USER MOD reduce.3.24.130724 H: found=0, std=0, add=1218, rem=0, adj=47 USER MOD reduce.3.24.130724 removed 1218 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 141 SER OG : rot -115:sc= 1.24 USER MOD Set 1.2: A 144 ASN :FLIP amide:sc= 0 F(o=0.52,f=1.2) USER MOD Set 2.1: A 78 LYS NZ :NH3+ -176:sc= 1.66 (180deg=0.536) USER MOD Set 2.2: A 120 THR OG1 : rot 70:sc= 2.09 USER MOD Set 3.1: A 93 TYR OH : rot 14:sc= 0.809 USER MOD Set 3.2: A 98 MET CE :methyl -165:sc= -1.08 (180deg=-0.462) USER MOD Set 3.3: A 121 HIS : no HE2:sc= 0.155 K(o=-0.11,f=-0.76) USER MOD Set 4.1: A 80 GLN : amide:sc= 0.646 K(o=1.3,f=0.35) USER MOD Set 4.2: A 115 TYR OH : rot 180:sc= 0.689 USER MOD Set 5.1: A 41 THR OG1 : rot -66:sc= 0.642 USER MOD Set 5.2: A 43 SER OG : rot 158:sc= 1.28 USER MOD Single : A 1 ALA N :NH3+ -118:sc= 0.154 (180deg=0) USER MOD Single : A 2 THR OG1 : rot 19:sc= 0.946 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 HIS : no HE2:sc= -0.245 K(o=-0.24,f=-7.7!) USER MOD Single : A 9 LYS NZ :NH3+ 179:sc= 1.19 (180deg=1.12) USER MOD Single : A 13 THR OG1 : rot 180:sc=-0.00881 USER MOD Single : A 16 LYS NZ :NH3+ 171:sc=-0.00638 (180deg=-0.0984) USER MOD Single : A 22 THR OG1 : rot 42:sc= -0.0452 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 MET CE :methyl 177:sc= -0.05 (180deg=-0.0663) USER MOD Single : A 27 TYR OH : rot 166:sc= -0.485 USER MOD Single : A 28 LYS NZ :NH3+ -171:sc=-0.00497 (180deg=-0.0754) USER MOD Single : A 30 GLN :FLIP amide:sc= -0.406 F(o=-1.2!,f=-0.41) USER MOD Single : A 32 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0332) USER MOD Single : A 46 HIS : no HD1:sc= 0 X(o=0,f=-0.0039) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ 144:sc= 0 (180deg=-0.687) USER MOD Single : A 53 LYS NZ :NH3+ -174:sc= 1.1 (180deg=0.886) USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot -124:sc= 1.34 USER MOD Single : A 62 THR OG1 : rot -166:sc= 0.678 USER MOD Single : A 63 LYS NZ :NH3+ -148:sc= 1.02 (180deg=0.933) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 MET CE :methyl 162:sc= -0.184 (180deg=-0.675) USER MOD Single : A 68 ASN : amide:sc=-0.00315 K(o=-0.0032,f=-0.76) USER MOD Single : A 70 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0482) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0.946 (180deg=0.946) USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 LYS NZ :NH3+ -162:sc= -0.0602 (180deg=-0.384) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 TYR OH : rot -161:sc= 1.62 USER MOD Single : A 97 LYS NZ :NH3+ 167:sc= 1.09 (180deg=0.373) USER MOD Single : A 100 ASN : amide:sc= 0.262 K(o=0.26,f=-6.5!) USER MOD Single : A 106 GLN :FLIP amide:sc= -0.277 F(o=-1.1,f=-0.28) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 TYR OH : rot 180:sc= 0 USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 ASN : amide:sc= 1.52 K(o=1.5,f=-9.5!) USER MOD Single : A 119 ASN :FLIP amide:sc= -0.0545 F(o=-1.1,f=-0.055) USER MOD Single : A 123 GLN : amide:sc= 0.385 K(o=0.39,f=-0.42) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 SER OG : rot 95:sc= 1.31 USER MOD Single : A 131 GLN :FLIP amide:sc= 0 F(o=-0.86,f=0) USER MOD Single : A 133 LYS NZ :NH3+ 135:sc= 1.28 (180deg=0.266) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 LYS NZ :NH3+ 173:sc= 1.17 (180deg=1.09) USER MOD Single : A 138 ASN : amide:sc= -0.0409 X(o=-0.041,f=-0.021) USER MOD Single : A 147 SER OG : rot 180:sc= 0 USER MOD Single : A 149 GLN : amide:sc= 0 K(o=0,f=-0.93) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -9.146 -32.802 11.493 1.00 0.00 N ATOM 2 CA ALA A 1 -9.162 -32.316 10.113 1.00 0.00 C ATOM 3 C ALA A 1 -9.850 -30.972 10.061 1.00 0.00 C ATOM 4 O ALA A 1 -10.441 -30.548 11.049 1.00 0.00 O ATOM 5 CB ALA A 1 -9.878 -33.302 9.200 1.00 0.00 C ATOM 0 H1 ALA A 1 -8.162 -32.904 11.814 1.00 0.00 H new ATOM 0 H2 ALA A 1 -9.642 -32.124 12.106 1.00 0.00 H new ATOM 0 H3 ALA A 1 -9.623 -33.725 11.542 1.00 0.00 H new ATOM 0 HA ALA A 1 -8.134 -32.215 9.766 1.00 0.00 H new ATOM 0 HB1 ALA A 1 -9.877 -32.919 8.179 1.00 0.00 H new ATOM 0 HB2 ALA A 1 -9.364 -34.263 9.228 1.00 0.00 H new ATOM 0 HB3 ALA A 1 -10.906 -33.431 9.538 1.00 0.00 H new ATOM 13 N THR A 2 -9.782 -30.319 8.908 1.00 0.00 N ATOM 14 CA THR A 2 -10.401 -29.013 8.655 1.00 0.00 C ATOM 15 C THR A 2 -9.925 -27.902 9.604 1.00 0.00 C ATOM 16 O THR A 2 -10.489 -27.680 10.688 1.00 0.00 O ATOM 17 CB THR A 2 -11.968 -29.057 8.533 1.00 0.00 C ATOM 18 OG1 THR A 2 -12.583 -29.676 9.683 1.00 0.00 O ATOM 19 CG2 THR A 2 -12.389 -29.805 7.273 1.00 0.00 C ATOM 0 H THR A 2 -9.283 -30.688 8.098 1.00 0.00 H new ATOM 0 HA THR A 2 -10.033 -28.742 7.665 1.00 0.00 H new ATOM 0 HB THR A 2 -12.309 -28.023 8.478 1.00 0.00 H new ATOM 0 HG1 THR A 2 -11.949 -29.680 10.430 1.00 0.00 H new ATOM 0 HG21 THR A 2 -13.477 -29.824 7.208 1.00 0.00 H new ATOM 0 HG22 THR A 2 -11.982 -29.300 6.397 1.00 0.00 H new ATOM 0 HG23 THR A 2 -12.010 -30.826 7.312 1.00 0.00 H new ATOM 27 N SER A 3 -8.864 -27.267 9.213 1.00 0.00 N ATOM 28 CA SER A 3 -8.302 -26.164 9.924 1.00 0.00 C ATOM 29 C SER A 3 -8.126 -25.009 8.935 1.00 0.00 C ATOM 30 O SER A 3 -7.416 -25.146 7.916 1.00 0.00 O ATOM 31 CB SER A 3 -6.960 -26.587 10.537 1.00 0.00 C ATOM 32 OG SER A 3 -7.118 -27.747 11.371 1.00 0.00 O ATOM 0 H SER A 3 -8.351 -27.510 8.365 1.00 0.00 H new ATOM 0 HA SER A 3 -8.953 -25.843 10.738 1.00 0.00 H new ATOM 0 HB2 SER A 3 -6.244 -26.800 9.743 1.00 0.00 H new ATOM 0 HB3 SER A 3 -6.549 -25.766 11.124 1.00 0.00 H new ATOM 0 HG SER A 3 -6.250 -27.999 11.749 1.00 0.00 H new ATOM 38 N THR A 4 -8.784 -23.911 9.205 1.00 0.00 N ATOM 39 CA THR A 4 -8.782 -22.775 8.327 1.00 0.00 C ATOM 40 C THR A 4 -7.485 -21.982 8.482 1.00 0.00 C ATOM 41 O THR A 4 -7.210 -21.393 9.545 1.00 0.00 O ATOM 42 CB THR A 4 -9.992 -21.875 8.640 1.00 0.00 C ATOM 43 OG1 THR A 4 -11.185 -22.681 8.644 1.00 0.00 O ATOM 44 CG2 THR A 4 -10.139 -20.777 7.595 1.00 0.00 C ATOM 0 H THR A 4 -9.341 -23.782 10.050 1.00 0.00 H new ATOM 0 HA THR A 4 -8.851 -23.126 7.297 1.00 0.00 H new ATOM 0 HB THR A 4 -9.839 -21.410 9.614 1.00 0.00 H new ATOM 0 HG1 THR A 4 -11.961 -22.116 8.844 1.00 0.00 H new ATOM 0 HG21 THR A 4 -11.001 -20.155 7.839 1.00 0.00 H new ATOM 0 HG22 THR A 4 -9.239 -20.162 7.584 1.00 0.00 H new ATOM 0 HG23 THR A 4 -10.283 -21.227 6.613 1.00 0.00 H new ATOM 52 N LYS A 5 -6.665 -22.017 7.459 1.00 0.00 N ATOM 53 CA LYS A 5 -5.429 -21.277 7.466 1.00 0.00 C ATOM 54 C LYS A 5 -5.717 -19.808 7.322 1.00 0.00 C ATOM 55 O LYS A 5 -6.608 -19.413 6.538 1.00 0.00 O ATOM 56 CB LYS A 5 -4.519 -21.686 6.323 1.00 0.00 C ATOM 57 CG LYS A 5 -4.036 -23.119 6.340 1.00 0.00 C ATOM 58 CD LYS A 5 -3.232 -23.414 5.080 1.00 0.00 C ATOM 59 CE LYS A 5 -1.990 -22.527 4.963 1.00 0.00 C ATOM 60 NZ LYS A 5 -1.341 -22.663 3.649 1.00 0.00 N ATOM 0 H LYS A 5 -6.834 -22.553 6.608 1.00 0.00 H new ATOM 0 HA LYS A 5 -4.931 -21.491 8.412 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -5.046 -21.512 5.385 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -3.648 -21.030 6.325 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -3.421 -23.293 7.223 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -4.887 -23.797 6.405 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -2.929 -24.461 5.082 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -3.865 -23.267 4.205 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -2.271 -21.486 5.123 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -1.280 -22.790 5.747 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -0.504 -22.047 3.610 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -1.050 -23.651 3.506 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -2.009 -22.387 2.901 1.00 0.00 H new ATOM 74 N LYS A 6 -5.002 -19.009 8.057 1.00 0.00 N ATOM 75 CA LYS A 6 -5.127 -17.601 7.940 1.00 0.00 C ATOM 76 C LYS A 6 -4.343 -17.150 6.720 1.00 0.00 C ATOM 77 O LYS A 6 -3.164 -17.511 6.560 1.00 0.00 O ATOM 78 CB LYS A 6 -4.653 -16.868 9.227 1.00 0.00 C ATOM 79 CG LYS A 6 -3.174 -17.052 9.583 1.00 0.00 C ATOM 80 CD LYS A 6 -2.773 -16.265 10.830 1.00 0.00 C ATOM 81 CE LYS A 6 -3.430 -16.801 12.098 1.00 0.00 C ATOM 82 NZ LYS A 6 -3.006 -16.043 13.293 1.00 0.00 N ATOM 0 H LYS A 6 -4.321 -19.321 8.749 1.00 0.00 H new ATOM 0 HA LYS A 6 -6.178 -17.342 7.817 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -4.851 -15.802 9.111 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -5.257 -17.215 10.065 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -2.971 -18.111 9.744 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -2.558 -16.733 8.742 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -1.690 -16.299 10.944 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -3.046 -15.218 10.698 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -4.514 -16.746 11.998 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -3.174 -17.853 12.224 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -3.472 -16.435 14.136 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -1.974 -16.116 13.402 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -3.273 -15.044 13.183 1.00 0.00 H new ATOM 96 N LEU A 7 -5.021 -16.426 5.856 1.00 0.00 N ATOM 97 CA LEU A 7 -4.468 -15.861 4.649 1.00 0.00 C ATOM 98 C LEU A 7 -4.258 -16.874 3.523 1.00 0.00 C ATOM 99 O LEU A 7 -3.763 -17.995 3.718 1.00 0.00 O ATOM 100 CB LEU A 7 -3.246 -14.968 4.907 1.00 0.00 C ATOM 101 CG LEU A 7 -3.535 -13.583 5.525 1.00 0.00 C ATOM 102 CD1 LEU A 7 -4.171 -13.687 6.894 1.00 0.00 C ATOM 103 CD2 LEU A 7 -2.277 -12.782 5.612 1.00 0.00 C ATOM 0 H LEU A 7 -6.009 -16.208 5.982 1.00 0.00 H new ATOM 0 HA LEU A 7 -5.243 -15.195 4.271 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -2.564 -15.503 5.568 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -2.724 -14.820 3.962 1.00 0.00 H new ATOM 0 HG LEU A 7 -4.246 -13.082 4.868 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -4.355 -12.687 7.287 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -5.115 -14.226 6.816 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -3.502 -14.223 7.566 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -2.495 -11.808 6.050 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -1.554 -13.307 6.237 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -1.862 -12.646 4.613 1.00 0.00 H new ATOM 115 N HIS A 8 -4.690 -16.482 2.347 1.00 0.00 N ATOM 116 CA HIS A 8 -4.623 -17.324 1.162 1.00 0.00 C ATOM 117 C HIS A 8 -4.578 -16.469 -0.101 1.00 0.00 C ATOM 118 O HIS A 8 -5.387 -15.548 -0.245 1.00 0.00 O ATOM 119 CB HIS A 8 -5.846 -18.292 1.107 1.00 0.00 C ATOM 120 CG HIS A 8 -7.198 -17.616 1.085 1.00 0.00 C ATOM 121 ND1 HIS A 8 -7.975 -17.507 -0.045 1.00 0.00 N ATOM 122 CD2 HIS A 8 -7.903 -17.024 2.071 1.00 0.00 C ATOM 123 CE1 HIS A 8 -9.089 -16.882 0.246 1.00 0.00 C ATOM 124 NE2 HIS A 8 -9.071 -16.580 1.521 1.00 0.00 N ATOM 0 H HIS A 8 -5.102 -15.564 2.178 1.00 0.00 H new ATOM 0 HA HIS A 8 -3.710 -17.916 1.218 1.00 0.00 H new ATOM 0 HB2 HIS A 8 -5.755 -18.917 0.219 1.00 0.00 H new ATOM 0 HB3 HIS A 8 -5.803 -18.956 1.970 1.00 0.00 H new ATOM 0 HD1 HIS A 8 -7.722 -17.859 -0.968 1.00 0.00 H new ATOM 0 HD2 HIS A 8 -7.600 -16.921 3.102 1.00 0.00 H new ATOM 0 HE1 HIS A 8 -9.886 -16.655 -0.447 1.00 0.00 H new ATOM 133 N LYS A 9 -3.640 -16.756 -0.992 1.00 0.00 N ATOM 134 CA LYS A 9 -3.553 -16.047 -2.261 1.00 0.00 C ATOM 135 C LYS A 9 -4.500 -16.596 -3.283 1.00 0.00 C ATOM 136 O LYS A 9 -4.649 -17.812 -3.435 1.00 0.00 O ATOM 137 CB LYS A 9 -2.153 -16.052 -2.877 1.00 0.00 C ATOM 138 CG LYS A 9 -1.310 -14.831 -2.556 1.00 0.00 C ATOM 139 CD LYS A 9 -0.745 -14.831 -1.166 1.00 0.00 C ATOM 140 CE LYS A 9 0.239 -15.960 -0.938 1.00 0.00 C ATOM 141 NZ LYS A 9 0.820 -15.875 0.400 1.00 0.00 N ATOM 0 H LYS A 9 -2.928 -17.475 -0.860 1.00 0.00 H new ATOM 0 HA LYS A 9 -3.820 -15.022 -2.005 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -1.624 -16.941 -2.534 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -2.248 -16.135 -3.960 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -0.490 -14.770 -3.271 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -1.918 -13.936 -2.691 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -0.249 -13.878 -0.979 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -1.560 -14.913 -0.446 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -0.265 -16.919 -1.061 1.00 0.00 H new ATOM 0 HE3 LYS A 9 1.030 -15.917 -1.687 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 1.479 -16.667 0.543 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 1.333 -14.976 0.499 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 0.062 -15.922 1.111 1.00 0.00 H new ATOM 155 N GLU A 10 -5.130 -15.705 -3.963 1.00 0.00 N ATOM 156 CA GLU A 10 -5.976 -15.999 -5.078 1.00 0.00 C ATOM 157 C GLU A 10 -5.437 -15.145 -6.237 1.00 0.00 C ATOM 158 O GLU A 10 -5.134 -13.970 -6.024 1.00 0.00 O ATOM 159 CB GLU A 10 -7.424 -15.591 -4.769 1.00 0.00 C ATOM 160 CG GLU A 10 -8.049 -16.214 -3.515 1.00 0.00 C ATOM 161 CD GLU A 10 -8.135 -17.722 -3.540 1.00 0.00 C ATOM 162 OE1 GLU A 10 -8.705 -18.298 -4.506 1.00 0.00 O ATOM 163 OE2 GLU A 10 -7.715 -18.364 -2.544 1.00 0.00 O ATOM 0 H GLU A 10 -5.071 -14.708 -3.754 1.00 0.00 H new ATOM 0 HA GLU A 10 -5.975 -17.063 -5.313 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -7.460 -14.506 -4.667 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -8.044 -15.852 -5.627 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -7.466 -15.910 -2.645 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -9.052 -15.808 -3.384 1.00 0.00 H new ATOM 170 N PRO A 11 -5.251 -15.707 -7.437 1.00 0.00 N ATOM 171 CA PRO A 11 -4.693 -14.958 -8.581 1.00 0.00 C ATOM 172 C PRO A 11 -5.666 -13.910 -9.161 1.00 0.00 C ATOM 173 O PRO A 11 -6.899 -14.093 -9.140 1.00 0.00 O ATOM 174 CB PRO A 11 -4.406 -16.047 -9.611 1.00 0.00 C ATOM 175 CG PRO A 11 -5.369 -17.129 -9.284 1.00 0.00 C ATOM 176 CD PRO A 11 -5.546 -17.105 -7.789 1.00 0.00 C ATOM 0 HA PRO A 11 -3.817 -14.380 -8.286 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -4.551 -15.680 -10.627 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -3.376 -16.398 -9.542 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -6.321 -16.967 -9.790 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -4.992 -18.097 -9.615 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -6.558 -17.388 -7.499 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -4.866 -17.797 -7.292 1.00 0.00 H new ATOM 184 N ALA A 12 -5.107 -12.830 -9.669 1.00 0.00 N ATOM 185 CA ALA A 12 -5.848 -11.735 -10.244 1.00 0.00 C ATOM 186 C ALA A 12 -5.005 -11.026 -11.306 1.00 0.00 C ATOM 187 O ALA A 12 -3.828 -11.350 -11.505 1.00 0.00 O ATOM 188 CB ALA A 12 -6.237 -10.756 -9.153 1.00 0.00 C ATOM 0 H ALA A 12 -4.097 -12.690 -9.692 1.00 0.00 H new ATOM 0 HA ALA A 12 -6.749 -12.125 -10.717 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -6.797 -9.929 -9.589 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -6.856 -11.263 -8.413 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -5.338 -10.371 -8.672 1.00 0.00 H new ATOM 194 N THR A 13 -5.618 -10.106 -12.012 1.00 0.00 N ATOM 195 CA THR A 13 -4.953 -9.299 -13.024 1.00 0.00 C ATOM 196 C THR A 13 -5.568 -7.891 -12.967 1.00 0.00 C ATOM 197 O THR A 13 -6.759 -7.777 -12.747 1.00 0.00 O ATOM 198 CB THR A 13 -5.183 -9.932 -14.415 1.00 0.00 C ATOM 199 OG1 THR A 13 -4.777 -11.310 -14.355 1.00 0.00 O ATOM 200 CG2 THR A 13 -4.370 -9.223 -15.497 1.00 0.00 C ATOM 0 H THR A 13 -6.609 -9.889 -11.903 1.00 0.00 H new ATOM 0 HA THR A 13 -3.879 -9.247 -12.845 1.00 0.00 H new ATOM 0 HB THR A 13 -6.238 -9.839 -14.671 1.00 0.00 H new ATOM 0 HG1 THR A 13 -4.917 -11.731 -15.229 1.00 0.00 H new ATOM 0 HG21 THR A 13 -4.557 -9.696 -16.461 1.00 0.00 H new ATOM 0 HG22 THR A 13 -4.663 -8.174 -15.544 1.00 0.00 H new ATOM 0 HG23 THR A 13 -3.309 -9.293 -15.259 1.00 0.00 H new ATOM 208 N LEU A 14 -4.782 -6.837 -13.128 1.00 0.00 N ATOM 209 CA LEU A 14 -5.320 -5.482 -12.974 1.00 0.00 C ATOM 210 C LEU A 14 -6.145 -5.065 -14.171 1.00 0.00 C ATOM 211 O LEU A 14 -5.770 -5.326 -15.317 1.00 0.00 O ATOM 212 CB LEU A 14 -4.221 -4.433 -12.772 1.00 0.00 C ATOM 213 CG LEU A 14 -4.743 -3.007 -12.523 1.00 0.00 C ATOM 214 CD1 LEU A 14 -5.308 -2.854 -11.119 1.00 0.00 C ATOM 215 CD2 LEU A 14 -3.699 -1.953 -12.832 1.00 0.00 C ATOM 0 H LEU A 14 -3.790 -6.884 -13.360 1.00 0.00 H new ATOM 0 HA LEU A 14 -5.947 -5.524 -12.083 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -3.600 -4.732 -11.928 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -3.578 -4.423 -13.652 1.00 0.00 H new ATOM 0 HG LEU A 14 -5.565 -2.844 -13.220 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -5.667 -1.834 -10.980 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -6.134 -3.551 -10.981 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -4.528 -3.067 -10.388 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -4.114 -0.963 -12.641 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -2.826 -2.109 -12.198 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -3.405 -2.028 -13.879 1.00 0.00 H new ATOM 227 N ILE A 15 -7.263 -4.433 -13.905 1.00 0.00 N ATOM 228 CA ILE A 15 -8.056 -3.844 -14.944 1.00 0.00 C ATOM 229 C ILE A 15 -7.771 -2.354 -14.947 1.00 0.00 C ATOM 230 O ILE A 15 -7.290 -1.820 -15.935 1.00 0.00 O ATOM 231 CB ILE A 15 -9.572 -4.129 -14.760 1.00 0.00 C ATOM 232 CG1 ILE A 15 -9.823 -5.638 -14.880 1.00 0.00 C ATOM 233 CG2 ILE A 15 -10.406 -3.359 -15.788 1.00 0.00 C ATOM 234 CD1 ILE A 15 -11.259 -6.048 -14.704 1.00 0.00 C ATOM 0 H ILE A 15 -7.643 -4.316 -12.966 1.00 0.00 H new ATOM 0 HA ILE A 15 -7.788 -4.286 -15.903 1.00 0.00 H new ATOM 0 HB ILE A 15 -9.877 -3.790 -13.770 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -9.480 -5.974 -15.859 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -9.217 -6.154 -14.135 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -11.463 -3.577 -15.636 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -10.235 -2.289 -15.667 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -10.114 -3.662 -16.794 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -11.343 -7.130 -14.805 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -11.605 -5.748 -13.715 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -11.871 -5.564 -15.465 1.00 0.00 H new ATOM 246 N LYS A 16 -8.033 -1.698 -13.819 1.00 0.00 N ATOM 247 CA LYS A 16 -7.712 -0.294 -13.640 1.00 0.00 C ATOM 248 C LYS A 16 -7.445 -0.011 -12.189 1.00 0.00 C ATOM 249 O LYS A 16 -8.186 -0.471 -11.306 1.00 0.00 O ATOM 250 CB LYS A 16 -8.815 0.654 -14.173 1.00 0.00 C ATOM 251 CG LYS A 16 -8.789 0.869 -15.682 1.00 0.00 C ATOM 252 CD LYS A 16 -9.903 1.785 -16.145 1.00 0.00 C ATOM 253 CE LYS A 16 -9.763 2.127 -17.626 1.00 0.00 C ATOM 254 NZ LYS A 16 -9.767 0.929 -18.493 1.00 0.00 N ATOM 0 H LYS A 16 -8.474 -2.129 -13.007 1.00 0.00 H new ATOM 0 HA LYS A 16 -6.817 -0.096 -14.230 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -9.789 0.252 -13.893 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -8.715 1.621 -13.679 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -7.827 1.293 -15.971 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -8.878 -0.093 -16.187 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -10.866 1.306 -15.970 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -9.891 2.702 -15.556 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -10.580 2.786 -17.921 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -8.836 2.679 -17.781 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -9.823 1.222 -19.489 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -8.893 0.387 -18.340 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -10.588 0.335 -18.260 1.00 0.00 H new ATOM 268 N ALA A 17 -6.374 0.681 -11.926 1.00 0.00 N ATOM 269 CA ALA A 17 -6.073 1.083 -10.586 1.00 0.00 C ATOM 270 C ALA A 17 -6.934 2.275 -10.279 1.00 0.00 C ATOM 271 O ALA A 17 -6.952 3.243 -11.041 1.00 0.00 O ATOM 272 CB ALA A 17 -4.597 1.416 -10.426 1.00 0.00 C ATOM 0 H ALA A 17 -5.694 0.978 -12.625 1.00 0.00 H new ATOM 0 HA ALA A 17 -6.280 0.270 -9.890 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -4.402 1.718 -9.397 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -3.998 0.538 -10.667 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -4.333 2.231 -11.099 1.00 0.00 H new ATOM 278 N ILE A 18 -7.672 2.199 -9.223 1.00 0.00 N ATOM 279 CA ILE A 18 -8.591 3.251 -8.885 1.00 0.00 C ATOM 280 C ILE A 18 -7.841 4.356 -8.169 1.00 0.00 C ATOM 281 O ILE A 18 -7.975 5.536 -8.497 1.00 0.00 O ATOM 282 CB ILE A 18 -9.751 2.719 -7.994 1.00 0.00 C ATOM 283 CG1 ILE A 18 -10.503 1.562 -8.690 1.00 0.00 C ATOM 284 CG2 ILE A 18 -10.714 3.835 -7.612 1.00 0.00 C ATOM 285 CD1 ILE A 18 -11.131 1.925 -10.027 1.00 0.00 C ATOM 0 H ILE A 18 -7.661 1.416 -8.570 1.00 0.00 H new ATOM 0 HA ILE A 18 -9.032 3.641 -9.802 1.00 0.00 H new ATOM 0 HB ILE A 18 -9.307 2.332 -7.077 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -9.809 0.736 -8.843 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -11.286 1.202 -8.022 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -11.512 3.430 -6.990 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -10.177 4.605 -7.058 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -11.143 4.270 -8.515 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -11.636 1.052 -10.441 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -11.853 2.728 -9.883 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -10.354 2.255 -10.716 1.00 0.00 H new ATOM 297 N ASP A 19 -7.024 3.963 -7.226 1.00 0.00 N ATOM 298 CA ASP A 19 -6.253 4.884 -6.441 1.00 0.00 C ATOM 299 C ASP A 19 -5.124 4.094 -5.777 1.00 0.00 C ATOM 300 O ASP A 19 -4.812 3.001 -6.238 1.00 0.00 O ATOM 301 CB ASP A 19 -7.166 5.563 -5.411 1.00 0.00 C ATOM 302 CG ASP A 19 -6.539 6.779 -4.797 1.00 0.00 C ATOM 303 OD1 ASP A 19 -6.143 7.697 -5.550 1.00 0.00 O ATOM 304 OD2 ASP A 19 -6.463 6.850 -3.577 1.00 0.00 O ATOM 0 H ASP A 19 -6.876 2.984 -6.981 1.00 0.00 H new ATOM 0 HA ASP A 19 -5.819 5.673 -7.056 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -8.103 5.845 -5.892 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -7.413 4.850 -4.625 1.00 0.00 H new ATOM 309 N GLY A 20 -4.524 4.623 -4.720 1.00 0.00 N ATOM 310 CA GLY A 20 -3.407 3.964 -4.080 1.00 0.00 C ATOM 311 C GLY A 20 -3.800 2.691 -3.376 1.00 0.00 C ATOM 312 O GLY A 20 -3.188 1.650 -3.577 1.00 0.00 O ATOM 0 H GLY A 20 -4.796 5.508 -4.291 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -2.647 3.739 -4.829 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -2.954 4.646 -3.360 1.00 0.00 H new ATOM 316 N ASP A 21 -4.831 2.766 -2.576 1.00 0.00 N ATOM 317 CA ASP A 21 -5.270 1.611 -1.792 1.00 0.00 C ATOM 318 C ASP A 21 -6.526 0.967 -2.367 1.00 0.00 C ATOM 319 O ASP A 21 -7.077 0.026 -1.785 1.00 0.00 O ATOM 320 CB ASP A 21 -5.496 1.986 -0.311 1.00 0.00 C ATOM 321 CG ASP A 21 -6.521 3.086 -0.098 1.00 0.00 C ATOM 322 OD1 ASP A 21 -7.621 3.024 -0.673 1.00 0.00 O ATOM 323 OD2 ASP A 21 -6.246 4.047 0.650 1.00 0.00 O ATOM 0 H ASP A 21 -5.391 3.608 -2.441 1.00 0.00 H new ATOM 0 HA ASP A 21 -4.465 0.879 -1.847 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -5.815 1.097 0.233 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -4.546 2.301 0.122 1.00 0.00 H new ATOM 328 N THR A 22 -6.977 1.464 -3.491 1.00 0.00 N ATOM 329 CA THR A 22 -8.170 0.951 -4.109 1.00 0.00 C ATOM 330 C THR A 22 -7.861 0.581 -5.563 1.00 0.00 C ATOM 331 O THR A 22 -7.394 1.414 -6.335 1.00 0.00 O ATOM 332 CB THR A 22 -9.294 2.016 -4.082 1.00 0.00 C ATOM 333 OG1 THR A 22 -9.428 2.562 -2.757 1.00 0.00 O ATOM 334 CG2 THR A 22 -10.625 1.397 -4.482 1.00 0.00 C ATOM 0 H THR A 22 -6.531 2.228 -3.998 1.00 0.00 H new ATOM 0 HA THR A 22 -8.505 0.071 -3.559 1.00 0.00 H new ATOM 0 HB THR A 22 -9.027 2.803 -4.787 1.00 0.00 H new ATOM 0 HG1 THR A 22 -8.539 2.711 -2.373 1.00 0.00 H new ATOM 0 HG21 THR A 22 -11.403 2.160 -4.457 1.00 0.00 H new ATOM 0 HG22 THR A 22 -10.548 0.989 -5.490 1.00 0.00 H new ATOM 0 HG23 THR A 22 -10.878 0.598 -3.786 1.00 0.00 H new ATOM 342 N VAL A 23 -8.098 -0.645 -5.930 1.00 0.00 N ATOM 343 CA VAL A 23 -7.868 -1.088 -7.296 1.00 0.00 C ATOM 344 C VAL A 23 -9.036 -1.906 -7.772 1.00 0.00 C ATOM 345 O VAL A 23 -9.784 -2.454 -6.959 1.00 0.00 O ATOM 346 CB VAL A 23 -6.552 -1.922 -7.466 1.00 0.00 C ATOM 347 CG1 VAL A 23 -5.311 -1.088 -7.172 1.00 0.00 C ATOM 348 CG2 VAL A 23 -6.571 -3.170 -6.594 1.00 0.00 C ATOM 0 H VAL A 23 -8.453 -1.369 -5.305 1.00 0.00 H new ATOM 0 HA VAL A 23 -7.756 -0.186 -7.897 1.00 0.00 H new ATOM 0 HB VAL A 23 -6.507 -2.232 -8.510 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -4.420 -1.703 -7.301 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -5.270 -0.242 -7.858 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -5.353 -0.722 -6.146 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -5.644 -3.726 -6.735 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -6.665 -2.881 -5.547 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -7.417 -3.797 -6.875 1.00 0.00 H new ATOM 358 N LYS A 24 -9.226 -1.961 -9.065 1.00 0.00 N ATOM 359 CA LYS A 24 -10.249 -2.782 -9.618 1.00 0.00 C ATOM 360 C LYS A 24 -9.582 -3.760 -10.534 1.00 0.00 C ATOM 361 O LYS A 24 -8.978 -3.381 -11.560 1.00 0.00 O ATOM 362 CB LYS A 24 -11.287 -1.958 -10.360 1.00 0.00 C ATOM 363 CG LYS A 24 -12.574 -2.727 -10.624 1.00 0.00 C ATOM 364 CD LYS A 24 -13.672 -1.845 -11.205 1.00 0.00 C ATOM 365 CE LYS A 24 -13.292 -1.269 -12.555 1.00 0.00 C ATOM 366 NZ LYS A 24 -14.367 -0.442 -13.118 1.00 0.00 N ATOM 0 H LYS A 24 -8.678 -1.441 -9.750 1.00 0.00 H new ATOM 0 HA LYS A 24 -10.785 -3.302 -8.824 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -11.516 -1.064 -9.780 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -10.868 -1.624 -11.309 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -12.369 -3.547 -11.312 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -12.925 -3.172 -9.693 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -14.588 -2.427 -11.306 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -13.886 -1.031 -10.512 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -12.388 -0.669 -12.453 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -13.059 -2.081 -13.244 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -14.069 -0.066 -14.041 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -15.223 -1.021 -13.240 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -14.572 0.348 -12.473 1.00 0.00 H new ATOM 380 N LEU A 25 -9.638 -4.986 -10.170 1.00 0.00 N ATOM 381 CA LEU A 25 -8.948 -5.989 -10.886 1.00 0.00 C ATOM 382 C LEU A 25 -9.859 -7.113 -11.325 1.00 0.00 C ATOM 383 O LEU A 25 -11.019 -7.184 -10.928 1.00 0.00 O ATOM 384 CB LEU A 25 -7.705 -6.468 -10.090 1.00 0.00 C ATOM 385 CG LEU A 25 -7.898 -6.867 -8.614 1.00 0.00 C ATOM 386 CD1 LEU A 25 -8.728 -8.125 -8.463 1.00 0.00 C ATOM 387 CD2 LEU A 25 -6.552 -7.023 -7.928 1.00 0.00 C ATOM 0 H LEU A 25 -10.165 -5.323 -9.365 1.00 0.00 H new ATOM 0 HA LEU A 25 -8.579 -5.554 -11.815 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -7.283 -7.325 -10.615 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -6.960 -5.674 -10.126 1.00 0.00 H new ATOM 0 HG LEU A 25 -8.451 -6.062 -8.129 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -8.836 -8.365 -7.405 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -9.713 -7.966 -8.901 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -8.233 -8.951 -8.974 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -6.705 -7.305 -6.886 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -5.974 -7.797 -8.432 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -6.009 -6.079 -7.972 1.00 0.00 H new ATOM 399 N MET A 26 -9.333 -7.946 -12.150 1.00 0.00 N ATOM 400 CA MET A 26 -10.014 -9.074 -12.684 1.00 0.00 C ATOM 401 C MET A 26 -9.807 -10.235 -11.741 1.00 0.00 C ATOM 402 O MET A 26 -8.696 -10.758 -11.613 1.00 0.00 O ATOM 403 CB MET A 26 -9.431 -9.402 -14.055 1.00 0.00 C ATOM 404 CG MET A 26 -10.069 -10.574 -14.759 1.00 0.00 C ATOM 405 SD MET A 26 -9.276 -10.903 -16.335 1.00 0.00 S ATOM 406 CE MET A 26 -10.219 -12.308 -16.895 1.00 0.00 C ATOM 0 H MET A 26 -8.374 -7.857 -12.487 1.00 0.00 H new ATOM 0 HA MET A 26 -11.079 -8.871 -12.792 1.00 0.00 H new ATOM 0 HB2 MET A 26 -9.523 -8.522 -14.692 1.00 0.00 H new ATOM 0 HB3 MET A 26 -8.366 -9.603 -13.941 1.00 0.00 H new ATOM 0 HG2 MET A 26 -10.005 -11.459 -14.126 1.00 0.00 H new ATOM 0 HG3 MET A 26 -11.128 -10.372 -14.918 1.00 0.00 H new ATOM 0 HE1 MET A 26 -9.882 -12.600 -17.890 1.00 0.00 H new ATOM 0 HE2 MET A 26 -10.077 -13.140 -16.205 1.00 0.00 H new ATOM 0 HE3 MET A 26 -11.276 -12.045 -16.933 1.00 0.00 H new ATOM 416 N TYR A 27 -10.846 -10.588 -11.063 1.00 0.00 N ATOM 417 CA TYR A 27 -10.836 -11.647 -10.105 1.00 0.00 C ATOM 418 C TYR A 27 -11.916 -12.643 -10.487 1.00 0.00 C ATOM 419 O TYR A 27 -13.056 -12.255 -10.687 1.00 0.00 O ATOM 420 CB TYR A 27 -11.096 -11.059 -8.714 1.00 0.00 C ATOM 421 CG TYR A 27 -11.117 -12.081 -7.623 1.00 0.00 C ATOM 422 CD1 TYR A 27 -9.957 -12.715 -7.230 1.00 0.00 C ATOM 423 CD2 TYR A 27 -12.300 -12.419 -6.992 1.00 0.00 C ATOM 424 CE1 TYR A 27 -9.974 -13.664 -6.247 1.00 0.00 C ATOM 425 CE2 TYR A 27 -12.323 -13.363 -6.000 1.00 0.00 C ATOM 426 CZ TYR A 27 -11.160 -13.986 -5.631 1.00 0.00 C ATOM 427 OH TYR A 27 -11.189 -14.952 -4.658 1.00 0.00 O ATOM 0 H TYR A 27 -11.755 -10.135 -11.161 1.00 0.00 H new ATOM 0 HA TYR A 27 -9.872 -12.156 -10.089 1.00 0.00 H new ATOM 0 HB2 TYR A 27 -10.326 -10.320 -8.492 1.00 0.00 H new ATOM 0 HB3 TYR A 27 -12.050 -10.532 -8.725 1.00 0.00 H new ATOM 0 HD1 TYR A 27 -9.022 -12.458 -7.706 1.00 0.00 H new ATOM 0 HD2 TYR A 27 -13.218 -11.932 -7.285 1.00 0.00 H new ATOM 0 HE1 TYR A 27 -9.060 -14.159 -5.955 1.00 0.00 H new ATOM 0 HE2 TYR A 27 -13.253 -13.615 -5.511 1.00 0.00 H new ATOM 0 HH TYR A 27 -12.041 -14.905 -4.175 1.00 0.00 H new ATOM 437 N LYS A 28 -11.544 -13.911 -10.633 1.00 0.00 N ATOM 438 CA LYS A 28 -12.467 -14.994 -11.055 1.00 0.00 C ATOM 439 C LYS A 28 -13.181 -14.630 -12.371 1.00 0.00 C ATOM 440 O LYS A 28 -14.337 -15.011 -12.608 1.00 0.00 O ATOM 441 CB LYS A 28 -13.506 -15.310 -9.954 1.00 0.00 C ATOM 442 CG LYS A 28 -12.923 -15.877 -8.662 1.00 0.00 C ATOM 443 CD LYS A 28 -14.033 -16.198 -7.663 1.00 0.00 C ATOM 444 CE LYS A 28 -13.487 -16.744 -6.346 1.00 0.00 C ATOM 445 NZ LYS A 28 -12.735 -18.002 -6.517 1.00 0.00 N ATOM 0 H LYS A 28 -10.591 -14.232 -10.464 1.00 0.00 H new ATOM 0 HA LYS A 28 -11.865 -15.887 -11.222 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -14.053 -14.397 -9.718 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -14.230 -16.022 -10.352 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -12.352 -16.779 -8.880 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -12.230 -15.159 -8.224 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -14.614 -15.297 -7.467 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -14.714 -16.927 -8.102 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -12.838 -15.997 -5.890 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -14.314 -16.911 -5.656 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -12.519 -18.407 -5.584 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -13.307 -18.677 -7.063 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -11.848 -17.810 -7.025 1.00 0.00 H new ATOM 459 N GLY A 29 -12.472 -13.925 -13.232 1.00 0.00 N ATOM 460 CA GLY A 29 -13.014 -13.539 -14.517 1.00 0.00 C ATOM 461 C GLY A 29 -13.897 -12.294 -14.467 1.00 0.00 C ATOM 462 O GLY A 29 -14.388 -11.842 -15.507 1.00 0.00 O ATOM 0 H GLY A 29 -11.517 -13.608 -13.063 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -12.191 -13.361 -15.209 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -13.595 -14.369 -14.919 1.00 0.00 H new ATOM 466 N GLN A 30 -14.096 -11.727 -13.290 1.00 0.00 N ATOM 467 CA GLN A 30 -14.945 -10.563 -13.161 1.00 0.00 C ATOM 468 C GLN A 30 -14.233 -9.388 -12.496 1.00 0.00 C ATOM 469 O GLN A 30 -13.350 -9.591 -11.667 1.00 0.00 O ATOM 470 CB GLN A 30 -16.328 -10.915 -12.528 1.00 0.00 C ATOM 471 CG GLN A 30 -16.362 -11.641 -11.159 1.00 0.00 C ATOM 472 CD GLN A 30 -16.116 -10.756 -9.937 1.00 0.00 C ATOM 473 OE1 GLN A 30 -14.916 -10.726 -9.455 1.00 0.00 O flip ATOM 474 NE2 GLN A 30 -17.046 -10.154 -9.394 1.00 0.00 N flip ATOM 0 H GLN A 30 -13.683 -12.054 -12.417 1.00 0.00 H new ATOM 0 HA GLN A 30 -15.170 -10.214 -14.169 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -16.888 -9.986 -12.422 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -16.870 -11.534 -13.243 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -17.333 -12.123 -11.047 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -15.613 -12.433 -11.169 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -17.983 -10.194 -9.795 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -16.878 -9.616 -8.544 1.00 0.00 H new ATOM 483 N PRO A 31 -14.537 -8.154 -12.927 1.00 0.00 N ATOM 484 CA PRO A 31 -13.952 -6.948 -12.338 1.00 0.00 C ATOM 485 C PRO A 31 -14.454 -6.718 -10.916 1.00 0.00 C ATOM 486 O PRO A 31 -15.655 -6.595 -10.678 1.00 0.00 O ATOM 487 CB PRO A 31 -14.426 -5.824 -13.263 1.00 0.00 C ATOM 488 CG PRO A 31 -15.653 -6.354 -13.916 1.00 0.00 C ATOM 489 CD PRO A 31 -15.459 -7.833 -14.039 1.00 0.00 C ATOM 0 HA PRO A 31 -12.867 -7.012 -12.260 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -14.639 -4.914 -12.702 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -13.664 -5.572 -14.000 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -16.538 -6.126 -13.323 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -15.800 -5.898 -14.895 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -16.403 -8.371 -13.946 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -15.032 -8.103 -15.005 1.00 0.00 H new ATOM 497 N MET A 32 -13.552 -6.693 -9.989 1.00 0.00 N ATOM 498 CA MET A 32 -13.889 -6.537 -8.622 1.00 0.00 C ATOM 499 C MET A 32 -12.984 -5.495 -7.991 1.00 0.00 C ATOM 500 O MET A 32 -11.777 -5.455 -8.277 1.00 0.00 O ATOM 501 CB MET A 32 -13.726 -7.879 -7.949 1.00 0.00 C ATOM 502 CG MET A 32 -14.192 -7.914 -6.526 1.00 0.00 C ATOM 503 SD MET A 32 -14.162 -9.576 -5.830 1.00 0.00 S ATOM 504 CE MET A 32 -14.692 -9.229 -4.160 1.00 0.00 C ATOM 0 H MET A 32 -12.552 -6.782 -10.167 1.00 0.00 H new ATOM 0 HA MET A 32 -14.918 -6.196 -8.509 1.00 0.00 H new ATOM 0 HB2 MET A 32 -14.277 -8.627 -8.518 1.00 0.00 H new ATOM 0 HB3 MET A 32 -12.674 -8.164 -7.982 1.00 0.00 H new ATOM 0 HG2 MET A 32 -13.561 -7.260 -5.924 1.00 0.00 H new ATOM 0 HG3 MET A 32 -15.206 -7.518 -6.469 1.00 0.00 H new ATOM 0 HE1 MET A 32 -14.728 -10.157 -3.589 1.00 0.00 H new ATOM 0 HE2 MET A 32 -13.989 -8.541 -3.691 1.00 0.00 H new ATOM 0 HE3 MET A 32 -15.684 -8.777 -4.180 1.00 0.00 H new ATOM 514 N THR A 33 -13.555 -4.647 -7.179 1.00 0.00 N ATOM 515 CA THR A 33 -12.816 -3.611 -6.528 1.00 0.00 C ATOM 516 C THR A 33 -12.276 -4.119 -5.192 1.00 0.00 C ATOM 517 O THR A 33 -12.996 -4.748 -4.415 1.00 0.00 O ATOM 518 CB THR A 33 -13.723 -2.392 -6.292 1.00 0.00 C ATOM 519 OG1 THR A 33 -14.411 -2.079 -7.518 1.00 0.00 O ATOM 520 CG2 THR A 33 -12.900 -1.186 -5.862 1.00 0.00 C ATOM 0 H THR A 33 -14.549 -4.659 -6.953 1.00 0.00 H new ATOM 0 HA THR A 33 -11.980 -3.318 -7.163 1.00 0.00 H new ATOM 0 HB THR A 33 -14.436 -2.629 -5.503 1.00 0.00 H new ATOM 0 HG1 THR A 33 -14.994 -1.304 -7.377 1.00 0.00 H new ATOM 0 HG21 THR A 33 -13.560 -0.334 -5.700 1.00 0.00 H new ATOM 0 HG22 THR A 33 -12.372 -1.417 -4.937 1.00 0.00 H new ATOM 0 HG23 THR A 33 -12.177 -0.942 -6.641 1.00 0.00 H new ATOM 528 N PHE A 34 -11.017 -3.888 -4.963 1.00 0.00 N ATOM 529 CA PHE A 34 -10.354 -4.269 -3.735 1.00 0.00 C ATOM 530 C PHE A 34 -9.857 -3.046 -3.009 1.00 0.00 C ATOM 531 O PHE A 34 -9.312 -2.122 -3.637 1.00 0.00 O ATOM 532 CB PHE A 34 -9.192 -5.230 -4.005 1.00 0.00 C ATOM 533 CG PHE A 34 -9.612 -6.641 -4.297 1.00 0.00 C ATOM 534 CD1 PHE A 34 -10.275 -6.970 -5.464 1.00 0.00 C ATOM 535 CD2 PHE A 34 -9.333 -7.643 -3.395 1.00 0.00 C ATOM 536 CE1 PHE A 34 -10.653 -8.270 -5.717 1.00 0.00 C ATOM 537 CE2 PHE A 34 -9.708 -8.940 -3.645 1.00 0.00 C ATOM 538 CZ PHE A 34 -10.369 -9.254 -4.808 1.00 0.00 C ATOM 0 H PHE A 34 -10.404 -3.421 -5.632 1.00 0.00 H new ATOM 0 HA PHE A 34 -11.081 -4.786 -3.108 1.00 0.00 H new ATOM 0 HB2 PHE A 34 -8.613 -4.854 -4.849 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -8.529 -5.232 -3.140 1.00 0.00 H new ATOM 0 HD1 PHE A 34 -10.499 -6.199 -6.186 1.00 0.00 H new ATOM 0 HD2 PHE A 34 -8.812 -7.406 -2.479 1.00 0.00 H new ATOM 0 HE1 PHE A 34 -11.173 -8.513 -6.632 1.00 0.00 H new ATOM 0 HE2 PHE A 34 -9.483 -9.714 -2.927 1.00 0.00 H new ATOM 0 HZ PHE A 34 -10.664 -10.274 -5.005 1.00 0.00 H new ATOM 548 N ARG A 35 -10.079 -3.013 -1.712 1.00 0.00 N ATOM 549 CA ARG A 35 -9.644 -1.915 -0.890 1.00 0.00 C ATOM 550 C ARG A 35 -9.305 -2.477 0.488 1.00 0.00 C ATOM 551 O ARG A 35 -10.196 -2.823 1.255 1.00 0.00 O ATOM 552 CB ARG A 35 -10.766 -0.854 -0.810 1.00 0.00 C ATOM 553 CG ARG A 35 -10.314 0.556 -0.434 1.00 0.00 C ATOM 554 CD ARG A 35 -9.865 0.705 1.007 1.00 0.00 C ATOM 555 NE ARG A 35 -9.197 1.987 1.197 1.00 0.00 N ATOM 556 CZ ARG A 35 -9.318 2.816 2.229 1.00 0.00 C ATOM 557 NH1 ARG A 35 -10.224 2.598 3.168 1.00 0.00 N ATOM 558 NH2 ARG A 35 -8.535 3.889 2.300 1.00 0.00 N ATOM 0 H ARG A 35 -10.567 -3.749 -1.202 1.00 0.00 H new ATOM 0 HA ARG A 35 -8.763 -1.428 -1.309 1.00 0.00 H new ATOM 0 HB2 ARG A 35 -11.269 -0.810 -1.776 1.00 0.00 H new ATOM 0 HB3 ARG A 35 -11.505 -1.186 -0.081 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -9.494 0.849 -1.090 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -11.134 1.249 -0.620 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -10.725 0.633 1.673 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -9.189 -0.108 1.271 1.00 0.00 H new ATOM 0 HE ARG A 35 -8.564 2.281 0.453 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -10.839 1.787 3.105 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -10.307 3.241 3.955 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -7.850 4.070 1.567 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -8.620 4.531 3.088 1.00 0.00 H new ATOM 572 N LEU A 36 -8.033 -2.590 0.787 1.00 0.00 N ATOM 573 CA LEU A 36 -7.594 -3.169 2.047 1.00 0.00 C ATOM 574 C LEU A 36 -7.634 -2.089 3.142 1.00 0.00 C ATOM 575 O LEU A 36 -6.829 -1.175 3.168 1.00 0.00 O ATOM 576 CB LEU A 36 -6.203 -3.837 1.849 1.00 0.00 C ATOM 577 CG LEU A 36 -5.607 -4.715 2.986 1.00 0.00 C ATOM 578 CD1 LEU A 36 -5.000 -3.885 4.086 1.00 0.00 C ATOM 579 CD2 LEU A 36 -6.656 -5.669 3.555 1.00 0.00 C ATOM 0 H LEU A 36 -7.275 -2.288 0.175 1.00 0.00 H new ATOM 0 HA LEU A 36 -8.264 -3.962 2.380 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -6.263 -4.457 0.955 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -5.486 -3.043 1.639 1.00 0.00 H new ATOM 0 HG LEU A 36 -4.807 -5.305 2.539 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -4.597 -4.542 4.857 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -4.198 -3.270 3.678 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -5.765 -3.242 4.521 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -6.210 -6.269 4.348 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -7.489 -5.094 3.960 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -7.019 -6.325 2.764 1.00 0.00 H new ATOM 591 N LEU A 37 -8.582 -2.246 4.045 1.00 0.00 N ATOM 592 CA LEU A 37 -8.961 -1.232 5.048 1.00 0.00 C ATOM 593 C LEU A 37 -7.891 -0.939 6.155 1.00 0.00 C ATOM 594 O LEU A 37 -8.054 0.001 6.939 1.00 0.00 O ATOM 595 CB LEU A 37 -10.326 -1.630 5.648 1.00 0.00 C ATOM 596 CG LEU A 37 -11.050 -0.604 6.525 1.00 0.00 C ATOM 597 CD1 LEU A 37 -11.320 0.677 5.747 1.00 0.00 C ATOM 598 CD2 LEU A 37 -12.357 -1.182 7.029 1.00 0.00 C ATOM 0 H LEU A 37 -9.134 -3.101 4.115 1.00 0.00 H new ATOM 0 HA LEU A 37 -9.030 -0.278 4.525 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -10.989 -1.893 4.824 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -10.180 -2.533 6.241 1.00 0.00 H new ATOM 0 HG LEU A 37 -10.409 -0.366 7.374 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -11.835 1.391 6.390 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -10.375 1.105 5.412 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -11.943 0.453 4.882 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -12.865 -0.445 7.652 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -12.992 -1.440 6.181 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -12.156 -2.077 7.617 1.00 0.00 H new ATOM 610 N LEU A 38 -6.820 -1.728 6.213 1.00 0.00 N ATOM 611 CA LEU A 38 -5.722 -1.465 7.187 1.00 0.00 C ATOM 612 C LEU A 38 -4.929 -0.231 6.772 1.00 0.00 C ATOM 613 O LEU A 38 -4.329 0.445 7.612 1.00 0.00 O ATOM 614 CB LEU A 38 -4.734 -2.673 7.352 1.00 0.00 C ATOM 615 CG LEU A 38 -5.134 -3.871 8.251 1.00 0.00 C ATOM 616 CD1 LEU A 38 -6.476 -4.433 7.881 1.00 0.00 C ATOM 617 CD2 LEU A 38 -4.093 -4.971 8.137 1.00 0.00 C ATOM 0 H LEU A 38 -6.675 -2.543 5.617 1.00 0.00 H new ATOM 0 HA LEU A 38 -6.207 -1.305 8.150 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -4.530 -3.066 6.356 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -3.794 -2.276 7.736 1.00 0.00 H new ATOM 0 HG LEU A 38 -5.190 -3.501 9.275 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -6.714 -5.270 8.538 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -7.237 -3.660 7.989 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -6.454 -4.778 6.847 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -4.379 -5.810 8.771 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -4.028 -5.304 7.101 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -3.124 -4.589 8.457 1.00 0.00 H new ATOM 629 N VAL A 39 -4.946 0.071 5.482 1.00 0.00 N ATOM 630 CA VAL A 39 -4.179 1.183 4.957 1.00 0.00 C ATOM 631 C VAL A 39 -5.088 2.332 4.552 1.00 0.00 C ATOM 632 O VAL A 39 -6.284 2.139 4.289 1.00 0.00 O ATOM 633 CB VAL A 39 -3.254 0.776 3.761 1.00 0.00 C ATOM 634 CG1 VAL A 39 -2.255 -0.274 4.187 1.00 0.00 C ATOM 635 CG2 VAL A 39 -4.047 0.279 2.562 1.00 0.00 C ATOM 0 H VAL A 39 -5.484 -0.441 4.782 1.00 0.00 H new ATOM 0 HA VAL A 39 -3.528 1.512 5.767 1.00 0.00 H new ATOM 0 HB VAL A 39 -2.721 1.677 3.457 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -1.624 -0.541 3.339 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -1.634 0.120 4.992 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -2.785 -1.160 4.537 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -3.361 0.009 1.759 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -4.631 -0.595 2.849 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -4.717 1.066 2.217 1.00 0.00 H new ATOM 645 N ASP A 40 -4.532 3.509 4.542 1.00 0.00 N ATOM 646 CA ASP A 40 -5.242 4.711 4.166 1.00 0.00 C ATOM 647 C ASP A 40 -4.326 5.620 3.387 1.00 0.00 C ATOM 648 O ASP A 40 -3.318 6.107 3.916 1.00 0.00 O ATOM 649 CB ASP A 40 -5.751 5.430 5.420 1.00 0.00 C ATOM 650 CG ASP A 40 -6.508 6.709 5.140 1.00 0.00 C ATOM 651 OD1 ASP A 40 -7.717 6.633 4.805 1.00 0.00 O ATOM 652 OD2 ASP A 40 -5.941 7.805 5.300 1.00 0.00 O ATOM 0 H ASP A 40 -3.558 3.670 4.798 1.00 0.00 H new ATOM 0 HA ASP A 40 -6.094 4.443 3.542 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -6.399 4.752 5.975 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -4.902 5.658 6.064 1.00 0.00 H new ATOM 657 N THR A 41 -4.607 5.786 2.131 1.00 0.00 N ATOM 658 CA THR A 41 -3.848 6.695 1.326 1.00 0.00 C ATOM 659 C THR A 41 -4.445 8.109 1.445 1.00 0.00 C ATOM 660 O THR A 41 -5.676 8.259 1.631 1.00 0.00 O ATOM 661 CB THR A 41 -3.775 6.226 -0.152 1.00 0.00 C ATOM 662 OG1 THR A 41 -5.092 5.956 -0.662 1.00 0.00 O ATOM 663 CG2 THR A 41 -2.912 4.975 -0.273 1.00 0.00 C ATOM 0 H THR A 41 -5.359 5.303 1.639 1.00 0.00 H new ATOM 0 HA THR A 41 -2.822 6.717 1.694 1.00 0.00 H new ATOM 0 HB THR A 41 -3.325 7.027 -0.739 1.00 0.00 H new ATOM 0 HG1 THR A 41 -5.475 5.188 -0.189 1.00 0.00 H new ATOM 0 HG21 THR A 41 -2.872 4.660 -1.316 1.00 0.00 H new ATOM 0 HG22 THR A 41 -1.904 5.193 0.079 1.00 0.00 H new ATOM 0 HG23 THR A 41 -3.343 4.176 0.331 1.00 0.00 H new ATOM 671 N PRO A 42 -3.612 9.175 1.391 1.00 0.00 N ATOM 672 CA PRO A 42 -4.088 10.539 1.522 1.00 0.00 C ATOM 673 C PRO A 42 -4.771 11.038 0.248 1.00 0.00 C ATOM 674 O PRO A 42 -4.216 11.820 -0.533 1.00 0.00 O ATOM 675 CB PRO A 42 -2.829 11.362 1.839 1.00 0.00 C ATOM 676 CG PRO A 42 -1.708 10.372 1.915 1.00 0.00 C ATOM 677 CD PRO A 42 -2.164 9.137 1.195 1.00 0.00 C ATOM 0 HA PRO A 42 -4.847 10.624 2.299 1.00 0.00 H new ATOM 0 HB2 PRO A 42 -2.642 12.106 1.065 1.00 0.00 H new ATOM 0 HB3 PRO A 42 -2.940 11.901 2.780 1.00 0.00 H new ATOM 0 HG2 PRO A 42 -0.806 10.775 1.456 1.00 0.00 H new ATOM 0 HG3 PRO A 42 -1.463 10.145 2.953 1.00 0.00 H new ATOM 0 HD2 PRO A 42 -1.896 9.161 0.139 1.00 0.00 H new ATOM 0 HD3 PRO A 42 -1.721 8.235 1.616 1.00 0.00 H new ATOM 685 N SER A 43 -5.932 10.514 0.020 1.00 0.00 N ATOM 686 CA SER A 43 -6.755 10.885 -1.086 1.00 0.00 C ATOM 687 C SER A 43 -8.074 11.438 -0.559 1.00 0.00 C ATOM 688 O SER A 43 -9.072 11.503 -1.271 1.00 0.00 O ATOM 689 CB SER A 43 -6.981 9.663 -1.970 1.00 0.00 C ATOM 690 OG SER A 43 -5.737 9.132 -2.429 1.00 0.00 O ATOM 0 H SER A 43 -6.346 9.796 0.615 1.00 0.00 H new ATOM 0 HA SER A 43 -6.272 11.657 -1.684 1.00 0.00 H new ATOM 0 HB2 SER A 43 -7.523 8.900 -1.412 1.00 0.00 H new ATOM 0 HB3 SER A 43 -7.602 9.936 -2.823 1.00 0.00 H new ATOM 0 HG SER A 43 -5.856 8.194 -2.685 1.00 0.00 H new ATOM 696 N THR A 44 -8.046 11.860 0.688 1.00 0.00 N ATOM 697 CA THR A 44 -9.202 12.415 1.332 1.00 0.00 C ATOM 698 C THR A 44 -9.484 13.821 0.782 1.00 0.00 C ATOM 699 O THR A 44 -8.590 14.686 0.729 1.00 0.00 O ATOM 700 CB THR A 44 -9.039 12.433 2.900 1.00 0.00 C ATOM 701 OG1 THR A 44 -10.181 13.030 3.538 1.00 0.00 O ATOM 702 CG2 THR A 44 -7.771 13.163 3.337 1.00 0.00 C ATOM 0 H THR A 44 -7.215 11.825 1.279 1.00 0.00 H new ATOM 0 HA THR A 44 -10.058 11.778 1.111 1.00 0.00 H new ATOM 0 HB THR A 44 -8.960 11.392 3.213 1.00 0.00 H new ATOM 0 HG1 THR A 44 -10.052 13.026 4.510 1.00 0.00 H new ATOM 0 HG21 THR A 44 -7.700 13.150 4.425 1.00 0.00 H new ATOM 0 HG22 THR A 44 -6.900 12.666 2.911 1.00 0.00 H new ATOM 0 HG23 THR A 44 -7.807 14.195 2.988 1.00 0.00 H new ATOM 710 N LYS A 45 -10.679 14.016 0.307 1.00 0.00 N ATOM 711 CA LYS A 45 -11.102 15.301 -0.165 1.00 0.00 C ATOM 712 C LYS A 45 -11.839 16.015 0.928 1.00 0.00 C ATOM 713 O LYS A 45 -12.327 15.394 1.872 1.00 0.00 O ATOM 714 CB LYS A 45 -11.962 15.204 -1.425 1.00 0.00 C ATOM 715 CG LYS A 45 -11.191 14.890 -2.694 1.00 0.00 C ATOM 716 CD LYS A 45 -12.123 14.851 -3.894 1.00 0.00 C ATOM 717 CE LYS A 45 -11.364 14.734 -5.209 1.00 0.00 C ATOM 718 NZ LYS A 45 -10.518 13.532 -5.267 1.00 0.00 N ATOM 0 H LYS A 45 -11.389 13.287 0.236 1.00 0.00 H new ATOM 0 HA LYS A 45 -10.213 15.868 -0.439 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -12.718 14.433 -1.275 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -12.491 16.147 -1.561 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -10.419 15.643 -2.852 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -10.684 13.931 -2.590 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -12.806 14.007 -3.794 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -12.733 15.754 -3.908 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -12.075 14.714 -6.035 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -10.742 15.619 -5.346 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -10.116 13.436 -6.222 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -9.747 13.616 -4.574 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -11.091 12.693 -5.047 1.00 0.00 H new ATOM 732 N HIS A 46 -11.890 17.302 0.823 1.00 0.00 N ATOM 733 CA HIS A 46 -12.526 18.153 1.804 1.00 0.00 C ATOM 734 C HIS A 46 -13.319 19.172 1.027 1.00 0.00 C ATOM 735 O HIS A 46 -13.035 19.352 -0.166 1.00 0.00 O ATOM 736 CB HIS A 46 -11.465 18.879 2.672 1.00 0.00 C ATOM 737 CG HIS A 46 -10.486 17.982 3.373 1.00 0.00 C ATOM 738 ND1 HIS A 46 -10.621 17.563 4.675 1.00 0.00 N ATOM 739 CD2 HIS A 46 -9.339 17.429 2.928 1.00 0.00 C ATOM 740 CE1 HIS A 46 -9.599 16.796 4.992 1.00 0.00 C ATOM 741 NE2 HIS A 46 -8.810 16.699 3.949 1.00 0.00 N ATOM 0 H HIS A 46 -11.485 17.814 0.039 1.00 0.00 H new ATOM 0 HA HIS A 46 -13.156 17.567 2.473 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -10.910 19.569 2.036 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -11.981 19.481 3.420 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -8.917 17.544 1.941 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -9.437 16.325 5.951 1.00 0.00 H new ATOM 0 HE2 HIS A 46 -7.942 16.164 3.909 1.00 0.00 H new ATOM 750 N PRO A 47 -14.356 19.806 1.626 1.00 0.00 N ATOM 751 CA PRO A 47 -15.133 20.858 0.957 1.00 0.00 C ATOM 752 C PRO A 47 -14.228 21.892 0.287 1.00 0.00 C ATOM 753 O PRO A 47 -14.279 22.090 -0.937 1.00 0.00 O ATOM 754 CB PRO A 47 -15.909 21.501 2.105 1.00 0.00 C ATOM 755 CG PRO A 47 -16.111 20.398 3.079 1.00 0.00 C ATOM 756 CD PRO A 47 -14.892 19.516 2.978 1.00 0.00 C ATOM 0 HA PRO A 47 -15.767 20.464 0.162 1.00 0.00 H new ATOM 0 HB2 PRO A 47 -15.351 22.326 2.549 1.00 0.00 H new ATOM 0 HB3 PRO A 47 -16.861 21.908 1.763 1.00 0.00 H new ATOM 0 HG2 PRO A 47 -16.226 20.788 4.090 1.00 0.00 H new ATOM 0 HG3 PRO A 47 -17.017 19.837 2.849 1.00 0.00 H new ATOM 0 HD2 PRO A 47 -14.164 19.749 3.755 1.00 0.00 H new ATOM 0 HD3 PRO A 47 -15.150 18.463 3.088 1.00 0.00 H new ATOM 764 N LYS A 48 -13.360 22.487 1.072 1.00 0.00 N ATOM 765 CA LYS A 48 -12.444 23.482 0.587 1.00 0.00 C ATOM 766 C LYS A 48 -11.075 23.238 1.174 1.00 0.00 C ATOM 767 O LYS A 48 -10.815 23.631 2.307 1.00 0.00 O ATOM 768 CB LYS A 48 -12.903 24.888 0.992 1.00 0.00 C ATOM 769 CG LYS A 48 -14.257 25.319 0.445 1.00 0.00 C ATOM 770 CD LYS A 48 -14.655 26.690 0.972 1.00 0.00 C ATOM 771 CE LYS A 48 -13.641 27.758 0.585 1.00 0.00 C ATOM 772 NZ LYS A 48 -14.017 29.093 1.081 1.00 0.00 N ATOM 0 H LYS A 48 -13.272 22.290 2.069 1.00 0.00 H new ATOM 0 HA LYS A 48 -12.411 23.413 -0.500 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -12.937 24.941 2.080 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -12.152 25.606 0.661 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -14.221 25.342 -0.644 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -15.014 24.586 0.723 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -15.636 26.960 0.580 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -14.746 26.650 2.058 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -12.663 27.488 0.982 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -13.547 27.790 -0.500 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -13.297 29.786 0.793 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -14.938 29.365 0.682 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -14.082 29.072 2.119 1.00 0.00 H new ATOM 786 N LYS A 49 -10.217 22.549 0.460 1.00 0.00 N ATOM 787 CA LYS A 49 -8.870 22.364 0.960 1.00 0.00 C ATOM 788 C LYS A 49 -8.019 23.554 0.566 1.00 0.00 C ATOM 789 O LYS A 49 -8.226 24.146 -0.507 1.00 0.00 O ATOM 790 CB LYS A 49 -8.229 21.033 0.513 1.00 0.00 C ATOM 791 CG LYS A 49 -8.095 20.833 -0.987 1.00 0.00 C ATOM 792 CD LYS A 49 -7.347 19.539 -1.284 1.00 0.00 C ATOM 793 CE LYS A 49 -7.303 19.229 -2.772 1.00 0.00 C ATOM 794 NZ LYS A 49 -6.654 20.303 -3.567 1.00 0.00 N ATOM 0 H LYS A 49 -10.415 22.117 -0.443 1.00 0.00 H new ATOM 0 HA LYS A 49 -8.927 22.302 2.047 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -7.237 20.961 0.960 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -8.821 20.213 0.918 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -9.083 20.803 -1.446 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -7.564 21.677 -1.427 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -6.330 19.613 -0.900 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -7.827 18.715 -0.757 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -6.766 18.294 -2.927 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -8.319 19.077 -3.137 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -6.113 19.879 -4.347 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -7.382 20.936 -3.955 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -6.012 20.847 -2.956 1.00 0.00 H new ATOM 808 N GLY A 50 -7.105 23.921 1.431 1.00 0.00 N ATOM 809 CA GLY A 50 -6.265 25.066 1.204 1.00 0.00 C ATOM 810 C GLY A 50 -5.253 24.835 0.111 1.00 0.00 C ATOM 811 O GLY A 50 -5.430 25.299 -1.022 1.00 0.00 O ATOM 0 H GLY A 50 -6.925 23.434 2.309 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -6.887 25.922 0.943 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -5.745 25.319 2.128 1.00 0.00 H new ATOM 815 N VAL A 51 -4.232 24.092 0.421 1.00 0.00 N ATOM 816 CA VAL A 51 -3.165 23.849 -0.511 1.00 0.00 C ATOM 817 C VAL A 51 -2.840 22.354 -0.576 1.00 0.00 C ATOM 818 O VAL A 51 -2.910 21.641 0.435 1.00 0.00 O ATOM 819 CB VAL A 51 -1.894 24.698 -0.153 1.00 0.00 C ATOM 820 CG1 VAL A 51 -1.325 24.335 1.215 1.00 0.00 C ATOM 821 CG2 VAL A 51 -0.826 24.606 -1.239 1.00 0.00 C ATOM 0 H VAL A 51 -4.113 23.636 1.326 1.00 0.00 H new ATOM 0 HA VAL A 51 -3.497 24.165 -1.500 1.00 0.00 H new ATOM 0 HB VAL A 51 -2.220 25.737 -0.100 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -0.447 24.948 1.418 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -2.079 24.514 1.982 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -1.042 23.282 1.224 1.00 0.00 H new ATOM 0 HG21 VAL A 51 0.037 25.207 -0.953 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -0.520 23.567 -1.361 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -1.231 24.978 -2.180 1.00 0.00 H new ATOM 831 N GLU A 52 -2.554 21.891 -1.759 1.00 0.00 N ATOM 832 CA GLU A 52 -2.193 20.527 -2.019 1.00 0.00 C ATOM 833 C GLU A 52 -1.223 20.622 -3.204 1.00 0.00 C ATOM 834 O GLU A 52 -1.300 21.594 -3.980 1.00 0.00 O ATOM 835 CB GLU A 52 -3.477 19.731 -2.367 1.00 0.00 C ATOM 836 CG GLU A 52 -3.439 18.224 -2.103 1.00 0.00 C ATOM 837 CD GLU A 52 -2.443 17.493 -2.935 1.00 0.00 C ATOM 838 OE1 GLU A 52 -2.747 17.189 -4.094 1.00 0.00 O ATOM 839 OE2 GLU A 52 -1.314 17.254 -2.451 1.00 0.00 O ATOM 0 H GLU A 52 -2.566 22.472 -2.597 1.00 0.00 H new ATOM 0 HA GLU A 52 -1.731 20.012 -1.177 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -4.306 20.156 -1.801 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -3.699 19.887 -3.423 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -3.213 18.055 -1.050 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -4.429 17.807 -2.288 1.00 0.00 H new ATOM 846 N LYS A 53 -0.334 19.675 -3.354 1.00 0.00 N ATOM 847 CA LYS A 53 0.699 19.783 -4.365 1.00 0.00 C ATOM 848 C LYS A 53 0.314 19.043 -5.641 1.00 0.00 C ATOM 849 O LYS A 53 -0.194 19.638 -6.594 1.00 0.00 O ATOM 850 CB LYS A 53 2.038 19.242 -3.854 1.00 0.00 C ATOM 851 CG LYS A 53 2.514 19.823 -2.539 1.00 0.00 C ATOM 852 CD LYS A 53 3.781 19.121 -2.086 1.00 0.00 C ATOM 853 CE LYS A 53 4.256 19.626 -0.739 1.00 0.00 C ATOM 854 NZ LYS A 53 4.562 21.065 -0.750 1.00 0.00 N ATOM 0 H LYS A 53 -0.299 18.823 -2.795 1.00 0.00 H new ATOM 0 HA LYS A 53 0.805 20.844 -4.591 1.00 0.00 H new ATOM 0 HB2 LYS A 53 1.956 18.161 -3.745 1.00 0.00 H new ATOM 0 HB3 LYS A 53 2.799 19.430 -4.611 1.00 0.00 H new ATOM 0 HG2 LYS A 53 2.701 20.891 -2.651 1.00 0.00 H new ATOM 0 HG3 LYS A 53 1.738 19.713 -1.782 1.00 0.00 H new ATOM 0 HD2 LYS A 53 3.600 18.048 -2.028 1.00 0.00 H new ATOM 0 HD3 LYS A 53 4.565 19.273 -2.828 1.00 0.00 H new ATOM 0 HE2 LYS A 53 3.490 19.427 0.010 1.00 0.00 H new ATOM 0 HE3 LYS A 53 5.146 19.071 -0.440 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 4.978 21.338 0.163 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 5.238 21.270 -1.513 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 3.687 21.605 -0.908 1.00 0.00 H new ATOM 868 N TYR A 54 0.488 17.748 -5.624 1.00 0.00 N ATOM 869 CA TYR A 54 0.321 16.929 -6.808 1.00 0.00 C ATOM 870 C TYR A 54 -0.745 15.875 -6.594 1.00 0.00 C ATOM 871 O TYR A 54 -1.549 15.590 -7.487 1.00 0.00 O ATOM 872 CB TYR A 54 1.680 16.269 -7.121 1.00 0.00 C ATOM 873 CG TYR A 54 1.725 15.338 -8.323 1.00 0.00 C ATOM 874 CD1 TYR A 54 2.004 15.822 -9.590 1.00 0.00 C ATOM 875 CD2 TYR A 54 1.522 13.971 -8.177 1.00 0.00 C ATOM 876 CE1 TYR A 54 2.081 14.977 -10.675 1.00 0.00 C ATOM 877 CE2 TYR A 54 1.590 13.120 -9.259 1.00 0.00 C ATOM 878 CZ TYR A 54 1.872 13.627 -10.502 1.00 0.00 C ATOM 879 OH TYR A 54 1.956 12.780 -11.586 1.00 0.00 O ATOM 0 H TYR A 54 0.750 17.224 -4.789 1.00 0.00 H new ATOM 0 HA TYR A 54 -0.003 17.548 -7.645 1.00 0.00 H new ATOM 0 HB2 TYR A 54 2.415 17.059 -7.275 1.00 0.00 H new ATOM 0 HB3 TYR A 54 1.996 15.706 -6.242 1.00 0.00 H new ATOM 0 HD1 TYR A 54 2.164 16.881 -9.730 1.00 0.00 H new ATOM 0 HD2 TYR A 54 1.307 13.568 -7.198 1.00 0.00 H new ATOM 0 HE1 TYR A 54 2.304 15.371 -11.656 1.00 0.00 H new ATOM 0 HE2 TYR A 54 1.422 12.061 -9.129 1.00 0.00 H new ATOM 0 HH TYR A 54 1.784 11.860 -11.296 1.00 0.00 H new ATOM 889 N GLY A 55 -0.759 15.332 -5.419 1.00 0.00 N ATOM 890 CA GLY A 55 -1.617 14.247 -5.109 1.00 0.00 C ATOM 891 C GLY A 55 -0.764 13.036 -4.911 1.00 0.00 C ATOM 892 O GLY A 55 -0.252 12.507 -5.903 1.00 0.00 O ATOM 0 H GLY A 55 -0.168 15.636 -4.645 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -2.193 14.460 -4.209 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -2.333 14.083 -5.914 1.00 0.00 H new ATOM 896 N PRO A 56 -0.550 12.611 -3.628 1.00 0.00 N ATOM 897 CA PRO A 56 0.335 11.498 -3.245 1.00 0.00 C ATOM 898 C PRO A 56 0.401 10.382 -4.276 1.00 0.00 C ATOM 899 O PRO A 56 -0.619 9.750 -4.604 1.00 0.00 O ATOM 900 CB PRO A 56 -0.297 11.008 -1.957 1.00 0.00 C ATOM 901 CG PRO A 56 -0.785 12.258 -1.309 1.00 0.00 C ATOM 902 CD PRO A 56 -1.190 13.195 -2.427 1.00 0.00 C ATOM 0 HA PRO A 56 1.372 11.819 -3.151 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -1.113 10.312 -2.150 1.00 0.00 H new ATOM 0 HB3 PRO A 56 0.425 10.486 -1.329 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -1.630 12.050 -0.653 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -0.005 12.705 -0.692 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -2.274 13.244 -2.535 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -0.842 14.211 -2.243 1.00 0.00 H new ATOM 910 N GLU A 57 1.611 10.129 -4.762 1.00 0.00 N ATOM 911 CA GLU A 57 1.883 9.174 -5.845 1.00 0.00 C ATOM 912 C GLU A 57 1.644 7.705 -5.468 1.00 0.00 C ATOM 913 O GLU A 57 2.124 6.814 -6.151 1.00 0.00 O ATOM 914 CB GLU A 57 3.306 9.361 -6.354 1.00 0.00 C ATOM 915 CG GLU A 57 3.550 10.701 -7.020 1.00 0.00 C ATOM 916 CD GLU A 57 4.976 10.861 -7.452 1.00 0.00 C ATOM 917 OE1 GLU A 57 5.371 10.263 -8.479 1.00 0.00 O ATOM 918 OE2 GLU A 57 5.750 11.568 -6.755 1.00 0.00 O ATOM 0 H GLU A 57 2.451 10.588 -4.411 1.00 0.00 H new ATOM 0 HA GLU A 57 1.163 9.397 -6.632 1.00 0.00 H new ATOM 0 HB2 GLU A 57 3.997 9.250 -5.519 1.00 0.00 H new ATOM 0 HB3 GLU A 57 3.535 8.566 -7.064 1.00 0.00 H new ATOM 0 HG2 GLU A 57 2.895 10.800 -7.886 1.00 0.00 H new ATOM 0 HG3 GLU A 57 3.288 11.502 -6.329 1.00 0.00 H new ATOM 925 N ALA A 58 0.846 7.468 -4.440 1.00 0.00 N ATOM 926 CA ALA A 58 0.492 6.138 -4.014 1.00 0.00 C ATOM 927 C ALA A 58 -0.288 5.479 -5.129 1.00 0.00 C ATOM 928 O ALA A 58 -0.004 4.364 -5.517 1.00 0.00 O ATOM 929 CB ALA A 58 -0.366 6.206 -2.758 1.00 0.00 C ATOM 0 H ALA A 58 0.425 8.206 -3.876 1.00 0.00 H new ATOM 0 HA ALA A 58 1.391 5.564 -3.789 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -0.630 5.197 -2.442 1.00 0.00 H new ATOM 0 HB2 ALA A 58 0.192 6.701 -1.963 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -1.275 6.769 -2.968 1.00 0.00 H new ATOM 935 N SER A 59 -1.221 6.247 -5.694 1.00 0.00 N ATOM 936 CA SER A 59 -2.084 5.812 -6.774 1.00 0.00 C ATOM 937 C SER A 59 -1.258 5.342 -7.993 1.00 0.00 C ATOM 938 O SER A 59 -1.619 4.387 -8.678 1.00 0.00 O ATOM 939 CB SER A 59 -2.977 6.997 -7.151 1.00 0.00 C ATOM 940 OG SER A 59 -3.471 7.633 -5.959 1.00 0.00 O ATOM 0 H SER A 59 -1.395 7.208 -5.401 1.00 0.00 H new ATOM 0 HA SER A 59 -2.687 4.962 -6.454 1.00 0.00 H new ATOM 0 HB2 SER A 59 -2.414 7.713 -7.749 1.00 0.00 H new ATOM 0 HB3 SER A 59 -3.811 6.655 -7.764 1.00 0.00 H new ATOM 0 HG SER A 59 -4.451 7.654 -5.981 1.00 0.00 H new ATOM 946 N ALA A 60 -0.130 5.994 -8.220 1.00 0.00 N ATOM 947 CA ALA A 60 0.728 5.674 -9.337 1.00 0.00 C ATOM 948 C ALA A 60 1.673 4.536 -8.982 1.00 0.00 C ATOM 949 O ALA A 60 1.907 3.647 -9.793 1.00 0.00 O ATOM 950 CB ALA A 60 1.513 6.901 -9.775 1.00 0.00 C ATOM 0 H ALA A 60 0.212 6.756 -7.635 1.00 0.00 H new ATOM 0 HA ALA A 60 0.100 5.350 -10.167 1.00 0.00 H new ATOM 0 HB1 ALA A 60 2.154 6.641 -10.617 1.00 0.00 H new ATOM 0 HB2 ALA A 60 0.821 7.688 -10.075 1.00 0.00 H new ATOM 0 HB3 ALA A 60 2.127 7.254 -8.947 1.00 0.00 H new ATOM 956 N PHE A 61 2.195 4.575 -7.767 1.00 0.00 N ATOM 957 CA PHE A 61 3.148 3.593 -7.263 1.00 0.00 C ATOM 958 C PHE A 61 2.521 2.196 -7.280 1.00 0.00 C ATOM 959 O PHE A 61 3.128 1.233 -7.784 1.00 0.00 O ATOM 960 CB PHE A 61 3.558 3.989 -5.846 1.00 0.00 C ATOM 961 CG PHE A 61 4.764 3.283 -5.294 1.00 0.00 C ATOM 962 CD1 PHE A 61 6.040 3.684 -5.659 1.00 0.00 C ATOM 963 CD2 PHE A 61 4.629 2.260 -4.377 1.00 0.00 C ATOM 964 CE1 PHE A 61 7.154 3.068 -5.126 1.00 0.00 C ATOM 965 CE2 PHE A 61 5.739 1.645 -3.834 1.00 0.00 C ATOM 966 CZ PHE A 61 7.002 2.048 -4.209 1.00 0.00 C ATOM 0 H PHE A 61 1.966 5.302 -7.089 1.00 0.00 H new ATOM 0 HA PHE A 61 4.033 3.570 -7.899 1.00 0.00 H new ATOM 0 HB2 PHE A 61 3.749 5.062 -5.830 1.00 0.00 H new ATOM 0 HB3 PHE A 61 2.716 3.805 -5.179 1.00 0.00 H new ATOM 0 HD1 PHE A 61 6.164 4.488 -6.369 1.00 0.00 H new ATOM 0 HD2 PHE A 61 3.642 1.937 -4.081 1.00 0.00 H new ATOM 0 HE1 PHE A 61 8.142 3.383 -5.426 1.00 0.00 H new ATOM 0 HE2 PHE A 61 5.617 0.848 -3.115 1.00 0.00 H new ATOM 0 HZ PHE A 61 7.871 1.567 -3.786 1.00 0.00 H new ATOM 976 N THR A 62 1.301 2.110 -6.751 1.00 0.00 N ATOM 977 CA THR A 62 0.509 0.892 -6.762 1.00 0.00 C ATOM 978 C THR A 62 0.313 0.419 -8.201 1.00 0.00 C ATOM 979 O THR A 62 0.618 -0.734 -8.541 1.00 0.00 O ATOM 980 CB THR A 62 -0.885 1.171 -6.145 1.00 0.00 C ATOM 981 OG1 THR A 62 -0.738 1.662 -4.816 1.00 0.00 O ATOM 982 CG2 THR A 62 -1.760 -0.076 -6.140 1.00 0.00 C ATOM 0 H THR A 62 0.834 2.896 -6.299 1.00 0.00 H new ATOM 0 HA THR A 62 1.029 0.128 -6.184 1.00 0.00 H new ATOM 0 HB THR A 62 -1.377 1.922 -6.763 1.00 0.00 H new ATOM 0 HG1 THR A 62 -1.604 1.632 -4.358 1.00 0.00 H new ATOM 0 HG21 THR A 62 -2.729 0.161 -5.700 1.00 0.00 H new ATOM 0 HG22 THR A 62 -1.902 -0.425 -7.163 1.00 0.00 H new ATOM 0 HG23 THR A 62 -1.276 -0.857 -5.554 1.00 0.00 H new ATOM 990 N LYS A 63 -0.151 1.347 -9.036 1.00 0.00 N ATOM 991 CA LYS A 63 -0.472 1.100 -10.425 1.00 0.00 C ATOM 992 C LYS A 63 0.712 0.471 -11.157 1.00 0.00 C ATOM 993 O LYS A 63 0.579 -0.588 -11.748 1.00 0.00 O ATOM 994 CB LYS A 63 -0.864 2.417 -11.090 1.00 0.00 C ATOM 995 CG LYS A 63 -1.431 2.270 -12.481 1.00 0.00 C ATOM 996 CD LYS A 63 -1.753 3.628 -13.094 1.00 0.00 C ATOM 997 CE LYS A 63 -0.505 4.318 -13.621 1.00 0.00 C ATOM 998 NZ LYS A 63 0.003 3.652 -14.837 1.00 0.00 N ATOM 0 H LYS A 63 -0.315 2.312 -8.750 1.00 0.00 H new ATOM 0 HA LYS A 63 -1.306 0.400 -10.476 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -1.599 2.922 -10.463 1.00 0.00 H new ATOM 0 HB3 LYS A 63 0.013 3.062 -11.135 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -0.716 1.743 -13.114 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -2.334 1.661 -12.445 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -2.468 3.500 -13.906 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -2.230 4.261 -12.346 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -0.730 5.361 -13.842 1.00 0.00 H new ATOM 0 HE3 LYS A 63 0.267 4.314 -12.852 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 1.039 3.736 -14.872 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -0.262 2.647 -14.819 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -0.409 4.104 -15.678 1.00 0.00 H new ATOM 1012 N LYS A 64 1.859 1.116 -11.068 1.00 0.00 N ATOM 1013 CA LYS A 64 3.082 0.650 -11.724 1.00 0.00 C ATOM 1014 C LYS A 64 3.421 -0.781 -11.368 1.00 0.00 C ATOM 1015 O LYS A 64 3.565 -1.616 -12.255 1.00 0.00 O ATOM 1016 CB LYS A 64 4.261 1.570 -11.392 1.00 0.00 C ATOM 1017 CG LYS A 64 4.086 2.973 -11.932 1.00 0.00 C ATOM 1018 CD LYS A 64 5.164 3.933 -11.451 1.00 0.00 C ATOM 1019 CE LYS A 64 6.514 3.637 -12.069 1.00 0.00 C ATOM 1020 NZ LYS A 64 7.540 4.601 -11.626 1.00 0.00 N ATOM 0 H LYS A 64 1.977 1.980 -10.540 1.00 0.00 H new ATOM 0 HA LYS A 64 2.893 0.682 -12.797 1.00 0.00 H new ATOM 0 HB2 LYS A 64 4.386 1.616 -10.310 1.00 0.00 H new ATOM 0 HB3 LYS A 64 5.176 1.141 -11.800 1.00 0.00 H new ATOM 0 HG2 LYS A 64 4.095 2.941 -13.021 1.00 0.00 H new ATOM 0 HG3 LYS A 64 3.109 3.353 -11.633 1.00 0.00 H new ATOM 0 HD2 LYS A 64 4.872 4.955 -11.694 1.00 0.00 H new ATOM 0 HD3 LYS A 64 5.243 3.873 -10.365 1.00 0.00 H new ATOM 0 HE2 LYS A 64 6.824 2.627 -11.801 1.00 0.00 H new ATOM 0 HE3 LYS A 64 6.431 3.667 -13.155 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 8.451 4.367 -12.070 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 7.256 5.562 -11.904 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 7.637 4.554 -10.592 1.00 0.00 H new ATOM 1034 N MET A 65 3.466 -1.086 -10.090 1.00 0.00 N ATOM 1035 CA MET A 65 3.871 -2.418 -9.673 1.00 0.00 C ATOM 1036 C MET A 65 2.879 -3.487 -10.081 1.00 0.00 C ATOM 1037 O MET A 65 3.280 -4.578 -10.458 1.00 0.00 O ATOM 1038 CB MET A 65 4.223 -2.523 -8.180 1.00 0.00 C ATOM 1039 CG MET A 65 3.095 -2.231 -7.203 1.00 0.00 C ATOM 1040 SD MET A 65 3.579 -2.543 -5.489 1.00 0.00 S ATOM 1041 CE MET A 65 4.969 -1.435 -5.315 1.00 0.00 C ATOM 0 H MET A 65 3.233 -0.446 -9.331 1.00 0.00 H new ATOM 0 HA MET A 65 4.797 -2.605 -10.218 1.00 0.00 H new ATOM 0 HB2 MET A 65 4.593 -3.529 -7.985 1.00 0.00 H new ATOM 0 HB3 MET A 65 5.043 -1.836 -7.972 1.00 0.00 H new ATOM 0 HG2 MET A 65 2.786 -1.191 -7.308 1.00 0.00 H new ATOM 0 HG3 MET A 65 2.231 -2.847 -7.453 1.00 0.00 H new ATOM 0 HE1 MET A 65 5.173 -1.270 -4.257 1.00 0.00 H new ATOM 0 HE2 MET A 65 5.846 -1.875 -5.790 1.00 0.00 H new ATOM 0 HE3 MET A 65 4.737 -0.483 -5.792 1.00 0.00 H new ATOM 1051 N VAL A 66 1.602 -3.174 -10.053 1.00 0.00 N ATOM 1052 CA VAL A 66 0.600 -4.160 -10.436 1.00 0.00 C ATOM 1053 C VAL A 66 0.484 -4.319 -11.972 1.00 0.00 C ATOM 1054 O VAL A 66 0.152 -5.393 -12.467 1.00 0.00 O ATOM 1055 CB VAL A 66 -0.798 -3.929 -9.785 1.00 0.00 C ATOM 1056 CG1 VAL A 66 -0.720 -4.082 -8.275 1.00 0.00 C ATOM 1057 CG2 VAL A 66 -1.354 -2.573 -10.140 1.00 0.00 C ATOM 0 H VAL A 66 1.232 -2.265 -9.776 1.00 0.00 H new ATOM 0 HA VAL A 66 0.970 -5.101 -10.030 1.00 0.00 H new ATOM 0 HB VAL A 66 -1.473 -4.687 -10.182 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -1.706 -3.917 -7.841 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -0.379 -5.087 -8.028 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -0.019 -3.352 -7.871 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -2.329 -2.445 -9.670 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -0.675 -1.797 -9.785 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -1.460 -2.495 -11.222 1.00 0.00 H new ATOM 1067 N GLU A 67 0.777 -3.265 -12.732 1.00 0.00 N ATOM 1068 CA GLU A 67 0.753 -3.374 -14.202 1.00 0.00 C ATOM 1069 C GLU A 67 1.986 -4.115 -14.685 1.00 0.00 C ATOM 1070 O GLU A 67 1.974 -4.773 -15.735 1.00 0.00 O ATOM 1071 CB GLU A 67 0.705 -2.005 -14.878 1.00 0.00 C ATOM 1072 CG GLU A 67 -0.519 -1.184 -14.555 1.00 0.00 C ATOM 1073 CD GLU A 67 -0.545 0.104 -15.317 1.00 0.00 C ATOM 1074 OE1 GLU A 67 0.266 1.014 -15.026 1.00 0.00 O ATOM 1075 OE2 GLU A 67 -1.351 0.227 -16.256 1.00 0.00 O ATOM 0 H GLU A 67 1.029 -2.344 -12.372 1.00 0.00 H new ATOM 0 HA GLU A 67 -0.151 -3.920 -14.470 1.00 0.00 H new ATOM 0 HB2 GLU A 67 1.591 -1.441 -14.588 1.00 0.00 H new ATOM 0 HB3 GLU A 67 0.756 -2.146 -15.958 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -1.414 -1.761 -14.787 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -0.543 -0.974 -13.486 1.00 0.00 H new ATOM 1082 N ASN A 68 3.047 -3.988 -13.925 1.00 0.00 N ATOM 1083 CA ASN A 68 4.319 -4.627 -14.232 1.00 0.00 C ATOM 1084 C ASN A 68 4.383 -6.023 -13.637 1.00 0.00 C ATOM 1085 O ASN A 68 5.344 -6.778 -13.870 1.00 0.00 O ATOM 1086 CB ASN A 68 5.488 -3.765 -13.713 1.00 0.00 C ATOM 1087 CG ASN A 68 5.667 -2.462 -14.495 1.00 0.00 C ATOM 1088 OD1 ASN A 68 5.403 -2.410 -15.691 1.00 0.00 O ATOM 1089 ND2 ASN A 68 6.063 -1.385 -13.831 1.00 0.00 N ATOM 0 H ASN A 68 3.059 -3.435 -13.068 1.00 0.00 H new ATOM 0 HA ASN A 68 4.404 -4.718 -15.315 1.00 0.00 H new ATOM 0 HB2 ASN A 68 5.320 -3.531 -12.662 1.00 0.00 H new ATOM 0 HB3 ASN A 68 6.410 -4.344 -13.767 1.00 0.00 H new ATOM 0 HD21 ASN A 68 6.153 -0.492 -14.315 1.00 0.00 H new ATOM 0 HD22 ASN A 68 6.278 -1.450 -12.836 1.00 0.00 H new ATOM 1096 N ALA A 69 3.364 -6.371 -12.885 1.00 0.00 N ATOM 1097 CA ALA A 69 3.286 -7.646 -12.231 1.00 0.00 C ATOM 1098 C ALA A 69 2.832 -8.734 -13.175 1.00 0.00 C ATOM 1099 O ALA A 69 1.823 -8.593 -13.869 1.00 0.00 O ATOM 1100 CB ALA A 69 2.353 -7.585 -11.049 1.00 0.00 C ATOM 0 H ALA A 69 2.561 -5.767 -12.712 1.00 0.00 H new ATOM 0 HA ALA A 69 4.291 -7.888 -11.887 1.00 0.00 H new ATOM 0 HB1 ALA A 69 2.310 -8.563 -10.569 1.00 0.00 H new ATOM 0 HB2 ALA A 69 2.718 -6.846 -10.335 1.00 0.00 H new ATOM 0 HB3 ALA A 69 1.356 -7.302 -11.387 1.00 0.00 H new ATOM 1106 N LYS A 70 3.585 -9.807 -13.205 1.00 0.00 N ATOM 1107 CA LYS A 70 3.231 -10.969 -13.985 1.00 0.00 C ATOM 1108 C LYS A 70 2.105 -11.745 -13.313 1.00 0.00 C ATOM 1109 O LYS A 70 1.245 -12.315 -13.974 1.00 0.00 O ATOM 1110 CB LYS A 70 4.451 -11.844 -14.186 1.00 0.00 C ATOM 1111 CG LYS A 70 5.499 -11.240 -15.109 1.00 0.00 C ATOM 1112 CD LYS A 70 4.979 -11.112 -16.539 1.00 0.00 C ATOM 1113 CE LYS A 70 5.971 -10.404 -17.449 1.00 0.00 C ATOM 1114 NZ LYS A 70 7.294 -11.066 -17.486 1.00 0.00 N ATOM 0 H LYS A 70 4.460 -9.900 -12.690 1.00 0.00 H new ATOM 0 HA LYS A 70 2.872 -10.644 -14.962 1.00 0.00 H new ATOM 0 HB2 LYS A 70 4.907 -12.043 -13.216 1.00 0.00 H new ATOM 0 HB3 LYS A 70 4.134 -12.805 -14.592 1.00 0.00 H new ATOM 0 HG2 LYS A 70 5.790 -10.257 -14.737 1.00 0.00 H new ATOM 0 HG3 LYS A 70 6.394 -11.862 -15.101 1.00 0.00 H new ATOM 0 HD2 LYS A 70 4.767 -12.104 -16.937 1.00 0.00 H new ATOM 0 HD3 LYS A 70 4.037 -10.563 -16.534 1.00 0.00 H new ATOM 0 HE2 LYS A 70 5.563 -10.362 -18.459 1.00 0.00 H new ATOM 0 HE3 LYS A 70 6.095 -9.375 -17.112 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 7.889 -10.612 -18.208 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 7.752 -10.979 -16.556 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 7.172 -12.072 -17.720 1.00 0.00 H new ATOM 1128 N LYS A 71 2.129 -11.779 -12.008 1.00 0.00 N ATOM 1129 CA LYS A 71 1.057 -12.386 -11.257 1.00 0.00 C ATOM 1130 C LYS A 71 0.579 -11.465 -10.154 1.00 0.00 C ATOM 1131 O LYS A 71 1.340 -11.098 -9.275 1.00 0.00 O ATOM 1132 CB LYS A 71 1.434 -13.773 -10.674 1.00 0.00 C ATOM 1133 CG LYS A 71 2.632 -13.814 -9.716 1.00 0.00 C ATOM 1134 CD LYS A 71 2.754 -15.197 -9.091 1.00 0.00 C ATOM 1135 CE LYS A 71 3.986 -15.373 -8.204 1.00 0.00 C ATOM 1136 NZ LYS A 71 3.974 -14.505 -7.003 1.00 0.00 N ATOM 0 H LYS A 71 2.882 -11.392 -11.438 1.00 0.00 H new ATOM 0 HA LYS A 71 0.244 -12.549 -11.965 1.00 0.00 H new ATOM 0 HB2 LYS A 71 0.565 -14.170 -10.149 1.00 0.00 H new ATOM 0 HB3 LYS A 71 1.640 -14.447 -11.505 1.00 0.00 H new ATOM 0 HG2 LYS A 71 3.547 -13.568 -10.255 1.00 0.00 H new ATOM 0 HG3 LYS A 71 2.510 -13.063 -8.936 1.00 0.00 H new ATOM 0 HD2 LYS A 71 1.861 -15.396 -8.498 1.00 0.00 H new ATOM 0 HD3 LYS A 71 2.782 -15.942 -9.886 1.00 0.00 H new ATOM 0 HE2 LYS A 71 4.053 -16.415 -7.890 1.00 0.00 H new ATOM 0 HE3 LYS A 71 4.880 -15.159 -8.790 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 4.835 -14.673 -6.445 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 3.940 -13.508 -7.296 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 3.138 -14.725 -6.424 1.00 0.00 H new ATOM 1150 N ILE A 72 -0.638 -11.044 -10.227 1.00 0.00 N ATOM 1151 CA ILE A 72 -1.212 -10.294 -9.156 1.00 0.00 C ATOM 1152 C ILE A 72 -1.948 -11.270 -8.302 1.00 0.00 C ATOM 1153 O ILE A 72 -2.667 -12.118 -8.814 1.00 0.00 O ATOM 1154 CB ILE A 72 -2.165 -9.187 -9.652 1.00 0.00 C ATOM 1155 CG1 ILE A 72 -1.396 -8.231 -10.555 1.00 0.00 C ATOM 1156 CG2 ILE A 72 -2.793 -8.434 -8.470 1.00 0.00 C ATOM 1157 CD1 ILE A 72 -2.202 -7.058 -11.034 1.00 0.00 C ATOM 0 H ILE A 72 -1.259 -11.206 -11.020 1.00 0.00 H new ATOM 0 HA ILE A 72 -0.425 -9.781 -8.603 1.00 0.00 H new ATOM 0 HB ILE A 72 -2.977 -9.642 -10.219 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -0.523 -7.863 -10.016 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -1.028 -8.782 -11.420 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -3.461 -7.659 -8.846 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -3.359 -9.132 -7.853 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -2.006 -7.976 -7.871 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -1.582 -6.426 -11.671 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -3.061 -7.415 -11.602 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -2.549 -6.480 -10.177 1.00 0.00 H new ATOM 1169 N GLU A 73 -1.717 -11.223 -7.044 1.00 0.00 N ATOM 1170 CA GLU A 73 -2.337 -12.140 -6.152 1.00 0.00 C ATOM 1171 C GLU A 73 -2.989 -11.365 -5.049 1.00 0.00 C ATOM 1172 O GLU A 73 -2.448 -10.360 -4.584 1.00 0.00 O ATOM 1173 CB GLU A 73 -1.285 -13.078 -5.578 1.00 0.00 C ATOM 1174 CG GLU A 73 -0.470 -13.810 -6.635 1.00 0.00 C ATOM 1175 CD GLU A 73 0.668 -14.590 -6.056 1.00 0.00 C ATOM 1176 OE1 GLU A 73 1.725 -13.978 -5.752 1.00 0.00 O ATOM 1177 OE2 GLU A 73 0.562 -15.831 -5.915 1.00 0.00 O ATOM 0 H GLU A 73 -1.094 -10.550 -6.599 1.00 0.00 H new ATOM 0 HA GLU A 73 -3.086 -12.731 -6.678 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -0.609 -12.505 -4.944 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -1.776 -13.812 -4.939 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -1.123 -14.486 -7.187 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -0.081 -13.087 -7.352 1.00 0.00 H new ATOM 1184 N VAL A 74 -4.137 -11.794 -4.653 1.00 0.00 N ATOM 1185 CA VAL A 74 -4.845 -11.166 -3.579 1.00 0.00 C ATOM 1186 C VAL A 74 -4.951 -12.155 -2.424 1.00 0.00 C ATOM 1187 O VAL A 74 -5.387 -13.293 -2.605 1.00 0.00 O ATOM 1188 CB VAL A 74 -6.260 -10.644 -4.029 1.00 0.00 C ATOM 1189 CG1 VAL A 74 -6.130 -9.641 -5.157 1.00 0.00 C ATOM 1190 CG2 VAL A 74 -7.168 -11.771 -4.477 1.00 0.00 C ATOM 0 H VAL A 74 -4.618 -12.594 -5.064 1.00 0.00 H new ATOM 0 HA VAL A 74 -4.292 -10.284 -3.254 1.00 0.00 H new ATOM 0 HB VAL A 74 -6.706 -10.166 -3.157 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -7.121 -9.294 -5.451 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -5.533 -8.793 -4.822 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -5.643 -10.114 -6.010 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -8.133 -11.363 -4.778 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -6.714 -12.290 -5.321 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -7.311 -12.472 -3.654 1.00 0.00 H new ATOM 1200 N GLU A 75 -4.488 -11.771 -1.278 1.00 0.00 N ATOM 1201 CA GLU A 75 -4.526 -12.640 -0.140 1.00 0.00 C ATOM 1202 C GLU A 75 -5.542 -12.152 0.866 1.00 0.00 C ATOM 1203 O GLU A 75 -5.364 -11.123 1.491 1.00 0.00 O ATOM 1204 CB GLU A 75 -3.134 -12.765 0.469 1.00 0.00 C ATOM 1205 CG GLU A 75 -3.047 -13.668 1.677 1.00 0.00 C ATOM 1206 CD GLU A 75 -1.624 -14.003 2.070 1.00 0.00 C ATOM 1207 OE1 GLU A 75 -0.894 -13.134 2.566 1.00 0.00 O ATOM 1208 OE2 GLU A 75 -1.219 -15.163 1.895 1.00 0.00 O ATOM 0 H GLU A 75 -4.076 -10.855 -1.102 1.00 0.00 H new ATOM 0 HA GLU A 75 -4.839 -13.634 -0.458 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -2.451 -13.137 -0.295 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -2.786 -11.771 0.751 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -3.546 -13.187 2.519 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -3.587 -14.592 1.472 1.00 0.00 H new ATOM 1215 N PHE A 76 -6.610 -12.883 0.993 1.00 0.00 N ATOM 1216 CA PHE A 76 -7.669 -12.524 1.917 1.00 0.00 C ATOM 1217 C PHE A 76 -7.288 -12.947 3.312 1.00 0.00 C ATOM 1218 O PHE A 76 -6.575 -13.954 3.485 1.00 0.00 O ATOM 1219 CB PHE A 76 -8.993 -13.176 1.510 1.00 0.00 C ATOM 1220 CG PHE A 76 -9.484 -12.759 0.162 1.00 0.00 C ATOM 1221 CD1 PHE A 76 -10.194 -11.584 0.005 1.00 0.00 C ATOM 1222 CD2 PHE A 76 -9.242 -13.542 -0.948 1.00 0.00 C ATOM 1223 CE1 PHE A 76 -10.652 -11.202 -1.236 1.00 0.00 C ATOM 1224 CE2 PHE A 76 -9.698 -13.166 -2.185 1.00 0.00 C ATOM 1225 CZ PHE A 76 -10.404 -11.997 -2.332 1.00 0.00 C ATOM 0 H PHE A 76 -6.780 -13.741 0.468 1.00 0.00 H new ATOM 0 HA PHE A 76 -7.803 -11.443 1.891 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -8.872 -14.259 1.523 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -9.751 -12.931 2.254 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -10.392 -10.959 0.864 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -8.687 -14.462 -0.841 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -11.204 -10.281 -1.349 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -9.502 -13.790 -3.045 1.00 0.00 H new ATOM 0 HZ PHE A 76 -10.764 -11.702 -3.306 1.00 0.00 H new ATOM 1235 N ASP A 77 -7.744 -12.188 4.294 1.00 0.00 N ATOM 1236 CA ASP A 77 -7.443 -12.472 5.690 1.00 0.00 C ATOM 1237 C ASP A 77 -8.488 -13.478 6.217 1.00 0.00 C ATOM 1238 O ASP A 77 -9.358 -13.920 5.464 1.00 0.00 O ATOM 1239 CB ASP A 77 -7.442 -11.160 6.528 1.00 0.00 C ATOM 1240 CG ASP A 77 -6.682 -11.264 7.865 1.00 0.00 C ATOM 1241 OD1 ASP A 77 -7.208 -11.857 8.839 1.00 0.00 O ATOM 1242 OD2 ASP A 77 -5.541 -10.758 7.963 1.00 0.00 O ATOM 0 H ASP A 77 -8.328 -11.364 4.150 1.00 0.00 H new ATOM 0 HA ASP A 77 -6.448 -12.907 5.779 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -6.999 -10.362 5.932 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -8.473 -10.871 6.731 1.00 0.00 H new ATOM 1247 N LYS A 78 -8.450 -13.768 7.493 1.00 0.00 N ATOM 1248 CA LYS A 78 -9.266 -14.819 8.099 1.00 0.00 C ATOM 1249 C LYS A 78 -10.704 -14.360 8.321 1.00 0.00 C ATOM 1250 O LYS A 78 -11.626 -15.184 8.408 1.00 0.00 O ATOM 1251 CB LYS A 78 -8.634 -15.242 9.440 1.00 0.00 C ATOM 1252 CG LYS A 78 -8.743 -14.180 10.547 1.00 0.00 C ATOM 1253 CD LYS A 78 -7.844 -14.481 11.735 1.00 0.00 C ATOM 1254 CE LYS A 78 -6.383 -14.239 11.391 1.00 0.00 C ATOM 1255 NZ LYS A 78 -6.129 -12.819 11.059 1.00 0.00 N ATOM 0 H LYS A 78 -7.848 -13.282 8.158 1.00 0.00 H new ATOM 0 HA LYS A 78 -9.295 -15.667 7.415 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -9.114 -16.159 9.782 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -7.582 -15.474 9.276 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -8.482 -13.204 10.137 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -9.777 -14.118 10.885 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -8.130 -13.855 12.580 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -7.981 -15.517 12.045 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -5.757 -14.534 12.233 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -6.099 -14.867 10.547 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -5.138 -12.703 10.764 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -6.757 -12.526 10.284 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -6.312 -12.229 11.895 1.00 0.00 H new ATOM 1269 N GLY A 79 -10.892 -13.058 8.397 1.00 0.00 N ATOM 1270 CA GLY A 79 -12.187 -12.513 8.689 1.00 0.00 C ATOM 1271 C GLY A 79 -13.032 -12.330 7.461 1.00 0.00 C ATOM 1272 O GLY A 79 -13.436 -13.307 6.814 1.00 0.00 O ATOM 0 H GLY A 79 -10.158 -12.363 8.259 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -12.705 -13.172 9.386 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -12.067 -11.552 9.189 1.00 0.00 H new ATOM 1276 N GLN A 80 -13.262 -11.091 7.115 1.00 0.00 N ATOM 1277 CA GLN A 80 -14.106 -10.762 6.004 1.00 0.00 C ATOM 1278 C GLN A 80 -13.332 -10.725 4.743 1.00 0.00 C ATOM 1279 O GLN A 80 -12.206 -10.229 4.687 1.00 0.00 O ATOM 1280 CB GLN A 80 -14.821 -9.441 6.192 1.00 0.00 C ATOM 1281 CG GLN A 80 -15.854 -9.459 7.280 1.00 0.00 C ATOM 1282 CD GLN A 80 -16.533 -8.114 7.486 1.00 0.00 C ATOM 1283 OE1 GLN A 80 -16.945 -7.772 8.601 1.00 0.00 O ATOM 1284 NE2 GLN A 80 -16.677 -7.346 6.418 1.00 0.00 N ATOM 0 H GLN A 80 -12.868 -10.283 7.598 1.00 0.00 H new ATOM 0 HA GLN A 80 -14.859 -11.548 5.948 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -14.085 -8.669 6.416 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -15.300 -9.162 5.254 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -16.610 -10.207 7.042 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -15.383 -9.768 8.213 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -16.325 -7.659 5.513 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -17.140 -6.441 6.499 1.00 0.00 H new ATOM 1293 N ARG A 81 -13.937 -11.238 3.751 1.00 0.00 N ATOM 1294 CA ARG A 81 -13.357 -11.277 2.430 1.00 0.00 C ATOM 1295 C ARG A 81 -13.663 -9.971 1.698 1.00 0.00 C ATOM 1296 O ARG A 81 -12.920 -9.533 0.820 1.00 0.00 O ATOM 1297 CB ARG A 81 -13.899 -12.493 1.681 1.00 0.00 C ATOM 1298 CG ARG A 81 -13.470 -12.631 0.250 1.00 0.00 C ATOM 1299 CD ARG A 81 -13.937 -13.950 -0.298 1.00 0.00 C ATOM 1300 NE ARG A 81 -15.390 -14.119 -0.142 1.00 0.00 N ATOM 1301 CZ ARG A 81 -16.065 -15.238 -0.408 1.00 0.00 C ATOM 1302 NH1 ARG A 81 -15.451 -16.282 -0.956 1.00 0.00 N ATOM 1303 NH2 ARG A 81 -17.361 -15.304 -0.132 1.00 0.00 N ATOM 0 H ARG A 81 -14.866 -11.656 3.811 1.00 0.00 H new ATOM 0 HA ARG A 81 -12.273 -11.374 2.491 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -13.595 -13.391 2.219 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -14.988 -12.457 1.711 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -13.882 -11.814 -0.343 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -12.385 -12.561 0.178 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -13.674 -14.020 -1.353 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -13.419 -14.761 0.214 1.00 0.00 H new ATOM 0 HE ARG A 81 -15.923 -13.318 0.196 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -14.456 -16.231 -1.176 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -15.975 -17.134 -1.156 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -17.836 -14.502 0.281 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -17.882 -16.157 -0.333 1.00 0.00 H new ATOM 1317 N THR A 82 -14.730 -9.335 2.098 1.00 0.00 N ATOM 1318 CA THR A 82 -15.147 -8.098 1.517 1.00 0.00 C ATOM 1319 C THR A 82 -15.509 -7.102 2.611 1.00 0.00 C ATOM 1320 O THR A 82 -15.894 -7.499 3.722 1.00 0.00 O ATOM 1321 CB THR A 82 -16.345 -8.314 0.564 1.00 0.00 C ATOM 1322 OG1 THR A 82 -17.310 -9.193 1.182 1.00 0.00 O ATOM 1323 CG2 THR A 82 -15.897 -8.907 -0.763 1.00 0.00 C ATOM 0 H THR A 82 -15.338 -9.669 2.846 1.00 0.00 H new ATOM 0 HA THR A 82 -14.320 -7.694 0.933 1.00 0.00 H new ATOM 0 HB THR A 82 -16.799 -7.342 0.370 1.00 0.00 H new ATOM 0 HG1 THR A 82 -18.068 -9.325 0.575 1.00 0.00 H new ATOM 0 HG21 THR A 82 -16.763 -9.046 -1.410 1.00 0.00 H new ATOM 0 HG22 THR A 82 -15.190 -8.231 -1.244 1.00 0.00 H new ATOM 0 HG23 THR A 82 -15.416 -9.869 -0.588 1.00 0.00 H new ATOM 1331 N ASP A 83 -15.341 -5.838 2.318 1.00 0.00 N ATOM 1332 CA ASP A 83 -15.662 -4.762 3.227 1.00 0.00 C ATOM 1333 C ASP A 83 -17.154 -4.446 3.118 1.00 0.00 C ATOM 1334 O ASP A 83 -17.853 -5.035 2.287 1.00 0.00 O ATOM 1335 CB ASP A 83 -14.787 -3.508 2.914 1.00 0.00 C ATOM 1336 CG ASP A 83 -15.491 -2.386 2.181 1.00 0.00 C ATOM 1337 OD1 ASP A 83 -15.716 -2.479 0.976 1.00 0.00 O ATOM 1338 OD2 ASP A 83 -15.851 -1.382 2.832 1.00 0.00 O ATOM 0 H ASP A 83 -14.970 -5.519 1.423 1.00 0.00 H new ATOM 0 HA ASP A 83 -15.443 -5.064 4.251 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -14.397 -3.116 3.853 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -13.930 -3.824 2.320 1.00 0.00 H new ATOM 1343 N LYS A 84 -17.631 -3.525 3.932 1.00 0.00 N ATOM 1344 CA LYS A 84 -19.034 -3.141 3.967 1.00 0.00 C ATOM 1345 C LYS A 84 -19.495 -2.577 2.602 1.00 0.00 C ATOM 1346 O LYS A 84 -20.647 -2.748 2.209 1.00 0.00 O ATOM 1347 CB LYS A 84 -19.243 -2.114 5.128 1.00 0.00 C ATOM 1348 CG LYS A 84 -20.694 -1.695 5.435 1.00 0.00 C ATOM 1349 CD LYS A 84 -21.262 -0.695 4.429 1.00 0.00 C ATOM 1350 CE LYS A 84 -22.729 -0.428 4.684 1.00 0.00 C ATOM 1351 NZ LYS A 84 -23.557 -1.649 4.514 1.00 0.00 N ATOM 0 H LYS A 84 -17.050 -3.014 4.597 1.00 0.00 H new ATOM 0 HA LYS A 84 -19.652 -4.019 4.157 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -18.812 -2.536 6.036 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -18.673 -1.215 4.893 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -21.326 -2.583 5.449 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -20.735 -1.258 6.433 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -20.705 0.240 4.489 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -21.131 -1.080 3.418 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -22.856 -0.042 5.695 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -23.080 0.346 4.001 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -24.554 -1.378 4.394 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -23.237 -2.171 3.674 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -23.461 -2.253 5.355 1.00 0.00 H new ATOM 1365 N TYR A 85 -18.590 -1.957 1.871 1.00 0.00 N ATOM 1366 CA TYR A 85 -18.930 -1.353 0.594 1.00 0.00 C ATOM 1367 C TYR A 85 -18.864 -2.405 -0.532 1.00 0.00 C ATOM 1368 O TYR A 85 -19.237 -2.143 -1.687 1.00 0.00 O ATOM 1369 CB TYR A 85 -17.983 -0.185 0.310 1.00 0.00 C ATOM 1370 CG TYR A 85 -18.498 0.794 -0.715 1.00 0.00 C ATOM 1371 CD1 TYR A 85 -19.496 1.697 -0.379 1.00 0.00 C ATOM 1372 CD2 TYR A 85 -17.997 0.821 -2.008 1.00 0.00 C ATOM 1373 CE1 TYR A 85 -19.982 2.596 -1.300 1.00 0.00 C ATOM 1374 CE2 TYR A 85 -18.479 1.720 -2.934 1.00 0.00 C ATOM 1375 CZ TYR A 85 -19.471 2.605 -2.573 1.00 0.00 C ATOM 1376 OH TYR A 85 -19.960 3.499 -3.497 1.00 0.00 O ATOM 0 H TYR A 85 -17.611 -1.857 2.139 1.00 0.00 H new ATOM 0 HA TYR A 85 -19.950 -0.972 0.636 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -17.792 0.348 1.241 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -17.027 -0.582 -0.031 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -19.899 1.694 0.623 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -17.219 0.128 -2.293 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -20.761 3.290 -1.022 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -18.081 1.731 -3.938 1.00 0.00 H new ATOM 0 HH TYR A 85 -19.492 3.377 -4.349 1.00 0.00 H new ATOM 1386 N GLY A 86 -18.390 -3.581 -0.193 1.00 0.00 N ATOM 1387 CA GLY A 86 -18.314 -4.655 -1.146 1.00 0.00 C ATOM 1388 C GLY A 86 -16.976 -4.710 -1.831 1.00 0.00 C ATOM 1389 O GLY A 86 -16.836 -5.330 -2.901 1.00 0.00 O ATOM 0 H GLY A 86 -18.051 -3.815 0.740 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -18.501 -5.602 -0.640 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -19.098 -4.533 -1.893 1.00 0.00 H new ATOM 1393 N ARG A 87 -15.994 -4.063 -1.248 1.00 0.00 N ATOM 1394 CA ARG A 87 -14.665 -4.067 -1.805 1.00 0.00 C ATOM 1395 C ARG A 87 -13.896 -5.195 -1.165 1.00 0.00 C ATOM 1396 O ARG A 87 -14.079 -5.466 0.010 1.00 0.00 O ATOM 1397 CB ARG A 87 -13.993 -2.727 -1.539 1.00 0.00 C ATOM 1398 CG ARG A 87 -14.738 -1.554 -2.154 1.00 0.00 C ATOM 1399 CD ARG A 87 -14.282 -0.237 -1.564 1.00 0.00 C ATOM 1400 NE ARG A 87 -14.573 -0.158 -0.123 1.00 0.00 N ATOM 1401 CZ ARG A 87 -14.327 0.906 0.659 1.00 0.00 C ATOM 1402 NH1 ARG A 87 -13.780 2.010 0.147 1.00 0.00 N ATOM 1403 NH2 ARG A 87 -14.656 0.864 1.945 1.00 0.00 N ATOM 0 H ARG A 87 -16.093 -3.526 -0.386 1.00 0.00 H new ATOM 0 HA ARG A 87 -14.697 -4.215 -2.884 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -13.913 -2.575 -0.463 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -12.977 -2.752 -1.934 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -14.579 -1.545 -3.232 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -15.809 -1.676 -1.991 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -13.211 -0.117 -1.726 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -14.777 0.585 -2.081 1.00 0.00 H new ATOM 0 HE ARG A 87 -14.995 -0.976 0.316 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -13.546 2.050 -0.845 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -13.596 2.814 0.747 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -15.092 0.028 2.333 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -14.472 1.668 2.545 1.00 0.00 H new ATOM 1417 N GLY A 88 -13.086 -5.867 -1.925 1.00 0.00 N ATOM 1418 CA GLY A 88 -12.357 -6.996 -1.401 1.00 0.00 C ATOM 1419 C GLY A 88 -11.289 -6.596 -0.404 1.00 0.00 C ATOM 1420 O GLY A 88 -10.510 -5.660 -0.650 1.00 0.00 O ATOM 0 H GLY A 88 -12.909 -5.659 -2.908 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -13.055 -7.683 -0.922 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -11.893 -7.537 -2.226 1.00 0.00 H new ATOM 1424 N LEU A 89 -11.264 -7.282 0.713 1.00 0.00 N ATOM 1425 CA LEU A 89 -10.289 -7.041 1.749 1.00 0.00 C ATOM 1426 C LEU A 89 -9.179 -8.044 1.602 1.00 0.00 C ATOM 1427 O LEU A 89 -9.254 -9.155 2.138 1.00 0.00 O ATOM 1428 CB LEU A 89 -10.912 -7.171 3.150 1.00 0.00 C ATOM 1429 CG LEU A 89 -12.011 -6.175 3.521 1.00 0.00 C ATOM 1430 CD1 LEU A 89 -12.580 -6.504 4.892 1.00 0.00 C ATOM 1431 CD2 LEU A 89 -11.469 -4.763 3.514 1.00 0.00 C ATOM 0 H LEU A 89 -11.924 -8.028 0.930 1.00 0.00 H new ATOM 0 HA LEU A 89 -9.910 -6.024 1.644 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -11.321 -8.177 3.246 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -10.112 -7.081 3.885 1.00 0.00 H new ATOM 0 HG LEU A 89 -12.807 -6.249 2.780 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -13.361 -5.787 5.143 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -13.001 -7.509 4.880 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -11.786 -6.452 5.637 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -12.264 -4.067 3.780 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -10.658 -4.681 4.237 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -11.094 -4.522 2.519 1.00 0.00 H new ATOM 1443 N ALA A 90 -8.181 -7.690 0.849 1.00 0.00 N ATOM 1444 CA ALA A 90 -7.104 -8.590 0.598 1.00 0.00 C ATOM 1445 C ALA A 90 -5.788 -7.870 0.558 1.00 0.00 C ATOM 1446 O ALA A 90 -5.718 -6.681 0.224 1.00 0.00 O ATOM 1447 CB ALA A 90 -7.330 -9.334 -0.709 1.00 0.00 C ATOM 0 H ALA A 90 -8.093 -6.780 0.398 1.00 0.00 H new ATOM 0 HA ALA A 90 -7.073 -9.308 1.418 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -6.500 -10.017 -0.887 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -8.259 -9.900 -0.649 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -7.393 -8.618 -1.529 1.00 0.00 H new ATOM 1453 N TYR A 91 -4.772 -8.579 0.927 1.00 0.00 N ATOM 1454 CA TYR A 91 -3.426 -8.125 0.845 1.00 0.00 C ATOM 1455 C TYR A 91 -2.985 -8.422 -0.567 1.00 0.00 C ATOM 1456 O TYR A 91 -2.983 -9.570 -0.988 1.00 0.00 O ATOM 1457 CB TYR A 91 -2.547 -8.887 1.844 1.00 0.00 C ATOM 1458 CG TYR A 91 -2.992 -8.784 3.297 1.00 0.00 C ATOM 1459 CD1 TYR A 91 -2.581 -7.735 4.110 1.00 0.00 C ATOM 1460 CD2 TYR A 91 -3.821 -9.752 3.858 1.00 0.00 C ATOM 1461 CE1 TYR A 91 -2.979 -7.661 5.439 1.00 0.00 C ATOM 1462 CE2 TYR A 91 -4.225 -9.681 5.174 1.00 0.00 C ATOM 1463 CZ TYR A 91 -3.800 -8.640 5.964 1.00 0.00 C ATOM 1464 OH TYR A 91 -4.203 -8.571 7.290 1.00 0.00 O ATOM 0 H TYR A 91 -4.861 -9.522 1.306 1.00 0.00 H new ATOM 0 HA TYR A 91 -3.342 -7.065 1.082 1.00 0.00 H new ATOM 0 HB2 TYR A 91 -2.526 -9.939 1.559 1.00 0.00 H new ATOM 0 HB3 TYR A 91 -1.526 -8.515 1.765 1.00 0.00 H new ATOM 0 HD1 TYR A 91 -1.942 -6.965 3.703 1.00 0.00 H new ATOM 0 HD2 TYR A 91 -4.155 -10.578 3.248 1.00 0.00 H new ATOM 0 HE1 TYR A 91 -2.648 -6.841 6.059 1.00 0.00 H new ATOM 0 HE2 TYR A 91 -4.874 -10.441 5.583 1.00 0.00 H new ATOM 0 HH TYR A 91 -4.509 -9.454 7.585 1.00 0.00 H new ATOM 1474 N ILE A 92 -2.656 -7.421 -1.295 1.00 0.00 N ATOM 1475 CA ILE A 92 -2.370 -7.583 -2.686 1.00 0.00 C ATOM 1476 C ILE A 92 -0.881 -7.679 -2.933 1.00 0.00 C ATOM 1477 O ILE A 92 -0.087 -6.887 -2.402 1.00 0.00 O ATOM 1478 CB ILE A 92 -3.027 -6.450 -3.516 1.00 0.00 C ATOM 1479 CG1 ILE A 92 -4.549 -6.499 -3.291 1.00 0.00 C ATOM 1480 CG2 ILE A 92 -2.693 -6.588 -5.009 1.00 0.00 C ATOM 1481 CD1 ILE A 92 -5.326 -5.411 -3.981 1.00 0.00 C ATOM 0 H ILE A 92 -2.575 -6.464 -0.952 1.00 0.00 H new ATOM 0 HA ILE A 92 -2.806 -8.526 -3.018 1.00 0.00 H new ATOM 0 HB ILE A 92 -2.634 -5.487 -3.188 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -4.921 -7.465 -3.633 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -4.745 -6.443 -2.220 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -3.168 -5.779 -5.564 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -1.613 -6.537 -5.146 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -3.061 -7.546 -5.377 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -6.388 -5.528 -3.764 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -4.988 -4.439 -3.622 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -5.166 -5.476 -5.057 1.00 0.00 H new ATOM 1493 N TYR A 93 -0.516 -8.669 -3.689 1.00 0.00 N ATOM 1494 CA TYR A 93 0.838 -8.919 -4.047 1.00 0.00 C ATOM 1495 C TYR A 93 0.993 -8.749 -5.545 1.00 0.00 C ATOM 1496 O TYR A 93 0.254 -9.346 -6.328 1.00 0.00 O ATOM 1497 CB TYR A 93 1.261 -10.347 -3.640 1.00 0.00 C ATOM 1498 CG TYR A 93 1.203 -10.634 -2.145 1.00 0.00 C ATOM 1499 CD1 TYR A 93 0.005 -10.950 -1.522 1.00 0.00 C ATOM 1500 CD2 TYR A 93 2.348 -10.596 -1.363 1.00 0.00 C ATOM 1501 CE1 TYR A 93 -0.053 -11.208 -0.170 1.00 0.00 C ATOM 1502 CE2 TYR A 93 2.295 -10.860 -0.002 1.00 0.00 C ATOM 1503 CZ TYR A 93 1.084 -11.164 0.586 1.00 0.00 C ATOM 1504 OH TYR A 93 1.016 -11.421 1.945 1.00 0.00 O ATOM 0 H TYR A 93 -1.174 -9.342 -4.083 1.00 0.00 H new ATOM 0 HA TYR A 93 1.478 -8.211 -3.521 1.00 0.00 H new ATOM 0 HB2 TYR A 93 0.620 -11.061 -4.157 1.00 0.00 H new ATOM 0 HB3 TYR A 93 2.279 -10.522 -3.989 1.00 0.00 H new ATOM 0 HD1 TYR A 93 -0.901 -10.995 -2.109 1.00 0.00 H new ATOM 0 HD2 TYR A 93 3.296 -10.357 -1.821 1.00 0.00 H new ATOM 0 HE1 TYR A 93 -0.999 -11.446 0.293 1.00 0.00 H new ATOM 0 HE2 TYR A 93 3.195 -10.828 0.593 1.00 0.00 H new ATOM 0 HH TYR A 93 0.151 -11.829 2.158 1.00 0.00 H new ATOM 1514 N ALA A 94 1.936 -7.950 -5.933 1.00 0.00 N ATOM 1515 CA ALA A 94 2.252 -7.742 -7.305 1.00 0.00 C ATOM 1516 C ALA A 94 3.501 -8.537 -7.579 1.00 0.00 C ATOM 1517 O ALA A 94 4.572 -8.212 -7.078 1.00 0.00 O ATOM 1518 CB ALA A 94 2.502 -6.261 -7.547 1.00 0.00 C ATOM 0 H ALA A 94 2.518 -7.414 -5.289 1.00 0.00 H new ATOM 0 HA ALA A 94 1.440 -8.057 -7.960 1.00 0.00 H new ATOM 0 HB1 ALA A 94 2.744 -6.100 -8.597 1.00 0.00 H new ATOM 0 HB2 ALA A 94 1.607 -5.694 -7.290 1.00 0.00 H new ATOM 0 HB3 ALA A 94 3.334 -5.926 -6.927 1.00 0.00 H new ATOM 1524 N ASP A 95 3.325 -9.637 -8.305 1.00 0.00 N ATOM 1525 CA ASP A 95 4.370 -10.637 -8.633 1.00 0.00 C ATOM 1526 C ASP A 95 5.047 -11.187 -7.394 1.00 0.00 C ATOM 1527 O ASP A 95 6.122 -11.755 -7.446 1.00 0.00 O ATOM 1528 CB ASP A 95 5.379 -10.202 -9.722 1.00 0.00 C ATOM 1529 CG ASP A 95 6.280 -9.037 -9.386 1.00 0.00 C ATOM 1530 OD1 ASP A 95 7.285 -9.207 -8.663 1.00 0.00 O ATOM 1531 OD2 ASP A 95 6.037 -7.933 -9.900 1.00 0.00 O ATOM 0 H ASP A 95 2.418 -9.878 -8.703 1.00 0.00 H new ATOM 0 HA ASP A 95 3.823 -11.458 -9.097 1.00 0.00 H new ATOM 0 HB2 ASP A 95 6.007 -11.059 -9.965 1.00 0.00 H new ATOM 0 HB3 ASP A 95 4.820 -9.951 -10.623 1.00 0.00 H new ATOM 1536 N GLY A 96 4.299 -11.191 -6.318 1.00 0.00 N ATOM 1537 CA GLY A 96 4.819 -11.632 -5.041 1.00 0.00 C ATOM 1538 C GLY A 96 5.311 -10.500 -4.137 1.00 0.00 C ATOM 1539 O GLY A 96 5.692 -10.746 -2.989 1.00 0.00 O ATOM 0 H GLY A 96 3.324 -10.893 -6.298 1.00 0.00 H new ATOM 0 HA2 GLY A 96 4.041 -12.187 -4.517 1.00 0.00 H new ATOM 0 HA3 GLY A 96 5.642 -12.325 -5.217 1.00 0.00 H new ATOM 1543 N LYS A 97 5.316 -9.276 -4.627 1.00 0.00 N ATOM 1544 CA LYS A 97 5.672 -8.139 -3.789 1.00 0.00 C ATOM 1545 C LYS A 97 4.417 -7.589 -3.139 1.00 0.00 C ATOM 1546 O LYS A 97 3.458 -7.286 -3.833 1.00 0.00 O ATOM 1547 CB LYS A 97 6.361 -7.032 -4.590 1.00 0.00 C ATOM 1548 CG LYS A 97 7.729 -7.416 -5.118 1.00 0.00 C ATOM 1549 CD LYS A 97 8.435 -6.232 -5.793 1.00 0.00 C ATOM 1550 CE LYS A 97 7.748 -5.752 -7.080 1.00 0.00 C ATOM 1551 NZ LYS A 97 7.950 -6.674 -8.219 1.00 0.00 N ATOM 0 H LYS A 97 5.081 -9.040 -5.591 1.00 0.00 H new ATOM 0 HA LYS A 97 6.375 -8.484 -3.031 1.00 0.00 H new ATOM 0 HB2 LYS A 97 5.723 -6.754 -5.429 1.00 0.00 H new ATOM 0 HB3 LYS A 97 6.461 -6.149 -3.959 1.00 0.00 H new ATOM 0 HG2 LYS A 97 8.344 -7.786 -4.298 1.00 0.00 H new ATOM 0 HG3 LYS A 97 7.626 -8.233 -5.833 1.00 0.00 H new ATOM 0 HD2 LYS A 97 8.486 -5.402 -5.088 1.00 0.00 H new ATOM 0 HD3 LYS A 97 9.461 -6.517 -6.025 1.00 0.00 H new ATOM 0 HE2 LYS A 97 6.680 -5.640 -6.895 1.00 0.00 H new ATOM 0 HE3 LYS A 97 8.131 -4.766 -7.345 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 7.296 -6.424 -8.988 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 8.930 -6.596 -8.559 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 7.767 -7.651 -7.912 1.00 0.00 H new ATOM 1565 N MET A 98 4.405 -7.456 -1.829 1.00 0.00 N ATOM 1566 CA MET A 98 3.203 -6.986 -1.149 1.00 0.00 C ATOM 1567 C MET A 98 3.050 -5.494 -1.350 1.00 0.00 C ATOM 1568 O MET A 98 3.861 -4.701 -0.844 1.00 0.00 O ATOM 1569 CB MET A 98 3.219 -7.297 0.350 1.00 0.00 C ATOM 1570 CG MET A 98 1.876 -7.026 1.034 1.00 0.00 C ATOM 1571 SD MET A 98 1.949 -7.119 2.839 1.00 0.00 S ATOM 1572 CE MET A 98 2.653 -8.749 3.076 1.00 0.00 C ATOM 0 H MET A 98 5.195 -7.661 -1.218 1.00 0.00 H new ATOM 0 HA MET A 98 2.358 -7.517 -1.587 1.00 0.00 H new ATOM 0 HB2 MET A 98 3.489 -8.343 0.495 1.00 0.00 H new ATOM 0 HB3 MET A 98 3.992 -6.698 0.831 1.00 0.00 H new ATOM 0 HG2 MET A 98 1.523 -6.036 0.744 1.00 0.00 H new ATOM 0 HG3 MET A 98 1.142 -7.745 0.671 1.00 0.00 H new ATOM 0 HE1 MET A 98 2.515 -9.058 4.112 1.00 0.00 H new ATOM 0 HE2 MET A 98 2.155 -9.460 2.416 1.00 0.00 H new ATOM 0 HE3 MET A 98 3.718 -8.723 2.844 1.00 0.00 H new ATOM 1582 N VAL A 99 2.017 -5.127 -2.070 1.00 0.00 N ATOM 1583 CA VAL A 99 1.725 -3.749 -2.417 1.00 0.00 C ATOM 1584 C VAL A 99 1.422 -2.945 -1.162 1.00 0.00 C ATOM 1585 O VAL A 99 1.986 -1.881 -0.951 1.00 0.00 O ATOM 1586 CB VAL A 99 0.507 -3.673 -3.379 1.00 0.00 C ATOM 1587 CG1 VAL A 99 0.199 -2.242 -3.775 1.00 0.00 C ATOM 1588 CG2 VAL A 99 0.732 -4.531 -4.616 1.00 0.00 C ATOM 0 H VAL A 99 1.338 -5.791 -2.442 1.00 0.00 H new ATOM 0 HA VAL A 99 2.600 -3.332 -2.915 1.00 0.00 H new ATOM 0 HB VAL A 99 -0.356 -4.065 -2.840 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -0.658 -2.227 -4.448 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -0.030 -1.659 -2.883 1.00 0.00 H new ATOM 0 HG13 VAL A 99 1.063 -1.810 -4.279 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -0.136 -4.459 -5.272 1.00 0.00 H new ATOM 0 HG22 VAL A 99 1.617 -4.180 -5.146 1.00 0.00 H new ATOM 0 HG23 VAL A 99 0.876 -5.569 -4.317 1.00 0.00 H new ATOM 1598 N ASN A 100 0.564 -3.510 -0.311 1.00 0.00 N ATOM 1599 CA ASN A 100 0.124 -2.866 0.944 1.00 0.00 C ATOM 1600 C ASN A 100 1.320 -2.452 1.774 1.00 0.00 C ATOM 1601 O ASN A 100 1.413 -1.310 2.225 1.00 0.00 O ATOM 1602 CB ASN A 100 -0.736 -3.828 1.775 1.00 0.00 C ATOM 1603 CG ASN A 100 -1.911 -4.383 1.012 1.00 0.00 C ATOM 1604 OD1 ASN A 100 -1.796 -5.405 0.364 1.00 0.00 O ATOM 1605 ND2 ASN A 100 -3.035 -3.729 1.069 1.00 0.00 N ATOM 0 H ASN A 100 0.149 -4.429 -0.466 1.00 0.00 H new ATOM 0 HA ASN A 100 -0.463 -1.988 0.676 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -0.114 -4.653 2.123 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -1.099 -3.307 2.661 1.00 0.00 H new ATOM 0 HD21 ASN A 100 -3.851 -4.071 0.561 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -3.100 -2.874 1.622 1.00 0.00 H new ATOM 1612 N GLU A 101 2.247 -3.390 1.940 1.00 0.00 N ATOM 1613 CA GLU A 101 3.451 -3.159 2.701 1.00 0.00 C ATOM 1614 C GLU A 101 4.280 -2.069 2.053 1.00 0.00 C ATOM 1615 O GLU A 101 4.668 -1.117 2.714 1.00 0.00 O ATOM 1616 CB GLU A 101 4.285 -4.429 2.800 1.00 0.00 C ATOM 1617 CG GLU A 101 5.518 -4.246 3.651 1.00 0.00 C ATOM 1618 CD GLU A 101 6.483 -5.393 3.542 1.00 0.00 C ATOM 1619 OE1 GLU A 101 7.039 -5.606 2.451 1.00 0.00 O ATOM 1620 OE2 GLU A 101 6.754 -6.056 4.550 1.00 0.00 O ATOM 0 H GLU A 101 2.177 -4.329 1.547 1.00 0.00 H new ATOM 0 HA GLU A 101 3.157 -2.849 3.704 1.00 0.00 H new ATOM 0 HB2 GLU A 101 3.674 -5.229 3.218 1.00 0.00 H new ATOM 0 HB3 GLU A 101 4.581 -4.744 1.800 1.00 0.00 H new ATOM 0 HG2 GLU A 101 6.022 -3.325 3.357 1.00 0.00 H new ATOM 0 HG3 GLU A 101 5.219 -4.127 4.693 1.00 0.00 H new ATOM 1627 N ALA A 102 4.498 -2.194 0.747 1.00 0.00 N ATOM 1628 CA ALA A 102 5.332 -1.266 0.001 1.00 0.00 C ATOM 1629 C ALA A 102 4.807 0.161 0.081 1.00 0.00 C ATOM 1630 O ALA A 102 5.582 1.089 0.247 1.00 0.00 O ATOM 1631 CB ALA A 102 5.475 -1.712 -1.444 1.00 0.00 C ATOM 0 H ALA A 102 4.100 -2.942 0.179 1.00 0.00 H new ATOM 0 HA ALA A 102 6.319 -1.272 0.463 1.00 0.00 H new ATOM 0 HB1 ALA A 102 6.103 -1.003 -1.983 1.00 0.00 H new ATOM 0 HB2 ALA A 102 5.934 -2.700 -1.476 1.00 0.00 H new ATOM 0 HB3 ALA A 102 4.491 -1.753 -1.911 1.00 0.00 H new ATOM 1637 N LEU A 103 3.493 0.320 0.004 1.00 0.00 N ATOM 1638 CA LEU A 103 2.867 1.637 0.081 1.00 0.00 C ATOM 1639 C LEU A 103 3.167 2.305 1.406 1.00 0.00 C ATOM 1640 O LEU A 103 3.574 3.463 1.456 1.00 0.00 O ATOM 1641 CB LEU A 103 1.347 1.542 -0.092 1.00 0.00 C ATOM 1642 CG LEU A 103 0.851 0.924 -1.387 1.00 0.00 C ATOM 1643 CD1 LEU A 103 -0.663 0.964 -1.451 1.00 0.00 C ATOM 1644 CD2 LEU A 103 1.475 1.616 -2.579 1.00 0.00 C ATOM 0 H LEU A 103 2.835 -0.450 -0.112 1.00 0.00 H new ATOM 0 HA LEU A 103 3.284 2.234 -0.730 1.00 0.00 H new ATOM 0 HB2 LEU A 103 0.944 0.963 0.739 1.00 0.00 H new ATOM 0 HB3 LEU A 103 0.931 2.546 -0.012 1.00 0.00 H new ATOM 0 HG LEU A 103 1.156 -0.122 -1.414 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -1.000 0.517 -2.386 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -1.078 0.405 -0.612 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -1.002 1.999 -1.401 1.00 0.00 H new ATOM 0 HD21 LEU A 103 1.108 1.159 -3.498 1.00 0.00 H new ATOM 0 HD22 LEU A 103 1.208 2.673 -2.567 1.00 0.00 H new ATOM 0 HD23 LEU A 103 2.559 1.515 -2.532 1.00 0.00 H new ATOM 1656 N VAL A 104 2.973 1.579 2.471 1.00 0.00 N ATOM 1657 CA VAL A 104 3.185 2.119 3.787 1.00 0.00 C ATOM 1658 C VAL A 104 4.683 2.309 4.056 1.00 0.00 C ATOM 1659 O VAL A 104 5.109 3.342 4.559 1.00 0.00 O ATOM 1660 CB VAL A 104 2.543 1.230 4.876 1.00 0.00 C ATOM 1661 CG1 VAL A 104 2.655 1.885 6.227 1.00 0.00 C ATOM 1662 CG2 VAL A 104 1.091 0.958 4.557 1.00 0.00 C ATOM 0 H VAL A 104 2.667 0.606 2.454 1.00 0.00 H new ATOM 0 HA VAL A 104 2.697 3.093 3.828 1.00 0.00 H new ATOM 0 HB VAL A 104 3.081 0.282 4.897 1.00 0.00 H new ATOM 0 HG11 VAL A 104 2.198 1.244 6.981 1.00 0.00 H new ATOM 0 HG12 VAL A 104 3.706 2.039 6.471 1.00 0.00 H new ATOM 0 HG13 VAL A 104 2.142 2.847 6.209 1.00 0.00 H new ATOM 0 HG21 VAL A 104 0.659 0.331 5.336 1.00 0.00 H new ATOM 0 HG22 VAL A 104 0.547 1.901 4.507 1.00 0.00 H new ATOM 0 HG23 VAL A 104 1.019 0.446 3.597 1.00 0.00 H new ATOM 1672 N ARG A 105 5.471 1.327 3.638 1.00 0.00 N ATOM 1673 CA ARG A 105 6.921 1.309 3.849 1.00 0.00 C ATOM 1674 C ARG A 105 7.589 2.474 3.119 1.00 0.00 C ATOM 1675 O ARG A 105 8.613 2.994 3.563 1.00 0.00 O ATOM 1676 CB ARG A 105 7.511 0.010 3.292 1.00 0.00 C ATOM 1677 CG ARG A 105 8.941 -0.257 3.720 1.00 0.00 C ATOM 1678 CD ARG A 105 9.689 -1.089 2.693 1.00 0.00 C ATOM 1679 NE ARG A 105 9.041 -2.359 2.346 1.00 0.00 N ATOM 1680 CZ ARG A 105 9.111 -2.923 1.119 1.00 0.00 C ATOM 1681 NH1 ARG A 105 9.689 -2.265 0.105 1.00 0.00 N ATOM 1682 NH2 ARG A 105 8.578 -4.113 0.895 1.00 0.00 N ATOM 0 H ARG A 105 5.122 0.510 3.137 1.00 0.00 H new ATOM 0 HA ARG A 105 7.103 1.389 4.921 1.00 0.00 H new ATOM 0 HB2 ARG A 105 6.887 -0.825 3.610 1.00 0.00 H new ATOM 0 HB3 ARG A 105 7.470 0.043 2.203 1.00 0.00 H new ATOM 0 HG2 ARG A 105 9.459 0.690 3.868 1.00 0.00 H new ATOM 0 HG3 ARG A 105 8.943 -0.775 4.679 1.00 0.00 H new ATOM 0 HD2 ARG A 105 9.810 -0.498 1.785 1.00 0.00 H new ATOM 0 HD3 ARG A 105 10.689 -1.298 3.073 1.00 0.00 H new ATOM 0 HE ARG A 105 8.509 -2.843 3.070 1.00 0.00 H new ATOM 0 HH11 ARG A 105 10.079 -1.335 0.257 1.00 0.00 H new ATOM 0 HH12 ARG A 105 9.739 -2.694 -0.819 1.00 0.00 H new ATOM 0 HH21 ARG A 105 8.110 -4.612 1.651 1.00 0.00 H new ATOM 0 HH22 ARG A 105 8.635 -4.531 -0.034 1.00 0.00 H new ATOM 1696 N GLN A 106 7.008 2.860 1.992 1.00 0.00 N ATOM 1697 CA GLN A 106 7.561 3.909 1.158 1.00 0.00 C ATOM 1698 C GLN A 106 6.929 5.273 1.492 1.00 0.00 C ATOM 1699 O GLN A 106 7.236 6.308 0.864 1.00 0.00 O ATOM 1700 CB GLN A 106 7.349 3.553 -0.316 1.00 0.00 C ATOM 1701 CG GLN A 106 8.097 4.434 -1.285 1.00 0.00 C ATOM 1702 CD GLN A 106 9.587 4.376 -1.057 1.00 0.00 C ATOM 1703 OE1 GLN A 106 10.104 5.274 -0.258 1.00 0.00 O flip ATOM 1704 NE2 GLN A 106 10.270 3.524 -1.616 1.00 0.00 N flip ATOM 0 H GLN A 106 6.143 2.454 1.634 1.00 0.00 H new ATOM 0 HA GLN A 106 8.630 3.990 1.354 1.00 0.00 H new ATOM 0 HB2 GLN A 106 7.654 2.519 -0.475 1.00 0.00 H new ATOM 0 HB3 GLN A 106 6.284 3.609 -0.541 1.00 0.00 H new ATOM 0 HG2 GLN A 106 7.873 4.124 -2.306 1.00 0.00 H new ATOM 0 HG3 GLN A 106 7.753 5.463 -1.181 1.00 0.00 H new ATOM 0 HE21 GLN A 106 9.829 2.841 -2.232 1.00 0.00 H new ATOM 0 HE22 GLN A 106 11.278 3.499 -1.465 1.00 0.00 H new ATOM 1713 N GLY A 107 6.087 5.271 2.488 1.00 0.00 N ATOM 1714 CA GLY A 107 5.434 6.478 2.922 1.00 0.00 C ATOM 1715 C GLY A 107 4.479 7.014 1.897 1.00 0.00 C ATOM 1716 O GLY A 107 4.574 8.169 1.497 1.00 0.00 O ATOM 0 H GLY A 107 5.834 4.438 3.020 1.00 0.00 H new ATOM 0 HA2 GLY A 107 4.895 6.283 3.849 1.00 0.00 H new ATOM 0 HA3 GLY A 107 6.186 7.235 3.144 1.00 0.00 H new ATOM 1720 N LEU A 108 3.604 6.170 1.438 1.00 0.00 N ATOM 1721 CA LEU A 108 2.577 6.545 0.490 1.00 0.00 C ATOM 1722 C LEU A 108 1.200 6.209 1.044 1.00 0.00 C ATOM 1723 O LEU A 108 0.190 6.756 0.606 1.00 0.00 O ATOM 1724 CB LEU A 108 2.837 5.853 -0.841 1.00 0.00 C ATOM 1725 CG LEU A 108 4.096 6.320 -1.569 1.00 0.00 C ATOM 1726 CD1 LEU A 108 4.549 5.280 -2.514 1.00 0.00 C ATOM 1727 CD2 LEU A 108 3.819 7.594 -2.340 1.00 0.00 C ATOM 0 H LEU A 108 3.576 5.187 1.710 1.00 0.00 H new ATOM 0 HA LEU A 108 2.605 7.622 0.323 1.00 0.00 H new ATOM 0 HB2 LEU A 108 2.911 4.779 -0.668 1.00 0.00 H new ATOM 0 HB3 LEU A 108 1.977 6.013 -1.492 1.00 0.00 H new ATOM 0 HG LEU A 108 4.871 6.507 -0.825 1.00 0.00 H new ATOM 0 HD11 LEU A 108 5.447 5.622 -3.028 1.00 0.00 H new ATOM 0 HD12 LEU A 108 4.771 4.363 -1.967 1.00 0.00 H new ATOM 0 HD13 LEU A 108 3.764 5.086 -3.245 1.00 0.00 H new ATOM 0 HD21 LEU A 108 4.726 7.913 -2.853 1.00 0.00 H new ATOM 0 HD22 LEU A 108 3.033 7.412 -3.073 1.00 0.00 H new ATOM 0 HD23 LEU A 108 3.498 8.375 -1.650 1.00 0.00 H new ATOM 1739 N ALA A 109 1.170 5.338 2.031 1.00 0.00 N ATOM 1740 CA ALA A 109 -0.055 4.963 2.690 1.00 0.00 C ATOM 1741 C ALA A 109 0.169 4.981 4.183 1.00 0.00 C ATOM 1742 O ALA A 109 1.280 4.711 4.647 1.00 0.00 O ATOM 1743 CB ALA A 109 -0.518 3.588 2.238 1.00 0.00 C ATOM 0 H ALA A 109 2.000 4.871 2.397 1.00 0.00 H new ATOM 0 HA ALA A 109 -0.837 5.676 2.426 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -1.444 3.329 2.751 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -0.689 3.597 1.162 1.00 0.00 H new ATOM 0 HB3 ALA A 109 0.247 2.850 2.477 1.00 0.00 H new ATOM 1749 N LYS A 110 -0.851 5.341 4.913 1.00 0.00 N ATOM 1750 CA LYS A 110 -0.804 5.399 6.361 1.00 0.00 C ATOM 1751 C LYS A 110 -1.510 4.185 6.890 1.00 0.00 C ATOM 1752 O LYS A 110 -2.283 3.553 6.152 1.00 0.00 O ATOM 1753 CB LYS A 110 -1.594 6.609 6.865 1.00 0.00 C ATOM 1754 CG LYS A 110 -1.259 7.925 6.213 1.00 0.00 C ATOM 1755 CD LYS A 110 -2.174 9.010 6.730 1.00 0.00 C ATOM 1756 CE LYS A 110 -1.954 10.315 6.009 1.00 0.00 C ATOM 1757 NZ LYS A 110 -2.871 11.360 6.499 1.00 0.00 N ATOM 0 H LYS A 110 -1.754 5.607 4.520 1.00 0.00 H new ATOM 0 HA LYS A 110 0.235 5.458 6.684 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -2.656 6.412 6.720 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -1.431 6.704 7.939 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -0.221 8.187 6.417 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -1.359 7.839 5.131 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -3.212 8.699 6.610 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -2.005 9.151 7.797 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -0.923 10.640 6.147 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -2.102 10.171 4.939 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -2.695 12.246 5.983 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -3.854 11.059 6.345 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -2.711 11.513 7.515 1.00 0.00 H new ATOM 1771 N VAL A 111 -1.260 3.835 8.121 1.00 0.00 N ATOM 1772 CA VAL A 111 -2.043 2.807 8.746 1.00 0.00 C ATOM 1773 C VAL A 111 -3.292 3.469 9.322 1.00 0.00 C ATOM 1774 O VAL A 111 -3.212 4.555 9.937 1.00 0.00 O ATOM 1775 CB VAL A 111 -1.261 2.070 9.864 1.00 0.00 C ATOM 1776 CG1 VAL A 111 -2.088 0.936 10.464 1.00 0.00 C ATOM 1777 CG2 VAL A 111 0.040 1.534 9.319 1.00 0.00 C ATOM 0 H VAL A 111 -0.529 4.241 8.705 1.00 0.00 H new ATOM 0 HA VAL A 111 -2.302 2.052 8.004 1.00 0.00 H new ATOM 0 HB VAL A 111 -1.049 2.787 10.657 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -1.512 0.439 11.245 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -3.005 1.341 10.892 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -2.339 0.217 9.684 1.00 0.00 H new ATOM 0 HG21 VAL A 111 0.582 1.018 10.112 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -0.166 0.837 8.507 1.00 0.00 H new ATOM 0 HG23 VAL A 111 0.645 2.359 8.944 1.00 0.00 H new ATOM 1787 N ALA A 112 -4.416 2.861 9.118 1.00 0.00 N ATOM 1788 CA ALA A 112 -5.669 3.407 9.566 1.00 0.00 C ATOM 1789 C ALA A 112 -6.202 2.571 10.700 1.00 0.00 C ATOM 1790 O ALA A 112 -5.481 1.705 11.226 1.00 0.00 O ATOM 1791 CB ALA A 112 -6.648 3.431 8.415 1.00 0.00 C ATOM 0 H ALA A 112 -4.498 1.967 8.634 1.00 0.00 H new ATOM 0 HA ALA A 112 -5.524 4.427 9.922 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -7.598 3.845 8.754 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -6.249 4.049 7.611 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -6.804 2.416 8.049 1.00 0.00 H new ATOM 1797 N TYR A 113 -7.423 2.837 11.125 1.00 0.00 N ATOM 1798 CA TYR A 113 -8.002 2.056 12.174 1.00 0.00 C ATOM 1799 C TYR A 113 -8.334 0.673 11.637 1.00 0.00 C ATOM 1800 O TYR A 113 -9.231 0.503 10.796 1.00 0.00 O ATOM 1801 CB TYR A 113 -9.230 2.725 12.798 1.00 0.00 C ATOM 1802 CG TYR A 113 -9.703 2.010 14.045 1.00 0.00 C ATOM 1803 CD1 TYR A 113 -8.978 2.105 15.226 1.00 0.00 C ATOM 1804 CD2 TYR A 113 -10.853 1.231 14.046 1.00 0.00 C ATOM 1805 CE1 TYR A 113 -9.377 1.446 16.365 1.00 0.00 C ATOM 1806 CE2 TYR A 113 -11.261 0.573 15.190 1.00 0.00 C ATOM 1807 CZ TYR A 113 -10.518 0.682 16.343 1.00 0.00 C ATOM 1808 OH TYR A 113 -10.918 0.009 17.487 1.00 0.00 O ATOM 0 H TYR A 113 -8.018 3.580 10.759 1.00 0.00 H new ATOM 0 HA TYR A 113 -7.272 1.969 12.979 1.00 0.00 H new ATOM 0 HB2 TYR A 113 -8.991 3.760 13.044 1.00 0.00 H new ATOM 0 HB3 TYR A 113 -10.038 2.749 12.067 1.00 0.00 H new ATOM 0 HD1 TYR A 113 -8.083 2.709 15.250 1.00 0.00 H new ATOM 0 HD2 TYR A 113 -11.435 1.139 13.141 1.00 0.00 H new ATOM 0 HE1 TYR A 113 -8.796 1.529 17.272 1.00 0.00 H new ATOM 0 HE2 TYR A 113 -12.160 -0.025 15.179 1.00 0.00 H new ATOM 0 HH TYR A 113 -11.745 -0.484 17.304 1.00 0.00 H new ATOM 1818 N VAL A 114 -7.552 -0.275 12.087 1.00 0.00 N ATOM 1819 CA VAL A 114 -7.627 -1.660 11.692 1.00 0.00 C ATOM 1820 C VAL A 114 -9.014 -2.248 11.965 1.00 0.00 C ATOM 1821 O VAL A 114 -9.580 -2.070 13.058 1.00 0.00 O ATOM 1822 CB VAL A 114 -6.549 -2.477 12.446 1.00 0.00 C ATOM 1823 CG1 VAL A 114 -6.559 -3.927 12.023 1.00 0.00 C ATOM 1824 CG2 VAL A 114 -5.166 -1.869 12.237 1.00 0.00 C ATOM 0 H VAL A 114 -6.814 -0.096 12.768 1.00 0.00 H new ATOM 0 HA VAL A 114 -7.447 -1.716 10.618 1.00 0.00 H new ATOM 0 HB VAL A 114 -6.789 -2.437 13.509 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -5.790 -4.471 12.572 1.00 0.00 H new ATOM 0 HG12 VAL A 114 -7.535 -4.362 12.238 1.00 0.00 H new ATOM 0 HG13 VAL A 114 -6.359 -3.995 10.954 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -4.424 -2.459 12.775 1.00 0.00 H new ATOM 0 HG22 VAL A 114 -4.926 -1.867 11.174 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -5.158 -0.846 12.612 1.00 0.00 H new ATOM 1834 N TYR A 115 -9.546 -2.931 10.980 1.00 0.00 N ATOM 1835 CA TYR A 115 -10.843 -3.543 11.078 1.00 0.00 C ATOM 1836 C TYR A 115 -10.679 -5.037 11.308 1.00 0.00 C ATOM 1837 O TYR A 115 -10.207 -5.757 10.432 1.00 0.00 O ATOM 1838 CB TYR A 115 -11.638 -3.276 9.799 1.00 0.00 C ATOM 1839 CG TYR A 115 -13.061 -3.785 9.819 1.00 0.00 C ATOM 1840 CD1 TYR A 115 -14.076 -3.018 10.368 1.00 0.00 C ATOM 1841 CD2 TYR A 115 -13.392 -5.024 9.286 1.00 0.00 C ATOM 1842 CE1 TYR A 115 -15.375 -3.471 10.391 1.00 0.00 C ATOM 1843 CE2 TYR A 115 -14.690 -5.480 9.307 1.00 0.00 C ATOM 1844 CZ TYR A 115 -15.676 -4.698 9.864 1.00 0.00 C ATOM 1845 OH TYR A 115 -16.978 -5.152 9.890 1.00 0.00 O ATOM 0 H TYR A 115 -9.085 -3.077 10.082 1.00 0.00 H new ATOM 0 HA TYR A 115 -11.390 -3.116 11.919 1.00 0.00 H new ATOM 0 HB2 TYR A 115 -11.654 -2.202 9.616 1.00 0.00 H new ATOM 0 HB3 TYR A 115 -11.115 -3.735 8.960 1.00 0.00 H new ATOM 0 HD1 TYR A 115 -13.844 -2.049 10.785 1.00 0.00 H new ATOM 0 HD2 TYR A 115 -12.619 -5.639 8.849 1.00 0.00 H new ATOM 0 HE1 TYR A 115 -16.154 -2.861 10.823 1.00 0.00 H new ATOM 0 HE2 TYR A 115 -14.934 -6.446 8.889 1.00 0.00 H new ATOM 0 HH TYR A 115 -17.023 -6.039 9.476 1.00 0.00 H new ATOM 1855 N LYS A 116 -11.058 -5.490 12.473 1.00 0.00 N ATOM 1856 CA LYS A 116 -10.926 -6.884 12.833 1.00 0.00 C ATOM 1857 C LYS A 116 -12.080 -7.701 12.244 1.00 0.00 C ATOM 1858 O LYS A 116 -13.133 -7.134 11.913 1.00 0.00 O ATOM 1859 CB LYS A 116 -10.848 -7.015 14.353 1.00 0.00 C ATOM 1860 CG LYS A 116 -9.598 -6.381 14.905 1.00 0.00 C ATOM 1861 CD LYS A 116 -9.566 -6.400 16.416 1.00 0.00 C ATOM 1862 CE LYS A 116 -8.313 -5.719 16.930 1.00 0.00 C ATOM 1863 NZ LYS A 116 -8.192 -5.784 18.400 1.00 0.00 N ATOM 0 H LYS A 116 -11.468 -4.906 13.202 1.00 0.00 H new ATOM 0 HA LYS A 116 -10.004 -7.285 12.413 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -11.723 -6.546 14.804 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -10.873 -8.069 14.629 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -8.725 -6.907 14.518 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -9.530 -5.351 14.555 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -10.448 -5.896 16.810 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -9.600 -7.429 16.773 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -7.439 -6.186 16.476 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -8.316 -4.675 16.616 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -7.319 -5.304 18.698 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -9.011 -5.315 18.837 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -8.161 -6.779 18.702 1.00 0.00 H new ATOM 1877 N PRO A 117 -11.928 -9.040 12.075 1.00 0.00 N ATOM 1878 CA PRO A 117 -10.727 -9.826 12.452 1.00 0.00 C ATOM 1879 C PRO A 117 -9.586 -9.759 11.427 1.00 0.00 C ATOM 1880 O PRO A 117 -8.591 -10.507 11.533 1.00 0.00 O ATOM 1881 CB PRO A 117 -11.257 -11.275 12.527 1.00 0.00 C ATOM 1882 CG PRO A 117 -12.729 -11.192 12.253 1.00 0.00 C ATOM 1883 CD PRO A 117 -12.950 -9.911 11.510 1.00 0.00 C ATOM 0 HA PRO A 117 -10.294 -9.440 13.375 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -10.759 -11.911 11.795 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -11.067 -11.710 13.508 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -13.063 -12.046 11.663 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -13.298 -11.205 13.182 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -12.826 -10.039 10.435 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -13.953 -9.517 11.670 1.00 0.00 H new ATOM 1891 N ASN A 118 -9.706 -8.876 10.460 1.00 0.00 N ATOM 1892 CA ASN A 118 -8.691 -8.740 9.419 1.00 0.00 C ATOM 1893 C ASN A 118 -7.504 -7.967 9.928 1.00 0.00 C ATOM 1894 O ASN A 118 -7.445 -6.751 9.832 1.00 0.00 O ATOM 1895 CB ASN A 118 -9.231 -8.093 8.126 1.00 0.00 C ATOM 1896 CG ASN A 118 -10.293 -8.917 7.419 1.00 0.00 C ATOM 1897 OD1 ASN A 118 -11.093 -9.616 8.044 1.00 0.00 O ATOM 1898 ND2 ASN A 118 -10.293 -8.866 6.115 1.00 0.00 N ATOM 0 H ASN A 118 -10.495 -8.237 10.366 1.00 0.00 H new ATOM 0 HA ASN A 118 -8.382 -9.753 9.162 1.00 0.00 H new ATOM 0 HB2 ASN A 118 -9.646 -7.115 8.368 1.00 0.00 H new ATOM 0 HB3 ASN A 118 -8.400 -7.926 7.441 1.00 0.00 H new ATOM 0 HD21 ASN A 118 -10.969 -9.415 5.583 1.00 0.00 H new ATOM 0 HD22 ASN A 118 -9.617 -8.277 5.628 1.00 0.00 H new ATOM 1905 N ASN A 119 -6.591 -8.680 10.530 1.00 0.00 N ATOM 1906 CA ASN A 119 -5.397 -8.085 11.071 1.00 0.00 C ATOM 1907 C ASN A 119 -4.298 -9.106 11.257 1.00 0.00 C ATOM 1908 O ASN A 119 -4.157 -9.738 12.309 1.00 0.00 O ATOM 1909 CB ASN A 119 -5.634 -7.208 12.347 1.00 0.00 C ATOM 1910 CG ASN A 119 -6.182 -7.908 13.612 1.00 0.00 C ATOM 1911 OD1 ASN A 119 -7.027 -8.886 13.456 1.00 0.00 O flip ATOM 1912 ND2 ASN A 119 -5.866 -7.510 14.734 1.00 0.00 N flip ATOM 0 H ASN A 119 -6.653 -9.690 10.660 1.00 0.00 H new ATOM 0 HA ASN A 119 -5.057 -7.375 10.317 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -4.687 -6.736 12.609 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -6.326 -6.409 12.080 1.00 0.00 H new ATOM 0 HD21 ASN A 119 -5.202 -6.742 14.835 1.00 0.00 H new ATOM 0 HD22 ASN A 119 -6.268 -7.948 15.563 1.00 0.00 H new ATOM 1919 N THR A 120 -3.593 -9.349 10.192 1.00 0.00 N ATOM 1920 CA THR A 120 -2.459 -10.245 10.232 1.00 0.00 C ATOM 1921 C THR A 120 -1.186 -9.496 9.807 1.00 0.00 C ATOM 1922 O THR A 120 -0.067 -9.919 10.071 1.00 0.00 O ATOM 1923 CB THR A 120 -2.704 -11.462 9.319 1.00 0.00 C ATOM 1924 OG1 THR A 120 -3.996 -12.006 9.625 1.00 0.00 O ATOM 1925 CG2 THR A 120 -1.648 -12.549 9.525 1.00 0.00 C ATOM 0 H THR A 120 -3.779 -8.940 9.276 1.00 0.00 H new ATOM 0 HA THR A 120 -2.328 -10.606 11.252 1.00 0.00 H new ATOM 0 HB THR A 120 -2.648 -11.131 8.282 1.00 0.00 H new ATOM 0 HG1 THR A 120 -4.692 -11.384 9.327 1.00 0.00 H new ATOM 0 HG21 THR A 120 -1.857 -13.389 8.863 1.00 0.00 H new ATOM 0 HG22 THR A 120 -0.661 -12.145 9.299 1.00 0.00 H new ATOM 0 HG23 THR A 120 -1.672 -12.888 10.561 1.00 0.00 H new ATOM 1933 N HIS A 121 -1.356 -8.378 9.137 1.00 0.00 N ATOM 1934 CA HIS A 121 -0.206 -7.591 8.735 1.00 0.00 C ATOM 1935 C HIS A 121 -0.338 -6.149 9.194 1.00 0.00 C ATOM 1936 O HIS A 121 0.410 -5.301 8.744 1.00 0.00 O ATOM 1937 CB HIS A 121 0.068 -7.669 7.209 1.00 0.00 C ATOM 1938 CG HIS A 121 0.522 -9.025 6.703 1.00 0.00 C ATOM 1939 ND1 HIS A 121 0.012 -9.623 5.562 1.00 0.00 N ATOM 1940 CD2 HIS A 121 1.482 -9.872 7.160 1.00 0.00 C ATOM 1941 CE1 HIS A 121 0.638 -10.769 5.352 1.00 0.00 C ATOM 1942 NE2 HIS A 121 1.528 -10.939 6.304 1.00 0.00 N ATOM 0 H HIS A 121 -2.261 -7.996 8.862 1.00 0.00 H new ATOM 0 HA HIS A 121 0.659 -8.030 9.232 1.00 0.00 H new ATOM 0 HB2 HIS A 121 -0.841 -7.387 6.678 1.00 0.00 H new ATOM 0 HB3 HIS A 121 0.828 -6.931 6.954 1.00 0.00 H new ATOM 0 HD1 HIS A 121 -0.730 -9.240 4.976 1.00 0.00 H new ATOM 0 HD2 HIS A 121 2.096 -9.729 8.037 1.00 0.00 H new ATOM 0 HE1 HIS A 121 0.450 -11.450 4.536 1.00 0.00 H new ATOM 1951 N GLU A 122 -1.241 -5.900 10.151 1.00 0.00 N ATOM 1952 CA GLU A 122 -1.486 -4.571 10.679 1.00 0.00 C ATOM 1953 C GLU A 122 -0.197 -4.005 11.324 1.00 0.00 C ATOM 1954 O GLU A 122 0.187 -2.862 11.087 1.00 0.00 O ATOM 1955 CB GLU A 122 -2.664 -4.573 11.712 1.00 0.00 C ATOM 1956 CG GLU A 122 -2.383 -5.147 13.125 1.00 0.00 C ATOM 1957 CD GLU A 122 -2.151 -6.650 13.200 1.00 0.00 C ATOM 1958 OE1 GLU A 122 -1.283 -7.181 12.486 1.00 0.00 O ATOM 1959 OE2 GLU A 122 -2.826 -7.321 13.982 1.00 0.00 O ATOM 0 H GLU A 122 -1.820 -6.624 10.576 1.00 0.00 H new ATOM 0 HA GLU A 122 -1.777 -3.927 9.849 1.00 0.00 H new ATOM 0 HB2 GLU A 122 -3.008 -3.546 11.830 1.00 0.00 H new ATOM 0 HB3 GLU A 122 -3.489 -5.138 11.279 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -1.507 -4.643 13.533 1.00 0.00 H new ATOM 0 HG3 GLU A 122 -3.224 -4.896 13.771 1.00 0.00 H new ATOM 1966 N GLN A 123 0.482 -4.845 12.096 1.00 0.00 N ATOM 1967 CA GLN A 123 1.728 -4.470 12.770 1.00 0.00 C ATOM 1968 C GLN A 123 2.881 -4.344 11.805 1.00 0.00 C ATOM 1969 O GLN A 123 3.764 -3.502 11.978 1.00 0.00 O ATOM 1970 CB GLN A 123 2.051 -5.383 13.970 1.00 0.00 C ATOM 1971 CG GLN A 123 1.489 -6.797 13.891 1.00 0.00 C ATOM 1972 CD GLN A 123 2.056 -7.670 12.787 1.00 0.00 C ATOM 1973 OE1 GLN A 123 3.219 -7.561 12.404 1.00 0.00 O ATOM 1974 NE2 GLN A 123 1.221 -8.490 12.233 1.00 0.00 N ATOM 0 H GLN A 123 0.188 -5.805 12.275 1.00 0.00 H new ATOM 0 HA GLN A 123 1.568 -3.476 13.188 1.00 0.00 H new ATOM 0 HB2 GLN A 123 3.134 -5.447 14.074 1.00 0.00 H new ATOM 0 HB3 GLN A 123 1.671 -4.910 14.876 1.00 0.00 H new ATOM 0 HG2 GLN A 123 1.664 -7.292 14.846 1.00 0.00 H new ATOM 0 HG3 GLN A 123 0.409 -6.732 13.759 1.00 0.00 H new ATOM 0 HE21 GLN A 123 0.263 -8.553 12.578 1.00 0.00 H new ATOM 0 HE22 GLN A 123 1.521 -9.073 11.451 1.00 0.00 H new ATOM 1983 N LEU A 124 2.838 -5.141 10.756 1.00 0.00 N ATOM 1984 CA LEU A 124 3.825 -5.071 9.709 1.00 0.00 C ATOM 1985 C LEU A 124 3.714 -3.726 9.023 1.00 0.00 C ATOM 1986 O LEU A 124 4.711 -3.096 8.690 1.00 0.00 O ATOM 1987 CB LEU A 124 3.628 -6.204 8.697 1.00 0.00 C ATOM 1988 CG LEU A 124 4.528 -6.163 7.458 1.00 0.00 C ATOM 1989 CD1 LEU A 124 6.000 -6.245 7.839 1.00 0.00 C ATOM 1990 CD2 LEU A 124 4.153 -7.270 6.493 1.00 0.00 C ATOM 0 H LEU A 124 2.120 -5.850 10.610 1.00 0.00 H new ATOM 0 HA LEU A 124 4.819 -5.183 10.143 1.00 0.00 H new ATOM 0 HB2 LEU A 124 3.790 -7.153 9.208 1.00 0.00 H new ATOM 0 HB3 LEU A 124 2.589 -6.193 8.367 1.00 0.00 H new ATOM 0 HG LEU A 124 4.373 -5.206 6.960 1.00 0.00 H new ATOM 0 HD11 LEU A 124 6.612 -6.213 6.937 1.00 0.00 H new ATOM 0 HD12 LEU A 124 6.257 -5.403 8.481 1.00 0.00 H new ATOM 0 HD13 LEU A 124 6.187 -7.178 8.371 1.00 0.00 H new ATOM 0 HD21 LEU A 124 4.802 -7.226 5.619 1.00 0.00 H new ATOM 0 HD22 LEU A 124 4.271 -8.236 6.984 1.00 0.00 H new ATOM 0 HD23 LEU A 124 3.116 -7.145 6.181 1.00 0.00 H new ATOM 2002 N LEU A 125 2.504 -3.276 8.857 1.00 0.00 N ATOM 2003 CA LEU A 125 2.256 -2.000 8.253 1.00 0.00 C ATOM 2004 C LEU A 125 2.639 -0.882 9.197 1.00 0.00 C ATOM 2005 O LEU A 125 3.258 0.078 8.784 1.00 0.00 O ATOM 2006 CB LEU A 125 0.808 -1.899 7.796 1.00 0.00 C ATOM 2007 CG LEU A 125 0.400 -2.942 6.758 1.00 0.00 C ATOM 2008 CD1 LEU A 125 -1.060 -2.812 6.396 1.00 0.00 C ATOM 2009 CD2 LEU A 125 1.281 -2.837 5.526 1.00 0.00 C ATOM 0 H LEU A 125 1.664 -3.782 9.136 1.00 0.00 H new ATOM 0 HA LEU A 125 2.881 -1.899 7.366 1.00 0.00 H new ATOM 0 HB2 LEU A 125 0.158 -1.996 8.665 1.00 0.00 H new ATOM 0 HB3 LEU A 125 0.639 -0.905 7.381 1.00 0.00 H new ATOM 0 HG LEU A 125 0.541 -3.930 7.196 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -1.320 -3.568 5.655 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -1.670 -2.953 7.288 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -1.246 -1.821 5.983 1.00 0.00 H new ATOM 0 HD21 LEU A 125 0.977 -3.587 4.796 1.00 0.00 H new ATOM 0 HD22 LEU A 125 1.179 -1.844 5.089 1.00 0.00 H new ATOM 0 HD23 LEU A 125 2.321 -3.005 5.807 1.00 0.00 H new ATOM 2021 N ARG A 126 2.332 -1.041 10.477 1.00 0.00 N ATOM 2022 CA ARG A 126 2.686 -0.032 11.477 1.00 0.00 C ATOM 2023 C ARG A 126 4.185 0.197 11.567 1.00 0.00 C ATOM 2024 O ARG A 126 4.634 1.342 11.643 1.00 0.00 O ATOM 2025 CB ARG A 126 2.112 -0.366 12.837 1.00 0.00 C ATOM 2026 CG ARG A 126 0.624 -0.150 12.942 1.00 0.00 C ATOM 2027 CD ARG A 126 0.132 -0.616 14.278 1.00 0.00 C ATOM 2028 NE ARG A 126 -1.278 -0.292 14.519 1.00 0.00 N ATOM 2029 CZ ARG A 126 -2.031 -0.856 15.469 1.00 0.00 C ATOM 2030 NH1 ARG A 126 -1.559 -1.878 16.176 1.00 0.00 N ATOM 2031 NH2 ARG A 126 -3.259 -0.413 15.689 1.00 0.00 N ATOM 0 H ARG A 126 1.841 -1.853 10.850 1.00 0.00 H new ATOM 0 HA ARG A 126 2.236 0.902 11.139 1.00 0.00 H new ATOM 0 HB2 ARG A 126 2.335 -1.407 13.069 1.00 0.00 H new ATOM 0 HB3 ARG A 126 2.612 0.243 13.591 1.00 0.00 H new ATOM 0 HG2 ARG A 126 0.391 0.906 12.808 1.00 0.00 H new ATOM 0 HG3 ARG A 126 0.112 -0.693 12.147 1.00 0.00 H new ATOM 0 HD2 ARG A 126 0.268 -1.695 14.352 1.00 0.00 H new ATOM 0 HD3 ARG A 126 0.741 -0.163 15.060 1.00 0.00 H new ATOM 0 HE ARG A 126 -1.713 0.411 13.922 1.00 0.00 H new ATOM 0 HH11 ARG A 126 -0.620 -2.234 15.994 1.00 0.00 H new ATOM 0 HH12 ARG A 126 -2.135 -2.307 16.900 1.00 0.00 H new ATOM 0 HH21 ARG A 126 -3.630 0.358 15.134 1.00 0.00 H new ATOM 0 HH22 ARG A 126 -3.834 -0.843 16.414 1.00 0.00 H new ATOM 2045 N LYS A 127 4.961 -0.872 11.520 1.00 0.00 N ATOM 2046 CA LYS A 127 6.409 -0.735 11.585 1.00 0.00 C ATOM 2047 C LYS A 127 6.939 -0.134 10.288 1.00 0.00 C ATOM 2048 O LYS A 127 7.899 0.648 10.292 1.00 0.00 O ATOM 2049 CB LYS A 127 7.081 -2.064 11.894 1.00 0.00 C ATOM 2050 CG LYS A 127 6.962 -3.106 10.806 1.00 0.00 C ATOM 2051 CD LYS A 127 7.399 -4.444 11.301 1.00 0.00 C ATOM 2052 CE LYS A 127 8.855 -4.441 11.748 1.00 0.00 C ATOM 2053 NZ LYS A 127 9.286 -5.759 12.235 1.00 0.00 N ATOM 0 H LYS A 127 4.622 -1.831 11.438 1.00 0.00 H new ATOM 0 HA LYS A 127 6.651 -0.057 12.403 1.00 0.00 H new ATOM 0 HB2 LYS A 127 8.138 -1.883 12.089 1.00 0.00 H new ATOM 0 HB3 LYS A 127 6.652 -2.467 12.811 1.00 0.00 H new ATOM 0 HG2 LYS A 127 5.930 -3.161 10.461 1.00 0.00 H new ATOM 0 HG3 LYS A 127 7.570 -2.814 9.949 1.00 0.00 H new ATOM 0 HD2 LYS A 127 6.765 -4.747 12.134 1.00 0.00 H new ATOM 0 HD3 LYS A 127 7.264 -5.184 10.512 1.00 0.00 H new ATOM 0 HE2 LYS A 127 9.489 -4.138 10.915 1.00 0.00 H new ATOM 0 HE3 LYS A 127 8.990 -3.701 12.537 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 10.283 -5.712 12.529 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 8.699 -6.038 13.047 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 9.182 -6.461 11.475 1.00 0.00 H new ATOM 2067 N SER A 128 6.306 -0.502 9.180 1.00 0.00 N ATOM 2068 CA SER A 128 6.632 0.064 7.887 1.00 0.00 C ATOM 2069 C SER A 128 6.359 1.581 7.886 1.00 0.00 C ATOM 2070 O SER A 128 7.187 2.370 7.409 1.00 0.00 O ATOM 2071 CB SER A 128 5.830 -0.647 6.804 1.00 0.00 C ATOM 2072 OG SER A 128 6.169 -2.029 6.756 1.00 0.00 O ATOM 0 H SER A 128 5.559 -1.196 9.157 1.00 0.00 H new ATOM 0 HA SER A 128 7.692 -0.081 7.680 1.00 0.00 H new ATOM 0 HB2 SER A 128 4.764 -0.535 7.001 1.00 0.00 H new ATOM 0 HB3 SER A 128 6.026 -0.185 5.836 1.00 0.00 H new ATOM 0 HG SER A 128 5.531 -2.541 7.296 1.00 0.00 H new ATOM 2078 N GLU A 129 5.222 1.964 8.468 1.00 0.00 N ATOM 2079 CA GLU A 129 4.819 3.356 8.615 1.00 0.00 C ATOM 2080 C GLU A 129 5.845 4.103 9.435 1.00 0.00 C ATOM 2081 O GLU A 129 6.329 5.149 9.031 1.00 0.00 O ATOM 2082 CB GLU A 129 3.458 3.436 9.318 1.00 0.00 C ATOM 2083 CG GLU A 129 2.963 4.845 9.530 1.00 0.00 C ATOM 2084 CD GLU A 129 1.734 4.914 10.394 1.00 0.00 C ATOM 2085 OE1 GLU A 129 1.876 4.998 11.651 1.00 0.00 O ATOM 2086 OE2 GLU A 129 0.621 4.923 9.862 1.00 0.00 O ATOM 0 H GLU A 129 4.548 1.303 8.855 1.00 0.00 H new ATOM 0 HA GLU A 129 4.744 3.806 7.625 1.00 0.00 H new ATOM 0 HB2 GLU A 129 2.723 2.888 8.729 1.00 0.00 H new ATOM 0 HB3 GLU A 129 3.529 2.937 10.284 1.00 0.00 H new ATOM 0 HG2 GLU A 129 3.755 5.437 9.988 1.00 0.00 H new ATOM 0 HG3 GLU A 129 2.746 5.297 8.562 1.00 0.00 H new ATOM 2093 N ALA A 130 6.179 3.533 10.577 1.00 0.00 N ATOM 2094 CA ALA A 130 7.153 4.103 11.503 1.00 0.00 C ATOM 2095 C ALA A 130 8.494 4.369 10.814 1.00 0.00 C ATOM 2096 O ALA A 130 9.153 5.387 11.077 1.00 0.00 O ATOM 2097 CB ALA A 130 7.336 3.187 12.702 1.00 0.00 C ATOM 0 H ALA A 130 5.780 2.650 10.896 1.00 0.00 H new ATOM 0 HA ALA A 130 6.768 5.062 11.849 1.00 0.00 H new ATOM 0 HB1 ALA A 130 8.065 3.623 13.385 1.00 0.00 H new ATOM 0 HB2 ALA A 130 6.383 3.067 13.217 1.00 0.00 H new ATOM 0 HB3 ALA A 130 7.692 2.213 12.365 1.00 0.00 H new ATOM 2103 N GLN A 131 8.887 3.472 9.930 1.00 0.00 N ATOM 2104 CA GLN A 131 10.122 3.635 9.182 1.00 0.00 C ATOM 2105 C GLN A 131 9.992 4.809 8.246 1.00 0.00 C ATOM 2106 O GLN A 131 10.828 5.710 8.238 1.00 0.00 O ATOM 2107 CB GLN A 131 10.404 2.398 8.364 1.00 0.00 C ATOM 2108 CG GLN A 131 11.694 2.488 7.555 1.00 0.00 C ATOM 2109 CD GLN A 131 11.989 1.250 6.743 1.00 0.00 C ATOM 2110 OE1 GLN A 131 10.969 0.537 6.341 1.00 0.00 O flip ATOM 2111 NE2 GLN A 131 13.146 0.935 6.477 1.00 0.00 N flip ATOM 0 H GLN A 131 8.369 2.621 9.711 1.00 0.00 H new ATOM 0 HA GLN A 131 10.937 3.801 9.887 1.00 0.00 H new ATOM 0 HB2 GLN A 131 10.460 1.536 9.029 1.00 0.00 H new ATOM 0 HB3 GLN A 131 9.570 2.222 7.685 1.00 0.00 H new ATOM 0 HG2 GLN A 131 11.633 3.345 6.885 1.00 0.00 H new ATOM 0 HG3 GLN A 131 12.526 2.673 8.234 1.00 0.00 H new ATOM 0 HE21 GLN A 131 13.920 1.512 6.805 1.00 0.00 H new ATOM 0 HE22 GLN A 131 13.333 0.096 5.928 1.00 0.00 H new ATOM 2120 N ALA A 132 8.915 4.797 7.501 1.00 0.00 N ATOM 2121 CA ALA A 132 8.616 5.826 6.515 1.00 0.00 C ATOM 2122 C ALA A 132 8.544 7.208 7.153 1.00 0.00 C ATOM 2123 O ALA A 132 8.961 8.212 6.553 1.00 0.00 O ATOM 2124 CB ALA A 132 7.323 5.498 5.805 1.00 0.00 C ATOM 0 H ALA A 132 8.206 4.065 7.557 1.00 0.00 H new ATOM 0 HA ALA A 132 9.427 5.846 5.787 1.00 0.00 H new ATOM 0 HB1 ALA A 132 7.106 6.272 5.069 1.00 0.00 H new ATOM 0 HB2 ALA A 132 7.418 4.536 5.302 1.00 0.00 H new ATOM 0 HB3 ALA A 132 6.511 5.450 6.531 1.00 0.00 H new ATOM 2130 N LYS A 133 8.039 7.246 8.370 1.00 0.00 N ATOM 2131 CA LYS A 133 7.935 8.451 9.131 1.00 0.00 C ATOM 2132 C LYS A 133 9.306 9.013 9.471 1.00 0.00 C ATOM 2133 O LYS A 133 9.574 10.195 9.234 1.00 0.00 O ATOM 2134 CB LYS A 133 7.134 8.208 10.405 1.00 0.00 C ATOM 2135 CG LYS A 133 5.644 8.002 10.191 1.00 0.00 C ATOM 2136 CD LYS A 133 4.933 7.700 11.496 1.00 0.00 C ATOM 2137 CE LYS A 133 3.444 7.906 11.344 1.00 0.00 C ATOM 2138 NZ LYS A 133 2.677 7.437 12.511 1.00 0.00 N ATOM 0 H LYS A 133 7.687 6.421 8.856 1.00 0.00 H new ATOM 0 HA LYS A 133 7.413 9.187 8.519 1.00 0.00 H new ATOM 0 HB2 LYS A 133 7.539 7.331 10.910 1.00 0.00 H new ATOM 0 HB3 LYS A 133 7.277 9.056 11.075 1.00 0.00 H new ATOM 0 HG2 LYS A 133 5.213 8.895 9.739 1.00 0.00 H new ATOM 0 HG3 LYS A 133 5.486 7.182 9.491 1.00 0.00 H new ATOM 0 HD2 LYS A 133 5.135 6.673 11.799 1.00 0.00 H new ATOM 0 HD3 LYS A 133 5.317 8.346 12.285 1.00 0.00 H new ATOM 0 HE2 LYS A 133 3.243 8.966 11.186 1.00 0.00 H new ATOM 0 HE3 LYS A 133 3.099 7.380 10.454 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 1.964 8.150 12.767 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 2.203 6.541 12.277 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 3.322 7.288 13.313 1.00 0.00 H new ATOM 2152 N LYS A 134 10.194 8.174 9.977 1.00 0.00 N ATOM 2153 CA LYS A 134 11.501 8.654 10.405 1.00 0.00 C ATOM 2154 C LYS A 134 12.437 8.908 9.222 1.00 0.00 C ATOM 2155 O LYS A 134 13.473 9.562 9.356 1.00 0.00 O ATOM 2156 CB LYS A 134 12.112 7.744 11.503 1.00 0.00 C ATOM 2157 CG LYS A 134 12.494 6.316 11.095 1.00 0.00 C ATOM 2158 CD LYS A 134 13.887 6.223 10.494 1.00 0.00 C ATOM 2159 CE LYS A 134 14.239 4.784 10.157 1.00 0.00 C ATOM 2160 NZ LYS A 134 15.649 4.635 9.752 1.00 0.00 N ATOM 0 H LYS A 134 10.040 7.173 10.101 1.00 0.00 H new ATOM 0 HA LYS A 134 11.360 9.629 10.872 1.00 0.00 H new ATOM 0 HB2 LYS A 134 13.004 8.235 11.891 1.00 0.00 H new ATOM 0 HB3 LYS A 134 11.399 7.682 12.325 1.00 0.00 H new ATOM 0 HG2 LYS A 134 12.437 5.667 11.969 1.00 0.00 H new ATOM 0 HG3 LYS A 134 11.767 5.943 10.373 1.00 0.00 H new ATOM 0 HD2 LYS A 134 13.940 6.835 9.593 1.00 0.00 H new ATOM 0 HD3 LYS A 134 14.618 6.625 11.196 1.00 0.00 H new ATOM 0 HE2 LYS A 134 14.043 4.152 11.023 1.00 0.00 H new ATOM 0 HE3 LYS A 134 13.593 4.433 9.353 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 15.843 3.637 9.532 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 15.832 5.217 8.910 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 16.268 4.945 10.528 1.00 0.00 H new ATOM 2174 N GLU A 135 12.075 8.395 8.064 1.00 0.00 N ATOM 2175 CA GLU A 135 12.850 8.649 6.871 1.00 0.00 C ATOM 2176 C GLU A 135 12.263 9.826 6.088 1.00 0.00 C ATOM 2177 O GLU A 135 12.822 10.240 5.086 1.00 0.00 O ATOM 2178 CB GLU A 135 12.963 7.405 5.981 1.00 0.00 C ATOM 2179 CG GLU A 135 13.553 6.197 6.686 1.00 0.00 C ATOM 2180 CD GLU A 135 13.942 5.089 5.741 1.00 0.00 C ATOM 2181 OE1 GLU A 135 13.077 4.525 5.037 1.00 0.00 O ATOM 2182 OE2 GLU A 135 15.140 4.742 5.694 1.00 0.00 O ATOM 0 H GLU A 135 11.255 7.804 7.925 1.00 0.00 H new ATOM 0 HA GLU A 135 13.860 8.909 7.189 1.00 0.00 H new ATOM 0 HB2 GLU A 135 11.972 7.147 5.606 1.00 0.00 H new ATOM 0 HB3 GLU A 135 13.579 7.645 5.114 1.00 0.00 H new ATOM 0 HG2 GLU A 135 14.431 6.508 7.252 1.00 0.00 H new ATOM 0 HG3 GLU A 135 12.829 5.815 7.405 1.00 0.00 H new ATOM 2189 N LYS A 136 11.147 10.374 6.592 1.00 0.00 N ATOM 2190 CA LYS A 136 10.436 11.517 5.975 1.00 0.00 C ATOM 2191 C LYS A 136 10.107 11.247 4.526 1.00 0.00 C ATOM 2192 O LYS A 136 10.458 12.019 3.623 1.00 0.00 O ATOM 2193 CB LYS A 136 11.154 12.885 6.131 1.00 0.00 C ATOM 2194 CG LYS A 136 11.371 13.343 7.578 1.00 0.00 C ATOM 2195 CD LYS A 136 12.521 12.626 8.282 1.00 0.00 C ATOM 2196 CE LYS A 136 13.885 12.946 7.659 1.00 0.00 C ATOM 2197 NZ LYS A 136 14.287 14.375 7.812 1.00 0.00 N ATOM 0 H LYS A 136 10.704 10.037 7.447 1.00 0.00 H new ATOM 0 HA LYS A 136 9.509 11.606 6.541 1.00 0.00 H new ATOM 0 HB2 LYS A 136 12.123 12.828 5.635 1.00 0.00 H new ATOM 0 HB3 LYS A 136 10.573 13.645 5.609 1.00 0.00 H new ATOM 0 HG2 LYS A 136 11.564 14.416 7.585 1.00 0.00 H new ATOM 0 HG3 LYS A 136 10.453 13.181 8.143 1.00 0.00 H new ATOM 0 HD2 LYS A 136 12.531 12.909 9.334 1.00 0.00 H new ATOM 0 HD3 LYS A 136 12.351 11.550 8.243 1.00 0.00 H new ATOM 0 HE2 LYS A 136 14.643 12.312 8.118 1.00 0.00 H new ATOM 0 HE3 LYS A 136 13.859 12.695 6.599 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 15.264 14.499 7.477 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 13.650 14.977 7.252 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 14.228 14.647 8.814 1.00 0.00 H new ATOM 2211 N LEU A 137 9.498 10.125 4.306 1.00 0.00 N ATOM 2212 CA LEU A 137 9.129 9.707 2.965 1.00 0.00 C ATOM 2213 C LEU A 137 7.931 10.492 2.457 1.00 0.00 C ATOM 2214 O LEU A 137 7.358 11.233 3.201 1.00 0.00 O ATOM 2215 CB LEU A 137 8.906 8.209 2.917 1.00 0.00 C ATOM 2216 CG LEU A 137 10.139 7.375 3.292 1.00 0.00 C ATOM 2217 CD1 LEU A 137 9.878 5.907 3.156 1.00 0.00 C ATOM 2218 CD2 LEU A 137 11.325 7.766 2.450 1.00 0.00 C ATOM 0 H LEU A 137 9.237 9.466 5.039 1.00 0.00 H new ATOM 0 HA LEU A 137 9.955 9.930 2.289 1.00 0.00 H new ATOM 0 HB2 LEU A 137 8.090 7.953 3.592 1.00 0.00 H new ATOM 0 HB3 LEU A 137 8.587 7.933 1.912 1.00 0.00 H new ATOM 0 HG LEU A 137 10.362 7.583 4.339 1.00 0.00 H new ATOM 0 HD11 LEU A 137 10.775 5.351 3.430 1.00 0.00 H new ATOM 0 HD12 LEU A 137 9.058 5.621 3.814 1.00 0.00 H new ATOM 0 HD13 LEU A 137 9.611 5.679 2.124 1.00 0.00 H new ATOM 0 HD21 LEU A 137 12.187 7.162 2.733 1.00 0.00 H new ATOM 0 HD22 LEU A 137 11.095 7.599 1.398 1.00 0.00 H new ATOM 0 HD23 LEU A 137 11.552 8.820 2.609 1.00 0.00 H new ATOM 2230 N ASN A 138 7.549 10.263 1.204 1.00 0.00 N ATOM 2231 CA ASN A 138 6.532 11.064 0.449 1.00 0.00 C ATOM 2232 C ASN A 138 5.405 11.686 1.297 1.00 0.00 C ATOM 2233 O ASN A 138 5.304 12.913 1.373 1.00 0.00 O ATOM 2234 CB ASN A 138 5.881 10.211 -0.660 1.00 0.00 C ATOM 2235 CG ASN A 138 6.847 9.722 -1.720 1.00 0.00 C ATOM 2236 OD1 ASN A 138 7.086 10.405 -2.719 1.00 0.00 O ATOM 2237 ND2 ASN A 138 7.370 8.523 -1.548 1.00 0.00 N ATOM 0 H ASN A 138 7.936 9.498 0.651 1.00 0.00 H new ATOM 0 HA ASN A 138 7.108 11.895 0.042 1.00 0.00 H new ATOM 0 HB2 ASN A 138 5.396 9.349 -0.202 1.00 0.00 H new ATOM 0 HB3 ASN A 138 5.099 10.798 -1.141 1.00 0.00 H new ATOM 0 HD21 ASN A 138 7.994 8.133 -2.254 1.00 0.00 H new ATOM 0 HD22 ASN A 138 7.150 7.986 -0.709 1.00 0.00 H new ATOM 2244 N ILE A 139 4.600 10.881 1.967 1.00 0.00 N ATOM 2245 CA ILE A 139 3.497 11.450 2.774 1.00 0.00 C ATOM 2246 C ILE A 139 3.906 11.871 4.191 1.00 0.00 C ATOM 2247 O ILE A 139 3.145 12.533 4.888 1.00 0.00 O ATOM 2248 CB ILE A 139 2.249 10.546 2.843 1.00 0.00 C ATOM 2249 CG1 ILE A 139 2.529 9.279 3.653 1.00 0.00 C ATOM 2250 CG2 ILE A 139 1.796 10.197 1.431 1.00 0.00 C ATOM 2251 CD1 ILE A 139 1.320 8.408 3.864 1.00 0.00 C ATOM 0 H ILE A 139 4.670 9.864 1.981 1.00 0.00 H new ATOM 0 HA ILE A 139 3.234 12.354 2.224 1.00 0.00 H new ATOM 0 HB ILE A 139 1.451 11.087 3.351 1.00 0.00 H new ATOM 0 HG12 ILE A 139 3.299 8.698 3.145 1.00 0.00 H new ATOM 0 HG13 ILE A 139 2.933 9.563 4.624 1.00 0.00 H new ATOM 0 HG21 ILE A 139 0.914 9.558 1.479 1.00 0.00 H new ATOM 0 HG22 ILE A 139 1.552 11.112 0.891 1.00 0.00 H new ATOM 0 HG23 ILE A 139 2.597 9.671 0.911 1.00 0.00 H new ATOM 0 HD11 ILE A 139 1.601 7.531 4.446 1.00 0.00 H new ATOM 0 HD12 ILE A 139 0.556 8.970 4.401 1.00 0.00 H new ATOM 0 HD13 ILE A 139 0.926 8.092 2.898 1.00 0.00 H new ATOM 2263 N TRP A 140 5.092 11.501 4.604 1.00 0.00 N ATOM 2264 CA TRP A 140 5.564 11.778 5.962 1.00 0.00 C ATOM 2265 C TRP A 140 6.688 12.782 5.922 1.00 0.00 C ATOM 2266 O TRP A 140 7.432 12.961 6.896 1.00 0.00 O ATOM 2267 CB TRP A 140 6.064 10.503 6.628 1.00 0.00 C ATOM 2268 CG TRP A 140 5.036 9.433 6.734 1.00 0.00 C ATOM 2269 CD1 TRP A 140 5.057 8.220 6.123 1.00 0.00 C ATOM 2270 CD2 TRP A 140 3.820 9.491 7.478 1.00 0.00 C ATOM 2271 NE1 TRP A 140 3.943 7.503 6.468 1.00 0.00 N ATOM 2272 CE2 TRP A 140 3.166 8.266 7.296 1.00 0.00 C ATOM 2273 CE3 TRP A 140 3.229 10.458 8.294 1.00 0.00 C ATOM 2274 CZ2 TRP A 140 1.951 7.984 7.890 1.00 0.00 C ATOM 2275 CZ3 TRP A 140 2.018 10.174 8.881 1.00 0.00 C ATOM 2276 CH2 TRP A 140 1.392 8.943 8.680 1.00 0.00 C ATOM 0 H TRP A 140 5.764 11.001 4.022 1.00 0.00 H new ATOM 0 HA TRP A 140 4.729 12.179 6.536 1.00 0.00 H new ATOM 0 HB2 TRP A 140 6.915 10.121 6.064 1.00 0.00 H new ATOM 0 HB3 TRP A 140 6.426 10.745 7.627 1.00 0.00 H new ATOM 0 HD1 TRP A 140 5.838 7.872 5.462 1.00 0.00 H new ATOM 0 HE1 TRP A 140 3.728 6.555 6.158 1.00 0.00 H new ATOM 0 HE3 TRP A 140 3.713 11.409 8.461 1.00 0.00 H new ATOM 0 HZ2 TRP A 140 1.460 7.035 7.733 1.00 0.00 H new ATOM 0 HZ3 TRP A 140 1.544 10.915 9.507 1.00 0.00 H new ATOM 0 HH2 TRP A 140 0.445 8.747 9.161 1.00 0.00 H new ATOM 2287 N SER A 141 6.813 13.411 4.795 1.00 0.00 N ATOM 2288 CA SER A 141 7.825 14.386 4.548 1.00 0.00 C ATOM 2289 C SER A 141 7.687 15.620 5.458 1.00 0.00 C ATOM 2290 O SER A 141 6.683 15.780 6.183 1.00 0.00 O ATOM 2291 CB SER A 141 7.831 14.730 3.061 1.00 0.00 C ATOM 2292 OG SER A 141 6.501 14.977 2.583 1.00 0.00 O ATOM 0 H SER A 141 6.195 13.254 3.999 1.00 0.00 H new ATOM 0 HA SER A 141 8.797 13.966 4.805 1.00 0.00 H new ATOM 0 HB2 SER A 141 8.451 15.610 2.891 1.00 0.00 H new ATOM 0 HB3 SER A 141 8.277 13.911 2.497 1.00 0.00 H new ATOM 0 HG SER A 141 6.259 14.295 1.922 1.00 0.00 H new ATOM 2298 N GLU A 142 8.670 16.482 5.414 1.00 0.00 N ATOM 2299 CA GLU A 142 8.730 17.613 6.295 1.00 0.00 C ATOM 2300 C GLU A 142 7.846 18.768 5.835 1.00 0.00 C ATOM 2301 O GLU A 142 7.648 19.742 6.573 1.00 0.00 O ATOM 2302 CB GLU A 142 10.171 18.020 6.490 1.00 0.00 C ATOM 2303 CG GLU A 142 10.983 16.915 7.142 1.00 0.00 C ATOM 2304 CD GLU A 142 12.415 17.275 7.388 1.00 0.00 C ATOM 2305 OE1 GLU A 142 12.677 18.145 8.249 1.00 0.00 O ATOM 2306 OE2 GLU A 142 13.310 16.650 6.775 1.00 0.00 O ATOM 0 H GLU A 142 9.453 16.416 4.763 1.00 0.00 H new ATOM 0 HA GLU A 142 8.321 17.320 7.262 1.00 0.00 H new ATOM 0 HB2 GLU A 142 10.611 18.275 5.526 1.00 0.00 H new ATOM 0 HB3 GLU A 142 10.215 18.917 7.107 1.00 0.00 H new ATOM 0 HG2 GLU A 142 10.518 16.648 8.091 1.00 0.00 H new ATOM 0 HG3 GLU A 142 10.946 16.029 6.509 1.00 0.00 H new ATOM 2313 N ASP A 143 7.333 18.653 4.633 1.00 0.00 N ATOM 2314 CA ASP A 143 6.361 19.592 4.090 1.00 0.00 C ATOM 2315 C ASP A 143 5.323 18.777 3.358 1.00 0.00 C ATOM 2316 O ASP A 143 5.583 18.273 2.263 1.00 0.00 O ATOM 2317 CB ASP A 143 7.010 20.602 3.114 1.00 0.00 C ATOM 2318 CG ASP A 143 6.022 21.649 2.574 1.00 0.00 C ATOM 2319 OD1 ASP A 143 5.151 21.321 1.767 1.00 0.00 O ATOM 2320 OD2 ASP A 143 6.122 22.829 2.939 1.00 0.00 O ATOM 0 H ASP A 143 7.577 17.898 3.992 1.00 0.00 H new ATOM 0 HA ASP A 143 5.925 20.173 4.902 1.00 0.00 H new ATOM 0 HB2 ASP A 143 7.828 21.113 3.622 1.00 0.00 H new ATOM 0 HB3 ASP A 143 7.446 20.058 2.276 1.00 0.00 H new ATOM 2325 N ASN A 144 4.197 18.542 3.983 1.00 0.00 N ATOM 2326 CA ASN A 144 3.147 17.766 3.331 1.00 0.00 C ATOM 2327 C ASN A 144 2.228 18.727 2.651 1.00 0.00 C ATOM 2328 O ASN A 144 1.904 18.584 1.469 1.00 0.00 O ATOM 2329 CB ASN A 144 2.350 16.891 4.324 1.00 0.00 C ATOM 2330 CG ASN A 144 3.198 15.921 5.139 1.00 0.00 C ATOM 2331 OD1 ASN A 144 4.295 15.460 4.593 1.00 0.00 O flip ATOM 2332 ND2 ASN A 144 2.853 15.585 6.275 1.00 0.00 N flip ATOM 0 H ASN A 144 3.976 18.865 4.925 1.00 0.00 H new ATOM 0 HA ASN A 144 3.609 17.082 2.619 1.00 0.00 H new ATOM 0 HB2 ASN A 144 1.809 17.543 5.009 1.00 0.00 H new ATOM 0 HB3 ASN A 144 1.604 16.322 3.769 1.00 0.00 H new ATOM 0 HD21 ASN A 144 1.994 15.958 6.678 1.00 0.00 H new ATOM 0 HD22 ASN A 144 3.427 14.934 6.811 1.00 0.00 H new ATOM 2339 N ALA A 145 1.826 19.709 3.405 1.00 0.00 N ATOM 2340 CA ALA A 145 1.009 20.786 2.926 1.00 0.00 C ATOM 2341 C ALA A 145 1.652 22.095 3.341 1.00 0.00 C ATOM 2342 O ALA A 145 1.608 23.088 2.607 1.00 0.00 O ATOM 2343 CB ALA A 145 -0.405 20.678 3.481 1.00 0.00 C ATOM 0 H ALA A 145 2.063 19.785 4.394 1.00 0.00 H new ATOM 0 HA ALA A 145 0.936 20.740 1.839 1.00 0.00 H new ATOM 0 HB1 ALA A 145 -1.008 21.505 3.105 1.00 0.00 H new ATOM 0 HB2 ALA A 145 -0.848 19.733 3.166 1.00 0.00 H new ATOM 0 HB3 ALA A 145 -0.373 20.718 4.570 1.00 0.00 H new ATOM 2349 N ASP A 146 2.288 22.079 4.493 1.00 0.00 N ATOM 2350 CA ASP A 146 2.969 23.233 5.037 1.00 0.00 C ATOM 2351 C ASP A 146 4.257 22.769 5.678 1.00 0.00 C ATOM 2352 O ASP A 146 4.437 21.570 5.909 1.00 0.00 O ATOM 2353 CB ASP A 146 2.093 23.989 6.068 1.00 0.00 C ATOM 2354 CG ASP A 146 1.770 23.193 7.320 1.00 0.00 C ATOM 2355 OD1 ASP A 146 2.568 23.221 8.288 1.00 0.00 O ATOM 2356 OD2 ASP A 146 0.692 22.555 7.378 1.00 0.00 O ATOM 0 H ASP A 146 2.347 21.251 5.086 1.00 0.00 H new ATOM 0 HA ASP A 146 3.178 23.933 4.228 1.00 0.00 H new ATOM 0 HB2 ASP A 146 2.605 24.907 6.358 1.00 0.00 H new ATOM 0 HB3 ASP A 146 1.160 24.282 5.588 1.00 0.00 H new ATOM 2361 N SER A 147 5.128 23.685 5.962 1.00 0.00 N ATOM 2362 CA SER A 147 6.421 23.376 6.520 1.00 0.00 C ATOM 2363 C SER A 147 6.557 23.980 7.914 1.00 0.00 C ATOM 2364 O SER A 147 7.673 24.183 8.417 1.00 0.00 O ATOM 2365 CB SER A 147 7.500 23.915 5.570 1.00 0.00 C ATOM 2366 OG SER A 147 7.208 25.262 5.180 1.00 0.00 O ATOM 0 H SER A 147 4.967 24.681 5.814 1.00 0.00 H new ATOM 0 HA SER A 147 6.539 22.297 6.623 1.00 0.00 H new ATOM 0 HB2 SER A 147 8.473 23.876 6.059 1.00 0.00 H new ATOM 0 HB3 SER A 147 7.562 23.281 4.686 1.00 0.00 H new ATOM 0 HG SER A 147 7.908 25.587 4.576 1.00 0.00 H new ATOM 2372 N GLY A 148 5.421 24.186 8.568 1.00 0.00 N ATOM 2373 CA GLY A 148 5.400 24.860 9.846 1.00 0.00 C ATOM 2374 C GLY A 148 5.764 23.980 11.025 1.00 0.00 C ATOM 2375 O GLY A 148 5.684 24.419 12.169 1.00 0.00 O ATOM 0 H GLY A 148 4.505 23.893 8.229 1.00 0.00 H new ATOM 0 HA2 GLY A 148 6.091 25.702 9.810 1.00 0.00 H new ATOM 0 HA3 GLY A 148 4.404 25.272 10.009 1.00 0.00 H new ATOM 2379 N GLN A 149 6.153 22.759 10.772 1.00 0.00 N ATOM 2380 CA GLN A 149 6.538 21.868 11.825 1.00 0.00 C ATOM 2381 C GLN A 149 7.804 21.142 11.432 1.00 0.00 C ATOM 2382 O GLN A 149 8.885 21.544 11.889 1.00 0.00 O ATOM 2383 CB GLN A 149 5.415 20.888 12.156 1.00 0.00 C ATOM 2384 CG GLN A 149 5.711 19.992 13.348 1.00 0.00 C ATOM 2385 CD GLN A 149 4.534 19.124 13.722 1.00 0.00 C ATOM 2386 OE1 GLN A 149 3.371 19.505 13.523 1.00 0.00 O ATOM 2387 NE2 GLN A 149 4.806 17.967 14.269 1.00 0.00 N ATOM 2388 OXT GLN A 149 7.740 20.194 10.612 1.00 0.00 O ATOM 0 H GLN A 149 6.211 22.359 9.835 1.00 0.00 H new ATOM 0 HA GLN A 149 6.731 22.448 12.728 1.00 0.00 H new ATOM 0 HB2 GLN A 149 4.502 21.450 12.354 1.00 0.00 H new ATOM 0 HB3 GLN A 149 5.222 20.264 11.284 1.00 0.00 H new ATOM 0 HG2 GLN A 149 6.568 19.358 13.119 1.00 0.00 H new ATOM 0 HG3 GLN A 149 5.990 20.609 14.202 1.00 0.00 H new ATOM 0 HE21 GLN A 149 5.776 17.688 14.417 1.00 0.00 H new ATOM 0 HE22 GLN A 149 4.048 17.344 14.548 1.00 0.00 H new TER 2397 GLN A 149