 96 -15.660 -9.766 -3.053 1.00 0.00 C ATOM 1495 NZ LYS A 96 -16.000 -10.568 -1.861 1.00 0.00 N ATOM 0 H LYS A 96 -10.707 -6.342 -2.722 1.00 0.00 H new ATOM 0 HA LYS A 96 -12.793 -5.615 -4.737 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -12.037 -7.928 -4.940 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -12.063 -8.140 -3.200 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -14.697 -7.385 -4.307 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -14.075 -8.885 -4.965 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -13.577 -9.577 -2.505 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -14.563 -8.207 -2.032 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -16.493 -9.106 -3.298 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -15.515 -10.427 -3.908 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -16.862 -11.120 -2.048 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -15.215 -11.215 -1.642 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -16.163 -9.935 -1.052 1.00 0.00 H new ATOM 1509 N TRP A 97 -14.011 -4.483 -2.902 1.00 0.00 N ATOM 1510 CA TRP A 97 -14.756 -3.837 -1.819 1.00 0.00 C ATOM 1511 C TRP A 97 -16.206 -4.310 -1.810 1.00 0.00 C ATOM 1512 O TRP A 97 -16.650 -4.893 -0.823 1.00 0.00 O ATOM 1513 CB TRP A 97 -14.596 -2.303 -1.823 1.00 0.00 C ATOM 1514 CG TRP A 97 -14.390 -1.637 -3.148 1.00 0.00 C ATOM 1515 CD1 TRP A 97 -15.352 -1.419 -4.069 1.00 0.00 C ATOM 1516 CD2 TRP A 97 -13.157 -1.106 -3.731 1.00 0.00 C ATOM 1517 NE1 TRP A 97 -14.780 -0.912 -5.211 1.00 0.00 N ATOM 1518 CE2 TRP A 97 -13.429 -0.722 -5.072 1.00 0.00 C ATOM 1519 CE3 TRP A 97 -11.839 -0.898 -3.273 1.00 0.00 C ATOM 1520 CZ2 TRP A 97 -12.442 -0.244 -5.941 1.00 0.00 C ATOM 1521 CZ3 TRP A 97 -10.845 -0.371 -4.119 1.00 0.00 C ATOM 1522 CH2 TRP A 97 -11.143 -0.051 -5.454 1.00 0.00 C ATOM 0 H TRP A 97 -14.106 -4.027 -3.810 1.00 0.00 H new ATOM 0 HA TRP A 97 -14.320 -4.151 -0.870 1.00 0.00 H new ATOM 0 HB2 TRP A 97 -15.484 -1.870 -1.363 1.00 0.00 H new ATOM 0 HB3 TRP A 97 -13.750 -2.051 -1.184 1.00 0.00 H new ATOM 0 HD1 TRP A 97 -16.405 -1.613 -3.930 1.00 0.00 H new ATOM 0 HE1 TRP A 97 -15.300 -0.701 -6.063 1.00 0.00 H new ATOM 0 HE3 TRP A 97 -11.588 -1.148 -2.253 1.00 0.00 H new ATOM 0 HZ2 TRP A 97 -12.678 -0.027 -6.972 1.00 0.00 H new ATOM 0 HZ3 TRP A 97 -9.847 -0.212 -3.739 1.00 0.00 H new ATOM 0 HH2 TRP A 97 -10.374 0.342 -6.102 1.00 0.00 H new ATOM 1533 N ASN A 98 -16.951 -4.086 -2.897 1.00 0.00 N ATOM 1534 CA ASN A 98 -18.375 -4.409 -2.930 1.00 0.00 C ATOM 1535 C ASN A 98 -18.933 -4.417 -4.353 1.00 0.00 C ATOM 1536 O ASN A 98 -19.076 -5.485 -4.938 1.00 0.00 O ATOM 1537 CB ASN A 98 -19.199 -3.540 -1.955 1.00 0.00 C ATOM 1538 CG ASN A 98 -19.052 -2.033 -2.157 1.00 0.00 C ATOM 1539 OD1 ASN A 98 -18.011 -1.454 -1.873 1.00 0.00 O ATOM 1540 ND2 ASN A 98 -20.083 -1.375 -2.683 1.00 0.00 N ATOM 0 H ASN A 98 -16.590 -3.683 -3.762 1.00 0.00 H new ATOM 0 HA ASN A 98 -18.475 -5.432 -2.566 1.00 0.00 H new ATOM 0 HB2 ASN A 98 -20.252 -3.805 -2.056 1.00 0.00 H new ATOM 0 HB3 ASN A 98 -18.905 -3.786 -0.935 1.00 0.00 H new ATOM 0 HD21 ASN A 98 -20.013 -0.372 -2.856 1.00 0.00 H new ATOM 0 HD22 ASN A 98 -20.942 -1.874 -2.913 1.00 0.00 H new ATOM 1547 N GLY A 99 -19.269 -3.254 -4.919 1.00 0.00 N ATOM 1548 CA GLY A 99 -19.942 -3.191 -6.208 1.00 0.00 C ATOM 1549 C GLY A 99 -19.009 -3.587 -7.348 1.00 0.00 C ATOM 1550 O GLY A 99 -19.461 -3.997 -8.412 1.00 0.00 O ATOM 0 H GLY A 99 -19.083 -2.344 -4.498 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -20.808 -3.852 -6.200 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -20.314 -2.180 -6.376 1.00 0.00 H new ATOM 1554 N GLN A 100 -17.705 -3.398 -7.139 1.00 0.00 N ATOM 1555 CA GLN A 100 -16.657 -3.715 -8.082 1.00 0.00 C ATOM 1556 C GLN A 100 -15.352 -3.863 -7.296 1.00 0.00 C ATOM 1557 O GLN A 100 -15.319 -3.604 -6.089 1.00 0.00 O ATOM 1558 CB GLN A 100 -16.563 -2.660 -9.208 1.00 0.00 C ATOM 1559 CG GLN A 100 -17.316 -1.333 -9.001 1.00 0.00 C ATOM 1560 CD GLN A 100 -16.813 -0.560 -7.791 1.00 0.00 C ATOM 1561 OE1 GLN A 100 -15.656 -0.154 -7.759 1.00 0.00 O ATOM 1562 NE2 GLN A 100 -17.643 -0.370 -6.765 1.00 0.00 N ATOM 0 H GLN A 100 -17.347 -3.003 -6.269 1.00 0.00 H new ATOM 0 HA GLN A 100 -16.876 -4.653 -8.592 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -15.510 -2.428 -9.365 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -16.930 -3.116 -10.128 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -17.209 -0.715 -9.893 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -18.380 -1.538 -8.881 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -18.601 -0.716 -6.813 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -17.320 0.122 -5.932 1.00 0.00 H new ATOM 1571 N GLU A 101 -14.303 -4.291 -7.993 1.00 0.00 N ATOM 1572 CA GLU A 101 -12.989 -4.612 -7.479 1.00 0.00 C ATOM 1573 C GLU A 101 -11.960 -3.911 -8.352 1.00 0.00 C ATOM 1574 O GLU A 101 -12.128 -3.893 -9.569 1.00 0.00 O ATOM 1575 CB GLU A 101 -12.765 -6.130 -7.598 1.00 0.00 C ATOM 1576 CG GLU A 101 -14.013 -6.981 -7.303 1.00 0.00 C ATOM 1577 CD GLU A 101 -14.965 -7.158 -8.490 1.00 0.00 C ATOM 1578 OE1 GLU A 101 -14.873 -6.354 -9.449 1.00 0.00 O ATOM 1579 OE2 GLU A 101 -15.788 -8.090 -8.393 1.00 0.00 O ATOM 0 H GLU A 101 -14.360 -4.430 -9.002 1.00 0.00 H new ATOM 0 HA GLU A 101 -12.900 -4.298 -6.439 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -12.416 -6.356 -8.606 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -11.970 -6.423 -6.912 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -13.692 -7.966 -6.963 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -14.562 -6.523 -6.480 1.00 0.00 H new ATOM 1586 N THR A 102 -10.897 -3.364 -7.766 1.00 0.00 N ATOM 1587 CA THR A 102 -9.713 -2.999 -8.525 1.00 0.00 C ATOM 1588 C THR A 102 -8.672 -4.108 -8.392 1.00 0.00 C ATOM 1589 O THR A 102 -8.857 -5.074 -7.647 1.00 0.00 O ATOM 1590 CB THR A 102 -9.193 -1.618 -8.102 1.00 0.00 C ATOM 1591 OG1 THR A 102 -8.338 -1.140 -9.123 1.00 0.00 O ATOM 1592 CG2 THR A 102 -8.476 -1.621 -6.748 1.00 0.00 C ATOM 0 H THR A 102 -10.836 -3.166 -6.767 1.00 0.00 H new ATOM 0 HA THR A 102 -9.959 -2.906 -9.583 1.00 0.00 H new ATOM 0 HB THR A 102 -10.051 -0.959 -7.969 1.00 0.00 H new ATOM 0 HG1 THR A 102 -8.683 -0.290 -9.468 1.00 0.00 H new ATOM 0 HG21 THR A 102 -8.136 -0.612 -6.514 1.00 0.00 H new ATOM 0 HG22 THR A 102 -9.163 -1.961 -5.973 1.00 0.00 H new ATOM 0 HG23 THR A 102 -7.618 -2.292 -6.792 1.00 0.00 H new ATOM 1600 N SER A 103 -7.566 -3.975 -9.118 1.00 0.00 N ATOM 1601 CA SER A 103 -6.497 -4.946 -9.103 1.00 0.00 C ATOM 1602 C SER A 103 -5.200 -4.271 -9.514 1.00 0.00 C ATOM 1603 O SER A 103 -5.209 -3.243 -10.198 1.00 0.00 O ATOM 1604 CB SER A 103 -6.851 -6.129 -10.015 1.00 0.00 C ATOM 1605 OG SER A 103 -7.261 -5.673 -11.289 1.00 0.00 O ATOM 0 H SER A 103 -7.393 -3.182 -9.735 1.00 0.00 H new ATOM 0 HA SER A 103 -6.363 -5.344 -8.097 1.00 0.00 H new ATOM 0 HB2 SER A 103 -5.987 -6.786 -10.119 1.00 0.00 H new ATOM 0 HB3 SER A 103 -7.647 -6.719 -9.561 1.00 0.00 H new ATOM 0 HG SER A 103 -7.481 -6.441 -11.856 1.00 0.00 H new ATOM 1611 N LEU A 104 -4.084 -4.849 -9.069 1.00 0.00 N ATOM 1612 CA LEU A 104 -2.770 -4.426 -9.493 1.00 0.00 C ATOM 1613 C LEU A 104 -1.829 -5.618 -9.513 1.00 0.00 C ATOM 1614 O LEU A 104 -2.039 -6.593 -8.787 1.00 0.00 O ATOM 1615 CB LEU A 104 -2.264 -3.269 -8.618 1.00 0.00 C ATOM 1616 CG LEU A 104 -2.111 -3.607 -7.125 1.00 0.00 C ATOM 1617 CD1 LEU A 104 -0.682 -4.048 -6.798 1.00 0.00 C ATOM 1618 CD2 LEU A 104 -2.439 -2.384 -6.264 1.00 0.00 C ATOM 0 H LEU A 104 -4.077 -5.623 -8.405 1.00 0.00 H new ATOM 0 HA LEU A 104 -2.817 -4.037 -10.510 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -1.299 -2.937 -9.002 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -2.952 -2.429 -8.717 1.00 0.00 H new ATOM 0 HG LEU A 104 -2.802 -4.421 -6.908 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -0.607 -4.280 -5.736 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -0.432 -4.934 -7.381 1.00 0.00 H new ATOM 0 HD13 LEU A 104 0.012 -3.244 -7.044 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -2.326 -2.640 -5.210 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -1.759 -1.570 -6.515 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -3.466 -2.071 -6.453 1.00 0.00 H new ATOM 1630 N VAL A 105 -0.802 -5.521 -10.356 1.00 0.00 N ATOM 1631 CA VAL A 105 0.266 -6.497 -10.477 1.00 0.00 C ATOM 1632 C VAL A 105 1.568 -5.715 -10.342 1.00 0.00 C ATOM 1633 O VAL A 105 1.635 -4.600 -10.867 1.00 0.00 O ATOM 1634 CB VAL A 105 0.208 -7.243 -11.828 1.00 0.00 C ATOM 1635 CG1 VAL A 105 0.616 -8.702 -11.601 1.00 0.00 C ATOM 1636 CG2 VAL A 105 -1.168 -7.217 -12.510 1.00 0.00 C ATOM 0 H VAL A 105 -0.692 -4.732 -10.993 1.00 0.00 H new ATOM 0 HA VAL A 105 0.178 -7.265 -9.708 1.00 0.00 H new ATOM 0 HB VAL A 105 0.892 -6.720 -12.497 1.00 0.00 H new ATOM 0 HG11 VAL A 105 0.580 -9.241 -12.547 1.00 0.00 H new ATOM 0 HG12 VAL A 105 1.629 -8.738 -11.201 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -0.070 -9.166 -10.892 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -1.118 -7.764 -13.452 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -1.906 -7.684 -11.858 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -1.458 -6.185 -12.705 1.00 0.00 H new ATOM 1646 N ARG A 106 2.558 -6.263 -9.629 1.00 0.00 N ATOM 1647 CA ARG A 106 3.865 -5.648 -9.426 1.00 0.00 C ATOM 1648 C ARG A 106 4.963 -6.647 -9.797 1.00 0.00 C ATOM 1649 O ARG A 106 4.837 -7.823 -9.463 1.00 0.00 O ATOM 1650 CB ARG A 106 4.050 -5.191 -7.966 1.00 0.00 C ATOM 1651 CG ARG A 106 2.771 -4.986 -7.145 1.00 0.00 C ATOM 1652 CD ARG A 106 3.152 -4.443 -5.758 1.00 0.00 C ATOM 1653 NE ARG A 106 2.000 -4.443 -4.841 1.00 0.00 N ATOM 1654 CZ ARG A 106 1.723 -3.533 -3.888 1.00 0.00 C ATOM 1655 NH1 ARG A 106 2.515 -2.470 -3.702 1.00 0.00 N ATOM 1656 NH2 ARG A 106 0.643 -3.694 -3.115 1.00 0.00 N ATOM 0 H ARG A 106 2.466 -7.168 -9.168 1.00 0.00 H new ATOM 0 HA ARG A 106 3.931 -4.768 -10.066 1.00 0.00 H new ATOM 0 HB2 ARG A 106 4.669 -5.927 -7.454 1.00 0.00 H new ATOM 0 HB3 ARG A 106 4.607 -4.254 -7.970 1.00 0.00 H new ATOM 0 HG2 ARG A 106 2.105 -4.289 -7.653 1.00 0.00 H new ATOM 0 HG3 ARG A 106 2.231 -5.928 -7.046 1.00 0.00 H new ATOM 0 HD2 ARG A 106 3.953 -5.050 -5.337 1.00 0.00 H new ATOM 0 HD3 ARG A 106 3.539 -3.429 -5.857 1.00 0.00 H new ATOM 0 HE ARG A 106 1.341 -5.215 -4.938 1.00 0.00 H new ATOM 0 HH11 ARG A 106 3.341 -2.341 -4.286 1.00 0.00 H new ATOM 0 HH12 ARG A 106 2.292 -1.789 -2.976 1.00 0.00 H new ATOM 0 HH21 ARG A 106 0.035 -4.502 -3.249 1.00 0.00 H new ATOM 0 HH22 ARG A 106 0.427 -3.009 -2.391 1.00 0.00 H new ATOM 1670 N GLU A 107 6.042 -6.197 -10.446 1.00 0.00 N ATOM 1671 CA GLU A 107 7.169 -7.047 -10.818 1.00 0.00 C ATOM 1672 C GLU A 107 8.445 -6.211 -10.834 1.00 0.00 C ATOM 1673 O GLU A 107 8.435 -5.126 -11.415 1.00 0.00 O ATOM 1674 CB GLU A 107 6.898 -7.655 -12.201 1.00 0.00 C ATOM 1675 CG GLU A 107 8.069 -8.495 -12.738 1.00 0.00 C ATOM 1676 CD GLU A 107 7.693 -9.247 -14.006 1.00 0.00 C ATOM 1677 OE1 GLU A 107 6.574 -9.030 -14.526 1.00 0.00 O ATOM 1678 OE2 GLU A 107 8.444 -10.156 -14.421 1.00 0.00 O ATOM 0 H GLU A 107 6.155 -5.223 -10.729 1.00 0.00 H new ATOM 0 HA GLU A 107 7.292 -7.854 -10.096 1.00 0.00 H new ATOM 0 HB2 GLU A 107 6.007 -8.280 -12.147 1.00 0.00 H new ATOM 0 HB3 GLU A 107 6.682 -6.853 -12.907 1.00 0.00 H new ATOM 0 HG2 GLU A 107 8.920 -7.844 -12.941 1.00 0.00 H new ATOM 0 HG3 GLU A 107 8.386 -9.206 -11.975 1.00 0.00 H new ATOM 1685 N MET A 108 9.534 -6.715 -10.233 1.00 0.00 N ATOM 1686 CA MET A 108 10.870 -6.192 -10.481 1.00 0.00 C ATOM 1687 C MET A 108 11.624 -7.147 -11.393 1.00 0.00 C ATOM 1688 O MET A 108 11.913 -8.277 -11.009 1.00 0.00 O ATOM 1689 CB MET A 108 11.677 -5.924 -9.199 1.00 0.00 C ATOM 1690 CG MET A 108 12.888 -5.019 -9.508 1.00 0.00 C ATOM 1691 SD MET A 108 14.497 -5.516 -8.826 1.00 0.00 S ATOM 1692 CE MET A 108 14.860 -6.986 -9.815 1.00 0.00 C ATOM 0 H MET A 108 9.506 -7.489 -9.569 1.00 0.00 H new ATOM 0 HA MET A 108 10.747 -5.222 -10.963 1.00 0.00 H new ATOM 0 HB2 MET A 108 11.040 -5.449 -8.453 1.00 0.00 H new ATOM 0 HB3 MET A 108 12.019 -6.867 -8.772 1.00 0.00 H new ATOM 0 HG2 MET A 108 12.988 -4.948 -10.591 1.00 0.00 H new ATOM 0 HG3 MET A 108 12.662 -4.017 -9.143 1.00 0.00 H new ATOM 0 HE1 MET A 108 15.820 -7.402 -9.509 1.00 0.00 H new ATOM 0 HE2 MET A 108 14.077 -7.729 -9.663 1.00 0.00 H new ATOM 0 HE3 MET A 108 14.902 -6.714 -10.870 1.00 0.00 H new ATOM 1702 N VAL A 109 12.021 -6.635 -12.551 1.00 0.00 N ATOM 1703 CA VAL A 109 13.161 -7.118 -13.306 1.00 0.00 C ATOM 1704 C VAL A 109 14.030 -5.886 -13.544 1.00 0.00 C ATOM 1705 O VAL A 109 13.660 -4.794 -13.099 1.00 0.00 O ATOM 1706 CB VAL A 109 12.716 -7.844 -14.586 1.00 0.00 C ATOM 1707 CG1 VAL A 109 11.980 -9.143 -14.235 1.00 0.00 C ATOM 1708 CG2 VAL A 109 11.828 -6.970 -15.482 1.00 0.00 C ATOM 0 H VAL A 109 11.544 -5.853 -12.999 1.00 0.00 H new ATOM 0 HA VAL A 109 13.736 -7.877 -12.775 1.00 0.00 H new ATOM 0 HB VAL A 109 13.621 -8.073 -15.148 1.00 0.00 H new ATOM 0 HG11 VAL A 109 11.671 -9.645 -15.152 1.00 0.00 H new ATOM 0 HG12 VAL A 109 12.644 -9.796 -13.669 1.00 0.00 H new ATOM 0 HG13 VAL A 109 11.100 -8.912 -13.634 1.00 0.00 H new ATOM 0 HG21 VAL A 109 11.543 -7.532 -16.371 1.00 0.00 H new ATOM 0 HG22 VAL A 109 10.932 -6.680 -14.934 1.00 0.00 H new ATOM 0 HG23 VAL A 109 12.378 -6.077 -15.778 1.00 0.00 H new ATOM 1718 N ASP A 110 15.199 -6.059 -14.166 1.00 0.00 N ATOM 1719 CA ASP A 110 16.183 -4.990 -14.266 1.00 0.00 C ATOM 1720 C ASP A 110 16.434 -4.445 -12.846 1.00 0.00 C ATOM 1721 O ASP A 110 16.810 -5.216 -11.962 1.00 0.00 O ATOM 1722 CB ASP A 110 15.696 -3.977 -15.319 1.00 0.00 C ATOM 1723 CG ASP A 110 16.604 -2.768 -15.456 1.00 0.00 C ATOM 1724 OD1 ASP A 110 17.649 -2.900 -16.122 1.00 0.00 O ATOM 1725 OD2 ASP A 110 16.230 -1.746 -14.837 1.00 0.00 O ATOM 0 H ASP A 110 15.483 -6.933 -14.607 1.00 0.00 H new ATOM 0 HA ASP A 110 17.159 -5.316 -14.626 1.00 0.00 H new ATOM 0 HB2 ASP A 110 15.620 -4.476 -16.285 1.00 0.00 H new ATOM 0 HB3 ASP A 110 14.694 -3.641 -15.053 1.00 0.00 H new ATOM 1730 N GLY A 111 16.144 -3.172 -12.581 1.00 0.00 N ATOM 1731 CA GLY A 111 16.244 -2.545 -11.274 1.00 0.00 C ATOM 1732 C GLY A 111 15.008 -1.698 -10.981 1.00 0.00 C ATOM 1733 O GLY A 111 15.061 -0.818 -10.123 1.00 0.00 O ATOM 0 H GLY A 111 15.821 -2.528 -13.303 1.00 0.00 H new ATOM 0 HA2 GLY A 111 16.356 -3.311 -10.506 1.00 0.00 H new ATOM 0 HA3 GLY A 111 17.136 -1.920 -11.233 1.00 0.00 H new ATOM 1737 N LYS A 112 13.892 -1.971 -11.667 1.00 0.00 N ATOM 1738 CA LYS A 112 12.663 -1.206 -11.548 1.00 0.00 C ATOM 1739 C LYS A 112 11.532 -2.152 -11.185 1.00 0.00 C ATOM 1740 O LYS A 112 11.350 -3.166 -11.852 1.00 0.00 O ATOM 1741 CB LYS A 112 12.365 -0.481 -12.864 1.00 0.00 C ATOM 1742 CG LYS A 112 13.367 0.655 -13.088 1.00 0.00 C ATOM 1743 CD LYS A 112 12.857 1.636 -14.153 1.00 0.00 C ATOM 1744 CE LYS A 112 13.613 2.962 -14.002 1.00 0.00 C ATOM 1745 NZ LYS A 112 13.129 4.011 -14.920 1.00 0.00 N ATOM 0 H LYS A 112 13.825 -2.744 -12.329 1.00 0.00 H new ATOM 0 HA LYS A 112 12.767 -0.453 -10.767 1.00 0.00 H new ATOM 0 HB2 LYS A 112 12.414 -1.186 -13.694 1.00 0.00 H new ATOM 0 HB3 LYS A 112 11.351 -0.081 -12.845 1.00 0.00 H new ATOM 0 HG2 LYS A 112 13.536 1.186 -12.151 1.00 0.00 H new ATOM 0 HG3 LYS A 112 14.327 0.242 -13.398 1.00 0.00 H new ATOM 0 HD2 LYS A 112 13.011 1.225 -15.151 1.00 0.00 H new ATOM 0 HD3 LYS A 112 11.785 1.797 -14.037 1.00 0.00 H new ATOM 0 HE2 LYS A 112 13.517 3.314 -12.975 1.00 0.00 H new ATOM 0 HE3 LYS A 112 14.674 2.791 -14.182 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 13.677 4.882 -14.771 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 13.245 3.692 -15.903 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 12.123 4.199 -14.733 1.00 0.00 H new ATOM 1759 N LEU A 113 10.797 -1.829 -10.118 1.00 0.00 N ATOM 1760 CA LEU A 113 9.621 -2.570 -9.700 1.00 0.00 C ATOM 1761 C LEU A 113 8.436 -1.892 -10.387 1.00 0.00 C ATOM 1762 O LEU A 113 7.875 -0.920 -9.878 1.00 0.00 O ATOM 1763 CB LEU A 113 9.569 -2.629 -8.167 1.00 0.00 C ATOM 1764 CG LEU A 113 8.653 -3.693 -7.540 1.00 0.00 C ATOM 1765 CD1 LEU A 113 8.684 -3.535 -6.013 1.00 0.00 C ATOM 1766 CD2 LEU A 113 7.203 -3.654 -8.011 1.00 0.00 C ATOM 0 H LEU A 113 11.011 -1.033 -9.517 1.00 0.00 H new ATOM 0 HA LEU A 113 9.620 -3.618 -9.999 1.00 0.00 H new ATOM 0 HB2 LEU A 113 10.582 -2.795 -7.800 1.00 0.00 H new ATOM 0 HB3 LEU A 113 9.253 -1.652 -7.801 1.00 0.00 H new ATOM 0 HG LEU A 113 9.046 -4.656 -7.866 1.00 0.00 H new ATOM 0 HD11 LEU A 113 8.038 -4.285 -5.556 1.00 0.00 H new ATOM 0 HD12 LEU A 113 9.704 -3.669 -5.654 1.00 0.00 H new ATOM 0 HD13 LEU A 113 8.332 -2.539 -5.743 1.00 0.00 H new ATOM 0 HD21 LEU A 113 6.637 -4.442 -7.513 1.00 0.00 H new ATOM 0 HD22 LEU A 113 6.767 -2.685 -7.768 1.00 0.00 H new ATOM 0 HD23 LEU A 113 7.167 -3.808 -9.090 1.00 0.00 H new ATOM 1778 N ILE A 114 8.102 -2.385 -11.579 1.00 0.00 N ATOM 1779 CA ILE A 114 7.025 -1.871 -12.410 1.00 0.00 C ATOM 1780 C ILE A 114 5.713 -2.360 -11.802 1.00 0.00 C ATOM 1781 O ILE A 114 5.663 -3.489 -11.306 1.00 0.00 O ATOM 1782 CB ILE A 114 7.204 -2.362 -13.862 1.00 0.00 C ATOM 1783 CG1 ILE A 114 8.600 -1.984 -14.400 1.00 0.00 C ATOM 1784 CG2 ILE A 114 6.105 -1.776 -14.763 1.00 0.00 C ATOM 1785 CD1 ILE A 114 8.875 -2.528 -15.805 1.00 0.00 C ATOM 0 H ILE A 114 8.590 -3.175 -12.001 1.00 0.00 H new ATOM 0 HA ILE A 114 7.028 -0.781 -12.442 1.00 0.00 H new ATOM 0 HB ILE A 114 7.119 -3.449 -13.869 1.00 0.00 H new ATOM 0 HG12 ILE A 114 8.695 -0.898 -14.413 1.00 0.00 H new ATOM 0 HG13 ILE A 114 9.360 -2.362 -13.716 1.00 0.00 H new ATOM 0 HG21 ILE A 114 6.244 -2.131 -15.784 1.00 0.00 H new ATOM 0 HG22 ILE A 114 5.128 -2.093 -14.398 1.00 0.00 H new ATOM 0 HG23 ILE A 114 6.163 -0.688 -14.746 1.00 0.00 H new ATOM 0 HD11 ILE A 114 9.873 -2.226 -16.123 1.00 0.00 H new ATOM 0 HD12 ILE A 114 8.812 -3.616 -15.793 1.00 0.00 H new ATOM 0 HD13 ILE A 114 8.136 -2.129 -16.500 1.00 0.00 H new ATOM 1797 N LEU A 115 4.652 -1.542 -11.830 1.00 0.00 N ATOM 1798 CA LEU A 115 3.344 -1.996 -11.387 1.00 0.00 C ATOM 1799 C LEU A 115 2.197 -1.282 -12.104 1.00 0.00 C ATOM 1800 O LEU A 115 2.256 -0.083 -12.387 1.00 0.00 O ATOM 1801 CB LEU A 115 3.212 -1.991 -9.853 1.00 0.00 C ATOM 1802 CG LEU A 115 3.286 -0.630 -9.153 1.00 0.00 C ATOM 1803 CD1 LEU A 115 2.866 -0.793 -7.690 1.00 0.00 C ATOM 1804 CD2 LEU A 115 4.701 -0.047 -9.145 1.00 0.00 C ATOM 0 H LEU A 115 4.681 -0.575 -12.152 1.00 0.00 H new ATOM 0 HA LEU A 115 3.258 -3.041 -11.685 1.00 0.00 H new ATOM 0 HB2 LEU A 115 2.260 -2.454 -9.593 1.00 0.00 H new ATOM 0 HB3 LEU A 115 3.998 -2.626 -9.443 1.00 0.00 H new ATOM 0 HG LEU A 115 2.628 0.041 -9.704 1.00 0.00 H new ATOM 0 HD11 LEU A 115 2.917 0.173 -7.187 1.00 0.00 H new ATOM 0 HD12 LEU A 115 1.845 -1.172 -7.645 1.00 0.00 H new ATOM 0 HD13 LEU A 115 3.537 -1.496 -7.195 1.00 0.00 H new ATOM 0 HD21 LEU A 115 4.694 0.917 -8.637 1.00 0.00 H new ATOM 0 HD22 LEU A 115 5.372 -0.728 -8.622 1.00 0.00 H new ATOM 0 HD23 LEU A 115 5.046 0.086 -10.171 1.00 0.00 H new ATOM 1816 N THR A 116 1.152 -2.056 -12.403 1.00 0.00 N ATOM 1817 CA THR A 116 -0.002 -1.639 -13.188 1.00 0.00 C ATOM 1818 C THR A 116 -1.183 -1.471 -12.237 1.00 0.00 C ATOM 1819 O THR A 116 -1.490 -2.401 -11.497 1.00 0.00 O ATOM 1820 CB THR A 116 -0.274 -2.703 -14.263 1.00 0.00 C ATOM 1821 OG1 THR A 116 0.917 -2.912 -14.999 1.00 0.00 O ATOM 1822 CG2 THR A 116 -1.385 -2.258 -15.220 1.00 0.00 C ATOM 0 H THR A 116 1.088 -3.025 -12.092 1.00 0.00 H new ATOM 0 HA THR A 116 0.172 -0.689 -13.694 1.00 0.00 H new ATOM 0 HB THR A 116 -0.597 -3.622 -13.773 1.00 0.00 H new ATOM 0 HG1 THR A 116 0.761 -3.590 -15.689 1.00 0.00 H new ATOM 0 HG21 THR A 116 -1.553 -3.033 -15.968 1.00 0.00 H new ATOM 0 HG22 THR A 116 -2.304 -2.091 -14.658 1.00 0.00 H new ATOM 0 HG23 THR A 116 -1.090 -1.333 -15.716 1.00 0.00 H new ATOM 1830 N LEU A 117 -1.812 -0.291 -12.232 1.00 0.00 N ATOM 1831 CA LEU A 117 -2.878 0.112 -11.318 1.00 0.00 C ATOM 1832 C LEU A 117 -4.119 0.394 -12.167 1.00 0.00 C ATOM 1833 O LEU A 117 -4.460 1.551 -12.414 1.00 0.00 O ATOM 1834 CB LEU A 117 -2.439 1.384 -10.566 1.00 0.00 C ATOM 1835 CG LEU A 117 -1.600 1.181 -9.298 1.00 0.00 C ATOM 1836 CD1 LEU A 117 -2.466 0.768 -8.105 1.00 0.00 C ATOM 1837 CD2 LEU A 117 -0.415 0.231 -9.473 1.00 0.00 C ATOM 0 H LEU A 117 -1.577 0.443 -12.900 1.00 0.00 H new ATOM 0 HA LEU A 117 -3.093 -0.665 -10.584 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -1.868 2.007 -11.255 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -3.334 1.945 -10.296 1.00 0.00 H new ATOM 0 HG LEU A 117 -1.165 2.159 -9.090 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -1.835 0.634 -7.226 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -3.205 1.544 -7.906 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -2.975 -0.169 -8.332 1.00 0.00 H new ATOM 0 HD21 LEU A 117 0.124 0.144 -8.530 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -0.778 -0.751 -9.776 1.00 0.00 H new ATOM 0 HD23 LEU A 117 0.255 0.622 -10.239 1.00 0.00 H new ATOM 1849 N THR A 118 -4.789 -0.654 -12.642 1.00 0.00 N ATOM 1850 CA THR A 118 -5.789 -0.520 -13.692 1.00 0.00 C ATOM 1851 C THR A 118 -7.090 -1.183 -13.271 1.00 0.00 C ATOM 1852 O THR A 118 -7.094 -2.242 -12.653 1.00 0.00 O ATOM 1853 CB THR A 118 -5.210 -1.067 -15.003 1.00 0.00 C ATOM 1854 OG1 THR A 118 -4.314 -0.087 -15.492 1.00 0.00 O ATOM 1855 CG2 THR A 118 -6.257 -1.368 -16.080 1.00 0.00 C ATOM 0 H THR A 118 -4.654 -1.610 -12.312 1.00 0.00 H new ATOM 0 HA THR A 118 -6.035 0.528 -13.862 1.00 0.00 H new ATOM 0 HB THR A 118 -4.731 -2.022 -14.786 1.00 0.00 H new ATOM 0 HG1 THR A 118 -3.800 -0.458 -16.240 1.00 0.00 H new ATOM 0 HG21 THR A 118 -5.761 -1.750 -16.972 1.00 0.00 H new ATOM 0 HG22 THR A 118 -6.959 -2.114 -15.707 1.00 0.00 H new ATOM 0 HG23 THR A 118 -6.797 -0.454 -16.328 1.00 0.00 H new ATOM 1863 N HIS A 119 -8.198 -0.515 -13.582 1.00 0.00 N ATOM 1864 CA HIS A 119 -9.551 -0.969 -13.340 1.00 0.00 C ATOM 1865 C HIS A 119 -10.427 -0.151 -14.283 1.00 0.00 C ATOM 1866 O HIS A 119 -10.016 0.940 -14.670 1.00 0.00 O ATOM 1867 CB HIS A 119 -9.868 -0.729 -11.860 1.00 0.00 C ATOM 1868 CG HIS A 119 -11.304 -0.893 -11.438 1.00 0.00 C ATOM 1869 ND1 HIS A 119 -11.952 -0.111 -10.497 1.00 0.00 N ATOM 1870 CD2 HIS A 119 -12.094 -1.974 -11.708 1.00 0.00 C ATOM 1871 CE1 HIS A 119 -13.124 -0.707 -10.209 1.00 0.00 C ATOM 1872 NE2 HIS A 119 -13.232 -1.834 -10.940 1.00 0.00 N ATOM 0 H HIS A 119 -8.167 0.400 -14.031 1.00 0.00 H new ATOM 0 HA HIS A 119 -9.713 -2.030 -13.530 1.00 0.00 H new ATOM 0 HB2 HIS A 119 -9.260 -1.412 -11.267 1.00 0.00 H new ATOM 0 HB3 HIS A 119 -9.552 0.283 -11.605 1.00 0.00 H new ATOM 0 HD2 HIS A 119 -11.871 -2.781 -12.390 1.00 0.00 H new ATOM 0 HE1 HIS A 119 -13.858 -0.342 -9.506 1.00 0.00 H new ATOM 0 HE2 HIS A 119 -14.024 -2.477 -10.928 1.00 0.00 H new ATOM 1881 N GLY A 120 -11.608 -0.658 -14.649 1.00 0.00 N ATOM 1882 CA GLY A 120 -12.522 -0.008 -15.586 1.00 0.00 C ATOM 1883 C GLY A 120 -12.726 1.481 -15.292 1.00 0.00 C ATOM 1884 O GLY A 120 -12.875 2.284 -16.206 1.00 0.00 O ATOM 0 H GLY A 120 -11.960 -1.548 -14.295 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -12.136 -0.123 -16.599 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -13.487 -0.514 -15.553 1.00 0.00 H new ATOM 1888 N THR A 121 -12.714 1.840 -14.005 1.00 0.00 N ATOM 1889 CA THR A 121 -12.805 3.215 -13.534 1.00 0.00 C ATOM 1890 C THR A 121 -11.768 4.127 -14.221 1.00 0.00 C ATOM 1891 O THR A 121 -12.102 5.245 -14.605 1.00 0.00 O ATOM 1892 CB THR A 121 -12.707 3.205 -11.996 1.00 0.00 C ATOM 1893 OG1 THR A 121 -13.288 4.348 -11.415 1.00 0.00 O ATOM 1894 CG2 THR A 121 -11.267 3.069 -11.492 1.00 0.00 C ATOM 0 H THR A 121 -12.639 1.162 -13.247 1.00 0.00 H new ATOM 0 HA THR A 121 -13.767 3.648 -13.810 1.00 0.00 H new ATOM 0 HB THR A 121 -13.268 2.323 -11.686 1.00 0.00 H new ATOM 0 HG1 THR A 121 -13.204 4.298 -10.440 1.00 0.00 H new ATOM 0 HG21 THR A 121 -11.262 3.068 -10.402 1.00 0.00 H new ATOM 0 HG22 THR A 121 -10.840 2.135 -11.858 1.00 0.00 H new ATOM 0 HG23 THR A 121 -10.673 3.907 -11.857 1.00 0.00 H new ATOM 1902 N ALA A 122 -10.528 3.641 -14.391 1.00 0.00 N ATOM 1903 CA ALA A 122 -9.419 4.343 -15.027 1.00 0.00 C ATOM 1904 C ALA A 122 -8.188 3.427 -15.100 1.00 0.00 C ATOM 1905 O ALA A 122 -7.732 2.906 -14.080 1.00 0.00 O ATOM 1906 CB ALA A 122 -9.061 5.616 -14.252 1.00 0.00 C ATOM 0 H ALA A 122 -10.267 2.708 -14.073 1.00 0.00 H new ATOM 0 HA ALA A 122 -9.728 4.621 -16.034 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -8.231 6.122 -14.746 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -9.925 6.280 -14.223 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -8.772 5.353 -13.235 1.00 0.00 H new ATOM 1912 N VAL A 123 -7.612 3.270 -16.295 1.00 0.00 N ATOM 1913 CA VAL A 123 -6.324 2.611 -16.501 1.00 0.00 C ATOM 1914 C VAL A 123 -5.243 3.455 -15.819 1.00 0.00 C ATOM 1915 O VAL A 123 -5.311 4.683 -15.877 1.00 0.00 O ATOM 1916 CB VAL A 123 -6.063 2.475 -18.016 1.00 0.00 C ATOM 1917 CG1 VAL A 123 -4.740 1.768 -18.310 1.00 0.00 C ATOM 1918 CG2 VAL A 123 -7.152 1.651 -18.711 1.00 0.00 C ATOM 0 H VAL A 123 -8.037 3.604 -17.160 1.00 0.00 H new ATOM 0 HA VAL A 123 -6.317 1.611 -16.068 1.00 0.00 H new ATOM 0 HB VAL A 123 -6.047 3.498 -18.392 1.00 0.00 H new ATOM 0 HG11 VAL A 123 -4.598 1.695 -19.388 1.00 0.00 H new ATOM 0 HG12 VAL A 123 -3.919 2.337 -17.874 1.00 0.00 H new ATOM 0 HG13 VAL A 123 -4.758 0.768 -17.878 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -6.930 1.580 -19.776 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -7.183 0.651 -18.279 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -8.119 2.136 -18.573 1.00 0.00 H new ATOM 1928 N CYS A 124 -4.281 2.863 -15.096 1.00 0.00 N ATOM 1929 CA CYS A 124 -3.178 3.631 -14.508 1.00 0.00 C ATOM 1930 C CYS A 124 -1.930 2.759 -14.398 1.00 0.00 C ATOM 1931 O CYS A 124 -2.028 1.535 -14.336 1.00 0.00 O ATOM 1932 CB CYS A 124 -3.517 4.235 -13.129 1.00 0.00 C ATOM 1933 SG CYS A 124 -5.277 4.599 -12.901 1.00 0.00 S ATOM 0 H CYS A 124 -4.246 1.861 -14.906 1.00 0.00 H new ATOM 0 HA CYS A 124 -2.995 4.469 -15.181 1.00 0.00 H new ATOM 0 HB2 CYS A 124 -3.195 3.543 -12.351 1.00 0.00 H new ATOM 0 HB3 CYS A 124 -2.946 5.153 -12.995 1.00 0.00 H new ATOM 0 HG CYS A 124 -5.689 4.071 -11.787 1.00 0.00 H new ATOM 1939 N THR A 125 -0.754 3.385 -14.361 1.00 0.00 N ATOM 1940 CA THR A 125 0.528 2.694 -14.349 1.00 0.00 C ATOM 1941 C THR A 125 1.503 3.455 -13.457 1.00 0.00 C ATOM 1942 O THR A 125 1.258 4.624 -13.130 1.00 0.00 O ATOM 1943 CB THR A 125 1.073 2.610 -15.785 1.00 0.00 C ATOM 1944 OG1 THR A 125 0.929 3.863 -16.422 1.00 0.00 O ATOM 1945 CG2 THR A 125 0.332 1.569 -16.625 1.00 0.00 C ATOM 0 H THR A 125 -0.668 4.401 -14.338 1.00 0.00 H new ATOM 0 HA THR A 125 0.403 1.685 -13.957 1.00 0.00 H new ATOM 0 HB THR A 125 2.121 2.320 -15.711 1.00 0.00 H new ATOM 0 HG1 THR A 125 1.278 3.807 -17.336 1.00 0.00 H new ATOM 0 HG21 THR A 125 0.752 1.547 -17.630 1.00 0.00 H new ATOM 0 HG22 THR A 125 0.439 0.587 -16.165 1.00 0.00 H new ATOM 0 HG23 THR A 125 -0.725 1.831 -16.679 1.00 0.00 H new ATOM 1953 N ARG A 126 2.596 2.788 -13.064 1.00 0.00 N ATOM 1954 CA ARG A 126 3.734 3.400 -12.400 1.00 0.00 C ATOM 1955 C ARG A 126 4.922 2.453 -12.368 1.00 0.00 C ATOM 1956 O ARG A 126 4.785 1.258 -12.639 1.00 0.00 O ATOM 1957 CB ARG A 126 3.356 3.855 -10.984 1.00 0.00 C ATOM 1958 CG ARG A 126 2.677 2.766 -10.152 1.00 0.00 C ATOM 1959 CD ARG A 126 1.985 3.311 -8.898 1.00 0.00 C ATOM 1960 NE ARG A 126 0.932 4.283 -9.243 1.00 0.00 N ATOM 1961 CZ ARG A 126 -0.176 4.520 -8.529 1.00 0.00 C ATOM 1962 NH1 ARG A 126 -0.335 3.958 -7.325 1.00 0.00 N ATOM 1963 NH2 ARG A 126 -1.122 5.311 -9.036 1.00 0.00 N ATOM 0 H ARG A 126 2.707 1.784 -13.206 1.00 0.00 H new ATOM 0 HA ARG A 126 4.026 4.280 -12.973 1.00 0.00 H new ATOM 0 HB2 ARG A 126 4.255 4.188 -10.466 1.00 0.00 H new ATOM 0 HB3 ARG A 126 2.691 4.716 -11.053 1.00 0.00 H new ATOM 0 HG2 ARG A 126 1.942 2.250 -10.770 1.00 0.00 H new ATOM 0 HG3 ARG A 126 3.421 2.026 -9.857 1.00 0.00 H new ATOM 0 HD2 ARG A 126 1.550 2.486 -8.333 1.00 0.00 H new ATOM 0 HD3 ARG A 126 2.723 3.786 -8.251 1.00 0.00 H new ATOM 0 HE ARG A 126 1.058 4.822 -10.100 1.00 0.00 H new ATOM 0 HH11 ARG A 126 0.389 3.347 -6.948 1.00 0.00 H new ATOM 0 HH12 ARG A 126 -1.180 4.141 -6.784 1.00 0.00 H new ATOM 0 HH21 ARG A 126 -0.998 5.728 -9.958 1.00 0.00 H new ATOM 0 HH22 ARG A 126 -1.970 5.499 -8.502 1.00 0.00 H new ATOM 1977 N THR A 127 6.083 2.991 -11.994 1.00 0.00 N ATOM 1978 CA THR A 127 7.205 2.170 -11.590 1.00 0.00 C ATOM 1979 C THR A 127 7.857 2.770 -10.354 1.00 0.00 C ATOM 1980 O THR A 127 8.067 3.983 -10.249 1.00 0.00 O ATOM 1981 CB THR A 127 8.181 1.915 -12.748 1.00 0.00 C ATOM 1982 OG1 THR A 127 9.059 0.859 -12.414 1.00 0.00 O ATOM 1983 CG2 THR A 127 9.039 3.120 -13.112 1.00 0.00 C ATOM 0 H THR A 127 6.263 3.995 -11.965 1.00 0.00 H new ATOM 0 HA THR A 127 6.845 1.179 -11.315 1.00 0.00 H new ATOM 0 HB THR A 127 7.554 1.675 -13.607 1.00 0.00 H new ATOM 0 HG1 THR A 127 9.543 1.083 -11.592 1.00 0.00 H new ATOM 0 HG21 THR A 127 9.701 2.859 -13.938 1.00 0.00 H new ATOM 0 HG22 THR A 127 8.396 3.948 -13.410 1.00 0.00 H new ATOM 0 HG23 THR A 127 9.635 3.416 -12.249 1.00 0.00 H new ATOM 1991 N TYR A 128 8.170 1.873 -9.425 1.00 0.00 N ATOM 1992 CA TYR A 128 9.061 2.113 -8.319 1.00 0.00 C ATOM 1993 C TYR A 128 10.478 1.768 -8.779 1.00 0.00 C ATOM 1994 O TYR A 128 10.656 0.943 -9.681 1.00 0.00 O ATOM 1995 CB TYR A 128 8.647 1.197 -7.166 1.00 0.00 C ATOM 1996 CG TYR A 128 7.420 1.600 -6.373 1.00 0.00 C ATOM 1997 CD1 TYR A 128 7.418 2.798 -5.638 1.00 0.00 C ATOM 1998 CD2 TYR A 128 6.355 0.694 -6.226 1.00 0.00 C ATOM 1999 CE1 TYR A 128 6.319 3.127 -4.825 1.00 0.00 C ATOM 2000 CE2 TYR A 128 5.248 1.030 -5.429 1.00 0.00 C ATOM 2001 CZ TYR A 128 5.225 2.251 -4.741 1.00 0.00 C ATOM 2002 OH TYR A 128 4.178 2.526 -3.914 1.00 0.00 O ATOM 0 H TYR A 128 7.790 0.926 -9.431 1.00 0.00 H new ATOM 0 HA TYR A 128 9.022 3.151 -7.989 1.00 0.00 H new ATOM 0 HB2 TYR A 128 8.476 0.199 -7.571 1.00 0.00 H new ATOM 0 HB3 TYR A 128 9.487 1.121 -6.475 1.00 0.00 H new ATOM 0 HD1 TYR A 128 8.263 3.468 -5.698 1.00 0.00 H new ATOM 0 HD2 TYR A 128 6.388 -0.262 -6.727 1.00 0.00 H new ATOM 0 HE1 TYR A 128 6.316 4.051 -4.266 1.00 0.00 H new ATOM 0 HE2 TYR A 128 4.415 0.348 -5.346 1.00 0.00 H new ATOM 0 HH TYR A 128 3.510 1.812 -3.984 1.00 0.00 H new ATOM 2012 N GLU A 129 11.474 2.364 -8.126 1.00 0.00 N ATOM 2013 CA GLU A 129 12.873 1.976 -8.214 1.00 0.00 C ATOM 2014 C GLU A 129 13.462 2.018 -6.801 1.00 0.00 C ATOM 2015 O GLU A 129 12.991 2.774 -5.947 1.00 0.00 O ATOM 2016 CB GLU A 129 13.618 2.850 -9.232 1.00 0.00 C ATOM 2017 CG GLU A 129 13.397 4.353 -9.026 1.00 0.00 C ATOM 2018 CD GLU A 129 14.130 5.198 -10.064 1.00 0.00 C ATOM 2019 OE1 GLU A 129 14.227 4.735 -11.223 1.00 0.00 O ATOM 2020 OE2 GLU A 129 14.555 6.309 -9.684 1.00 0.00 O ATOM 0 H GLU A 129 11.320 3.156 -7.502 1.00 0.00 H new ATOM 0 HA GLU A 129 12.981 0.959 -8.591 1.00 0.00 H new ATOM 0 HB2 GLU A 129 14.685 2.636 -9.170 1.00 0.00 H new ATOM 0 HB3 GLU A 129 13.296 2.578 -10.237 1.00 0.00 H new ATOM 0 HG2 GLU A 129 12.330 4.570 -9.073 1.00 0.00 H new ATOM 0 HG3 GLU A 129 13.736 4.634 -8.029 1.00 0.00 H new ATOM 2027 N LYS A 130 14.407 1.118 -6.517 1.00 0.00 N ATOM 2028 CA LYS A 130 14.863 0.854 -5.161 1.00 0.00 C ATOM 2029 C LYS A 130 15.891 1.906 -4.752 1.00 0.00 C ATOM 2030 O LYS A 130 16.974 1.948 -5.331 1.00 0.00 O ATOM 2031 CB LYS A 130 15.433 -0.571 -5.074 1.00 0.00 C ATOM 2032 CG LYS A 130 15.316 -1.121 -3.649 1.00 0.00 C ATOM 2033 CD LYS A 130 15.683 -2.610 -3.618 1.00 0.00 C ATOM 2034 CE LYS A 130 15.428 -3.173 -2.216 1.00 0.00 C ATOM 2035 NZ LYS A 130 15.633 -4.632 -2.145 1.00 0.00 N ATOM 0 H LYS A 130 14.875 0.554 -7.226 1.00 0.00 H new ATOM 0 HA LYS A 130 14.026 0.919 -4.465 1.00 0.00 H new ATOM 0 HB2 LYS A 130 14.899 -1.223 -5.765 1.00 0.00 H new ATOM 0 HB3 LYS A 130 16.479 -0.568 -5.382 1.00 0.00 H new ATOM 0 HG2 LYS A 130 15.974 -0.564 -2.982 1.00 0.00 H new ATOM 0 HG3 LYS A 130 14.299 -0.983 -3.282 1.00 0.00 H new ATOM 0 HD2 LYS A 130 15.092 -3.156 -4.353 1.00 0.00 H new ATOM 0 HD3 LYS A 130 16.730 -2.743 -3.889 1.00 0.00 H new ATOM 0 HE2 LYS A 130 16.092 -2.681 -1.505 1.00 0.00 H new ATOM 0 HE3 LYS A 130 14.407 -2.938 -1.914 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 15.448 -4.962 -1.176 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 14.982 -5.106 -2.803 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 16.614 -4.858 -2.406 1.00 0.00 H new ATOM 2049 N GLN A 131 15.572 2.744 -3.760 1.00 0.00 N ATOM 2050 CA GLN A 131 16.495 3.777 -3.301 1.00 0.00 C ATOM 2051 C GLN A 131 17.387 3.274 -2.165 1.00 0.00 C ATOM 2052 O GLN A 131 18.494 3.779 -1.996 1.00 0.00 O ATOM 2053 CB GLN A 131 15.767 5.090 -2.983 1.00 0.00 C ATOM 2054 CG GLN A 131 14.927 5.076 -1.704 1.00 0.00 C ATOM 2055 CD GLN A 131 14.204 6.408 -1.513 1.00 0.00 C ATOM 2056 OE1 GLN A 131 14.770 7.480 -1.726 1.00 0.00 O ATOM 2057 NE2 GLN A 131 12.928 6.368 -1.148 1.00 0.00 N ATOM 0 H GLN A 131 14.682 2.724 -3.263 1.00 0.00 H new ATOM 0 HA GLN A 131 17.172 4.011 -4.123 1.00 0.00 H new ATOM 0 HB2 GLN A 131 16.506 5.887 -2.904 1.00 0.00 H new ATOM 0 HB3 GLN A 131 15.118 5.339 -3.822 1.00 0.00 H new ATOM 0 HG2 GLN A 131 14.199 4.266 -1.751 1.00 0.00 H new ATOM 0 HG3 GLN A 131 15.568 4.879 -0.845 1.00 0.00 H new ATOM 0 HE21 GLN A 131 12.475 5.471 -0.976 1.00 0.00 H new ATOM 0 HE22 GLN A 131 12.401 7.235 -1.040 1.00 0.00 H new ATOM 2066 N ALA A 132 16.928 2.287 -1.384 1.00 0.00 N ATOM 2067 CA ALA A 132 17.754 1.663 -0.352 1.00 0.00 C ATOM 2068 C ALA A 132 17.222 0.278 0.003 1.00 0.00 C ATOM 2069 O ALA A 132 16.166 -0.131 -0.476 1.00 0.00 O ATOM 2070 CB ALA A 132 17.830 2.552 0.894 1.00 0.00 C ATOM 2071 OXT ALA A 132 17.933 -0.524 0.872 1.00 0.00 O ATOM 0 H ALA A 132 15.985 1.905 -1.451 1.00 0.00 H new ATOM 0 HA ALA A 132 18.763 1.547 -0.749 1.00 0.00 H new ATOM 0 HB1 ALA A 132 18.450 2.068 1.649 1.00 0.00 H new ATOM 0 HB2 ALA A 132 18.267 3.514 0.628 1.00 0.00 H new ATOM 0 HB3 ALA A 132 16.827 2.707 1.292 1.00 0.00 H new TER 2077 ALA A 132