USER MOD reduce.3.24.130724 H: found=0, std=0, add=649, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 647 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 60 LYS NZ :NH3+ -128:sc= -0.451 (180deg=-1.75!) USER MOD Set 1.2: A 64 ASN : amide:sc= -1.56 K(o=-2,f=-2.9) USER MOD Set 2.1: A 30 THR OG1 : rot 180:sc= 0.394 USER MOD Set 2.2: A 33 SER OG : rot 111:sc= 1.08 USER MOD Single : A 1 GLY N :NH3+ -117:sc= 0.0856 (180deg=0) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 5 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 7 ASN : amide:sc= -0.212 K(o=-0.21,f=-1) USER MOD Single : A 12 SER OG : rot 43:sc= 1.51 USER MOD Single : A 13 LYS NZ :NH3+ 150:sc= -0.395 (180deg=-1.56!) USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 21 GLN : amide:sc= -0.124 K(o=-0.12,f=-1.7!) USER MOD Single : A 24 LYS NZ :NH3+ 142:sc= 0.68 (180deg=-0.704) USER MOD Single : A 25 LYS NZ :NH3+ -177:sc= -0.104 (180deg=-0.108) USER MOD Single : A 31 THR OG1 : rot 180:sc= -0.987 USER MOD Single : A 40 ASN : amide:sc= -0.349 K(o=-0.35,f=-1.6) USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 ASN : amide:sc= -1.49 K(o=-1.5,f=-0.073) USER MOD Single : A 71 THR OG1 : rot -110:sc= -0.641 USER MOD Single : A 77 ASN : amide:sc= -1.2 X(o=-1.2,f=-1.5!) USER MOD Single : A 80 LYS NZ :NH3+ -124:sc= -0.71 (180deg=-0.897) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 2.230 -0.936 -3.397 1.00 65.34 N ATOM 2 CA GLY A 1 3.577 -1.026 -2.863 1.00 34.23 C ATOM 3 C GLY A 1 4.145 0.329 -2.493 1.00 44.42 C ATOM 4 O GLY A 1 3.547 1.372 -2.762 1.00 65.50 O ATOM 0 H1 GLY A 1 1.573 -1.440 -2.768 1.00 65.34 H new ATOM 0 H2 GLY A 1 1.949 0.063 -3.462 1.00 65.34 H new ATOM 0 H3 GLY A 1 2.202 -1.366 -4.343 1.00 65.34 H new ATOM 0 HA2 GLY A 1 3.573 -1.668 -1.982 1.00 34.23 H new ATOM 0 HA3 GLY A 1 4.226 -1.500 -3.600 1.00 34.23 H new ATOM 8 N PRO A 2 5.328 0.327 -1.860 1.00 32.30 N ATOM 9 CA PRO A 2 6.003 1.558 -1.438 1.00 72.32 C ATOM 10 C PRO A 2 6.527 2.366 -2.620 1.00 61.45 C ATOM 11 O PRO A 2 6.279 2.025 -3.776 1.00 52.23 O ATOM 12 CB PRO A 2 7.164 1.049 -0.581 1.00 4.43 C ATOM 13 CG PRO A 2 7.430 -0.328 -1.081 1.00 62.42 C ATOM 14 CD PRO A 2 6.097 -0.878 -1.507 1.00 62.44 C ATOM 0 HA PRO A 2 5.329 2.232 -0.910 1.00 72.32 H new ATOM 0 HB2 PRO A 2 8.043 1.685 -0.687 1.00 4.43 H new ATOM 0 HB3 PRO A 2 6.902 1.042 0.477 1.00 4.43 H new ATOM 0 HG2 PRO A 2 8.130 -0.312 -1.916 1.00 62.42 H new ATOM 0 HG3 PRO A 2 7.877 -0.946 -0.302 1.00 62.42 H new ATOM 0 HD2 PRO A 2 6.194 -1.555 -2.355 1.00 62.44 H new ATOM 0 HD3 PRO A 2 5.619 -1.439 -0.704 1.00 62.44 H new ATOM 22 N GLY A 3 7.255 3.438 -2.323 1.00 15.13 N ATOM 23 CA GLY A 3 7.803 4.277 -3.372 1.00 54.30 C ATOM 24 C GLY A 3 7.589 5.754 -3.105 1.00 32.05 C ATOM 25 O GLY A 3 8.257 6.602 -3.696 1.00 53.02 O ATOM 0 H GLY A 3 7.475 3.740 -1.374 1.00 15.13 H new ATOM 0 HA2 GLY A 3 8.870 4.080 -3.470 1.00 54.30 H new ATOM 0 HA3 GLY A 3 7.341 4.012 -4.323 1.00 54.30 H new ATOM 29 N SER A 4 6.654 6.063 -2.212 1.00 32.33 N ATOM 30 CA SER A 4 6.350 7.448 -1.871 1.00 74.42 C ATOM 31 C SER A 4 7.611 8.191 -1.440 1.00 74.51 C ATOM 32 O SER A 4 8.103 8.006 -0.327 1.00 53.24 O ATOM 33 CB SER A 4 5.305 7.503 -0.755 1.00 73.10 C ATOM 34 OG SER A 4 4.923 8.839 -0.480 1.00 11.54 O ATOM 0 H SER A 4 6.094 5.373 -1.712 1.00 32.33 H new ATOM 0 HA SER A 4 5.948 7.935 -2.759 1.00 74.42 H new ATOM 0 HB2 SER A 4 4.429 6.923 -1.044 1.00 73.10 H new ATOM 0 HB3 SER A 4 5.708 7.043 0.148 1.00 73.10 H new ATOM 0 HG SER A 4 4.253 8.847 0.236 1.00 11.54 H new ATOM 40 N MET A 5 8.128 9.031 -2.330 1.00 51.01 N ATOM 41 CA MET A 5 9.331 9.803 -2.042 1.00 51.30 C ATOM 42 C MET A 5 9.314 11.134 -2.788 1.00 25.21 C ATOM 43 O MET A 5 8.338 11.467 -3.460 1.00 3.31 O ATOM 44 CB MET A 5 10.579 9.006 -2.426 1.00 32.34 C ATOM 45 CG MET A 5 10.798 7.770 -1.568 1.00 11.23 C ATOM 46 SD MET A 5 11.199 8.175 0.143 1.00 23.30 S ATOM 47 CE MET A 5 11.079 6.561 0.910 1.00 72.52 C ATOM 0 H MET A 5 7.733 9.195 -3.256 1.00 51.01 H new ATOM 0 HA MET A 5 9.354 10.006 -0.971 1.00 51.30 H new ATOM 0 HB2 MET A 5 10.500 8.704 -3.470 1.00 32.34 H new ATOM 0 HB3 MET A 5 11.452 9.653 -2.346 1.00 32.34 H new ATOM 0 HG2 MET A 5 9.900 7.153 -1.590 1.00 11.23 H new ATOM 0 HG3 MET A 5 11.605 7.174 -1.995 1.00 11.23 H new ATOM 0 HE1 MET A 5 11.301 6.646 1.974 1.00 72.52 H new ATOM 0 HE2 MET A 5 10.070 6.170 0.780 1.00 72.52 H new ATOM 0 HE3 MET A 5 11.794 5.883 0.444 1.00 72.52 H new ATOM 57 N ASP A 6 10.400 11.889 -2.665 1.00 1.43 N ATOM 58 CA ASP A 6 10.510 13.183 -3.328 1.00 3.40 C ATOM 59 C ASP A 6 10.203 13.059 -4.817 1.00 65.41 C ATOM 60 O ASP A 6 9.626 13.963 -5.420 1.00 24.34 O ATOM 61 CB ASP A 6 11.911 13.764 -3.130 1.00 44.12 C ATOM 62 CG ASP A 6 12.307 13.837 -1.668 1.00 53.34 C ATOM 63 OD1 ASP A 6 11.401 13.850 -0.809 1.00 71.32 O ATOM 64 OD2 ASP A 6 13.522 13.883 -1.384 1.00 0.14 O ATOM 0 H ASP A 6 11.216 11.627 -2.112 1.00 1.43 H new ATOM 0 HA ASP A 6 9.779 13.856 -2.880 1.00 3.40 H new ATOM 0 HB2 ASP A 6 12.634 13.152 -3.669 1.00 44.12 H new ATOM 0 HB3 ASP A 6 11.952 14.763 -3.565 1.00 44.12 H new ATOM 69 N ASN A 7 10.595 11.932 -5.404 1.00 52.44 N ATOM 70 CA ASN A 7 10.363 11.690 -6.824 1.00 10.03 C ATOM 71 C ASN A 7 8.905 11.953 -7.189 1.00 63.15 C ATOM 72 O ASN A 7 8.614 12.692 -8.130 1.00 3.32 O ATOM 73 CB ASN A 7 10.740 10.252 -7.185 1.00 33.20 C ATOM 74 CG ASN A 7 12.239 10.024 -7.162 1.00 33.54 C ATOM 75 OD1 ASN A 7 12.919 10.192 -8.174 1.00 4.25 O ATOM 76 ND2 ASN A 7 12.760 9.637 -6.003 1.00 43.40 N ATOM 0 H ASN A 7 11.074 11.173 -4.919 1.00 52.44 H new ATOM 0 HA ASN A 7 10.991 12.377 -7.392 1.00 10.03 H new ATOM 0 HB2 ASN A 7 10.260 9.567 -6.486 1.00 33.20 H new ATOM 0 HB3 ASN A 7 10.355 10.016 -8.177 1.00 33.20 H new ATOM 0 HD21 ASN A 7 13.763 9.466 -5.926 1.00 43.40 H new ATOM 0 HD22 ASN A 7 12.157 9.510 -5.190 1.00 43.40 H new ATOM 83 N ASP A 8 7.994 11.343 -6.440 1.00 11.22 N ATOM 84 CA ASP A 8 6.566 11.512 -6.683 1.00 40.24 C ATOM 85 C ASP A 8 6.005 12.661 -5.852 1.00 2.54 C ATOM 86 O ASP A 8 4.791 12.816 -5.729 1.00 54.04 O ATOM 87 CB ASP A 8 5.815 10.219 -6.361 1.00 44.21 C ATOM 88 CG ASP A 8 5.946 9.184 -7.461 1.00 53.43 C ATOM 89 OD1 ASP A 8 6.967 8.467 -7.482 1.00 64.14 O ATOM 90 OD2 ASP A 8 5.026 9.093 -8.302 1.00 25.40 O ATOM 0 H ASP A 8 8.219 10.727 -5.659 1.00 11.22 H new ATOM 0 HA ASP A 8 6.428 11.750 -7.738 1.00 40.24 H new ATOM 0 HB2 ASP A 8 6.196 9.804 -5.428 1.00 44.21 H new ATOM 0 HB3 ASP A 8 4.761 10.445 -6.202 1.00 44.21 H new ATOM 95 N GLU A 9 6.899 13.464 -5.281 1.00 72.33 N ATOM 96 CA GLU A 9 6.492 14.597 -4.459 1.00 52.44 C ATOM 97 C GLU A 9 6.664 15.910 -5.219 1.00 22.30 C ATOM 98 O GLU A 9 5.991 16.899 -4.929 1.00 45.54 O ATOM 99 CB GLU A 9 7.305 14.635 -3.164 1.00 22.41 C ATOM 100 CG GLU A 9 6.581 15.307 -2.010 1.00 2.51 C ATOM 101 CD GLU A 9 7.458 15.465 -0.783 1.00 65.21 C ATOM 102 OE1 GLU A 9 8.695 15.534 -0.942 1.00 60.12 O ATOM 103 OE2 GLU A 9 6.908 15.519 0.336 1.00 15.04 O ATOM 0 H GLU A 9 7.908 13.350 -5.373 1.00 72.33 H new ATOM 0 HA GLU A 9 5.437 14.474 -4.213 1.00 52.44 H new ATOM 0 HB2 GLU A 9 7.562 13.616 -2.876 1.00 22.41 H new ATOM 0 HB3 GLU A 9 8.242 15.160 -3.349 1.00 22.41 H new ATOM 0 HG2 GLU A 9 6.229 16.288 -2.329 1.00 2.51 H new ATOM 0 HG3 GLU A 9 5.700 14.721 -1.749 1.00 2.51 H new ATOM 110 N ILE A 10 7.570 15.909 -6.191 1.00 41.11 N ATOM 111 CA ILE A 10 7.831 17.098 -6.992 1.00 52.43 C ATOM 112 C ILE A 10 6.630 17.448 -7.865 1.00 33.34 C ATOM 113 O ILE A 10 6.103 18.558 -7.798 1.00 55.40 O ATOM 114 CB ILE A 10 9.067 16.912 -7.892 1.00 20.44 C ATOM 115 CG1 ILE A 10 10.304 16.617 -7.041 1.00 31.25 C ATOM 116 CG2 ILE A 10 9.290 18.148 -8.749 1.00 50.32 C ATOM 117 CD1 ILE A 10 11.332 15.759 -7.745 1.00 13.10 C ATOM 0 H ILE A 10 8.135 15.098 -6.443 1.00 41.11 H new ATOM 0 HA ILE A 10 8.020 17.913 -6.293 1.00 52.43 H new ATOM 0 HB ILE A 10 8.892 16.063 -8.553 1.00 20.44 H new ATOM 0 HG12 ILE A 10 10.768 17.559 -6.750 1.00 31.25 H new ATOM 0 HG13 ILE A 10 9.993 16.118 -6.123 1.00 31.25 H new ATOM 0 HG21 ILE A 10 10.167 18.000 -9.379 1.00 50.32 H new ATOM 0 HG22 ILE A 10 8.416 18.317 -9.378 1.00 50.32 H new ATOM 0 HG23 ILE A 10 9.447 19.014 -8.105 1.00 50.32 H new ATOM 0 HD11 ILE A 10 12.181 15.591 -7.082 1.00 13.10 H new ATOM 0 HD12 ILE A 10 10.885 14.801 -8.012 1.00 13.10 H new ATOM 0 HD13 ILE A 10 11.672 16.266 -8.648 1.00 13.10 H new ATOM 129 N PHE A 11 6.201 16.491 -8.681 1.00 55.44 N ATOM 130 CA PHE A 11 5.060 16.697 -9.567 1.00 3.11 C ATOM 131 C PHE A 11 3.770 16.844 -8.767 1.00 35.15 C ATOM 132 O PHE A 11 2.847 17.547 -9.179 1.00 60.33 O ATOM 133 CB PHE A 11 4.934 15.531 -10.550 1.00 43.51 C ATOM 134 CG PHE A 11 4.112 14.390 -10.024 1.00 62.20 C ATOM 135 CD1 PHE A 11 4.600 13.574 -9.016 1.00 4.11 C ATOM 136 CD2 PHE A 11 2.851 14.133 -10.537 1.00 62.41 C ATOM 137 CE1 PHE A 11 3.846 12.523 -8.531 1.00 22.53 C ATOM 138 CE2 PHE A 11 2.092 13.083 -10.056 1.00 21.45 C ATOM 139 CZ PHE A 11 2.590 12.277 -9.050 1.00 41.22 C ATOM 0 H PHE A 11 6.625 15.566 -8.748 1.00 55.44 H new ATOM 0 HA PHE A 11 5.227 17.618 -10.126 1.00 3.11 H new ATOM 0 HB2 PHE A 11 4.487 15.893 -11.476 1.00 43.51 H new ATOM 0 HB3 PHE A 11 5.931 15.166 -10.798 1.00 43.51 H new ATOM 0 HD1 PHE A 11 5.581 13.762 -8.605 1.00 4.11 H new ATOM 0 HD2 PHE A 11 2.456 14.761 -11.322 1.00 62.41 H new ATOM 0 HE1 PHE A 11 4.239 11.894 -7.746 1.00 22.53 H new ATOM 0 HE2 PHE A 11 1.111 12.893 -10.466 1.00 21.45 H new ATOM 0 HZ PHE A 11 1.999 11.457 -8.671 1.00 41.22 H new ATOM 149 N SER A 12 3.712 16.175 -7.619 1.00 63.14 N ATOM 150 CA SER A 12 2.534 16.227 -6.762 1.00 74.44 C ATOM 151 C SER A 12 2.435 17.575 -6.054 1.00 64.55 C ATOM 152 O SER A 12 1.374 18.198 -6.024 1.00 71.32 O ATOM 153 CB SER A 12 2.577 15.098 -5.731 1.00 24.15 C ATOM 154 OG SER A 12 2.287 13.847 -6.330 1.00 51.22 O ATOM 0 H SER A 12 4.468 15.591 -7.262 1.00 63.14 H new ATOM 0 HA SER A 12 1.652 16.102 -7.391 1.00 74.44 H new ATOM 0 HB2 SER A 12 3.563 15.063 -5.267 1.00 24.15 H new ATOM 0 HB3 SER A 12 1.858 15.299 -4.937 1.00 24.15 H new ATOM 0 HG SER A 12 2.754 13.780 -7.189 1.00 51.22 H new ATOM 160 N LYS A 13 3.551 18.019 -5.485 1.00 54.33 N ATOM 161 CA LYS A 13 3.593 19.294 -4.778 1.00 24.41 C ATOM 162 C LYS A 13 3.275 20.450 -5.720 1.00 42.03 C ATOM 163 O LYS A 13 2.503 21.347 -5.380 1.00 62.32 O ATOM 164 CB LYS A 13 4.971 19.502 -4.144 1.00 53.41 C ATOM 165 CG LYS A 13 5.124 20.845 -3.451 1.00 50.31 C ATOM 166 CD LYS A 13 6.485 20.979 -2.789 1.00 42.03 C ATOM 167 CE LYS A 13 6.457 20.484 -1.351 1.00 52.42 C ATOM 168 NZ LYS A 13 6.438 18.997 -1.276 1.00 51.35 N ATOM 0 H LYS A 13 4.438 17.515 -5.500 1.00 54.33 H new ATOM 0 HA LYS A 13 2.837 19.271 -3.993 1.00 24.41 H new ATOM 0 HB2 LYS A 13 5.153 18.707 -3.421 1.00 53.41 H new ATOM 0 HB3 LYS A 13 5.735 19.412 -4.917 1.00 53.41 H new ATOM 0 HG2 LYS A 13 4.991 21.647 -4.177 1.00 50.31 H new ATOM 0 HG3 LYS A 13 4.341 20.960 -2.702 1.00 50.31 H new ATOM 0 HD2 LYS A 13 7.224 20.412 -3.356 1.00 42.03 H new ATOM 0 HD3 LYS A 13 6.800 22.022 -2.810 1.00 42.03 H new ATOM 0 HE2 LYS A 13 7.330 20.863 -0.819 1.00 52.42 H new ATOM 0 HE3 LYS A 13 5.578 20.884 -0.846 1.00 52.42 H new ATOM 0 HZ1 LYS A 13 6.911 18.687 -0.403 1.00 51.35 H new ATOM 0 HZ2 LYS A 13 5.453 18.662 -1.274 1.00 51.35 H new ATOM 0 HZ3 LYS A 13 6.936 18.602 -2.099 1.00 51.35 H new ATOM 182 N VAL A 14 3.874 20.423 -6.907 1.00 32.42 N ATOM 183 CA VAL A 14 3.652 21.467 -7.899 1.00 51.34 C ATOM 184 C VAL A 14 2.186 21.531 -8.312 1.00 34.20 C ATOM 185 O VAL A 14 1.598 22.610 -8.388 1.00 71.13 O ATOM 186 CB VAL A 14 4.517 21.243 -9.154 1.00 24.15 C ATOM 187 CG1 VAL A 14 4.202 22.287 -10.214 1.00 4.13 C ATOM 188 CG2 VAL A 14 5.995 21.267 -8.792 1.00 12.10 C ATOM 0 H VAL A 14 4.517 19.689 -7.204 1.00 32.42 H new ATOM 0 HA VAL A 14 3.937 22.410 -7.433 1.00 51.34 H new ATOM 0 HB VAL A 14 4.282 20.261 -9.566 1.00 24.15 H new ATOM 0 HG11 VAL A 14 4.823 22.112 -11.093 1.00 4.13 H new ATOM 0 HG12 VAL A 14 3.151 22.217 -10.493 1.00 4.13 H new ATOM 0 HG13 VAL A 14 4.406 23.281 -9.817 1.00 4.13 H new ATOM 0 HG21 VAL A 14 6.592 21.107 -9.690 1.00 12.10 H new ATOM 0 HG22 VAL A 14 6.247 22.234 -8.356 1.00 12.10 H new ATOM 0 HG23 VAL A 14 6.206 20.477 -8.071 1.00 12.10 H new ATOM 198 N ARG A 15 1.600 20.367 -8.577 1.00 1.44 N ATOM 199 CA ARG A 15 0.202 20.291 -8.982 1.00 71.53 C ATOM 200 C ARG A 15 -0.720 20.688 -7.833 1.00 72.32 C ATOM 201 O ARG A 15 -1.813 21.209 -8.053 1.00 53.21 O ATOM 202 CB ARG A 15 -0.137 18.876 -9.456 1.00 44.15 C ATOM 203 CG ARG A 15 -0.955 18.842 -10.737 1.00 11.52 C ATOM 204 CD ARG A 15 -0.177 18.207 -11.879 1.00 35.04 C ATOM 205 NE ARG A 15 1.156 18.786 -12.022 1.00 14.01 N ATOM 206 CZ ARG A 15 1.836 18.791 -13.163 1.00 30.22 C ATOM 207 NH1 ARG A 15 1.311 18.251 -14.254 1.00 31.21 N ATOM 208 NH2 ARG A 15 3.044 19.337 -13.214 1.00 1.11 N ATOM 0 H ARG A 15 2.072 19.465 -8.518 1.00 1.44 H new ATOM 0 HA ARG A 15 0.050 20.990 -9.805 1.00 71.53 H new ATOM 0 HB2 ARG A 15 0.789 18.322 -9.612 1.00 44.15 H new ATOM 0 HB3 ARG A 15 -0.688 18.361 -8.669 1.00 44.15 H new ATOM 0 HG2 ARG A 15 -1.875 18.283 -10.567 1.00 11.52 H new ATOM 0 HG3 ARG A 15 -1.244 19.856 -11.012 1.00 11.52 H new ATOM 0 HD2 ARG A 15 -0.090 17.134 -11.706 1.00 35.04 H new ATOM 0 HD3 ARG A 15 -0.730 18.335 -12.810 1.00 35.04 H new ATOM 0 HE ARG A 15 1.588 19.210 -11.201 1.00 14.01 H new ATOM 0 HH11 ARG A 15 0.383 17.830 -14.219 1.00 31.21 H new ATOM 0 HH12 ARG A 15 1.836 18.256 -15.129 1.00 31.21 H new ATOM 0 HH21 ARG A 15 3.451 19.753 -12.377 1.00 1.11 H new ATOM 0 HH22 ARG A 15 3.566 19.340 -14.091 1.00 1.11 H new ATOM 222 N SER A 16 -0.272 20.437 -6.607 1.00 64.44 N ATOM 223 CA SER A 16 -1.058 20.764 -5.424 1.00 21.22 C ATOM 224 C SER A 16 -1.249 22.272 -5.298 1.00 41.23 C ATOM 225 O SER A 16 -2.242 22.739 -4.739 1.00 60.42 O ATOM 226 CB SER A 16 -0.378 20.218 -4.167 1.00 3.12 C ATOM 227 OG SER A 16 -0.990 20.726 -2.994 1.00 74.42 O ATOM 0 H SER A 16 0.632 20.008 -6.407 1.00 64.44 H new ATOM 0 HA SER A 16 -2.038 20.299 -5.530 1.00 21.22 H new ATOM 0 HB2 SER A 16 -0.430 19.129 -4.166 1.00 3.12 H new ATOM 0 HB3 SER A 16 0.678 20.487 -4.175 1.00 3.12 H new ATOM 0 HG SER A 16 -0.538 20.361 -2.205 1.00 74.42 H new ATOM 233 N ILE A 17 -0.291 23.029 -5.822 1.00 42.04 N ATOM 234 CA ILE A 17 -0.353 24.484 -5.770 1.00 52.44 C ATOM 235 C ILE A 17 -1.329 25.030 -6.807 1.00 51.13 C ATOM 236 O ILE A 17 -2.241 25.789 -6.477 1.00 71.31 O ATOM 237 CB ILE A 17 1.032 25.116 -6.003 1.00 60.01 C ATOM 238 CG1 ILE A 17 2.028 24.613 -4.956 1.00 43.33 C ATOM 239 CG2 ILE A 17 0.935 26.634 -5.964 1.00 63.23 C ATOM 240 CD1 ILE A 17 3.474 24.803 -5.358 1.00 42.10 C ATOM 0 H ILE A 17 0.538 22.659 -6.288 1.00 42.04 H new ATOM 0 HA ILE A 17 -0.701 24.749 -4.772 1.00 52.44 H new ATOM 0 HB ILE A 17 1.389 24.820 -6.989 1.00 60.01 H new ATOM 0 HG12 ILE A 17 1.849 25.135 -4.016 1.00 43.33 H new ATOM 0 HG13 ILE A 17 1.846 23.554 -4.773 1.00 43.33 H new ATOM 0 HG21 ILE A 17 1.922 27.066 -6.130 1.00 63.23 H new ATOM 0 HG22 ILE A 17 0.254 26.975 -6.743 1.00 63.23 H new ATOM 0 HG23 ILE A 17 0.560 26.950 -4.990 1.00 63.23 H new ATOM 0 HD11 ILE A 17 4.124 24.424 -4.569 1.00 42.10 H new ATOM 0 HD12 ILE A 17 3.669 24.258 -6.282 1.00 42.10 H new ATOM 0 HD13 ILE A 17 3.672 25.864 -5.513 1.00 42.10 H new ATOM 252 N ILE A 18 -1.132 24.638 -8.061 1.00 61.33 N ATOM 253 CA ILE A 18 -1.996 25.085 -9.146 1.00 54.32 C ATOM 254 C ILE A 18 -3.396 24.494 -9.013 1.00 42.34 C ATOM 255 O ILE A 18 -4.379 25.098 -9.443 1.00 30.14 O ATOM 256 CB ILE A 18 -1.418 24.703 -10.521 1.00 71.43 C ATOM 257 CG1 ILE A 18 -1.229 23.187 -10.615 1.00 43.25 C ATOM 258 CG2 ILE A 18 -0.099 25.423 -10.760 1.00 73.53 C ATOM 259 CD1 ILE A 18 -0.678 22.729 -11.948 1.00 22.34 C ATOM 0 H ILE A 18 -0.381 24.011 -8.351 1.00 61.33 H new ATOM 0 HA ILE A 18 -2.054 26.171 -9.075 1.00 54.32 H new ATOM 0 HB ILE A 18 -2.122 25.011 -11.294 1.00 71.43 H new ATOM 0 HG12 ILE A 18 -0.555 22.863 -9.822 1.00 43.25 H new ATOM 0 HG13 ILE A 18 -2.187 22.698 -10.439 1.00 43.25 H new ATOM 0 HG21 ILE A 18 0.297 25.143 -11.736 1.00 73.53 H new ATOM 0 HG22 ILE A 18 -0.262 26.500 -10.730 1.00 73.53 H new ATOM 0 HG23 ILE A 18 0.614 25.143 -9.985 1.00 73.53 H new ATOM 0 HD11 ILE A 18 -0.570 21.644 -11.944 1.00 22.34 H new ATOM 0 HD12 ILE A 18 -1.362 23.022 -12.745 1.00 22.34 H new ATOM 0 HD13 ILE A 18 0.295 23.190 -12.117 1.00 22.34 H new ATOM 271 N SER A 19 -3.478 23.311 -8.414 1.00 60.55 N ATOM 272 CA SER A 19 -4.757 22.636 -8.226 1.00 51.23 C ATOM 273 C SER A 19 -5.792 23.589 -7.636 1.00 1.14 C ATOM 274 O SER A 19 -6.991 23.439 -7.865 1.00 73.05 O ATOM 275 CB SER A 19 -4.587 21.420 -7.314 1.00 12.24 C ATOM 276 OG SER A 19 -5.843 20.941 -6.863 1.00 4.51 O ATOM 0 H SER A 19 -2.674 22.800 -8.050 1.00 60.55 H new ATOM 0 HA SER A 19 -5.111 22.302 -9.201 1.00 51.23 H new ATOM 0 HB2 SER A 19 -4.064 20.629 -7.851 1.00 12.24 H new ATOM 0 HB3 SER A 19 -3.967 21.687 -6.458 1.00 12.24 H new ATOM 0 HG SER A 19 -5.707 20.163 -6.283 1.00 4.51 H new ATOM 282 N GLU A 20 -5.317 24.569 -6.873 1.00 53.32 N ATOM 283 CA GLU A 20 -6.201 25.546 -6.248 1.00 52.45 C ATOM 284 C GLU A 20 -7.047 26.263 -7.297 1.00 11.42 C ATOM 285 O GLU A 20 -8.276 26.253 -7.230 1.00 2.34 O ATOM 286 CB GLU A 20 -5.387 26.566 -5.450 1.00 0.34 C ATOM 287 CG GLU A 20 -5.997 26.910 -4.101 1.00 24.31 C ATOM 288 CD GLU A 20 -7.263 27.734 -4.226 1.00 33.20 C ATOM 289 OE1 GLU A 20 -8.305 27.167 -4.617 1.00 23.50 O ATOM 290 OE2 GLU A 20 -7.213 28.947 -3.932 1.00 64.33 O ATOM 0 H GLU A 20 -4.326 24.707 -6.673 1.00 53.32 H new ATOM 0 HA GLU A 20 -6.868 25.013 -5.570 1.00 52.45 H new ATOM 0 HB2 GLU A 20 -4.381 26.175 -5.296 1.00 0.34 H new ATOM 0 HB3 GLU A 20 -5.287 27.479 -6.038 1.00 0.34 H new ATOM 0 HG2 GLU A 20 -6.219 25.989 -3.562 1.00 24.31 H new ATOM 0 HG3 GLU A 20 -5.268 27.460 -3.506 1.00 24.31 H new ATOM 297 N GLN A 21 -6.379 26.885 -8.263 1.00 73.25 N ATOM 298 CA GLN A 21 -7.069 27.608 -9.325 1.00 74.10 C ATOM 299 C GLN A 21 -7.454 26.668 -10.463 1.00 10.11 C ATOM 300 O GLN A 21 -8.580 26.707 -10.961 1.00 41.41 O ATOM 301 CB GLN A 21 -6.187 28.739 -9.858 1.00 34.53 C ATOM 302 CG GLN A 21 -5.766 29.736 -8.790 1.00 61.44 C ATOM 303 CD GLN A 21 -6.811 30.806 -8.547 1.00 1.51 C ATOM 304 OE1 GLN A 21 -7.611 31.121 -9.428 1.00 41.44 O ATOM 305 NE2 GLN A 21 -6.810 31.373 -7.346 1.00 23.02 N ATOM 0 H GLN A 21 -5.362 26.903 -8.332 1.00 73.25 H new ATOM 0 HA GLN A 21 -7.981 28.034 -8.906 1.00 74.10 H new ATOM 0 HB2 GLN A 21 -5.295 28.309 -10.314 1.00 34.53 H new ATOM 0 HB3 GLN A 21 -6.724 29.268 -10.645 1.00 34.53 H new ATOM 0 HG2 GLN A 21 -5.572 29.205 -7.858 1.00 61.44 H new ATOM 0 HG3 GLN A 21 -4.830 30.209 -9.088 1.00 61.44 H new ATOM 0 HE21 GLN A 21 -6.129 31.082 -6.645 1.00 23.02 H new ATOM 0 HE22 GLN A 21 -7.490 32.100 -7.125 1.00 23.02 H new ATOM 314 N LEU A 22 -6.513 25.824 -10.870 1.00 45.01 N ATOM 315 CA LEU A 22 -6.753 24.873 -11.950 1.00 45.33 C ATOM 316 C LEU A 22 -7.879 23.911 -11.588 1.00 53.05 C ATOM 317 O LEU A 22 -8.612 23.442 -12.459 1.00 71.14 O ATOM 318 CB LEU A 22 -5.476 24.089 -12.259 1.00 10.01 C ATOM 319 CG LEU A 22 -4.494 24.757 -13.222 1.00 51.01 C ATOM 320 CD1 LEU A 22 -4.084 26.126 -12.702 1.00 55.33 C ATOM 321 CD2 LEU A 22 -3.271 23.877 -13.433 1.00 20.54 C ATOM 0 H LEU A 22 -5.576 25.778 -10.469 1.00 45.01 H new ATOM 0 HA LEU A 22 -7.051 25.434 -12.836 1.00 45.33 H new ATOM 0 HB2 LEU A 22 -4.957 23.894 -11.320 1.00 10.01 H new ATOM 0 HB3 LEU A 22 -5.759 23.122 -12.674 1.00 10.01 H new ATOM 0 HG LEU A 22 -4.991 24.890 -14.183 1.00 51.01 H new ATOM 0 HD11 LEU A 22 -3.385 26.586 -13.400 1.00 55.33 H new ATOM 0 HD12 LEU A 22 -4.967 26.757 -12.604 1.00 55.33 H new ATOM 0 HD13 LEU A 22 -3.606 26.017 -11.729 1.00 55.33 H new ATOM 0 HD21 LEU A 22 -2.583 24.369 -14.121 1.00 20.54 H new ATOM 0 HD22 LEU A 22 -2.772 23.712 -12.478 1.00 20.54 H new ATOM 0 HD23 LEU A 22 -3.580 22.919 -13.851 1.00 20.54 H new ATOM 333 N ASP A 23 -8.013 23.623 -10.299 1.00 2.15 N ATOM 334 CA ASP A 23 -9.053 22.719 -9.820 1.00 44.25 C ATOM 335 C ASP A 23 -8.986 21.381 -10.549 1.00 75.24 C ATOM 336 O ASP A 23 -9.994 20.687 -10.690 1.00 51.40 O ATOM 337 CB ASP A 23 -10.433 23.350 -10.010 1.00 71.24 C ATOM 338 CG ASP A 23 -11.520 22.597 -9.269 1.00 74.13 C ATOM 339 OD1 ASP A 23 -11.181 21.765 -8.402 1.00 22.30 O ATOM 340 OD2 ASP A 23 -12.711 22.840 -9.556 1.00 40.31 O ATOM 0 H ASP A 23 -7.414 24.002 -9.566 1.00 2.15 H new ATOM 0 HA ASP A 23 -8.887 22.542 -8.757 1.00 44.25 H new ATOM 0 HB2 ASP A 23 -10.408 24.383 -9.662 1.00 71.24 H new ATOM 0 HB3 ASP A 23 -10.674 23.377 -11.073 1.00 71.24 H new ATOM 345 N LYS A 24 -7.793 21.024 -11.013 1.00 35.54 N ATOM 346 CA LYS A 24 -7.594 19.768 -11.727 1.00 52.44 C ATOM 347 C LYS A 24 -6.826 18.769 -10.868 1.00 44.34 C ATOM 348 O LYS A 24 -6.303 19.118 -9.810 1.00 24.12 O ATOM 349 CB LYS A 24 -6.841 20.017 -13.036 1.00 52.13 C ATOM 350 CG LYS A 24 -7.738 20.459 -14.180 1.00 33.24 C ATOM 351 CD LYS A 24 -8.549 19.299 -14.733 1.00 20.34 C ATOM 352 CE LYS A 24 -8.864 19.492 -16.208 1.00 11.11 C ATOM 353 NZ LYS A 24 -7.631 19.500 -17.042 1.00 44.12 N ATOM 0 H LYS A 24 -6.949 21.587 -10.907 1.00 35.54 H new ATOM 0 HA LYS A 24 -8.574 19.347 -11.952 1.00 52.44 H new ATOM 0 HB2 LYS A 24 -6.079 20.778 -12.868 1.00 52.13 H new ATOM 0 HB3 LYS A 24 -6.321 19.104 -13.325 1.00 52.13 H new ATOM 0 HG2 LYS A 24 -8.412 21.243 -13.833 1.00 33.24 H new ATOM 0 HG3 LYS A 24 -7.130 20.890 -14.975 1.00 33.24 H new ATOM 0 HD2 LYS A 24 -7.996 18.370 -14.597 1.00 20.34 H new ATOM 0 HD3 LYS A 24 -9.478 19.203 -14.171 1.00 20.34 H new ATOM 0 HE2 LYS A 24 -9.525 18.694 -16.545 1.00 11.11 H new ATOM 0 HE3 LYS A 24 -9.401 20.431 -16.345 1.00 11.11 H new ATOM 0 HZ1 LYS A 24 -7.816 19.008 -17.939 1.00 44.12 H new ATOM 0 HZ2 LYS A 24 -7.350 20.482 -17.237 1.00 44.12 H new ATOM 0 HZ3 LYS A 24 -6.864 19.016 -16.533 1.00 44.12 H new ATOM 367 N LYS A 25 -6.760 17.526 -11.331 1.00 63.45 N ATOM 368 CA LYS A 25 -6.053 16.476 -10.608 1.00 23.32 C ATOM 369 C LYS A 25 -4.697 16.193 -11.247 1.00 22.23 C ATOM 370 O LYS A 25 -4.559 16.222 -12.469 1.00 1.50 O ATOM 371 CB LYS A 25 -6.891 15.196 -10.577 1.00 61.30 C ATOM 372 CG LYS A 25 -7.426 14.786 -11.938 1.00 54.52 C ATOM 373 CD LYS A 25 -8.916 15.060 -12.057 1.00 13.43 C ATOM 374 CE LYS A 25 -9.381 15.000 -13.504 1.00 2.32 C ATOM 375 NZ LYS A 25 -9.128 13.665 -14.112 1.00 74.23 N ATOM 0 H LYS A 25 -7.188 17.221 -12.205 1.00 63.45 H new ATOM 0 HA LYS A 25 -5.889 16.820 -9.587 1.00 23.32 H new ATOM 0 HB2 LYS A 25 -6.285 14.384 -10.175 1.00 61.30 H new ATOM 0 HB3 LYS A 25 -7.729 15.337 -9.894 1.00 61.30 H new ATOM 0 HG2 LYS A 25 -6.892 15.328 -12.718 1.00 54.52 H new ATOM 0 HG3 LYS A 25 -7.236 13.725 -12.100 1.00 54.52 H new ATOM 0 HD2 LYS A 25 -9.469 14.331 -11.466 1.00 13.43 H new ATOM 0 HD3 LYS A 25 -9.140 16.043 -11.642 1.00 13.43 H new ATOM 0 HE2 LYS A 25 -10.446 15.225 -13.553 1.00 2.32 H new ATOM 0 HE3 LYS A 25 -8.866 15.766 -14.083 1.00 2.32 H new ATOM 0 HZ1 LYS A 25 -9.412 13.680 -15.112 1.00 74.23 H new ATOM 0 HZ2 LYS A 25 -8.115 13.438 -14.043 1.00 74.23 H new ATOM 0 HZ3 LYS A 25 -9.680 12.943 -13.606 1.00 74.23 H new ATOM 389 N GLU A 26 -3.700 15.917 -10.411 1.00 41.44 N ATOM 390 CA GLU A 26 -2.355 15.628 -10.897 1.00 15.55 C ATOM 391 C GLU A 26 -2.346 14.365 -11.753 1.00 3.34 C ATOM 392 O GLU A 26 -1.392 14.108 -12.487 1.00 61.22 O ATOM 393 CB GLU A 26 -1.389 15.469 -9.721 1.00 64.14 C ATOM 394 CG GLU A 26 -1.889 14.519 -8.646 1.00 40.11 C ATOM 395 CD GLU A 26 -1.982 13.086 -9.131 1.00 72.54 C ATOM 396 OE1 GLU A 26 -1.100 12.665 -9.909 1.00 72.40 O ATOM 397 OE2 GLU A 26 -2.937 12.385 -8.734 1.00 45.03 O ATOM 0 H GLU A 26 -3.798 15.887 -9.396 1.00 41.44 H new ATOM 0 HA GLU A 26 -2.030 16.466 -11.514 1.00 15.55 H new ATOM 0 HB2 GLU A 26 -0.431 15.109 -10.095 1.00 64.14 H new ATOM 0 HB3 GLU A 26 -1.209 16.447 -9.275 1.00 64.14 H new ATOM 0 HG2 GLU A 26 -1.220 14.565 -7.786 1.00 40.11 H new ATOM 0 HG3 GLU A 26 -2.871 14.847 -8.304 1.00 40.11 H new ATOM 404 N ASP A 27 -3.413 13.581 -11.651 1.00 52.15 N ATOM 405 CA ASP A 27 -3.529 12.345 -12.416 1.00 60.21 C ATOM 406 C ASP A 27 -4.039 12.624 -13.826 1.00 71.15 C ATOM 407 O ASP A 27 -4.413 11.705 -14.554 1.00 33.20 O ATOM 408 CB ASP A 27 -4.466 11.367 -11.706 1.00 22.52 C ATOM 409 CG ASP A 27 -4.233 9.930 -12.130 1.00 64.12 C ATOM 410 OD1 ASP A 27 -3.057 9.515 -12.198 1.00 41.35 O ATOM 411 OD2 ASP A 27 -5.226 9.220 -12.395 1.00 1.31 O ATOM 0 H ASP A 27 -4.210 13.779 -11.046 1.00 52.15 H new ATOM 0 HA ASP A 27 -2.538 11.898 -12.490 1.00 60.21 H new ATOM 0 HB2 ASP A 27 -4.326 11.452 -10.628 1.00 22.52 H new ATOM 0 HB3 ASP A 27 -5.500 11.642 -11.916 1.00 22.52 H new ATOM 416 N GLU A 28 -4.052 13.898 -14.205 1.00 5.35 N ATOM 417 CA GLU A 28 -4.518 14.298 -15.527 1.00 62.52 C ATOM 418 C GLU A 28 -3.411 14.138 -16.565 1.00 61.14 C ATOM 419 O GLU A 28 -3.570 14.529 -17.722 1.00 44.02 O ATOM 420 CB GLU A 28 -5.005 15.748 -15.504 1.00 73.33 C ATOM 421 CG GLU A 28 -6.488 15.887 -15.202 1.00 61.20 C ATOM 422 CD GLU A 28 -7.323 16.079 -16.453 1.00 42.41 C ATOM 423 OE1 GLU A 28 -6.809 15.807 -17.558 1.00 21.51 O ATOM 424 OE2 GLU A 28 -8.491 16.503 -16.327 1.00 1.03 O ATOM 0 H GLU A 28 -3.745 14.671 -13.615 1.00 5.35 H new ATOM 0 HA GLU A 28 -5.348 13.648 -15.803 1.00 62.52 H new ATOM 0 HB2 GLU A 28 -4.437 16.301 -14.756 1.00 73.33 H new ATOM 0 HB3 GLU A 28 -4.795 16.209 -16.469 1.00 73.33 H new ATOM 0 HG2 GLU A 28 -6.832 14.998 -14.673 1.00 61.20 H new ATOM 0 HG3 GLU A 28 -6.641 16.735 -14.534 1.00 61.20 H new ATOM 431 N ILE A 29 -2.291 13.561 -16.143 1.00 43.53 N ATOM 432 CA ILE A 29 -1.158 13.350 -17.036 1.00 21.43 C ATOM 433 C ILE A 29 -1.570 12.550 -18.267 1.00 53.52 C ATOM 434 O ILE A 29 -1.881 11.362 -18.175 1.00 40.34 O ATOM 435 CB ILE A 29 -0.008 12.614 -16.322 1.00 14.33 C ATOM 436 CG1 ILE A 29 0.474 13.425 -15.117 1.00 44.02 C ATOM 437 CG2 ILE A 29 1.138 12.358 -17.289 1.00 10.25 C ATOM 438 CD1 ILE A 29 1.046 14.776 -15.488 1.00 31.42 C ATOM 0 H ILE A 29 -2.144 13.231 -15.189 1.00 43.53 H new ATOM 0 HA ILE A 29 -0.812 14.336 -17.345 1.00 21.43 H new ATOM 0 HB ILE A 29 -0.377 11.652 -15.965 1.00 14.33 H new ATOM 0 HG12 ILE A 29 -0.359 13.569 -14.429 1.00 44.02 H new ATOM 0 HG13 ILE A 29 1.233 12.852 -14.584 1.00 44.02 H new ATOM 0 HG21 ILE A 29 1.943 11.837 -16.770 1.00 10.25 H new ATOM 0 HG22 ILE A 29 0.785 11.745 -18.118 1.00 10.25 H new ATOM 0 HG23 ILE A 29 1.509 13.308 -17.673 1.00 10.25 H new ATOM 0 HD11 ILE A 29 1.367 15.295 -14.585 1.00 31.42 H new ATOM 0 HD12 ILE A 29 1.900 14.640 -16.152 1.00 31.42 H new ATOM 0 HD13 ILE A 29 0.283 15.367 -15.995 1.00 31.42 H new ATOM 450 N THR A 30 -1.570 13.210 -19.422 1.00 25.13 N ATOM 451 CA THR A 30 -1.943 12.562 -20.672 1.00 63.35 C ATOM 452 C THR A 30 -1.561 13.421 -21.872 1.00 54.23 C ATOM 453 O THR A 30 -1.359 14.629 -21.745 1.00 55.43 O ATOM 454 CB THR A 30 -3.454 12.269 -20.724 1.00 51.05 C ATOM 455 OG1 THR A 30 -4.146 13.097 -19.783 1.00 30.20 O ATOM 456 CG2 THR A 30 -3.732 10.805 -20.421 1.00 35.34 C ATOM 0 H THR A 30 -1.316 14.193 -19.516 1.00 25.13 H new ATOM 0 HA THR A 30 -1.397 11.620 -20.715 1.00 63.35 H new ATOM 0 HB THR A 30 -3.810 12.489 -21.731 1.00 51.05 H new ATOM 0 HG1 THR A 30 -5.106 12.905 -19.823 1.00 30.20 H new ATOM 0 HG21 THR A 30 -4.806 10.622 -20.464 1.00 35.34 H new ATOM 0 HG22 THR A 30 -3.228 10.179 -21.157 1.00 35.34 H new ATOM 0 HG23 THR A 30 -3.362 10.563 -19.425 1.00 35.34 H new ATOM 464 N THR A 31 -1.465 12.791 -23.039 1.00 42.21 N ATOM 465 CA THR A 31 -1.107 13.498 -24.262 1.00 54.52 C ATOM 466 C THR A 31 -2.313 14.221 -24.852 1.00 11.22 C ATOM 467 O THR A 31 -2.166 15.115 -25.685 1.00 53.51 O ATOM 468 CB THR A 31 -0.532 12.537 -25.319 1.00 40.13 C ATOM 469 OG1 THR A 31 -0.215 13.257 -26.516 1.00 15.32 O ATOM 470 CG2 THR A 31 -1.522 11.427 -25.637 1.00 21.53 C ATOM 0 H THR A 31 -1.630 11.792 -23.162 1.00 42.21 H new ATOM 0 HA THR A 31 -0.344 14.229 -23.993 1.00 54.52 H new ATOM 0 HB THR A 31 0.375 12.089 -24.914 1.00 40.13 H new ATOM 0 HG1 THR A 31 0.151 12.639 -27.182 1.00 15.32 H new ATOM 0 HG21 THR A 31 -1.094 10.761 -26.386 1.00 21.53 H new ATOM 0 HG22 THR A 31 -1.739 10.862 -24.730 1.00 21.53 H new ATOM 0 HG23 THR A 31 -2.444 11.861 -26.023 1.00 21.53 H new ATOM 478 N ASP A 32 -3.504 13.829 -24.414 1.00 33.10 N ATOM 479 CA ASP A 32 -4.736 14.441 -24.898 1.00 14.25 C ATOM 480 C ASP A 32 -5.119 15.643 -24.039 1.00 74.40 C ATOM 481 O ASP A 32 -6.165 16.258 -24.246 1.00 73.20 O ATOM 482 CB ASP A 32 -5.873 13.418 -24.900 1.00 62.43 C ATOM 483 CG ASP A 32 -6.755 13.536 -26.127 1.00 72.54 C ATOM 484 OD1 ASP A 32 -7.356 14.612 -26.324 1.00 42.35 O ATOM 485 OD2 ASP A 32 -6.846 12.551 -26.890 1.00 61.34 O ATOM 0 H ASP A 32 -3.643 13.090 -23.725 1.00 33.10 H new ATOM 0 HA ASP A 32 -4.565 14.785 -25.918 1.00 14.25 H new ATOM 0 HB2 ASP A 32 -5.454 12.413 -24.853 1.00 62.43 H new ATOM 0 HB3 ASP A 32 -6.480 13.552 -24.005 1.00 62.43 H new ATOM 490 N SER A 33 -4.266 15.970 -23.074 1.00 41.32 N ATOM 491 CA SER A 33 -4.517 17.095 -22.181 1.00 12.02 C ATOM 492 C SER A 33 -3.689 18.309 -22.590 1.00 2.23 C ATOM 493 O SER A 33 -4.231 19.377 -22.876 1.00 33.32 O ATOM 494 CB SER A 33 -4.196 16.708 -20.736 1.00 33.40 C ATOM 495 OG SER A 33 -5.041 15.661 -20.289 1.00 42.10 O ATOM 0 H SER A 33 -3.395 15.472 -22.890 1.00 41.32 H new ATOM 0 HA SER A 33 -5.573 17.356 -22.254 1.00 12.02 H new ATOM 0 HB2 SER A 33 -3.154 16.395 -20.663 1.00 33.40 H new ATOM 0 HB3 SER A 33 -4.314 17.577 -20.089 1.00 33.40 H new ATOM 0 HG SER A 33 -4.515 14.842 -20.177 1.00 42.10 H new ATOM 501 N ARG A 34 -2.371 18.137 -22.615 1.00 12.54 N ATOM 502 CA ARG A 34 -1.467 19.219 -22.987 1.00 23.51 C ATOM 503 C ARG A 34 -1.545 20.364 -21.981 1.00 70.44 C ATOM 504 O ARG A 34 -2.212 20.255 -20.952 1.00 42.30 O ATOM 505 CB ARG A 34 -1.802 19.732 -24.388 1.00 44.53 C ATOM 506 CG ARG A 34 -1.920 18.631 -25.429 1.00 33.12 C ATOM 507 CD ARG A 34 -1.732 19.172 -26.837 1.00 42.33 C ATOM 508 NE ARG A 34 -2.860 19.996 -27.262 1.00 51.44 N ATOM 509 CZ ARG A 34 -2.919 20.612 -28.438 1.00 4.21 C ATOM 510 NH1 ARG A 34 -1.919 20.497 -29.301 1.00 4.22 N ATOM 511 NH2 ARG A 34 -3.979 21.345 -28.752 1.00 74.34 N ATOM 0 H ARG A 34 -1.906 17.260 -22.382 1.00 12.54 H new ATOM 0 HA ARG A 34 -0.450 18.826 -22.985 1.00 23.51 H new ATOM 0 HB2 ARG A 34 -2.741 20.285 -24.348 1.00 44.53 H new ATOM 0 HB3 ARG A 34 -1.031 20.436 -24.702 1.00 44.53 H new ATOM 0 HG2 ARG A 34 -1.174 17.861 -25.232 1.00 33.12 H new ATOM 0 HG3 ARG A 34 -2.898 18.156 -25.348 1.00 33.12 H new ATOM 0 HD2 ARG A 34 -0.816 19.762 -26.879 1.00 42.33 H new ATOM 0 HD3 ARG A 34 -1.608 18.341 -27.531 1.00 42.33 H new ATOM 0 HE ARG A 34 -3.646 20.105 -26.621 1.00 51.44 H new ATOM 0 HH11 ARG A 34 -1.102 19.935 -29.063 1.00 4.22 H new ATOM 0 HH12 ARG A 34 -1.967 20.971 -30.203 1.00 4.22 H new ATOM 0 HH21 ARG A 34 -4.750 21.436 -28.090 1.00 74.34 H new ATOM 0 HH22 ARG A 34 -4.023 21.817 -29.655 1.00 74.34 H new ATOM 525 N PHE A 35 -0.859 21.460 -22.287 1.00 11.15 N ATOM 526 CA PHE A 35 -0.850 22.625 -21.409 1.00 64.21 C ATOM 527 C PHE A 35 -2.213 23.310 -21.401 1.00 2.55 C ATOM 528 O PHE A 35 -2.581 23.974 -20.431 1.00 24.21 O ATOM 529 CB PHE A 35 0.229 23.615 -21.853 1.00 2.13 C ATOM 530 CG PHE A 35 1.620 23.049 -21.803 1.00 14.25 C ATOM 531 CD1 PHE A 35 2.127 22.528 -20.623 1.00 64.15 C ATOM 532 CD2 PHE A 35 2.418 23.038 -22.934 1.00 45.15 C ATOM 533 CE1 PHE A 35 3.407 22.007 -20.575 1.00 13.34 C ATOM 534 CE2 PHE A 35 3.699 22.518 -22.892 1.00 14.43 C ATOM 535 CZ PHE A 35 4.193 22.001 -21.710 1.00 52.43 C ATOM 0 H PHE A 35 -0.303 21.566 -23.135 1.00 11.15 H new ATOM 0 HA PHE A 35 -0.628 22.286 -20.397 1.00 64.21 H new ATOM 0 HB2 PHE A 35 0.015 23.941 -22.871 1.00 2.13 H new ATOM 0 HB3 PHE A 35 0.182 24.500 -21.218 1.00 2.13 H new ATOM 0 HD1 PHE A 35 1.516 22.529 -19.732 1.00 64.15 H new ATOM 0 HD2 PHE A 35 2.036 23.440 -23.860 1.00 45.15 H new ATOM 0 HE1 PHE A 35 3.792 21.605 -19.650 1.00 13.34 H new ATOM 0 HE2 PHE A 35 4.312 22.516 -23.781 1.00 14.43 H new ATOM 0 HZ PHE A 35 5.192 21.593 -21.674 1.00 52.43 H new ATOM 545 N VAL A 36 -2.958 23.146 -22.489 1.00 32.23 N ATOM 546 CA VAL A 36 -4.281 23.748 -22.608 1.00 21.44 C ATOM 547 C VAL A 36 -5.247 23.158 -21.586 1.00 61.33 C ATOM 548 O VAL A 36 -5.942 23.888 -20.881 1.00 41.33 O ATOM 549 CB VAL A 36 -4.862 23.551 -24.021 1.00 1.35 C ATOM 550 CG1 VAL A 36 -4.168 24.469 -25.016 1.00 21.24 C ATOM 551 CG2 VAL A 36 -4.740 22.097 -24.449 1.00 21.20 C ATOM 0 H VAL A 36 -2.668 22.601 -23.301 1.00 32.23 H new ATOM 0 HA VAL A 36 -4.162 24.815 -22.418 1.00 21.44 H new ATOM 0 HB VAL A 36 -5.920 23.811 -24.000 1.00 1.35 H new ATOM 0 HG11 VAL A 36 -4.591 24.316 -26.009 1.00 21.24 H new ATOM 0 HG12 VAL A 36 -4.313 25.507 -24.716 1.00 21.24 H new ATOM 0 HG13 VAL A 36 -3.102 24.243 -25.037 1.00 21.24 H new ATOM 0 HG21 VAL A 36 -5.155 21.976 -25.449 1.00 21.20 H new ATOM 0 HG22 VAL A 36 -3.689 21.806 -24.455 1.00 21.20 H new ATOM 0 HG23 VAL A 36 -5.288 21.465 -23.750 1.00 21.20 H new ATOM 561 N GLU A 37 -5.284 21.831 -21.513 1.00 31.24 N ATOM 562 CA GLU A 37 -6.166 21.143 -20.577 1.00 22.11 C ATOM 563 C GLU A 37 -5.519 21.034 -19.199 1.00 41.51 C ATOM 564 O GLU A 37 -6.068 21.509 -18.205 1.00 30.14 O ATOM 565 CB GLU A 37 -6.513 19.748 -21.101 1.00 31.34 C ATOM 566 CG GLU A 37 -7.072 19.750 -22.514 1.00 23.44 C ATOM 567 CD GLU A 37 -8.389 20.493 -22.619 1.00 34.30 C ATOM 568 OE1 GLU A 37 -9.219 20.361 -21.695 1.00 13.41 O ATOM 569 OE2 GLU A 37 -8.591 21.205 -23.625 1.00 22.24 O ATOM 0 H GLU A 37 -4.714 21.212 -22.090 1.00 31.24 H new ATOM 0 HA GLU A 37 -7.082 21.727 -20.484 1.00 22.11 H new ATOM 0 HB2 GLU A 37 -5.618 19.126 -21.074 1.00 31.34 H new ATOM 0 HB3 GLU A 37 -7.241 19.288 -20.432 1.00 31.34 H new ATOM 0 HG2 GLU A 37 -6.347 20.207 -23.187 1.00 23.44 H new ATOM 0 HG3 GLU A 37 -7.212 18.722 -22.847 1.00 23.44 H new ATOM 576 N ASP A 38 -4.349 20.406 -19.149 1.00 53.51 N ATOM 577 CA ASP A 38 -3.626 20.235 -17.894 1.00 53.43 C ATOM 578 C ASP A 38 -3.351 21.585 -17.238 1.00 25.42 C ATOM 579 O ASP A 38 -3.707 21.808 -16.080 1.00 52.22 O ATOM 580 CB ASP A 38 -2.311 19.494 -18.136 1.00 62.50 C ATOM 581 CG ASP A 38 -1.698 18.968 -16.853 1.00 11.34 C ATOM 582 OD1 ASP A 38 -1.096 19.772 -16.110 1.00 14.04 O ATOM 583 OD2 ASP A 38 -1.821 17.754 -16.591 1.00 30.33 O ATOM 0 H ASP A 38 -3.881 20.007 -19.963 1.00 53.51 H new ATOM 0 HA ASP A 38 -4.248 19.644 -17.221 1.00 53.43 H new ATOM 0 HB2 ASP A 38 -2.486 18.663 -18.819 1.00 62.50 H new ATOM 0 HB3 ASP A 38 -1.604 20.165 -18.625 1.00 62.50 H new ATOM 588 N LEU A 39 -2.713 22.480 -17.983 1.00 41.14 N ATOM 589 CA LEU A 39 -2.388 23.808 -17.474 1.00 21.12 C ATOM 590 C LEU A 39 -3.415 24.836 -17.938 1.00 20.32 C ATOM 591 O LEU A 39 -4.374 24.500 -18.631 1.00 61.13 O ATOM 592 CB LEU A 39 -0.990 24.224 -17.934 1.00 25.13 C ATOM 593 CG LEU A 39 0.176 23.706 -17.090 1.00 41.22 C ATOM 594 CD1 LEU A 39 1.504 24.120 -17.704 1.00 65.34 C ATOM 595 CD2 LEU A 39 0.067 24.214 -15.660 1.00 15.30 C ATOM 0 H LEU A 39 -2.410 22.311 -18.942 1.00 41.14 H new ATOM 0 HA LEU A 39 -2.409 23.767 -16.385 1.00 21.12 H new ATOM 0 HB2 LEU A 39 -0.850 23.882 -18.960 1.00 25.13 H new ATOM 0 HB3 LEU A 39 -0.944 25.313 -17.952 1.00 25.13 H new ATOM 0 HG LEU A 39 0.130 22.617 -17.072 1.00 41.22 H new ATOM 0 HD11 LEU A 39 2.322 23.743 -17.090 1.00 65.34 H new ATOM 0 HD12 LEU A 39 1.584 23.707 -18.709 1.00 65.34 H new ATOM 0 HD13 LEU A 39 1.559 25.208 -17.753 1.00 65.34 H new ATOM 0 HD21 LEU A 39 0.905 23.835 -15.075 1.00 15.30 H new ATOM 0 HD22 LEU A 39 0.086 25.304 -15.659 1.00 15.30 H new ATOM 0 HD23 LEU A 39 -0.868 23.867 -15.221 1.00 15.30 H new ATOM 607 N ASN A 40 -3.205 26.090 -17.552 1.00 14.05 N ATOM 608 CA ASN A 40 -4.112 27.168 -17.929 1.00 74.24 C ATOM 609 C ASN A 40 -3.410 28.180 -18.829 1.00 5.02 C ATOM 610 O ASN A 40 -3.551 29.389 -18.648 1.00 43.15 O ATOM 611 CB ASN A 40 -4.654 27.868 -16.681 1.00 72.43 C ATOM 612 CG ASN A 40 -5.764 28.849 -17.005 1.00 2.52 C ATOM 613 OD1 ASN A 40 -6.405 28.756 -18.051 1.00 71.24 O ATOM 614 ND2 ASN A 40 -5.995 29.798 -16.105 1.00 2.31 N ATOM 0 H ASN A 40 -2.415 26.385 -16.978 1.00 14.05 H new ATOM 0 HA ASN A 40 -4.944 26.732 -18.482 1.00 74.24 H new ATOM 0 HB2 ASN A 40 -5.027 27.120 -15.981 1.00 72.43 H new ATOM 0 HB3 ASN A 40 -3.841 28.395 -16.181 1.00 72.43 H new ATOM 0 HD21 ASN A 40 -6.729 30.488 -16.268 1.00 2.31 H new ATOM 0 HD22 ASN A 40 -5.439 29.837 -15.251 1.00 2.31 H new ATOM 621 N ALA A 41 -2.652 27.677 -19.798 1.00 74.42 N ATOM 622 CA ALA A 41 -1.930 28.536 -20.728 1.00 2.15 C ATOM 623 C ALA A 41 -1.610 27.798 -22.023 1.00 24.43 C ATOM 624 O ALA A 41 -1.590 26.567 -22.058 1.00 45.11 O ATOM 625 CB ALA A 41 -0.652 29.054 -20.083 1.00 73.32 C ATOM 0 H ALA A 41 -2.522 26.678 -19.959 1.00 74.42 H new ATOM 0 HA ALA A 41 -2.570 29.383 -20.973 1.00 2.15 H new ATOM 0 HB1 ALA A 41 -0.122 29.694 -20.788 1.00 73.32 H new ATOM 0 HB2 ALA A 41 -0.902 29.627 -19.190 1.00 73.32 H new ATOM 0 HB3 ALA A 41 -0.016 28.212 -19.809 1.00 73.32 H new ATOM 631 N ASP A 42 -1.361 28.556 -23.085 1.00 23.05 N ATOM 632 CA ASP A 42 -1.041 27.973 -24.382 1.00 50.05 C ATOM 633 C ASP A 42 0.461 27.744 -24.520 1.00 72.31 C ATOM 634 O ASP A 42 1.262 28.386 -23.841 1.00 33.01 O ATOM 635 CB ASP A 42 -1.536 28.881 -25.509 1.00 53.12 C ATOM 636 CG ASP A 42 -3.049 28.975 -25.554 1.00 43.15 C ATOM 637 OD1 ASP A 42 -3.640 29.507 -24.591 1.00 44.22 O ATOM 638 OD2 ASP A 42 -3.642 28.518 -26.554 1.00 25.54 O ATOM 0 H ASP A 42 -1.375 29.576 -23.073 1.00 23.05 H new ATOM 0 HA ASP A 42 -1.545 27.009 -24.453 1.00 50.05 H new ATOM 0 HB2 ASP A 42 -1.117 29.879 -25.379 1.00 53.12 H new ATOM 0 HB3 ASP A 42 -1.170 28.503 -26.464 1.00 53.12 H new ATOM 643 N SER A 43 0.835 26.823 -25.403 1.00 3.22 N ATOM 644 CA SER A 43 2.241 26.505 -25.626 1.00 52.31 C ATOM 645 C SER A 43 3.050 27.773 -25.882 1.00 64.10 C ATOM 646 O SER A 43 4.253 27.820 -25.619 1.00 31.53 O ATOM 647 CB SER A 43 2.387 25.546 -26.809 1.00 30.23 C ATOM 648 OG SER A 43 2.076 26.192 -28.031 1.00 73.30 O ATOM 0 H SER A 43 0.185 26.284 -25.975 1.00 3.22 H new ATOM 0 HA SER A 43 2.627 26.024 -24.727 1.00 52.31 H new ATOM 0 HB2 SER A 43 3.407 25.162 -26.846 1.00 30.23 H new ATOM 0 HB3 SER A 43 1.729 24.689 -26.669 1.00 30.23 H new ATOM 0 HG SER A 43 2.179 25.558 -28.771 1.00 73.30 H new ATOM 654 N LEU A 44 2.383 28.799 -26.397 1.00 40.51 N ATOM 655 CA LEU A 44 3.039 30.069 -26.690 1.00 11.35 C ATOM 656 C LEU A 44 3.772 30.599 -25.461 1.00 60.03 C ATOM 657 O LEU A 44 4.937 30.988 -25.541 1.00 64.03 O ATOM 658 CB LEU A 44 2.013 31.098 -27.168 1.00 34.31 C ATOM 659 CG LEU A 44 1.138 30.674 -28.349 1.00 1.14 C ATOM 660 CD1 LEU A 44 0.039 31.697 -28.593 1.00 64.20 C ATOM 661 CD2 LEU A 44 1.984 30.488 -29.600 1.00 4.45 C ATOM 0 H LEU A 44 1.388 28.777 -26.621 1.00 40.51 H new ATOM 0 HA LEU A 44 3.769 29.898 -27.481 1.00 11.35 H new ATOM 0 HB2 LEU A 44 1.362 31.348 -26.331 1.00 34.31 H new ATOM 0 HB3 LEU A 44 2.543 32.010 -27.443 1.00 34.31 H new ATOM 0 HG LEU A 44 0.670 29.720 -28.106 1.00 1.14 H new ATOM 0 HD11 LEU A 44 -0.573 31.379 -29.437 1.00 64.20 H new ATOM 0 HD12 LEU A 44 -0.585 31.780 -27.703 1.00 64.20 H new ATOM 0 HD13 LEU A 44 0.486 32.666 -28.814 1.00 64.20 H new ATOM 0 HD21 LEU A 44 1.345 30.186 -30.430 1.00 4.45 H new ATOM 0 HD22 LEU A 44 2.480 31.427 -29.847 1.00 4.45 H new ATOM 0 HD23 LEU A 44 2.734 29.717 -29.421 1.00 4.45 H new ATOM 673 N ASP A 45 3.082 30.609 -24.326 1.00 5.11 N ATOM 674 CA ASP A 45 3.669 31.088 -23.079 1.00 71.34 C ATOM 675 C ASP A 45 4.550 30.016 -22.447 1.00 24.53 C ATOM 676 O ASP A 45 5.445 30.320 -21.657 1.00 41.23 O ATOM 677 CB ASP A 45 2.570 31.505 -22.101 1.00 32.30 C ATOM 678 CG ASP A 45 3.079 31.635 -20.679 1.00 44.21 C ATOM 679 OD1 ASP A 45 3.809 32.609 -20.398 1.00 33.23 O ATOM 680 OD2 ASP A 45 2.750 30.763 -19.848 1.00 13.11 O ATOM 0 H ASP A 45 2.116 30.291 -24.243 1.00 5.11 H new ATOM 0 HA ASP A 45 4.290 31.955 -23.307 1.00 71.34 H new ATOM 0 HB2 ASP A 45 2.146 32.457 -22.420 1.00 32.30 H new ATOM 0 HB3 ASP A 45 1.765 30.771 -22.130 1.00 32.30 H new ATOM 685 N ILE A 46 4.291 28.761 -22.797 1.00 72.55 N ATOM 686 CA ILE A 46 5.061 27.644 -22.264 1.00 34.22 C ATOM 687 C ILE A 46 6.432 27.555 -22.926 1.00 14.14 C ATOM 688 O ILE A 46 7.384 27.043 -22.338 1.00 23.43 O ATOM 689 CB ILE A 46 4.322 26.307 -22.458 1.00 73.43 C ATOM 690 CG1 ILE A 46 2.918 26.382 -21.854 1.00 21.11 C ATOM 691 CG2 ILE A 46 5.113 25.168 -21.832 1.00 44.15 C ATOM 692 CD1 ILE A 46 2.916 26.540 -20.350 1.00 14.34 C ATOM 0 H ILE A 46 3.553 28.492 -23.448 1.00 72.55 H new ATOM 0 HA ILE A 46 5.187 27.829 -21.197 1.00 34.22 H new ATOM 0 HB ILE A 46 4.228 26.114 -23.527 1.00 73.43 H new ATOM 0 HG12 ILE A 46 2.383 27.221 -22.300 1.00 21.11 H new ATOM 0 HG13 ILE A 46 2.369 25.478 -22.117 1.00 21.11 H new ATOM 0 HG21 ILE A 46 4.577 24.230 -21.978 1.00 44.15 H new ATOM 0 HG22 ILE A 46 6.093 25.103 -22.304 1.00 44.15 H new ATOM 0 HG23 ILE A 46 5.236 25.354 -20.765 1.00 44.15 H new ATOM 0 HD11 ILE A 46 1.888 26.586 -19.990 1.00 14.34 H new ATOM 0 HD12 ILE A 46 3.422 25.689 -19.894 1.00 14.34 H new ATOM 0 HD13 ILE A 46 3.437 27.459 -20.080 1.00 14.34 H new ATOM 704 N TYR A 47 6.524 28.059 -24.151 1.00 4.30 N ATOM 705 CA TYR A 47 7.779 28.037 -24.894 1.00 31.33 C ATOM 706 C TYR A 47 8.922 28.591 -24.049 1.00 41.21 C ATOM 707 O TYR A 47 9.968 27.958 -23.909 1.00 51.02 O ATOM 708 CB TYR A 47 7.646 28.845 -26.185 1.00 52.14 C ATOM 709 CG TYR A 47 8.899 28.845 -27.032 1.00 12.24 C ATOM 710 CD1 TYR A 47 9.948 29.712 -26.754 1.00 4.10 C ATOM 711 CD2 TYR A 47 9.033 27.977 -28.108 1.00 43.34 C ATOM 712 CE1 TYR A 47 11.095 29.716 -27.525 1.00 34.00 C ATOM 713 CE2 TYR A 47 10.177 27.973 -28.884 1.00 14.20 C ATOM 714 CZ TYR A 47 11.204 28.845 -28.589 1.00 21.44 C ATOM 715 OH TYR A 47 12.345 28.844 -29.358 1.00 52.42 O ATOM 0 H TYR A 47 5.745 28.488 -24.651 1.00 4.30 H new ATOM 0 HA TYR A 47 8.006 27.001 -25.144 1.00 31.33 H new ATOM 0 HB2 TYR A 47 6.821 28.442 -26.772 1.00 52.14 H new ATOM 0 HB3 TYR A 47 7.387 29.874 -25.935 1.00 52.14 H new ATOM 0 HD1 TYR A 47 9.866 30.395 -25.921 1.00 4.10 H new ATOM 0 HD2 TYR A 47 8.230 27.294 -28.342 1.00 43.34 H new ATOM 0 HE1 TYR A 47 11.901 30.397 -27.296 1.00 34.00 H new ATOM 0 HE2 TYR A 47 10.266 27.291 -29.717 1.00 14.20 H new ATOM 0 HH TYR A 47 12.262 28.171 -30.066 1.00 52.42 H new ATOM 725 N GLU A 48 8.713 29.778 -23.488 1.00 10.01 N ATOM 726 CA GLU A 48 9.726 30.418 -22.657 1.00 12.50 C ATOM 727 C GLU A 48 9.904 29.667 -21.341 1.00 1.33 C ATOM 728 O GLU A 48 11.009 29.590 -20.801 1.00 51.34 O ATOM 729 CB GLU A 48 9.343 31.874 -22.379 1.00 24.33 C ATOM 730 CG GLU A 48 9.607 32.807 -23.549 1.00 22.35 C ATOM 731 CD GLU A 48 9.165 34.230 -23.271 1.00 12.23 C ATOM 732 OE1 GLU A 48 7.953 34.509 -23.392 1.00 64.24 O ATOM 733 OE2 GLU A 48 10.029 35.065 -22.932 1.00 1.30 O ATOM 0 H GLU A 48 7.852 30.315 -23.594 1.00 10.01 H new ATOM 0 HA GLU A 48 10.672 30.395 -23.199 1.00 12.50 H new ATOM 0 HB2 GLU A 48 8.285 31.920 -22.120 1.00 24.33 H new ATOM 0 HB3 GLU A 48 9.899 32.228 -21.511 1.00 24.33 H new ATOM 0 HG2 GLU A 48 10.672 32.800 -23.781 1.00 22.35 H new ATOM 0 HG3 GLU A 48 9.086 32.434 -24.431 1.00 22.35 H new ATOM 740 N LEU A 49 8.810 29.115 -20.828 1.00 53.55 N ATOM 741 CA LEU A 49 8.844 28.370 -19.575 1.00 15.32 C ATOM 742 C LEU A 49 9.894 27.265 -19.626 1.00 52.42 C ATOM 743 O LEU A 49 10.832 27.249 -18.829 1.00 25.33 O ATOM 744 CB LEU A 49 7.468 27.769 -19.279 1.00 4.23 C ATOM 745 CG LEU A 49 7.169 27.469 -17.810 1.00 3.15 C ATOM 746 CD1 LEU A 49 7.192 28.749 -16.988 1.00 30.30 C ATOM 747 CD2 LEU A 49 5.826 26.768 -17.671 1.00 53.12 C ATOM 0 H LEU A 49 7.888 29.169 -21.261 1.00 53.55 H new ATOM 0 HA LEU A 49 9.111 29.062 -18.777 1.00 15.32 H new ATOM 0 HB2 LEU A 49 6.707 28.454 -19.651 1.00 4.23 H new ATOM 0 HB3 LEU A 49 7.368 26.843 -19.846 1.00 4.23 H new ATOM 0 HG LEU A 49 7.944 26.804 -17.430 1.00 3.15 H new ATOM 0 HD11 LEU A 49 6.977 28.516 -15.945 1.00 30.30 H new ATOM 0 HD12 LEU A 49 8.177 29.211 -17.061 1.00 30.30 H new ATOM 0 HD13 LEU A 49 6.439 29.439 -17.368 1.00 30.30 H new ATOM 0 HD21 LEU A 49 5.630 26.562 -16.619 1.00 53.12 H new ATOM 0 HD22 LEU A 49 5.038 27.408 -18.068 1.00 53.12 H new ATOM 0 HD23 LEU A 49 5.846 25.830 -18.226 1.00 53.12 H new ATOM 759 N LEU A 50 9.731 26.345 -20.570 1.00 52.11 N ATOM 760 CA LEU A 50 10.666 25.237 -20.728 1.00 24.11 C ATOM 761 C LEU A 50 12.007 25.728 -21.264 1.00 2.21 C ATOM 762 O LEU A 50 13.065 25.253 -20.850 1.00 33.40 O ATOM 763 CB LEU A 50 10.084 24.182 -21.669 1.00 75.45 C ATOM 764 CG LEU A 50 9.450 24.708 -22.958 1.00 1.12 C ATOM 765 CD1 LEU A 50 10.210 24.200 -24.173 1.00 21.51 C ATOM 766 CD2 LEU A 50 7.985 24.304 -23.035 1.00 51.44 C ATOM 0 H LEU A 50 8.960 26.344 -21.238 1.00 52.11 H new ATOM 0 HA LEU A 50 10.829 24.790 -19.747 1.00 24.11 H new ATOM 0 HB2 LEU A 50 10.878 23.485 -21.937 1.00 75.45 H new ATOM 0 HB3 LEU A 50 9.331 23.613 -21.123 1.00 75.45 H new ATOM 0 HG LEU A 50 9.506 25.797 -22.950 1.00 1.12 H new ATOM 0 HD11 LEU A 50 9.744 24.585 -25.080 1.00 21.51 H new ATOM 0 HD12 LEU A 50 11.244 24.540 -24.124 1.00 21.51 H new ATOM 0 HD13 LEU A 50 10.187 23.110 -24.187 1.00 21.51 H new ATOM 0 HD21 LEU A 50 7.550 24.687 -23.958 1.00 51.44 H new ATOM 0 HD22 LEU A 50 7.906 23.217 -23.020 1.00 51.44 H new ATOM 0 HD23 LEU A 50 7.448 24.719 -22.182 1.00 51.44 H new ATOM 778 N TYR A 51 11.956 26.684 -22.185 1.00 74.11 N ATOM 779 CA TYR A 51 13.166 27.240 -22.778 1.00 61.00 C ATOM 780 C TYR A 51 14.114 27.756 -21.699 1.00 73.24 C ATOM 781 O TYR A 51 15.312 27.470 -21.720 1.00 52.44 O ATOM 782 CB TYR A 51 12.812 28.371 -23.745 1.00 42.00 C ATOM 783 CG TYR A 51 13.999 29.219 -24.145 1.00 75.34 C ATOM 784 CD1 TYR A 51 15.210 28.633 -24.493 1.00 54.15 C ATOM 785 CD2 TYR A 51 13.909 30.605 -24.175 1.00 31.22 C ATOM 786 CE1 TYR A 51 16.297 29.403 -24.859 1.00 55.44 C ATOM 787 CE2 TYR A 51 14.990 31.383 -24.541 1.00 20.12 C ATOM 788 CZ TYR A 51 16.182 30.778 -24.882 1.00 34.30 C ATOM 789 OH TYR A 51 17.261 31.549 -25.246 1.00 3.43 O ATOM 0 H TYR A 51 11.089 27.090 -22.537 1.00 74.11 H new ATOM 0 HA TYR A 51 13.669 26.445 -23.328 1.00 61.00 H new ATOM 0 HB2 TYR A 51 12.362 27.944 -24.641 1.00 42.00 H new ATOM 0 HB3 TYR A 51 12.059 29.010 -23.284 1.00 42.00 H new ATOM 0 HD1 TYR A 51 15.303 27.557 -24.477 1.00 54.15 H new ATOM 0 HD2 TYR A 51 12.978 31.082 -23.908 1.00 31.22 H new ATOM 0 HE1 TYR A 51 17.231 28.932 -25.126 1.00 55.44 H new ATOM 0 HE2 TYR A 51 14.903 32.459 -24.560 1.00 20.12 H new ATOM 0 HH TYR A 51 17.013 32.496 -25.211 1.00 3.43 H new ATOM 799 N LEU A 52 13.568 28.517 -20.757 1.00 24.52 N ATOM 800 CA LEU A 52 14.363 29.073 -19.668 1.00 25.04 C ATOM 801 C LEU A 52 14.706 27.999 -18.640 1.00 44.10 C ATOM 802 O LEU A 52 15.734 28.076 -17.965 1.00 71.11 O ATOM 803 CB LEU A 52 13.608 30.219 -18.992 1.00 70.30 C ATOM 804 CG LEU A 52 13.884 31.619 -19.540 1.00 14.53 C ATOM 805 CD1 LEU A 52 13.408 31.733 -20.980 1.00 22.32 C ATOM 806 CD2 LEU A 52 13.213 32.673 -18.670 1.00 44.44 C ATOM 0 H LEU A 52 12.579 28.763 -20.725 1.00 24.52 H new ATOM 0 HA LEU A 52 15.292 29.457 -20.089 1.00 25.04 H new ATOM 0 HB2 LEU A 52 12.539 30.022 -19.075 1.00 70.30 H new ATOM 0 HB3 LEU A 52 13.852 30.212 -17.930 1.00 70.30 H new ATOM 0 HG LEU A 52 14.960 31.790 -19.521 1.00 14.53 H new ATOM 0 HD11 LEU A 52 13.613 32.737 -21.353 1.00 22.32 H new ATOM 0 HD12 LEU A 52 13.933 31.003 -21.596 1.00 22.32 H new ATOM 0 HD13 LEU A 52 12.336 31.541 -21.025 1.00 22.32 H new ATOM 0 HD21 LEU A 52 13.420 33.664 -19.074 1.00 44.44 H new ATOM 0 HD22 LEU A 52 12.136 32.503 -18.658 1.00 44.44 H new ATOM 0 HD23 LEU A 52 13.602 32.607 -17.654 1.00 44.44 H new ATOM 818 N LEU A 53 13.841 26.997 -18.528 1.00 0.53 N ATOM 819 CA LEU A 53 14.053 25.906 -17.584 1.00 30.52 C ATOM 820 C LEU A 53 15.284 25.089 -17.963 1.00 44.21 C ATOM 821 O LEU A 53 16.157 24.843 -17.131 1.00 60.43 O ATOM 822 CB LEU A 53 12.821 25.000 -17.537 1.00 23.33 C ATOM 823 CG LEU A 53 11.950 25.116 -16.285 1.00 64.52 C ATOM 824 CD1 LEU A 53 11.639 26.573 -15.985 1.00 14.41 C ATOM 825 CD2 LEU A 53 10.666 24.317 -16.454 1.00 12.25 C ATOM 0 H LEU A 53 12.986 26.918 -19.079 1.00 0.53 H new ATOM 0 HA LEU A 53 14.217 26.339 -16.597 1.00 30.52 H new ATOM 0 HB2 LEU A 53 12.202 25.217 -18.407 1.00 23.33 H new ATOM 0 HB3 LEU A 53 13.152 23.966 -17.631 1.00 23.33 H new ATOM 0 HG LEU A 53 12.502 24.703 -15.441 1.00 64.52 H new ATOM 0 HD11 LEU A 53 11.018 26.636 -15.091 1.00 14.41 H new ATOM 0 HD12 LEU A 53 12.569 27.117 -15.820 1.00 14.41 H new ATOM 0 HD13 LEU A 53 11.106 27.012 -16.828 1.00 14.41 H new ATOM 0 HD21 LEU A 53 10.058 24.411 -15.554 1.00 12.25 H new ATOM 0 HD22 LEU A 53 10.109 24.700 -17.309 1.00 12.25 H new ATOM 0 HD23 LEU A 53 10.910 23.268 -16.620 1.00 12.25 H new ATOM 837 N GLU A 54 15.348 24.675 -19.225 1.00 1.13 N ATOM 838 CA GLU A 54 16.474 23.888 -19.714 1.00 30.14 C ATOM 839 C GLU A 54 17.778 24.671 -19.594 1.00 41.24 C ATOM 840 O GLU A 54 18.845 24.092 -19.396 1.00 5.00 O ATOM 841 CB GLU A 54 16.244 23.478 -21.170 1.00 30.43 C ATOM 842 CG GLU A 54 16.721 24.511 -22.176 1.00 14.51 C ATOM 843 CD GLU A 54 16.127 24.300 -23.555 1.00 65.23 C ATOM 844 OE1 GLU A 54 14.925 24.583 -23.734 1.00 74.33 O ATOM 845 OE2 GLU A 54 16.867 23.851 -24.456 1.00 43.10 O ATOM 0 H GLU A 54 14.634 24.871 -19.926 1.00 1.13 H new ATOM 0 HA GLU A 54 16.552 22.991 -19.100 1.00 30.14 H new ATOM 0 HB2 GLU A 54 16.758 22.535 -21.359 1.00 30.43 H new ATOM 0 HB3 GLU A 54 15.180 23.298 -21.324 1.00 30.43 H new ATOM 0 HG2 GLU A 54 16.459 25.507 -21.820 1.00 14.51 H new ATOM 0 HG3 GLU A 54 17.808 24.472 -22.243 1.00 14.51 H new ATOM 852 N GLU A 55 17.682 25.991 -19.718 1.00 1.43 N ATOM 853 CA GLU A 55 18.854 26.854 -19.625 1.00 62.22 C ATOM 854 C GLU A 55 19.482 26.772 -18.237 1.00 14.24 C ATOM 855 O GLU A 55 20.696 26.901 -18.084 1.00 12.21 O ATOM 856 CB GLU A 55 18.475 28.302 -19.941 1.00 45.25 C ATOM 857 CG GLU A 55 19.652 29.263 -19.896 1.00 31.20 C ATOM 858 CD GLU A 55 19.340 30.598 -20.543 1.00 40.22 C ATOM 859 OE1 GLU A 55 18.312 30.692 -21.246 1.00 0.03 O ATOM 860 OE2 GLU A 55 20.125 31.550 -20.347 1.00 32.35 O ATOM 0 H GLU A 55 16.805 26.486 -19.883 1.00 1.43 H new ATOM 0 HA GLU A 55 19.585 26.510 -20.356 1.00 62.22 H new ATOM 0 HB2 GLU A 55 18.022 28.342 -20.931 1.00 45.25 H new ATOM 0 HB3 GLU A 55 17.718 28.634 -19.230 1.00 45.25 H new ATOM 0 HG2 GLU A 55 19.944 29.426 -18.858 1.00 31.20 H new ATOM 0 HG3 GLU A 55 20.506 28.810 -20.400 1.00 31.20 H new ATOM 867 N ALA A 56 18.644 26.558 -17.227 1.00 61.21 N ATOM 868 CA ALA A 56 19.116 26.458 -15.852 1.00 34.55 C ATOM 869 C ALA A 56 19.821 25.128 -15.609 1.00 22.44 C ATOM 870 O ALA A 56 20.598 24.989 -14.663 1.00 74.12 O ATOM 871 CB ALA A 56 17.955 26.626 -14.882 1.00 40.22 C ATOM 0 H ALA A 56 17.636 26.451 -17.336 1.00 61.21 H new ATOM 0 HA ALA A 56 19.837 27.258 -15.682 1.00 34.55 H new ATOM 0 HB1 ALA A 56 18.322 26.549 -13.859 1.00 40.22 H new ATOM 0 HB2 ALA A 56 17.496 27.603 -15.030 1.00 40.22 H new ATOM 0 HB3 ALA A 56 17.215 25.846 -15.062 1.00 40.22 H new ATOM 877 N PHE A 57 19.546 24.152 -16.467 1.00 71.44 N ATOM 878 CA PHE A 57 20.153 22.832 -16.345 1.00 23.53 C ATOM 879 C PHE A 57 21.183 22.602 -17.447 1.00 3.20 C ATOM 880 O PHE A 57 21.843 21.563 -17.489 1.00 12.52 O ATOM 881 CB PHE A 57 19.078 21.745 -16.402 1.00 31.40 C ATOM 882 CG PHE A 57 17.825 22.101 -15.655 1.00 13.32 C ATOM 883 CD1 PHE A 57 17.893 22.680 -14.398 1.00 10.03 C ATOM 884 CD2 PHE A 57 16.579 21.858 -16.210 1.00 14.44 C ATOM 885 CE1 PHE A 57 16.741 23.008 -13.708 1.00 3.42 C ATOM 886 CE2 PHE A 57 15.423 22.185 -15.525 1.00 4.05 C ATOM 887 CZ PHE A 57 15.505 22.762 -14.272 1.00 61.23 C ATOM 0 H PHE A 57 18.906 24.250 -17.255 1.00 71.44 H new ATOM 0 HA PHE A 57 20.660 22.782 -15.382 1.00 23.53 H new ATOM 0 HB2 PHE A 57 18.827 21.548 -17.444 1.00 31.40 H new ATOM 0 HB3 PHE A 57 19.485 20.821 -15.992 1.00 31.40 H new ATOM 0 HD1 PHE A 57 18.857 22.877 -13.952 1.00 10.03 H new ATOM 0 HD2 PHE A 57 16.510 21.408 -17.189 1.00 14.44 H new ATOM 0 HE1 PHE A 57 16.808 23.457 -12.728 1.00 3.42 H new ATOM 0 HE2 PHE A 57 14.458 21.990 -15.969 1.00 4.05 H new ATOM 0 HZ PHE A 57 14.604 23.020 -13.735 1.00 61.23 H new ATOM 897 N ASP A 58 21.315 23.579 -18.338 1.00 11.04 N ATOM 898 CA ASP A 58 22.264 23.485 -19.440 1.00 44.35 C ATOM 899 C ASP A 58 22.038 22.210 -20.246 1.00 33.42 C ATOM 900 O ASP A 58 22.811 21.256 -20.148 1.00 52.52 O ATOM 901 CB ASP A 58 23.699 23.521 -18.911 1.00 71.20 C ATOM 902 CG ASP A 58 24.065 24.869 -18.321 1.00 61.53 C ATOM 903 OD1 ASP A 58 24.104 25.858 -19.082 1.00 61.21 O ATOM 904 OD2 ASP A 58 24.314 24.934 -17.099 1.00 33.10 O ATOM 0 H ASP A 58 20.776 24.445 -18.318 1.00 11.04 H new ATOM 0 HA ASP A 58 22.105 24.341 -20.096 1.00 44.35 H new ATOM 0 HB2 ASP A 58 23.822 22.749 -18.151 1.00 71.20 H new ATOM 0 HB3 ASP A 58 24.388 23.283 -19.721 1.00 71.20 H new ATOM 909 N ASP A 59 20.973 22.199 -21.040 1.00 32.12 N ATOM 910 CA ASP A 59 20.644 21.040 -21.862 1.00 51.42 C ATOM 911 C ASP A 59 19.612 21.404 -22.925 1.00 73.11 C ATOM 912 O ASP A 59 18.609 22.057 -22.635 1.00 3.30 O ATOM 913 CB ASP A 59 20.115 19.902 -20.989 1.00 24.43 C ATOM 914 CG ASP A 59 21.146 18.811 -20.774 1.00 30.34 C ATOM 915 OD1 ASP A 59 21.765 18.376 -21.767 1.00 3.11 O ATOM 916 OD2 ASP A 59 21.333 18.391 -19.612 1.00 74.11 O ATOM 0 H ASP A 59 20.323 22.979 -21.132 1.00 32.12 H new ATOM 0 HA ASP A 59 21.554 20.710 -22.362 1.00 51.42 H new ATOM 0 HB2 ASP A 59 19.806 20.302 -20.023 1.00 24.43 H new ATOM 0 HB3 ASP A 59 19.228 19.473 -21.454 1.00 24.43 H new ATOM 921 N LYS A 60 19.864 20.977 -24.158 1.00 10.32 N ATOM 922 CA LYS A 60 18.958 21.257 -25.265 1.00 74.22 C ATOM 923 C LYS A 60 17.646 20.497 -25.100 1.00 34.42 C ATOM 924 O LYS A 60 17.642 19.277 -24.929 1.00 14.12 O ATOM 925 CB LYS A 60 19.613 20.880 -26.596 1.00 24.14 C ATOM 926 CG LYS A 60 20.735 21.818 -27.008 1.00 73.32 C ATOM 927 CD LYS A 60 21.578 21.222 -28.123 1.00 52.34 C ATOM 928 CE LYS A 60 22.743 20.416 -27.571 1.00 61.22 C ATOM 929 NZ LYS A 60 22.411 18.969 -27.455 1.00 34.12 N ATOM 0 H LYS A 60 20.689 20.435 -24.415 1.00 10.32 H new ATOM 0 HA LYS A 60 18.742 22.325 -25.263 1.00 74.22 H new ATOM 0 HB2 LYS A 60 20.006 19.866 -26.524 1.00 24.14 H new ATOM 0 HB3 LYS A 60 18.852 20.872 -27.377 1.00 24.14 H new ATOM 0 HG2 LYS A 60 20.314 22.768 -27.337 1.00 73.32 H new ATOM 0 HG3 LYS A 60 21.368 22.031 -26.146 1.00 73.32 H new ATOM 0 HD2 LYS A 60 20.956 20.582 -28.749 1.00 52.34 H new ATOM 0 HD3 LYS A 60 21.957 22.021 -28.761 1.00 52.34 H new ATOM 0 HE2 LYS A 60 23.610 20.539 -28.221 1.00 61.22 H new ATOM 0 HE3 LYS A 60 23.021 20.804 -26.591 1.00 61.22 H new ATOM 0 HZ1 LYS A 60 22.627 18.639 -26.492 1.00 34.12 H new ATOM 0 HZ2 LYS A 60 21.399 18.828 -27.651 1.00 34.12 H new ATOM 0 HZ3 LYS A 60 22.975 18.427 -28.141 1.00 34.12 H new ATOM 943 N ILE A 61 16.535 21.224 -25.153 1.00 71.21 N ATOM 944 CA ILE A 61 15.217 20.617 -25.012 1.00 24.34 C ATOM 945 C ILE A 61 14.809 19.886 -26.286 1.00 62.22 C ATOM 946 O ILE A 61 14.532 18.686 -26.282 1.00 4.11 O ATOM 947 CB ILE A 61 14.146 21.669 -24.672 1.00 11.55 C ATOM 948 CG1 ILE A 61 14.075 21.886 -23.159 1.00 13.05 C ATOM 949 CG2 ILE A 61 12.791 21.241 -25.215 1.00 41.11 C ATOM 950 CD1 ILE A 61 13.262 20.835 -22.435 1.00 63.12 C ATOM 0 H ILE A 61 16.521 22.234 -25.293 1.00 71.21 H new ATOM 0 HA ILE A 61 15.285 19.902 -24.192 1.00 24.34 H new ATOM 0 HB ILE A 61 14.423 22.612 -25.143 1.00 11.55 H new ATOM 0 HG12 ILE A 61 15.087 21.894 -22.753 1.00 13.05 H new ATOM 0 HG13 ILE A 61 13.644 22.867 -22.961 1.00 13.05 H new ATOM 0 HG21 ILE A 61 12.045 21.995 -24.966 1.00 41.11 H new ATOM 0 HG22 ILE A 61 12.851 21.133 -26.298 1.00 41.11 H new ATOM 0 HG23 ILE A 61 12.505 20.288 -24.770 1.00 41.11 H new ATOM 0 HD11 ILE A 61 13.255 21.052 -21.367 1.00 63.12 H new ATOM 0 HD12 ILE A 61 12.240 20.841 -22.813 1.00 63.12 H new ATOM 0 HD13 ILE A 61 13.705 19.853 -22.603 1.00 63.12 H new ATOM 962 N PRO A 62 14.772 20.624 -27.405 1.00 70.15 N ATOM 963 CA PRO A 62 14.401 20.066 -28.710 1.00 2.35 C ATOM 964 C PRO A 62 15.460 19.115 -29.255 1.00 63.34 C ATOM 965 O PRO A 62 15.286 18.524 -30.321 1.00 5.12 O ATOM 966 CB PRO A 62 14.282 21.303 -29.603 1.00 41.33 C ATOM 967 CG PRO A 62 15.164 22.319 -28.964 1.00 0.34 C ATOM 968 CD PRO A 62 15.090 22.060 -27.484 1.00 75.33 C ATOM 0 HA PRO A 62 13.488 19.473 -28.656 1.00 2.35 H new ATOM 0 HB2 PRO A 62 14.601 21.087 -30.623 1.00 41.33 H new ATOM 0 HB3 PRO A 62 13.251 21.653 -29.659 1.00 41.33 H new ATOM 0 HG2 PRO A 62 16.188 22.229 -29.325 1.00 0.34 H new ATOM 0 HG3 PRO A 62 14.830 23.329 -29.200 1.00 0.34 H new ATOM 0 HD2 PRO A 62 16.033 22.291 -26.988 1.00 75.33 H new ATOM 0 HD3 PRO A 62 14.322 22.669 -27.007 1.00 75.33 H new ATOM 976 N GLU A 63 16.557 18.971 -28.518 1.00 10.12 N ATOM 977 CA GLU A 63 17.644 18.091 -28.930 1.00 31.32 C ATOM 978 C GLU A 63 17.731 16.870 -28.018 1.00 52.10 C ATOM 979 O GLU A 63 17.503 15.741 -28.451 1.00 44.42 O ATOM 980 CB GLU A 63 18.974 18.846 -28.917 1.00 45.12 C ATOM 981 CG GLU A 63 19.934 18.407 -30.010 1.00 63.31 C ATOM 982 CD GLU A 63 19.725 19.162 -31.308 1.00 61.24 C ATOM 983 OE1 GLU A 63 20.310 20.255 -31.459 1.00 61.00 O ATOM 984 OE2 GLU A 63 18.977 18.660 -32.173 1.00 50.32 O ATOM 0 H GLU A 63 16.716 19.452 -27.633 1.00 10.12 H new ATOM 0 HA GLU A 63 17.437 17.751 -29.945 1.00 31.32 H new ATOM 0 HB2 GLU A 63 18.778 19.913 -29.025 1.00 45.12 H new ATOM 0 HB3 GLU A 63 19.452 18.706 -27.947 1.00 45.12 H new ATOM 0 HG2 GLU A 63 20.959 18.555 -29.669 1.00 63.31 H new ATOM 0 HG3 GLU A 63 19.809 17.339 -30.191 1.00 63.31 H new ATOM 991 N ASN A 64 18.062 17.106 -26.753 1.00 3.42 N ATOM 992 CA ASN A 64 18.181 16.027 -25.779 1.00 73.13 C ATOM 993 C ASN A 64 16.805 15.574 -25.299 1.00 62.14 C ATOM 994 O ASN A 64 16.415 14.424 -25.500 1.00 2.21 O ATOM 995 CB ASN A 64 19.026 16.478 -24.587 1.00 2.23 C ATOM 996 CG ASN A 64 20.311 17.162 -25.014 1.00 74.12 C ATOM 997 OD1 ASN A 64 20.965 16.738 -25.967 1.00 23.24 O ATOM 998 ND2 ASN A 64 20.677 18.226 -24.310 1.00 10.25 N ATOM 0 H ASN A 64 18.253 18.035 -26.378 1.00 3.42 H new ATOM 0 HA ASN A 64 18.673 15.185 -26.266 1.00 73.13 H new ATOM 0 HB2 ASN A 64 18.442 17.160 -23.969 1.00 2.23 H new ATOM 0 HB3 ASN A 64 19.266 15.614 -23.968 1.00 2.23 H new ATOM 0 HD21 ASN A 64 21.532 18.728 -24.551 1.00 10.25 H new ATOM 0 HD22 ASN A 64 20.104 18.542 -23.528 1.00 10.25 H new ATOM 1005 N GLU A 65 16.075 16.486 -24.665 1.00 44.45 N ATOM 1006 CA GLU A 65 14.744 16.180 -24.157 1.00 75.11 C ATOM 1007 C GLU A 65 13.828 15.704 -25.282 1.00 0.34 C ATOM 1008 O GLU A 65 12.851 14.996 -25.043 1.00 31.52 O ATOM 1009 CB GLU A 65 14.138 17.409 -23.477 1.00 14.32 C ATOM 1010 CG GLU A 65 15.000 17.974 -22.360 1.00 35.51 C ATOM 1011 CD GLU A 65 15.671 16.891 -21.538 1.00 22.14 C ATOM 1012 OE1 GLU A 65 16.682 16.330 -22.010 1.00 22.44 O ATOM 1013 OE2 GLU A 65 15.186 16.605 -20.423 1.00 63.31 O ATOM 0 H GLU A 65 16.383 17.443 -24.491 1.00 44.45 H new ATOM 0 HA GLU A 65 14.838 15.378 -23.425 1.00 75.11 H new ATOM 0 HB2 GLU A 65 13.974 18.184 -24.226 1.00 14.32 H new ATOM 0 HB3 GLU A 65 13.161 17.145 -23.072 1.00 14.32 H new ATOM 0 HG2 GLU A 65 15.762 18.625 -22.788 1.00 35.51 H new ATOM 0 HG3 GLU A 65 14.383 18.591 -21.707 1.00 35.51 H new ATOM 1020 N ALA A 66 14.152 16.101 -26.508 1.00 22.30 N ATOM 1021 CA ALA A 66 13.361 15.714 -27.670 1.00 11.53 C ATOM 1022 C ALA A 66 13.470 14.217 -27.935 1.00 21.20 C ATOM 1023 O ALA A 66 12.732 13.666 -28.750 1.00 55.12 O ATOM 1024 CB ALA A 66 13.802 16.503 -28.894 1.00 74.11 C ATOM 0 H ALA A 66 14.956 16.690 -26.722 1.00 22.30 H new ATOM 0 HA ALA A 66 12.316 15.943 -27.460 1.00 11.53 H new ATOM 0 HB1 ALA A 66 13.203 16.204 -29.755 1.00 74.11 H new ATOM 0 HB2 ALA A 66 13.665 17.568 -28.709 1.00 74.11 H new ATOM 0 HB3 ALA A 66 14.854 16.302 -29.097 1.00 74.11 H new ATOM 1030 N ASN A 67 14.397 13.564 -27.241 1.00 71.35 N ATOM 1031 CA ASN A 67 14.603 12.129 -27.404 1.00 3.13 C ATOM 1032 C ASN A 67 13.410 11.344 -26.868 1.00 22.23 C ATOM 1033 O ASN A 67 13.250 10.161 -27.166 1.00 35.25 O ATOM 1034 CB ASN A 67 15.881 11.692 -26.684 1.00 32.01 C ATOM 1035 CG ASN A 67 15.641 11.376 -25.220 1.00 55.23 C ATOM 1036 OD1 ASN A 67 16.033 10.317 -24.730 1.00 12.33 O ATOM 1037 ND2 ASN A 67 14.992 12.296 -24.515 1.00 45.33 N ATOM 0 H ASN A 67 15.017 14.005 -26.561 1.00 71.35 H new ATOM 0 HA ASN A 67 14.704 11.920 -28.469 1.00 3.13 H new ATOM 0 HB2 ASN A 67 16.292 10.813 -27.180 1.00 32.01 H new ATOM 0 HB3 ASN A 67 16.628 12.481 -26.765 1.00 32.01 H new ATOM 0 HD21 ASN A 67 14.800 12.139 -23.526 1.00 45.33 H new ATOM 0 HD22 ASN A 67 14.686 13.160 -24.963 1.00 45.33 H new ATOM 1044 N GLU A 68 12.577 12.011 -26.076 1.00 55.41 N ATOM 1045 CA GLU A 68 11.398 11.375 -25.499 1.00 3.33 C ATOM 1046 C GLU A 68 10.370 12.419 -25.072 1.00 5.32 C ATOM 1047 O GLU A 68 9.735 12.289 -24.025 1.00 41.52 O ATOM 1048 CB GLU A 68 11.794 10.512 -24.299 1.00 13.34 C ATOM 1049 CG GLU A 68 10.907 9.294 -24.107 1.00 33.35 C ATOM 1050 CD GLU A 68 11.252 8.165 -25.059 1.00 15.21 C ATOM 1051 OE1 GLU A 68 11.350 8.425 -26.276 1.00 60.33 O ATOM 1052 OE2 GLU A 68 11.423 7.022 -24.586 1.00 1.12 O ATOM 0 H GLU A 68 12.696 12.991 -25.819 1.00 55.41 H new ATOM 0 HA GLU A 68 10.949 10.740 -26.262 1.00 3.33 H new ATOM 0 HB2 GLU A 68 12.826 10.184 -24.423 1.00 13.34 H new ATOM 0 HB3 GLU A 68 11.760 11.122 -23.396 1.00 13.34 H new ATOM 0 HG2 GLU A 68 11.000 8.940 -23.080 1.00 33.35 H new ATOM 0 HG3 GLU A 68 9.866 9.581 -24.252 1.00 33.35 H new ATOM 1059 N PHE A 69 10.213 13.455 -25.889 1.00 62.04 N ATOM 1060 CA PHE A 69 9.264 14.523 -25.597 1.00 23.13 C ATOM 1061 C PHE A 69 8.014 14.391 -26.461 1.00 53.20 C ATOM 1062 O PHE A 69 8.083 13.946 -27.606 1.00 33.31 O ATOM 1063 CB PHE A 69 9.915 15.889 -25.826 1.00 34.24 C ATOM 1064 CG PHE A 69 9.774 16.823 -24.658 1.00 31.01 C ATOM 1065 CD1 PHE A 69 9.969 16.369 -23.363 1.00 51.34 C ATOM 1066 CD2 PHE A 69 9.446 18.155 -24.855 1.00 21.21 C ATOM 1067 CE1 PHE A 69 9.841 17.226 -22.287 1.00 15.44 C ATOM 1068 CE2 PHE A 69 9.317 19.017 -23.782 1.00 72.52 C ATOM 1069 CZ PHE A 69 9.513 18.552 -22.496 1.00 60.44 C ATOM 0 H PHE A 69 10.731 13.578 -26.759 1.00 62.04 H new ATOM 0 HA PHE A 69 8.971 14.439 -24.551 1.00 23.13 H new ATOM 0 HB2 PHE A 69 10.974 15.746 -26.041 1.00 34.24 H new ATOM 0 HB3 PHE A 69 9.470 16.352 -26.707 1.00 34.24 H new ATOM 0 HD1 PHE A 69 10.224 15.333 -23.193 1.00 51.34 H new ATOM 0 HD2 PHE A 69 9.289 18.524 -25.858 1.00 21.21 H new ATOM 0 HE1 PHE A 69 9.997 16.860 -21.283 1.00 15.44 H new ATOM 0 HE2 PHE A 69 9.063 20.053 -23.949 1.00 72.52 H new ATOM 0 HZ PHE A 69 9.410 19.223 -21.656 1.00 60.44 H new ATOM 1079 N GLU A 70 6.872 14.782 -25.903 1.00 60.30 N ATOM 1080 CA GLU A 70 5.606 14.706 -26.622 1.00 72.12 C ATOM 1081 C GLU A 70 4.586 15.676 -26.033 1.00 4.51 C ATOM 1082 O GLU A 70 4.153 16.619 -26.696 1.00 41.32 O ATOM 1083 CB GLU A 70 5.053 13.280 -26.578 1.00 23.30 C ATOM 1084 CG GLU A 70 3.792 13.090 -27.404 1.00 63.41 C ATOM 1085 CD GLU A 70 3.390 11.633 -27.527 1.00 72.24 C ATOM 1086 OE1 GLU A 70 3.179 10.986 -26.480 1.00 61.53 O ATOM 1087 OE2 GLU A 70 3.286 11.140 -28.670 1.00 13.10 O ATOM 0 H GLU A 70 6.798 15.154 -24.956 1.00 60.30 H new ATOM 0 HA GLU A 70 5.791 14.985 -27.659 1.00 72.12 H new ATOM 0 HB2 GLU A 70 5.819 12.591 -26.936 1.00 23.30 H new ATOM 0 HB3 GLU A 70 4.842 13.013 -25.542 1.00 23.30 H new ATOM 0 HG2 GLU A 70 2.976 13.651 -26.949 1.00 63.41 H new ATOM 0 HG3 GLU A 70 3.948 13.505 -28.400 1.00 63.41 H new ATOM 1094 N THR A 71 4.206 15.439 -24.781 1.00 62.43 N ATOM 1095 CA THR A 71 3.237 16.289 -24.102 1.00 50.12 C ATOM 1096 C THR A 71 3.660 16.564 -22.664 1.00 12.43 C ATOM 1097 O THR A 71 4.724 16.129 -22.225 1.00 3.03 O ATOM 1098 CB THR A 71 1.835 15.652 -24.100 1.00 74.11 C ATOM 1099 OG1 THR A 71 1.905 14.315 -23.592 1.00 13.01 O ATOM 1100 CG2 THR A 71 1.245 15.637 -25.502 1.00 60.43 C ATOM 0 H THR A 71 4.555 14.664 -24.217 1.00 62.43 H new ATOM 0 HA THR A 71 3.200 17.229 -24.653 1.00 50.12 H new ATOM 0 HB THR A 71 1.189 16.251 -23.458 1.00 74.11 H new ATOM 0 HG1 THR A 71 1.742 13.680 -24.320 1.00 13.01 H new ATOM 0 HG21 THR A 71 0.255 15.182 -25.475 1.00 60.43 H new ATOM 0 HG22 THR A 71 1.165 16.658 -25.874 1.00 60.43 H new ATOM 0 HG23 THR A 71 1.892 15.059 -26.163 1.00 60.43 H new ATOM 1108 N VAL A 72 2.819 17.290 -21.933 1.00 72.40 N ATOM 1109 CA VAL A 72 3.105 17.622 -20.542 1.00 72.54 C ATOM 1110 C VAL A 72 3.509 16.381 -19.753 1.00 55.22 C ATOM 1111 O VAL A 72 4.452 16.414 -18.965 1.00 4.11 O ATOM 1112 CB VAL A 72 1.889 18.277 -19.861 1.00 5.45 C ATOM 1113 CG1 VAL A 72 2.250 18.742 -18.458 1.00 3.22 C ATOM 1114 CG2 VAL A 72 1.370 19.436 -20.698 1.00 44.40 C ATOM 0 H VAL A 72 1.934 17.659 -22.281 1.00 72.40 H new ATOM 0 HA VAL A 72 3.934 18.330 -20.549 1.00 72.54 H new ATOM 0 HB VAL A 72 1.096 17.534 -19.780 1.00 5.45 H new ATOM 0 HG11 VAL A 72 1.379 19.202 -17.992 1.00 3.22 H new ATOM 0 HG12 VAL A 72 2.571 17.887 -17.863 1.00 3.22 H new ATOM 0 HG13 VAL A 72 3.059 19.470 -18.513 1.00 3.22 H new ATOM 0 HG21 VAL A 72 0.511 19.887 -20.202 1.00 44.40 H new ATOM 0 HG22 VAL A 72 2.156 20.183 -20.813 1.00 44.40 H new ATOM 0 HG23 VAL A 72 1.071 19.070 -21.680 1.00 44.40 H new ATOM 1124 N GLY A 73 2.786 15.286 -19.972 1.00 3.35 N ATOM 1125 CA GLY A 73 3.085 14.049 -19.274 1.00 14.55 C ATOM 1126 C GLY A 73 4.549 13.669 -19.367 1.00 51.35 C ATOM 1127 O GLY A 73 5.122 13.140 -18.415 1.00 62.02 O ATOM 0 H GLY A 73 2.000 15.234 -20.620 1.00 3.35 H new ATOM 0 HA2 GLY A 73 2.805 14.151 -18.225 1.00 14.55 H new ATOM 0 HA3 GLY A 73 2.477 13.245 -19.690 1.00 14.55 H new ATOM 1131 N ASP A 74 5.155 13.938 -20.518 1.00 64.14 N ATOM 1132 CA ASP A 74 6.562 13.620 -20.734 1.00 23.12 C ATOM 1133 C ASP A 74 7.458 14.510 -19.878 1.00 12.21 C ATOM 1134 O ASP A 74 8.519 14.085 -19.420 1.00 74.12 O ATOM 1135 CB ASP A 74 6.923 13.782 -22.211 1.00 64.12 C ATOM 1136 CG ASP A 74 6.220 12.769 -23.093 1.00 41.25 C ATOM 1137 OD1 ASP A 74 5.010 12.540 -22.886 1.00 21.45 O ATOM 1138 OD2 ASP A 74 6.879 12.207 -23.992 1.00 45.04 O ATOM 0 H ASP A 74 4.694 14.375 -21.316 1.00 64.14 H new ATOM 0 HA ASP A 74 6.723 12.583 -20.440 1.00 23.12 H new ATOM 0 HB2 ASP A 74 6.661 14.788 -22.538 1.00 64.12 H new ATOM 0 HB3 ASP A 74 8.001 13.679 -22.332 1.00 64.12 H new ATOM 1143 N VAL A 75 7.024 15.749 -19.666 1.00 71.24 N ATOM 1144 CA VAL A 75 7.786 16.700 -18.866 1.00 31.53 C ATOM 1145 C VAL A 75 7.654 16.395 -17.378 1.00 30.12 C ATOM 1146 O VAL A 75 8.633 16.448 -16.633 1.00 33.11 O ATOM 1147 CB VAL A 75 7.327 18.147 -19.125 1.00 33.31 C ATOM 1148 CG1 VAL A 75 8.405 19.133 -18.703 1.00 30.01 C ATOM 1149 CG2 VAL A 75 6.964 18.336 -20.590 1.00 73.40 C ATOM 0 H VAL A 75 6.148 16.117 -20.038 1.00 71.24 H new ATOM 0 HA VAL A 75 8.830 16.600 -19.164 1.00 31.53 H new ATOM 0 HB VAL A 75 6.437 18.340 -18.526 1.00 33.31 H new ATOM 0 HG11 VAL A 75 8.063 20.150 -18.894 1.00 30.01 H new ATOM 0 HG12 VAL A 75 8.612 19.013 -17.640 1.00 30.01 H new ATOM 0 HG13 VAL A 75 9.315 18.944 -19.273 1.00 30.01 H new ATOM 0 HG21 VAL A 75 6.642 19.364 -20.755 1.00 73.40 H new ATOM 0 HG22 VAL A 75 7.835 18.124 -21.211 1.00 73.40 H new ATOM 0 HG23 VAL A 75 6.155 17.655 -20.855 1.00 73.40 H new ATOM 1159 N VAL A 76 6.437 16.075 -16.950 1.00 74.15 N ATOM 1160 CA VAL A 76 6.176 15.760 -15.551 1.00 72.30 C ATOM 1161 C VAL A 76 7.102 14.655 -15.055 1.00 35.41 C ATOM 1162 O VAL A 76 7.735 14.785 -14.009 1.00 4.22 O ATOM 1163 CB VAL A 76 4.714 15.325 -15.337 1.00 30.54 C ATOM 1164 CG1 VAL A 76 4.474 14.957 -13.880 1.00 41.42 C ATOM 1165 CG2 VAL A 76 3.761 16.423 -15.782 1.00 53.21 C ATOM 0 H VAL A 76 5.616 16.027 -17.553 1.00 74.15 H new ATOM 0 HA VAL A 76 6.363 16.670 -14.981 1.00 72.30 H new ATOM 0 HB VAL A 76 4.523 14.441 -15.946 1.00 30.54 H new ATOM 0 HG11 VAL A 76 3.436 14.652 -13.748 1.00 41.42 H new ATOM 0 HG12 VAL A 76 5.132 14.135 -13.599 1.00 41.42 H new ATOM 0 HG13 VAL A 76 4.682 15.820 -13.248 1.00 41.42 H new ATOM 0 HG21 VAL A 76 2.733 16.098 -15.624 1.00 53.21 H new ATOM 0 HG22 VAL A 76 3.950 17.326 -15.202 1.00 53.21 H new ATOM 0 HG23 VAL A 76 3.916 16.633 -16.840 1.00 53.21 H new ATOM 1175 N ASN A 77 7.174 13.566 -15.814 1.00 44.11 N ATOM 1176 CA ASN A 77 8.023 12.437 -15.452 1.00 22.15 C ATOM 1177 C ASN A 77 9.494 12.761 -15.697 1.00 12.03 C ATOM 1178 O ASN A 77 10.383 12.143 -15.111 1.00 31.12 O ATOM 1179 CB ASN A 77 7.623 11.194 -16.250 1.00 3.51 C ATOM 1180 CG ASN A 77 8.434 11.039 -17.522 1.00 23.32 C ATOM 1181 OD1 ASN A 77 9.592 10.621 -17.486 1.00 11.11 O ATOM 1182 ND2 ASN A 77 7.828 11.375 -18.655 1.00 5.24 N ATOM 0 H ASN A 77 6.655 13.442 -16.683 1.00 44.11 H new ATOM 0 HA ASN A 77 7.886 12.238 -14.389 1.00 22.15 H new ATOM 0 HB2 ASN A 77 7.754 10.308 -15.628 1.00 3.51 H new ATOM 0 HB3 ASN A 77 6.564 11.252 -16.502 1.00 3.51 H new ATOM 0 HD21 ASN A 77 8.323 11.291 -19.543 1.00 5.24 H new ATOM 0 HD22 ASN A 77 6.867 11.717 -18.638 1.00 5.24 H new ATOM 1189 N PHE A 78 9.742 13.735 -16.566 1.00 24.10 N ATOM 1190 CA PHE A 78 11.105 14.142 -16.889 1.00 70.54 C ATOM 1191 C PHE A 78 11.756 14.852 -15.706 1.00 71.11 C ATOM 1192 O PHE A 78 12.762 14.389 -15.167 1.00 74.44 O ATOM 1193 CB PHE A 78 11.109 15.058 -18.114 1.00 41.53 C ATOM 1194 CG PHE A 78 11.716 14.426 -19.334 1.00 51.42 C ATOM 1195 CD1 PHE A 78 11.243 13.215 -19.811 1.00 32.41 C ATOM 1196 CD2 PHE A 78 12.760 15.044 -20.004 1.00 12.10 C ATOM 1197 CE1 PHE A 78 11.799 12.630 -20.933 1.00 53.45 C ATOM 1198 CE2 PHE A 78 13.319 14.465 -21.127 1.00 64.12 C ATOM 1199 CZ PHE A 78 12.839 13.256 -21.592 1.00 1.12 C ATOM 0 H PHE A 78 9.018 14.257 -17.059 1.00 24.10 H new ATOM 0 HA PHE A 78 11.682 13.245 -17.113 1.00 70.54 H new ATOM 0 HB2 PHE A 78 10.084 15.354 -18.340 1.00 41.53 H new ATOM 0 HB3 PHE A 78 11.658 15.969 -17.875 1.00 41.53 H new ATOM 0 HD1 PHE A 78 10.430 12.722 -19.300 1.00 32.41 H new ATOM 0 HD2 PHE A 78 13.141 15.988 -19.644 1.00 12.10 H new ATOM 0 HE1 PHE A 78 11.421 11.685 -21.294 1.00 53.45 H new ATOM 0 HE2 PHE A 78 14.131 14.957 -21.641 1.00 64.12 H new ATOM 0 HZ PHE A 78 13.276 12.801 -22.469 1.00 1.12 H new ATOM 1209 N ILE A 79 11.175 15.979 -15.308 1.00 62.30 N ATOM 1210 CA ILE A 79 11.698 16.753 -14.189 1.00 32.21 C ATOM 1211 C ILE A 79 11.611 15.964 -12.887 1.00 25.21 C ATOM 1212 O ILE A 79 12.335 16.241 -11.930 1.00 44.34 O ATOM 1213 CB ILE A 79 10.939 18.083 -14.021 1.00 63.34 C ATOM 1214 CG1 ILE A 79 10.844 18.813 -15.363 1.00 1.14 C ATOM 1215 CG2 ILE A 79 11.627 18.957 -12.983 1.00 54.35 C ATOM 1216 CD1 ILE A 79 10.269 20.208 -15.252 1.00 34.44 C ATOM 0 H ILE A 79 10.343 16.376 -15.744 1.00 62.30 H new ATOM 0 HA ILE A 79 12.743 16.966 -14.414 1.00 32.21 H new ATOM 0 HB ILE A 79 9.929 17.868 -13.674 1.00 63.34 H new ATOM 0 HG12 ILE A 79 11.838 18.873 -15.806 1.00 1.14 H new ATOM 0 HG13 ILE A 79 10.226 18.227 -16.043 1.00 1.14 H new ATOM 0 HG21 ILE A 79 11.079 19.893 -12.875 1.00 54.35 H new ATOM 0 HG22 ILE A 79 11.648 18.437 -12.025 1.00 54.35 H new ATOM 0 HG23 ILE A 79 12.647 19.168 -13.304 1.00 54.35 H new ATOM 0 HD11 ILE A 79 10.231 20.666 -16.241 1.00 34.44 H new ATOM 0 HD12 ILE A 79 9.262 20.155 -14.838 1.00 34.44 H new ATOM 0 HD13 ILE A 79 10.899 20.810 -14.597 1.00 34.44 H new ATOM 1228 N LYS A 80 10.722 14.977 -12.857 1.00 41.13 N ATOM 1229 CA LYS A 80 10.542 14.144 -11.674 1.00 51.03 C ATOM 1230 C LYS A 80 11.818 13.373 -11.352 1.00 61.02 C ATOM 1231 O LYS A 80 12.324 13.430 -10.231 1.00 61.23 O ATOM 1232 CB LYS A 80 9.383 13.167 -11.885 1.00 13.32 C ATOM 1233 CG LYS A 80 8.072 13.640 -11.281 1.00 54.42 C ATOM 1234 CD LYS A 80 6.892 12.850 -11.821 1.00 72.42 C ATOM 1235 CE LYS A 80 7.036 11.364 -11.530 1.00 23.24 C ATOM 1236 NZ LYS A 80 7.264 11.102 -10.081 1.00 44.45 N ATOM 0 H LYS A 80 10.114 14.734 -13.639 1.00 41.13 H new ATOM 0 HA LYS A 80 10.311 14.797 -10.832 1.00 51.03 H new ATOM 0 HB2 LYS A 80 9.244 13.007 -12.954 1.00 13.32 H new ATOM 0 HB3 LYS A 80 9.647 12.203 -11.450 1.00 13.32 H new ATOM 0 HG2 LYS A 80 8.113 13.539 -10.196 1.00 54.42 H new ATOM 0 HG3 LYS A 80 7.932 14.699 -11.498 1.00 54.42 H new ATOM 0 HD2 LYS A 80 5.969 13.221 -11.375 1.00 72.42 H new ATOM 0 HD3 LYS A 80 6.811 13.005 -12.897 1.00 72.42 H new ATOM 0 HE2 LYS A 80 6.137 10.841 -11.857 1.00 23.24 H new ATOM 0 HE3 LYS A 80 7.867 10.960 -12.107 1.00 23.24 H new ATOM 0 HZ1 LYS A 80 8.142 10.558 -9.961 1.00 44.45 H new ATOM 0 HZ2 LYS A 80 7.345 12.006 -9.573 1.00 44.45 H new ATOM 0 HZ3 LYS A 80 6.465 10.559 -9.696 1.00 44.45 H new ATOM 1250 N LYS A 81 12.335 12.653 -12.342 1.00 50.55 N ATOM 1251 CA LYS A 81 13.554 11.873 -12.166 1.00 71.13 C ATOM 1252 C LYS A 81 14.789 12.760 -12.279 1.00 3.54 C ATOM 1253 O LYS A 81 15.804 12.513 -11.628 1.00 24.44 O ATOM 1254 CB LYS A 81 13.621 10.753 -13.207 1.00 24.33 C ATOM 1255 CG LYS A 81 13.568 11.250 -14.641 1.00 1.32 C ATOM 1256 CD LYS A 81 14.960 11.391 -15.234 1.00 52.42 C ATOM 1257 CE LYS A 81 14.915 12.028 -16.615 1.00 61.30 C ATOM 1258 NZ LYS A 81 16.204 11.865 -17.343 1.00 2.35 N ATOM 0 H LYS A 81 11.928 12.594 -13.275 1.00 50.55 H new ATOM 0 HA LYS A 81 13.534 11.434 -11.168 1.00 71.13 H new ATOM 0 HB2 LYS A 81 14.542 10.188 -13.061 1.00 24.33 H new ATOM 0 HB3 LYS A 81 12.794 10.063 -13.040 1.00 24.33 H new ATOM 0 HG2 LYS A 81 12.982 10.558 -15.246 1.00 1.32 H new ATOM 0 HG3 LYS A 81 13.058 12.213 -14.675 1.00 1.32 H new ATOM 0 HD2 LYS A 81 15.579 11.997 -14.572 1.00 52.42 H new ATOM 0 HD3 LYS A 81 15.430 10.410 -15.300 1.00 52.42 H new ATOM 0 HE2 LYS A 81 14.110 11.578 -17.196 1.00 61.30 H new ATOM 0 HE3 LYS A 81 14.684 13.089 -16.518 1.00 61.30 H new ATOM 0 HZ1 LYS A 81 16.133 12.312 -18.279 1.00 2.35 H new ATOM 0 HZ2 LYS A 81 16.968 12.316 -16.801 1.00 2.35 H new ATOM 0 HZ3 LYS A 81 16.412 10.853 -17.458 1.00 2.35 H new ATOM 1272 N ARG A 82 14.695 13.796 -13.107 1.00 24.42 N ATOM 1273 CA ARG A 82 15.806 14.720 -13.303 1.00 73.15 C ATOM 1274 C ARG A 82 16.169 15.419 -11.997 1.00 10.03 C ATOM 1275 O ARG A 82 17.344 15.541 -11.651 1.00 23.01 O ATOM 1276 CB ARG A 82 15.450 15.759 -14.368 1.00 73.14 C ATOM 1277 CG ARG A 82 16.031 15.451 -15.738 1.00 63.34 C ATOM 1278 CD ARG A 82 15.029 15.736 -16.846 1.00 61.20 C ATOM 1279 NE ARG A 82 14.441 17.067 -16.723 1.00 2.01 N ATOM 1280 CZ ARG A 82 15.046 18.178 -17.129 1.00 21.13 C ATOM 1281 NH1 ARG A 82 16.250 18.117 -17.681 1.00 51.31 N ATOM 1282 NH2 ARG A 82 14.447 19.353 -16.983 1.00 35.54 N ATOM 0 H ARG A 82 13.862 14.016 -13.652 1.00 24.42 H new ATOM 0 HA ARG A 82 16.669 14.145 -13.639 1.00 73.15 H new ATOM 0 HB2 ARG A 82 14.365 15.826 -14.450 1.00 73.14 H new ATOM 0 HB3 ARG A 82 15.806 16.737 -14.043 1.00 73.14 H new ATOM 0 HG2 ARG A 82 16.929 16.048 -15.896 1.00 63.34 H new ATOM 0 HG3 ARG A 82 16.333 14.404 -15.779 1.00 63.34 H new ATOM 0 HD2 ARG A 82 15.523 15.646 -17.813 1.00 61.20 H new ATOM 0 HD3 ARG A 82 14.238 14.987 -16.821 1.00 61.20 H new ATOM 0 HE ARG A 82 13.515 17.148 -16.302 1.00 2.01 H new ATOM 0 HH11 ARG A 82 16.714 17.216 -17.795 1.00 51.31 H new ATOM 0 HH12 ARG A 82 16.712 18.971 -17.992 1.00 51.31 H new ATOM 0 HH21 ARG A 82 13.521 19.404 -16.559 1.00 35.54 H new ATOM 0 HH22 ARG A 82 14.913 20.205 -17.295 1.00 35.54 H new ATOM 1296 N LYS A 83 15.152 15.877 -11.274 1.00 42.35 N ATOM 1297 CA LYS A 83 15.363 16.564 -10.005 1.00 74.15 C ATOM 1298 C LYS A 83 15.418 15.569 -8.851 1.00 32.50 C ATOM 1299 O LYS A 83 16.301 15.642 -7.997 1.00 73.43 O ATOM 1300 CB LYS A 83 14.247 17.582 -9.762 1.00 14.32 C ATOM 1301 CG LYS A 83 14.339 18.810 -10.651 1.00 1.32 C ATOM 1302 CD LYS A 83 13.696 20.022 -9.997 1.00 22.11 C ATOM 1303 CE LYS A 83 14.688 20.777 -9.125 1.00 61.23 C ATOM 1304 NZ LYS A 83 15.457 21.786 -9.906 1.00 34.32 N ATOM 0 H LYS A 83 14.173 15.785 -11.546 1.00 42.35 H new ATOM 0 HA LYS A 83 16.318 17.086 -10.057 1.00 74.15 H new ATOM 0 HB2 LYS A 83 13.284 17.098 -9.924 1.00 14.32 H new ATOM 0 HB3 LYS A 83 14.274 17.896 -8.719 1.00 14.32 H new ATOM 0 HG2 LYS A 83 15.385 19.025 -10.869 1.00 1.32 H new ATOM 0 HG3 LYS A 83 13.850 18.608 -11.604 1.00 1.32 H new ATOM 0 HD2 LYS A 83 13.306 20.688 -10.767 1.00 22.11 H new ATOM 0 HD3 LYS A 83 12.847 19.703 -9.392 1.00 22.11 H new ATOM 0 HE2 LYS A 83 14.154 21.274 -8.315 1.00 61.23 H new ATOM 0 HE3 LYS A 83 15.379 20.070 -8.665 1.00 61.23 H new ATOM 0 HZ1 LYS A 83 16.122 22.279 -9.276 1.00 34.32 H new ATOM 0 HZ2 LYS A 83 15.986 21.309 -10.663 1.00 34.32 H new ATOM 0 HZ3 LYS A 83 14.800 22.476 -10.324 1.00 34.32 H new ATOM 1318 N GLY A 84 14.469 14.637 -8.832 1.00 51.32 N ATOM 1319 CA GLY A 84 14.429 13.640 -7.779 1.00 21.12 C ATOM 1320 C GLY A 84 14.997 12.306 -8.222 1.00 11.04 C ATOM 1321 O GLY A 84 16.160 12.219 -8.614 1.00 63.23 O ATOM 0 H GLY A 84 13.727 14.555 -9.528 1.00 51.32 H new ATOM 0 HA2 GLY A 84 14.991 14.003 -6.918 1.00 21.12 H new ATOM 0 HA3 GLY A 84 13.398 13.502 -7.452 1.00 21.12 H new TER 1325 GLY A 84