USER MOD reduce.3.24.130724 H: found=0, std=0, add=587, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 586 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 55 THR OG1 : rot 124:sc= 0.245 USER MOD Set 1.2: A 57 SER OG : rot -75:sc= 0.235 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 171:sc= 1.13 (180deg=0.808) USER MOD Single : A 2 GLN : amide:sc= 0.302 X(o=0.3,f=0) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0.18 USER MOD Single : A 9 THR OG1 : rot 180:sc= 0.0977 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 85:sc= 0.86 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 27 LYS NZ :NH3+ 165:sc= 2.26 (180deg=1.9) USER MOD Single : A 29 LYS NZ :NH3+ -173:sc= 1.24 (180deg=1.18) USER MOD Single : A 31 GLN : amide:sc= -0.573 X(o=-0.57,f=-0.83) USER MOD Single : A 33 LYS NZ :NH3+ 171:sc= 0.848 (180deg=0.833) USER MOD Single : A 40 GLN : amide:sc=-0.00936 K(o=-0.0094,f=-1.2) USER MOD Single : A 41 GLN : amide:sc= 0.519 K(o=0.52,f=-3.2!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= -0.0685 X(o=-0.069,f=-0.4) USER MOD Single : A 59 TYR OH : rot 180:sc= 0.25 USER MOD Single : A 60 ASN : amide:sc=-0.00983 X(o=-0.0098,f=0) USER MOD Single : A 62 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 109:sc= 0.775 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HD1:sc= 0 X(o=0,f=-0.16) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 12.560 32.693 18.595 1.00 0.00 N ATOM 2 CA MET A 1 13.320 31.578 17.995 1.00 0.00 C ATOM 3 C MET A 1 14.822 31.808 18.166 1.00 0.00 C ATOM 4 O MET A 1 15.666 31.479 17.337 1.00 0.00 O ATOM 5 CB MET A 1 12.765 31.304 16.600 1.00 0.00 C ATOM 6 CG MET A 1 12.759 29.840 16.139 1.00 0.00 C ATOM 7 SD MET A 1 11.764 28.608 17.007 1.00 0.00 S ATOM 8 CE MET A 1 10.201 28.762 16.115 1.00 0.00 C ATOM 0 H1 MET A 1 11.555 32.604 18.341 1.00 0.00 H new ATOM 0 H2 MET A 1 12.660 32.664 19.630 1.00 0.00 H new ATOM 0 H3 MET A 1 12.929 33.597 18.237 1.00 0.00 H new ATOM 0 HA MET A 1 13.184 30.629 18.513 1.00 0.00 H new ATOM 0 HB2 MET A 1 11.742 31.678 16.561 1.00 0.00 H new ATOM 0 HB3 MET A 1 13.344 31.885 15.882 1.00 0.00 H new ATOM 0 HG2 MET A 1 12.442 29.833 15.096 1.00 0.00 H new ATOM 0 HG3 MET A 1 13.792 29.492 16.160 1.00 0.00 H new ATOM 0 HE1 MET A 1 9.474 28.064 16.531 1.00 0.00 H new ATOM 0 HE2 MET A 1 9.824 29.780 16.214 1.00 0.00 H new ATOM 0 HE3 MET A 1 10.360 28.535 15.061 1.00 0.00 H new ATOM 20 N GLN A 2 15.232 32.432 19.267 1.00 0.00 N ATOM 21 CA GLN A 2 16.597 32.712 19.680 1.00 0.00 C ATOM 22 C GLN A 2 17.293 31.584 20.443 1.00 0.00 C ATOM 23 O GLN A 2 16.699 30.767 21.138 1.00 0.00 O ATOM 24 CB GLN A 2 16.289 33.893 20.610 1.00 0.00 C ATOM 25 CG GLN A 2 17.464 34.858 20.787 1.00 0.00 C ATOM 26 CD GLN A 2 17.210 35.974 21.793 1.00 0.00 C ATOM 27 OE1 GLN A 2 17.983 36.917 21.877 1.00 0.00 O ATOM 28 NE2 GLN A 2 16.083 36.098 22.487 1.00 0.00 N ATOM 0 H GLN A 2 14.558 32.783 19.948 1.00 0.00 H new ATOM 0 HA GLN A 2 17.288 32.874 18.852 1.00 0.00 H new ATOM 0 HB2 GLN A 2 15.435 34.443 20.214 1.00 0.00 H new ATOM 0 HB3 GLN A 2 15.996 33.508 21.587 1.00 0.00 H new ATOM 0 HG2 GLN A 2 18.340 34.292 21.103 1.00 0.00 H new ATOM 0 HG3 GLN A 2 17.703 35.303 19.821 1.00 0.00 H new ATOM 0 HE21 GLN A 2 15.387 35.352 22.467 1.00 0.00 H new ATOM 0 HE22 GLN A 2 15.914 36.939 23.039 1.00 0.00 H new ATOM 37 N ILE A 3 18.625 31.536 20.455 1.00 0.00 N ATOM 38 CA ILE A 3 19.522 30.821 21.340 1.00 0.00 C ATOM 39 C ILE A 3 20.606 31.814 21.768 1.00 0.00 C ATOM 40 O ILE A 3 21.230 32.493 20.961 1.00 0.00 O ATOM 41 CB ILE A 3 20.019 29.438 20.929 1.00 0.00 C ATOM 42 CG1 ILE A 3 20.636 29.178 19.557 1.00 0.00 C ATOM 43 CG2 ILE A 3 19.013 28.323 21.215 1.00 0.00 C ATOM 44 CD1 ILE A 3 21.412 27.863 19.432 1.00 0.00 C ATOM 0 H ILE A 3 19.155 32.062 19.760 1.00 0.00 H new ATOM 0 HA ILE A 3 18.933 30.486 22.194 1.00 0.00 H new ATOM 0 HB ILE A 3 20.885 29.428 21.590 1.00 0.00 H new ATOM 0 HG12 ILE A 3 19.841 29.185 18.811 1.00 0.00 H new ATOM 0 HG13 ILE A 3 21.307 30.002 19.316 1.00 0.00 H new ATOM 0 HG21 ILE A 3 19.430 27.367 20.899 1.00 0.00 H new ATOM 0 HG22 ILE A 3 18.800 28.290 22.284 1.00 0.00 H new ATOM 0 HG23 ILE A 3 18.091 28.516 20.667 1.00 0.00 H new ATOM 0 HD11 ILE A 3 21.811 27.771 18.422 1.00 0.00 H new ATOM 0 HD12 ILE A 3 22.233 27.856 20.149 1.00 0.00 H new ATOM 0 HD13 ILE A 3 20.745 27.026 19.636 1.00 0.00 H new ATOM 56 N PHE A 4 20.879 31.787 23.069 1.00 0.00 N ATOM 57 CA PHE A 4 22.037 32.402 23.677 1.00 0.00 C ATOM 58 C PHE A 4 23.166 31.362 23.806 1.00 0.00 C ATOM 59 O PHE A 4 22.933 30.201 24.129 1.00 0.00 O ATOM 60 CB PHE A 4 21.702 32.938 25.071 1.00 0.00 C ATOM 61 CG PHE A 4 20.446 33.784 25.152 1.00 0.00 C ATOM 62 CD1 PHE A 4 19.241 33.111 25.361 1.00 0.00 C ATOM 63 CD2 PHE A 4 20.481 35.172 24.984 1.00 0.00 C ATOM 64 CE1 PHE A 4 18.039 33.826 25.442 1.00 0.00 C ATOM 65 CE2 PHE A 4 19.300 35.904 25.168 1.00 0.00 C ATOM 66 CZ PHE A 4 18.086 35.229 25.376 1.00 0.00 C ATOM 0 H PHE A 4 20.275 31.319 23.745 1.00 0.00 H new ATOM 0 HA PHE A 4 22.354 33.230 23.044 1.00 0.00 H new ATOM 0 HB2 PHE A 4 21.597 32.093 25.752 1.00 0.00 H new ATOM 0 HB3 PHE A 4 22.544 33.531 25.427 1.00 0.00 H new ATOM 0 HD1 PHE A 4 19.235 32.036 25.461 1.00 0.00 H new ATOM 0 HD2 PHE A 4 21.401 35.671 24.717 1.00 0.00 H new ATOM 0 HE1 PHE A 4 17.097 33.310 25.553 1.00 0.00 H new ATOM 0 HE2 PHE A 4 19.323 36.984 25.150 1.00 0.00 H new ATOM 0 HZ PHE A 4 17.174 35.797 25.487 1.00 0.00 H new ATOM 76 N VAL A 5 24.387 31.840 23.630 1.00 0.00 N ATOM 77 CA VAL A 5 25.639 31.106 23.690 1.00 0.00 C ATOM 78 C VAL A 5 26.545 31.876 24.656 1.00 0.00 C ATOM 79 O VAL A 5 26.594 33.104 24.595 1.00 0.00 O ATOM 80 CB VAL A 5 26.174 30.891 22.269 1.00 0.00 C ATOM 81 CG1 VAL A 5 27.248 29.808 22.253 1.00 0.00 C ATOM 82 CG2 VAL A 5 25.171 30.669 21.128 1.00 0.00 C ATOM 0 H VAL A 5 24.539 32.828 23.426 1.00 0.00 H new ATOM 0 HA VAL A 5 25.548 30.094 24.084 1.00 0.00 H new ATOM 0 HB VAL A 5 26.584 31.873 22.031 1.00 0.00 H new ATOM 0 HG11 VAL A 5 27.613 29.673 21.235 1.00 0.00 H new ATOM 0 HG12 VAL A 5 28.075 30.106 22.898 1.00 0.00 H new ATOM 0 HG13 VAL A 5 26.825 28.871 22.615 1.00 0.00 H new ATOM 0 HG21 VAL A 5 25.710 30.534 20.191 1.00 0.00 H new ATOM 0 HG22 VAL A 5 24.575 29.780 21.335 1.00 0.00 H new ATOM 0 HG23 VAL A 5 24.515 31.535 21.047 1.00 0.00 H new ATOM 92 N LYS A 6 27.203 31.200 25.598 1.00 0.00 N ATOM 93 CA LYS A 6 28.041 31.728 26.652 1.00 0.00 C ATOM 94 C LYS A 6 29.294 30.849 26.598 1.00 0.00 C ATOM 95 O LYS A 6 29.274 29.641 26.380 1.00 0.00 O ATOM 96 CB LYS A 6 27.235 31.812 27.953 1.00 0.00 C ATOM 97 CG LYS A 6 27.936 31.962 29.301 1.00 0.00 C ATOM 98 CD LYS A 6 27.175 31.982 30.628 1.00 0.00 C ATOM 99 CE LYS A 6 26.921 33.411 31.099 1.00 0.00 C ATOM 100 NZ LYS A 6 26.061 33.355 32.296 1.00 0.00 N ATOM 0 H LYS A 6 27.153 30.182 25.638 1.00 0.00 H new ATOM 0 HA LYS A 6 28.376 32.760 26.553 1.00 0.00 H new ATOM 0 HB2 LYS A 6 26.552 32.655 27.852 1.00 0.00 H new ATOM 0 HB3 LYS A 6 26.623 30.911 28.009 1.00 0.00 H new ATOM 0 HG2 LYS A 6 28.658 31.148 29.369 1.00 0.00 H new ATOM 0 HG3 LYS A 6 28.505 32.890 29.254 1.00 0.00 H new ATOM 0 HD2 LYS A 6 26.225 31.460 30.513 1.00 0.00 H new ATOM 0 HD3 LYS A 6 27.745 31.443 31.385 1.00 0.00 H new ATOM 0 HE2 LYS A 6 27.863 33.908 31.331 1.00 0.00 H new ATOM 0 HE3 LYS A 6 26.440 33.991 30.312 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 25.875 34.320 32.635 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 25.161 32.893 32.056 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 26.540 32.812 33.043 1.00 0.00 H new ATOM 114 N THR A 7 30.439 31.455 26.893 1.00 0.00 N ATOM 115 CA THR A 7 31.643 30.762 27.307 1.00 0.00 C ATOM 116 C THR A 7 32.210 31.380 28.592 1.00 0.00 C ATOM 117 O THR A 7 31.854 30.862 29.651 1.00 0.00 O ATOM 118 CB THR A 7 32.590 30.675 26.109 1.00 0.00 C ATOM 119 OG1 THR A 7 32.919 31.975 25.651 1.00 0.00 O ATOM 120 CG2 THR A 7 32.087 29.760 24.991 1.00 0.00 C ATOM 0 H THR A 7 30.553 32.468 26.848 1.00 0.00 H new ATOM 0 HA THR A 7 31.445 29.730 27.597 1.00 0.00 H new ATOM 0 HB THR A 7 33.505 30.194 26.455 1.00 0.00 H new ATOM 0 HG1 THR A 7 33.527 31.908 24.885 1.00 0.00 H new ATOM 0 HG21 THR A 7 32.811 29.749 24.176 1.00 0.00 H new ATOM 0 HG22 THR A 7 31.960 28.749 25.378 1.00 0.00 H new ATOM 0 HG23 THR A 7 31.130 30.129 24.621 1.00 0.00 H new ATOM 128 N LEU A 8 33.104 32.367 28.513 1.00 0.00 N ATOM 129 CA LEU A 8 33.593 33.221 29.576 1.00 0.00 C ATOM 130 C LEU A 8 33.831 34.670 29.158 1.00 0.00 C ATOM 131 O LEU A 8 33.390 35.555 29.887 1.00 0.00 O ATOM 132 CB LEU A 8 34.822 32.483 30.116 1.00 0.00 C ATOM 133 CG LEU A 8 36.050 32.453 29.213 1.00 0.00 C ATOM 134 CD1 LEU A 8 37.114 33.424 29.729 1.00 0.00 C ATOM 135 CD2 LEU A 8 36.570 31.050 28.862 1.00 0.00 C ATOM 0 H LEU A 8 33.537 32.603 27.620 1.00 0.00 H new ATOM 0 HA LEU A 8 32.850 33.367 30.360 1.00 0.00 H new ATOM 0 HB2 LEU A 8 35.106 32.942 31.063 1.00 0.00 H new ATOM 0 HB3 LEU A 8 34.534 31.455 30.334 1.00 0.00 H new ATOM 0 HG LEU A 8 35.732 32.814 28.235 1.00 0.00 H new ATOM 0 HD11 LEU A 8 37.985 33.391 29.074 1.00 0.00 H new ATOM 0 HD12 LEU A 8 36.708 34.435 29.742 1.00 0.00 H new ATOM 0 HD13 LEU A 8 37.409 33.138 30.739 1.00 0.00 H new ATOM 0 HD21 LEU A 8 37.444 31.137 28.217 1.00 0.00 H new ATOM 0 HD22 LEU A 8 36.845 30.525 29.777 1.00 0.00 H new ATOM 0 HD23 LEU A 8 35.790 30.492 28.343 1.00 0.00 H new ATOM 147 N THR A 9 34.411 34.932 27.992 1.00 0.00 N ATOM 148 CA THR A 9 34.595 36.256 27.431 1.00 0.00 C ATOM 149 C THR A 9 33.317 36.645 26.698 1.00 0.00 C ATOM 150 O THR A 9 32.936 36.008 25.717 1.00 0.00 O ATOM 151 CB THR A 9 35.807 36.214 26.486 1.00 0.00 C ATOM 152 OG1 THR A 9 36.403 34.938 26.469 1.00 0.00 O ATOM 153 CG2 THR A 9 36.911 37.157 26.961 1.00 0.00 C ATOM 0 H THR A 9 34.779 34.195 27.391 1.00 0.00 H new ATOM 0 HA THR A 9 34.788 37.002 28.202 1.00 0.00 H new ATOM 0 HB THR A 9 35.423 36.495 25.505 1.00 0.00 H new ATOM 0 HG1 THR A 9 37.169 34.943 25.858 1.00 0.00 H new ATOM 0 HG21 THR A 9 37.755 37.105 26.273 1.00 0.00 H new ATOM 0 HG22 THR A 9 36.530 38.178 26.992 1.00 0.00 H new ATOM 0 HG23 THR A 9 37.238 36.862 27.958 1.00 0.00 H new ATOM 161 N GLY A 10 32.606 37.667 27.190 1.00 0.00 N ATOM 162 CA GLY A 10 31.275 38.009 26.743 1.00 0.00 C ATOM 163 C GLY A 10 30.312 37.592 27.865 1.00 0.00 C ATOM 164 O GLY A 10 30.435 36.494 28.394 1.00 0.00 O ATOM 0 H GLY A 10 32.958 38.283 27.923 1.00 0.00 H new ATOM 0 HA2 GLY A 10 31.197 39.078 26.543 1.00 0.00 H new ATOM 0 HA3 GLY A 10 31.034 37.492 25.814 1.00 0.00 H new ATOM 168 N LYS A 11 29.260 38.371 28.126 1.00 0.00 N ATOM 169 CA LYS A 11 28.018 37.975 28.760 1.00 0.00 C ATOM 170 C LYS A 11 27.398 36.793 28.017 1.00 0.00 C ATOM 171 O LYS A 11 27.244 35.750 28.653 1.00 0.00 O ATOM 172 CB LYS A 11 26.971 39.084 28.921 1.00 0.00 C ATOM 173 CG LYS A 11 25.641 38.856 29.638 1.00 0.00 C ATOM 174 CD LYS A 11 24.510 39.769 29.156 1.00 0.00 C ATOM 175 CE LYS A 11 23.395 39.816 30.204 1.00 0.00 C ATOM 176 NZ LYS A 11 22.010 40.149 29.824 1.00 0.00 N ATOM 0 H LYS A 11 29.262 39.361 27.880 1.00 0.00 H new ATOM 0 HA LYS A 11 28.305 37.699 29.775 1.00 0.00 H new ATOM 0 HB2 LYS A 11 27.466 39.908 29.435 1.00 0.00 H new ATOM 0 HB3 LYS A 11 26.729 39.433 27.917 1.00 0.00 H new ATOM 0 HG2 LYS A 11 25.339 37.818 29.501 1.00 0.00 H new ATOM 0 HG3 LYS A 11 25.786 39.008 30.708 1.00 0.00 H new ATOM 0 HD2 LYS A 11 24.894 40.773 28.975 1.00 0.00 H new ATOM 0 HD3 LYS A 11 24.115 39.403 28.208 1.00 0.00 H new ATOM 0 HE2 LYS A 11 23.368 38.838 30.685 1.00 0.00 H new ATOM 0 HE3 LYS A 11 23.700 40.537 30.963 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 21.404 40.130 30.669 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 21.985 41.099 29.402 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 21.663 39.454 29.133 1.00 0.00 H new ATOM 190 N THR A 12 26.939 36.974 26.785 1.00 0.00 N ATOM 191 CA THR A 12 26.348 35.997 25.909 1.00 0.00 C ATOM 192 C THR A 12 26.560 36.509 24.474 1.00 0.00 C ATOM 193 O THR A 12 26.928 37.667 24.355 1.00 0.00 O ATOM 194 CB THR A 12 24.893 35.793 26.324 1.00 0.00 C ATOM 195 OG1 THR A 12 24.292 37.051 26.539 1.00 0.00 O ATOM 196 CG2 THR A 12 24.475 34.878 27.487 1.00 0.00 C ATOM 0 H THR A 12 26.979 37.893 26.344 1.00 0.00 H new ATOM 0 HA THR A 12 26.803 35.008 25.968 1.00 0.00 H new ATOM 0 HB THR A 12 24.550 35.214 25.467 1.00 0.00 H new ATOM 0 HG1 THR A 12 23.357 36.926 26.804 1.00 0.00 H new ATOM 0 HG21 THR A 12 23.390 34.894 27.591 1.00 0.00 H new ATOM 0 HG22 THR A 12 24.805 33.859 27.285 1.00 0.00 H new ATOM 0 HG23 THR A 12 24.933 35.231 28.411 1.00 0.00 H new ATOM 204 N ILE A 13 26.203 35.737 23.452 1.00 0.00 N ATOM 205 CA ILE A 13 26.027 36.136 22.076 1.00 0.00 C ATOM 206 C ILE A 13 24.667 35.588 21.670 1.00 0.00 C ATOM 207 O ILE A 13 24.238 34.522 22.126 1.00 0.00 O ATOM 208 CB ILE A 13 27.214 35.634 21.241 1.00 0.00 C ATOM 209 CG1 ILE A 13 27.038 34.191 20.757 1.00 0.00 C ATOM 210 CG2 ILE A 13 28.576 36.069 21.768 1.00 0.00 C ATOM 211 CD1 ILE A 13 27.463 33.888 19.315 1.00 0.00 C ATOM 0 H ILE A 13 26.017 34.743 23.584 1.00 0.00 H new ATOM 0 HA ILE A 13 26.026 37.214 21.916 1.00 0.00 H new ATOM 0 HB ILE A 13 27.204 36.177 20.296 1.00 0.00 H new ATOM 0 HG12 ILE A 13 27.604 33.538 21.422 1.00 0.00 H new ATOM 0 HG13 ILE A 13 25.987 33.922 20.865 1.00 0.00 H new ATOM 0 HG21 ILE A 13 29.360 35.673 21.122 1.00 0.00 H new ATOM 0 HG22 ILE A 13 28.631 37.158 21.780 1.00 0.00 H new ATOM 0 HG23 ILE A 13 28.713 35.688 22.780 1.00 0.00 H new ATOM 0 HD11 ILE A 13 27.288 32.834 19.098 1.00 0.00 H new ATOM 0 HD12 ILE A 13 26.881 34.502 18.628 1.00 0.00 H new ATOM 0 HD13 ILE A 13 28.523 34.112 19.193 1.00 0.00 H new ATOM 223 N THR A 14 23.962 36.347 20.834 1.00 0.00 N ATOM 224 CA THR A 14 22.608 36.073 20.391 1.00 0.00 C ATOM 225 C THR A 14 22.561 35.547 18.958 1.00 0.00 C ATOM 226 O THR A 14 23.282 36.018 18.075 1.00 0.00 O ATOM 227 CB THR A 14 21.779 37.357 20.483 1.00 0.00 C ATOM 228 OG1 THR A 14 22.114 38.422 19.622 1.00 0.00 O ATOM 229 CG2 THR A 14 21.509 37.654 21.958 1.00 0.00 C ATOM 0 H THR A 14 24.340 37.205 20.433 1.00 0.00 H new ATOM 0 HA THR A 14 22.199 35.299 21.040 1.00 0.00 H new ATOM 0 HB THR A 14 20.813 37.179 20.011 1.00 0.00 H new ATOM 0 HG1 THR A 14 21.508 39.175 19.783 1.00 0.00 H new ATOM 0 HG21 THR A 14 20.919 38.566 22.043 1.00 0.00 H new ATOM 0 HG22 THR A 14 20.960 36.824 22.402 1.00 0.00 H new ATOM 0 HG23 THR A 14 22.456 37.784 22.482 1.00 0.00 H new ATOM 237 N LEU A 15 21.891 34.440 18.671 1.00 0.00 N ATOM 238 CA LEU A 15 21.690 33.844 17.367 1.00 0.00 C ATOM 239 C LEU A 15 20.177 33.709 17.134 1.00 0.00 C ATOM 240 O LEU A 15 19.544 33.136 18.010 1.00 0.00 O ATOM 241 CB LEU A 15 22.271 32.434 17.289 1.00 0.00 C ATOM 242 CG LEU A 15 23.696 32.165 17.765 1.00 0.00 C ATOM 243 CD1 LEU A 15 24.099 30.749 17.350 1.00 0.00 C ATOM 244 CD2 LEU A 15 24.758 33.109 17.215 1.00 0.00 C ATOM 0 H LEU A 15 21.440 33.896 19.406 1.00 0.00 H new ATOM 0 HA LEU A 15 22.182 34.478 16.629 1.00 0.00 H new ATOM 0 HB2 LEU A 15 21.611 31.780 17.859 1.00 0.00 H new ATOM 0 HB3 LEU A 15 22.213 32.117 16.248 1.00 0.00 H new ATOM 0 HG LEU A 15 23.665 32.314 18.844 1.00 0.00 H new ATOM 0 HD11 LEU A 15 25.116 30.547 17.686 1.00 0.00 H new ATOM 0 HD12 LEU A 15 23.418 30.029 17.803 1.00 0.00 H new ATOM 0 HD13 LEU A 15 24.051 30.660 16.265 1.00 0.00 H new ATOM 0 HD21 LEU A 15 25.733 32.832 17.615 1.00 0.00 H new ATOM 0 HD22 LEU A 15 24.778 33.040 16.127 1.00 0.00 H new ATOM 0 HD23 LEU A 15 24.523 34.132 17.509 1.00 0.00 H new ATOM 256 N GLU A 16 19.797 33.871 15.872 1.00 0.00 N ATOM 257 CA GLU A 16 18.488 33.412 15.425 1.00 0.00 C ATOM 258 C GLU A 16 18.606 32.024 14.793 1.00 0.00 C ATOM 259 O GLU A 16 19.492 31.777 13.972 1.00 0.00 O ATOM 260 CB GLU A 16 17.872 34.354 14.397 1.00 0.00 C ATOM 261 CG GLU A 16 16.346 34.376 14.488 1.00 0.00 C ATOM 262 CD GLU A 16 15.682 34.414 13.108 1.00 0.00 C ATOM 263 OE1 GLU A 16 16.215 34.881 12.079 1.00 0.00 O ATOM 264 OE2 GLU A 16 14.530 33.952 13.056 1.00 0.00 O ATOM 0 H GLU A 16 20.367 34.310 15.149 1.00 0.00 H new ATOM 0 HA GLU A 16 17.845 33.383 16.304 1.00 0.00 H new ATOM 0 HB2 GLU A 16 18.260 35.361 14.549 1.00 0.00 H new ATOM 0 HB3 GLU A 16 18.172 34.045 13.396 1.00 0.00 H new ATOM 0 HG2 GLU A 16 16.004 33.494 15.029 1.00 0.00 H new ATOM 0 HG3 GLU A 16 16.031 35.246 15.064 1.00 0.00 H new ATOM 271 N VAL A 17 17.896 31.036 15.329 1.00 0.00 N ATOM 272 CA VAL A 17 17.970 29.680 14.809 1.00 0.00 C ATOM 273 C VAL A 17 16.610 29.134 14.373 1.00 0.00 C ATOM 274 O VAL A 17 15.706 29.946 14.189 1.00 0.00 O ATOM 275 CB VAL A 17 18.611 28.764 15.840 1.00 0.00 C ATOM 276 CG1 VAL A 17 20.061 29.195 16.058 1.00 0.00 C ATOM 277 CG2 VAL A 17 17.811 28.611 17.141 1.00 0.00 C ATOM 0 H VAL A 17 17.265 31.151 16.122 1.00 0.00 H new ATOM 0 HA VAL A 17 18.590 29.712 13.913 1.00 0.00 H new ATOM 0 HB VAL A 17 18.603 27.751 15.437 1.00 0.00 H new ATOM 0 HG11 VAL A 17 20.527 28.543 16.796 1.00 0.00 H new ATOM 0 HG12 VAL A 17 20.606 29.126 15.117 1.00 0.00 H new ATOM 0 HG13 VAL A 17 20.085 30.224 16.417 1.00 0.00 H new ATOM 0 HG21 VAL A 17 18.342 27.941 17.818 1.00 0.00 H new ATOM 0 HG22 VAL A 17 17.694 29.586 17.613 1.00 0.00 H new ATOM 0 HG23 VAL A 17 16.828 28.197 16.917 1.00 0.00 H new ATOM 287 N GLU A 18 16.460 27.815 14.232 1.00 0.00 N ATOM 288 CA GLU A 18 15.209 27.093 14.144 1.00 0.00 C ATOM 289 C GLU A 18 15.464 25.790 14.920 1.00 0.00 C ATOM 290 O GLU A 18 16.594 25.311 14.908 1.00 0.00 O ATOM 291 CB GLU A 18 14.917 27.069 12.648 1.00 0.00 C ATOM 292 CG GLU A 18 13.400 26.978 12.498 1.00 0.00 C ATOM 293 CD GLU A 18 12.860 25.556 12.408 1.00 0.00 C ATOM 294 OE1 GLU A 18 13.630 24.568 12.442 1.00 0.00 O ATOM 295 OE2 GLU A 18 11.630 25.336 12.315 1.00 0.00 O ATOM 0 H GLU A 18 17.266 27.192 14.174 1.00 0.00 H new ATOM 0 HA GLU A 18 14.299 27.488 14.595 1.00 0.00 H new ATOM 0 HB2 GLU A 18 15.300 27.968 12.164 1.00 0.00 H new ATOM 0 HB3 GLU A 18 15.405 26.218 12.172 1.00 0.00 H new ATOM 0 HG2 GLU A 18 12.933 27.478 13.346 1.00 0.00 H new ATOM 0 HG3 GLU A 18 13.102 27.524 11.603 1.00 0.00 H new ATOM 302 N PRO A 19 14.499 25.182 15.593 1.00 0.00 N ATOM 303 CA PRO A 19 14.763 23.966 16.346 1.00 0.00 C ATOM 304 C PRO A 19 15.158 22.748 15.506 1.00 0.00 C ATOM 305 O PRO A 19 15.733 21.849 16.125 1.00 0.00 O ATOM 306 CB PRO A 19 13.532 23.650 17.179 1.00 0.00 C ATOM 307 CG PRO A 19 12.405 24.582 16.728 1.00 0.00 C ATOM 308 CD PRO A 19 13.206 25.689 16.035 1.00 0.00 C ATOM 0 HA PRO A 19 15.638 24.166 16.964 1.00 0.00 H new ATOM 0 HB2 PRO A 19 13.240 22.608 17.048 1.00 0.00 H new ATOM 0 HB3 PRO A 19 13.742 23.791 18.239 1.00 0.00 H new ATOM 0 HG2 PRO A 19 11.708 24.090 16.049 1.00 0.00 H new ATOM 0 HG3 PRO A 19 11.820 24.959 17.567 1.00 0.00 H new ATOM 0 HD2 PRO A 19 12.647 26.070 15.181 1.00 0.00 H new ATOM 0 HD3 PRO A 19 13.351 26.525 16.720 1.00 0.00 H new ATOM 316 N SER A 20 14.846 22.681 14.216 1.00 0.00 N ATOM 317 CA SER A 20 15.282 21.645 13.303 1.00 0.00 C ATOM 318 C SER A 20 16.642 21.907 12.650 1.00 0.00 C ATOM 319 O SER A 20 17.036 21.258 11.679 1.00 0.00 O ATOM 320 CB SER A 20 14.210 21.567 12.212 1.00 0.00 C ATOM 321 OG SER A 20 12.908 21.909 12.629 1.00 0.00 O ATOM 0 H SER A 20 14.257 23.380 13.764 1.00 0.00 H new ATOM 0 HA SER A 20 15.407 20.720 13.866 1.00 0.00 H new ATOM 0 HB2 SER A 20 14.498 22.227 11.393 1.00 0.00 H new ATOM 0 HB3 SER A 20 14.193 20.553 11.813 1.00 0.00 H new ATOM 0 HG SER A 20 12.794 22.881 12.581 1.00 0.00 H new ATOM 327 N ASP A 21 17.402 22.852 13.186 1.00 0.00 N ATOM 328 CA ASP A 21 18.795 23.110 12.925 1.00 0.00 C ATOM 329 C ASP A 21 19.597 22.023 13.644 1.00 0.00 C ATOM 330 O ASP A 21 19.426 21.891 14.853 1.00 0.00 O ATOM 331 CB ASP A 21 19.189 24.506 13.391 1.00 0.00 C ATOM 332 CG ASP A 21 18.766 25.578 12.389 1.00 0.00 C ATOM 333 OD1 ASP A 21 18.362 25.268 11.256 1.00 0.00 O ATOM 334 OD2 ASP A 21 18.801 26.778 12.747 1.00 0.00 O ATOM 0 H ASP A 21 17.020 23.506 13.869 1.00 0.00 H new ATOM 0 HA ASP A 21 19.001 23.080 11.855 1.00 0.00 H new ATOM 0 HB2 ASP A 21 18.729 24.710 14.358 1.00 0.00 H new ATOM 0 HB3 ASP A 21 20.268 24.550 13.536 1.00 0.00 H new ATOM 339 N THR A 22 20.371 21.313 12.819 1.00 0.00 N ATOM 340 CA THR A 22 21.484 20.547 13.343 1.00 0.00 C ATOM 341 C THR A 22 22.537 21.512 13.899 1.00 0.00 C ATOM 342 O THR A 22 22.683 22.667 13.513 1.00 0.00 O ATOM 343 CB THR A 22 21.992 19.584 12.268 1.00 0.00 C ATOM 344 OG1 THR A 22 22.583 20.247 11.167 1.00 0.00 O ATOM 345 CG2 THR A 22 20.965 18.593 11.730 1.00 0.00 C ATOM 0 H THR A 22 20.245 21.258 11.808 1.00 0.00 H new ATOM 0 HA THR A 22 21.185 19.916 14.180 1.00 0.00 H new ATOM 0 HB THR A 22 22.742 19.012 12.815 1.00 0.00 H new ATOM 0 HG1 THR A 22 22.891 19.585 10.513 1.00 0.00 H new ATOM 0 HG21 THR A 22 21.431 17.960 10.975 1.00 0.00 H new ATOM 0 HG22 THR A 22 20.596 17.972 12.546 1.00 0.00 H new ATOM 0 HG23 THR A 22 20.133 19.138 11.284 1.00 0.00 H new ATOM 353 N ILE A 23 23.317 20.970 14.837 1.00 0.00 N ATOM 354 CA ILE A 23 24.390 21.717 15.464 1.00 0.00 C ATOM 355 C ILE A 23 25.519 22.019 14.487 1.00 0.00 C ATOM 356 O ILE A 23 26.241 23.003 14.553 1.00 0.00 O ATOM 357 CB ILE A 23 24.928 20.898 16.641 1.00 0.00 C ATOM 358 CG1 ILE A 23 23.829 20.751 17.703 1.00 0.00 C ATOM 359 CG2 ILE A 23 26.232 21.383 17.262 1.00 0.00 C ATOM 360 CD1 ILE A 23 24.045 19.675 18.759 1.00 0.00 C ATOM 0 H ILE A 23 23.218 20.013 15.174 1.00 0.00 H new ATOM 0 HA ILE A 23 23.994 22.673 15.807 1.00 0.00 H new ATOM 0 HB ILE A 23 25.198 19.930 16.218 1.00 0.00 H new ATOM 0 HG12 ILE A 23 23.714 21.709 18.210 1.00 0.00 H new ATOM 0 HG13 ILE A 23 22.888 20.545 17.194 1.00 0.00 H new ATOM 0 HG21 ILE A 23 26.511 20.724 18.084 1.00 0.00 H new ATOM 0 HG22 ILE A 23 27.019 21.375 16.508 1.00 0.00 H new ATOM 0 HG23 ILE A 23 26.100 22.397 17.639 1.00 0.00 H new ATOM 0 HD11 ILE A 23 23.202 19.670 19.451 1.00 0.00 H new ATOM 0 HD12 ILE A 23 24.124 18.701 18.275 1.00 0.00 H new ATOM 0 HD13 ILE A 23 24.963 19.883 19.308 1.00 0.00 H new ATOM 372 N GLU A 24 25.617 21.110 13.515 1.00 0.00 N ATOM 373 CA GLU A 24 26.451 21.219 12.342 1.00 0.00 C ATOM 374 C GLU A 24 26.311 22.583 11.676 1.00 0.00 C ATOM 375 O GLU A 24 27.334 23.177 11.365 1.00 0.00 O ATOM 376 CB GLU A 24 26.236 19.974 11.473 1.00 0.00 C ATOM 377 CG GLU A 24 27.288 19.685 10.402 1.00 0.00 C ATOM 378 CD GLU A 24 28.687 19.627 10.997 1.00 0.00 C ATOM 379 OE1 GLU A 24 28.889 18.943 12.016 1.00 0.00 O ATOM 380 OE2 GLU A 24 29.545 20.316 10.408 1.00 0.00 O ATOM 0 H GLU A 24 25.086 20.239 13.537 1.00 0.00 H new ATOM 0 HA GLU A 24 27.512 21.209 12.592 1.00 0.00 H new ATOM 0 HB2 GLU A 24 26.176 19.107 12.132 1.00 0.00 H new ATOM 0 HB3 GLU A 24 25.268 20.068 10.981 1.00 0.00 H new ATOM 0 HG2 GLU A 24 27.060 18.738 9.912 1.00 0.00 H new ATOM 0 HG3 GLU A 24 27.249 20.458 9.635 1.00 0.00 H new ATOM 387 N ASN A 25 25.104 23.147 11.563 1.00 0.00 N ATOM 388 CA ASN A 25 24.839 24.452 10.978 1.00 0.00 C ATOM 389 C ASN A 25 25.243 25.595 11.903 1.00 0.00 C ATOM 390 O ASN A 25 25.686 26.644 11.446 1.00 0.00 O ATOM 391 CB ASN A 25 23.324 24.532 10.763 1.00 0.00 C ATOM 392 CG ASN A 25 22.820 25.787 10.057 1.00 0.00 C ATOM 393 OD1 ASN A 25 22.339 26.674 10.755 1.00 0.00 O ATOM 394 ND2 ASN A 25 22.881 25.766 8.721 1.00 0.00 N ATOM 0 H ASN A 25 24.257 22.684 11.891 1.00 0.00 H new ATOM 0 HA ASN A 25 25.413 24.553 10.057 1.00 0.00 H new ATOM 0 HB2 ASN A 25 23.011 23.662 10.185 1.00 0.00 H new ATOM 0 HB3 ASN A 25 22.834 24.462 11.734 1.00 0.00 H new ATOM 0 HD21 ASN A 25 22.502 26.544 8.181 1.00 0.00 H new ATOM 0 HD22 ASN A 25 23.306 24.972 8.242 1.00 0.00 H new ATOM 401 N VAL A 26 24.975 25.341 13.179 1.00 0.00 N ATOM 402 CA VAL A 26 25.282 26.261 14.263 1.00 0.00 C ATOM 403 C VAL A 26 26.783 26.447 14.471 1.00 0.00 C ATOM 404 O VAL A 26 27.156 27.597 14.713 1.00 0.00 O ATOM 405 CB VAL A 26 24.527 25.814 15.509 1.00 0.00 C ATOM 406 CG1 VAL A 26 24.928 26.425 16.859 1.00 0.00 C ATOM 407 CG2 VAL A 26 23.008 25.925 15.407 1.00 0.00 C ATOM 0 H VAL A 26 24.532 24.477 13.492 1.00 0.00 H new ATOM 0 HA VAL A 26 24.938 27.262 14.003 1.00 0.00 H new ATOM 0 HB VAL A 26 24.852 24.774 15.516 1.00 0.00 H new ATOM 0 HG11 VAL A 26 24.301 26.008 17.647 1.00 0.00 H new ATOM 0 HG12 VAL A 26 25.973 26.195 17.066 1.00 0.00 H new ATOM 0 HG13 VAL A 26 24.795 27.506 16.823 1.00 0.00 H new ATOM 0 HG21 VAL A 26 22.555 25.586 16.338 1.00 0.00 H new ATOM 0 HG22 VAL A 26 22.730 26.963 15.226 1.00 0.00 H new ATOM 0 HG23 VAL A 26 22.652 25.305 14.584 1.00 0.00 H new ATOM 417 N LYS A 27 27.604 25.434 14.203 1.00 0.00 N ATOM 418 CA LYS A 27 29.037 25.637 14.249 1.00 0.00 C ATOM 419 C LYS A 27 29.546 26.825 13.424 1.00 0.00 C ATOM 420 O LYS A 27 30.433 27.575 13.826 1.00 0.00 O ATOM 421 CB LYS A 27 29.758 24.351 13.844 1.00 0.00 C ATOM 422 CG LYS A 27 29.659 23.115 14.746 1.00 0.00 C ATOM 423 CD LYS A 27 30.160 21.921 13.941 1.00 0.00 C ATOM 424 CE LYS A 27 29.850 20.677 14.787 1.00 0.00 C ATOM 425 NZ LYS A 27 30.241 19.446 14.086 1.00 0.00 N ATOM 0 H LYS A 27 27.305 24.490 13.958 1.00 0.00 H new ATOM 0 HA LYS A 27 29.268 25.893 15.283 1.00 0.00 H new ATOM 0 HB2 LYS A 27 29.390 24.067 12.858 1.00 0.00 H new ATOM 0 HB3 LYS A 27 30.816 24.590 13.733 1.00 0.00 H new ATOM 0 HG2 LYS A 27 30.258 23.249 15.647 1.00 0.00 H new ATOM 0 HG3 LYS A 27 28.630 22.956 15.068 1.00 0.00 H new ATOM 0 HD2 LYS A 27 29.663 21.868 12.973 1.00 0.00 H new ATOM 0 HD3 LYS A 27 31.229 22.003 13.746 1.00 0.00 H new ATOM 0 HE2 LYS A 27 30.378 20.740 15.738 1.00 0.00 H new ATOM 0 HE3 LYS A 27 28.785 20.646 15.015 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 30.261 18.654 14.760 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 29.553 19.242 13.333 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 31.185 19.569 13.668 1.00 0.00 H new ATOM 439 N ALA A 28 28.939 27.047 12.263 1.00 0.00 N ATOM 440 CA ALA A 28 29.385 28.092 11.353 1.00 0.00 C ATOM 441 C ALA A 28 28.889 29.461 11.802 1.00 0.00 C ATOM 442 O ALA A 28 29.449 30.530 11.590 1.00 0.00 O ATOM 443 CB ALA A 28 28.662 27.683 10.072 1.00 0.00 C ATOM 0 H ALA A 28 28.135 26.515 11.931 1.00 0.00 H new ATOM 0 HA ALA A 28 30.469 28.178 11.274 1.00 0.00 H new ATOM 0 HB1 ALA A 28 28.903 28.389 9.277 1.00 0.00 H new ATOM 0 HB2 ALA A 28 28.980 26.683 9.778 1.00 0.00 H new ATOM 0 HB3 ALA A 28 27.586 27.685 10.245 1.00 0.00 H new ATOM 449 N LYS A 29 27.715 29.538 12.430 1.00 0.00 N ATOM 450 CA LYS A 29 27.305 30.708 13.185 1.00 0.00 C ATOM 451 C LYS A 29 28.314 31.080 14.279 1.00 0.00 C ATOM 452 O LYS A 29 28.668 32.243 14.432 1.00 0.00 O ATOM 453 CB LYS A 29 25.903 30.544 13.775 1.00 0.00 C ATOM 454 CG LYS A 29 24.785 30.345 12.753 1.00 0.00 C ATOM 455 CD LYS A 29 23.293 30.426 13.112 1.00 0.00 C ATOM 456 CE LYS A 29 22.375 30.665 11.913 1.00 0.00 C ATOM 457 NZ LYS A 29 20.996 30.262 12.211 1.00 0.00 N ATOM 0 H LYS A 29 27.025 28.786 12.425 1.00 0.00 H new ATOM 0 HA LYS A 29 27.276 31.533 12.473 1.00 0.00 H new ATOM 0 HB2 LYS A 29 25.909 29.691 14.453 1.00 0.00 H new ATOM 0 HB3 LYS A 29 25.673 31.425 14.374 1.00 0.00 H new ATOM 0 HG2 LYS A 29 24.953 31.079 11.965 1.00 0.00 H new ATOM 0 HG3 LYS A 29 24.943 29.361 12.311 1.00 0.00 H new ATOM 0 HD2 LYS A 29 22.998 29.499 13.603 1.00 0.00 H new ATOM 0 HD3 LYS A 29 23.147 31.230 13.834 1.00 0.00 H new ATOM 0 HE2 LYS A 29 22.397 31.720 11.639 1.00 0.00 H new ATOM 0 HE3 LYS A 29 22.742 30.105 11.053 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 20.422 30.323 11.346 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 20.989 29.283 12.563 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 20.599 30.893 12.936 1.00 0.00 H new ATOM 471 N ILE A 30 28.697 30.152 15.162 1.00 0.00 N ATOM 472 CA ILE A 30 29.617 30.430 16.246 1.00 0.00 C ATOM 473 C ILE A 30 30.945 30.925 15.683 1.00 0.00 C ATOM 474 O ILE A 30 31.474 31.882 16.244 1.00 0.00 O ATOM 475 CB ILE A 30 29.882 29.159 17.054 1.00 0.00 C ATOM 476 CG1 ILE A 30 28.578 28.607 17.633 1.00 0.00 C ATOM 477 CG2 ILE A 30 31.012 29.268 18.069 1.00 0.00 C ATOM 478 CD1 ILE A 30 27.657 29.440 18.525 1.00 0.00 C ATOM 0 H ILE A 30 28.371 29.186 15.136 1.00 0.00 H new ATOM 0 HA ILE A 30 29.172 31.190 16.887 1.00 0.00 H new ATOM 0 HB ILE A 30 30.268 28.421 16.351 1.00 0.00 H new ATOM 0 HG12 ILE A 30 27.976 28.276 16.786 1.00 0.00 H new ATOM 0 HG13 ILE A 30 28.842 27.717 18.203 1.00 0.00 H new ATOM 0 HG21 ILE A 30 31.124 28.318 18.592 1.00 0.00 H new ATOM 0 HG22 ILE A 30 31.942 29.511 17.554 1.00 0.00 H new ATOM 0 HG23 ILE A 30 30.780 30.053 18.789 1.00 0.00 H new ATOM 0 HD11 ILE A 30 26.794 28.842 18.816 1.00 0.00 H new ATOM 0 HD12 ILE A 30 28.200 29.752 19.417 1.00 0.00 H new ATOM 0 HD13 ILE A 30 27.320 30.321 17.978 1.00 0.00 H new ATOM 490 N GLN A 31 31.471 30.392 14.585 1.00 0.00 N ATOM 491 CA GLN A 31 32.501 31.018 13.775 1.00 0.00 C ATOM 492 C GLN A 31 32.378 32.448 13.245 1.00 0.00 C ATOM 493 O GLN A 31 33.211 33.318 13.516 1.00 0.00 O ATOM 494 CB GLN A 31 32.879 30.046 12.655 1.00 0.00 C ATOM 495 CG GLN A 31 34.162 30.390 11.896 1.00 0.00 C ATOM 496 CD GLN A 31 34.559 29.321 10.889 1.00 0.00 C ATOM 497 OE1 GLN A 31 33.705 28.835 10.150 1.00 0.00 O ATOM 498 NE2 GLN A 31 35.851 29.149 10.647 1.00 0.00 N ATOM 0 H GLN A 31 31.180 29.483 14.226 1.00 0.00 H new ATOM 0 HA GLN A 31 33.276 31.206 14.518 1.00 0.00 H new ATOM 0 HB2 GLN A 31 32.985 29.049 13.082 1.00 0.00 H new ATOM 0 HB3 GLN A 31 32.056 30.001 11.942 1.00 0.00 H new ATOM 0 HG2 GLN A 31 34.028 31.339 11.377 1.00 0.00 H new ATOM 0 HG3 GLN A 31 34.974 30.529 12.610 1.00 0.00 H new ATOM 0 HE21 GLN A 31 36.546 29.560 11.271 1.00 0.00 H new ATOM 0 HE22 GLN A 31 36.150 28.606 9.837 1.00 0.00 H new ATOM 507 N ASP A 32 31.208 32.667 12.650 1.00 0.00 N ATOM 508 CA ASP A 32 30.748 33.981 12.232 1.00 0.00 C ATOM 509 C ASP A 32 30.580 35.074 13.278 1.00 0.00 C ATOM 510 O ASP A 32 30.854 36.235 12.957 1.00 0.00 O ATOM 511 CB ASP A 32 29.537 33.760 11.326 1.00 0.00 C ATOM 512 CG ASP A 32 28.994 35.004 10.628 1.00 0.00 C ATOM 513 OD1 ASP A 32 29.544 35.485 9.611 1.00 0.00 O ATOM 514 OD2 ASP A 32 28.033 35.564 11.194 1.00 0.00 O ATOM 0 H ASP A 32 30.544 31.921 12.443 1.00 0.00 H new ATOM 0 HA ASP A 32 31.574 34.447 11.694 1.00 0.00 H new ATOM 0 HB2 ASP A 32 29.805 33.027 10.565 1.00 0.00 H new ATOM 0 HB3 ASP A 32 28.736 33.322 11.922 1.00 0.00 H new ATOM 519 N LYS A 33 30.165 34.756 14.504 1.00 0.00 N ATOM 520 CA LYS A 33 29.861 35.689 15.563 1.00 0.00 C ATOM 521 C LYS A 33 30.984 35.868 16.593 1.00 0.00 C ATOM 522 O LYS A 33 30.997 36.777 17.407 1.00 0.00 O ATOM 523 CB LYS A 33 28.521 35.349 16.219 1.00 0.00 C ATOM 524 CG LYS A 33 27.333 36.064 15.588 1.00 0.00 C ATOM 525 CD LYS A 33 26.652 35.335 14.430 1.00 0.00 C ATOM 526 CE LYS A 33 25.812 36.309 13.590 1.00 0.00 C ATOM 527 NZ LYS A 33 26.695 37.011 12.651 1.00 0.00 N ATOM 0 H LYS A 33 30.028 33.786 14.790 1.00 0.00 H new ATOM 0 HA LYS A 33 29.774 36.666 15.087 1.00 0.00 H new ATOM 0 HB2 LYS A 33 28.360 34.273 16.159 1.00 0.00 H new ATOM 0 HB3 LYS A 33 28.569 35.606 17.277 1.00 0.00 H new ATOM 0 HG2 LYS A 33 26.590 36.246 16.364 1.00 0.00 H new ATOM 0 HG3 LYS A 33 27.668 37.038 15.232 1.00 0.00 H new ATOM 0 HD2 LYS A 33 27.405 34.861 13.800 1.00 0.00 H new ATOM 0 HD3 LYS A 33 26.015 34.541 14.819 1.00 0.00 H new ATOM 0 HE2 LYS A 33 25.038 35.767 13.046 1.00 0.00 H new ATOM 0 HE3 LYS A 33 25.305 37.025 14.237 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 26.121 37.557 11.977 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 27.319 37.656 13.177 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 27.272 36.318 12.132 1.00 0.00 H new ATOM 541 N GLU A 34 31.848 34.855 16.708 1.00 0.00 N ATOM 542 CA GLU A 34 32.774 34.729 17.816 1.00 0.00 C ATOM 543 C GLU A 34 34.159 34.167 17.453 1.00 0.00 C ATOM 544 O GLU A 34 35.149 34.234 18.168 1.00 0.00 O ATOM 545 CB GLU A 34 32.075 33.886 18.888 1.00 0.00 C ATOM 546 CG GLU A 34 32.948 33.421 20.055 1.00 0.00 C ATOM 547 CD GLU A 34 33.306 34.529 21.027 1.00 0.00 C ATOM 548 OE1 GLU A 34 32.405 35.175 21.612 1.00 0.00 O ATOM 549 OE2 GLU A 34 34.505 34.619 21.348 1.00 0.00 O ATOM 0 H GLU A 34 31.918 34.100 16.026 1.00 0.00 H new ATOM 0 HA GLU A 34 33.009 35.729 18.179 1.00 0.00 H new ATOM 0 HB2 GLU A 34 31.244 34.464 19.291 1.00 0.00 H new ATOM 0 HB3 GLU A 34 31.648 33.006 18.407 1.00 0.00 H new ATOM 0 HG2 GLU A 34 32.427 32.630 20.595 1.00 0.00 H new ATOM 0 HG3 GLU A 34 33.866 32.986 19.660 1.00 0.00 H new ATOM 556 N GLY A 35 34.355 33.610 16.264 1.00 0.00 N ATOM 557 CA GLY A 35 35.665 33.441 15.662 1.00 0.00 C ATOM 558 C GLY A 35 36.152 31.985 15.616 1.00 0.00 C ATOM 559 O GLY A 35 37.000 31.590 14.831 1.00 0.00 O ATOM 0 H GLY A 35 33.593 33.258 15.684 1.00 0.00 H new ATOM 0 HA2 GLY A 35 35.640 33.836 14.647 1.00 0.00 H new ATOM 0 HA3 GLY A 35 36.388 34.037 16.219 1.00 0.00 H new ATOM 563 N ILE A 36 35.533 31.122 16.417 1.00 0.00 N ATOM 564 CA ILE A 36 36.053 29.780 16.594 1.00 0.00 C ATOM 565 C ILE A 36 35.798 28.884 15.383 1.00 0.00 C ATOM 566 O ILE A 36 34.635 28.788 14.991 1.00 0.00 O ATOM 567 CB ILE A 36 35.348 29.142 17.793 1.00 0.00 C ATOM 568 CG1 ILE A 36 35.026 30.084 18.953 1.00 0.00 C ATOM 569 CG2 ILE A 36 36.121 27.895 18.226 1.00 0.00 C ATOM 570 CD1 ILE A 36 33.870 29.440 19.718 1.00 0.00 C ATOM 0 H ILE A 36 34.684 31.328 16.944 1.00 0.00 H new ATOM 0 HA ILE A 36 37.130 29.865 16.737 1.00 0.00 H new ATOM 0 HB ILE A 36 34.353 28.855 17.453 1.00 0.00 H new ATOM 0 HG12 ILE A 36 35.894 30.217 19.599 1.00 0.00 H new ATOM 0 HG13 ILE A 36 34.747 31.072 18.586 1.00 0.00 H new ATOM 0 HG21 ILE A 36 35.623 27.436 19.080 1.00 0.00 H new ATOM 0 HG22 ILE A 36 36.155 27.183 17.401 1.00 0.00 H new ATOM 0 HG23 ILE A 36 37.137 28.175 18.506 1.00 0.00 H new ATOM 0 HD11 ILE A 36 33.596 30.072 20.563 1.00 0.00 H new ATOM 0 HD12 ILE A 36 33.012 29.328 19.055 1.00 0.00 H new ATOM 0 HD13 ILE A 36 34.177 28.460 20.083 1.00 0.00 H new ATOM 582 N PRO A 37 36.837 28.259 14.833 1.00 0.00 N ATOM 583 CA PRO A 37 36.539 27.297 13.786 1.00 0.00 C ATOM 584 C PRO A 37 35.746 26.052 14.167 1.00 0.00 C ATOM 585 O PRO A 37 35.881 25.691 15.333 1.00 0.00 O ATOM 586 CB PRO A 37 37.880 26.921 13.156 1.00 0.00 C ATOM 587 CG PRO A 37 38.902 27.331 14.215 1.00 0.00 C ATOM 588 CD PRO A 37 38.254 28.399 15.085 1.00 0.00 C ATOM 0 HA PRO A 37 35.849 27.789 13.100 1.00 0.00 H new ATOM 0 HB2 PRO A 37 37.935 25.855 12.937 1.00 0.00 H new ATOM 0 HB3 PRO A 37 38.043 27.448 12.216 1.00 0.00 H new ATOM 0 HG2 PRO A 37 39.196 26.472 14.818 1.00 0.00 H new ATOM 0 HG3 PRO A 37 39.807 27.716 13.746 1.00 0.00 H new ATOM 0 HD2 PRO A 37 38.487 28.248 16.139 1.00 0.00 H new ATOM 0 HD3 PRO A 37 38.608 29.395 14.820 1.00 0.00 H new ATOM 596 N PRO A 38 34.811 25.529 13.382 1.00 0.00 N ATOM 597 CA PRO A 38 34.040 24.338 13.677 1.00 0.00 C ATOM 598 C PRO A 38 34.804 23.139 14.245 1.00 0.00 C ATOM 599 O PRO A 38 34.230 22.460 15.093 1.00 0.00 O ATOM 600 CB PRO A 38 33.372 24.009 12.345 1.00 0.00 C ATOM 601 CG PRO A 38 33.335 25.280 11.492 1.00 0.00 C ATOM 602 CD PRO A 38 34.430 26.145 12.131 1.00 0.00 C ATOM 0 HA PRO A 38 33.351 24.543 14.496 1.00 0.00 H new ATOM 0 HB2 PRO A 38 33.923 23.223 11.829 1.00 0.00 H new ATOM 0 HB3 PRO A 38 32.362 23.634 12.510 1.00 0.00 H new ATOM 0 HG2 PRO A 38 33.545 25.070 10.443 1.00 0.00 H new ATOM 0 HG3 PRO A 38 32.360 25.766 11.531 1.00 0.00 H new ATOM 0 HD2 PRO A 38 35.291 26.223 11.467 1.00 0.00 H new ATOM 0 HD3 PRO A 38 34.065 27.158 12.300 1.00 0.00 H new ATOM 610 N ASP A 39 35.995 22.851 13.719 1.00 0.00 N ATOM 611 CA ASP A 39 36.921 21.794 14.073 1.00 0.00 C ATOM 612 C ASP A 39 37.315 21.865 15.556 1.00 0.00 C ATOM 613 O ASP A 39 37.574 20.826 16.164 1.00 0.00 O ATOM 614 CB ASP A 39 38.158 21.930 13.184 1.00 0.00 C ATOM 615 CG ASP A 39 39.179 20.819 13.345 1.00 0.00 C ATOM 616 OD1 ASP A 39 38.668 19.677 13.340 1.00 0.00 O ATOM 617 OD2 ASP A 39 40.398 21.091 13.402 1.00 0.00 O ATOM 0 H ASP A 39 36.366 23.416 12.955 1.00 0.00 H new ATOM 0 HA ASP A 39 36.444 20.827 13.916 1.00 0.00 H new ATOM 0 HB2 ASP A 39 37.838 21.963 12.142 1.00 0.00 H new ATOM 0 HB3 ASP A 39 38.641 22.883 13.400 1.00 0.00 H new ATOM 622 N GLN A 40 37.277 23.012 16.219 1.00 0.00 N ATOM 623 CA GLN A 40 37.737 23.255 17.578 1.00 0.00 C ATOM 624 C GLN A 40 36.643 23.212 18.650 1.00 0.00 C ATOM 625 O GLN A 40 36.998 23.134 19.817 1.00 0.00 O ATOM 626 CB GLN A 40 38.476 24.580 17.696 1.00 0.00 C ATOM 627 CG GLN A 40 39.434 24.642 18.882 1.00 0.00 C ATOM 628 CD GLN A 40 40.435 25.783 18.769 1.00 0.00 C ATOM 629 OE1 GLN A 40 40.416 26.549 17.812 1.00 0.00 O ATOM 630 NE2 GLN A 40 41.433 25.912 19.641 1.00 0.00 N ATOM 0 H GLN A 40 36.897 23.856 15.791 1.00 0.00 H new ATOM 0 HA GLN A 40 38.410 22.420 17.772 1.00 0.00 H new ATOM 0 HB2 GLN A 40 39.036 24.757 16.778 1.00 0.00 H new ATOM 0 HB3 GLN A 40 37.748 25.386 17.786 1.00 0.00 H new ATOM 0 HG2 GLN A 40 38.860 24.757 19.802 1.00 0.00 H new ATOM 0 HG3 GLN A 40 39.973 23.698 18.958 1.00 0.00 H new ATOM 0 HE21 GLN A 40 41.485 25.294 20.451 1.00 0.00 H new ATOM 0 HE22 GLN A 40 42.145 26.628 19.499 1.00 0.00 H new ATOM 639 N GLN A 41 35.367 23.272 18.289 1.00 0.00 N ATOM 640 CA GLN A 41 34.237 23.452 19.178 1.00 0.00 C ATOM 641 C GLN A 41 33.805 22.039 19.564 1.00 0.00 C ATOM 642 O GLN A 41 33.579 21.160 18.737 1.00 0.00 O ATOM 643 CB GLN A 41 33.075 24.156 18.496 1.00 0.00 C ATOM 644 CG GLN A 41 33.287 25.568 17.954 1.00 0.00 C ATOM 645 CD GLN A 41 32.166 25.953 16.993 1.00 0.00 C ATOM 646 OE1 GLN A 41 31.055 25.432 17.038 1.00 0.00 O ATOM 647 NE2 GLN A 41 32.439 26.796 16.001 1.00 0.00 N ATOM 0 H GLN A 41 35.082 23.191 17.313 1.00 0.00 H new ATOM 0 HA GLN A 41 34.519 24.070 20.031 1.00 0.00 H new ATOM 0 HB2 GLN A 41 32.750 23.529 17.666 1.00 0.00 H new ATOM 0 HB3 GLN A 41 32.250 24.196 19.207 1.00 0.00 H new ATOM 0 HG2 GLN A 41 33.324 26.278 18.780 1.00 0.00 H new ATOM 0 HG3 GLN A 41 34.247 25.625 17.442 1.00 0.00 H new ATOM 0 HE21 GLN A 41 33.356 27.239 15.946 1.00 0.00 H new ATOM 0 HE22 GLN A 41 31.731 26.999 15.295 1.00 0.00 H new ATOM 656 N ARG A 42 33.612 21.894 20.871 1.00 0.00 N ATOM 657 CA ARG A 42 33.005 20.793 21.591 1.00 0.00 C ATOM 658 C ARG A 42 31.699 21.268 22.250 1.00 0.00 C ATOM 659 O ARG A 42 31.717 22.000 23.230 1.00 0.00 O ATOM 660 CB ARG A 42 33.986 20.213 22.601 1.00 0.00 C ATOM 661 CG ARG A 42 33.516 18.904 23.245 1.00 0.00 C ATOM 662 CD ARG A 42 34.605 18.077 23.935 1.00 0.00 C ATOM 663 NE ARG A 42 34.761 16.796 23.253 1.00 0.00 N ATOM 664 CZ ARG A 42 35.034 15.590 23.787 1.00 0.00 C ATOM 665 NH1 ARG A 42 35.092 15.507 25.117 1.00 0.00 N ATOM 666 NH2 ARG A 42 34.926 14.521 22.986 1.00 0.00 N ATOM 0 H ARG A 42 33.911 22.626 21.515 1.00 0.00 H new ATOM 0 HA ARG A 42 32.755 19.990 20.897 1.00 0.00 H new ATOM 0 HB2 ARG A 42 34.942 20.040 22.106 1.00 0.00 H new ATOM 0 HB3 ARG A 42 34.162 20.949 23.385 1.00 0.00 H new ATOM 0 HG2 ARG A 42 32.743 19.137 23.978 1.00 0.00 H new ATOM 0 HG3 ARG A 42 33.050 18.288 22.476 1.00 0.00 H new ATOM 0 HD2 ARG A 42 35.549 18.622 23.925 1.00 0.00 H new ATOM 0 HD3 ARG A 42 34.342 17.913 24.980 1.00 0.00 H new ATOM 0 HE ARG A 42 34.649 16.817 22.239 1.00 0.00 H new ATOM 0 HH11 ARG A 42 34.932 16.338 25.687 1.00 0.00 H new ATOM 0 HH12 ARG A 42 35.296 14.613 25.564 1.00 0.00 H new ATOM 0 HH21 ARG A 42 34.646 14.639 22.012 1.00 0.00 H new ATOM 0 HH22 ARG A 42 35.124 13.589 23.350 1.00 0.00 H new ATOM 680 N LEU A 43 30.541 20.786 21.795 1.00 0.00 N ATOM 681 CA LEU A 43 29.254 21.217 22.300 1.00 0.00 C ATOM 682 C LEU A 43 28.784 20.206 23.343 1.00 0.00 C ATOM 683 O LEU A 43 28.443 19.073 22.982 1.00 0.00 O ATOM 684 CB LEU A 43 28.294 21.288 21.116 1.00 0.00 C ATOM 685 CG LEU A 43 28.616 22.288 20.008 1.00 0.00 C ATOM 686 CD1 LEU A 43 29.250 23.587 20.491 1.00 0.00 C ATOM 687 CD2 LEU A 43 29.413 21.672 18.860 1.00 0.00 C ATOM 0 H LEU A 43 30.479 20.081 21.061 1.00 0.00 H new ATOM 0 HA LEU A 43 29.306 22.197 22.774 1.00 0.00 H new ATOM 0 HB2 LEU A 43 28.238 20.296 20.668 1.00 0.00 H new ATOM 0 HB3 LEU A 43 27.301 21.520 21.501 1.00 0.00 H new ATOM 0 HG LEU A 43 27.637 22.565 19.616 1.00 0.00 H new ATOM 0 HD11 LEU A 43 29.444 24.236 19.637 1.00 0.00 H new ATOM 0 HD12 LEU A 43 28.572 24.088 21.181 1.00 0.00 H new ATOM 0 HD13 LEU A 43 30.188 23.367 21.000 1.00 0.00 H new ATOM 0 HD21 LEU A 43 29.610 22.433 18.105 1.00 0.00 H new ATOM 0 HD22 LEU A 43 30.358 21.284 19.240 1.00 0.00 H new ATOM 0 HD23 LEU A 43 28.840 20.859 18.415 1.00 0.00 H new ATOM 699 N ILE A 44 28.764 20.573 24.620 1.00 0.00 N ATOM 700 CA ILE A 44 28.451 19.738 25.763 1.00 0.00 C ATOM 701 C ILE A 44 27.235 20.507 26.270 1.00 0.00 C ATOM 702 O ILE A 44 27.265 21.738 26.370 1.00 0.00 O ATOM 703 CB ILE A 44 29.565 19.862 26.808 1.00 0.00 C ATOM 704 CG1 ILE A 44 30.928 19.520 26.202 1.00 0.00 C ATOM 705 CG2 ILE A 44 29.261 18.943 27.994 1.00 0.00 C ATOM 706 CD1 ILE A 44 32.053 19.276 27.216 1.00 0.00 C ATOM 0 H ILE A 44 28.982 21.530 24.898 1.00 0.00 H new ATOM 0 HA ILE A 44 28.318 18.676 25.556 1.00 0.00 H new ATOM 0 HB ILE A 44 29.605 20.895 27.154 1.00 0.00 H new ATOM 0 HG12 ILE A 44 30.819 18.629 25.583 1.00 0.00 H new ATOM 0 HG13 ILE A 44 31.227 20.333 25.540 1.00 0.00 H new ATOM 0 HG21 ILE A 44 30.054 19.032 28.736 1.00 0.00 H new ATOM 0 HG22 ILE A 44 28.310 19.230 28.443 1.00 0.00 H new ATOM 0 HG23 ILE A 44 29.202 17.911 27.649 1.00 0.00 H new ATOM 0 HD11 ILE A 44 32.976 19.041 26.686 1.00 0.00 H new ATOM 0 HD12 ILE A 44 32.199 20.172 27.820 1.00 0.00 H new ATOM 0 HD13 ILE A 44 31.784 18.441 27.864 1.00 0.00 H new ATOM 718 N PHE A 45 26.148 19.860 26.665 1.00 0.00 N ATOM 719 CA PHE A 45 24.960 20.409 27.294 1.00 0.00 C ATOM 720 C PHE A 45 24.125 19.225 27.810 1.00 0.00 C ATOM 721 O PHE A 45 23.981 18.186 27.172 1.00 0.00 O ATOM 722 CB PHE A 45 24.138 21.253 26.322 1.00 0.00 C ATOM 723 CG PHE A 45 22.905 21.968 26.814 1.00 0.00 C ATOM 724 CD1 PHE A 45 23.079 23.164 27.527 1.00 0.00 C ATOM 725 CD2 PHE A 45 21.611 21.555 26.482 1.00 0.00 C ATOM 726 CE1 PHE A 45 21.958 23.906 27.904 1.00 0.00 C ATOM 727 CE2 PHE A 45 20.481 22.296 26.838 1.00 0.00 C ATOM 728 CZ PHE A 45 20.665 23.437 27.627 1.00 0.00 C ATOM 0 H PHE A 45 26.070 18.850 26.542 1.00 0.00 H new ATOM 0 HA PHE A 45 25.252 21.070 28.110 1.00 0.00 H new ATOM 0 HB2 PHE A 45 24.804 22.005 25.900 1.00 0.00 H new ATOM 0 HB3 PHE A 45 23.832 20.602 25.503 1.00 0.00 H new ATOM 0 HD1 PHE A 45 24.071 23.507 27.782 1.00 0.00 H new ATOM 0 HD2 PHE A 45 21.481 20.634 25.933 1.00 0.00 H new ATOM 0 HE1 PHE A 45 22.087 24.849 28.413 1.00 0.00 H new ATOM 0 HE2 PHE A 45 19.495 21.997 26.514 1.00 0.00 H new ATOM 0 HZ PHE A 45 19.807 23.959 28.025 1.00 0.00 H new ATOM 738 N ALA A 46 23.490 19.395 28.963 1.00 0.00 N ATOM 739 CA ALA A 46 22.550 18.486 29.590 1.00 0.00 C ATOM 740 C ALA A 46 23.187 17.163 30.022 1.00 0.00 C ATOM 741 O ALA A 46 22.560 16.121 30.204 1.00 0.00 O ATOM 742 CB ALA A 46 21.218 18.344 28.858 1.00 0.00 C ATOM 0 H ALA A 46 23.632 20.236 29.523 1.00 0.00 H new ATOM 0 HA ALA A 46 22.266 18.975 30.522 1.00 0.00 H new ATOM 0 HB1 ALA A 46 20.579 17.645 29.398 1.00 0.00 H new ATOM 0 HB2 ALA A 46 20.728 19.316 28.803 1.00 0.00 H new ATOM 0 HB3 ALA A 46 21.395 17.969 27.850 1.00 0.00 H new ATOM 748 N GLY A 47 24.482 17.208 30.302 1.00 0.00 N ATOM 749 CA GLY A 47 25.294 16.247 31.023 1.00 0.00 C ATOM 750 C GLY A 47 26.058 15.406 30.005 1.00 0.00 C ATOM 751 O GLY A 47 26.936 14.625 30.371 1.00 0.00 O ATOM 0 H GLY A 47 25.044 18.002 29.996 1.00 0.00 H new ATOM 0 HA2 GLY A 47 25.988 16.760 31.689 1.00 0.00 H new ATOM 0 HA3 GLY A 47 24.666 15.611 31.646 1.00 0.00 H new ATOM 755 N LYS A 48 25.817 15.472 28.699 1.00 0.00 N ATOM 756 CA LYS A 48 26.529 14.765 27.651 1.00 0.00 C ATOM 757 C LYS A 48 26.997 15.679 26.519 1.00 0.00 C ATOM 758 O LYS A 48 26.356 16.675 26.148 1.00 0.00 O ATOM 759 CB LYS A 48 25.570 13.634 27.264 1.00 0.00 C ATOM 760 CG LYS A 48 24.280 14.030 26.541 1.00 0.00 C ATOM 761 CD LYS A 48 23.666 12.753 25.959 1.00 0.00 C ATOM 762 CE LYS A 48 22.418 12.923 25.097 1.00 0.00 C ATOM 763 NZ LYS A 48 22.025 11.631 24.500 1.00 0.00 N ATOM 0 H LYS A 48 25.071 16.059 28.326 1.00 0.00 H new ATOM 0 HA LYS A 48 27.487 14.355 27.971 1.00 0.00 H new ATOM 0 HB2 LYS A 48 26.112 12.933 26.629 1.00 0.00 H new ATOM 0 HB3 LYS A 48 25.297 13.096 28.172 1.00 0.00 H new ATOM 0 HG2 LYS A 48 23.586 14.509 27.231 1.00 0.00 H new ATOM 0 HG3 LYS A 48 24.490 14.749 25.750 1.00 0.00 H new ATOM 0 HD2 LYS A 48 24.427 12.252 25.361 1.00 0.00 H new ATOM 0 HD3 LYS A 48 23.420 12.086 26.786 1.00 0.00 H new ATOM 0 HE2 LYS A 48 21.601 13.315 25.702 1.00 0.00 H new ATOM 0 HE3 LYS A 48 22.609 13.652 24.309 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 21.174 11.763 23.916 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 22.800 11.273 23.906 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 21.823 10.946 25.256 1.00 0.00 H new ATOM 777 N GLN A 49 28.142 15.288 25.974 1.00 0.00 N ATOM 778 CA GLN A 49 28.763 15.691 24.730 1.00 0.00 C ATOM 779 C GLN A 49 27.883 15.361 23.523 1.00 0.00 C ATOM 780 O GLN A 49 27.768 14.193 23.155 1.00 0.00 O ATOM 781 CB GLN A 49 30.093 14.954 24.681 1.00 0.00 C ATOM 782 CG GLN A 49 31.086 15.555 23.687 1.00 0.00 C ATOM 783 CD GLN A 49 31.313 14.577 22.552 1.00 0.00 C ATOM 784 OE1 GLN A 49 31.659 13.423 22.801 1.00 0.00 O ATOM 785 NE2 GLN A 49 31.367 15.173 21.371 1.00 0.00 N ATOM 0 H GLN A 49 28.721 14.600 26.455 1.00 0.00 H new ATOM 0 HA GLN A 49 28.906 16.771 24.688 1.00 0.00 H new ATOM 0 HB2 GLN A 49 30.539 14.958 25.676 1.00 0.00 H new ATOM 0 HB3 GLN A 49 29.913 13.912 24.417 1.00 0.00 H new ATOM 0 HG2 GLN A 49 30.703 16.498 23.298 1.00 0.00 H new ATOM 0 HG3 GLN A 49 32.029 15.776 24.186 1.00 0.00 H new ATOM 0 HE21 GLN A 49 31.053 16.139 21.272 1.00 0.00 H new ATOM 0 HE22 GLN A 49 31.722 14.667 20.560 1.00 0.00 H new ATOM 794 N LEU A 50 27.240 16.364 22.931 1.00 0.00 N ATOM 795 CA LEU A 50 26.264 16.224 21.878 1.00 0.00 C ATOM 796 C LEU A 50 26.771 15.556 20.607 1.00 0.00 C ATOM 797 O LEU A 50 27.923 15.802 20.269 1.00 0.00 O ATOM 798 CB LEU A 50 25.650 17.617 21.683 1.00 0.00 C ATOM 799 CG LEU A 50 25.146 18.459 22.859 1.00 0.00 C ATOM 800 CD1 LEU A 50 24.561 19.813 22.461 1.00 0.00 C ATOM 801 CD2 LEU A 50 24.108 17.734 23.721 1.00 0.00 C ATOM 0 H LEU A 50 27.400 17.337 23.191 1.00 0.00 H new ATOM 0 HA LEU A 50 25.495 15.509 22.171 1.00 0.00 H new ATOM 0 HB2 LEU A 50 26.396 18.219 21.164 1.00 0.00 H new ATOM 0 HB3 LEU A 50 24.808 17.496 21.001 1.00 0.00 H new ATOM 0 HG LEU A 50 26.054 18.629 23.437 1.00 0.00 H new ATOM 0 HD11 LEU A 50 24.229 20.343 23.354 1.00 0.00 H new ATOM 0 HD12 LEU A 50 25.323 20.403 21.952 1.00 0.00 H new ATOM 0 HD13 LEU A 50 23.713 19.661 21.793 1.00 0.00 H new ATOM 0 HD21 LEU A 50 23.793 18.386 24.536 1.00 0.00 H new ATOM 0 HD22 LEU A 50 23.244 17.474 23.109 1.00 0.00 H new ATOM 0 HD23 LEU A 50 24.547 16.825 24.132 1.00 0.00 H new ATOM 813 N GLU A 51 25.927 14.766 19.942 1.00 0.00 N ATOM 814 CA GLU A 51 26.077 14.348 18.564 1.00 0.00 C ATOM 815 C GLU A 51 25.677 15.484 17.609 1.00 0.00 C ATOM 816 O GLU A 51 24.778 16.270 17.875 1.00 0.00 O ATOM 817 CB GLU A 51 25.132 13.178 18.314 1.00 0.00 C ATOM 818 CG GLU A 51 25.627 12.377 17.112 1.00 0.00 C ATOM 819 CD GLU A 51 24.728 11.284 16.569 1.00 0.00 C ATOM 820 OE1 GLU A 51 24.022 10.647 17.377 1.00 0.00 O ATOM 821 OE2 GLU A 51 24.759 11.030 15.342 1.00 0.00 O ATOM 0 H GLU A 51 25.085 14.388 20.377 1.00 0.00 H new ATOM 0 HA GLU A 51 27.117 14.073 18.388 1.00 0.00 H new ATOM 0 HB2 GLU A 51 25.084 12.540 19.196 1.00 0.00 H new ATOM 0 HB3 GLU A 51 24.122 13.544 18.130 1.00 0.00 H new ATOM 0 HG2 GLU A 51 25.827 13.079 16.302 1.00 0.00 H new ATOM 0 HG3 GLU A 51 26.580 11.922 17.383 1.00 0.00 H new ATOM 828 N ASP A 52 26.465 15.757 16.570 1.00 0.00 N ATOM 829 CA ASP A 52 26.505 16.895 15.677 1.00 0.00 C ATOM 830 C ASP A 52 25.360 17.050 14.676 1.00 0.00 C ATOM 831 O ASP A 52 25.039 18.169 14.294 1.00 0.00 O ATOM 832 CB ASP A 52 27.754 16.817 14.790 1.00 0.00 C ATOM 833 CG ASP A 52 29.029 16.477 15.538 1.00 0.00 C ATOM 834 OD1 ASP A 52 29.121 15.340 16.062 1.00 0.00 O ATOM 835 OD2 ASP A 52 29.854 17.392 15.752 1.00 0.00 O ATOM 0 H ASP A 52 27.187 15.086 16.307 1.00 0.00 H new ATOM 0 HA ASP A 52 26.462 17.730 16.376 1.00 0.00 H new ATOM 0 HB2 ASP A 52 27.590 16.067 14.016 1.00 0.00 H new ATOM 0 HB3 ASP A 52 27.887 17.773 14.284 1.00 0.00 H new ATOM 840 N GLY A 53 24.853 15.890 14.268 1.00 0.00 N ATOM 841 CA GLY A 53 23.830 15.850 13.243 1.00 0.00 C ATOM 842 C GLY A 53 22.462 15.629 13.879 1.00 0.00 C ATOM 843 O GLY A 53 21.459 15.485 13.176 1.00 0.00 O ATOM 0 H GLY A 53 25.133 14.979 14.630 1.00 0.00 H new ATOM 0 HA2 GLY A 53 23.832 16.783 12.680 1.00 0.00 H new ATOM 0 HA3 GLY A 53 24.044 15.050 12.535 1.00 0.00 H new ATOM 847 N ARG A 54 22.387 15.708 15.210 1.00 0.00 N ATOM 848 CA ARG A 54 21.112 15.891 15.874 1.00 0.00 C ATOM 849 C ARG A 54 20.806 17.382 16.058 1.00 0.00 C ATOM 850 O ARG A 54 21.661 18.260 16.048 1.00 0.00 O ATOM 851 CB ARG A 54 21.168 15.304 17.290 1.00 0.00 C ATOM 852 CG ARG A 54 20.764 13.838 17.390 1.00 0.00 C ATOM 853 CD ARG A 54 21.464 12.815 16.495 1.00 0.00 C ATOM 854 NE ARG A 54 20.883 12.882 15.160 1.00 0.00 N ATOM 855 CZ ARG A 54 21.389 12.215 14.110 1.00 0.00 C ATOM 856 NH1 ARG A 54 22.464 11.422 14.089 1.00 0.00 N ATOM 857 NH2 ARG A 54 20.756 12.379 12.933 1.00 0.00 N ATOM 0 H ARG A 54 23.190 15.648 15.836 1.00 0.00 H new ATOM 0 HA ARG A 54 20.357 15.403 15.258 1.00 0.00 H new ATOM 0 HB2 ARG A 54 22.182 15.414 17.674 1.00 0.00 H new ATOM 0 HB3 ARG A 54 20.517 15.891 17.938 1.00 0.00 H new ATOM 0 HG2 ARG A 54 20.910 13.526 18.424 1.00 0.00 H new ATOM 0 HG3 ARG A 54 19.695 13.776 17.187 1.00 0.00 H new ATOM 0 HD2 ARG A 54 22.533 13.021 16.452 1.00 0.00 H new ATOM 0 HD3 ARG A 54 21.349 11.812 16.907 1.00 0.00 H new ATOM 0 HE ARG A 54 20.056 13.461 15.017 1.00 0.00 H new ATOM 0 HH11 ARG A 54 23.002 11.269 14.942 1.00 0.00 H new ATOM 0 HH12 ARG A 54 22.747 10.969 13.220 1.00 0.00 H new ATOM 0 HH21 ARG A 54 19.938 12.985 12.874 1.00 0.00 H new ATOM 0 HH22 ARG A 54 21.095 11.897 12.100 1.00 0.00 H new ATOM 871 N THR A 55 19.505 17.598 16.243 1.00 0.00 N ATOM 872 CA THR A 55 18.880 18.907 16.271 1.00 0.00 C ATOM 873 C THR A 55 18.594 19.317 17.716 1.00 0.00 C ATOM 874 O THR A 55 18.607 18.500 18.638 1.00 0.00 O ATOM 875 CB THR A 55 17.569 18.815 15.494 1.00 0.00 C ATOM 876 OG1 THR A 55 16.538 18.032 16.070 1.00 0.00 O ATOM 877 CG2 THR A 55 17.633 18.477 14.000 1.00 0.00 C ATOM 0 H THR A 55 18.840 16.837 16.382 1.00 0.00 H new ATOM 0 HA THR A 55 19.539 19.651 15.824 1.00 0.00 H new ATOM 0 HB THR A 55 17.313 19.871 15.582 1.00 0.00 H new ATOM 0 HG1 THR A 55 15.730 18.577 16.170 1.00 0.00 H new ATOM 0 HG21 THR A 55 16.623 18.448 13.590 1.00 0.00 H new ATOM 0 HG22 THR A 55 18.215 19.238 13.479 1.00 0.00 H new ATOM 0 HG23 THR A 55 18.106 17.504 13.867 1.00 0.00 H new ATOM 885 N LEU A 56 18.338 20.603 17.893 1.00 0.00 N ATOM 886 CA LEU A 56 17.891 21.249 19.113 1.00 0.00 C ATOM 887 C LEU A 56 16.658 20.503 19.636 1.00 0.00 C ATOM 888 O LEU A 56 16.591 20.052 20.769 1.00 0.00 O ATOM 889 CB LEU A 56 17.621 22.749 18.917 1.00 0.00 C ATOM 890 CG LEU A 56 18.845 23.660 19.011 1.00 0.00 C ATOM 891 CD1 LEU A 56 19.730 23.706 17.763 1.00 0.00 C ATOM 892 CD2 LEU A 56 18.404 25.122 19.138 1.00 0.00 C ATOM 0 H LEU A 56 18.446 21.271 17.130 1.00 0.00 H new ATOM 0 HA LEU A 56 18.687 21.196 19.856 1.00 0.00 H new ATOM 0 HB2 LEU A 56 17.159 22.892 17.940 1.00 0.00 H new ATOM 0 HB3 LEU A 56 16.894 23.069 19.663 1.00 0.00 H new ATOM 0 HG LEU A 56 19.390 23.245 19.859 1.00 0.00 H new ATOM 0 HD11 LEU A 56 20.568 24.381 17.936 1.00 0.00 H new ATOM 0 HD12 LEU A 56 20.107 22.706 17.547 1.00 0.00 H new ATOM 0 HD13 LEU A 56 19.145 24.064 16.915 1.00 0.00 H new ATOM 0 HD21 LEU A 56 19.283 25.763 19.204 1.00 0.00 H new ATOM 0 HD22 LEU A 56 17.816 25.402 18.264 1.00 0.00 H new ATOM 0 HD23 LEU A 56 17.799 25.243 20.036 1.00 0.00 H new ATOM 904 N SER A 57 15.592 20.423 18.847 1.00 0.00 N ATOM 905 CA SER A 57 14.383 19.646 19.047 1.00 0.00 C ATOM 906 C SER A 57 14.591 18.211 19.528 1.00 0.00 C ATOM 907 O SER A 57 13.897 17.755 20.433 1.00 0.00 O ATOM 908 CB SER A 57 13.365 19.771 17.916 1.00 0.00 C ATOM 909 OG SER A 57 13.768 19.358 16.625 1.00 0.00 O ATOM 0 H SER A 57 15.553 20.949 17.974 1.00 0.00 H new ATOM 0 HA SER A 57 13.922 20.136 19.905 1.00 0.00 H new ATOM 0 HB2 SER A 57 12.482 19.195 18.193 1.00 0.00 H new ATOM 0 HB3 SER A 57 13.058 20.815 17.854 1.00 0.00 H new ATOM 0 HG SER A 57 14.366 20.031 16.238 1.00 0.00 H new ATOM 915 N ASP A 58 15.517 17.469 18.925 1.00 0.00 N ATOM 916 CA ASP A 58 15.938 16.145 19.342 1.00 0.00 C ATOM 917 C ASP A 58 16.328 16.030 20.818 1.00 0.00 C ATOM 918 O ASP A 58 16.171 14.996 21.466 1.00 0.00 O ATOM 919 CB ASP A 58 17.112 15.706 18.461 1.00 0.00 C ATOM 920 CG ASP A 58 16.829 15.169 17.070 1.00 0.00 C ATOM 921 OD1 ASP A 58 15.770 14.523 16.894 1.00 0.00 O ATOM 922 OD2 ASP A 58 17.593 15.590 16.174 1.00 0.00 O ATOM 0 H ASP A 58 16.013 17.794 18.095 1.00 0.00 H new ATOM 0 HA ASP A 58 15.073 15.493 19.222 1.00 0.00 H new ATOM 0 HB2 ASP A 58 17.780 16.560 18.354 1.00 0.00 H new ATOM 0 HB3 ASP A 58 17.662 14.938 19.005 1.00 0.00 H new ATOM 927 N TYR A 59 16.913 17.094 21.370 1.00 0.00 N ATOM 928 CA TYR A 59 17.420 17.070 22.727 1.00 0.00 C ATOM 929 C TYR A 59 16.516 17.818 23.703 1.00 0.00 C ATOM 930 O TYR A 59 16.866 18.050 24.858 1.00 0.00 O ATOM 931 CB TYR A 59 18.715 17.868 22.783 1.00 0.00 C ATOM 932 CG TYR A 59 19.922 17.255 22.109 1.00 0.00 C ATOM 933 CD1 TYR A 59 20.218 15.895 22.318 1.00 0.00 C ATOM 934 CD2 TYR A 59 20.495 17.942 21.040 1.00 0.00 C ATOM 935 CE1 TYR A 59 21.154 15.235 21.511 1.00 0.00 C ATOM 936 CE2 TYR A 59 21.452 17.318 20.237 1.00 0.00 C ATOM 937 CZ TYR A 59 21.807 15.996 20.542 1.00 0.00 C ATOM 938 OH TYR A 59 22.937 15.399 20.068 1.00 0.00 O ATOM 0 H TYR A 59 17.044 17.984 20.889 1.00 0.00 H new ATOM 0 HA TYR A 59 17.513 16.017 22.993 1.00 0.00 H new ATOM 0 HB2 TYR A 59 18.533 18.844 22.332 1.00 0.00 H new ATOM 0 HB3 TYR A 59 18.962 18.042 23.830 1.00 0.00 H new ATOM 0 HD1 TYR A 59 19.719 15.355 23.109 1.00 0.00 H new ATOM 0 HD2 TYR A 59 20.198 18.959 20.832 1.00 0.00 H new ATOM 0 HE1 TYR A 59 21.361 14.182 21.634 1.00 0.00 H new ATOM 0 HE2 TYR A 59 21.905 17.838 19.406 1.00 0.00 H new ATOM 0 HH TYR A 59 23.352 15.975 19.393 1.00 0.00 H new ATOM 948 N ASN A 60 15.424 18.370 23.190 1.00 0.00 N ATOM 949 CA ASN A 60 14.453 19.196 23.890 1.00 0.00 C ATOM 950 C ASN A 60 14.922 20.650 24.001 1.00 0.00 C ATOM 951 O ASN A 60 14.397 21.347 24.872 1.00 0.00 O ATOM 952 CB ASN A 60 13.950 18.710 25.249 1.00 0.00 C ATOM 953 CG ASN A 60 12.881 17.629 25.175 1.00 0.00 C ATOM 954 OD1 ASN A 60 13.031 16.615 24.497 1.00 0.00 O ATOM 955 ND2 ASN A 60 11.750 17.902 25.811 1.00 0.00 N ATOM 0 H ASN A 60 15.178 18.243 22.208 1.00 0.00 H new ATOM 0 HA ASN A 60 13.582 19.110 23.241 1.00 0.00 H new ATOM 0 HB2 ASN A 60 14.796 18.328 25.820 1.00 0.00 H new ATOM 0 HB3 ASN A 60 13.551 19.561 25.800 1.00 0.00 H new ATOM 0 HD21 ASN A 60 10.961 17.258 25.748 1.00 0.00 H new ATOM 0 HD22 ASN A 60 11.669 18.756 26.363 1.00 0.00 H new ATOM 962 N ILE A 61 15.804 21.169 23.157 1.00 0.00 N ATOM 963 CA ILE A 61 16.352 22.504 23.320 1.00 0.00 C ATOM 964 C ILE A 61 15.296 23.399 22.657 1.00 0.00 C ATOM 965 O ILE A 61 15.191 23.441 21.433 1.00 0.00 O ATOM 966 CB ILE A 61 17.778 22.759 22.829 1.00 0.00 C ATOM 967 CG1 ILE A 61 18.682 21.696 23.442 1.00 0.00 C ATOM 968 CG2 ILE A 61 18.223 24.211 23.019 1.00 0.00 C ATOM 969 CD1 ILE A 61 20.061 21.591 22.777 1.00 0.00 C ATOM 0 H ILE A 61 16.159 20.673 22.339 1.00 0.00 H new ATOM 0 HA ILE A 61 16.515 22.711 24.378 1.00 0.00 H new ATOM 0 HB ILE A 61 17.840 22.651 21.746 1.00 0.00 H new ATOM 0 HG12 ILE A 61 18.816 21.915 24.501 1.00 0.00 H new ATOM 0 HG13 ILE A 61 18.184 20.729 23.377 1.00 0.00 H new ATOM 0 HG21 ILE A 61 19.242 24.330 22.652 1.00 0.00 H new ATOM 0 HG22 ILE A 61 17.558 24.871 22.463 1.00 0.00 H new ATOM 0 HG23 ILE A 61 18.186 24.467 24.078 1.00 0.00 H new ATOM 0 HD11 ILE A 61 20.644 20.813 23.270 1.00 0.00 H new ATOM 0 HD12 ILE A 61 19.939 21.340 21.723 1.00 0.00 H new ATOM 0 HD13 ILE A 61 20.581 22.545 22.865 1.00 0.00 H new ATOM 981 N GLN A 62 14.507 24.040 23.516 1.00 0.00 N ATOM 982 CA GLN A 62 13.559 25.038 23.067 1.00 0.00 C ATOM 983 C GLN A 62 14.120 26.369 22.567 1.00 0.00 C ATOM 984 O GLN A 62 15.219 26.769 22.953 1.00 0.00 O ATOM 985 CB GLN A 62 12.499 25.314 24.137 1.00 0.00 C ATOM 986 CG GLN A 62 11.559 24.144 24.420 1.00 0.00 C ATOM 987 CD GLN A 62 10.663 24.442 25.607 1.00 0.00 C ATOM 988 OE1 GLN A 62 11.107 24.102 26.704 1.00 0.00 O ATOM 989 NE2 GLN A 62 9.409 24.807 25.364 1.00 0.00 N ATOM 0 H GLN A 62 14.510 23.882 24.524 1.00 0.00 H new ATOM 0 HA GLN A 62 13.131 24.568 22.181 1.00 0.00 H new ATOM 0 HB2 GLN A 62 13.001 25.591 25.064 1.00 0.00 H new ATOM 0 HB3 GLN A 62 11.904 26.173 23.827 1.00 0.00 H new ATOM 0 HG2 GLN A 62 10.948 23.943 23.540 1.00 0.00 H new ATOM 0 HG3 GLN A 62 12.142 23.244 24.616 1.00 0.00 H new ATOM 0 HE21 GLN A 62 9.129 25.074 24.420 1.00 0.00 H new ATOM 0 HE22 GLN A 62 8.726 24.820 26.121 1.00 0.00 H new ATOM 998 N LYS A 63 13.316 27.136 21.830 1.00 0.00 N ATOM 999 CA LYS A 63 13.402 28.569 21.657 1.00 0.00 C ATOM 1000 C LYS A 63 13.705 29.336 22.949 1.00 0.00 C ATOM 1001 O LYS A 63 13.138 29.045 24.002 1.00 0.00 O ATOM 1002 CB LYS A 63 12.155 29.079 20.936 1.00 0.00 C ATOM 1003 CG LYS A 63 10.853 28.516 21.524 1.00 0.00 C ATOM 1004 CD LYS A 63 9.534 28.700 20.771 1.00 0.00 C ATOM 1005 CE LYS A 63 8.306 28.038 21.412 1.00 0.00 C ATOM 1006 NZ LYS A 63 7.176 28.078 20.471 1.00 0.00 N ATOM 0 H LYS A 63 12.538 26.736 21.306 1.00 0.00 H new ATOM 0 HA LYS A 63 14.270 28.770 21.029 1.00 0.00 H new ATOM 0 HB2 LYS A 63 12.131 30.167 20.988 1.00 0.00 H new ATOM 0 HB3 LYS A 63 12.217 28.812 19.881 1.00 0.00 H new ATOM 0 HG2 LYS A 63 10.998 27.445 21.668 1.00 0.00 H new ATOM 0 HG3 LYS A 63 10.726 28.956 22.513 1.00 0.00 H new ATOM 0 HD2 LYS A 63 9.339 29.768 20.672 1.00 0.00 H new ATOM 0 HD3 LYS A 63 9.654 28.303 19.763 1.00 0.00 H new ATOM 0 HE2 LYS A 63 8.534 27.006 21.678 1.00 0.00 H new ATOM 0 HE3 LYS A 63 8.042 28.554 22.335 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 6.345 27.629 20.907 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 6.953 29.067 20.238 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 7.430 27.566 19.602 1.00 0.00 H new ATOM 1020 N GLU A 64 14.568 30.351 22.941 1.00 0.00 N ATOM 1021 CA GLU A 64 14.853 31.320 23.989 1.00 0.00 C ATOM 1022 C GLU A 64 15.731 30.728 25.085 1.00 0.00 C ATOM 1023 O GLU A 64 15.863 31.359 26.129 1.00 0.00 O ATOM 1024 CB GLU A 64 13.620 32.075 24.494 1.00 0.00 C ATOM 1025 CG GLU A 64 12.579 32.487 23.458 1.00 0.00 C ATOM 1026 CD GLU A 64 13.161 33.277 22.298 1.00 0.00 C ATOM 1027 OE1 GLU A 64 13.562 34.447 22.503 1.00 0.00 O ATOM 1028 OE2 GLU A 64 13.277 32.649 21.222 1.00 0.00 O ATOM 0 H GLU A 64 15.140 30.529 22.116 1.00 0.00 H new ATOM 0 HA GLU A 64 15.449 32.107 23.528 1.00 0.00 H new ATOM 0 HB2 GLU A 64 13.126 31.453 25.240 1.00 0.00 H new ATOM 0 HB3 GLU A 64 13.962 32.975 25.005 1.00 0.00 H new ATOM 0 HG2 GLU A 64 12.090 31.593 23.070 1.00 0.00 H new ATOM 0 HG3 GLU A 64 11.809 33.085 23.945 1.00 0.00 H new ATOM 1035 N SER A 65 16.429 29.619 24.865 1.00 0.00 N ATOM 1036 CA SER A 65 17.280 28.840 25.753 1.00 0.00 C ATOM 1037 C SER A 65 18.745 29.257 25.549 1.00 0.00 C ATOM 1038 O SER A 65 19.303 29.737 24.562 1.00 0.00 O ATOM 1039 CB SER A 65 17.244 27.364 25.351 1.00 0.00 C ATOM 1040 OG SER A 65 15.939 26.945 25.680 1.00 0.00 O ATOM 0 H SER A 65 16.407 29.192 23.939 1.00 0.00 H new ATOM 0 HA SER A 65 16.930 29.000 26.773 1.00 0.00 H new ATOM 0 HB2 SER A 65 17.447 27.236 24.288 1.00 0.00 H new ATOM 0 HB3 SER A 65 17.995 26.786 25.890 1.00 0.00 H new ATOM 0 HG SER A 65 15.425 26.800 24.858 1.00 0.00 H new ATOM 1046 N THR A 66 19.450 28.984 26.638 1.00 0.00 N ATOM 1047 CA THR A 66 20.886 29.218 26.678 1.00 0.00 C ATOM 1048 C THR A 66 21.552 27.881 26.367 1.00 0.00 C ATOM 1049 O THR A 66 21.029 26.926 26.941 1.00 0.00 O ATOM 1050 CB THR A 66 21.153 29.644 28.119 1.00 0.00 C ATOM 1051 OG1 THR A 66 20.618 30.915 28.387 1.00 0.00 O ATOM 1052 CG2 THR A 66 22.627 29.819 28.506 1.00 0.00 C ATOM 0 H THR A 66 19.055 28.604 27.498 1.00 0.00 H new ATOM 0 HA THR A 66 21.256 29.965 25.975 1.00 0.00 H new ATOM 0 HB THR A 66 20.703 28.822 28.676 1.00 0.00 H new ATOM 0 HG1 THR A 66 20.804 31.159 29.318 1.00 0.00 H new ATOM 0 HG21 THR A 66 22.695 30.122 29.551 1.00 0.00 H new ATOM 0 HG22 THR A 66 23.154 28.875 28.367 1.00 0.00 H new ATOM 0 HG23 THR A 66 23.080 30.584 27.876 1.00 0.00 H new ATOM 1060 N LEU A 67 22.643 27.794 25.605 1.00 0.00 N ATOM 1061 CA LEU A 67 23.630 26.732 25.568 1.00 0.00 C ATOM 1062 C LEU A 67 24.795 27.478 26.238 1.00 0.00 C ATOM 1063 O LEU A 67 24.865 28.700 26.187 1.00 0.00 O ATOM 1064 CB LEU A 67 24.030 26.360 24.140 1.00 0.00 C ATOM 1065 CG LEU A 67 23.075 25.459 23.352 1.00 0.00 C ATOM 1066 CD1 LEU A 67 23.166 24.032 23.881 1.00 0.00 C ATOM 1067 CD2 LEU A 67 21.659 26.006 23.171 1.00 0.00 C ATOM 0 H LEU A 67 22.872 28.534 24.942 1.00 0.00 H new ATOM 0 HA LEU A 67 23.304 25.796 26.022 1.00 0.00 H new ATOM 0 HB2 LEU A 67 24.164 27.283 23.576 1.00 0.00 H new ATOM 0 HB3 LEU A 67 25.002 25.867 24.180 1.00 0.00 H new ATOM 0 HG LEU A 67 23.414 25.445 22.316 1.00 0.00 H new ATOM 0 HD11 LEU A 67 22.486 23.392 23.319 1.00 0.00 H new ATOM 0 HD12 LEU A 67 24.186 23.666 23.767 1.00 0.00 H new ATOM 0 HD13 LEU A 67 22.891 24.017 24.936 1.00 0.00 H new ATOM 0 HD21 LEU A 67 21.064 25.293 22.600 1.00 0.00 H new ATOM 0 HD22 LEU A 67 21.201 26.161 24.148 1.00 0.00 H new ATOM 0 HD23 LEU A 67 21.701 26.954 22.635 1.00 0.00 H new ATOM 1079 N HIS A 68 25.747 26.668 26.684 1.00 0.00 N ATOM 1080 CA HIS A 68 27.082 27.019 27.133 1.00 0.00 C ATOM 1081 C HIS A 68 28.002 26.243 26.176 1.00 0.00 C ATOM 1082 O HIS A 68 27.622 25.158 25.748 1.00 0.00 O ATOM 1083 CB HIS A 68 27.254 26.542 28.572 1.00 0.00 C ATOM 1084 CG HIS A 68 26.062 26.468 29.477 1.00 0.00 C ATOM 1085 ND1 HIS A 68 25.136 25.416 29.490 1.00 0.00 N ATOM 1086 CD2 HIS A 68 25.642 27.450 30.336 1.00 0.00 C ATOM 1087 CE1 HIS A 68 24.156 25.794 30.320 1.00 0.00 C ATOM 1088 NE2 HIS A 68 24.428 27.012 30.817 1.00 0.00 N ATOM 0 H HIS A 68 25.587 25.662 26.745 1.00 0.00 H new ATOM 0 HA HIS A 68 27.293 28.088 27.121 1.00 0.00 H new ATOM 0 HB2 HIS A 68 27.697 25.547 28.534 1.00 0.00 H new ATOM 0 HB3 HIS A 68 27.984 27.198 29.047 1.00 0.00 H new ATOM 0 HD2 HIS A 68 26.153 28.369 30.583 1.00 0.00 H new ATOM 0 HE1 HIS A 68 23.279 25.208 30.555 1.00 0.00 H new ATOM 0 HE2 HIS A 68 23.826 27.534 31.454 1.00 0.00 H new ATOM 1096 N LEU A 69 29.129 26.781 25.732 1.00 0.00 N ATOM 1097 CA LEU A 69 30.067 26.313 24.731 1.00 0.00 C ATOM 1098 C LEU A 69 31.452 26.026 25.306 1.00 0.00 C ATOM 1099 O LEU A 69 31.833 26.663 26.286 1.00 0.00 O ATOM 1100 CB LEU A 69 30.011 27.235 23.526 1.00 0.00 C ATOM 1101 CG LEU A 69 31.194 27.394 22.578 1.00 0.00 C ATOM 1102 CD1 LEU A 69 31.547 26.130 21.783 1.00 0.00 C ATOM 1103 CD2 LEU A 69 31.006 28.553 21.611 1.00 0.00 C ATOM 0 H LEU A 69 29.443 27.671 26.118 1.00 0.00 H new ATOM 0 HA LEU A 69 29.771 25.329 24.368 1.00 0.00 H new ATOM 0 HB2 LEU A 69 29.164 26.911 22.921 1.00 0.00 H new ATOM 0 HB3 LEU A 69 29.773 28.230 23.902 1.00 0.00 H new ATOM 0 HG LEU A 69 32.032 27.602 23.244 1.00 0.00 H new ATOM 0 HD11 LEU A 69 32.399 26.334 21.135 1.00 0.00 H new ATOM 0 HD12 LEU A 69 31.800 25.325 22.473 1.00 0.00 H new ATOM 0 HD13 LEU A 69 30.693 25.832 21.176 1.00 0.00 H new ATOM 0 HD21 LEU A 69 31.875 28.625 20.957 1.00 0.00 H new ATOM 0 HD22 LEU A 69 30.112 28.384 21.010 1.00 0.00 H new ATOM 0 HD23 LEU A 69 30.896 29.481 22.172 1.00 0.00 H new ATOM 1115 N VAL A 70 32.203 25.060 24.759 1.00 0.00 N ATOM 1116 CA VAL A 70 33.497 24.547 25.150 1.00 0.00 C ATOM 1117 C VAL A 70 34.404 24.421 23.918 1.00 0.00 C ATOM 1118 O VAL A 70 34.042 23.834 22.902 1.00 0.00 O ATOM 1119 CB VAL A 70 33.404 23.229 25.925 1.00 0.00 C ATOM 1120 CG1 VAL A 70 34.711 22.481 26.205 1.00 0.00 C ATOM 1121 CG2 VAL A 70 32.386 23.201 27.060 1.00 0.00 C ATOM 0 H VAL A 70 31.864 24.569 23.932 1.00 0.00 H new ATOM 0 HA VAL A 70 33.942 25.263 25.841 1.00 0.00 H new ATOM 0 HB VAL A 70 32.958 22.589 25.163 1.00 0.00 H new ATOM 0 HG11 VAL A 70 34.496 21.568 26.760 1.00 0.00 H new ATOM 0 HG12 VAL A 70 35.194 22.227 25.262 1.00 0.00 H new ATOM 0 HG13 VAL A 70 35.374 23.115 26.793 1.00 0.00 H new ATOM 0 HG21 VAL A 70 32.403 22.223 27.540 1.00 0.00 H new ATOM 0 HG22 VAL A 70 32.636 23.969 27.792 1.00 0.00 H new ATOM 0 HG23 VAL A 70 31.390 23.391 26.660 1.00 0.00 H new ATOM 1131 N LEU A 71 35.623 24.940 23.987 1.00 0.00 N ATOM 1132 CA LEU A 71 36.701 24.647 23.056 1.00 0.00 C ATOM 1133 C LEU A 71 37.236 23.253 23.400 1.00 0.00 C ATOM 1134 O LEU A 71 37.306 22.906 24.576 1.00 0.00 O ATOM 1135 CB LEU A 71 37.793 25.703 22.989 1.00 0.00 C ATOM 1136 CG LEU A 71 37.643 26.700 21.848 1.00 0.00 C ATOM 1137 CD1 LEU A 71 36.373 27.546 22.008 1.00 0.00 C ATOM 1138 CD2 LEU A 71 38.842 27.637 21.682 1.00 0.00 C ATOM 0 H LEU A 71 35.896 25.598 24.717 1.00 0.00 H new ATOM 0 HA LEU A 71 36.299 24.664 22.043 1.00 0.00 H new ATOM 0 HB2 LEU A 71 37.809 26.250 23.932 1.00 0.00 H new ATOM 0 HB3 LEU A 71 38.757 25.204 22.893 1.00 0.00 H new ATOM 0 HG LEU A 71 37.578 26.087 20.949 1.00 0.00 H new ATOM 0 HD11 LEU A 71 36.296 28.247 21.177 1.00 0.00 H new ATOM 0 HD12 LEU A 71 35.500 26.894 22.014 1.00 0.00 H new ATOM 0 HD13 LEU A 71 36.420 28.099 22.946 1.00 0.00 H new ATOM 0 HD21 LEU A 71 38.660 28.317 20.850 1.00 0.00 H new ATOM 0 HD22 LEU A 71 38.983 28.213 22.597 1.00 0.00 H new ATOM 0 HD23 LEU A 71 39.738 27.049 21.481 1.00 0.00 H new