USER MOD reduce.3.24.130724 H: found=0, std=0, add=828, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 828 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: B 6 LYS NZ :NH3+ -174:sc= 0.389 (180deg=0) USER MOD Set 1.2: B 68 HIS : no HE2:sc= 0.348 K(o=0.74,f=-3.1) USER MOD Set 2.1: A 33 SER OG : rot -69:sc= 0.24 USER MOD Set 2.2: B 55 THR OG1 : rot 116:sc= 0.507 USER MOD Set 2.3: B 57 SER OG : rot 180:sc= 0.467 USER MOD Set 3.1: B 1 MET CE :methyl 160:sc= 0 (180deg=-0.00481) USER MOD Set 3.2: B 19 SER OG : rot 180:sc= 0 USER MOD Set 4.1: B 7 THR OG1 : rot 110:sc= 1.05 USER MOD Set 4.2: B 9 THR OG1 : rot 180:sc= 0.896 USER MOD Set 5.1: A 31 MET CE :methyl 156:sc= -0.0187 (180deg=0) USER MOD Set 5.2: A 39 HIS : no HD1:sc= -4.08 K(o=-4.1,f=-2) USER MOD Set 6.1: A 23 TYR OH : rot 180:sc= 0 USER MOD Set 6.2: B 48 LYS NZ :NH3+ -165:sc= 0.316 (180deg=0.129) USER MOD Single : A 14 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 18 THR OG1 : rot -70:sc= 1.27 USER MOD Single : A 25 ASN : amide:sc= -3.19! C(o=-3.2!,f=-3.9!) USER MOD Single : A 28 THR OG1 : rot -26:sc= 0.854 USER MOD Single : A 29 ASN : amide:sc= 0 K(o=0,f=-0.79) USER MOD Single : A 32 CYS SG : rot -128:sc= 0.155 USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 43 GLN : amide:sc= -0.123 K(o=-0.12,f=-1.8!) USER MOD Single : A 44 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 45 ASN : amide:sc= -0.427 K(o=-0.43,f=-1.5!) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : B 1 MET N :NH3+ 178:sc= 1.59 (180deg=1.59) USER MOD Single : B 2 GLN : amide:sc= -2.02 K(o=-2,f=-0.0013) USER MOD Single : B 11 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00185) USER MOD Single : B 12 THR OG1 : rot 180:sc= 0 USER MOD Single : B 14 THR OG1 : rot -78:sc= 0.076 USER MOD Single : B 20 SER OG : rot 180:sc= 0.00338 USER MOD Single : B 22 THR OG1 : rot 180:sc= 0.234 USER MOD Single : B 25 ASN : amide:sc= -4.13! K(o=-4.1!,f=-0.13) USER MOD Single : B 27 LYS NZ :NH3+ -164:sc= 0.22 (180deg=0.172) USER MOD Single : B 28 SER OG : rot 180:sc= 0 USER MOD Single : B 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 31 GLN : amide:sc= -0.707 X(o=-0.71,f=-1) USER MOD Single : B 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 40 GLN : amide:sc= -1.71! K(o=-1.7!,f=-0.094) USER MOD Single : B 41 GLN : amide:sc= -2.04! C(o=-2!,f=-4!) USER MOD Single : B 49 GLN : amide:sc= -0.515 K(o=-0.51,f=-3.8!) USER MOD Single : B 59 TYR OH : rot 130:sc= 0.0213 USER MOD Single : B 60 ASN : amide:sc= -0.271 K(o=-0.27,f=-1.7!) USER MOD Single : B 62 GLN : amide:sc= -0.717 K(o=-0.72,f=0) USER MOD Single : B 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 65 SER OG : rot 92:sc= 0.59 USER MOD Single : B 66 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 12 7.109 -11.579 0.084 1.00 10.00 N ATOM 2 CA GLY A 12 8.522 -11.250 -0.060 1.00 10.00 C ATOM 3 C GLY A 12 8.752 -10.056 -0.977 1.00 10.00 C ATOM 4 O GLY A 12 8.901 -8.937 -0.487 1.00 10.00 O ATOM 0 HA2 GLY A 12 8.944 -11.036 0.922 1.00 10.00 H new ATOM 0 HA3 GLY A 12 9.055 -12.115 -0.455 1.00 10.00 H new ATOM 8 N PRO A 13 8.785 -10.255 -2.317 1.00 10.00 N ATOM 9 CA PRO A 13 9.002 -9.152 -3.258 1.00 10.00 C ATOM 10 C PRO A 13 7.807 -8.201 -3.315 1.00 10.00 C ATOM 11 O PRO A 13 7.002 -8.253 -4.248 1.00 10.00 O ATOM 12 CB PRO A 13 9.229 -9.852 -4.605 1.00 10.00 C ATOM 13 CG PRO A 13 8.580 -11.193 -4.472 1.00 10.00 C ATOM 14 CD PRO A 13 8.623 -11.555 -3.004 1.00 10.00 C ATOM 0 HA PRO A 13 9.842 -8.522 -2.965 1.00 10.00 H new ATOM 0 HB2 PRO A 13 8.788 -9.282 -5.423 1.00 10.00 H new ATOM 0 HB3 PRO A 13 10.293 -9.950 -4.822 1.00 10.00 H new ATOM 0 HG2 PRO A 13 7.552 -11.162 -4.833 1.00 10.00 H new ATOM 0 HG3 PRO A 13 9.106 -11.938 -5.070 1.00 10.00 H new ATOM 0 HD2 PRO A 13 7.709 -12.060 -2.691 1.00 10.00 H new ATOM 0 HD3 PRO A 13 9.451 -12.228 -2.783 1.00 10.00 H new ATOM 22 N MET A 14 7.707 -7.326 -2.308 1.00 10.00 N ATOM 23 CA MET A 14 6.612 -6.361 -2.236 1.00 10.00 C ATOM 24 C MET A 14 6.795 -5.270 -3.294 1.00 10.00 C ATOM 25 O MET A 14 7.310 -4.186 -3.006 1.00 10.00 O ATOM 26 CB MET A 14 6.544 -5.742 -0.832 1.00 10.00 C ATOM 27 CG MET A 14 5.852 -6.717 0.125 1.00 10.00 C ATOM 28 SD MET A 14 4.077 -6.759 -0.233 1.00 10.00 S ATOM 29 CE MET A 14 3.498 -6.947 1.470 1.00 10.00 C ATOM 0 H MET A 14 8.371 -7.269 -1.535 1.00 10.00 H new ATOM 0 HA MET A 14 5.674 -6.879 -2.434 1.00 10.00 H new ATOM 0 HB2 MET A 14 7.548 -5.516 -0.474 1.00 10.00 H new ATOM 0 HB3 MET A 14 5.998 -4.799 -0.865 1.00 10.00 H new ATOM 0 HG2 MET A 14 6.279 -7.714 0.017 1.00 10.00 H new ATOM 0 HG3 MET A 14 6.018 -6.409 1.157 1.00 10.00 H new ATOM 0 HE1 MET A 14 2.409 -6.995 1.481 1.00 10.00 H new ATOM 0 HE2 MET A 14 3.906 -7.865 1.894 1.00 10.00 H new ATOM 0 HE3 MET A 14 3.830 -6.095 2.063 1.00 10.00 H new ATOM 39 N LEU A 15 6.375 -5.577 -4.526 1.00 10.00 N ATOM 40 CA LEU A 15 6.497 -4.632 -5.635 1.00 10.00 C ATOM 41 C LEU A 15 5.447 -3.526 -5.508 1.00 10.00 C ATOM 42 O LEU A 15 4.336 -3.772 -5.042 1.00 10.00 O ATOM 43 CB LEU A 15 6.332 -5.385 -6.976 1.00 10.00 C ATOM 44 CG LEU A 15 7.560 -5.174 -7.878 1.00 10.00 C ATOM 45 CD1 LEU A 15 8.801 -5.804 -7.236 1.00 10.00 C ATOM 46 CD2 LEU A 15 7.304 -5.834 -9.234 1.00 10.00 C ATOM 0 H LEU A 15 5.950 -6.469 -4.777 1.00 10.00 H new ATOM 0 HA LEU A 15 7.484 -4.170 -5.606 1.00 10.00 H new ATOM 0 HB2 LEU A 15 6.194 -6.449 -6.786 1.00 10.00 H new ATOM 0 HB3 LEU A 15 5.436 -5.034 -7.487 1.00 10.00 H new ATOM 0 HG LEU A 15 7.730 -4.105 -8.008 1.00 10.00 H new ATOM 0 HD11 LEU A 15 9.664 -5.649 -7.883 1.00 10.00 H new ATOM 0 HD12 LEU A 15 8.985 -5.339 -6.267 1.00 10.00 H new ATOM 0 HD13 LEU A 15 8.637 -6.873 -7.100 1.00 10.00 H new ATOM 0 HD21 LEU A 15 8.171 -5.688 -9.879 1.00 10.00 H new ATOM 0 HD22 LEU A 15 7.132 -6.901 -9.093 1.00 10.00 H new ATOM 0 HD23 LEU A 15 6.427 -5.383 -9.698 1.00 10.00 H new ATOM 58 N CYS A 16 5.820 -2.302 -5.909 1.00 10.00 N ATOM 59 CA CYS A 16 4.926 -1.131 -5.823 1.00 10.00 C ATOM 60 C CYS A 16 3.487 -1.417 -6.290 1.00 10.00 C ATOM 61 O CYS A 16 3.263 -2.011 -7.343 1.00 10.00 O ATOM 62 CB CYS A 16 5.499 0.020 -6.651 1.00 10.00 C ATOM 63 SG CYS A 16 4.745 1.575 -6.113 1.00 10.00 S ATOM 0 H CYS A 16 6.739 -2.094 -6.299 1.00 10.00 H new ATOM 0 HA CYS A 16 4.872 -0.866 -4.767 1.00 10.00 H new ATOM 0 HB2 CYS A 16 6.581 0.066 -6.531 1.00 10.00 H new ATOM 0 HB3 CYS A 16 5.303 -0.146 -7.710 1.00 10.00 H new ATOM 68 N SER A 17 2.528 -0.981 -5.467 1.00 10.00 N ATOM 69 CA SER A 17 1.107 -1.182 -5.759 1.00 10.00 C ATOM 70 C SER A 17 0.679 -0.404 -7.006 1.00 10.00 C ATOM 71 O SER A 17 -0.201 -0.850 -7.744 1.00 10.00 O ATOM 72 CB SER A 17 0.261 -0.739 -4.563 1.00 10.00 C ATOM 73 OG SER A 17 0.661 -1.468 -3.412 1.00 10.00 O ATOM 0 H SER A 17 2.711 -0.487 -4.594 1.00 10.00 H new ATOM 0 HA SER A 17 0.950 -2.244 -5.948 1.00 10.00 H new ATOM 0 HB2 SER A 17 0.384 0.330 -4.392 1.00 10.00 H new ATOM 0 HB3 SER A 17 -0.796 -0.910 -4.767 1.00 10.00 H new ATOM 0 HG SER A 17 0.123 -1.186 -2.643 1.00 10.00 H new ATOM 79 N THR A 18 1.298 0.759 -7.230 1.00 10.00 N ATOM 80 CA THR A 18 0.955 1.587 -8.392 1.00 10.00 C ATOM 81 C THR A 18 1.472 0.985 -9.711 1.00 10.00 C ATOM 82 O THR A 18 1.047 1.415 -10.786 1.00 10.00 O ATOM 83 CB THR A 18 1.514 3.002 -8.216 1.00 10.00 C ATOM 84 OG1 THR A 18 2.920 2.939 -8.043 1.00 10.00 O ATOM 85 CG2 THR A 18 0.875 3.661 -6.989 1.00 10.00 C ATOM 0 H THR A 18 2.029 1.145 -6.632 1.00 10.00 H new ATOM 0 HA THR A 18 -0.133 1.624 -8.450 1.00 10.00 H new ATOM 0 HB THR A 18 1.284 3.593 -9.103 1.00 10.00 H new ATOM 0 HG1 THR A 18 3.125 2.551 -7.167 1.00 10.00 H new ATOM 0 HG21 THR A 18 1.275 4.668 -6.867 1.00 10.00 H new ATOM 0 HG22 THR A 18 -0.205 3.714 -7.126 1.00 10.00 H new ATOM 0 HG23 THR A 18 1.100 3.071 -6.101 1.00 10.00 H new ATOM 93 N GLY A 19 2.370 -0.013 -9.637 1.00 10.00 N ATOM 94 CA GLY A 19 2.898 -0.651 -10.845 1.00 10.00 C ATOM 95 C GLY A 19 3.918 0.236 -11.552 1.00 10.00 C ATOM 96 O GLY A 19 3.887 0.362 -12.778 1.00 10.00 O ATOM 0 H GLY A 19 2.739 -0.388 -8.763 1.00 10.00 H new ATOM 0 HA2 GLY A 19 3.363 -1.601 -10.581 1.00 10.00 H new ATOM 0 HA3 GLY A 19 2.077 -0.876 -11.526 1.00 10.00 H new ATOM 100 N CYS A 20 4.820 0.846 -10.787 1.00 10.00 N ATOM 101 CA CYS A 20 5.836 1.725 -11.364 1.00 10.00 C ATOM 102 C CYS A 20 7.021 0.931 -11.954 1.00 10.00 C ATOM 103 O CYS A 20 7.842 1.493 -12.676 1.00 10.00 O ATOM 104 CB CYS A 20 6.324 2.735 -10.309 1.00 10.00 C ATOM 105 SG CYS A 20 7.310 1.982 -9.003 1.00 10.00 S ATOM 0 H CYS A 20 4.869 0.750 -9.773 1.00 10.00 H new ATOM 0 HA CYS A 20 5.375 2.269 -12.189 1.00 10.00 H new ATOM 0 HB2 CYS A 20 6.915 3.507 -10.802 1.00 10.00 H new ATOM 0 HB3 CYS A 20 5.461 3.230 -9.864 1.00 10.00 H new ATOM 110 N GLY A 21 7.106 -0.379 -11.648 1.00 10.00 N ATOM 111 CA GLY A 21 8.189 -1.216 -12.183 1.00 10.00 C ATOM 112 C GLY A 21 9.375 -1.363 -11.218 1.00 10.00 C ATOM 113 O GLY A 21 10.386 -1.967 -11.579 1.00 10.00 O ATOM 0 H GLY A 21 6.448 -0.870 -11.043 1.00 10.00 H new ATOM 0 HA2 GLY A 21 7.794 -2.205 -12.416 1.00 10.00 H new ATOM 0 HA3 GLY A 21 8.543 -0.786 -13.120 1.00 10.00 H new ATOM 117 N PHE A 22 9.253 -0.819 -10.003 1.00 10.00 N ATOM 118 CA PHE A 22 10.328 -0.900 -9.013 1.00 10.00 C ATOM 119 C PHE A 22 9.847 -1.572 -7.738 1.00 10.00 C ATOM 120 O PHE A 22 8.681 -1.944 -7.632 1.00 10.00 O ATOM 121 CB PHE A 22 10.863 0.504 -8.731 1.00 10.00 C ATOM 122 CG PHE A 22 11.625 1.032 -9.918 1.00 10.00 C ATOM 123 CD1 PHE A 22 12.940 0.638 -10.130 1.00 10.00 C ATOM 124 CD2 PHE A 22 11.019 1.877 -10.838 1.00 10.00 C ATOM 125 CE1 PHE A 22 13.644 1.083 -11.236 1.00 10.00 C ATOM 126 CE2 PHE A 22 11.721 2.328 -11.947 1.00 10.00 C ATOM 127 CZ PHE A 22 13.035 1.928 -12.147 1.00 10.00 C ATOM 0 H PHE A 22 8.423 -0.320 -9.684 1.00 10.00 H new ATOM 0 HA PHE A 22 11.136 -1.513 -9.413 1.00 10.00 H new ATOM 0 HB2 PHE A 22 10.035 1.174 -8.497 1.00 10.00 H new ATOM 0 HB3 PHE A 22 11.513 0.482 -7.856 1.00 10.00 H new ATOM 0 HD1 PHE A 22 13.419 -0.024 -9.423 1.00 10.00 H new ATOM 0 HD2 PHE A 22 9.995 2.185 -10.690 1.00 10.00 H new ATOM 0 HE1 PHE A 22 14.667 0.771 -11.387 1.00 10.00 H new ATOM 0 HE2 PHE A 22 11.245 2.990 -12.655 1.00 10.00 H new ATOM 0 HZ PHE A 22 13.581 2.275 -13.012 1.00 10.00 H new ATOM 137 N TYR A 23 10.754 -1.728 -6.775 1.00 10.00 N ATOM 138 CA TYR A 23 10.419 -2.366 -5.511 1.00 10.00 C ATOM 139 C TYR A 23 9.890 -1.353 -4.495 1.00 10.00 C ATOM 140 O TYR A 23 10.287 -0.193 -4.509 1.00 10.00 O ATOM 141 CB TYR A 23 11.639 -3.085 -4.936 1.00 10.00 C ATOM 142 CG TYR A 23 11.962 -4.355 -5.683 1.00 10.00 C ATOM 143 CD1 TYR A 23 12.372 -4.297 -7.006 1.00 10.00 C ATOM 144 CD2 TYR A 23 11.834 -5.602 -5.081 1.00 10.00 C ATOM 145 CE1 TYR A 23 12.654 -5.445 -7.718 1.00 10.00 C ATOM 146 CE2 TYR A 23 12.113 -6.761 -5.787 1.00 10.00 C ATOM 147 CZ TYR A 23 12.523 -6.678 -7.109 1.00 10.00 C ATOM 148 OH TYR A 23 12.807 -7.832 -7.812 1.00 10.00 O ATOM 0 H TYR A 23 11.724 -1.421 -6.849 1.00 10.00 H new ATOM 0 HA TYR A 23 9.632 -3.093 -5.709 1.00 10.00 H new ATOM 0 HB2 TYR A 23 12.500 -2.418 -4.970 1.00 10.00 H new ATOM 0 HB3 TYR A 23 11.458 -3.319 -3.887 1.00 10.00 H new ATOM 0 HD1 TYR A 23 12.473 -3.336 -7.488 1.00 10.00 H new ATOM 0 HD2 TYR A 23 11.514 -5.668 -4.052 1.00 10.00 H new ATOM 0 HE1 TYR A 23 12.976 -5.380 -8.747 1.00 10.00 H new ATOM 0 HE2 TYR A 23 12.012 -7.725 -5.310 1.00 10.00 H new ATOM 0 HH TYR A 23 12.664 -8.611 -7.234 1.00 10.00 H new ATOM 158 N GLY A 24 8.987 -1.807 -3.621 1.00 10.00 N ATOM 159 CA GLY A 24 8.414 -0.940 -2.600 1.00 10.00 C ATOM 160 C GLY A 24 8.811 -1.377 -1.202 1.00 10.00 C ATOM 161 O GLY A 24 8.859 -2.573 -0.913 1.00 10.00 O ATOM 0 H GLY A 24 8.641 -2.766 -3.604 1.00 10.00 H new ATOM 0 HA2 GLY A 24 8.743 0.086 -2.767 1.00 10.00 H new ATOM 0 HA3 GLY A 24 7.328 -0.944 -2.687 1.00 10.00 H new ATOM 165 N ASN A 25 9.102 -0.413 -0.331 1.00 10.00 N ATOM 166 CA ASN A 25 9.496 -0.715 1.040 1.00 10.00 C ATOM 167 C ASN A 25 8.303 -1.224 1.849 1.00 10.00 C ATOM 168 O ASN A 25 7.295 -0.545 1.960 1.00 10.00 O ATOM 169 CB ASN A 25 10.051 0.530 1.725 1.00 10.00 C ATOM 170 CG ASN A 25 10.985 0.171 2.877 1.00 10.00 C ATOM 171 OD1 ASN A 25 11.594 -0.889 2.880 1.00 10.00 O ATOM 172 ND2 ASN A 25 11.120 1.050 3.865 1.00 10.00 N ATOM 0 H ASN A 25 9.072 0.582 -0.552 1.00 10.00 H new ATOM 0 HA ASN A 25 10.264 -1.487 0.998 1.00 10.00 H new ATOM 0 HB2 ASN A 25 10.588 1.137 0.997 1.00 10.00 H new ATOM 0 HB3 ASN A 25 9.227 1.137 2.100 1.00 10.00 H new ATOM 0 HD21 ASN A 25 11.742 0.846 4.647 1.00 10.00 H new ATOM 0 HD22 ASN A 25 10.602 1.928 3.841 1.00 10.00 H new ATOM 179 N PRO A 26 8.370 -2.434 2.437 1.00 10.00 N ATOM 180 CA PRO A 26 7.239 -2.979 3.253 1.00 10.00 C ATOM 181 C PRO A 26 7.021 -2.180 4.544 1.00 10.00 C ATOM 182 O PRO A 26 5.934 -2.229 5.125 1.00 10.00 O ATOM 183 CB PRO A 26 7.652 -4.416 3.547 1.00 10.00 C ATOM 184 CG PRO A 26 9.139 -4.417 3.460 1.00 10.00 C ATOM 185 CD PRO A 26 9.497 -3.393 2.389 1.00 10.00 C ATOM 0 HA PRO A 26 6.287 -2.916 2.726 1.00 10.00 H new ATOM 0 HB2 PRO A 26 7.315 -4.729 4.535 1.00 10.00 H new ATOM 0 HB3 PRO A 26 7.214 -5.107 2.827 1.00 10.00 H new ATOM 0 HG2 PRO A 26 9.586 -4.152 4.418 1.00 10.00 H new ATOM 0 HG3 PRO A 26 9.514 -5.406 3.196 1.00 10.00 H new ATOM 0 HD2 PRO A 26 10.448 -2.905 2.602 1.00 10.00 H new ATOM 0 HD3 PRO A 26 9.589 -3.855 1.406 1.00 10.00 H new ATOM 193 N ARG A 27 8.034 -1.411 4.967 1.00 10.00 N ATOM 194 CA ARG A 27 7.909 -0.573 6.164 1.00 10.00 C ATOM 195 C ARG A 27 7.056 0.662 5.843 1.00 10.00 C ATOM 196 O ARG A 27 6.322 1.159 6.698 1.00 10.00 O ATOM 197 CB ARG A 27 9.290 -0.115 6.638 1.00 10.00 C ATOM 198 CG ARG A 27 10.030 -1.286 7.288 1.00 10.00 C ATOM 199 CD ARG A 27 11.346 -0.788 7.898 1.00 10.00 C ATOM 200 NE ARG A 27 11.117 -0.251 9.248 1.00 10.00 N ATOM 201 CZ ARG A 27 12.094 0.309 9.988 1.00 10.00 C ATOM 202 NH1 ARG A 27 13.337 0.378 9.563 1.00 10.00 N ATOM 203 NH2 ARG A 27 11.802 0.792 11.165 1.00 10.00 N ATOM 0 H ARG A 27 8.940 -1.353 4.502 1.00 10.00 H new ATOM 0 HA ARG A 27 7.434 -1.159 6.951 1.00 10.00 H new ATOM 0 HB2 ARG A 27 9.865 0.268 5.795 1.00 10.00 H new ATOM 0 HB3 ARG A 27 9.187 0.703 7.351 1.00 10.00 H new ATOM 0 HG2 ARG A 27 9.408 -1.739 8.060 1.00 10.00 H new ATOM 0 HG3 ARG A 27 10.231 -2.059 6.546 1.00 10.00 H new ATOM 0 HD2 ARG A 27 12.065 -1.606 7.943 1.00 10.00 H new ATOM 0 HD3 ARG A 27 11.780 -0.016 7.262 1.00 10.00 H new ATOM 0 HE ARG A 27 10.177 -0.305 9.641 1.00 10.00 H new ATOM 0 HH11 ARG A 27 13.585 0.001 8.648 1.00 10.00 H new ATOM 0 HH12 ARG A 27 14.053 0.809 10.148 1.00 10.00 H new ATOM 0 HH21 ARG A 27 10.845 0.743 11.513 1.00 10.00 H new ATOM 0 HH22 ARG A 27 12.531 1.219 11.736 1.00 10.00 H new ATOM 217 N THR A 28 7.142 1.126 4.587 1.00 10.00 N ATOM 218 CA THR A 28 6.360 2.271 4.137 1.00 10.00 C ATOM 219 C THR A 28 4.925 1.788 3.841 1.00 10.00 C ATOM 220 O THR A 28 4.483 0.800 4.432 1.00 10.00 O ATOM 221 CB THR A 28 7.025 2.904 2.895 1.00 10.00 C ATOM 222 OG1 THR A 28 7.015 1.968 1.828 1.00 10.00 O ATOM 223 CG2 THR A 28 8.473 3.306 3.208 1.00 10.00 C ATOM 0 H THR A 28 7.746 0.722 3.871 1.00 10.00 H new ATOM 0 HA THR A 28 6.319 3.042 4.906 1.00 10.00 H new ATOM 0 HB THR A 28 6.466 3.796 2.612 1.00 10.00 H new ATOM 0 HG1 THR A 28 6.988 1.058 2.191 1.00 10.00 H new ATOM 0 HG21 THR A 28 8.927 3.750 2.322 1.00 10.00 H new ATOM 0 HG22 THR A 28 8.482 4.031 4.022 1.00 10.00 H new ATOM 0 HG23 THR A 28 9.040 2.423 3.502 1.00 10.00 H new ATOM 231 N ASN A 29 4.200 2.471 2.945 1.00 10.00 N ATOM 232 CA ASN A 29 2.829 2.080 2.609 1.00 10.00 C ATOM 233 C ASN A 29 2.782 1.085 1.438 1.00 10.00 C ATOM 234 O ASN A 29 1.790 1.035 0.708 1.00 10.00 O ATOM 235 CB ASN A 29 2.028 3.338 2.255 1.00 10.00 C ATOM 236 CG ASN A 29 1.560 4.030 3.531 1.00 10.00 C ATOM 237 OD1 ASN A 29 2.362 4.279 4.430 1.00 10.00 O ATOM 238 ND2 ASN A 29 0.307 4.355 3.665 1.00 10.00 N ATOM 0 H ASN A 29 4.540 3.292 2.444 1.00 10.00 H new ATOM 0 HA ASN A 29 2.395 1.580 3.475 1.00 10.00 H new ATOM 0 HB2 ASN A 29 2.644 4.018 1.667 1.00 10.00 H new ATOM 0 HB3 ASN A 29 1.169 3.072 1.639 1.00 10.00 H new ATOM 0 HD21 ASN A 29 -0.012 4.817 4.517 1.00 10.00 H new ATOM 0 HD22 ASN A 29 -0.356 4.148 2.918 1.00 10.00 H new ATOM 245 N GLY A 30 3.858 0.305 1.244 1.00 10.00 N ATOM 246 CA GLY A 30 3.913 -0.654 0.143 1.00 10.00 C ATOM 247 C GLY A 30 4.395 0.015 -1.154 1.00 10.00 C ATOM 248 O GLY A 30 4.298 -0.581 -2.229 1.00 10.00 O ATOM 0 H GLY A 30 4.691 0.323 1.832 1.00 10.00 H new ATOM 0 HA2 GLY A 30 4.584 -1.473 0.404 1.00 10.00 H new ATOM 0 HA3 GLY A 30 2.926 -1.088 -0.014 1.00 10.00 H new ATOM 252 N MET A 31 4.893 1.262 -1.055 1.00 10.00 N ATOM 253 CA MET A 31 5.354 1.999 -2.225 1.00 10.00 C ATOM 254 C MET A 31 6.822 2.405 -2.079 1.00 10.00 C ATOM 255 O MET A 31 7.371 2.415 -0.975 1.00 10.00 O ATOM 256 CB MET A 31 4.502 3.259 -2.393 1.00 10.00 C ATOM 257 CG MET A 31 3.232 2.934 -3.181 1.00 10.00 C ATOM 258 SD MET A 31 2.059 2.046 -2.128 1.00 10.00 S ATOM 259 CE MET A 31 0.574 2.975 -2.596 1.00 10.00 C ATOM 0 H MET A 31 4.982 1.771 -0.175 1.00 10.00 H new ATOM 0 HA MET A 31 5.258 1.353 -3.098 1.00 10.00 H new ATOM 0 HB2 MET A 31 4.239 3.663 -1.415 1.00 10.00 H new ATOM 0 HB3 MET A 31 5.074 4.028 -2.912 1.00 10.00 H new ATOM 0 HG2 MET A 31 2.778 3.854 -3.550 1.00 10.00 H new ATOM 0 HG3 MET A 31 3.480 2.329 -4.053 1.00 10.00 H new ATOM 0 HE1 MET A 31 -0.310 2.363 -2.417 1.00 10.00 H new ATOM 0 HE2 MET A 31 0.512 3.886 -2.000 1.00 10.00 H new ATOM 0 HE3 MET A 31 0.626 3.236 -3.653 1.00 10.00 H new ATOM 269 N CYS A 32 7.445 2.733 -3.208 1.00 10.00 N ATOM 270 CA CYS A 32 8.842 3.148 -3.226 1.00 10.00 C ATOM 271 C CYS A 32 8.970 4.575 -2.670 1.00 10.00 C ATOM 272 O CYS A 32 7.994 5.140 -2.188 1.00 10.00 O ATOM 273 CB CYS A 32 9.388 3.032 -4.661 1.00 10.00 C ATOM 274 SG CYS A 32 8.529 4.090 -5.839 1.00 10.00 S ATOM 0 H CYS A 32 7.000 2.719 -4.126 1.00 10.00 H new ATOM 0 HA CYS A 32 9.438 2.497 -2.587 1.00 10.00 H new ATOM 0 HB2 CYS A 32 10.448 3.286 -4.661 1.00 10.00 H new ATOM 0 HB3 CYS A 32 9.309 1.996 -4.989 1.00 10.00 H new ATOM 0 HG CYS A 32 8.145 3.381 -6.859 1.00 10.00 H new ATOM 279 N SER A 33 10.164 5.159 -2.727 1.00 10.00 N ATOM 280 CA SER A 33 10.384 6.512 -2.189 1.00 10.00 C ATOM 281 C SER A 33 9.787 7.612 -3.072 1.00 10.00 C ATOM 282 O SER A 33 9.516 8.717 -2.600 1.00 10.00 O ATOM 283 CB SER A 33 11.882 6.767 -2.015 1.00 10.00 C ATOM 284 OG SER A 33 12.532 6.723 -3.254 1.00 10.00 O ATOM 0 H SER A 33 10.992 4.726 -3.136 1.00 10.00 H new ATOM 0 HA SER A 33 9.873 6.551 -1.227 1.00 10.00 H new ATOM 0 HB2 SER A 33 12.040 7.739 -1.549 1.00 10.00 H new ATOM 0 HB3 SER A 33 12.309 6.020 -1.346 1.00 10.00 H new ATOM 0 HG SER A 33 12.527 5.804 -3.594 1.00 10.00 H new ATOM 290 N VAL A 34 9.573 7.300 -4.347 1.00 10.00 N ATOM 291 CA VAL A 34 9.042 8.269 -5.304 1.00 10.00 C ATOM 292 C VAL A 34 7.511 8.392 -5.235 1.00 10.00 C ATOM 293 O VAL A 34 6.974 9.500 -5.247 1.00 10.00 O ATOM 294 CB VAL A 34 9.461 7.902 -6.744 1.00 10.00 C ATOM 295 CG1 VAL A 34 9.118 9.040 -7.701 1.00 10.00 C ATOM 296 CG2 VAL A 34 10.957 7.592 -6.807 1.00 10.00 C ATOM 0 H VAL A 34 9.760 6.379 -4.744 1.00 10.00 H new ATOM 0 HA VAL A 34 9.467 9.235 -5.030 1.00 10.00 H new ATOM 0 HB VAL A 34 8.911 7.011 -7.046 1.00 10.00 H new ATOM 0 HG11 VAL A 34 9.419 8.768 -8.713 1.00 10.00 H new ATOM 0 HG12 VAL A 34 8.044 9.223 -7.679 1.00 10.00 H new ATOM 0 HG13 VAL A 34 9.646 9.943 -7.396 1.00 10.00 H new ATOM 0 HG21 VAL A 34 11.233 7.336 -7.830 1.00 10.00 H new ATOM 0 HG22 VAL A 34 11.524 8.466 -6.487 1.00 10.00 H new ATOM 0 HG23 VAL A 34 11.183 6.753 -6.149 1.00 10.00 H new ATOM 306 N CYS A 35 6.827 7.260 -5.153 1.00 10.00 N ATOM 307 CA CYS A 35 5.365 7.232 -5.096 1.00 10.00 C ATOM 308 C CYS A 35 4.826 7.471 -3.686 1.00 10.00 C ATOM 309 O CYS A 35 3.719 7.984 -3.525 1.00 10.00 O ATOM 310 CB CYS A 35 4.868 5.893 -5.624 1.00 10.00 C ATOM 311 SG CYS A 35 5.354 5.613 -7.337 1.00 10.00 S ATOM 0 H CYS A 35 7.263 6.338 -5.124 1.00 10.00 H new ATOM 0 HA CYS A 35 4.994 8.047 -5.718 1.00 10.00 H new ATOM 0 HB2 CYS A 35 5.262 5.090 -5.001 1.00 10.00 H new ATOM 0 HB3 CYS A 35 3.782 5.854 -5.545 1.00 10.00 H new ATOM 316 N TYR A 36 5.624 7.125 -2.677 1.00 10.00 N ATOM 317 CA TYR A 36 5.220 7.293 -1.273 1.00 10.00 C ATOM 318 C TYR A 36 4.915 8.759 -0.928 1.00 10.00 C ATOM 319 O TYR A 36 3.878 9.048 -0.329 1.00 10.00 O ATOM 320 CB TYR A 36 6.321 6.727 -0.346 1.00 10.00 C ATOM 321 CG TYR A 36 5.970 6.874 1.133 1.00 10.00 C ATOM 322 CD1 TYR A 36 4.669 6.607 1.600 1.00 10.00 C ATOM 323 CD2 TYR A 36 6.962 7.266 2.037 1.00 10.00 C ATOM 324 CE1 TYR A 36 4.373 6.735 2.962 1.00 10.00 C ATOM 325 CE2 TYR A 36 6.664 7.396 3.399 1.00 10.00 C ATOM 326 CZ TYR A 36 5.371 7.130 3.862 1.00 10.00 C ATOM 327 OH TYR A 36 5.079 7.254 5.204 1.00 10.00 O ATOM 0 H TYR A 36 6.555 6.726 -2.801 1.00 10.00 H new ATOM 0 HA TYR A 36 4.295 6.737 -1.120 1.00 10.00 H new ATOM 0 HB2 TYR A 36 6.479 5.673 -0.576 1.00 10.00 H new ATOM 0 HB3 TYR A 36 7.261 7.242 -0.546 1.00 10.00 H new ATOM 0 HD1 TYR A 36 3.899 6.303 0.907 1.00 10.00 H new ATOM 0 HD2 TYR A 36 7.962 7.469 1.683 1.00 10.00 H new ATOM 0 HE1 TYR A 36 3.375 6.529 3.319 1.00 10.00 H new ATOM 0 HE2 TYR A 36 7.433 7.702 4.093 1.00 10.00 H new ATOM 0 HH TYR A 36 5.883 7.535 5.689 1.00 10.00 H new ATOM 337 N LYS A 37 5.814 9.671 -1.301 1.00 10.00 N ATOM 338 CA LYS A 37 5.612 11.089 -1.004 1.00 10.00 C ATOM 339 C LYS A 37 4.511 11.658 -1.894 1.00 10.00 C ATOM 340 O LYS A 37 3.653 12.409 -1.429 1.00 10.00 O ATOM 341 CB LYS A 37 6.920 11.888 -1.172 1.00 10.00 C ATOM 342 CG LYS A 37 7.449 11.792 -2.607 1.00 10.00 C ATOM 343 CD LYS A 37 8.760 12.570 -2.721 1.00 10.00 C ATOM 344 CE LYS A 37 9.130 12.726 -4.196 1.00 10.00 C ATOM 345 NZ LYS A 37 10.540 13.193 -4.306 1.00 10.00 N ATOM 0 H LYS A 37 6.677 9.458 -1.802 1.00 10.00 H new ATOM 0 HA LYS A 37 5.304 11.180 0.038 1.00 10.00 H new ATOM 0 HB2 LYS A 37 6.746 12.933 -0.915 1.00 10.00 H new ATOM 0 HB3 LYS A 37 7.671 11.510 -0.479 1.00 10.00 H new ATOM 0 HG2 LYS A 37 7.609 10.748 -2.878 1.00 10.00 H new ATOM 0 HG3 LYS A 37 6.714 12.194 -3.304 1.00 10.00 H new ATOM 0 HD2 LYS A 37 8.656 13.550 -2.255 1.00 10.00 H new ATOM 0 HD3 LYS A 37 9.554 12.046 -2.189 1.00 10.00 H new ATOM 0 HE2 LYS A 37 9.009 11.775 -4.715 1.00 10.00 H new ATOM 0 HE3 LYS A 37 8.461 13.439 -4.677 1.00 10.00 H new ATOM 0 HZ1 LYS A 37 10.793 13.300 -5.309 1.00 10.00 H new ATOM 0 HZ2 LYS A 37 10.641 14.109 -3.824 1.00 10.00 H new ATOM 0 HZ3 LYS A 37 11.172 12.497 -3.862 1.00 10.00 H new ATOM 359 N GLU A 38 4.560 11.304 -3.180 1.00 10.00 N ATOM 360 CA GLU A 38 3.579 11.788 -4.157 1.00 10.00 C ATOM 361 C GLU A 38 2.140 11.493 -3.726 1.00 10.00 C ATOM 362 O GLU A 38 1.252 12.326 -3.924 1.00 10.00 O ATOM 363 CB GLU A 38 3.842 11.139 -5.520 1.00 10.00 C ATOM 364 CG GLU A 38 4.991 11.866 -6.222 1.00 10.00 C ATOM 365 CD GLU A 38 4.488 13.174 -6.821 1.00 10.00 C ATOM 366 OE1 GLU A 38 3.457 13.147 -7.470 1.00 10.00 O ATOM 367 OE2 GLU A 38 5.142 14.183 -6.620 1.00 10.00 O ATOM 0 H GLU A 38 5.269 10.683 -3.571 1.00 10.00 H new ATOM 0 HA GLU A 38 3.693 12.870 -4.224 1.00 10.00 H new ATOM 0 HB2 GLU A 38 4.090 10.086 -5.391 1.00 10.00 H new ATOM 0 HB3 GLU A 38 2.942 11.182 -6.134 1.00 10.00 H new ATOM 0 HG2 GLU A 38 5.794 12.066 -5.512 1.00 10.00 H new ATOM 0 HG3 GLU A 38 5.408 11.234 -7.006 1.00 10.00 H new ATOM 374 N HIS A 39 1.908 10.304 -3.148 1.00 10.00 N ATOM 375 CA HIS A 39 0.553 9.939 -2.718 1.00 10.00 C ATOM 376 C HIS A 39 0.240 10.473 -1.310 1.00 10.00 C ATOM 377 O HIS A 39 -0.905 10.820 -1.013 1.00 10.00 O ATOM 378 CB HIS A 39 0.321 8.407 -2.844 1.00 10.00 C ATOM 379 CG HIS A 39 0.905 7.596 -1.701 1.00 10.00 C ATOM 380 ND1 HIS A 39 1.710 6.491 -1.931 1.00 10.00 N ATOM 381 CD2 HIS A 39 0.747 7.658 -0.335 1.00 10.00 C ATOM 382 CE1 HIS A 39 1.993 5.936 -0.737 1.00 10.00 C ATOM 383 NE2 HIS A 39 1.432 6.611 0.269 1.00 10.00 N ATOM 0 H HIS A 39 2.622 9.597 -2.972 1.00 10.00 H new ATOM 0 HA HIS A 39 -0.155 10.423 -3.390 1.00 10.00 H new ATOM 0 HB2 HIS A 39 -0.751 8.216 -2.901 1.00 10.00 H new ATOM 0 HB3 HIS A 39 0.756 8.060 -3.781 1.00 10.00 H new ATOM 0 HD2 HIS A 39 0.175 8.409 0.190 1.00 10.00 H new ATOM 0 HE1 HIS A 39 2.600 5.052 -0.609 1.00 10.00 H new ATOM 0 HE2 HIS A 39 1.493 6.403 1.266 1.00 10.00 H new ATOM 392 N LEU A 40 1.264 10.528 -0.456 1.00 10.00 N ATOM 393 CA LEU A 40 1.098 11.015 0.923 1.00 10.00 C ATOM 394 C LEU A 40 0.649 12.481 0.951 1.00 10.00 C ATOM 395 O LEU A 40 -0.052 12.903 1.874 1.00 10.00 O ATOM 396 CB LEU A 40 2.422 10.871 1.686 1.00 10.00 C ATOM 397 CG LEU A 40 2.182 11.044 3.186 1.00 10.00 C ATOM 398 CD1 LEU A 40 1.519 9.781 3.745 1.00 10.00 C ATOM 399 CD2 LEU A 40 3.524 11.275 3.895 1.00 10.00 C ATOM 0 H LEU A 40 2.215 10.243 -0.690 1.00 10.00 H new ATOM 0 HA LEU A 40 0.325 10.413 1.401 1.00 10.00 H new ATOM 0 HB2 LEU A 40 2.860 9.892 1.490 1.00 10.00 H new ATOM 0 HB3 LEU A 40 3.136 11.616 1.335 1.00 10.00 H new ATOM 0 HG LEU A 40 1.530 11.901 3.354 1.00 10.00 H new ATOM 0 HD11 LEU A 40 1.347 9.903 4.814 1.00 10.00 H new ATOM 0 HD12 LEU A 40 0.567 9.617 3.241 1.00 10.00 H new ATOM 0 HD13 LEU A 40 2.171 8.923 3.578 1.00 10.00 H new ATOM 0 HD21 LEU A 40 3.354 11.398 4.965 1.00 10.00 H new ATOM 0 HD22 LEU A 40 4.176 10.418 3.728 1.00 10.00 H new ATOM 0 HD23 LEU A 40 3.996 12.173 3.497 1.00 10.00 H new ATOM 411 N GLN A 41 1.064 13.247 -0.058 1.00 10.00 N ATOM 412 CA GLN A 41 0.711 14.668 -0.141 1.00 10.00 C ATOM 413 C GLN A 41 -0.795 14.857 -0.349 1.00 10.00 C ATOM 414 O GLN A 41 -1.394 15.769 0.230 1.00 10.00 O ATOM 415 CB GLN A 41 1.487 15.316 -1.298 1.00 10.00 C ATOM 416 CG GLN A 41 2.833 15.840 -0.789 1.00 10.00 C ATOM 417 CD GLN A 41 3.650 16.392 -1.950 1.00 10.00 C ATOM 418 OE1 GLN A 41 4.371 15.646 -2.615 1.00 10.00 O ATOM 419 NE2 GLN A 41 3.584 17.664 -2.233 1.00 10.00 N ATOM 0 H GLN A 41 1.643 12.911 -0.828 1.00 10.00 H new ATOM 0 HA GLN A 41 0.979 15.147 0.800 1.00 10.00 H new ATOM 0 HB2 GLN A 41 1.647 14.588 -2.094 1.00 10.00 H new ATOM 0 HB3 GLN A 41 0.906 16.133 -1.725 1.00 10.00 H new ATOM 0 HG2 GLN A 41 2.671 16.619 -0.045 1.00 10.00 H new ATOM 0 HG3 GLN A 41 3.382 15.038 -0.296 1.00 10.00 H new ATOM 0 HE21 GLN A 41 2.986 18.279 -1.681 1.00 10.00 H new ATOM 0 HE22 GLN A 41 4.130 18.043 -3.006 1.00 10.00 H new ATOM 428 N ARG A 42 -1.398 13.997 -1.171 1.00 10.00 N ATOM 429 CA ARG A 42 -2.837 14.080 -1.446 1.00 10.00 C ATOM 430 C ARG A 42 -3.655 13.470 -0.309 1.00 10.00 C ATOM 431 O ARG A 42 -4.776 13.906 -0.042 1.00 10.00 O ATOM 432 CB ARG A 42 -3.161 13.351 -2.749 1.00 10.00 C ATOM 433 CG ARG A 42 -2.624 14.163 -3.926 1.00 10.00 C ATOM 434 CD ARG A 42 -2.622 13.294 -5.185 1.00 10.00 C ATOM 435 NE ARG A 42 -1.891 13.967 -6.263 1.00 10.00 N ATOM 436 CZ ARG A 42 -2.367 15.052 -6.903 1.00 10.00 C ATOM 437 NH1 ARG A 42 -3.543 15.566 -6.622 1.00 10.00 N ATOM 438 NH2 ARG A 42 -1.644 15.603 -7.839 1.00 10.00 N ATOM 0 H ARG A 42 -0.918 13.239 -1.656 1.00 10.00 H new ATOM 0 HA ARG A 42 -3.100 15.134 -1.535 1.00 10.00 H new ATOM 0 HB2 ARG A 42 -2.715 12.357 -2.744 1.00 10.00 H new ATOM 0 HB3 ARG A 42 -4.238 13.216 -2.846 1.00 10.00 H new ATOM 0 HG2 ARG A 42 -3.241 15.048 -4.083 1.00 10.00 H new ATOM 0 HG3 ARG A 42 -1.614 14.512 -3.710 1.00 10.00 H new ATOM 0 HD2 ARG A 42 -2.161 12.330 -4.970 1.00 10.00 H new ATOM 0 HD3 ARG A 42 -3.646 13.094 -5.500 1.00 10.00 H new ATOM 0 HE ARG A 42 -0.982 13.597 -6.540 1.00 10.00 H new ATOM 0 HH11 ARG A 42 -4.125 15.142 -5.900 1.00 10.00 H new ATOM 0 HH12 ARG A 42 -3.874 16.389 -7.126 1.00 10.00 H new ATOM 0 HH21 ARG A 42 -0.733 15.211 -8.076 1.00 10.00 H new ATOM 0 HH22 ARG A 42 -1.990 16.425 -8.333 1.00 10.00 H new ATOM 452 N GLN A 43 -3.084 12.467 0.360 1.00 10.00 N ATOM 453 CA GLN A 43 -3.759 11.807 1.471 1.00 10.00 C ATOM 454 C GLN A 43 -3.715 12.698 2.714 1.00 10.00 C ATOM 455 O GLN A 43 -4.678 12.759 3.481 1.00 10.00 O ATOM 456 CB GLN A 43 -3.079 10.469 1.764 1.00 10.00 C ATOM 457 CG GLN A 43 -4.058 9.522 2.461 1.00 10.00 C ATOM 458 CD GLN A 43 -4.887 8.755 1.431 1.00 10.00 C ATOM 459 OE1 GLN A 43 -4.422 8.490 0.322 1.00 10.00 O ATOM 460 NE2 GLN A 43 -6.099 8.378 1.740 1.00 10.00 N ATOM 0 H GLN A 43 -2.157 12.097 0.150 1.00 10.00 H new ATOM 0 HA GLN A 43 -4.800 11.629 1.202 1.00 10.00 H new ATOM 0 HB2 GLN A 43 -2.726 10.021 0.835 1.00 10.00 H new ATOM 0 HB3 GLN A 43 -2.204 10.628 2.394 1.00 10.00 H new ATOM 0 HG2 GLN A 43 -3.509 8.821 3.090 1.00 10.00 H new ATOM 0 HG3 GLN A 43 -4.718 10.090 3.117 1.00 10.00 H new ATOM 0 HE21 GLN A 43 -6.483 8.598 2.659 1.00 10.00 H new ATOM 0 HE22 GLN A 43 -6.661 7.863 1.062 1.00 10.00 H new ATOM 469 N GLN A 44 -2.586 13.386 2.903 1.00 10.00 N ATOM 470 CA GLN A 44 -2.408 14.273 4.054 1.00 10.00 C ATOM 471 C GLN A 44 -3.224 15.555 3.887 1.00 10.00 C ATOM 472 O GLN A 44 -3.820 16.047 4.850 1.00 10.00 O ATOM 473 CB GLN A 44 -0.930 14.632 4.215 1.00 10.00 C ATOM 474 CG GLN A 44 -0.680 15.111 5.645 1.00 10.00 C ATOM 475 CD GLN A 44 0.816 15.206 5.910 1.00 10.00 C ATOM 476 OE1 GLN A 44 1.340 14.514 6.785 1.00 10.00 O ATOM 477 NE2 GLN A 44 1.543 16.028 5.205 1.00 10.00 N ATOM 0 H GLN A 44 -1.783 13.346 2.275 1.00 10.00 H new ATOM 0 HA GLN A 44 -2.758 13.747 4.943 1.00 10.00 H new ATOM 0 HB2 GLN A 44 -0.307 13.765 3.995 1.00 10.00 H new ATOM 0 HB3 GLN A 44 -0.654 15.411 3.505 1.00 10.00 H new ATOM 0 HG2 GLN A 44 -1.147 16.084 5.798 1.00 10.00 H new ATOM 0 HG3 GLN A 44 -1.140 14.422 6.353 1.00 10.00 H new ATOM 0 HE21 GLN A 44 1.109 16.600 4.481 1.00 10.00 H new ATOM 0 HE22 GLN A 44 2.546 16.098 5.378 1.00 10.00 H new ATOM 486 N ASN A 45 -3.240 16.093 2.665 1.00 10.00 N ATOM 487 CA ASN A 45 -3.982 17.325 2.382 1.00 10.00 C ATOM 488 C ASN A 45 -5.488 17.098 2.524 1.00 10.00 C ATOM 489 O ASN A 45 -6.199 17.938 3.077 1.00 10.00 O ATOM 490 CB ASN A 45 -3.668 17.811 0.960 1.00 10.00 C ATOM 491 CG ASN A 45 -2.359 18.601 0.950 1.00 10.00 C ATOM 492 OD1 ASN A 45 -2.052 19.306 1.911 1.00 10.00 O ATOM 493 ND2 ASN A 45 -1.568 18.524 -0.086 1.00 10.00 N ATOM 0 H ASN A 45 -2.752 15.699 1.861 1.00 10.00 H new ATOM 0 HA ASN A 45 -3.674 18.082 3.103 1.00 10.00 H new ATOM 0 HB2 ASN A 45 -3.592 16.959 0.285 1.00 10.00 H new ATOM 0 HB3 ASN A 45 -4.482 18.437 0.593 1.00 10.00 H new ATOM 0 HD21 ASN A 45 -0.693 19.049 -0.100 1.00 10.00 H new ATOM 0 HD22 ASN A 45 -1.825 17.939 -0.881 1.00 10.00 H new ATOM 500 N SER A 46 -5.962 15.957 2.015 1.00 10.00 N ATOM 501 CA SER A 46 -7.385 15.626 2.084 1.00 10.00 C ATOM 502 C SER A 46 -7.778 15.207 3.499 1.00 10.00 C ATOM 503 O SER A 46 -8.588 15.876 4.146 1.00 10.00 O ATOM 504 CB SER A 46 -7.706 14.493 1.108 1.00 10.00 C ATOM 505 OG SER A 46 -9.088 14.534 0.778 1.00 10.00 O ATOM 0 H SER A 46 -5.385 15.253 1.554 1.00 10.00 H new ATOM 0 HA SER A 46 -7.955 16.515 1.812 1.00 10.00 H new ATOM 0 HB2 SER A 46 -7.102 14.593 0.206 1.00 10.00 H new ATOM 0 HB3 SER A 46 -7.456 13.531 1.555 1.00 10.00 H new ATOM 0 HG SER A 46 -9.296 13.810 0.151 1.00 10.00 H new TER 511 SER A 46 ATOM 512 N MET B 1 23.469 0.622 9.148 1.00 10.00 N ATOM 513 CA MET B 1 23.717 -0.777 8.749 1.00 10.00 C ATOM 514 C MET B 1 24.919 -0.847 7.788 1.00 10.00 C ATOM 515 O MET B 1 25.167 0.059 7.001 1.00 10.00 O ATOM 516 CB MET B 1 22.461 -1.353 8.073 1.00 10.00 C ATOM 517 CG MET B 1 22.133 -0.712 6.716 1.00 10.00 C ATOM 518 SD MET B 1 20.645 -1.389 5.899 1.00 10.00 S ATOM 519 CE MET B 1 20.879 -0.717 4.270 1.00 10.00 C ATOM 0 H1 MET B 1 22.636 0.663 9.769 1.00 10.00 H new ATOM 0 H2 MET B 1 24.298 0.990 9.656 1.00 10.00 H new ATOM 0 H3 MET B 1 23.298 1.200 8.300 1.00 10.00 H new ATOM 0 HA MET B 1 23.946 -1.368 9.636 1.00 10.00 H new ATOM 0 HB2 MET B 1 22.595 -2.426 7.934 1.00 10.00 H new ATOM 0 HB3 MET B 1 21.609 -1.222 8.740 1.00 10.00 H new ATOM 0 HG2 MET B 1 21.998 0.360 6.858 1.00 10.00 H new ATOM 0 HG3 MET B 1 22.987 -0.841 6.051 1.00 10.00 H new ATOM 0 HE1 MET B 1 20.290 -1.289 3.553 1.00 10.00 H new ATOM 0 HE2 MET B 1 20.557 0.324 4.256 1.00 10.00 H new ATOM 0 HE3 MET B 1 21.934 -0.774 4.001 1.00 10.00 H new ATOM 531 N GLN B 2 25.658 -1.954 7.883 1.00 10.00 N ATOM 532 CA GLN B 2 26.761 -2.161 6.945 1.00 10.00 C ATOM 533 C GLN B 2 26.296 -3.047 5.787 1.00 10.00 C ATOM 534 O GLN B 2 25.448 -3.919 5.938 1.00 10.00 O ATOM 535 CB GLN B 2 27.966 -2.773 7.659 1.00 10.00 C ATOM 536 CG GLN B 2 27.851 -4.286 7.897 1.00 10.00 C ATOM 537 CD GLN B 2 29.096 -4.891 8.548 1.00 10.00 C ATOM 538 OE1 GLN B 2 29.059 -5.965 9.123 1.00 10.00 O ATOM 539 NE2 GLN B 2 30.221 -4.226 8.425 1.00 10.00 N ATOM 0 H GLN B 2 25.521 -2.694 8.571 1.00 10.00 H new ATOM 0 HA GLN B 2 27.071 -1.198 6.540 1.00 10.00 H new ATOM 0 HB2 GLN B 2 28.862 -2.576 7.071 1.00 10.00 H new ATOM 0 HB3 GLN B 2 28.098 -2.274 8.619 1.00 10.00 H new ATOM 0 HG2 GLN B 2 26.986 -4.483 8.530 1.00 10.00 H new ATOM 0 HG3 GLN B 2 27.669 -4.784 6.945 1.00 10.00 H new ATOM 0 HE21 GLN B 2 30.233 -3.329 7.940 1.00 10.00 H new ATOM 0 HE22 GLN B 2 31.084 -4.607 8.814 1.00 10.00 H new ATOM 548 N ILE B 3 26.867 -2.736 4.625 1.00 10.00 N ATOM 549 CA ILE B 3 26.690 -3.573 3.434 1.00 10.00 C ATOM 550 C ILE B 3 28.077 -3.709 2.779 1.00 10.00 C ATOM 551 O ILE B 3 28.953 -2.872 2.977 1.00 10.00 O ATOM 552 CB ILE B 3 25.600 -3.063 2.459 1.00 10.00 C ATOM 553 CG1 ILE B 3 26.045 -1.964 1.477 1.00 10.00 C ATOM 554 CG2 ILE B 3 24.281 -2.710 3.172 1.00 10.00 C ATOM 555 CD1 ILE B 3 26.454 -0.630 2.096 1.00 10.00 C ATOM 0 H ILE B 3 27.454 -1.915 4.480 1.00 10.00 H new ATOM 0 HA ILE B 3 26.307 -4.551 3.726 1.00 10.00 H new ATOM 0 HB ILE B 3 25.408 -3.925 1.820 1.00 10.00 H new ATOM 0 HG12 ILE B 3 26.886 -2.344 0.896 1.00 10.00 H new ATOM 0 HG13 ILE B 3 25.230 -1.781 0.776 1.00 10.00 H new ATOM 0 HG21 ILE B 3 23.554 -2.358 2.440 1.00 10.00 H new ATOM 0 HG22 ILE B 3 23.891 -3.595 3.674 1.00 10.00 H new ATOM 0 HG23 ILE B 3 24.463 -1.926 3.907 1.00 10.00 H new ATOM 0 HD11 ILE B 3 26.747 0.063 1.307 1.00 10.00 H new ATOM 0 HD12 ILE B 3 25.613 -0.213 2.651 1.00 10.00 H new ATOM 0 HD13 ILE B 3 27.294 -0.785 2.773 1.00 10.00 H new ATOM 567 N PHE B 4 28.199 -4.745 1.957 1.00 10.00 N ATOM 568 CA PHE B 4 29.485 -5.047 1.310 1.00 10.00 C ATOM 569 C PHE B 4 29.378 -4.812 -0.197 1.00 10.00 C ATOM 570 O PHE B 4 28.333 -5.019 -0.798 1.00 10.00 O ATOM 571 CB PHE B 4 29.862 -6.502 1.602 1.00 10.00 C ATOM 572 CG PHE B 4 29.755 -6.817 3.097 1.00 10.00 C ATOM 573 CD1 PHE B 4 30.729 -6.365 3.982 1.00 10.00 C ATOM 574 CD2 PHE B 4 28.644 -7.500 3.570 1.00 10.00 C ATOM 575 CE1 PHE B 4 30.589 -6.612 5.340 1.00 10.00 C ATOM 576 CE2 PHE B 4 28.508 -7.750 4.929 1.00 10.00 C ATOM 577 CZ PHE B 4 29.482 -7.307 5.815 1.00 10.00 C ATOM 0 H PHE B 4 27.441 -5.385 1.721 1.00 10.00 H new ATOM 0 HA PHE B 4 30.260 -4.390 1.704 1.00 10.00 H new ATOM 0 HB2 PHE B 4 29.208 -7.169 1.040 1.00 10.00 H new ATOM 0 HB3 PHE B 4 30.880 -6.691 1.260 1.00 10.00 H new ATOM 0 HD1 PHE B 4 31.589 -5.825 3.614 1.00 10.00 H new ATOM 0 HD2 PHE B 4 27.884 -7.838 2.881 1.00 10.00 H new ATOM 0 HE1 PHE B 4 31.342 -6.263 6.031 1.00 10.00 H new ATOM 0 HE2 PHE B 4 27.647 -8.288 5.297 1.00 10.00 H new ATOM 0 HZ PHE B 4 29.380 -7.502 6.872 1.00 10.00 H new ATOM 587 N VAL B 5 30.439 -4.232 -0.744 1.00 10.00 N ATOM 588 CA VAL B 5 30.552 -3.967 -2.189 1.00 10.00 C ATOM 589 C VAL B 5 31.805 -4.689 -2.691 1.00 10.00 C ATOM 590 O VAL B 5 32.928 -4.292 -2.416 1.00 10.00 O ATOM 591 CB VAL B 5 30.618 -2.456 -2.491 1.00 10.00 C ATOM 592 CG1 VAL B 5 30.758 -2.185 -3.994 1.00 10.00 C ATOM 593 CG2 VAL B 5 29.368 -1.728 -1.987 1.00 10.00 C ATOM 0 H VAL B 5 31.250 -3.929 -0.206 1.00 10.00 H new ATOM 0 HA VAL B 5 29.666 -4.338 -2.705 1.00 10.00 H new ATOM 0 HB VAL B 5 31.498 -2.080 -1.969 1.00 10.00 H new ATOM 0 HG11 VAL B 5 30.801 -1.110 -4.167 1.00 10.00 H new ATOM 0 HG12 VAL B 5 31.672 -2.649 -4.364 1.00 10.00 H new ATOM 0 HG13 VAL B 5 29.900 -2.603 -4.521 1.00 10.00 H new ATOM 0 HG21 VAL B 5 29.448 -0.665 -2.217 1.00 10.00 H new ATOM 0 HG22 VAL B 5 28.485 -2.139 -2.477 1.00 10.00 H new ATOM 0 HG23 VAL B 5 29.280 -1.861 -0.909 1.00 10.00 H new ATOM 603 N LYS B 6 31.549 -5.837 -3.315 1.00 10.00 N ATOM 604 CA LYS B 6 32.618 -6.640 -3.911 1.00 10.00 C ATOM 605 C LYS B 6 33.055 -6.034 -5.245 1.00 10.00 C ATOM 606 O LYS B 6 32.254 -5.692 -6.105 1.00 10.00 O ATOM 607 CB LYS B 6 32.086 -8.038 -4.187 1.00 10.00 C ATOM 608 CG LYS B 6 31.763 -8.833 -2.918 1.00 10.00 C ATOM 609 CD LYS B 6 31.143 -10.181 -3.294 1.00 10.00 C ATOM 610 CE LYS B 6 32.085 -11.014 -4.173 1.00 10.00 C ATOM 611 NZ LYS B 6 31.389 -12.155 -4.772 1.00 10.00 N ATOM 0 H LYS B 6 30.615 -6.232 -3.422 1.00 10.00 H new ATOM 0 HA LYS B 6 33.463 -6.667 -3.223 1.00 10.00 H new ATOM 0 HB2 LYS B 6 31.186 -7.961 -4.797 1.00 10.00 H new ATOM 0 HB3 LYS B 6 32.822 -8.589 -4.773 1.00 10.00 H new ATOM 0 HG2 LYS B 6 32.671 -8.990 -2.335 1.00 10.00 H new ATOM 0 HG3 LYS B 6 31.074 -8.268 -2.290 1.00 10.00 H new ATOM 0 HD2 LYS B 6 30.904 -10.737 -2.387 1.00 10.00 H new ATOM 0 HD3 LYS B 6 30.204 -10.015 -3.822 1.00 10.00 H new ATOM 0 HE2 LYS B 6 32.501 -10.385 -4.961 1.00 10.00 H new ATOM 0 HE3 LYS B 6 32.923 -11.371 -3.574 1.00 10.00 H new ATOM 0 HZ1 LYS B 6 32.074 -12.754 -5.276 1.00 10.00 H new ATOM 0 HZ2 LYS B 6 30.927 -12.711 -4.024 1.00 10.00 H new ATOM 0 HZ3 LYS B 6 30.671 -11.811 -5.441 1.00 10.00 H new ATOM 625 N THR B 7 34.382 -5.954 -5.387 1.00 10.00 N ATOM 626 CA THR B 7 34.980 -5.543 -6.663 1.00 10.00 C ATOM 627 C THR B 7 35.519 -6.809 -7.342 1.00 10.00 C ATOM 628 O THR B 7 35.712 -7.852 -6.720 1.00 10.00 O ATOM 629 CB THR B 7 36.105 -4.510 -6.466 1.00 10.00 C ATOM 630 OG1 THR B 7 37.206 -5.153 -5.841 1.00 10.00 O ATOM 631 CG2 THR B 7 35.668 -3.309 -5.622 1.00 10.00 C ATOM 0 H THR B 7 35.053 -6.164 -4.648 1.00 10.00 H new ATOM 0 HA THR B 7 34.226 -5.058 -7.283 1.00 10.00 H new ATOM 0 HB THR B 7 36.379 -4.124 -7.448 1.00 10.00 H new ATOM 0 HG1 THR B 7 37.945 -5.230 -6.480 1.00 10.00 H new ATOM 0 HG21 THR B 7 36.502 -2.615 -5.517 1.00 10.00 H new ATOM 0 HG22 THR B 7 34.835 -2.804 -6.111 1.00 10.00 H new ATOM 0 HG23 THR B 7 35.355 -3.652 -4.636 1.00 10.00 H new ATOM 639 N LEU B 8 35.829 -6.672 -8.627 1.00 10.00 N ATOM 640 CA LEU B 8 36.235 -7.820 -9.454 1.00 10.00 C ATOM 641 C LEU B 8 37.686 -8.276 -9.241 1.00 10.00 C ATOM 642 O LEU B 8 38.070 -9.373 -9.639 1.00 10.00 O ATOM 643 CB LEU B 8 35.901 -7.539 -10.922 1.00 10.00 C ATOM 644 CG LEU B 8 34.421 -7.152 -11.092 1.00 10.00 C ATOM 645 CD1 LEU B 8 34.115 -6.900 -12.567 1.00 10.00 C ATOM 646 CD2 LEU B 8 33.448 -8.190 -10.510 1.00 10.00 C ATOM 0 H LEU B 8 35.809 -5.782 -9.125 1.00 10.00 H new ATOM 0 HA LEU B 8 35.653 -8.680 -9.121 1.00 10.00 H new ATOM 0 HB2 LEU B 8 36.535 -6.734 -11.294 1.00 10.00 H new ATOM 0 HB3 LEU B 8 36.120 -8.422 -11.523 1.00 10.00 H new ATOM 0 HG LEU B 8 34.267 -6.237 -10.520 1.00 10.00 H new ATOM 0 HD11 LEU B 8 33.066 -6.627 -12.679 1.00 10.00 H new ATOM 0 HD12 LEU B 8 34.743 -6.089 -12.935 1.00 10.00 H new ATOM 0 HD13 LEU B 8 34.318 -7.805 -13.140 1.00 10.00 H new ATOM 0 HD21 LEU B 8 32.423 -7.854 -10.664 1.00 10.00 H new ATOM 0 HD22 LEU B 8 33.595 -9.147 -11.010 1.00 10.00 H new ATOM 0 HD23 LEU B 8 33.635 -8.306 -9.442 1.00 10.00 H new ATOM 658 N THR B 9 38.466 -7.397 -8.621 1.00 10.00 N ATOM 659 CA THR B 9 39.799 -7.751 -8.088 1.00 10.00 C ATOM 660 C THR B 9 39.682 -8.834 -7.006 1.00 10.00 C ATOM 661 O THR B 9 40.548 -9.705 -6.904 1.00 10.00 O ATOM 662 CB THR B 9 40.520 -6.527 -7.505 1.00 10.00 C ATOM 663 OG1 THR B 9 39.674 -5.837 -6.581 1.00 10.00 O ATOM 664 CG2 THR B 9 40.998 -5.580 -8.609 1.00 10.00 C ATOM 0 H THR B 9 38.205 -6.423 -8.469 1.00 10.00 H new ATOM 0 HA THR B 9 40.386 -8.133 -8.923 1.00 10.00 H new ATOM 0 HB THR B 9 41.400 -6.884 -6.971 1.00 10.00 H new ATOM 0 HG1 THR B 9 40.150 -5.061 -6.219 1.00 10.00 H new ATOM 0 HG21 THR B 9 41.504 -4.725 -8.161 1.00 10.00 H new ATOM 0 HG22 THR B 9 41.690 -6.107 -9.266 1.00 10.00 H new ATOM 0 HG23 THR B 9 40.141 -5.233 -9.187 1.00 10.00 H new ATOM 672 N GLY B 10 38.580 -8.774 -6.251 1.00 10.00 N ATOM 673 CA GLY B 10 38.297 -9.721 -5.159 1.00 10.00 C ATOM 674 C GLY B 10 38.112 -8.999 -3.819 1.00 10.00 C ATOM 675 O GLY B 10 37.478 -9.534 -2.909 1.00 10.00 O ATOM 0 H GLY B 10 37.856 -8.067 -6.378 1.00 10.00 H new ATOM 0 HA2 GLY B 10 37.397 -10.290 -5.394 1.00 10.00 H new ATOM 0 HA3 GLY B 10 39.114 -10.437 -5.077 1.00 10.00 H new ATOM 679 N LYS B 11 38.699 -7.811 -3.707 1.00 10.00 N ATOM 680 CA LYS B 11 38.569 -6.969 -2.498 1.00 10.00 C ATOM 681 C LYS B 11 37.084 -6.630 -2.265 1.00 10.00 C ATOM 682 O LYS B 11 36.295 -6.491 -3.197 1.00 10.00 O ATOM 683 CB LYS B 11 39.384 -5.684 -2.662 1.00 10.00 C ATOM 684 CG LYS B 11 39.643 -5.025 -1.298 1.00 10.00 C ATOM 685 CD LYS B 11 39.372 -3.518 -1.303 1.00 10.00 C ATOM 686 CE LYS B 11 40.366 -2.703 -2.137 1.00 10.00 C ATOM 687 NZ LYS B 11 41.693 -2.639 -1.504 1.00 10.00 N ATOM 0 H LYS B 11 39.276 -7.398 -4.439 1.00 10.00 H new ATOM 0 HA LYS B 11 38.952 -7.516 -1.636 1.00 10.00 H new ATOM 0 HB2 LYS B 11 40.333 -5.909 -3.148 1.00 10.00 H new ATOM 0 HB3 LYS B 11 38.850 -4.990 -3.311 1.00 10.00 H new ATOM 0 HG2 LYS B 11 39.013 -5.500 -0.545 1.00 10.00 H new ATOM 0 HG3 LYS B 11 40.678 -5.202 -1.005 1.00 10.00 H new ATOM 0 HD2 LYS B 11 38.366 -3.343 -1.684 1.00 10.00 H new ATOM 0 HD3 LYS B 11 39.392 -3.153 -0.276 1.00 10.00 H new ATOM 0 HE2 LYS B 11 40.458 -3.147 -3.128 1.00 10.00 H new ATOM 0 HE3 LYS B 11 39.981 -1.693 -2.275 1.00 10.00 H new ATOM 0 HZ1 LYS B 11 42.331 -2.065 -2.092 1.00 10.00 H new ATOM 0 HZ2 LYS B 11 41.608 -2.207 -0.562 1.00 10.00 H new ATOM 0 HZ3 LYS B 11 42.080 -3.600 -1.411 1.00 10.00 H new ATOM 701 N THR B 12 36.755 -6.482 -0.984 1.00 10.00 N ATOM 702 CA THR B 12 35.391 -6.132 -0.550 1.00 10.00 C ATOM 703 C THR B 12 35.451 -4.830 0.254 1.00 10.00 C ATOM 704 O THR B 12 36.159 -4.722 1.242 1.00 10.00 O ATOM 705 CB THR B 12 34.799 -7.266 0.303 1.00 10.00 C ATOM 706 OG1 THR B 12 34.712 -8.446 -0.496 1.00 10.00 O ATOM 707 CG2 THR B 12 33.410 -6.941 0.866 1.00 10.00 C ATOM 0 H THR B 12 37.417 -6.599 -0.216 1.00 10.00 H new ATOM 0 HA THR B 12 34.749 -5.994 -1.420 1.00 10.00 H new ATOM 0 HB THR B 12 35.463 -7.406 1.156 1.00 10.00 H new ATOM 0 HG1 THR B 12 34.337 -9.176 0.039 1.00 10.00 H new ATOM 0 HG21 THR B 12 33.051 -7.783 1.458 1.00 10.00 H new ATOM 0 HG22 THR B 12 33.471 -6.054 1.497 1.00 10.00 H new ATOM 0 HG23 THR B 12 32.719 -6.754 0.044 1.00 10.00 H new ATOM 715 N ILE B 13 34.582 -3.907 -0.157 1.00 10.00 N ATOM 716 CA ILE B 13 34.422 -2.619 0.536 1.00 10.00 C ATOM 717 C ILE B 13 33.269 -2.796 1.537 1.00 10.00 C ATOM 718 O ILE B 13 32.202 -3.280 1.181 1.00 10.00 O ATOM 719 CB ILE B 13 34.039 -1.484 -0.444 1.00 10.00 C ATOM 720 CG1 ILE B 13 34.643 -1.608 -1.855 1.00 10.00 C ATOM 721 CG2 ILE B 13 34.367 -0.116 0.176 1.00 10.00 C ATOM 722 CD1 ILE B 13 36.167 -1.762 -1.927 1.00 10.00 C ATOM 0 H ILE B 13 33.974 -4.023 -0.968 1.00 10.00 H new ATOM 0 HA ILE B 13 35.362 -2.347 1.015 1.00 10.00 H new ATOM 0 HB ILE B 13 32.964 -1.580 -0.595 1.00 10.00 H new ATOM 0 HG12 ILE B 13 34.188 -2.467 -2.348 1.00 10.00 H new ATOM 0 HG13 ILE B 13 34.360 -0.725 -2.428 1.00 10.00 H new ATOM 0 HG21 ILE B 13 34.093 0.675 -0.522 1.00 10.00 H new ATOM 0 HG22 ILE B 13 33.806 0.008 1.102 1.00 10.00 H new ATOM 0 HG23 ILE B 13 35.435 -0.059 0.388 1.00 10.00 H new ATOM 0 HD11 ILE B 13 36.476 -1.840 -2.969 1.00 10.00 H new ATOM 0 HD12 ILE B 13 36.642 -0.893 -1.472 1.00 10.00 H new ATOM 0 HD13 ILE B 13 36.467 -2.662 -1.391 1.00 10.00 H new ATOM 734 N THR B 14 33.520 -2.370 2.771 1.00 10.00 N ATOM 735 CA THR B 14 32.453 -2.309 3.786 1.00 10.00 C ATOM 736 C THR B 14 32.032 -0.844 3.922 1.00 10.00 C ATOM 737 O THR B 14 32.862 0.042 4.108 1.00 10.00 O ATOM 738 CB THR B 14 32.942 -2.854 5.136 1.00 10.00 C ATOM 739 OG1 THR B 14 33.345 -4.216 4.979 1.00 10.00 O ATOM 740 CG2 THR B 14 31.854 -2.775 6.213 1.00 10.00 C ATOM 0 H THR B 14 34.437 -2.064 3.097 1.00 10.00 H new ATOM 0 HA THR B 14 31.609 -2.926 3.479 1.00 10.00 H new ATOM 0 HB THR B 14 33.782 -2.239 5.458 1.00 10.00 H new ATOM 0 HG1 THR B 14 32.552 -4.792 4.960 1.00 10.00 H new ATOM 0 HG21 THR B 14 32.242 -3.171 7.152 1.00 10.00 H new ATOM 0 HG22 THR B 14 31.555 -1.736 6.353 1.00 10.00 H new ATOM 0 HG23 THR B 14 30.990 -3.362 5.901 1.00 10.00 H new ATOM 748 N LEU B 15 30.718 -0.648 3.864 1.00 10.00 N ATOM 749 CA LEU B 15 30.127 0.691 4.017 1.00 10.00 C ATOM 750 C LEU B 15 29.091 0.720 5.144 1.00 10.00 C ATOM 751 O LEU B 15 28.366 -0.244 5.354 1.00 10.00 O ATOM 752 CB LEU B 15 29.463 1.119 2.707 1.00 10.00 C ATOM 753 CG LEU B 15 30.428 1.192 1.518 1.00 10.00 C ATOM 754 CD1 LEU B 15 29.629 1.416 0.236 1.00 10.00 C ATOM 755 CD2 LEU B 15 31.447 2.321 1.696 1.00 10.00 C ATOM 0 H LEU B 15 30.038 -1.393 3.713 1.00 10.00 H new ATOM 0 HA LEU B 15 30.930 1.383 4.271 1.00 10.00 H new ATOM 0 HB2 LEU B 15 28.663 0.418 2.471 1.00 10.00 H new ATOM 0 HB3 LEU B 15 29.000 2.096 2.848 1.00 10.00 H new ATOM 0 HG LEU B 15 30.976 0.252 1.459 1.00 10.00 H new ATOM 0 HD11 LEU B 15 30.311 1.469 -0.613 1.00 10.00 H new ATOM 0 HD12 LEU B 15 28.933 0.590 0.092 1.00 10.00 H new ATOM 0 HD13 LEU B 15 29.072 2.350 0.313 1.00 10.00 H new ATOM 0 HD21 LEU B 15 32.116 2.346 0.836 1.00 10.00 H new ATOM 0 HD22 LEU B 15 30.924 3.274 1.776 1.00 10.00 H new ATOM 0 HD23 LEU B 15 32.027 2.148 2.602 1.00 10.00 H new ATOM 767 N GLU B 16 29.077 1.857 5.839 1.00 10.00 N ATOM 768 CA GLU B 16 28.043 2.184 6.837 1.00 10.00 C ATOM 769 C GLU B 16 27.032 3.124 6.175 1.00 10.00 C ATOM 770 O GLU B 16 27.344 4.252 5.822 1.00 10.00 O ATOM 771 CB GLU B 16 28.695 2.868 8.048 1.00 10.00 C ATOM 772 CG GLU B 16 27.674 3.287 9.115 1.00 10.00 C ATOM 773 CD GLU B 16 26.870 2.110 9.679 1.00 10.00 C ATOM 774 OE1 GLU B 16 27.474 1.040 9.909 1.00 10.00 O ATOM 775 OE2 GLU B 16 25.655 2.315 9.880 1.00 10.00 O ATOM 0 H GLU B 16 29.783 2.585 5.730 1.00 10.00 H new ATOM 0 HA GLU B 16 27.541 1.281 7.183 1.00 10.00 H new ATOM 0 HB2 GLU B 16 29.423 2.190 8.494 1.00 10.00 H new ATOM 0 HB3 GLU B 16 29.243 3.748 7.711 1.00 10.00 H new ATOM 0 HG2 GLU B 16 28.196 3.786 9.931 1.00 10.00 H new ATOM 0 HG3 GLU B 16 26.986 4.015 8.684 1.00 10.00 H new ATOM 782 N VAL B 17 25.834 2.572 5.956 1.00 10.00 N ATOM 783 CA VAL B 17 24.775 3.277 5.224 1.00 10.00 C ATOM 784 C VAL B 17 23.429 3.229 5.974 1.00 10.00 C ATOM 785 O VAL B 17 23.257 2.568 6.988 1.00 10.00 O ATOM 786 CB VAL B 17 24.621 2.693 3.804 1.00 10.00 C ATOM 787 CG1 VAL B 17 25.905 2.822 2.979 1.00 10.00 C ATOM 788 CG2 VAL B 17 24.118 1.248 3.835 1.00 10.00 C ATOM 0 H VAL B 17 25.573 1.639 6.275 1.00 10.00 H new ATOM 0 HA VAL B 17 25.071 4.323 5.148 1.00 10.00 H new ATOM 0 HB VAL B 17 23.861 3.293 3.303 1.00 10.00 H new ATOM 0 HG11 VAL B 17 25.745 2.397 1.988 1.00 10.00 H new ATOM 0 HG12 VAL B 17 26.172 3.875 2.883 1.00 10.00 H new ATOM 0 HG13 VAL B 17 26.713 2.287 3.478 1.00 10.00 H new ATOM 0 HG21 VAL B 17 24.023 0.874 2.816 1.00 10.00 H new ATOM 0 HG22 VAL B 17 24.826 0.628 4.385 1.00 10.00 H new ATOM 0 HG23 VAL B 17 23.146 1.212 4.327 1.00 10.00 H new ATOM 798 N GLU B 18 22.470 3.916 5.374 1.00 10.00 N ATOM 799 CA GLU B 18 21.048 3.861 5.737 1.00 10.00 C ATOM 800 C GLU B 18 20.257 3.420 4.501 1.00 10.00 C ATOM 801 O GLU B 18 20.619 3.775 3.384 1.00 10.00 O ATOM 802 CB GLU B 18 20.587 5.252 6.190 1.00 10.00 C ATOM 803 CG GLU B 18 21.309 5.732 7.457 1.00 10.00 C ATOM 804 CD GLU B 18 21.163 4.793 8.665 1.00 10.00 C ATOM 805 OE1 GLU B 18 20.162 4.041 8.707 1.00 10.00 O ATOM 806 OE2 GLU B 18 22.056 4.862 9.536 1.00 10.00 O ATOM 0 H GLU B 18 22.657 4.549 4.596 1.00 10.00 H new ATOM 0 HA GLU B 18 20.885 3.156 6.552 1.00 10.00 H new ATOM 0 HB2 GLU B 18 20.759 5.967 5.386 1.00 10.00 H new ATOM 0 HB3 GLU B 18 19.513 5.232 6.374 1.00 10.00 H new ATOM 0 HG2 GLU B 18 22.369 5.854 7.233 1.00 10.00 H new ATOM 0 HG3 GLU B 18 20.926 6.716 7.728 1.00 10.00 H new ATOM 813 N SER B 19 19.104 2.781 4.734 1.00 10.00 N ATOM 814 CA SER B 19 18.193 2.380 3.635 1.00 10.00 C ATOM 815 C SER B 19 17.735 3.573 2.782 1.00 10.00 C ATOM 816 O SER B 19 17.554 3.458 1.571 1.00 10.00 O ATOM 817 CB SER B 19 16.944 1.682 4.175 1.00 10.00 C ATOM 818 OG SER B 19 17.323 0.642 5.076 1.00 10.00 O ATOM 0 H SER B 19 18.774 2.528 5.665 1.00 10.00 H new ATOM 0 HA SER B 19 18.771 1.698 3.012 1.00 10.00 H new ATOM 0 HB2 SER B 19 16.305 2.403 4.685 1.00 10.00 H new ATOM 0 HB3 SER B 19 16.363 1.268 3.351 1.00 10.00 H new ATOM 0 HG SER B 19 16.520 0.199 5.421 1.00 10.00 H new ATOM 824 N SER B 20 17.630 4.726 3.443 1.00 10.00 N ATOM 825 CA SER B 20 17.277 6.014 2.815 1.00 10.00 C ATOM 826 C SER B 20 18.374 6.626 1.930 1.00 10.00 C ATOM 827 O SER B 20 18.096 7.550 1.167 1.00 10.00 O ATOM 828 CB SER B 20 16.840 7.023 3.881 1.00 10.00 C ATOM 829 OG SER B 20 17.829 7.118 4.915 1.00 10.00 O ATOM 0 H SER B 20 17.789 4.800 4.448 1.00 10.00 H new ATOM 0 HA SER B 20 16.452 5.786 2.141 1.00 10.00 H new ATOM 0 HB2 SER B 20 16.687 8.001 3.424 1.00 10.00 H new ATOM 0 HB3 SER B 20 15.885 6.718 4.309 1.00 10.00 H new ATOM 0 HG SER B 20 17.537 7.768 5.588 1.00 10.00 H new ATOM 835 N ASP B 21 19.591 6.092 2.000 1.00 10.00 N ATOM 836 CA ASP B 21 20.705 6.589 1.167 1.00 10.00 C ATOM 837 C ASP B 21 20.435 6.350 -0.316 1.00 10.00 C ATOM 838 O ASP B 21 20.046 5.264 -0.731 1.00 10.00 O ATOM 839 CB ASP B 21 22.029 5.927 1.549 1.00 10.00 C ATOM 840 CG ASP B 21 22.530 6.370 2.929 1.00 10.00 C ATOM 841 OD1 ASP B 21 22.118 7.452 3.401 1.00 10.00 O ATOM 842 OD2 ASP B 21 23.400 5.649 3.455 1.00 10.00 O ATOM 0 H ASP B 21 19.839 5.320 2.618 1.00 10.00 H new ATOM 0 HA ASP B 21 20.780 7.661 1.350 1.00 10.00 H new ATOM 0 HB2 ASP B 21 21.906 4.844 1.541 1.00 10.00 H new ATOM 0 HB3 ASP B 21 22.782 6.167 0.798 1.00 10.00 H new ATOM 847 N THR B 22 20.639 7.430 -1.075 1.00 10.00 N ATOM 848 CA THR B 22 20.569 7.371 -2.545 1.00 10.00 C ATOM 849 C THR B 22 21.780 6.569 -3.046 1.00 10.00 C ATOM 850 O THR B 22 22.827 6.532 -2.415 1.00 10.00 O ATOM 851 CB THR B 22 20.573 8.773 -3.179 1.00 10.00 C ATOM 852 OG1 THR B 22 21.835 9.413 -2.952 1.00 10.00 O ATOM 853 CG2 THR B 22 19.417 9.638 -2.663 1.00 10.00 C ATOM 0 H THR B 22 20.853 8.355 -0.701 1.00 10.00 H new ATOM 0 HA THR B 22 19.634 6.892 -2.835 1.00 10.00 H new ATOM 0 HB THR B 22 20.426 8.655 -4.253 1.00 10.00 H new ATOM 0 HG1 THR B 22 21.828 10.304 -3.361 1.00 10.00 H new ATOM 0 HG21 THR B 22 19.457 10.619 -3.136 1.00 10.00 H new ATOM 0 HG22 THR B 22 18.468 9.158 -2.903 1.00 10.00 H new ATOM 0 HG23 THR B 22 19.502 9.752 -1.582 1.00 10.00 H new ATOM 861 N ILE B 23 21.618 5.957 -4.222 1.00 10.00 N ATOM 862 CA ILE B 23 22.719 5.211 -4.868 1.00 10.00 C ATOM 863 C ILE B 23 23.931 6.116 -5.132 1.00 10.00 C ATOM 864 O ILE B 23 25.069 5.748 -4.832 1.00 10.00 O ATOM 865 CB ILE B 23 22.216 4.543 -6.164 1.00 10.00 C ATOM 866 CG1 ILE B 23 21.083 3.546 -5.870 1.00 10.00 C ATOM 867 CG2 ILE B 23 23.333 3.895 -6.998 1.00 10.00 C ATOM 868 CD1 ILE B 23 21.426 2.433 -4.869 1.00 10.00 C ATOM 0 H ILE B 23 20.745 5.959 -4.749 1.00 10.00 H new ATOM 0 HA ILE B 23 23.052 4.428 -4.187 1.00 10.00 H new ATOM 0 HB ILE B 23 21.817 5.348 -6.782 1.00 10.00 H new ATOM 0 HG12 ILE B 23 20.224 4.100 -5.491 1.00 10.00 H new ATOM 0 HG13 ILE B 23 20.776 3.085 -6.809 1.00 10.00 H new ATOM 0 HG21 ILE B 23 22.904 3.446 -7.894 1.00 10.00 H new ATOM 0 HG22 ILE B 23 24.060 4.655 -7.286 1.00 10.00 H new ATOM 0 HG23 ILE B 23 23.828 3.125 -6.407 1.00 10.00 H new ATOM 0 HD11 ILE B 23 20.559 1.786 -4.733 1.00 10.00 H new ATOM 0 HD12 ILE B 23 22.261 1.846 -5.250 1.00 10.00 H new ATOM 0 HD13 ILE B 23 21.701 2.876 -3.912 1.00 10.00 H new ATOM 880 N ASP B 24 23.634 7.343 -5.550 1.00 10.00 N ATOM 881 CA ASP B 24 24.661 8.379 -5.763 1.00 10.00 C ATOM 882 C ASP B 24 25.459 8.649 -4.476 1.00 10.00 C ATOM 883 O ASP B 24 26.684 8.754 -4.509 1.00 10.00 O ATOM 884 CB ASP B 24 23.989 9.663 -6.260 1.00 10.00 C ATOM 885 CG ASP B 24 25.012 10.778 -6.493 1.00 10.00 C ATOM 886 OD1 ASP B 24 25.881 10.577 -7.365 1.00 10.00 O ATOM 887 OD2 ASP B 24 24.897 11.787 -5.768 1.00 10.00 O ATOM 0 H ASP B 24 22.684 7.654 -5.752 1.00 10.00 H new ATOM 0 HA ASP B 24 25.366 8.023 -6.514 1.00 10.00 H new ATOM 0 HB2 ASP B 24 23.454 9.459 -7.187 1.00 10.00 H new ATOM 0 HB3 ASP B 24 23.249 9.993 -5.531 1.00 10.00 H new ATOM 892 N ASN B 25 24.739 8.682 -3.354 1.00 10.00 N ATOM 893 CA ASN B 25 25.328 8.870 -2.019 1.00 10.00 C ATOM 894 C ASN B 25 26.257 7.708 -1.629 1.00 10.00 C ATOM 895 O ASN B 25 27.338 7.930 -1.090 1.00 10.00 O ATOM 896 CB ASN B 25 24.193 9.020 -1.004 1.00 10.00 C ATOM 897 CG ASN B 25 24.693 9.142 0.427 1.00 10.00 C ATOM 898 OD1 ASN B 25 25.524 9.968 0.780 1.00 10.00 O ATOM 899 ND2 ASN B 25 24.187 8.275 1.260 1.00 10.00 N ATOM 0 H ASN B 25 23.724 8.579 -3.341 1.00 10.00 H new ATOM 0 HA ASN B 25 25.944 9.769 -2.030 1.00 10.00 H new ATOM 0 HB2 ASN B 25 23.603 9.902 -1.254 1.00 10.00 H new ATOM 0 HB3 ASN B 25 23.528 8.159 -1.079 1.00 10.00 H new ATOM 0 HD21 ASN B 25 24.482 8.273 2.236 1.00 10.00 H new ATOM 0 HD22 ASN B 25 23.496 7.599 0.935 1.00 10.00 H new ATOM 906 N VAL B 26 25.852 6.487 -1.981 1.00 10.00 N ATOM 907 CA VAL B 26 26.669 5.273 -1.765 1.00 10.00 C ATOM 908 C VAL B 26 27.971 5.347 -2.577 1.00 10.00 C ATOM 909 O VAL B 26 29.054 5.129 -2.042 1.00 10.00 O ATOM 910 CB VAL B 26 25.867 4.004 -2.117 1.00 10.00 C ATOM 911 CG1 VAL B 26 26.719 2.725 -2.100 1.00 10.00 C ATOM 912 CG2 VAL B 26 24.721 3.816 -1.123 1.00 10.00 C ATOM 0 H VAL B 26 24.952 6.303 -2.424 1.00 10.00 H new ATOM 0 HA VAL B 26 26.932 5.219 -0.709 1.00 10.00 H new ATOM 0 HB VAL B 26 25.497 4.155 -3.131 1.00 10.00 H new ATOM 0 HG11 VAL B 26 26.095 1.869 -2.356 1.00 10.00 H new ATOM 0 HG12 VAL B 26 27.526 2.816 -2.827 1.00 10.00 H new ATOM 0 HG13 VAL B 26 27.141 2.582 -1.105 1.00 10.00 H new ATOM 0 HG21 VAL B 26 24.160 2.917 -1.380 1.00 10.00 H new ATOM 0 HG22 VAL B 26 25.126 3.716 -0.116 1.00 10.00 H new ATOM 0 HG23 VAL B 26 24.059 4.681 -1.164 1.00 10.00 H new ATOM 922 N LYS B 27 27.844 5.671 -3.862 1.00 10.00 N ATOM 923 CA LYS B 27 28.999 5.783 -4.773 1.00 10.00 C ATOM 924 C LYS B 27 30.020 6.826 -4.290 1.00 10.00 C ATOM 925 O LYS B 27 31.227 6.591 -4.333 1.00 10.00 O ATOM 926 CB LYS B 27 28.530 6.131 -6.186 1.00 10.00 C ATOM 927 CG LYS B 27 27.736 4.981 -6.799 1.00 10.00 C ATOM 928 CD LYS B 27 27.283 5.330 -8.215 1.00 10.00 C ATOM 929 CE LYS B 27 26.545 4.146 -8.835 1.00 10.00 C ATOM 930 NZ LYS B 27 26.062 4.478 -10.179 1.00 10.00 N ATOM 0 H LYS B 27 26.946 5.864 -4.307 1.00 10.00 H new ATOM 0 HA LYS B 27 29.496 4.813 -4.782 1.00 10.00 H new ATOM 0 HB2 LYS B 27 27.913 7.029 -6.157 1.00 10.00 H new ATOM 0 HB3 LYS B 27 29.392 6.357 -6.813 1.00 10.00 H new ATOM 0 HG2 LYS B 27 28.349 4.080 -6.820 1.00 10.00 H new ATOM 0 HG3 LYS B 27 26.868 4.761 -6.178 1.00 10.00 H new ATOM 0 HD2 LYS B 27 26.631 6.203 -8.192 1.00 10.00 H new ATOM 0 HD3 LYS B 27 28.146 5.592 -8.827 1.00 10.00 H new ATOM 0 HE2 LYS B 27 27.210 3.284 -8.886 1.00 10.00 H new ATOM 0 HE3 LYS B 27 25.704 3.864 -8.201 1.00 10.00 H new ATOM 0 HZ1 LYS B 27 25.346 3.783 -10.472 1.00 10.00 H new ATOM 0 HZ2 LYS B 27 25.639 5.428 -10.171 1.00 10.00 H new ATOM 0 HZ3 LYS B 27 26.858 4.459 -10.848 1.00 10.00 H new ATOM 944 N SER B 28 29.492 7.906 -3.710 1.00 10.00 N ATOM 945 CA SER B 28 30.302 8.940 -3.035 1.00 10.00 C ATOM 946 C SER B 28 31.039 8.389 -1.799 1.00 10.00 C ATOM 947 O SER B 28 32.239 8.596 -1.635 1.00 10.00 O ATOM 948 CB SER B 28 29.419 10.118 -2.621 1.00 10.00 C ATOM 949 OG SER B 28 30.246 11.147 -2.075 1.00 10.00 O ATOM 0 H SER B 28 28.490 8.095 -3.691 1.00 10.00 H new ATOM 0 HA SER B 28 31.054 9.274 -3.750 1.00 10.00 H new ATOM 0 HB2 SER B 28 28.866 10.495 -3.481 1.00 10.00 H new ATOM 0 HB3 SER B 28 28.682 9.796 -1.885 1.00 10.00 H new ATOM 0 HG SER B 28 29.689 11.907 -1.808 1.00 10.00 H new ATOM 955 N LYS B 29 30.358 7.512 -1.057 1.00 10.00 N ATOM 956 CA LYS B 29 30.955 6.777 0.081 1.00 10.00 C ATOM 957 C LYS B 29 32.081 5.826 -0.370 1.00 10.00 C ATOM 958 O LYS B 29 33.090 5.682 0.317 1.00 10.00 O ATOM 959 CB LYS B 29 29.907 5.958 0.841 1.00 10.00 C ATOM 960 CG LYS B 29 28.867 6.820 1.557 1.00 10.00 C ATOM 961 CD LYS B 29 27.860 5.911 2.269 1.00 10.00 C ATOM 962 CE LYS B 29 26.736 6.687 2.957 1.00 10.00 C ATOM 963 NZ LYS B 29 27.207 7.453 4.122 1.00 10.00 N ATOM 0 H LYS B 29 29.377 7.286 -1.221 1.00 10.00 H new ATOM 0 HA LYS B 29 31.371 7.540 0.739 1.00 10.00 H new ATOM 0 HB2 LYS B 29 29.399 5.294 0.142 1.00 10.00 H new ATOM 0 HB3 LYS B 29 30.411 5.326 1.573 1.00 10.00 H new ATOM 0 HG2 LYS B 29 29.355 7.476 2.278 1.00 10.00 H new ATOM 0 HG3 LYS B 29 28.353 7.461 0.840 1.00 10.00 H new ATOM 0 HD2 LYS B 29 27.427 5.221 1.545 1.00 10.00 H new ATOM 0 HD3 LYS B 29 28.384 5.308 3.010 1.00 10.00 H new ATOM 0 HE2 LYS B 29 26.278 7.368 2.240 1.00 10.00 H new ATOM 0 HE3 LYS B 29 25.960 5.990 3.275 1.00 10.00 H new ATOM 0 HZ1 LYS B 29 26.407 7.960 4.551 1.00 10.00 H new ATOM 0 HZ2 LYS B 29 27.620 6.803 4.821 1.00 10.00 H new ATOM 0 HZ3 LYS B 29 27.928 8.138 3.818 1.00 10.00 H new ATOM 977 N ILE B 30 31.929 5.259 -1.570 1.00 10.00 N ATOM 978 CA ILE B 30 32.959 4.407 -2.211 1.00 10.00 C ATOM 979 C ILE B 30 34.182 5.255 -2.592 1.00 10.00 C ATOM 980 O ILE B 30 35.320 4.847 -2.384 1.00 10.00 O ATOM 981 CB ILE B 30 32.382 3.647 -3.423 1.00 10.00 C ATOM 982 CG1 ILE B 30 31.361 2.610 -2.931 1.00 10.00 C ATOM 983 CG2 ILE B 30 33.478 2.996 -4.295 1.00 10.00 C ATOM 984 CD1 ILE B 30 30.587 1.880 -4.036 1.00 10.00 C ATOM 0 H ILE B 30 31.087 5.373 -2.135 1.00 10.00 H new ATOM 0 HA ILE B 30 33.284 3.652 -1.495 1.00 10.00 H new ATOM 0 HB ILE B 30 31.882 4.368 -4.069 1.00 10.00 H new ATOM 0 HG12 ILE B 30 31.883 1.869 -2.325 1.00 10.00 H new ATOM 0 HG13 ILE B 30 30.646 3.110 -2.278 1.00 10.00 H new ATOM 0 HG21 ILE B 30 33.015 2.475 -5.133 1.00 10.00 H new ATOM 0 HG22 ILE B 30 34.148 3.768 -4.673 1.00 10.00 H new ATOM 0 HG23 ILE B 30 34.046 2.285 -3.695 1.00 10.00 H new ATOM 0 HD11 ILE B 30 29.893 1.170 -3.586 1.00 10.00 H new ATOM 0 HD12 ILE B 30 30.031 2.605 -4.630 1.00 10.00 H new ATOM 0 HD13 ILE B 30 31.287 1.345 -4.678 1.00 10.00 H new ATOM 996 N GLN B 31 33.914 6.421 -3.179 1.00 10.00 N ATOM 997 CA GLN B 31 34.970 7.391 -3.516 1.00 10.00 C ATOM 998 C GLN B 31 35.742 7.818 -2.260 1.00 10.00 C ATOM 999 O GLN B 31 36.970 7.872 -2.285 1.00 10.00 O ATOM 1000 CB GLN B 31 34.323 8.608 -4.178 1.00 10.00 C ATOM 1001 CG GLN B 31 35.373 9.618 -4.640 1.00 10.00 C ATOM 1002 CD GLN B 31 34.741 10.845 -5.287 1.00 10.00 C ATOM 1003 OE1 GLN B 31 33.633 11.278 -4.989 1.00 10.00 O ATOM 1004 NE2 GLN B 31 35.445 11.403 -6.240 1.00 10.00 N ATOM 0 H GLN B 31 32.974 6.723 -3.434 1.00 10.00 H new ATOM 0 HA GLN B 31 35.680 6.928 -4.201 1.00 10.00 H new ATOM 0 HB2 GLN B 31 33.727 8.285 -5.031 1.00 10.00 H new ATOM 0 HB3 GLN B 31 33.641 9.086 -3.475 1.00 10.00 H new ATOM 0 HG2 GLN B 31 35.977 9.929 -3.787 1.00 10.00 H new ATOM 0 HG3 GLN B 31 36.047 9.140 -5.351 1.00 10.00 H new ATOM 0 HE21 GLN B 31 36.365 11.033 -6.478 1.00 10.00 H new ATOM 0 HE22 GLN B 31 35.073 12.208 -6.744 1.00 10.00 H new ATOM 1013 N ASP B 32 35.017 7.929 -1.151 1.00 10.00 N ATOM 1014 CA ASP B 32 35.597 8.261 0.162 1.00 10.00 C ATOM 1015 C ASP B 32 36.514 7.186 0.755 1.00 10.00 C ATOM 1016 O ASP B 32 37.387 7.514 1.561 1.00 10.00 O ATOM 1017 CB ASP B 32 34.497 8.663 1.149 1.00 10.00 C ATOM 1018 CG ASP B 32 33.939 10.058 0.845 1.00 10.00 C ATOM 1019 OD1 ASP B 32 34.725 10.918 0.390 1.00 10.00 O ATOM 1020 OD2 ASP B 32 32.732 10.243 1.116 1.00 10.00 O ATOM 0 H ASP B 32 34.006 7.792 -1.129 1.00 10.00 H new ATOM 0 HA ASP B 32 36.254 9.112 -0.018 1.00 10.00 H new ATOM 0 HB2 ASP B 32 33.689 7.932 1.110 1.00 10.00 H new ATOM 0 HB3 ASP B 32 34.895 8.644 2.164 1.00 10.00 H new ATOM 1025 N LYS B 33 36.318 5.933 0.357 1.00 10.00 N ATOM 1026 CA LYS B 33 37.182 4.832 0.823 1.00 10.00 C ATOM 1027 C LYS B 33 38.238 4.376 -0.192 1.00 10.00 C ATOM 1028 O LYS B 33 39.382 4.124 0.166 1.00 10.00 O ATOM 1029 CB LYS B 33 36.361 3.615 1.257 1.00 10.00 C ATOM 1030 CG LYS B 33 35.648 3.841 2.595 1.00 10.00 C ATOM 1031 CD LYS B 33 35.291 2.513 3.274 1.00 10.00 C ATOM 1032 CE LYS B 33 36.551 1.760 3.719 1.00 10.00 C ATOM 1033 NZ LYS B 33 36.239 0.494 4.392 1.00 10.00 N ATOM 0 H LYS B 33 35.577 5.647 -0.282 1.00 10.00 H new ATOM 0 HA LYS B 33 37.714 5.256 1.674 1.00 10.00 H new ATOM 0 HB2 LYS B 33 35.623 3.385 0.489 1.00 10.00 H new ATOM 0 HB3 LYS B 33 37.016 2.748 1.339 1.00 10.00 H new ATOM 0 HG2 LYS B 33 36.288 4.427 3.255 1.00 10.00 H new ATOM 0 HG3 LYS B 33 34.741 4.422 2.431 1.00 10.00 H new ATOM 0 HD2 LYS B 33 34.654 2.703 4.138 1.00 10.00 H new ATOM 0 HD3 LYS B 33 34.718 1.892 2.585 1.00 10.00 H new ATOM 0 HE2 LYS B 33 37.178 1.561 2.850 1.00 10.00 H new ATOM 0 HE3 LYS B 33 37.130 2.393 4.392 1.00 10.00 H new ATOM 0 HZ1 LYS B 33 37.123 0.023 4.673 1.00 10.00 H new ATOM 0 HZ2 LYS B 33 35.663 0.683 5.237 1.00 10.00 H new ATOM 0 HZ3 LYS B 33 35.710 -0.123 3.743 1.00 10.00 H new ATOM 1047 N GLU B 34 37.853 4.340 -1.463 1.00 10.00 N ATOM 1048 CA GLU B 34 38.709 3.783 -2.527 1.00 10.00 C ATOM 1049 C GLU B 34 39.380 4.832 -3.418 1.00 10.00 C ATOM 1050 O GLU B 34 40.445 4.571 -3.981 1.00 10.00 O ATOM 1051 CB GLU B 34 37.891 2.804 -3.371 1.00 10.00 C ATOM 1052 CG GLU B 34 37.526 1.542 -2.580 1.00 10.00 C ATOM 1053 CD GLU B 34 38.751 0.748 -2.104 1.00 10.00 C ATOM 1054 OE1 GLU B 34 39.727 0.658 -2.881 1.00 10.00 O ATOM 1055 OE2 GLU B 34 38.649 0.177 -0.996 1.00 10.00 O ATOM 0 H GLU B 34 36.953 4.689 -1.791 1.00 10.00 H new ATOM 0 HA GLU B 34 39.530 3.270 -2.027 1.00 10.00 H new ATOM 0 HB2 GLU B 34 36.980 3.294 -3.716 1.00 10.00 H new ATOM 0 HB3 GLU B 34 38.459 2.526 -4.259 1.00 10.00 H new ATOM 0 HG2 GLU B 34 36.926 1.825 -1.715 1.00 10.00 H new ATOM 0 HG3 GLU B 34 36.904 0.899 -3.202 1.00 10.00 H new ATOM 1062 N GLY B 35 38.700 5.967 -3.592 1.00 10.00 N ATOM 1063 CA GLY B 35 39.167 7.047 -4.480 1.00 10.00 C ATOM 1064 C GLY B 35 38.575 6.941 -5.897 1.00 10.00 C ATOM 1065 O GLY B 35 38.859 7.765 -6.758 1.00 10.00 O ATOM 0 H GLY B 35 37.815 6.168 -3.127 1.00 10.00 H new ATOM 0 HA2 GLY B 35 38.897 8.011 -4.048 1.00 10.00 H new ATOM 0 HA3 GLY B 35 40.255 7.018 -4.541 1.00 10.00 H new ATOM 1069 N ILE B 36 37.710 5.945 -6.087 1.00 10.00 N ATOM 1070 CA ILE B 36 37.030 5.688 -7.374 1.00 10.00 C ATOM 1071 C ILE B 36 35.999 6.799 -7.639 1.00 10.00 C ATOM 1072 O ILE B 36 35.065 6.970 -6.855 1.00 10.00 O ATOM 1073 CB ILE B 36 36.376 4.293 -7.417 1.00 10.00 C ATOM 1074 CG1 ILE B 36 37.418 3.204 -7.106 1.00 10.00 C ATOM 1075 CG2 ILE B 36 35.742 4.043 -8.798 1.00 10.00 C ATOM 1076 CD1 ILE B 36 36.826 1.801 -6.908 1.00 10.00 C ATOM 0 H ILE B 36 37.454 5.285 -5.353 1.00 10.00 H new ATOM 0 HA ILE B 36 37.779 5.699 -8.166 1.00 10.00 H new ATOM 0 HB ILE B 36 35.593 4.253 -6.660 1.00 10.00 H new ATOM 0 HG12 ILE B 36 38.143 3.168 -7.919 1.00 10.00 H new ATOM 0 HG13 ILE B 36 37.963 3.486 -6.205 1.00 10.00 H new ATOM 0 HG21 ILE B 36 35.284 3.054 -8.814 1.00 10.00 H new ATOM 0 HG22 ILE B 36 34.981 4.799 -8.991 1.00 10.00 H new ATOM 0 HG23 ILE B 36 36.512 4.099 -9.567 1.00 10.00 H new ATOM 0 HD11 ILE B 36 37.628 1.095 -6.693 1.00 10.00 H new ATOM 0 HD12 ILE B 36 36.123 1.817 -6.075 1.00 10.00 H new ATOM 0 HD13 ILE B 36 36.306 1.494 -7.815 1.00 10.00 H new ATOM 1088 N PRO B 37 36.113 7.446 -8.812 1.00 10.00 N ATOM 1089 CA PRO B 37 35.131 8.437 -9.279 1.00 10.00 C ATOM 1090 C PRO B 37 33.737 7.794 -9.398 1.00 10.00 C ATOM 1091 O PRO B 37 33.595 6.746 -10.030 1.00 10.00 O ATOM 1092 CB PRO B 37 35.644 8.875 -10.650 1.00 10.00 C ATOM 1093 CG PRO B 37 37.154 8.703 -10.521 1.00 10.00 C ATOM 1094 CD PRO B 37 37.286 7.419 -9.704 1.00 10.00 C ATOM 0 HA PRO B 37 35.029 9.277 -8.593 1.00 10.00 H new ATOM 0 HB2 PRO B 37 35.234 8.259 -11.450 1.00 10.00 H new ATOM 0 HB3 PRO B 37 35.373 9.907 -10.872 1.00 10.00 H new ATOM 0 HG2 PRO B 37 37.634 8.612 -11.495 1.00 10.00 H new ATOM 0 HG3 PRO B 37 37.615 9.552 -10.016 1.00 10.00 H new ATOM 0 HD2 PRO B 37 37.282 6.536 -10.343 1.00 10.00 H new ATOM 0 HD3 PRO B 37 38.218 7.399 -9.139 1.00 10.00 H new ATOM 1102 N PRO B 38 32.715 8.423 -8.790 1.00 10.00 N ATOM 1103 CA PRO B 38 31.318 7.935 -8.783 1.00 10.00 C ATOM 1104 C PRO B 38 30.725 7.712 -10.177 1.00 10.00 C ATOM 1105 O PRO B 38 30.105 6.703 -10.446 1.00 10.00 O ATOM 1106 CB PRO B 38 30.528 9.025 -8.058 1.00 10.00 C ATOM 1107 CG PRO B 38 31.557 9.617 -7.103 1.00 10.00 C ATOM 1108 CD PRO B 38 32.838 9.615 -7.936 1.00 10.00 C ATOM 0 HA PRO B 38 31.274 6.958 -8.303 1.00 10.00 H new ATOM 0 HB2 PRO B 38 30.143 9.773 -8.751 1.00 10.00 H new ATOM 0 HB3 PRO B 38 29.671 8.615 -7.524 1.00 10.00 H new ATOM 0 HG2 PRO B 38 31.282 10.623 -6.787 1.00 10.00 H new ATOM 0 HG3 PRO B 38 31.662 9.016 -6.199 1.00 10.00 H new ATOM 0 HD2 PRO B 38 32.926 10.524 -8.532 1.00 10.00 H new ATOM 0 HD3 PRO B 38 33.724 9.561 -7.303 1.00 10.00 H new ATOM 1116 N ASP B 39 31.104 8.609 -11.106 1.00 10.00 N ATOM 1117 CA ASP B 39 30.666 8.560 -12.512 1.00 10.00 C ATOM 1118 C ASP B 39 31.399 7.512 -13.370 1.00 10.00 C ATOM 1119 O ASP B 39 31.410 7.590 -14.595 1.00 10.00 O ATOM 1120 CB ASP B 39 30.792 9.974 -13.117 1.00 10.00 C ATOM 1121 CG ASP B 39 32.205 10.581 -13.082 1.00 10.00 C ATOM 1122 OD1 ASP B 39 32.962 10.267 -12.134 1.00 10.00 O ATOM 1123 OD2 ASP B 39 32.471 11.431 -13.955 1.00 10.00 O ATOM 0 H ASP B 39 31.725 9.391 -10.901 1.00 10.00 H new ATOM 0 HA ASP B 39 29.626 8.233 -12.518 1.00 10.00 H new ATOM 0 HB2 ASP B 39 30.455 9.939 -14.153 1.00 10.00 H new ATOM 0 HB3 ASP B 39 30.115 10.641 -12.584 1.00 10.00 H new ATOM 1128 N GLN B 40 32.079 6.585 -12.699 1.00 10.00 N ATOM 1129 CA GLN B 40 32.720 5.425 -13.346 1.00 10.00 C ATOM 1130 C GLN B 40 32.331 4.100 -12.654 1.00 10.00 C ATOM 1131 O GLN B 40 32.843 3.026 -12.957 1.00 10.00 O ATOM 1132 CB GLN B 40 34.233 5.647 -13.304 1.00 10.00 C ATOM 1133 CG GLN B 40 34.967 4.676 -14.238 1.00 10.00 C ATOM 1134 CD GLN B 40 36.457 4.539 -13.916 1.00 10.00 C ATOM 1135 OE1 GLN B 40 37.282 4.270 -14.777 1.00 10.00 O ATOM 1136 NE2 GLN B 40 36.819 4.701 -12.661 1.00 10.00 N ATOM 0 H GLN B 40 32.206 6.610 -11.687 1.00 10.00 H new ATOM 0 HA GLN B 40 32.379 5.342 -14.378 1.00 10.00 H new ATOM 0 HB2 GLN B 40 34.460 6.673 -13.592 1.00 10.00 H new ATOM 0 HB3 GLN B 40 34.593 5.516 -12.284 1.00 10.00 H new ATOM 0 HG2 GLN B 40 34.496 3.695 -14.174 1.00 10.00 H new ATOM 0 HG3 GLN B 40 34.854 5.017 -15.267 1.00 10.00 H new ATOM 0 HE21 GLN B 40 36.119 4.925 -11.953 1.00 10.00 H new ATOM 0 HE22 GLN B 40 37.799 4.602 -12.396 1.00 10.00 H new ATOM 1145 N GLN B 41 31.401 4.201 -11.709 1.00 10.00 N ATOM 1146 CA GLN B 41 30.925 3.049 -10.931 1.00 10.00 C ATOM 1147 C GLN B 41 29.568 2.592 -11.478 1.00 10.00 C ATOM 1148 O GLN B 41 28.682 3.394 -11.742 1.00 10.00 O ATOM 1149 CB GLN B 41 30.721 3.481 -9.479 1.00 10.00 C ATOM 1150 CG GLN B 41 31.987 4.025 -8.818 1.00 10.00 C ATOM 1151 CD GLN B 41 31.699 4.454 -7.379 1.00 10.00 C ATOM 1152 OE1 GLN B 41 30.988 3.811 -6.619 1.00 10.00 O ATOM 1153 NE2 GLN B 41 32.298 5.545 -6.967 1.00 10.00 N ATOM 0 H GLN B 41 30.953 5.082 -11.457 1.00 10.00 H new ATOM 0 HA GLN B 41 31.655 2.242 -10.998 1.00 10.00 H new ATOM 0 HB2 GLN B 41 29.945 4.245 -9.442 1.00 10.00 H new ATOM 0 HB3 GLN B 41 30.358 2.630 -8.903 1.00 10.00 H new ATOM 0 HG2 GLN B 41 32.765 3.262 -8.827 1.00 10.00 H new ATOM 0 HG3 GLN B 41 32.366 4.874 -9.388 1.00 10.00 H new ATOM 0 HE21 GLN B 41 32.889 6.075 -7.607 1.00 10.00 H new ATOM 0 HE22 GLN B 41 32.173 5.864 -6.006 1.00 10.00 H new ATOM 1162 N ARG B 42 29.471 1.272 -11.652 1.00 10.00 N ATOM 1163 CA ARG B 42 28.206 0.600 -11.994 1.00 10.00 C ATOM 1164 C ARG B 42 27.923 -0.459 -10.925 1.00 10.00 C ATOM 1165 O ARG B 42 28.675 -1.420 -10.781 1.00 10.00 O ATOM 1166 CB ARG B 42 28.291 -0.061 -13.374 1.00 10.00 C ATOM 1167 CG ARG B 42 28.422 0.978 -14.490 1.00 10.00 C ATOM 1168 CD ARG B 42 28.717 0.327 -15.843 1.00 10.00 C ATOM 1169 NE ARG B 42 27.566 -0.412 -16.390 1.00 10.00 N ATOM 1170 CZ ARG B 42 27.593 -1.119 -17.531 1.00 10.00 C ATOM 1171 NH1 ARG B 42 28.702 -1.222 -18.245 1.00 10.00 N ATOM 1172 NH2 ARG B 42 26.495 -1.685 -17.987 1.00 10.00 N ATOM 0 H ARG B 42 30.263 0.636 -11.561 1.00 10.00 H new ATOM 0 HA ARG B 42 27.402 1.335 -12.027 1.00 10.00 H new ATOM 0 HB2 ARG B 42 29.146 -0.736 -13.403 1.00 10.00 H new ATOM 0 HB3 ARG B 42 27.401 -0.667 -13.543 1.00 10.00 H new ATOM 0 HG2 ARG B 42 27.500 1.556 -14.558 1.00 10.00 H new ATOM 0 HG3 ARG B 42 29.220 1.678 -14.242 1.00 10.00 H new ATOM 0 HD2 ARG B 42 29.017 1.098 -16.553 1.00 10.00 H new ATOM 0 HD3 ARG B 42 29.561 -0.354 -15.736 1.00 10.00 H new ATOM 0 HE ARG B 42 26.691 -0.385 -15.867 1.00 10.00 H new ATOM 0 HH11 ARG B 42 29.555 -0.760 -17.931 1.00 10.00 H new ATOM 0 HH12 ARG B 42 28.704 -1.763 -19.109 1.00 10.00 H new ATOM 0 HH21 ARG B 42 25.619 -1.587 -17.473 1.00 10.00 H new ATOM 0 HH22 ARG B 42 26.520 -2.221 -18.854 1.00 10.00 H new ATOM 1186 N LEU B 43 26.920 -0.168 -10.098 1.00 10.00 N ATOM 1187 CA LEU B 43 26.557 -1.045 -8.969 1.00 10.00 C ATOM 1188 C LEU B 43 25.407 -1.988 -9.333 1.00 10.00 C ATOM 1189 O LEU B 43 24.427 -1.583 -9.942 1.00 10.00 O ATOM 1190 CB LEU B 43 26.155 -0.233 -7.737 1.00 10.00 C ATOM 1191 CG LEU B 43 27.277 0.646 -7.168 1.00 10.00 C ATOM 1192 CD1 LEU B 43 26.755 1.389 -5.943 1.00 10.00 C ATOM 1193 CD2 LEU B 43 28.505 -0.182 -6.777 1.00 10.00 C ATOM 0 H LEU B 43 26.340 0.667 -10.183 1.00 10.00 H new ATOM 0 HA LEU B 43 27.445 -1.634 -8.741 1.00 10.00 H new ATOM 0 HB2 LEU B 43 25.307 0.402 -7.995 1.00 10.00 H new ATOM 0 HB3 LEU B 43 25.816 -0.918 -6.960 1.00 10.00 H new ATOM 0 HG LEU B 43 27.583 1.350 -7.942 1.00 10.00 H new ATOM 0 HD11 LEU B 43 27.547 2.016 -5.533 1.00 10.00 H new ATOM 0 HD12 LEU B 43 25.909 2.014 -6.230 1.00 10.00 H new ATOM 0 HD13 LEU B 43 26.435 0.669 -5.190 1.00 10.00 H new ATOM 0 HD21 LEU B 43 29.276 0.477 -6.379 1.00 10.00 H new ATOM 0 HD22 LEU B 43 28.225 -0.913 -6.018 1.00 10.00 H new ATOM 0 HD23 LEU B 43 28.889 -0.701 -7.656 1.00 10.00 H new ATOM 1205 N ILE B 44 25.582 -3.242 -8.918 1.00 10.00 N ATOM 1206 CA ILE B 44 24.610 -4.316 -9.193 1.00 10.00 C ATOM 1207 C ILE B 44 24.119 -4.886 -7.859 1.00 10.00 C ATOM 1208 O ILE B 44 24.911 -5.152 -6.956 1.00 10.00 O ATOM 1209 CB ILE B 44 25.234 -5.420 -10.088 1.00 10.00 C ATOM 1210 CG1 ILE B 44 25.491 -4.940 -11.524 1.00 10.00 C ATOM 1211 CG2 ILE B 44 24.382 -6.697 -10.189 1.00 10.00 C ATOM 1212 CD1 ILE B 44 26.675 -3.983 -11.703 1.00 10.00 C ATOM 0 H ILE B 44 26.395 -3.548 -8.384 1.00 10.00 H new ATOM 0 HA ILE B 44 23.762 -3.909 -9.744 1.00 10.00 H new ATOM 0 HB ILE B 44 26.172 -5.651 -9.583 1.00 10.00 H new ATOM 0 HG12 ILE B 44 25.655 -5.813 -12.156 1.00 10.00 H new ATOM 0 HG13 ILE B 44 24.590 -4.447 -11.889 1.00 10.00 H new ATOM 0 HG21 ILE B 44 24.885 -7.420 -10.831 1.00 10.00 H new ATOM 0 HG22 ILE B 44 24.249 -7.125 -9.195 1.00 10.00 H new ATOM 0 HG23 ILE B 44 23.408 -6.452 -10.612 1.00 10.00 H new ATOM 0 HD11 ILE B 44 26.765 -3.708 -12.754 1.00 10.00 H new ATOM 0 HD12 ILE B 44 26.511 -3.086 -11.106 1.00 10.00 H new ATOM 0 HD13 ILE B 44 27.592 -4.474 -11.376 1.00 10.00 H new ATOM 1224 N PHE B 45 22.824 -5.172 -7.854 1.00 10.00 N ATOM 1225 CA PHE B 45 22.177 -5.940 -6.778 1.00 10.00 C ATOM 1226 C PHE B 45 20.907 -6.599 -7.320 1.00 10.00 C ATOM 1227 O PHE B 45 20.116 -5.955 -8.004 1.00 10.00 O ATOM 1228 CB PHE B 45 21.839 -5.021 -5.601 1.00 10.00 C ATOM 1229 CG PHE B 45 21.204 -5.811 -4.456 1.00 10.00 C ATOM 1230 CD1 PHE B 45 22.002 -6.604 -3.642 1.00 10.00 C ATOM 1231 CD2 PHE B 45 19.832 -5.747 -4.249 1.00 10.00 C ATOM 1232 CE1 PHE B 45 21.424 -7.341 -2.616 1.00 10.00 C ATOM 1233 CE2 PHE B 45 19.254 -6.476 -3.217 1.00 10.00 C ATOM 1234 CZ PHE B 45 20.051 -7.272 -2.402 1.00 10.00 C ATOM 0 H PHE B 45 22.184 -4.881 -8.593 1.00 10.00 H new ATOM 0 HA PHE B 45 22.860 -6.712 -6.424 1.00 10.00 H new ATOM 0 HB2 PHE B 45 22.744 -4.527 -5.249 1.00 10.00 H new ATOM 0 HB3 PHE B 45 21.156 -4.238 -5.930 1.00 10.00 H new ATOM 0 HD1 PHE B 45 23.069 -6.648 -3.806 1.00 10.00 H new ATOM 0 HD2 PHE B 45 19.216 -5.132 -4.889 1.00 10.00 H new ATOM 0 HE1 PHE B 45 22.039 -7.966 -1.986 1.00 10.00 H new ATOM 0 HE2 PHE B 45 18.188 -6.424 -3.048 1.00 10.00 H new ATOM 0 HZ PHE B 45 19.603 -7.839 -1.600 1.00 10.00 H new ATOM 1244 N ALA B 46 20.821 -7.910 -7.098 1.00 10.00 N ATOM 1245 CA ALA B 46 19.662 -8.739 -7.518 1.00 10.00 C ATOM 1246 C ALA B 46 19.436 -8.694 -9.043 1.00 10.00 C ATOM 1247 O ALA B 46 18.304 -8.619 -9.550 1.00 10.00 O ATOM 1248 CB ALA B 46 18.424 -8.340 -6.694 1.00 10.00 C ATOM 0 H ALA B 46 21.549 -8.441 -6.621 1.00 10.00 H new ATOM 0 HA ALA B 46 19.873 -9.787 -7.306 1.00 10.00 H new ATOM 0 HB1 ALA B 46 17.572 -8.947 -7.000 1.00 10.00 H new ATOM 0 HB2 ALA B 46 18.624 -8.503 -5.635 1.00 10.00 H new ATOM 0 HB3 ALA B 46 18.199 -7.287 -6.863 1.00 10.00 H new ATOM 1254 N GLY B 47 20.546 -8.720 -9.777 1.00 10.00 N ATOM 1255 CA GLY B 47 20.564 -8.699 -11.260 1.00 10.00 C ATOM 1256 C GLY B 47 20.021 -7.396 -11.869 1.00 10.00 C ATOM 1257 O GLY B 47 19.493 -7.392 -12.980 1.00 10.00 O ATOM 0 H GLY B 47 21.478 -8.757 -9.364 1.00 10.00 H new ATOM 0 HA2 GLY B 47 21.587 -8.851 -11.604 1.00 10.00 H new ATOM 0 HA3 GLY B 47 19.975 -9.537 -11.633 1.00 10.00 H new ATOM 1261 N LYS B 48 20.216 -6.302 -11.145 1.00 10.00 N ATOM 1262 CA LYS B 48 19.763 -4.960 -11.553 1.00 10.00 C ATOM 1263 C LYS B 48 20.911 -3.960 -11.402 1.00 10.00 C ATOM 1264 O LYS B 48 21.679 -4.022 -10.447 1.00 10.00 O ATOM 1265 CB LYS B 48 18.598 -4.520 -10.658 1.00 10.00 C ATOM 1266 CG LYS B 48 17.308 -5.291 -10.957 1.00 10.00 C ATOM 1267 CD LYS B 48 16.149 -4.818 -10.075 1.00 10.00 C ATOM 1268 CE LYS B 48 16.231 -5.329 -8.631 1.00 10.00 C ATOM 1269 NZ LYS B 48 15.981 -6.776 -8.567 1.00 10.00 N ATOM 0 H LYS B 48 20.698 -6.311 -10.246 1.00 10.00 H new ATOM 0 HA LYS B 48 19.440 -4.993 -12.593 1.00 10.00 H new ATOM 0 HB2 LYS B 48 18.871 -4.666 -9.613 1.00 10.00 H new ATOM 0 HB3 LYS B 48 18.421 -3.453 -10.795 1.00 10.00 H new ATOM 0 HG2 LYS B 48 17.042 -5.163 -12.006 1.00 10.00 H new ATOM 0 HG3 LYS B 48 17.475 -6.356 -10.798 1.00 10.00 H new ATOM 0 HD2 LYS B 48 16.131 -3.728 -10.066 1.00 10.00 H new ATOM 0 HD3 LYS B 48 15.209 -5.149 -10.516 1.00 10.00 H new ATOM 0 HE2 LYS B 48 17.216 -5.108 -8.219 1.00 10.00 H new ATOM 0 HE3 LYS B 48 15.502 -4.803 -8.014 1.00 10.00 H new ATOM 0 HZ1 LYS B 48 15.790 -7.052 -7.583 1.00 10.00 H new ATOM 0 HZ2 LYS B 48 15.159 -7.013 -9.159 1.00 10.00 H new ATOM 0 HZ3 LYS B 48 16.817 -7.288 -8.914 1.00 10.00 H new ATOM 1283 N GLN B 49 21.040 -3.098 -12.415 1.00 10.00 N ATOM 1284 CA GLN B 49 21.973 -1.960 -12.347 1.00 10.00 C ATOM 1285 C GLN B 49 21.286 -0.817 -11.597 1.00 10.00 C ATOM 1286 O GLN B 49 20.146 -0.457 -11.873 1.00 10.00 O ATOM 1287 CB GLN B 49 22.370 -1.474 -13.743 1.00 10.00 C ATOM 1288 CG GLN B 49 22.982 -2.598 -14.582 1.00 10.00 C ATOM 1289 CD GLN B 49 23.749 -2.058 -15.789 1.00 10.00 C ATOM 1290 OE1 GLN B 49 24.492 -1.086 -15.724 1.00 10.00 O ATOM 1291 NE2 GLN B 49 23.628 -2.747 -16.900 1.00 10.00 N ATOM 0 H GLN B 49 20.516 -3.162 -13.288 1.00 10.00 H new ATOM 0 HA GLN B 49 22.878 -2.281 -11.832 1.00 10.00 H new ATOM 0 HB2 GLN B 49 21.493 -1.076 -14.253 1.00 10.00 H new ATOM 0 HB3 GLN B 49 23.085 -0.656 -13.654 1.00 10.00 H new ATOM 0 HG2 GLN B 49 23.654 -3.190 -13.960 1.00 10.00 H new ATOM 0 HG3 GLN B 49 22.192 -3.267 -14.924 1.00 10.00 H new ATOM 0 HE21 GLN B 49 23.004 -3.553 -16.935 1.00 10.00 H new ATOM 0 HE22 GLN B 49 24.158 -2.476 -17.728 1.00 10.00 H new ATOM 1300 N LEU B 50 22.014 -0.280 -10.621 1.00 10.00 N ATOM 1301 CA LEU B 50 21.454 0.742 -9.729 1.00 10.00 C ATOM 1302 C LEU B 50 21.498 2.130 -10.375 1.00 10.00 C ATOM 1303 O LEU B 50 22.485 2.548 -10.959 1.00 10.00 O ATOM 1304 CB LEU B 50 22.179 0.688 -8.381 1.00 10.00 C ATOM 1305 CG LEU B 50 22.207 -0.723 -7.773 1.00 10.00 C ATOM 1306 CD1 LEU B 50 22.849 -0.673 -6.391 1.00 10.00 C ATOM 1307 CD2 LEU B 50 20.828 -1.389 -7.688 1.00 10.00 C ATOM 0 H LEU B 50 22.983 -0.530 -10.426 1.00 10.00 H new ATOM 0 HA LEU B 50 20.399 0.534 -9.551 1.00 10.00 H new ATOM 0 HB2 LEU B 50 23.202 1.043 -8.510 1.00 10.00 H new ATOM 0 HB3 LEU B 50 21.691 1.369 -7.684 1.00 10.00 H new ATOM 0 HG LEU B 50 22.799 -1.340 -8.449 1.00 10.00 H new ATOM 0 HD11 LEU B 50 22.868 -1.675 -5.962 1.00 10.00 H new ATOM 0 HD12 LEU B 50 23.868 -0.296 -6.477 1.00 10.00 H new ATOM 0 HD13 LEU B 50 22.271 -0.012 -5.745 1.00 10.00 H new ATOM 0 HD21 LEU B 50 20.930 -2.381 -7.249 1.00 10.00 H new ATOM 0 HD22 LEU B 50 20.169 -0.783 -7.067 1.00 10.00 H new ATOM 0 HD23 LEU B 50 20.404 -1.477 -8.688 1.00 10.00 H new ATOM 1319 N GLU B 51 20.370 2.826 -10.236 1.00 10.00 N ATOM 1320 CA GLU B 51 20.143 4.137 -10.846 1.00 10.00 C ATOM 1321 C GLU B 51 20.417 5.255 -9.845 1.00 10.00 C ATOM 1322 O GLU B 51 19.882 5.242 -8.743 1.00 10.00 O ATOM 1323 CB GLU B 51 18.694 4.203 -11.316 1.00 10.00 C ATOM 1324 CG GLU B 51 18.303 3.102 -12.297 1.00 10.00 C ATOM 1325 CD GLU B 51 19.079 3.184 -13.593 1.00 10.00 C ATOM 1326 OE1 GLU B 51 18.609 3.870 -14.525 1.00 10.00 O ATOM 1327 OE2 GLU B 51 20.144 2.543 -13.697 1.00 10.00 O ATOM 0 H GLU B 51 19.577 2.491 -9.689 1.00 10.00 H new ATOM 0 HA GLU B 51 20.822 4.269 -11.689 1.00 10.00 H new ATOM 0 HB2 GLU B 51 18.039 4.148 -10.446 1.00 10.00 H new ATOM 0 HB3 GLU B 51 18.520 5.171 -11.786 1.00 10.00 H new ATOM 0 HG2 GLU B 51 18.474 2.130 -11.835 1.00 10.00 H new ATOM 0 HG3 GLU B 51 17.236 3.171 -12.510 1.00 10.00 H new ATOM 1334 N ASP B 52 21.178 6.247 -10.285 1.00 10.00 N ATOM 1335 CA ASP B 52 21.656 7.336 -9.400 1.00 10.00 C ATOM 1336 C ASP B 52 20.561 8.031 -8.583 1.00 10.00 C ATOM 1337 O ASP B 52 20.714 8.174 -7.365 1.00 10.00 O ATOM 1338 CB ASP B 52 22.430 8.386 -10.206 1.00 10.00 C ATOM 1339 CG ASP B 52 23.808 7.890 -10.647 1.00 10.00 C ATOM 1340 OD1 ASP B 52 24.465 7.222 -9.819 1.00 10.00 O ATOM 1341 OD2 ASP B 52 24.136 8.148 -11.822 1.00 10.00 O ATOM 0 H ASP B 52 21.487 6.333 -11.253 1.00 10.00 H new ATOM 0 HA ASP B 52 22.307 6.842 -8.679 1.00 10.00 H new ATOM 0 HB2 ASP B 52 21.849 8.664 -11.086 1.00 10.00 H new ATOM 0 HB3 ASP B 52 22.548 9.287 -9.604 1.00 10.00 H new ATOM 1346 N GLY B 53 19.448 8.363 -9.275 1.00 10.00 N ATOM 1347 CA GLY B 53 18.302 9.050 -8.667 1.00 10.00 C ATOM 1348 C GLY B 53 17.352 8.157 -7.867 1.00 10.00 C ATOM 1349 O GLY B 53 16.267 8.606 -7.470 1.00 10.00 O ATOM 0 H GLY B 53 19.326 8.160 -10.267 1.00 10.00 H new ATOM 0 HA2 GLY B 53 18.677 9.834 -8.009 1.00 10.00 H new ATOM 0 HA3 GLY B 53 17.733 9.541 -9.457 1.00 10.00 H new ATOM 1353 N ARG B 54 17.722 6.890 -7.670 1.00 10.00 N ATOM 1354 CA ARG B 54 16.924 5.955 -6.861 1.00 10.00 C ATOM 1355 C ARG B 54 17.628 5.755 -5.522 1.00 10.00 C ATOM 1356 O ARG B 54 18.774 6.178 -5.350 1.00 10.00 O ATOM 1357 CB ARG B 54 16.743 4.600 -7.572 1.00 10.00 C ATOM 1358 CG ARG B 54 16.024 4.653 -8.933 1.00 10.00 C ATOM 1359 CD ARG B 54 14.609 5.243 -8.882 1.00 10.00 C ATOM 1360 NE ARG B 54 13.694 4.429 -8.083 1.00 10.00 N ATOM 1361 CZ ARG B 54 12.371 4.355 -8.255 1.00 10.00 C ATOM 1362 NH1 ARG B 54 11.765 4.913 -9.298 1.00 10.00 N ATOM 1363 NH2 ARG B 54 11.643 3.720 -7.356 1.00 10.00 N ATOM 0 H ARG B 54 18.572 6.483 -8.060 1.00 10.00 H new ATOM 0 HA ARG B 54 15.930 6.376 -6.711 1.00 10.00 H new ATOM 0 HB2 ARG B 54 17.726 4.152 -7.718 1.00 10.00 H new ATOM 0 HB3 ARG B 54 16.185 3.936 -6.912 1.00 10.00 H new ATOM 0 HG2 ARG B 54 16.625 5.243 -9.625 1.00 10.00 H new ATOM 0 HG3 ARG B 54 15.969 3.643 -9.340 1.00 10.00 H new ATOM 0 HD2 ARG B 54 14.653 6.250 -8.466 1.00 10.00 H new ATOM 0 HD3 ARG B 54 14.219 5.334 -9.896 1.00 10.00 H new ATOM 0 HE ARG B 54 14.100 3.871 -7.332 1.00 10.00 H new ATOM 0 HH11 ARG B 54 12.312 5.416 -9.997 1.00 10.00 H new ATOM 0 HH12 ARG B 54 10.753 4.838 -9.400 1.00 10.00 H new ATOM 0 HH21 ARG B 54 12.092 3.295 -6.545 1.00 10.00 H new ATOM 0 HH22 ARG B 54 10.632 3.655 -7.473 1.00 10.00 H new ATOM 1377 N THR B 55 16.954 5.095 -4.590 1.00 10.00 N ATOM 1378 CA THR B 55 17.502 4.864 -3.250 1.00 10.00 C ATOM 1379 C THR B 55 17.633 3.373 -2.952 1.00 10.00 C ATOM 1380 O THR B 55 17.151 2.535 -3.709 1.00 10.00 O ATOM 1381 CB THR B 55 16.611 5.481 -2.154 1.00 10.00 C ATOM 1382 OG1 THR B 55 15.264 5.036 -2.330 1.00 10.00 O ATOM 1383 CG2 THR B 55 16.662 7.015 -2.173 1.00 10.00 C ATOM 0 H THR B 55 16.022 4.706 -4.733 1.00 10.00 H new ATOM 0 HA THR B 55 18.483 5.339 -3.241 1.00 10.00 H new ATOM 0 HB THR B 55 16.989 5.152 -1.186 1.00 10.00 H new ATOM 0 HG1 THR B 55 14.992 4.503 -1.554 1.00 10.00 H new ATOM 0 HG21 THR B 55 16.021 7.410 -1.385 1.00 10.00 H new ATOM 0 HG22 THR B 55 17.687 7.347 -2.007 1.00 10.00 H new ATOM 0 HG23 THR B 55 16.315 7.379 -3.140 1.00 10.00 H new ATOM 1391 N LEU B 56 18.300 3.057 -1.841 1.00 10.00 N ATOM 1392 CA LEU B 56 18.501 1.653 -1.418 1.00 10.00 C ATOM 1393 C LEU B 56 17.184 0.904 -1.167 1.00 10.00 C ATOM 1394 O LEU B 56 16.982 -0.208 -1.651 1.00 10.00 O ATOM 1395 CB LEU B 56 19.363 1.583 -0.155 1.00 10.00 C ATOM 1396 CG LEU B 56 20.789 2.091 -0.375 1.00 10.00 C ATOM 1397 CD1 LEU B 56 21.534 2.041 0.952 1.00 10.00 C ATOM 1398 CD2 LEU B 56 21.556 1.259 -1.403 1.00 10.00 C ATOM 0 H LEU B 56 18.713 3.746 -1.213 1.00 10.00 H new ATOM 0 HA LEU B 56 19.009 1.163 -2.248 1.00 10.00 H new ATOM 0 HB2 LEU B 56 18.892 2.170 0.633 1.00 10.00 H new ATOM 0 HB3 LEU B 56 19.401 0.552 0.196 1.00 10.00 H new ATOM 0 HG LEU B 56 20.723 3.109 -0.759 1.00 10.00 H new ATOM 0 HD11 LEU B 56 22.553 2.401 0.811 1.00 10.00 H new ATOM 0 HD12 LEU B 56 21.024 2.672 1.680 1.00 10.00 H new ATOM 0 HD13 LEU B 56 21.559 1.014 1.317 1.00 10.00 H new ATOM 0 HD21 LEU B 56 22.562 1.663 -1.521 1.00 10.00 H new ATOM 0 HD22 LEU B 56 21.618 0.226 -1.062 1.00 10.00 H new ATOM 0 HD23 LEU B 56 21.036 1.295 -2.361 1.00 10.00 H new ATOM 1410 N SER B 57 16.228 1.641 -0.579 1.00 10.00 N ATOM 1411 CA SER B 57 14.880 1.128 -0.296 1.00 10.00 C ATOM 1412 C SER B 57 14.153 0.727 -1.583 1.00 10.00 C ATOM 1413 O SER B 57 13.331 -0.188 -1.575 1.00 10.00 O ATOM 1414 CB SER B 57 14.056 2.186 0.471 1.00 10.00 C ATOM 1415 OG SER B 57 13.924 3.380 -0.279 1.00 10.00 O ATOM 0 H SER B 57 16.369 2.608 -0.287 1.00 10.00 H new ATOM 0 HA SER B 57 14.985 0.237 0.323 1.00 10.00 H new ATOM 0 HB2 SER B 57 13.068 1.786 0.698 1.00 10.00 H new ATOM 0 HB3 SER B 57 14.538 2.404 1.424 1.00 10.00 H new ATOM 0 HG SER B 57 13.397 4.030 0.231 1.00 10.00 H new ATOM 1421 N ASP B 58 14.449 1.436 -2.680 1.00 10.00 N ATOM 1422 CA ASP B 58 13.801 1.192 -3.983 1.00 10.00 C ATOM 1423 C ASP B 58 14.185 -0.166 -4.582 1.00 10.00 C ATOM 1424 O ASP B 58 13.552 -0.637 -5.530 1.00 10.00 O ATOM 1425 CB ASP B 58 14.159 2.304 -4.974 1.00 10.00 C ATOM 1426 CG ASP B 58 13.617 3.652 -4.574 1.00 10.00 C ATOM 1427 OD1 ASP B 58 12.703 3.718 -3.713 1.00 10.00 O ATOM 1428 OD2 ASP B 58 14.105 4.653 -5.128 1.00 10.00 O ATOM 0 H ASP B 58 15.137 2.189 -2.694 1.00 10.00 H new ATOM 0 HA ASP B 58 12.726 1.186 -3.803 1.00 10.00 H new ATOM 0 HB2 ASP B 58 15.244 2.367 -5.063 1.00 10.00 H new ATOM 0 HB3 ASP B 58 13.773 2.042 -5.959 1.00 10.00 H new ATOM 1433 N TYR B 59 15.232 -0.781 -4.038 1.00 10.00 N ATOM 1434 CA TYR B 59 15.712 -2.087 -4.503 1.00 10.00 C ATOM 1435 C TYR B 59 15.649 -3.136 -3.385 1.00 10.00 C ATOM 1436 O TYR B 59 16.062 -4.288 -3.570 1.00 10.00 O ATOM 1437 CB TYR B 59 17.152 -1.953 -4.987 1.00 10.00 C ATOM 1438 CG TYR B 59 17.311 -1.128 -6.232 1.00 10.00 C ATOM 1439 CD1 TYR B 59 17.009 -1.662 -7.477 1.00 10.00 C ATOM 1440 CD2 TYR B 59 17.827 0.159 -6.172 1.00 10.00 C ATOM 1441 CE1 TYR B 59 17.205 -0.931 -8.631 1.00 10.00 C ATOM 1442 CE2 TYR B 59 18.016 0.898 -7.321 1.00 10.00 C ATOM 1443 CZ TYR B 59 17.716 0.342 -8.548 1.00 10.00 C ATOM 1444 OH TYR B 59 17.934 1.065 -9.692 1.00 10.00 O ATOM 0 H TYR B 59 15.772 -0.393 -3.265 1.00 10.00 H new ATOM 0 HA TYR B 59 15.067 -2.416 -5.318 1.00 10.00 H new ATOM 0 HB2 TYR B 59 17.750 -1.509 -4.192 1.00 10.00 H new ATOM 0 HB3 TYR B 59 17.555 -2.949 -5.171 1.00 10.00 H new ATOM 0 HD1 TYR B 59 16.614 -2.665 -7.544 1.00 10.00 H new ATOM 0 HD2 TYR B 59 18.084 0.587 -5.214 1.00 10.00 H new ATOM 0 HE1 TYR B 59 16.959 -1.356 -9.593 1.00 10.00 H new ATOM 0 HE2 TYR B 59 18.397 1.907 -7.261 1.00 10.00 H new ATOM 0 HH TYR B 59 17.529 1.953 -9.600 1.00 10.00 H new ATOM 1454 N ASN B 60 15.115 -2.719 -2.232 1.00 10.00 N ATOM 1455 CA ASN B 60 14.974 -3.572 -1.041 1.00 10.00 C ATOM 1456 C ASN B 60 16.341 -4.032 -0.493 1.00 10.00 C ATOM 1457 O ASN B 60 16.498 -5.139 0.029 1.00 10.00 O ATOM 1458 CB ASN B 60 14.033 -4.749 -1.325 1.00 10.00 C ATOM 1459 CG ASN B 60 13.144 -5.095 -0.141 1.00 10.00 C ATOM 1460 OD1 ASN B 60 12.827 -4.241 0.692 1.00 10.00 O ATOM 1461 ND2 ASN B 60 12.748 -6.349 -0.055 1.00 10.00 N ATOM 0 H ASN B 60 14.764 -1.771 -2.095 1.00 10.00 H new ATOM 0 HA ASN B 60 14.520 -2.972 -0.252 1.00 10.00 H new ATOM 0 HB2 ASN B 60 13.407 -4.508 -2.184 1.00 10.00 H new ATOM 0 HB3 ASN B 60 14.625 -5.623 -1.596 1.00 10.00 H new ATOM 0 HD21 ASN B 60 12.157 -6.645 0.722 1.00 10.00 H new ATOM 0 HD22 ASN B 60 13.033 -7.024 -0.765 1.00 10.00 H new ATOM 1468 N ILE B 61 17.326 -3.162 -0.651 1.00 10.00 N ATOM 1469 CA ILE B 61 18.683 -3.353 -0.102 1.00 10.00 C ATOM 1470 C ILE B 61 18.603 -3.107 1.407 1.00 10.00 C ATOM 1471 O ILE B 61 18.477 -1.974 1.862 1.00 10.00 O ATOM 1472 CB ILE B 61 19.698 -2.419 -0.793 1.00 10.00 C ATOM 1473 CG1 ILE B 61 19.722 -2.725 -2.298 1.00 10.00 C ATOM 1474 CG2 ILE B 61 21.098 -2.541 -0.162 1.00 10.00 C ATOM 1475 CD1 ILE B 61 20.597 -1.802 -3.151 1.00 10.00 C ATOM 0 H ILE B 61 17.217 -2.290 -1.168 1.00 10.00 H new ATOM 0 HA ILE B 61 19.038 -4.366 -0.290 1.00 10.00 H new ATOM 0 HB ILE B 61 19.386 -1.384 -0.650 1.00 10.00 H new ATOM 0 HG12 ILE B 61 20.066 -3.750 -2.436 1.00 10.00 H new ATOM 0 HG13 ILE B 61 18.701 -2.678 -2.676 1.00 10.00 H new ATOM 0 HG21 ILE B 61 21.787 -1.869 -0.673 1.00 10.00 H new ATOM 0 HG22 ILE B 61 21.046 -2.273 0.893 1.00 10.00 H new ATOM 0 HG23 ILE B 61 21.453 -3.567 -0.259 1.00 10.00 H new ATOM 0 HD11 ILE B 61 20.539 -2.109 -4.195 1.00 10.00 H new ATOM 0 HD12 ILE B 61 20.245 -0.775 -3.055 1.00 10.00 H new ATOM 0 HD13 ILE B 61 21.631 -1.864 -2.811 1.00 10.00 H new ATOM 1487 N GLN B 62 18.687 -4.192 2.161 1.00 10.00 N ATOM 1488 CA GLN B 62 18.596 -4.133 3.611 1.00 10.00 C ATOM 1489 C GLN B 62 19.967 -4.349 4.257 1.00 10.00 C ATOM 1490 O GLN B 62 20.990 -4.361 3.573 1.00 10.00 O ATOM 1491 CB GLN B 62 17.594 -5.188 4.099 1.00 10.00 C ATOM 1492 CG GLN B 62 16.184 -5.017 3.527 1.00 10.00 C ATOM 1493 CD GLN B 62 15.161 -5.945 4.174 1.00 10.00 C ATOM 1494 OE1 GLN B 62 13.965 -5.653 4.187 1.00 10.00 O ATOM 1495 NE2 GLN B 62 15.622 -7.055 4.731 1.00 10.00 N ATOM 0 H GLN B 62 18.819 -5.132 1.788 1.00 10.00 H new ATOM 0 HA GLN B 62 18.248 -3.142 3.904 1.00 10.00 H new ATOM 0 HB2 GLN B 62 17.965 -6.178 3.833 1.00 10.00 H new ATOM 0 HB3 GLN B 62 17.541 -5.149 5.187 1.00 10.00 H new ATOM 0 HG2 GLN B 62 15.866 -3.983 3.663 1.00 10.00 H new ATOM 0 HG3 GLN B 62 16.208 -5.204 2.453 1.00 10.00 H new ATOM 0 HE21 GLN B 62 16.620 -7.264 4.701 1.00 10.00 H new ATOM 0 HE22 GLN B 62 14.979 -7.700 5.190 1.00 10.00 H new ATOM 1504 N LYS B 63 19.980 -4.498 5.581 1.00 10.00 N ATOM 1505 CA LYS B 63 21.240 -4.719 6.316 1.00 10.00 C ATOM 1506 C LYS B 63 21.856 -6.050 5.867 1.00 10.00 C ATOM 1507 O LYS B 63 21.130 -6.994 5.571 1.00 10.00 O ATOM 1508 CB LYS B 63 20.998 -4.719 7.832 1.00 10.00 C ATOM 1509 CG LYS B 63 20.171 -5.904 8.346 1.00 10.00 C ATOM 1510 CD LYS B 63 19.934 -5.766 9.844 1.00 10.00 C ATOM 1511 CE LYS B 63 19.161 -6.970 10.380 1.00 10.00 C ATOM 1512 NZ LYS B 63 18.769 -6.720 11.772 1.00 10.00 N ATOM 0 H LYS B 63 19.146 -4.471 6.168 1.00 10.00 H new ATOM 0 HA LYS B 63 21.931 -3.906 6.093 1.00 10.00 H new ATOM 0 HB2 LYS B 63 21.962 -4.718 8.341 1.00 10.00 H new ATOM 0 HB3 LYS B 63 20.492 -3.793 8.106 1.00 10.00 H new ATOM 0 HG2 LYS B 63 19.217 -5.946 7.821 1.00 10.00 H new ATOM 0 HG3 LYS B 63 20.691 -6.839 8.137 1.00 10.00 H new ATOM 0 HD2 LYS B 63 20.889 -5.680 10.362 1.00 10.00 H new ATOM 0 HD3 LYS B 63 19.378 -4.851 10.047 1.00 10.00 H new ATOM 0 HE2 LYS B 63 18.277 -7.149 9.769 1.00 10.00 H new ATOM 0 HE3 LYS B 63 19.777 -7.867 10.320 1.00 10.00 H new ATOM 0 HZ1 LYS B 63 18.243 -7.539 12.137 1.00 10.00 H new ATOM 0 HZ2 LYS B 63 19.620 -6.569 12.351 1.00 10.00 H new ATOM 0 HZ3 LYS B 63 18.166 -5.874 11.816 1.00 10.00 H new ATOM 1526 N GLU B 64 23.189 -6.040 5.749 1.00 10.00 N ATOM 1527 CA GLU B 64 23.982 -7.237 5.385 1.00 10.00 C ATOM 1528 C GLU B 64 23.890 -7.623 3.898 1.00 10.00 C ATOM 1529 O GLU B 64 24.445 -8.644 3.493 1.00 10.00 O ATOM 1530 CB GLU B 64 23.561 -8.461 6.218 1.00 10.00 C ATOM 1531 CG GLU B 64 24.644 -8.968 7.168 1.00 10.00 C ATOM 1532 CD GLU B 64 25.176 -7.899 8.125 1.00 10.00 C ATOM 1533 OE1 GLU B 64 24.416 -6.971 8.490 1.00 10.00 O ATOM 1534 OE2 GLU B 64 26.372 -8.034 8.460 1.00 10.00 O ATOM 0 H GLU B 64 23.755 -5.206 5.902 1.00 10.00 H new ATOM 0 HA GLU B 64 25.013 -6.955 5.598 1.00 10.00 H new ATOM 0 HB2 GLU B 64 22.674 -8.205 6.798 1.00 10.00 H new ATOM 0 HB3 GLU B 64 23.278 -9.268 5.542 1.00 10.00 H new ATOM 0 HG2 GLU B 64 24.244 -9.797 7.751 1.00 10.00 H new ATOM 0 HG3 GLU B 64 25.474 -9.362 6.581 1.00 10.00 H new ATOM 1541 N SER B 65 23.256 -6.772 3.098 1.00 10.00 N ATOM 1542 CA SER B 65 23.177 -6.984 1.640 1.00 10.00 C ATOM 1543 C SER B 65 24.551 -6.729 1.026 1.00 10.00 C ATOM 1544 O SER B 65 25.313 -5.889 1.485 1.00 10.00 O ATOM 1545 CB SER B 65 22.196 -6.019 0.982 1.00 10.00 C ATOM 1546 OG SER B 65 20.862 -6.277 1.413 1.00 10.00 O ATOM 0 H SER B 65 22.787 -5.927 3.425 1.00 10.00 H new ATOM 0 HA SER B 65 22.840 -8.007 1.472 1.00 10.00 H new ATOM 0 HB2 SER B 65 22.470 -4.993 1.227 1.00 10.00 H new ATOM 0 HB3 SER B 65 22.257 -6.115 -0.102 1.00 10.00 H new ATOM 0 HG SER B 65 20.659 -5.725 2.197 1.00 10.00 H new ATOM 1552 N THR B 66 24.875 -7.543 0.018 1.00 10.00 N ATOM 1553 CA THR B 66 26.127 -7.330 -0.723 1.00 10.00 C ATOM 1554 C THR B 66 25.802 -7.056 -2.198 1.00 10.00 C ATOM 1555 O THR B 66 24.927 -7.662 -2.798 1.00 10.00 O ATOM 1556 CB THR B 66 27.190 -8.444 -0.552 1.00 10.00 C ATOM 1557 OG1 THR B 66 27.240 -9.303 -1.688 1.00 10.00 O ATOM 1558 CG2 THR B 66 27.006 -9.311 0.702 1.00 10.00 C ATOM 0 H THR B 66 24.311 -8.332 -0.299 1.00 10.00 H new ATOM 0 HA THR B 66 26.607 -6.457 -0.282 1.00 10.00 H new ATOM 0 HB THR B 66 28.127 -7.899 -0.441 1.00 10.00 H new ATOM 0 HG1 THR B 66 27.922 -9.993 -1.547 1.00 10.00 H new ATOM 0 HG21 THR B 66 27.793 -10.064 0.742 1.00 10.00 H new ATOM 0 HG22 THR B 66 27.060 -8.682 1.590 1.00 10.00 H new ATOM 0 HG23 THR B 66 26.034 -9.803 0.665 1.00 10.00 H new ATOM 1566 N LEU B 67 26.442 -5.990 -2.663 1.00 10.00 N ATOM 1567 CA LEU B 67 26.339 -5.483 -4.035 1.00 10.00 C ATOM 1568 C LEU B 67 27.665 -5.788 -4.741 1.00 10.00 C ATOM 1569 O LEU B 67 28.669 -6.125 -4.123 1.00 10.00 O ATOM 1570 CB LEU B 67 26.119 -3.961 -3.989 1.00 10.00 C ATOM 1571 CG LEU B 67 24.723 -3.480 -3.551 1.00 10.00 C ATOM 1572 CD1 LEU B 67 24.302 -3.918 -2.143 1.00 10.00 C ATOM 1573 CD2 LEU B 67 24.721 -1.952 -3.574 1.00 10.00 C ATOM 0 H LEU B 67 27.068 -5.434 -2.081 1.00 10.00 H new ATOM 0 HA LEU B 67 25.508 -5.949 -4.565 1.00 10.00 H new ATOM 0 HB2 LEU B 67 26.856 -3.530 -3.311 1.00 10.00 H new ATOM 0 HB3 LEU B 67 26.323 -3.557 -4.981 1.00 10.00 H new ATOM 0 HG LEU B 67 24.015 -3.931 -4.246 1.00 10.00 H new ATOM 0 HD11 LEU B 67 23.306 -3.532 -1.924 1.00 10.00 H new ATOM 0 HD12 LEU B 67 24.289 -5.007 -2.089 1.00 10.00 H new ATOM 0 HD13 LEU B 67 25.011 -3.527 -1.413 1.00 10.00 H new ATOM 0 HD21 LEU B 67 23.742 -1.585 -3.267 1.00 10.00 H new ATOM 0 HD22 LEU B 67 25.480 -1.577 -2.888 1.00 10.00 H new ATOM 0 HD23 LEU B 67 24.939 -1.603 -4.583 1.00 10.00 H new ATOM 1585 N HIS B 68 27.614 -5.656 -6.063 1.00 10.00 N ATOM 1586 CA HIS B 68 28.813 -5.796 -6.899 1.00 10.00 C ATOM 1587 C HIS B 68 29.114 -4.485 -7.623 1.00 10.00 C ATOM 1588 O HIS B 68 28.224 -3.695 -7.919 1.00 10.00 O ATOM 1589 CB HIS B 68 28.644 -6.946 -7.891 1.00 10.00 C ATOM 1590 CG HIS B 68 28.807 -8.292 -7.183 1.00 10.00 C ATOM 1591 ND1 HIS B 68 27.857 -8.958 -6.530 1.00 10.00 N ATOM 1592 CD2 HIS B 68 29.922 -9.015 -7.149 1.00 10.00 C ATOM 1593 CE1 HIS B 68 28.391 -10.093 -6.089 1.00 10.00 C ATOM 1594 NE2 HIS B 68 29.662 -10.129 -6.477 1.00 10.00 N ATOM 0 H HIS B 68 26.760 -5.453 -6.582 1.00 10.00 H new ATOM 0 HA HIS B 68 29.661 -6.030 -6.256 1.00 10.00 H new ATOM 0 HB2 HIS B 68 27.660 -6.890 -8.357 1.00 10.00 H new ATOM 0 HB3 HIS B 68 29.381 -6.857 -8.689 1.00 10.00 H new ATOM 0 HD1 HIS B 68 26.893 -8.653 -6.393 1.00 10.00 H new ATOM 0 HD2 HIS B 68 30.870 -8.744 -7.590 1.00 10.00 H new ATOM 0 HE1 HIS B 68 27.881 -10.853 -5.516 1.00 10.00 H new ATOM 1603 N LEU B 69 30.416 -4.292 -7.828 1.00 10.00 N ATOM 1604 CA LEU B 69 30.947 -3.113 -8.519 1.00 10.00 C ATOM 1605 C LEU B 69 31.643 -3.545 -9.815 1.00 10.00 C ATOM 1606 O LEU B 69 32.508 -4.408 -9.823 1.00 10.00 O ATOM 1607 CB LEU B 69 31.941 -2.403 -7.589 1.00 10.00 C ATOM 1608 CG LEU B 69 32.654 -1.211 -8.244 1.00 10.00 C ATOM 1609 CD1 LEU B 69 31.675 -0.096 -8.607 1.00 10.00 C ATOM 1610 CD2 LEU B 69 33.750 -0.684 -7.323 1.00 10.00 C ATOM 0 H LEU B 69 31.134 -4.947 -7.521 1.00 10.00 H new ATOM 0 HA LEU B 69 30.137 -2.430 -8.773 1.00 10.00 H new ATOM 0 HB2 LEU B 69 31.411 -2.056 -6.702 1.00 10.00 H new ATOM 0 HB3 LEU B 69 32.688 -3.122 -7.253 1.00 10.00 H new ATOM 0 HG LEU B 69 33.107 -1.561 -9.172 1.00 10.00 H new ATOM 0 HD11 LEU B 69 32.218 0.729 -9.068 1.00 10.00 H new ATOM 0 HD12 LEU B 69 30.932 -0.478 -9.307 1.00 10.00 H new ATOM 0 HD13 LEU B 69 31.175 0.257 -7.705 1.00 10.00 H new ATOM 0 HD21 LEU B 69 34.249 0.161 -7.798 1.00 10.00 H new ATOM 0 HD22 LEU B 69 33.309 -0.362 -6.380 1.00 10.00 H new ATOM 0 HD23 LEU B 69 34.476 -1.474 -7.133 1.00 10.00 H new ATOM 1622 N VAL B 70 31.257 -2.849 -10.908 1.00 10.00 N ATOM 1623 CA VAL B 70 31.887 -3.010 -12.200 1.00 10.00 C ATOM 1624 C VAL B 70 32.532 -1.649 -12.511 1.00 10.00 C ATOM 1625 O VAL B 70 31.918 -0.591 -12.284 1.00 10.00 O ATOM 1626 CB VAL B 70 30.829 -3.401 -13.297 1.00 10.00 C ATOM 1627 CG1 VAL B 70 31.430 -3.369 -14.711 1.00 10.00 C ATOM 1628 CG2 VAL B 70 30.191 -4.763 -12.989 1.00 10.00 C ATOM 0 H VAL B 70 30.500 -2.166 -10.900 1.00 10.00 H new ATOM 0 HA VAL B 70 32.625 -3.812 -12.193 1.00 10.00 H new ATOM 0 HB VAL B 70 30.040 -2.649 -13.270 1.00 10.00 H new ATOM 0 HG11 VAL B 70 30.666 -3.645 -15.437 1.00 10.00 H new ATOM 0 HG12 VAL B 70 31.792 -2.365 -14.930 1.00 10.00 H new ATOM 0 HG13 VAL B 70 32.259 -4.075 -14.770 1.00 10.00 H new ATOM 0 HG21 VAL B 70 29.464 -5.008 -13.763 1.00 10.00 H new ATOM 0 HG22 VAL B 70 30.965 -5.530 -12.963 1.00 10.00 H new ATOM 0 HG23 VAL B 70 29.690 -4.720 -12.022 1.00 10.00 H new ATOM 1638 N LEU B 71 33.753 -1.678 -13.022 1.00 10.00 N ATOM 1639 CA LEU B 71 34.505 -0.459 -13.273 1.00 10.00 C ATOM 1640 C LEU B 71 34.299 0.009 -14.718 1.00 10.00 C ATOM 1641 O LEU B 71 34.698 -0.676 -15.659 1.00 10.00 O ATOM 1642 CB LEU B 71 35.997 -0.692 -12.989 1.00 10.00 C ATOM 1643 CG LEU B 71 36.681 0.456 -12.261 1.00 10.00 C ATOM 1644 CD1 LEU B 71 36.528 0.260 -10.742 1.00 10.00 C ATOM 1645 CD2 LEU B 71 38.180 0.653 -12.728 1.00 10.00 C ATOM 0 H LEU B 71 34.245 -2.536 -13.272 1.00 10.00 H new ATOM 0 HA LEU B 71 34.141 0.322 -12.605 1.00 10.00 H new ATOM 0 HB2 LEU B 71 36.105 -1.599 -12.395 1.00 10.00 H new ATOM 0 HB3 LEU B 71 36.512 -0.866 -13.934 1.00 10.00 H new ATOM 0 HG LEU B 71 36.189 1.392 -12.525 1.00 10.00 H new ATOM 0 HD11 LEU B 71 37.017 1.081 -10.218 1.00 10.00 H new ATOM 0 HD12 LEU B 71 35.470 0.243 -10.482 1.00 10.00 H new ATOM 0 HD13 LEU B 71 36.989 -0.683 -10.449 1.00 10.00 H new ATOM 0 HD21 LEU B 71 38.626 1.483 -12.180 1.00 10.00 H new ATOM 0 HD22 LEU B 71 38.746 -0.257 -12.530 1.00 10.00 H new ATOM 0 HD23 LEU B 71 38.203 0.869 -13.796 1.00 10.00 H new TER 1657 LEU B 71 HETATM 1658 ZN ZN A 63 6.185 3.135 -6.992 1.00 10.00 ZN