USER MOD reduce.3.24.130724 H: found=0, std=0, add=832, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 832 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 97 TYR OH : rot 180:sc= -0.951 USER MOD Set 1.2: A 108 LYS NZ :NH3+ 162:sc= -1.07 (180deg=-1.75!) USER MOD Set 2.1: A 70 THR OG1 : rot -31:sc= -4.5! USER MOD Set 2.2: A 92 SER OG : rot 72:sc= 0.962! USER MOD Set 3.1: A 13 TYR OH : rot 82:sc= -0.469! USER MOD Set 3.2: A 19 LYS NZ :NH3+ -123:sc= 0.136! (180deg=-2.9!) USER MOD Single : A 5 ASN : amide:sc= -0.0303 K(o=-0.03,f=-6.5!) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 GLN : amide:sc= 1.02 K(o=1,f=-1.3) USER MOD Single : A 16 THR OG1 : rot 100:sc= 1.19 USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 HIS : no HE2:sc= -0.58! C(o=-0.58!,f=-11!) USER MOD Single : A 23 ASN : amide:sc= -7.37! C(o=-7.4!,f=-10!) USER MOD Single : A 24 TYR OH : rot -38:sc= 0.786 USER MOD Single : A 26 THR OG1 : rot 160:sc= -1.63 USER MOD Single : A 27 LYS NZ :NH3+ -121:sc= -4.73! (180deg=-6.24!) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 31 GLN : amide:sc= -1.04 K(o=-1,f=-5.5!) USER MOD Single : A 38 SER OG : rot 65:sc= 1.13 USER MOD Single : A 39 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0111) USER MOD Single : A 41 ASN : amide:sc= -1.27! C(o=-1.3!,f=-12!) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 SER OG : rot 180:sc= -0.04 USER MOD Single : A 57 SER OG : rot 56:sc= -2.65! USER MOD Single : A 58 ASN : amide:sc= -2.12! C(o=-2.1!,f=-9.3!) USER MOD Single : A 62 LYS NZ :NH3+ 155:sc= 0.917! (180deg=-0.159!) USER MOD Single : A 66 LYS NZ :NH3+ -172:sc= 0.975 (180deg=0.82) USER MOD Single : A 67 SER OG : rot 60:sc= 0.842 USER MOD Single : A 77 ASN : amide:sc= -3.87! C(o=-3.9!,f=-4.2!) USER MOD Single : A 78 TYR OH : rot -166:sc= -0.11 USER MOD Single : A 79 THR OG1 : rot 117:sc= -0.369! USER MOD Single : A 80 SER OG : rot -70:sc= 1.05 USER MOD Single : A 84 ASN : amide:sc= -0.64 K(o=-0.64,f=-13!) USER MOD Single : A 85 SER OG : rot 141:sc= 0.701 USER MOD Single : A 90 TYR OH : rot 30:sc= 0.666 USER MOD Single : A 91 SER OG : rot 162:sc= 0.616 USER MOD Single : A 98 LYS NZ :NH3+ -122:sc= -1.1 (180deg=-1.62!) USER MOD Single : A 99 THR OG1 : rot 56:sc= 1.31 USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 TYR OH : rot -25:sc= 1.14 USER MOD Single : A 104 GLN : amide:sc= -0.208 K(o=-0.21,f=-3.1!) USER MOD Single : A 105 THR OG1 : rot -71:sc= 0.662! USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 3 15.672 49.755 12.049 1.00 0.00 N ATOM 2 CA VAL A 3 14.960 48.800 11.153 1.00 0.00 C ATOM 3 C VAL A 3 15.983 48.061 10.278 1.00 0.00 C ATOM 4 O VAL A 3 15.897 48.069 9.066 1.00 0.00 O ATOM 5 CB VAL A 3 13.942 49.568 10.280 1.00 0.00 C ATOM 6 CG1 VAL A 3 12.897 48.597 9.714 1.00 0.00 C ATOM 7 CG2 VAL A 3 13.216 50.618 11.132 1.00 0.00 C ATOM 0 HA VAL A 3 14.418 48.066 11.749 1.00 0.00 H new ATOM 0 HB VAL A 3 14.480 50.052 9.464 1.00 0.00 H new ATOM 0 HG11 VAL A 3 12.184 49.147 9.100 1.00 0.00 H new ATOM 0 HG12 VAL A 3 13.394 47.842 9.104 1.00 0.00 H new ATOM 0 HG13 VAL A 3 12.370 48.111 10.535 1.00 0.00 H new ATOM 0 HG21 VAL A 3 12.499 51.157 10.512 1.00 0.00 H new ATOM 0 HG22 VAL A 3 12.690 50.123 11.949 1.00 0.00 H new ATOM 0 HG23 VAL A 3 13.942 51.320 11.541 1.00 0.00 H new ATOM 17 N ILE A 4 16.936 47.391 10.889 1.00 0.00 N ATOM 18 CA ILE A 4 17.964 46.634 10.101 1.00 0.00 C ATOM 19 C ILE A 4 18.218 45.274 10.774 1.00 0.00 C ATOM 20 O ILE A 4 18.085 45.138 11.975 1.00 0.00 O ATOM 21 CB ILE A 4 19.279 47.440 10.058 1.00 0.00 C ATOM 22 CG1 ILE A 4 19.097 48.721 9.234 1.00 0.00 C ATOM 23 CG2 ILE A 4 20.375 46.592 9.403 1.00 0.00 C ATOM 24 CD1 ILE A 4 19.730 49.907 9.974 1.00 0.00 C ATOM 0 H ILE A 4 17.045 47.336 11.902 1.00 0.00 H new ATOM 0 HA ILE A 4 17.603 46.479 9.084 1.00 0.00 H new ATOM 0 HB ILE A 4 19.558 47.702 11.079 1.00 0.00 H new ATOM 0 HG12 ILE A 4 19.559 48.603 8.254 1.00 0.00 H new ATOM 0 HG13 ILE A 4 18.037 48.909 9.066 1.00 0.00 H new ATOM 0 HG21 ILE A 4 21.305 47.160 9.372 1.00 0.00 H new ATOM 0 HG22 ILE A 4 20.525 45.681 9.983 1.00 0.00 H new ATOM 0 HG23 ILE A 4 20.075 46.331 8.388 1.00 0.00 H new ATOM 0 HD11 ILE A 4 19.599 50.815 9.386 1.00 0.00 H new ATOM 0 HD12 ILE A 4 19.248 50.030 10.944 1.00 0.00 H new ATOM 0 HD13 ILE A 4 20.794 49.719 10.119 1.00 0.00 H new ATOM 36 N ASN A 5 18.591 44.274 10.019 1.00 0.00 N ATOM 37 CA ASN A 5 18.852 42.931 10.632 1.00 0.00 C ATOM 38 C ASN A 5 19.933 42.196 9.840 1.00 0.00 C ATOM 39 O ASN A 5 19.866 40.988 9.672 1.00 0.00 O ATOM 40 CB ASN A 5 17.556 42.116 10.589 1.00 0.00 C ATOM 41 CG ASN A 5 17.037 42.047 9.149 1.00 0.00 C ATOM 42 OD1 ASN A 5 17.643 42.576 8.238 1.00 0.00 O ATOM 43 ND2 ASN A 5 15.930 41.412 8.904 1.00 0.00 N ATOM 0 H ASN A 5 18.727 44.325 9.009 1.00 0.00 H new ATOM 0 HA ASN A 5 19.189 43.057 11.661 1.00 0.00 H new ATOM 0 HB2 ASN A 5 17.735 41.110 10.970 1.00 0.00 H new ATOM 0 HB3 ASN A 5 16.806 42.573 11.235 1.00 0.00 H new ATOM 0 HD21 ASN A 5 15.573 41.359 7.950 1.00 0.00 H new ATOM 0 HD22 ASN A 5 15.418 40.967 9.666 1.00 0.00 H new ATOM 50 N THR A 6 20.925 42.896 9.358 1.00 0.00 N ATOM 51 CA THR A 6 21.993 42.203 8.578 1.00 0.00 C ATOM 52 C THR A 6 23.360 42.431 9.222 1.00 0.00 C ATOM 53 O THR A 6 23.648 43.494 9.738 1.00 0.00 O ATOM 54 CB THR A 6 22.019 42.731 7.137 1.00 0.00 C ATOM 55 OG1 THR A 6 22.598 44.029 7.106 1.00 0.00 O ATOM 56 CG2 THR A 6 20.595 42.793 6.583 1.00 0.00 C ATOM 0 H THR A 6 21.043 43.903 9.468 1.00 0.00 H new ATOM 0 HA THR A 6 21.774 41.135 8.572 1.00 0.00 H new ATOM 0 HB THR A 6 22.617 42.057 6.524 1.00 0.00 H new ATOM 0 HG1 THR A 6 22.613 44.359 6.183 1.00 0.00 H new ATOM 0 HG21 THR A 6 20.619 43.168 5.560 1.00 0.00 H new ATOM 0 HG22 THR A 6 20.157 41.795 6.593 1.00 0.00 H new ATOM 0 HG23 THR A 6 19.993 43.460 7.200 1.00 0.00 H new ATOM 64 N PHE A 7 24.200 41.431 9.193 1.00 0.00 N ATOM 65 CA PHE A 7 25.565 41.537 9.818 1.00 0.00 C ATOM 66 C PHE A 7 26.233 42.878 9.486 1.00 0.00 C ATOM 67 O PHE A 7 26.284 43.773 10.297 1.00 0.00 O ATOM 68 CB PHE A 7 26.447 40.411 9.281 1.00 0.00 C ATOM 69 CG PHE A 7 25.841 39.084 9.631 1.00 0.00 C ATOM 70 CD1 PHE A 7 25.925 38.608 10.952 1.00 0.00 C ATOM 71 CD2 PHE A 7 25.184 38.318 8.649 1.00 0.00 C ATOM 72 CE1 PHE A 7 25.354 37.371 11.290 1.00 0.00 C ATOM 73 CE2 PHE A 7 24.615 37.077 8.991 1.00 0.00 C ATOM 74 CZ PHE A 7 24.702 36.607 10.310 1.00 0.00 C ATOM 0 H PHE A 7 24.002 40.530 8.758 1.00 0.00 H new ATOM 0 HA PHE A 7 25.449 41.464 10.899 1.00 0.00 H new ATOM 0 HB2 PHE A 7 26.550 40.501 8.200 1.00 0.00 H new ATOM 0 HB3 PHE A 7 27.449 40.487 9.704 1.00 0.00 H new ATOM 0 HD1 PHE A 7 26.429 39.194 11.706 1.00 0.00 H new ATOM 0 HD2 PHE A 7 25.117 38.682 7.635 1.00 0.00 H new ATOM 0 HE1 PHE A 7 25.417 37.007 12.305 1.00 0.00 H new ATOM 0 HE2 PHE A 7 24.112 36.487 8.239 1.00 0.00 H new ATOM 0 HZ PHE A 7 24.266 35.654 10.572 1.00 0.00 H new ATOM 84 N ASP A 8 26.770 43.001 8.311 1.00 0.00 N ATOM 85 CA ASP A 8 27.465 44.264 7.917 1.00 0.00 C ATOM 86 C ASP A 8 26.587 45.485 8.224 1.00 0.00 C ATOM 87 O ASP A 8 27.056 46.460 8.795 1.00 0.00 O ATOM 88 CB ASP A 8 27.811 44.205 6.422 1.00 0.00 C ATOM 89 CG ASP A 8 29.285 43.833 6.269 1.00 0.00 C ATOM 90 OD1 ASP A 8 29.709 42.903 6.928 1.00 0.00 O ATOM 91 OD2 ASP A 8 29.970 44.493 5.504 1.00 0.00 O ATOM 0 H ASP A 8 26.760 42.276 7.594 1.00 0.00 H new ATOM 0 HA ASP A 8 28.384 44.364 8.494 1.00 0.00 H new ATOM 0 HB2 ASP A 8 27.183 43.470 5.918 1.00 0.00 H new ATOM 0 HB3 ASP A 8 27.615 45.168 5.951 1.00 0.00 H new ATOM 96 N GLY A 9 25.329 45.453 7.855 1.00 0.00 N ATOM 97 CA GLY A 9 24.423 46.620 8.133 1.00 0.00 C ATOM 98 C GLY A 9 24.418 46.967 9.632 1.00 0.00 C ATOM 99 O GLY A 9 24.541 48.124 10.003 1.00 0.00 O ATOM 0 H GLY A 9 24.887 44.670 7.373 1.00 0.00 H new ATOM 0 HA2 GLY A 9 24.751 47.485 7.557 1.00 0.00 H new ATOM 0 HA3 GLY A 9 23.410 46.385 7.807 1.00 0.00 H new ATOM 103 N VAL A 10 24.274 45.991 10.505 1.00 0.00 N ATOM 104 CA VAL A 10 24.269 46.296 11.973 1.00 0.00 C ATOM 105 C VAL A 10 25.659 46.825 12.361 1.00 0.00 C ATOM 106 O VAL A 10 25.791 47.825 13.045 1.00 0.00 O ATOM 107 CB VAL A 10 23.977 45.018 12.769 1.00 0.00 C ATOM 108 CG1 VAL A 10 24.275 45.262 14.249 1.00 0.00 C ATOM 109 CG2 VAL A 10 22.500 44.644 12.603 1.00 0.00 C ATOM 0 H VAL A 10 24.161 45.006 10.265 1.00 0.00 H new ATOM 0 HA VAL A 10 23.501 47.037 12.195 1.00 0.00 H new ATOM 0 HB VAL A 10 24.604 44.206 12.400 1.00 0.00 H new ATOM 0 HG11 VAL A 10 24.068 44.355 14.816 1.00 0.00 H new ATOM 0 HG12 VAL A 10 25.324 45.534 14.369 1.00 0.00 H new ATOM 0 HG13 VAL A 10 23.646 46.072 14.618 1.00 0.00 H new ATOM 0 HG21 VAL A 10 22.289 43.736 13.168 1.00 0.00 H new ATOM 0 HG22 VAL A 10 21.875 45.456 12.975 1.00 0.00 H new ATOM 0 HG23 VAL A 10 22.284 44.474 11.548 1.00 0.00 H new ATOM 119 N ALA A 11 26.697 46.167 11.890 1.00 0.00 N ATOM 120 CA ALA A 11 28.097 46.604 12.198 1.00 0.00 C ATOM 121 C ALA A 11 28.288 48.036 11.679 1.00 0.00 C ATOM 122 O ALA A 11 28.678 48.945 12.413 1.00 0.00 O ATOM 123 CB ALA A 11 29.083 45.662 11.488 1.00 0.00 C ATOM 0 H ALA A 11 26.630 45.338 11.300 1.00 0.00 H new ATOM 0 HA ALA A 11 28.277 46.574 13.273 1.00 0.00 H new ATOM 0 HB1 ALA A 11 30.105 45.973 11.707 1.00 0.00 H new ATOM 0 HB2 ALA A 11 28.930 44.642 11.841 1.00 0.00 H new ATOM 0 HB3 ALA A 11 28.914 45.702 10.412 1.00 0.00 H new ATOM 129 N ASP A 12 27.992 48.235 10.409 1.00 0.00 N ATOM 130 CA ASP A 12 28.107 49.587 9.789 1.00 0.00 C ATOM 131 C ASP A 12 27.344 50.591 10.645 1.00 0.00 C ATOM 132 O ASP A 12 27.856 51.639 11.011 1.00 0.00 O ATOM 133 CB ASP A 12 27.466 49.563 8.391 1.00 0.00 C ATOM 134 CG ASP A 12 28.376 48.869 7.378 1.00 0.00 C ATOM 135 OD1 ASP A 12 29.340 48.243 7.790 1.00 0.00 O ATOM 136 OD2 ASP A 12 28.094 48.978 6.201 1.00 0.00 O ATOM 0 H ASP A 12 27.672 47.503 9.775 1.00 0.00 H new ATOM 0 HA ASP A 12 29.158 49.865 9.717 1.00 0.00 H new ATOM 0 HB2 ASP A 12 26.507 49.046 8.436 1.00 0.00 H new ATOM 0 HB3 ASP A 12 27.263 50.583 8.063 1.00 0.00 H new ATOM 141 N TYR A 13 26.121 50.266 10.978 1.00 0.00 N ATOM 142 CA TYR A 13 25.287 51.170 11.821 1.00 0.00 C ATOM 143 C TYR A 13 25.980 51.397 13.164 1.00 0.00 C ATOM 144 O TYR A 13 26.076 52.510 13.659 1.00 0.00 O ATOM 145 CB TYR A 13 23.934 50.500 12.054 1.00 0.00 C ATOM 146 CG TYR A 13 22.875 51.539 12.317 1.00 0.00 C ATOM 147 CD1 TYR A 13 22.263 52.201 11.244 1.00 0.00 C ATOM 148 CD2 TYR A 13 22.491 51.827 13.633 1.00 0.00 C ATOM 149 CE1 TYR A 13 21.270 53.154 11.490 1.00 0.00 C ATOM 150 CE2 TYR A 13 21.497 52.780 13.873 1.00 0.00 C ATOM 151 CZ TYR A 13 20.889 53.443 12.803 1.00 0.00 C ATOM 152 OH TYR A 13 19.919 54.388 13.042 1.00 0.00 O ATOM 0 H TYR A 13 25.660 49.400 10.697 1.00 0.00 H new ATOM 0 HA TYR A 13 25.151 52.130 11.322 1.00 0.00 H new ATOM 0 HB2 TYR A 13 23.661 49.904 11.183 1.00 0.00 H new ATOM 0 HB3 TYR A 13 24.000 49.816 12.900 1.00 0.00 H new ATOM 0 HD1 TYR A 13 22.558 51.976 10.230 1.00 0.00 H new ATOM 0 HD2 TYR A 13 22.961 51.315 14.459 1.00 0.00 H new ATOM 0 HE1 TYR A 13 20.797 53.667 10.665 1.00 0.00 H new ATOM 0 HE2 TYR A 13 21.198 53.004 14.886 1.00 0.00 H new ATOM 0 HH TYR A 13 19.033 53.984 12.927 1.00 0.00 H new ATOM 162 N LEU A 14 26.472 50.348 13.757 1.00 0.00 N ATOM 163 CA LEU A 14 27.159 50.483 15.068 1.00 0.00 C ATOM 164 C LEU A 14 28.469 51.256 14.888 1.00 0.00 C ATOM 165 O LEU A 14 28.768 52.163 15.651 1.00 0.00 O ATOM 166 CB LEU A 14 27.440 49.094 15.635 1.00 0.00 C ATOM 167 CG LEU A 14 26.138 48.494 16.171 1.00 0.00 C ATOM 168 CD1 LEU A 14 26.348 47.009 16.440 1.00 0.00 C ATOM 169 CD2 LEU A 14 25.737 49.197 17.473 1.00 0.00 C ATOM 0 H LEU A 14 26.427 49.398 13.388 1.00 0.00 H new ATOM 0 HA LEU A 14 26.522 51.031 15.762 1.00 0.00 H new ATOM 0 HB2 LEU A 14 27.859 48.451 14.861 1.00 0.00 H new ATOM 0 HB3 LEU A 14 28.180 49.157 16.433 1.00 0.00 H new ATOM 0 HG LEU A 14 25.346 48.629 15.435 1.00 0.00 H new ATOM 0 HD11 LEU A 14 25.424 46.574 16.822 1.00 0.00 H new ATOM 0 HD12 LEU A 14 26.629 46.508 15.514 1.00 0.00 H new ATOM 0 HD13 LEU A 14 27.141 46.881 17.177 1.00 0.00 H new ATOM 0 HD21 LEU A 14 24.810 48.765 17.849 1.00 0.00 H new ATOM 0 HD22 LEU A 14 26.525 49.066 18.215 1.00 0.00 H new ATOM 0 HD23 LEU A 14 25.591 50.260 17.282 1.00 0.00 H new ATOM 181 N GLN A 15 29.259 50.915 13.896 1.00 0.00 N ATOM 182 CA GLN A 15 30.538 51.659 13.689 1.00 0.00 C ATOM 183 C GLN A 15 30.262 53.120 13.272 1.00 0.00 C ATOM 184 O GLN A 15 31.111 53.976 13.428 1.00 0.00 O ATOM 185 CB GLN A 15 31.383 50.952 12.622 1.00 0.00 C ATOM 186 CG GLN A 15 31.762 49.549 13.128 1.00 0.00 C ATOM 187 CD GLN A 15 33.286 49.382 13.161 1.00 0.00 C ATOM 188 OE1 GLN A 15 33.984 49.887 12.307 1.00 0.00 O ATOM 189 NE2 GLN A 15 33.836 48.675 14.111 1.00 0.00 N ATOM 0 H GLN A 15 29.075 50.164 13.231 1.00 0.00 H new ATOM 0 HA GLN A 15 31.088 51.674 14.630 1.00 0.00 H new ATOM 0 HB2 GLN A 15 30.825 50.877 11.689 1.00 0.00 H new ATOM 0 HB3 GLN A 15 32.282 51.531 12.410 1.00 0.00 H new ATOM 0 HG2 GLN A 15 31.352 49.393 14.126 1.00 0.00 H new ATOM 0 HG3 GLN A 15 31.321 48.791 12.480 1.00 0.00 H new ATOM 0 HE21 GLN A 15 33.254 48.248 14.832 1.00 0.00 H new ATOM 0 HE22 GLN A 15 34.848 48.549 14.133 1.00 0.00 H new ATOM 198 N THR A 16 29.107 53.411 12.724 1.00 0.00 N ATOM 199 CA THR A 16 28.816 54.810 12.290 1.00 0.00 C ATOM 200 C THR A 16 27.950 55.550 13.322 1.00 0.00 C ATOM 201 O THR A 16 28.256 56.663 13.711 1.00 0.00 O ATOM 202 CB THR A 16 28.054 54.786 10.961 1.00 0.00 C ATOM 203 OG1 THR A 16 28.642 53.832 10.084 1.00 0.00 O ATOM 204 CG2 THR A 16 28.099 56.179 10.328 1.00 0.00 C ATOM 0 H THR A 16 28.356 52.741 12.560 1.00 0.00 H new ATOM 0 HA THR A 16 29.769 55.328 12.186 1.00 0.00 H new ATOM 0 HB THR A 16 27.016 54.504 11.140 1.00 0.00 H new ATOM 0 HG1 THR A 16 28.121 53.003 10.106 1.00 0.00 H new ATOM 0 HG21 THR A 16 27.558 56.166 9.382 1.00 0.00 H new ATOM 0 HG22 THR A 16 27.636 56.900 11.002 1.00 0.00 H new ATOM 0 HG23 THR A 16 29.136 56.464 10.149 1.00 0.00 H new ATOM 212 N TYR A 17 26.847 54.963 13.723 1.00 0.00 N ATOM 213 CA TYR A 17 25.927 55.650 14.684 1.00 0.00 C ATOM 214 C TYR A 17 26.167 55.160 16.114 1.00 0.00 C ATOM 215 O TYR A 17 25.711 55.764 17.062 1.00 0.00 O ATOM 216 CB TYR A 17 24.477 55.356 14.282 1.00 0.00 C ATOM 217 CG TYR A 17 24.234 55.829 12.875 1.00 0.00 C ATOM 218 CD1 TYR A 17 24.157 57.199 12.603 1.00 0.00 C ATOM 219 CD2 TYR A 17 24.079 54.900 11.842 1.00 0.00 C ATOM 220 CE1 TYR A 17 23.926 57.638 11.297 1.00 0.00 C ATOM 221 CE2 TYR A 17 23.849 55.341 10.536 1.00 0.00 C ATOM 222 CZ TYR A 17 23.772 56.708 10.266 1.00 0.00 C ATOM 223 OH TYR A 17 23.543 57.139 8.983 1.00 0.00 O ATOM 0 H TYR A 17 26.544 54.036 13.425 1.00 0.00 H new ATOM 0 HA TYR A 17 26.120 56.722 14.651 1.00 0.00 H new ATOM 0 HB2 TYR A 17 24.279 54.287 14.356 1.00 0.00 H new ATOM 0 HB3 TYR A 17 23.791 55.855 14.967 1.00 0.00 H new ATOM 0 HD1 TYR A 17 24.276 57.916 13.402 1.00 0.00 H new ATOM 0 HD2 TYR A 17 24.137 53.842 12.053 1.00 0.00 H new ATOM 0 HE1 TYR A 17 23.867 58.695 11.085 1.00 0.00 H new ATOM 0 HE2 TYR A 17 23.731 54.625 9.736 1.00 0.00 H new ATOM 0 HH TYR A 17 23.461 56.365 8.388 1.00 0.00 H new ATOM 233 N HIS A 18 26.849 54.058 16.278 1.00 0.00 N ATOM 234 CA HIS A 18 27.113 53.514 17.650 1.00 0.00 C ATOM 235 C HIS A 18 25.793 53.147 18.349 1.00 0.00 C ATOM 236 O HIS A 18 25.777 52.381 19.292 1.00 0.00 O ATOM 237 CB HIS A 18 27.892 54.553 18.472 1.00 0.00 C ATOM 238 CG HIS A 18 29.306 54.635 17.961 1.00 0.00 C ATOM 239 ND1 HIS A 18 29.738 53.892 16.874 1.00 0.00 N ATOM 240 CD2 HIS A 18 30.395 55.369 18.371 1.00 0.00 C ATOM 241 CE1 HIS A 18 31.034 54.193 16.667 1.00 0.00 C ATOM 242 NE2 HIS A 18 31.485 55.087 17.552 1.00 0.00 N ATOM 0 H HIS A 18 27.239 53.504 15.516 1.00 0.00 H new ATOM 0 HA HIS A 18 27.711 52.607 17.566 1.00 0.00 H new ATOM 0 HB2 HIS A 18 27.410 55.528 18.398 1.00 0.00 H new ATOM 0 HB3 HIS A 18 27.890 54.275 19.526 1.00 0.00 H new ATOM 0 HD1 HIS A 18 29.177 53.237 16.330 1.00 0.00 H new ATOM 0 HD2 HIS A 18 30.403 56.059 19.202 1.00 0.00 H new ATOM 0 HE1 HIS A 18 31.637 53.764 15.880 1.00 0.00 H new ATOM 250 N LYS A 19 24.686 53.670 17.893 1.00 0.00 N ATOM 251 CA LYS A 19 23.376 53.324 18.518 1.00 0.00 C ATOM 252 C LYS A 19 22.877 52.008 17.907 1.00 0.00 C ATOM 253 O LYS A 19 23.042 51.760 16.729 1.00 0.00 O ATOM 254 CB LYS A 19 22.367 54.460 18.260 0.50 0.00 C ATOM 255 CG LYS A 19 21.083 53.911 17.605 0.50 0.00 C ATOM 256 CD LYS A 19 20.140 55.067 17.242 0.50 0.00 C ATOM 257 CE LYS A 19 20.576 55.679 15.910 0.50 0.00 C ATOM 258 NZ LYS A 19 19.465 55.568 14.918 0.50 0.00 N ATOM 0 H LYS A 19 24.632 54.324 17.112 1.00 0.00 H new ATOM 0 HA LYS A 19 23.488 53.202 19.595 1.00 0.00 H new ATOM 0 HB2 LYS A 19 22.119 54.953 19.200 0.50 0.00 H new ATOM 0 HB3 LYS A 19 22.817 55.213 17.614 0.50 0.00 H new ATOM 0 HG2 LYS A 19 21.336 53.343 16.710 0.50 0.00 H new ATOM 0 HG3 LYS A 19 20.583 53.224 18.287 0.50 0.00 H new ATOM 0 HD2 LYS A 19 19.114 54.705 17.170 0.50 0.00 H new ATOM 0 HD3 LYS A 19 20.157 55.824 18.026 0.50 0.00 H new ATOM 0 HE2 LYS A 19 20.848 56.725 16.051 0.50 0.00 H new ATOM 0 HE3 LYS A 19 21.463 55.167 15.536 0.50 0.00 H new ATOM 0 HZ1 LYS A 19 19.799 55.052 14.079 0.50 0.00 H new ATOM 0 HZ2 LYS A 19 18.668 55.055 15.345 0.50 0.00 H new ATOM 0 HZ3 LYS A 19 19.153 56.520 14.638 0.50 0.00 H new ATOM 272 N LEU A 20 22.275 51.162 18.695 1.00 0.00 N ATOM 273 CA LEU A 20 21.778 49.860 18.156 1.00 0.00 C ATOM 274 C LEU A 20 20.690 50.112 17.109 1.00 0.00 C ATOM 275 O LEU A 20 19.721 50.799 17.373 1.00 0.00 O ATOM 276 CB LEU A 20 21.203 49.020 19.301 1.00 0.00 C ATOM 277 CG LEU A 20 22.349 48.318 20.035 1.00 0.00 C ATOM 278 CD1 LEU A 20 21.978 48.102 21.504 1.00 0.00 C ATOM 279 CD2 LEU A 20 22.618 46.961 19.381 1.00 0.00 C ATOM 0 H LEU A 20 22.104 51.313 19.689 1.00 0.00 H new ATOM 0 HA LEU A 20 22.605 49.324 17.690 1.00 0.00 H new ATOM 0 HB2 LEU A 20 20.648 49.656 19.991 1.00 0.00 H new ATOM 0 HB3 LEU A 20 20.500 48.284 18.911 1.00 0.00 H new ATOM 0 HG LEU A 20 23.241 48.941 19.977 1.00 0.00 H new ATOM 0 HD11 LEU A 20 22.800 47.602 22.017 1.00 0.00 H new ATOM 0 HD12 LEU A 20 21.788 49.066 21.977 1.00 0.00 H new ATOM 0 HD13 LEU A 20 21.082 47.484 21.566 1.00 0.00 H new ATOM 0 HD21 LEU A 20 23.434 46.461 19.903 1.00 0.00 H new ATOM 0 HD22 LEU A 20 21.720 46.346 19.437 1.00 0.00 H new ATOM 0 HD23 LEU A 20 22.892 47.109 18.336 1.00 0.00 H new ATOM 291 N PRO A 21 20.849 49.559 15.926 1.00 0.00 N ATOM 292 CA PRO A 21 19.871 49.725 14.819 1.00 0.00 C ATOM 293 C PRO A 21 18.427 49.879 15.325 1.00 0.00 C ATOM 294 O PRO A 21 17.880 49.005 15.969 1.00 0.00 O ATOM 295 CB PRO A 21 20.058 48.447 14.004 1.00 0.00 C ATOM 296 CG PRO A 21 21.488 48.035 14.215 1.00 0.00 C ATOM 297 CD PRO A 21 21.978 48.709 15.510 1.00 0.00 C ATOM 0 HA PRO A 21 20.041 50.633 14.241 1.00 0.00 H new ATOM 0 HB2 PRO A 21 19.373 47.667 14.336 1.00 0.00 H new ATOM 0 HB3 PRO A 21 19.853 48.623 12.948 1.00 0.00 H new ATOM 0 HG2 PRO A 21 21.567 46.951 14.294 1.00 0.00 H new ATOM 0 HG3 PRO A 21 22.103 48.339 13.368 1.00 0.00 H new ATOM 0 HD2 PRO A 21 22.224 47.972 16.274 1.00 0.00 H new ATOM 0 HD3 PRO A 21 22.878 49.299 15.336 1.00 0.00 H new ATOM 305 N ASP A 22 17.833 51.002 15.031 1.00 0.00 N ATOM 306 CA ASP A 22 16.436 51.307 15.467 1.00 0.00 C ATOM 307 C ASP A 22 15.486 50.141 15.124 1.00 0.00 C ATOM 308 O ASP A 22 14.731 50.188 14.166 1.00 0.00 O ATOM 309 CB ASP A 22 16.008 52.607 14.762 1.00 0.00 C ATOM 310 CG ASP A 22 17.255 53.477 14.547 1.00 0.00 C ATOM 311 OD1 ASP A 22 17.937 53.267 13.554 1.00 0.00 O ATOM 312 OD2 ASP A 22 17.525 54.325 15.382 1.00 0.00 O ATOM 0 H ASP A 22 18.271 51.747 14.489 1.00 0.00 H new ATOM 0 HA ASP A 22 16.391 51.435 16.548 1.00 0.00 H new ATOM 0 HB2 ASP A 22 15.534 52.382 13.807 1.00 0.00 H new ATOM 0 HB3 ASP A 22 15.273 53.141 15.365 1.00 0.00 H new ATOM 317 N ASN A 23 15.535 49.091 15.916 1.00 0.00 N ATOM 318 CA ASN A 23 14.664 47.885 15.692 1.00 0.00 C ATOM 319 C ASN A 23 15.109 46.731 16.605 1.00 0.00 C ATOM 320 O ASN A 23 14.727 45.588 16.401 1.00 0.00 O ATOM 321 CB ASN A 23 14.788 47.424 14.244 1.00 0.00 C ATOM 322 CG ASN A 23 16.265 47.315 13.869 1.00 0.00 C ATOM 323 OD1 ASN A 23 16.819 48.209 13.262 1.00 0.00 O ATOM 324 ND2 ASN A 23 16.928 46.251 14.199 1.00 0.00 N ATOM 0 H ASN A 23 16.154 49.018 16.724 1.00 0.00 H new ATOM 0 HA ASN A 23 13.633 48.158 15.917 1.00 0.00 H new ATOM 0 HB2 ASN A 23 14.297 46.460 14.115 1.00 0.00 H new ATOM 0 HB3 ASN A 23 14.285 48.129 13.582 1.00 0.00 H new ATOM 0 HD21 ASN A 23 17.913 46.166 13.949 1.00 0.00 H new ATOM 0 HD22 ASN A 23 16.464 45.499 14.709 1.00 0.00 H new ATOM 331 N TYR A 24 15.935 47.016 17.583 1.00 0.00 N ATOM 332 CA TYR A 24 16.429 45.937 18.496 1.00 0.00 C ATOM 333 C TYR A 24 15.871 46.097 19.914 1.00 0.00 C ATOM 334 O TYR A 24 15.335 47.126 20.283 1.00 0.00 O ATOM 335 CB TYR A 24 17.956 45.990 18.554 1.00 0.00 C ATOM 336 CG TYR A 24 18.508 45.166 17.424 1.00 0.00 C ATOM 337 CD1 TYR A 24 18.449 43.772 17.497 1.00 0.00 C ATOM 338 CD2 TYR A 24 19.061 45.785 16.300 1.00 0.00 C ATOM 339 CE1 TYR A 24 18.939 42.994 16.448 1.00 0.00 C ATOM 340 CE2 TYR A 24 19.559 45.002 15.248 1.00 0.00 C ATOM 341 CZ TYR A 24 19.494 43.608 15.325 1.00 0.00 C ATOM 342 OH TYR A 24 19.964 42.838 14.285 1.00 0.00 O ATOM 0 H TYR A 24 16.289 47.950 17.789 1.00 0.00 H new ATOM 0 HA TYR A 24 16.090 44.979 18.102 1.00 0.00 H new ATOM 0 HB2 TYR A 24 18.302 47.021 18.475 1.00 0.00 H new ATOM 0 HB3 TYR A 24 18.312 45.607 19.510 1.00 0.00 H new ATOM 0 HD1 TYR A 24 18.023 43.296 18.368 1.00 0.00 H new ATOM 0 HD2 TYR A 24 19.105 46.863 16.241 1.00 0.00 H new ATOM 0 HE1 TYR A 24 18.889 41.917 16.505 1.00 0.00 H new ATOM 0 HE2 TYR A 24 19.992 45.476 14.380 1.00 0.00 H new ATOM 0 HH TYR A 24 20.393 42.033 14.642 1.00 0.00 H new ATOM 352 N ILE A 25 16.005 45.070 20.711 1.00 0.00 N ATOM 353 CA ILE A 25 15.499 45.125 22.113 1.00 0.00 C ATOM 354 C ILE A 25 16.283 44.102 22.943 1.00 0.00 C ATOM 355 O ILE A 25 16.671 43.056 22.451 1.00 0.00 O ATOM 356 CB ILE A 25 13.996 44.805 22.121 1.00 0.00 C ATOM 357 CG1 ILE A 25 13.649 43.969 20.883 1.00 0.00 C ATOM 358 CG2 ILE A 25 13.200 46.119 22.084 1.00 0.00 C ATOM 359 CD1 ILE A 25 12.326 43.243 21.106 1.00 0.00 C ATOM 0 H ILE A 25 16.447 44.189 20.448 1.00 0.00 H new ATOM 0 HA ILE A 25 15.638 46.118 22.541 1.00 0.00 H new ATOM 0 HB ILE A 25 13.744 44.247 23.023 1.00 0.00 H new ATOM 0 HG12 ILE A 25 13.578 44.613 20.006 1.00 0.00 H new ATOM 0 HG13 ILE A 25 14.442 43.248 20.686 1.00 0.00 H new ATOM 0 HG21 ILE A 25 12.133 45.898 22.089 1.00 0.00 H new ATOM 0 HG22 ILE A 25 13.450 46.721 22.958 1.00 0.00 H new ATOM 0 HG23 ILE A 25 13.452 46.671 21.179 1.00 0.00 H new ATOM 0 HD11 ILE A 25 12.083 42.650 20.224 1.00 0.00 H new ATOM 0 HD12 ILE A 25 12.413 42.587 21.972 1.00 0.00 H new ATOM 0 HD13 ILE A 25 11.536 43.973 21.282 1.00 0.00 H new ATOM 371 N THR A 26 16.525 44.381 24.195 1.00 0.00 N ATOM 372 CA THR A 26 17.309 43.420 25.038 1.00 0.00 C ATOM 373 C THR A 26 16.495 42.154 25.260 1.00 0.00 C ATOM 374 O THR A 26 15.277 42.178 25.250 1.00 0.00 O ATOM 375 CB THR A 26 17.573 44.043 26.405 1.00 0.00 C ATOM 376 OG1 THR A 26 16.329 44.327 27.015 1.00 0.00 O ATOM 377 CG2 THR A 26 18.366 45.336 26.248 1.00 0.00 C ATOM 0 H THR A 26 16.217 45.228 24.673 1.00 0.00 H new ATOM 0 HA THR A 26 18.246 43.190 24.530 1.00 0.00 H new ATOM 0 HB THR A 26 18.149 43.351 27.019 1.00 0.00 H new ATOM 0 HG1 THR A 26 16.453 44.420 27.983 1.00 0.00 H new ATOM 0 HG21 THR A 26 18.549 45.772 27.230 1.00 0.00 H new ATOM 0 HG22 THR A 26 19.318 45.122 25.763 1.00 0.00 H new ATOM 0 HG23 THR A 26 17.798 46.039 25.639 1.00 0.00 H new ATOM 385 N LYS A 27 17.145 41.047 25.501 1.00 0.00 N ATOM 386 CA LYS A 27 16.379 39.808 25.769 1.00 0.00 C ATOM 387 C LYS A 27 15.385 40.118 26.899 1.00 0.00 C ATOM 388 O LYS A 27 14.191 39.898 26.761 1.00 0.00 O ATOM 389 CB LYS A 27 17.338 38.675 26.186 1.00 0.00 C ATOM 390 CG LYS A 27 17.308 37.549 25.136 1.00 0.00 C ATOM 391 CD LYS A 27 18.712 37.345 24.547 1.00 0.00 C ATOM 392 CE LYS A 27 18.960 38.347 23.414 1.00 0.00 C ATOM 393 NZ LYS A 27 20.429 38.491 23.198 1.00 0.00 N ATOM 0 H LYS A 27 18.160 40.952 25.523 1.00 0.00 H new ATOM 0 HA LYS A 27 15.846 39.480 24.876 1.00 0.00 H new ATOM 0 HB2 LYS A 27 18.352 39.063 26.286 1.00 0.00 H new ATOM 0 HB3 LYS A 27 17.049 38.283 27.161 1.00 0.00 H new ATOM 0 HG2 LYS A 27 16.958 36.623 25.593 1.00 0.00 H new ATOM 0 HG3 LYS A 27 16.604 37.799 24.342 1.00 0.00 H new ATOM 0 HD2 LYS A 27 19.463 37.472 25.326 1.00 0.00 H new ATOM 0 HD3 LYS A 27 18.812 36.327 24.171 1.00 0.00 H new ATOM 0 HE2 LYS A 27 18.478 38.005 22.498 1.00 0.00 H new ATOM 0 HE3 LYS A 27 18.521 39.313 23.664 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 20.705 39.484 23.337 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 20.940 37.891 23.877 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 20.668 38.198 22.229 1.00 0.00 H new ATOM 407 N SER A 28 15.869 40.659 28.000 1.00 0.00 N ATOM 408 CA SER A 28 14.958 41.022 29.137 1.00 0.00 C ATOM 409 C SER A 28 13.709 41.737 28.610 1.00 0.00 C ATOM 410 O SER A 28 12.592 41.255 28.771 1.00 0.00 O ATOM 411 CB SER A 28 15.688 41.946 30.106 0.50 0.00 C ATOM 412 OG SER A 28 14.740 42.507 31.006 0.50 0.00 O ATOM 0 H SER A 28 16.856 40.864 28.158 1.00 0.00 H new ATOM 0 HA SER A 28 14.660 40.107 29.650 1.00 0.00 H new ATOM 0 HB2 SER A 28 16.448 41.392 30.656 0.50 0.00 H new ATOM 0 HB3 SER A 28 16.203 42.736 29.559 0.50 0.00 H new ATOM 0 HG SER A 28 15.199 43.102 31.635 0.50 0.00 H new ATOM 418 N GLU A 29 13.891 42.865 27.961 1.00 0.00 N ATOM 419 CA GLU A 29 12.721 43.607 27.387 1.00 0.00 C ATOM 420 C GLU A 29 11.827 42.654 26.580 1.00 0.00 C ATOM 421 O GLU A 29 10.643 42.496 26.857 1.00 0.00 O ATOM 422 CB GLU A 29 13.240 44.708 26.466 1.00 0.00 C ATOM 423 CG GLU A 29 13.882 45.828 27.290 1.00 0.00 C ATOM 424 CD GLU A 29 14.698 46.726 26.371 1.00 0.00 C ATOM 425 OE1 GLU A 29 15.532 46.191 25.648 1.00 0.00 O ATOM 426 OE2 GLU A 29 14.473 47.929 26.393 1.00 0.00 O ATOM 0 H GLU A 29 14.799 43.303 27.804 1.00 0.00 H new ATOM 0 HA GLU A 29 12.135 44.036 28.200 1.00 0.00 H new ATOM 0 HB2 GLU A 29 13.970 44.295 25.769 1.00 0.00 H new ATOM 0 HB3 GLU A 29 12.421 45.109 25.869 1.00 0.00 H new ATOM 0 HG2 GLU A 29 13.112 46.410 27.796 1.00 0.00 H new ATOM 0 HG3 GLU A 29 14.521 45.404 28.065 1.00 0.00 H new ATOM 433 N ALA A 30 12.392 42.023 25.583 1.00 0.00 N ATOM 434 CA ALA A 30 11.619 41.065 24.741 1.00 0.00 C ATOM 435 C ALA A 30 10.920 40.027 25.631 1.00 0.00 C ATOM 436 O ALA A 30 9.730 39.783 25.503 1.00 0.00 O ATOM 437 CB ALA A 30 12.605 40.383 23.789 1.00 0.00 C ATOM 0 H ALA A 30 13.370 42.133 25.314 1.00 0.00 H new ATOM 0 HA ALA A 30 10.849 41.587 24.172 1.00 0.00 H new ATOM 0 HB1 ALA A 30 12.070 39.674 23.157 1.00 0.00 H new ATOM 0 HB2 ALA A 30 13.086 41.135 23.163 1.00 0.00 H new ATOM 0 HB3 ALA A 30 13.362 39.854 24.367 1.00 0.00 H new ATOM 443 N GLN A 31 11.653 39.432 26.533 1.00 0.00 N ATOM 444 CA GLN A 31 11.064 38.420 27.454 1.00 0.00 C ATOM 445 C GLN A 31 9.977 39.082 28.322 1.00 0.00 C ATOM 446 O GLN A 31 8.854 38.610 28.407 1.00 0.00 O ATOM 447 CB GLN A 31 12.194 37.876 28.337 1.00 0.00 C ATOM 448 CG GLN A 31 13.155 37.048 27.475 1.00 0.00 C ATOM 449 CD GLN A 31 14.372 36.646 28.303 1.00 0.00 C ATOM 450 OE1 GLN A 31 15.398 37.293 28.270 1.00 0.00 O ATOM 451 NE2 GLN A 31 14.296 35.590 29.053 1.00 0.00 N ATOM 0 H GLN A 31 12.648 39.607 26.672 1.00 0.00 H new ATOM 0 HA GLN A 31 10.604 37.607 26.892 1.00 0.00 H new ATOM 0 HB2 GLN A 31 12.729 38.699 28.811 1.00 0.00 H new ATOM 0 HB3 GLN A 31 11.782 37.261 29.137 1.00 0.00 H new ATOM 0 HG2 GLN A 31 12.648 36.159 27.100 1.00 0.00 H new ATOM 0 HG3 GLN A 31 13.469 37.626 26.606 1.00 0.00 H new ATOM 0 HE21 GLN A 31 13.434 35.046 29.081 1.00 0.00 H new ATOM 0 HE22 GLN A 31 15.098 35.304 29.614 1.00 0.00 H new ATOM 460 N ALA A 32 10.302 40.176 28.968 1.00 0.00 N ATOM 461 CA ALA A 32 9.305 40.876 29.832 1.00 0.00 C ATOM 462 C ALA A 32 8.152 41.440 28.981 1.00 0.00 C ATOM 463 O ALA A 32 7.028 41.533 29.437 1.00 0.00 O ATOM 464 CB ALA A 32 10.009 42.011 30.597 1.00 0.00 C ATOM 0 H ALA A 32 11.222 40.615 28.932 1.00 0.00 H new ATOM 0 HA ALA A 32 8.883 40.165 30.542 1.00 0.00 H new ATOM 0 HB1 ALA A 32 9.286 42.526 31.230 1.00 0.00 H new ATOM 0 HB2 ALA A 32 10.802 41.594 31.217 1.00 0.00 H new ATOM 0 HB3 ALA A 32 10.438 42.718 29.886 1.00 0.00 H new ATOM 470 N LEU A 33 8.411 41.808 27.751 1.00 0.00 N ATOM 471 CA LEU A 33 7.321 42.358 26.891 1.00 0.00 C ATOM 472 C LEU A 33 6.310 41.250 26.591 1.00 0.00 C ATOM 473 O LEU A 33 5.181 41.513 26.215 1.00 0.00 O ATOM 474 CB LEU A 33 7.901 42.878 25.567 1.00 0.00 C ATOM 475 CG LEU A 33 8.292 44.362 25.689 1.00 0.00 C ATOM 476 CD1 LEU A 33 9.485 44.664 24.775 1.00 0.00 C ATOM 477 CD2 LEU A 33 7.099 45.224 25.262 1.00 0.00 C ATOM 0 H LEU A 33 9.328 41.751 27.307 1.00 0.00 H new ATOM 0 HA LEU A 33 6.834 43.180 27.416 1.00 0.00 H new ATOM 0 HB2 LEU A 33 8.775 42.288 25.291 1.00 0.00 H new ATOM 0 HB3 LEU A 33 7.168 42.754 24.770 1.00 0.00 H new ATOM 0 HG LEU A 33 8.567 44.583 26.720 1.00 0.00 H new ATOM 0 HD11 LEU A 33 9.756 45.716 24.866 1.00 0.00 H new ATOM 0 HD12 LEU A 33 10.333 44.044 25.066 1.00 0.00 H new ATOM 0 HD13 LEU A 33 9.215 44.447 23.741 1.00 0.00 H new ATOM 0 HD21 LEU A 33 7.364 46.278 25.344 1.00 0.00 H new ATOM 0 HD22 LEU A 33 6.836 44.995 24.229 1.00 0.00 H new ATOM 0 HD23 LEU A 33 6.247 45.012 25.909 1.00 0.00 H new ATOM 489 N GLY A 34 6.700 40.011 26.781 1.00 0.00 N ATOM 490 CA GLY A 34 5.751 38.879 26.520 1.00 0.00 C ATOM 491 C GLY A 34 6.420 37.793 25.676 1.00 0.00 C ATOM 492 O GLY A 34 5.852 36.744 25.438 1.00 0.00 O ATOM 0 H GLY A 34 7.628 39.735 27.103 1.00 0.00 H new ATOM 0 HA2 GLY A 34 5.415 38.455 27.466 1.00 0.00 H new ATOM 0 HA3 GLY A 34 4.866 39.252 26.005 1.00 0.00 H new ATOM 496 N TRP A 35 7.617 38.021 25.216 1.00 0.00 N ATOM 497 CA TRP A 35 8.294 36.983 24.391 1.00 0.00 C ATOM 498 C TRP A 35 8.336 35.659 25.165 1.00 0.00 C ATOM 499 O TRP A 35 8.888 35.572 26.244 1.00 0.00 O ATOM 500 CB TRP A 35 9.716 37.441 24.047 1.00 0.00 C ATOM 501 CG TRP A 35 10.376 36.443 23.148 1.00 0.00 C ATOM 502 CD1 TRP A 35 9.795 35.850 22.077 1.00 0.00 C ATOM 503 CD2 TRP A 35 11.729 35.910 23.229 1.00 0.00 C ATOM 504 NE1 TRP A 35 10.714 34.996 21.487 1.00 0.00 N ATOM 505 CE2 TRP A 35 11.924 34.997 22.162 1.00 0.00 C ATOM 506 CE3 TRP A 35 12.795 36.135 24.118 1.00 0.00 C ATOM 507 CZ2 TRP A 35 13.144 34.330 21.984 1.00 0.00 C ATOM 508 CZ3 TRP A 35 14.021 35.464 23.951 1.00 0.00 C ATOM 509 CH2 TRP A 35 14.197 34.564 22.884 1.00 0.00 C ATOM 0 H TRP A 35 8.153 38.874 25.374 1.00 0.00 H new ATOM 0 HA TRP A 35 7.739 36.835 23.465 1.00 0.00 H new ATOM 0 HB2 TRP A 35 9.684 38.416 23.560 1.00 0.00 H new ATOM 0 HB3 TRP A 35 10.299 37.560 24.960 1.00 0.00 H new ATOM 0 HD1 TRP A 35 8.783 36.015 21.739 1.00 0.00 H new ATOM 0 HE1 TRP A 35 10.523 34.435 20.657 1.00 0.00 H new ATOM 0 HE3 TRP A 35 12.672 36.829 24.936 1.00 0.00 H new ATOM 0 HZ2 TRP A 35 13.273 33.642 21.162 1.00 0.00 H new ATOM 0 HZ3 TRP A 35 14.830 35.641 24.645 1.00 0.00 H new ATOM 0 HH2 TRP A 35 15.140 34.054 22.757 1.00 0.00 H new ATOM 520 N VAL A 36 7.726 34.638 24.624 1.00 0.00 N ATOM 521 CA VAL A 36 7.701 33.311 25.310 1.00 0.00 C ATOM 522 C VAL A 36 8.264 32.214 24.379 1.00 0.00 C ATOM 523 O VAL A 36 7.926 32.136 23.204 1.00 0.00 O ATOM 524 CB VAL A 36 6.246 32.978 25.685 1.00 0.00 C ATOM 525 CG1 VAL A 36 6.088 31.474 25.904 1.00 0.00 C ATOM 526 CG2 VAL A 36 5.871 33.699 26.981 1.00 0.00 C ATOM 0 H VAL A 36 7.239 34.666 23.728 1.00 0.00 H new ATOM 0 HA VAL A 36 8.319 33.353 26.207 1.00 0.00 H new ATOM 0 HB VAL A 36 5.596 33.301 24.872 1.00 0.00 H new ATOM 0 HG11 VAL A 36 5.054 31.251 26.169 1.00 0.00 H new ATOM 0 HG12 VAL A 36 6.350 30.943 24.989 1.00 0.00 H new ATOM 0 HG13 VAL A 36 6.746 31.153 26.711 1.00 0.00 H new ATOM 0 HG21 VAL A 36 4.840 33.462 27.244 1.00 0.00 H new ATOM 0 HG22 VAL A 36 6.534 33.375 27.783 1.00 0.00 H new ATOM 0 HG23 VAL A 36 5.971 34.775 26.841 1.00 0.00 H new ATOM 536 N ALA A 37 9.100 31.346 24.909 1.00 0.00 N ATOM 537 CA ALA A 37 9.669 30.227 24.094 1.00 0.00 C ATOM 538 C ALA A 37 8.517 29.400 23.518 1.00 0.00 C ATOM 539 O ALA A 37 8.390 29.251 22.321 1.00 0.00 O ATOM 540 CB ALA A 37 10.528 29.339 25.002 1.00 0.00 C ATOM 0 H ALA A 37 9.413 31.368 25.880 1.00 0.00 H new ATOM 0 HA ALA A 37 10.280 30.624 23.283 1.00 0.00 H new ATOM 0 HB1 ALA A 37 10.948 28.520 24.418 1.00 0.00 H new ATOM 0 HB2 ALA A 37 11.337 29.931 25.430 1.00 0.00 H new ATOM 0 HB3 ALA A 37 9.911 28.934 25.804 1.00 0.00 H new ATOM 546 N SER A 38 7.667 28.877 24.368 1.00 0.00 N ATOM 547 CA SER A 38 6.513 28.054 23.879 1.00 0.00 C ATOM 548 C SER A 38 5.489 28.955 23.182 1.00 0.00 C ATOM 549 O SER A 38 4.305 28.908 23.462 1.00 0.00 O ATOM 550 CB SER A 38 5.856 27.334 25.064 1.00 0.00 C ATOM 551 OG SER A 38 5.045 28.256 25.783 1.00 0.00 O ATOM 0 H SER A 38 7.721 28.984 25.381 1.00 0.00 H new ATOM 0 HA SER A 38 6.876 27.314 23.166 1.00 0.00 H new ATOM 0 HB2 SER A 38 5.251 26.500 24.708 1.00 0.00 H new ATOM 0 HB3 SER A 38 6.620 26.916 25.719 1.00 0.00 H new ATOM 0 HG SER A 38 4.306 28.555 25.213 1.00 0.00 H new ATOM 557 N LYS A 39 5.947 29.773 22.276 1.00 0.00 N ATOM 558 CA LYS A 39 5.027 30.694 21.544 1.00 0.00 C ATOM 559 C LYS A 39 5.778 31.395 20.408 1.00 0.00 C ATOM 560 O LYS A 39 5.325 31.427 19.280 1.00 0.00 O ATOM 561 CB LYS A 39 4.501 31.756 22.512 1.00 0.00 C ATOM 562 CG LYS A 39 3.428 32.605 21.816 1.00 0.00 C ATOM 563 CD LYS A 39 2.587 33.339 22.872 1.00 0.00 C ATOM 564 CE LYS A 39 1.096 33.234 22.528 1.00 0.00 C ATOM 565 NZ LYS A 39 0.604 31.859 22.848 1.00 0.00 N ATOM 0 H LYS A 39 6.928 29.845 22.007 1.00 0.00 H new ATOM 0 HA LYS A 39 4.201 30.115 21.131 1.00 0.00 H new ATOM 0 HB2 LYS A 39 4.083 31.279 23.398 1.00 0.00 H new ATOM 0 HB3 LYS A 39 5.320 32.392 22.849 1.00 0.00 H new ATOM 0 HG2 LYS A 39 3.898 33.325 21.146 1.00 0.00 H new ATOM 0 HG3 LYS A 39 2.788 31.970 21.204 1.00 0.00 H new ATOM 0 HD2 LYS A 39 2.772 32.910 23.857 1.00 0.00 H new ATOM 0 HD3 LYS A 39 2.884 34.387 22.920 1.00 0.00 H new ATOM 0 HE2 LYS A 39 0.529 33.975 23.092 1.00 0.00 H new ATOM 0 HE3 LYS A 39 0.940 33.450 21.471 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -0.430 31.827 22.744 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 1.039 31.174 22.197 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 0.861 31.617 23.826 1.00 0.00 H new ATOM 579 N GLY A 40 6.918 31.975 20.707 1.00 0.00 N ATOM 580 CA GLY A 40 7.696 32.696 19.654 1.00 0.00 C ATOM 581 C GLY A 40 6.961 33.980 19.285 1.00 0.00 C ATOM 582 O GLY A 40 7.230 34.587 18.266 1.00 0.00 O ATOM 0 H GLY A 40 7.341 31.979 21.635 1.00 0.00 H new ATOM 0 HA2 GLY A 40 8.697 32.927 20.018 1.00 0.00 H new ATOM 0 HA3 GLY A 40 7.814 32.064 18.774 1.00 0.00 H new ATOM 586 N ASN A 41 6.025 34.399 20.108 1.00 0.00 N ATOM 587 CA ASN A 41 5.271 35.652 19.796 1.00 0.00 C ATOM 588 C ASN A 41 6.272 36.776 19.546 1.00 0.00 C ATOM 589 O ASN A 41 7.195 36.985 20.315 1.00 0.00 O ATOM 590 CB ASN A 41 4.352 36.064 20.955 1.00 0.00 C ATOM 591 CG ASN A 41 5.091 35.921 22.283 1.00 0.00 C ATOM 592 OD1 ASN A 41 5.581 34.862 22.621 1.00 0.00 O ATOM 593 ND2 ASN A 41 5.205 36.957 23.057 1.00 0.00 N ATOM 0 H ASN A 41 5.755 33.931 20.973 1.00 0.00 H new ATOM 0 HA ASN A 41 4.653 35.468 18.917 1.00 0.00 H new ATOM 0 HB2 ASN A 41 4.024 37.095 20.821 1.00 0.00 H new ATOM 0 HB3 ASN A 41 3.457 35.442 20.959 1.00 0.00 H new ATOM 0 HD21 ASN A 41 5.704 36.879 23.943 1.00 0.00 H new ATOM 0 HD22 ASN A 41 4.796 37.849 22.779 1.00 0.00 H new ATOM 600 N LEU A 42 6.079 37.498 18.490 1.00 0.00 N ATOM 601 CA LEU A 42 7.004 38.614 18.165 1.00 0.00 C ATOM 602 C LEU A 42 6.433 39.400 16.985 1.00 0.00 C ATOM 603 O LEU A 42 6.147 40.565 17.091 1.00 0.00 O ATOM 604 CB LEU A 42 8.388 38.044 17.808 1.00 0.00 C ATOM 605 CG LEU A 42 9.485 39.097 18.048 1.00 0.00 C ATOM 606 CD1 LEU A 42 10.131 38.909 19.427 1.00 0.00 C ATOM 607 CD2 LEU A 42 10.569 38.951 16.978 1.00 0.00 C ATOM 0 H LEU A 42 5.314 37.365 17.829 1.00 0.00 H new ATOM 0 HA LEU A 42 7.110 39.278 19.023 1.00 0.00 H new ATOM 0 HB2 LEU A 42 8.589 37.158 18.410 1.00 0.00 H new ATOM 0 HB3 LEU A 42 8.400 37.730 16.764 1.00 0.00 H new ATOM 0 HG LEU A 42 9.028 40.085 18.000 1.00 0.00 H new ATOM 0 HD11 LEU A 42 10.903 39.665 19.573 1.00 0.00 H new ATOM 0 HD12 LEU A 42 9.371 39.012 20.202 1.00 0.00 H new ATOM 0 HD13 LEU A 42 10.579 37.917 19.487 1.00 0.00 H new ATOM 0 HD21 LEU A 42 11.348 39.695 17.145 1.00 0.00 H new ATOM 0 HD22 LEU A 42 11.003 37.953 17.034 1.00 0.00 H new ATOM 0 HD23 LEU A 42 10.129 39.101 15.992 1.00 0.00 H new ATOM 619 N ALA A 43 6.231 38.763 15.867 1.00 0.00 N ATOM 620 CA ALA A 43 5.667 39.474 14.674 1.00 0.00 C ATOM 621 C ALA A 43 4.332 40.118 15.028 1.00 0.00 C ATOM 622 O ALA A 43 3.929 41.090 14.429 1.00 0.00 O ATOM 623 CB ALA A 43 5.424 38.467 13.540 1.00 0.00 C ATOM 0 H ALA A 43 6.432 37.774 15.722 1.00 0.00 H new ATOM 0 HA ALA A 43 6.378 40.238 14.361 1.00 0.00 H new ATOM 0 HB1 ALA A 43 5.014 38.986 12.674 1.00 0.00 H new ATOM 0 HB2 ALA A 43 6.367 37.993 13.266 1.00 0.00 H new ATOM 0 HB3 ALA A 43 4.719 37.706 13.874 1.00 0.00 H new ATOM 629 N ASP A 44 3.637 39.551 15.967 1.00 0.00 N ATOM 630 CA ASP A 44 2.303 40.087 16.362 1.00 0.00 C ATOM 631 C ASP A 44 2.488 41.402 17.112 1.00 0.00 C ATOM 632 O ASP A 44 2.070 42.455 16.672 1.00 0.00 O ATOM 633 CB ASP A 44 1.625 39.051 17.275 1.00 0.00 C ATOM 634 CG ASP A 44 2.701 38.354 18.100 1.00 0.00 C ATOM 635 OD1 ASP A 44 3.510 37.656 17.505 1.00 0.00 O ATOM 636 OD2 ASP A 44 2.702 38.515 19.308 1.00 0.00 O ATOM 0 H ASP A 44 3.938 38.727 16.487 1.00 0.00 H new ATOM 0 HA ASP A 44 1.686 40.270 15.482 1.00 0.00 H new ATOM 0 HB2 ASP A 44 0.903 39.539 17.930 1.00 0.00 H new ATOM 0 HB3 ASP A 44 1.075 38.323 16.679 1.00 0.00 H new ATOM 641 N VAL A 45 3.138 41.347 18.232 1.00 0.00 N ATOM 642 CA VAL A 45 3.367 42.572 19.022 1.00 0.00 C ATOM 643 C VAL A 45 4.382 43.458 18.282 1.00 0.00 C ATOM 644 O VAL A 45 4.353 44.672 18.372 1.00 0.00 O ATOM 645 CB VAL A 45 3.867 42.167 20.426 1.00 0.00 C ATOM 646 CG1 VAL A 45 2.798 41.329 21.146 1.00 0.00 C ATOM 647 CG2 VAL A 45 5.118 41.300 20.323 1.00 0.00 C ATOM 0 H VAL A 45 3.524 40.494 18.637 1.00 0.00 H new ATOM 0 HA VAL A 45 2.447 43.145 19.142 1.00 0.00 H new ATOM 0 HB VAL A 45 4.082 43.085 20.974 1.00 0.00 H new ATOM 0 HG11 VAL A 45 3.161 41.049 22.135 1.00 0.00 H new ATOM 0 HG12 VAL A 45 1.884 41.914 21.247 1.00 0.00 H new ATOM 0 HG13 VAL A 45 2.590 40.429 20.567 1.00 0.00 H new ATOM 0 HG21 VAL A 45 5.454 41.026 21.323 1.00 0.00 H new ATOM 0 HG22 VAL A 45 4.889 40.397 19.757 1.00 0.00 H new ATOM 0 HG23 VAL A 45 5.906 41.857 19.816 1.00 0.00 H new ATOM 657 N ALA A 46 5.278 42.841 17.559 1.00 0.00 N ATOM 658 CA ALA A 46 6.312 43.590 16.805 1.00 0.00 C ATOM 659 C ALA A 46 6.507 42.967 15.399 1.00 0.00 C ATOM 660 O ALA A 46 7.458 42.236 15.166 1.00 0.00 O ATOM 661 CB ALA A 46 7.603 43.471 17.600 1.00 0.00 C ATOM 0 H ALA A 46 5.333 41.827 17.461 1.00 0.00 H new ATOM 0 HA ALA A 46 6.019 44.632 16.674 1.00 0.00 H new ATOM 0 HB1 ALA A 46 8.399 44.008 17.084 1.00 0.00 H new ATOM 0 HB2 ALA A 46 7.460 43.899 18.592 1.00 0.00 H new ATOM 0 HB3 ALA A 46 7.877 42.420 17.694 1.00 0.00 H new ATOM 667 N PRO A 47 5.625 43.254 14.466 1.00 0.00 N ATOM 668 CA PRO A 47 5.721 42.698 13.080 1.00 0.00 C ATOM 669 C PRO A 47 7.004 43.095 12.333 1.00 0.00 C ATOM 670 O PRO A 47 6.948 43.598 11.226 1.00 0.00 O ATOM 671 CB PRO A 47 4.483 43.240 12.353 1.00 0.00 C ATOM 672 CG PRO A 47 3.580 43.805 13.409 1.00 0.00 C ATOM 673 CD PRO A 47 4.447 44.123 14.631 1.00 0.00 C ATOM 0 HA PRO A 47 5.761 41.609 13.117 1.00 0.00 H new ATOM 0 HB2 PRO A 47 4.762 44.007 11.631 1.00 0.00 H new ATOM 0 HB3 PRO A 47 3.982 42.447 11.798 1.00 0.00 H new ATOM 0 HG2 PRO A 47 3.082 44.705 13.047 1.00 0.00 H new ATOM 0 HG3 PRO A 47 2.799 43.091 13.668 1.00 0.00 H new ATOM 0 HD2 PRO A 47 4.728 45.176 14.658 1.00 0.00 H new ATOM 0 HD3 PRO A 47 3.920 43.909 15.561 1.00 0.00 H new ATOM 681 N GLY A 48 8.151 42.829 12.902 1.00 0.00 N ATOM 682 CA GLY A 48 9.430 43.165 12.195 1.00 0.00 C ATOM 683 C GLY A 48 10.484 43.685 13.181 1.00 0.00 C ATOM 684 O GLY A 48 11.175 44.648 12.905 1.00 0.00 O ATOM 0 H GLY A 48 8.261 42.397 13.819 1.00 0.00 H new ATOM 0 HA2 GLY A 48 9.810 42.280 11.684 1.00 0.00 H new ATOM 0 HA3 GLY A 48 9.240 43.918 11.430 1.00 0.00 H new ATOM 688 N LYS A 49 10.625 43.053 14.322 1.00 0.00 N ATOM 689 CA LYS A 49 11.648 43.508 15.317 1.00 0.00 C ATOM 690 C LYS A 49 12.619 42.369 15.620 1.00 0.00 C ATOM 691 O LYS A 49 12.241 41.217 15.658 1.00 0.00 O ATOM 692 CB LYS A 49 10.970 43.935 16.623 1.00 0.00 C ATOM 693 CG LYS A 49 11.846 44.983 17.325 1.00 0.00 C ATOM 694 CD LYS A 49 10.965 45.982 18.081 1.00 0.00 C ATOM 695 CE LYS A 49 11.814 47.163 18.550 1.00 0.00 C ATOM 696 NZ LYS A 49 11.103 47.861 19.656 1.00 0.00 N ATOM 0 H LYS A 49 10.076 42.242 14.607 1.00 0.00 H new ATOM 0 HA LYS A 49 12.186 44.355 14.892 1.00 0.00 H new ATOM 0 HB2 LYS A 49 9.983 44.348 16.416 1.00 0.00 H new ATOM 0 HB3 LYS A 49 10.825 43.071 17.271 1.00 0.00 H new ATOM 0 HG2 LYS A 49 12.530 44.492 18.018 1.00 0.00 H new ATOM 0 HG3 LYS A 49 12.458 45.508 16.591 1.00 0.00 H new ATOM 0 HD2 LYS A 49 10.160 46.334 17.435 1.00 0.00 H new ATOM 0 HD3 LYS A 49 10.497 45.495 18.937 1.00 0.00 H new ATOM 0 HE2 LYS A 49 12.789 46.814 18.890 1.00 0.00 H new ATOM 0 HE3 LYS A 49 11.992 47.851 17.723 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 11.674 48.667 19.982 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 10.182 48.204 19.315 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 10.955 47.200 20.445 1.00 0.00 H new ATOM 710 N SER A 50 13.868 42.679 15.846 1.00 0.00 N ATOM 711 CA SER A 50 14.852 41.595 16.153 1.00 0.00 C ATOM 712 C SER A 50 15.408 41.794 17.569 1.00 0.00 C ATOM 713 O SER A 50 15.750 42.888 17.961 1.00 0.00 O ATOM 714 CB SER A 50 15.982 41.627 15.118 1.00 0.00 C ATOM 715 OG SER A 50 15.417 41.644 13.806 1.00 0.00 O ATOM 0 H SER A 50 14.249 43.625 15.832 1.00 0.00 H new ATOM 0 HA SER A 50 14.361 40.623 16.106 1.00 0.00 H new ATOM 0 HB2 SER A 50 16.606 42.508 15.270 1.00 0.00 H new ATOM 0 HB3 SER A 50 16.626 40.756 15.238 1.00 0.00 H new ATOM 0 HG SER A 50 16.136 41.666 13.140 1.00 0.00 H new ATOM 721 N ILE A 51 15.496 40.741 18.347 1.00 0.00 N ATOM 722 CA ILE A 51 16.024 40.885 19.744 1.00 0.00 C ATOM 723 C ILE A 51 17.520 41.186 19.682 1.00 0.00 C ATOM 724 O ILE A 51 18.186 40.873 18.711 1.00 0.00 O ATOM 725 CB ILE A 51 15.788 39.593 20.561 1.00 0.00 C ATOM 726 CG1 ILE A 51 14.566 38.828 20.028 1.00 0.00 C ATOM 727 CG2 ILE A 51 15.549 39.943 22.036 1.00 0.00 C ATOM 728 CD1 ILE A 51 13.303 39.689 20.141 1.00 0.00 C ATOM 0 H ILE A 51 15.228 39.794 18.079 1.00 0.00 H new ATOM 0 HA ILE A 51 15.496 41.701 20.237 1.00 0.00 H new ATOM 0 HB ILE A 51 16.674 38.965 20.465 1.00 0.00 H new ATOM 0 HG12 ILE A 51 14.730 38.548 18.988 1.00 0.00 H new ATOM 0 HG13 ILE A 51 14.435 37.903 20.590 1.00 0.00 H new ATOM 0 HG21 ILE A 51 15.384 39.028 22.605 1.00 0.00 H new ATOM 0 HG22 ILE A 51 16.421 40.464 22.432 1.00 0.00 H new ATOM 0 HG23 ILE A 51 14.673 40.586 22.120 1.00 0.00 H new ATOM 0 HD11 ILE A 51 12.447 39.132 19.759 1.00 0.00 H new ATOM 0 HD12 ILE A 51 13.131 39.947 21.186 1.00 0.00 H new ATOM 0 HD13 ILE A 51 13.431 40.601 19.558 1.00 0.00 H new ATOM 740 N GLY A 52 18.060 41.782 20.710 1.00 0.00 N ATOM 741 CA GLY A 52 19.520 42.102 20.704 1.00 0.00 C ATOM 742 C GLY A 52 19.777 43.378 21.507 1.00 0.00 C ATOM 743 O GLY A 52 18.912 44.226 21.640 1.00 0.00 O ATOM 0 H GLY A 52 17.557 42.061 21.552 1.00 0.00 H new ATOM 0 HA2 GLY A 52 20.084 41.273 21.131 1.00 0.00 H new ATOM 0 HA3 GLY A 52 19.869 42.230 19.679 1.00 0.00 H new ATOM 747 N GLY A 53 20.968 43.527 22.033 1.00 0.00 N ATOM 748 CA GLY A 53 21.297 44.758 22.817 1.00 0.00 C ATOM 749 C GLY A 53 21.526 44.413 24.293 1.00 0.00 C ATOM 750 O GLY A 53 21.502 45.280 25.143 1.00 0.00 O ATOM 0 H GLY A 53 21.726 42.850 21.953 1.00 0.00 H new ATOM 0 HA2 GLY A 53 22.189 45.230 22.406 1.00 0.00 H new ATOM 0 HA3 GLY A 53 20.485 45.480 22.728 1.00 0.00 H new ATOM 754 N ASP A 54 21.727 43.160 24.611 1.00 0.00 N ATOM 755 CA ASP A 54 21.947 42.765 26.039 1.00 0.00 C ATOM 756 C ASP A 54 23.323 43.245 26.519 1.00 0.00 C ATOM 757 O ASP A 54 23.966 44.053 25.879 1.00 0.00 O ATOM 758 CB ASP A 54 21.856 41.244 26.134 1.00 0.00 C ATOM 759 CG ASP A 54 20.887 40.766 25.070 1.00 0.00 C ATOM 760 OD1 ASP A 54 19.707 40.714 25.355 1.00 0.00 O ATOM 761 OD2 ASP A 54 21.334 40.494 23.970 1.00 0.00 O ATOM 0 H ASP A 54 21.749 42.390 23.943 1.00 0.00 H new ATOM 0 HA ASP A 54 21.190 43.225 26.673 1.00 0.00 H new ATOM 0 HB2 ASP A 54 22.837 40.793 25.986 1.00 0.00 H new ATOM 0 HB3 ASP A 54 21.513 40.944 27.124 1.00 0.00 H new ATOM 766 N ILE A 55 23.764 42.776 27.660 1.00 0.00 N ATOM 767 CA ILE A 55 25.090 43.225 28.197 1.00 0.00 C ATOM 768 C ILE A 55 25.928 42.031 28.671 1.00 0.00 C ATOM 769 O ILE A 55 25.464 41.194 29.423 1.00 0.00 O ATOM 770 CB ILE A 55 24.841 44.145 29.383 1.00 0.00 C ATOM 771 CG1 ILE A 55 24.105 45.403 28.909 1.00 0.00 C ATOM 772 CG2 ILE A 55 26.174 44.539 30.017 1.00 0.00 C ATOM 773 CD1 ILE A 55 25.052 46.275 28.079 1.00 0.00 C ATOM 0 H ILE A 55 23.266 42.103 28.243 1.00 0.00 H new ATOM 0 HA ILE A 55 25.634 43.739 27.404 1.00 0.00 H new ATOM 0 HB ILE A 55 24.231 43.625 30.122 1.00 0.00 H new ATOM 0 HG12 ILE A 55 23.236 45.124 28.313 1.00 0.00 H new ATOM 0 HG13 ILE A 55 23.736 45.965 29.767 1.00 0.00 H new ATOM 0 HG21 ILE A 55 25.992 45.198 30.866 1.00 0.00 H new ATOM 0 HG22 ILE A 55 26.694 43.643 30.357 1.00 0.00 H new ATOM 0 HG23 ILE A 55 26.788 45.057 29.281 1.00 0.00 H new ATOM 0 HD11 ILE A 55 24.525 47.168 27.744 1.00 0.00 H new ATOM 0 HD12 ILE A 55 25.907 46.566 28.689 1.00 0.00 H new ATOM 0 HD13 ILE A 55 25.399 45.712 27.212 1.00 0.00 H new ATOM 785 N PHE A 56 27.159 41.944 28.234 1.00 0.00 N ATOM 786 CA PHE A 56 28.021 40.810 28.668 1.00 0.00 C ATOM 787 C PHE A 56 29.471 41.293 28.872 1.00 0.00 C ATOM 788 O PHE A 56 29.935 42.199 28.196 1.00 0.00 O ATOM 789 CB PHE A 56 27.969 39.722 27.601 1.00 0.00 C ATOM 790 CG PHE A 56 28.316 38.396 28.226 1.00 0.00 C ATOM 791 CD1 PHE A 56 27.426 37.793 29.125 1.00 0.00 C ATOM 792 CD2 PHE A 56 29.527 37.771 27.909 1.00 0.00 C ATOM 793 CE1 PHE A 56 27.748 36.562 29.707 1.00 0.00 C ATOM 794 CE2 PHE A 56 29.851 36.538 28.490 1.00 0.00 C ATOM 795 CZ PHE A 56 28.961 35.933 29.390 1.00 0.00 C ATOM 0 H PHE A 56 27.600 42.608 27.598 1.00 0.00 H new ATOM 0 HA PHE A 56 27.660 40.411 29.616 1.00 0.00 H new ATOM 0 HB2 PHE A 56 26.974 39.679 27.157 1.00 0.00 H new ATOM 0 HB3 PHE A 56 28.667 39.952 26.796 1.00 0.00 H new ATOM 0 HD1 PHE A 56 26.492 38.278 29.368 1.00 0.00 H new ATOM 0 HD2 PHE A 56 30.212 38.239 27.217 1.00 0.00 H new ATOM 0 HE1 PHE A 56 27.063 36.096 30.400 1.00 0.00 H new ATOM 0 HE2 PHE A 56 30.785 36.054 28.245 1.00 0.00 H new ATOM 0 HZ PHE A 56 29.210 34.983 29.839 1.00 0.00 H new ATOM 805 N SER A 57 30.186 40.699 29.807 1.00 0.00 N ATOM 806 CA SER A 57 31.601 41.125 30.071 1.00 0.00 C ATOM 807 C SER A 57 32.587 40.235 29.303 1.00 0.00 C ATOM 808 O SER A 57 33.732 40.590 29.122 1.00 0.00 O ATOM 809 CB SER A 57 31.890 41.042 31.571 1.00 0.00 C ATOM 810 OG SER A 57 30.881 40.251 32.204 1.00 0.00 O ATOM 0 H SER A 57 29.849 39.938 30.397 1.00 0.00 H new ATOM 0 HA SER A 57 31.725 42.153 29.731 1.00 0.00 H new ATOM 0 HB2 SER A 57 32.873 40.602 31.740 1.00 0.00 H new ATOM 0 HB3 SER A 57 31.910 42.042 32.005 1.00 0.00 H new ATOM 0 HG SER A 57 30.839 39.371 31.775 1.00 0.00 H new ATOM 816 N ASN A 58 32.153 39.089 28.845 1.00 0.00 N ATOM 817 CA ASN A 58 33.060 38.183 28.067 1.00 0.00 C ATOM 818 C ASN A 58 34.176 37.593 28.948 1.00 0.00 C ATOM 819 O ASN A 58 35.229 37.222 28.459 1.00 0.00 O ATOM 820 CB ASN A 58 33.674 38.969 26.901 1.00 0.00 C ATOM 821 CG ASN A 58 34.353 38.006 25.919 1.00 0.00 C ATOM 822 OD1 ASN A 58 33.964 36.861 25.802 1.00 0.00 O ATOM 823 ND2 ASN A 58 35.352 38.418 25.198 1.00 0.00 N ATOM 0 H ASN A 58 31.205 38.737 28.976 1.00 0.00 H new ATOM 0 HA ASN A 58 32.468 37.349 27.690 1.00 0.00 H new ATOM 0 HB2 ASN A 58 32.899 39.539 26.388 1.00 0.00 H new ATOM 0 HB3 ASN A 58 34.401 39.688 27.279 1.00 0.00 H new ATOM 0 HD21 ASN A 58 35.803 37.782 24.540 1.00 0.00 H new ATOM 0 HD22 ASN A 58 35.685 39.378 25.289 1.00 0.00 H new ATOM 830 N ARG A 59 33.947 37.466 30.228 1.00 0.00 N ATOM 831 CA ARG A 59 34.985 36.856 31.124 1.00 0.00 C ATOM 832 C ARG A 59 35.361 35.487 30.570 1.00 0.00 C ATOM 833 O ARG A 59 36.483 35.033 30.689 1.00 0.00 O ATOM 834 CB ARG A 59 34.404 36.620 32.517 1.00 0.00 C ATOM 835 CG ARG A 59 34.766 37.763 33.469 1.00 0.00 C ATOM 836 CD ARG A 59 34.076 37.507 34.815 1.00 0.00 C ATOM 837 NE ARG A 59 32.684 37.002 34.556 1.00 0.00 N ATOM 838 CZ ARG A 59 31.893 37.642 33.743 1.00 0.00 C ATOM 839 NH1 ARG A 59 32.149 38.871 33.434 1.00 0.00 N ATOM 840 NH2 ARG A 59 30.821 37.075 33.293 1.00 0.00 N ATOM 0 H ARG A 59 33.088 37.757 30.696 1.00 0.00 H new ATOM 0 HA ARG A 59 35.842 37.527 31.175 1.00 0.00 H new ATOM 0 HB2 ARG A 59 33.320 36.528 32.451 1.00 0.00 H new ATOM 0 HB3 ARG A 59 34.780 35.678 32.916 1.00 0.00 H new ATOM 0 HG2 ARG A 59 35.847 37.819 33.601 1.00 0.00 H new ATOM 0 HG3 ARG A 59 34.446 38.719 33.054 1.00 0.00 H new ATOM 0 HD2 ARG A 59 34.640 36.778 35.396 1.00 0.00 H new ATOM 0 HD3 ARG A 59 34.042 38.425 35.402 1.00 0.00 H new ATOM 0 HE ARG A 59 32.357 36.154 35.019 1.00 0.00 H new ATOM 0 HH11 ARG A 59 32.968 39.336 33.827 1.00 0.00 H new ATOM 0 HH12 ARG A 59 31.532 39.376 32.798 1.00 0.00 H new ATOM 0 HH21 ARG A 59 30.592 36.122 33.575 1.00 0.00 H new ATOM 0 HH22 ARG A 59 30.205 37.581 32.657 1.00 0.00 H new ATOM 854 N GLU A 60 34.402 34.812 30.010 1.00 0.00 N ATOM 855 CA GLU A 60 34.645 33.454 29.470 1.00 0.00 C ATOM 856 C GLU A 60 35.655 33.537 28.317 1.00 0.00 C ATOM 857 O GLU A 60 36.210 32.543 27.894 1.00 0.00 O ATOM 858 CB GLU A 60 33.312 32.875 28.987 1.00 0.00 C ATOM 859 CG GLU A 60 32.395 32.587 30.196 1.00 0.00 C ATOM 860 CD GLU A 60 32.058 33.881 30.958 1.00 0.00 C ATOM 861 OE1 GLU A 60 31.938 34.917 30.319 1.00 0.00 O ATOM 862 OE2 GLU A 60 31.937 33.820 32.169 1.00 0.00 O ATOM 0 H GLU A 60 33.446 35.150 29.903 1.00 0.00 H new ATOM 0 HA GLU A 60 35.058 32.803 30.241 1.00 0.00 H new ATOM 0 HB2 GLU A 60 32.825 33.576 28.309 1.00 0.00 H new ATOM 0 HB3 GLU A 60 33.486 31.957 28.425 1.00 0.00 H new ATOM 0 HG2 GLU A 60 31.475 32.113 29.854 1.00 0.00 H new ATOM 0 HG3 GLU A 60 32.885 31.883 30.868 1.00 0.00 H new ATOM 869 N GLY A 61 35.920 34.725 27.833 1.00 0.00 N ATOM 870 CA GLY A 61 36.920 34.898 26.735 1.00 0.00 C ATOM 871 C GLY A 61 36.449 34.221 25.446 1.00 0.00 C ATOM 872 O GLY A 61 37.241 33.682 24.699 1.00 0.00 O ATOM 0 H GLY A 61 35.483 35.589 28.154 1.00 0.00 H new ATOM 0 HA2 GLY A 61 37.083 35.960 26.552 1.00 0.00 H new ATOM 0 HA3 GLY A 61 37.877 34.476 27.042 1.00 0.00 H new ATOM 876 N LYS A 62 35.178 34.255 25.163 1.00 0.00 N ATOM 877 CA LYS A 62 34.678 33.624 23.910 1.00 0.00 C ATOM 878 C LYS A 62 34.812 34.629 22.764 1.00 0.00 C ATOM 879 O LYS A 62 34.720 34.266 21.602 1.00 0.00 O ATOM 880 CB LYS A 62 33.207 33.232 24.086 1.00 0.00 C ATOM 881 CG LYS A 62 32.947 31.867 23.432 1.00 0.00 C ATOM 882 CD LYS A 62 32.507 32.063 21.971 1.00 0.00 C ATOM 883 CE LYS A 62 33.496 31.377 21.020 1.00 0.00 C ATOM 884 NZ LYS A 62 34.273 32.418 20.286 1.00 0.00 N ATOM 0 H LYS A 62 34.463 34.692 25.745 1.00 0.00 H new ATOM 0 HA LYS A 62 35.260 32.730 23.685 1.00 0.00 H new ATOM 0 HB2 LYS A 62 32.957 33.190 25.146 1.00 0.00 H new ATOM 0 HB3 LYS A 62 32.564 33.989 23.637 1.00 0.00 H new ATOM 0 HG2 LYS A 62 33.850 31.257 23.471 1.00 0.00 H new ATOM 0 HG3 LYS A 62 32.176 31.330 23.984 1.00 0.00 H new ATOM 0 HD2 LYS A 62 31.508 31.651 21.827 1.00 0.00 H new ATOM 0 HD3 LYS A 62 32.449 33.127 21.741 1.00 0.00 H new ATOM 0 HE2 LYS A 62 34.171 30.731 21.582 1.00 0.00 H new ATOM 0 HE3 LYS A 62 32.960 30.742 20.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 35.186 32.021 19.984 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 33.736 32.727 19.451 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 34.440 33.232 20.911 1.00 0.00 H new ATOM 898 N LEU A 63 35.029 35.885 23.089 1.00 0.00 N ATOM 899 CA LEU A 63 35.177 36.938 22.037 1.00 0.00 C ATOM 900 C LEU A 63 36.371 37.832 22.397 1.00 0.00 C ATOM 901 O LEU A 63 36.861 37.793 23.510 1.00 0.00 O ATOM 902 CB LEU A 63 33.890 37.771 21.977 1.00 0.00 C ATOM 903 CG LEU A 63 32.742 36.907 21.450 1.00 0.00 C ATOM 904 CD1 LEU A 63 31.417 37.618 21.691 1.00 0.00 C ATOM 905 CD2 LEU A 63 32.918 36.667 19.951 1.00 0.00 C ATOM 0 H LEU A 63 35.110 36.225 24.047 1.00 0.00 H new ATOM 0 HA LEU A 63 35.350 36.481 21.063 1.00 0.00 H new ATOM 0 HB2 LEU A 63 33.646 38.153 22.968 1.00 0.00 H new ATOM 0 HB3 LEU A 63 34.035 38.636 21.329 1.00 0.00 H new ATOM 0 HG LEU A 63 32.747 35.951 21.973 1.00 0.00 H new ATOM 0 HD11 LEU A 63 30.600 37.002 21.315 1.00 0.00 H new ATOM 0 HD12 LEU A 63 31.283 37.786 22.760 1.00 0.00 H new ATOM 0 HD13 LEU A 63 31.418 38.576 21.171 1.00 0.00 H new ATOM 0 HD21 LEU A 63 32.098 36.051 19.582 1.00 0.00 H new ATOM 0 HD22 LEU A 63 32.918 37.623 19.427 1.00 0.00 H new ATOM 0 HD23 LEU A 63 33.864 36.155 19.773 1.00 0.00 H new ATOM 917 N PRO A 64 36.858 38.619 21.462 1.00 0.00 N ATOM 918 CA PRO A 64 38.023 39.522 21.701 1.00 0.00 C ATOM 919 C PRO A 64 37.955 40.227 23.063 1.00 0.00 C ATOM 920 O PRO A 64 36.886 40.611 23.528 1.00 0.00 O ATOM 921 CB PRO A 64 37.926 40.530 20.559 1.00 0.00 C ATOM 922 CG PRO A 64 37.299 39.774 19.435 1.00 0.00 C ATOM 923 CD PRO A 64 36.361 38.742 20.076 1.00 0.00 C ATOM 0 HA PRO A 64 38.966 38.975 21.723 1.00 0.00 H new ATOM 0 HB2 PRO A 64 37.321 41.391 20.842 1.00 0.00 H new ATOM 0 HB3 PRO A 64 38.910 40.909 20.281 1.00 0.00 H new ATOM 0 HG2 PRO A 64 36.747 40.444 18.777 1.00 0.00 H new ATOM 0 HG3 PRO A 64 38.058 39.283 18.826 1.00 0.00 H new ATOM 0 HD2 PRO A 64 35.324 39.076 20.052 1.00 0.00 H new ATOM 0 HD3 PRO A 64 36.400 37.787 19.552 1.00 0.00 H new ATOM 931 N GLY A 65 39.084 40.386 23.706 1.00 0.00 N ATOM 932 CA GLY A 65 39.106 41.055 25.042 1.00 0.00 C ATOM 933 C GLY A 65 40.298 42.015 25.123 1.00 0.00 C ATOM 934 O GLY A 65 40.904 42.354 24.123 1.00 0.00 O ATOM 0 H GLY A 65 39.994 40.080 23.362 1.00 0.00 H new ATOM 0 HA2 GLY A 65 38.176 41.601 25.201 1.00 0.00 H new ATOM 0 HA3 GLY A 65 39.175 40.307 25.832 1.00 0.00 H new ATOM 938 N LYS A 66 40.623 42.456 26.310 1.00 0.00 N ATOM 939 CA LYS A 66 41.760 43.415 26.518 1.00 0.00 C ATOM 940 C LYS A 66 41.750 43.834 27.995 1.00 0.00 C ATOM 941 O LYS A 66 41.190 43.156 28.836 1.00 0.00 O ATOM 942 CB LYS A 66 41.551 44.660 25.625 1.00 0.00 C ATOM 943 CG LYS A 66 40.258 45.387 26.021 1.00 0.00 C ATOM 944 CD LYS A 66 40.211 46.746 25.316 1.00 0.00 C ATOM 945 CE LYS A 66 40.139 47.876 26.351 1.00 0.00 C ATOM 946 NZ LYS A 66 38.734 48.019 26.852 1.00 0.00 N ATOM 0 H LYS A 66 40.139 42.188 27.167 1.00 0.00 H new ATOM 0 HA LYS A 66 42.711 42.950 26.258 1.00 0.00 H new ATOM 0 HB2 LYS A 66 42.401 45.335 25.725 1.00 0.00 H new ATOM 0 HB3 LYS A 66 41.503 44.361 24.578 1.00 0.00 H new ATOM 0 HG2 LYS A 66 39.390 44.789 25.743 1.00 0.00 H new ATOM 0 HG3 LYS A 66 40.219 45.523 27.102 1.00 0.00 H new ATOM 0 HD2 LYS A 66 41.095 46.871 24.691 1.00 0.00 H new ATOM 0 HD3 LYS A 66 39.345 46.792 24.656 1.00 0.00 H new ATOM 0 HE2 LYS A 66 40.811 47.663 27.182 1.00 0.00 H new ATOM 0 HE3 LYS A 66 40.472 48.813 25.904 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 38.663 48.869 27.448 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 38.085 48.107 26.044 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 38.478 47.181 27.412 1.00 0.00 H new ATOM 960 N SER A 67 42.285 44.980 28.309 1.00 0.00 N ATOM 961 CA SER A 67 42.238 45.463 29.718 1.00 0.00 C ATOM 962 C SER A 67 40.791 45.876 30.031 1.00 0.00 C ATOM 963 O SER A 67 40.446 47.049 30.025 1.00 0.00 O ATOM 964 CB SER A 67 43.181 46.658 29.872 1.00 0.00 C ATOM 965 OG SER A 67 42.532 47.832 29.405 1.00 0.00 O ATOM 0 H SER A 67 42.753 45.604 27.651 1.00 0.00 H new ATOM 0 HA SER A 67 42.554 44.681 30.409 1.00 0.00 H new ATOM 0 HB2 SER A 67 43.467 46.778 30.917 1.00 0.00 H new ATOM 0 HB3 SER A 67 44.098 46.487 29.308 1.00 0.00 H new ATOM 0 HG SER A 67 41.718 47.986 29.928 1.00 0.00 H new ATOM 971 N GLY A 68 39.945 44.902 30.265 1.00 0.00 N ATOM 972 CA GLY A 68 38.500 45.182 30.551 1.00 0.00 C ATOM 973 C GLY A 68 37.762 45.360 29.222 1.00 0.00 C ATOM 974 O GLY A 68 37.988 46.330 28.499 1.00 0.00 O ATOM 0 H GLY A 68 40.196 43.913 30.270 1.00 0.00 H new ATOM 0 HA2 GLY A 68 38.062 44.362 31.120 1.00 0.00 H new ATOM 0 HA3 GLY A 68 38.403 46.080 31.161 1.00 0.00 H new ATOM 978 N ARG A 69 36.903 44.430 28.873 1.00 0.00 N ATOM 979 CA ARG A 69 36.172 44.536 27.573 1.00 0.00 C ATOM 980 C ARG A 69 34.661 44.376 27.783 1.00 0.00 C ATOM 981 O ARG A 69 34.212 43.674 28.678 1.00 0.00 O ATOM 982 CB ARG A 69 36.672 43.428 26.635 1.00 0.00 C ATOM 983 CG ARG A 69 35.971 43.525 25.270 1.00 0.00 C ATOM 984 CD ARG A 69 36.695 44.553 24.395 1.00 0.00 C ATOM 985 NE ARG A 69 38.025 43.988 24.007 1.00 0.00 N ATOM 986 CZ ARG A 69 38.799 44.582 23.149 1.00 0.00 C ATOM 987 NH1 ARG A 69 38.445 45.709 22.611 1.00 0.00 N ATOM 988 NH2 ARG A 69 39.945 44.046 22.838 1.00 0.00 N ATOM 0 H ARG A 69 36.679 43.606 29.431 1.00 0.00 H new ATOM 0 HA ARG A 69 36.359 45.519 27.140 1.00 0.00 H new ATOM 0 HB2 ARG A 69 37.751 43.513 26.504 1.00 0.00 H new ATOM 0 HB3 ARG A 69 36.481 42.452 27.081 1.00 0.00 H new ATOM 0 HG2 ARG A 69 35.970 42.551 24.780 1.00 0.00 H new ATOM 0 HG3 ARG A 69 34.929 43.816 25.404 1.00 0.00 H new ATOM 0 HD2 ARG A 69 36.105 44.778 23.507 1.00 0.00 H new ATOM 0 HD3 ARG A 69 36.824 45.489 24.938 1.00 0.00 H new ATOM 0 HE ARG A 69 38.333 43.111 24.428 1.00 0.00 H new ATOM 0 HH11 ARG A 69 37.553 46.135 22.861 1.00 0.00 H new ATOM 0 HH12 ARG A 69 39.059 46.168 21.938 1.00 0.00 H new ATOM 0 HH21 ARG A 69 40.229 43.166 23.267 1.00 0.00 H new ATOM 0 HH22 ARG A 69 40.558 44.507 22.165 1.00 0.00 H new ATOM 1002 N THR A 70 33.877 45.001 26.934 1.00 0.00 N ATOM 1003 CA THR A 70 32.387 44.879 27.025 1.00 0.00 C ATOM 1004 C THR A 70 31.899 44.137 25.782 1.00 0.00 C ATOM 1005 O THR A 70 32.268 44.502 24.679 1.00 0.00 O ATOM 1006 CB THR A 70 31.748 46.262 26.998 1.00 0.00 C ATOM 1007 OG1 THR A 70 31.890 46.791 25.689 1.00 0.00 O ATOM 1008 CG2 THR A 70 32.425 47.192 28.002 1.00 0.00 C ATOM 0 H THR A 70 34.210 45.596 26.175 1.00 0.00 H new ATOM 0 HA THR A 70 32.123 44.359 27.946 1.00 0.00 H new ATOM 0 HB THR A 70 30.695 46.181 27.268 1.00 0.00 H new ATOM 0 HG1 THR A 70 32.712 46.445 25.284 1.00 0.00 H new ATOM 0 HG21 THR A 70 31.952 48.173 27.965 1.00 0.00 H new ATOM 0 HG22 THR A 70 32.325 46.779 29.006 1.00 0.00 H new ATOM 0 HG23 THR A 70 33.482 47.289 27.753 1.00 0.00 H new ATOM 1016 N TRP A 71 31.082 43.121 25.920 1.00 0.00 N ATOM 1017 CA TRP A 71 30.602 42.400 24.697 1.00 0.00 C ATOM 1018 C TRP A 71 29.065 42.332 24.671 1.00 0.00 C ATOM 1019 O TRP A 71 28.426 42.137 25.687 1.00 0.00 O ATOM 1020 CB TRP A 71 31.193 40.980 24.669 1.00 0.00 C ATOM 1021 CG TRP A 71 32.440 41.000 23.844 1.00 0.00 C ATOM 1022 CD1 TRP A 71 33.704 40.869 24.313 1.00 0.00 C ATOM 1023 CD2 TRP A 71 32.554 41.184 22.408 1.00 0.00 C ATOM 1024 NE1 TRP A 71 34.585 40.966 23.249 1.00 0.00 N ATOM 1025 CE2 TRP A 71 33.925 41.166 22.058 1.00 0.00 C ATOM 1026 CE3 TRP A 71 31.607 41.369 21.383 1.00 0.00 C ATOM 1027 CZ2 TRP A 71 34.343 41.329 20.739 1.00 0.00 C ATOM 1028 CZ3 TRP A 71 32.025 41.532 20.050 1.00 0.00 C ATOM 1029 CH2 TRP A 71 33.392 41.515 19.730 1.00 0.00 C ATOM 0 H TRP A 71 30.731 42.764 26.809 1.00 0.00 H new ATOM 0 HA TRP A 71 30.934 42.949 23.816 1.00 0.00 H new ATOM 0 HB2 TRP A 71 31.414 40.642 25.681 1.00 0.00 H new ATOM 0 HB3 TRP A 71 30.472 40.278 24.249 1.00 0.00 H new ATOM 0 HD1 TRP A 71 33.979 40.714 25.346 1.00 0.00 H new ATOM 0 HE1 TRP A 71 35.599 40.898 23.337 1.00 0.00 H new ATOM 0 HE3 TRP A 71 30.554 41.386 21.621 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 35.395 41.312 20.497 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 31.292 41.671 19.269 1.00 0.00 H new ATOM 0 HH2 TRP A 71 33.709 41.645 18.706 1.00 0.00 H new ATOM 1040 N ARG A 72 28.472 42.493 23.511 1.00 0.00 N ATOM 1041 CA ARG A 72 26.979 42.445 23.402 1.00 0.00 C ATOM 1042 C ARG A 72 26.583 41.776 22.069 1.00 0.00 C ATOM 1043 O ARG A 72 27.325 41.821 21.101 1.00 0.00 O ATOM 1044 CB ARG A 72 26.426 43.880 23.449 1.00 0.00 C ATOM 1045 CG ARG A 72 26.683 44.500 24.831 1.00 0.00 C ATOM 1046 CD ARG A 72 27.899 45.418 24.738 1.00 0.00 C ATOM 1047 NE ARG A 72 27.470 46.686 24.064 1.00 0.00 N ATOM 1048 CZ ARG A 72 28.273 47.703 23.962 1.00 0.00 C ATOM 1049 NH1 ARG A 72 29.518 47.596 24.309 1.00 0.00 N ATOM 1050 NH2 ARG A 72 27.831 48.820 23.477 1.00 0.00 N ATOM 0 H ARG A 72 28.961 42.656 22.631 1.00 0.00 H new ATOM 0 HA ARG A 72 26.565 41.868 24.229 1.00 0.00 H new ATOM 0 HB2 ARG A 72 26.899 44.486 22.676 1.00 0.00 H new ATOM 0 HB3 ARG A 72 25.357 43.873 23.238 1.00 0.00 H new ATOM 0 HG2 ARG A 72 25.810 45.062 25.161 1.00 0.00 H new ATOM 0 HG3 ARG A 72 26.856 43.717 25.570 1.00 0.00 H new ATOM 0 HD2 ARG A 72 28.294 45.629 25.732 1.00 0.00 H new ATOM 0 HD3 ARG A 72 28.697 44.937 24.173 1.00 0.00 H new ATOM 0 HE ARG A 72 26.528 46.752 23.677 1.00 0.00 H new ATOM 0 HH11 ARG A 72 29.874 46.709 24.665 1.00 0.00 H new ATOM 0 HH12 ARG A 72 30.141 48.399 24.226 1.00 0.00 H new ATOM 0 HH21 ARG A 72 26.859 48.897 23.178 1.00 0.00 H new ATOM 0 HH22 ARG A 72 28.455 49.622 23.394 1.00 0.00 H new ATOM 1064 N GLU A 73 25.423 41.167 22.007 1.00 0.00 N ATOM 1065 CA GLU A 73 24.995 40.495 20.748 1.00 0.00 C ATOM 1066 C GLU A 73 23.692 41.095 20.183 1.00 0.00 C ATOM 1067 O GLU A 73 23.078 41.988 20.757 1.00 0.00 O ATOM 1068 CB GLU A 73 24.783 39.011 21.039 1.00 0.00 C ATOM 1069 CG GLU A 73 23.610 38.846 22.012 1.00 0.00 C ATOM 1070 CD GLU A 73 22.415 38.270 21.261 1.00 0.00 C ATOM 1071 OE1 GLU A 73 22.512 37.153 20.777 1.00 0.00 O ATOM 1072 OE2 GLU A 73 21.408 38.951 21.189 1.00 0.00 O ATOM 0 H GLU A 73 24.756 41.108 22.777 1.00 0.00 H new ATOM 0 HA GLU A 73 25.774 40.642 20.000 1.00 0.00 H new ATOM 0 HB2 GLU A 73 24.580 38.473 20.113 1.00 0.00 H new ATOM 0 HB3 GLU A 73 25.688 38.580 21.467 1.00 0.00 H new ATOM 0 HG2 GLU A 73 23.892 38.186 22.832 1.00 0.00 H new ATOM 0 HG3 GLU A 73 23.349 39.808 22.453 1.00 0.00 H new ATOM 1079 N ALA A 74 23.265 40.579 19.051 1.00 0.00 N ATOM 1080 CA ALA A 74 22.022 41.076 18.400 1.00 0.00 C ATOM 1081 C ALA A 74 21.545 40.052 17.364 1.00 0.00 C ATOM 1082 O ALA A 74 22.334 39.420 16.686 1.00 0.00 O ATOM 1083 CB ALA A 74 22.311 42.413 17.700 1.00 0.00 C ATOM 0 H ALA A 74 23.736 39.826 18.550 1.00 0.00 H new ATOM 0 HA ALA A 74 21.248 41.219 19.154 1.00 0.00 H new ATOM 0 HB1 ALA A 74 21.401 42.778 17.223 1.00 0.00 H new ATOM 0 HB2 ALA A 74 22.653 43.142 18.435 1.00 0.00 H new ATOM 0 HB3 ALA A 74 23.084 42.269 16.945 1.00 0.00 H new ATOM 1089 N ASP A 75 20.253 39.865 17.259 1.00 0.00 N ATOM 1090 CA ASP A 75 19.703 38.868 16.284 1.00 0.00 C ATOM 1091 C ASP A 75 19.966 39.347 14.848 1.00 0.00 C ATOM 1092 O ASP A 75 20.118 40.534 14.604 1.00 0.00 O ATOM 1093 CB ASP A 75 18.187 38.708 16.522 1.00 0.00 C ATOM 1094 CG ASP A 75 17.885 37.289 16.986 1.00 0.00 C ATOM 1095 OD1 ASP A 75 18.511 36.853 17.928 1.00 0.00 O ATOM 1096 OD2 ASP A 75 17.049 36.649 16.376 1.00 0.00 O ATOM 0 H ASP A 75 19.551 40.361 17.808 1.00 0.00 H new ATOM 0 HA ASP A 75 20.193 37.905 16.427 1.00 0.00 H new ATOM 0 HB2 ASP A 75 17.849 39.425 17.270 1.00 0.00 H new ATOM 0 HB3 ASP A 75 17.641 38.924 15.604 1.00 0.00 H new ATOM 1101 N ILE A 76 20.035 38.441 13.894 1.00 0.00 N ATOM 1102 CA ILE A 76 20.301 38.849 12.475 1.00 0.00 C ATOM 1103 C ILE A 76 19.401 38.040 11.524 1.00 0.00 C ATOM 1104 O ILE A 76 19.016 36.915 11.816 1.00 0.00 O ATOM 1105 CB ILE A 76 21.783 38.589 12.138 1.00 0.00 C ATOM 1106 CG1 ILE A 76 22.667 39.624 12.847 1.00 0.00 C ATOM 1107 CG2 ILE A 76 22.021 38.693 10.626 1.00 0.00 C ATOM 1108 CD1 ILE A 76 22.462 41.009 12.223 1.00 0.00 C ATOM 0 H ILE A 76 19.918 37.438 14.039 1.00 0.00 H new ATOM 0 HA ILE A 76 20.082 39.910 12.355 1.00 0.00 H new ATOM 0 HB ILE A 76 22.037 37.584 12.475 1.00 0.00 H new ATOM 0 HG12 ILE A 76 22.423 39.655 13.909 1.00 0.00 H new ATOM 0 HG13 ILE A 76 23.715 39.333 12.769 1.00 0.00 H new ATOM 0 HG21 ILE A 76 23.073 38.506 10.410 1.00 0.00 H new ATOM 0 HG22 ILE A 76 21.408 37.955 10.109 1.00 0.00 H new ATOM 0 HG23 ILE A 76 21.752 39.692 10.283 1.00 0.00 H new ATOM 0 HD11 ILE A 76 23.094 41.735 12.734 1.00 0.00 H new ATOM 0 HD12 ILE A 76 22.729 40.975 11.167 1.00 0.00 H new ATOM 0 HD13 ILE A 76 21.417 41.303 12.324 1.00 0.00 H new ATOM 1120 N ASN A 77 19.077 38.614 10.384 1.00 0.00 N ATOM 1121 CA ASN A 77 18.221 37.912 9.377 1.00 0.00 C ATOM 1122 C ASN A 77 16.889 37.475 9.995 1.00 0.00 C ATOM 1123 O ASN A 77 16.569 36.302 10.037 1.00 0.00 O ATOM 1124 CB ASN A 77 18.973 36.685 8.854 1.00 0.00 C ATOM 1125 CG ASN A 77 20.223 37.130 8.103 1.00 0.00 C ATOM 1126 OD1 ASN A 77 20.407 38.300 7.818 1.00 0.00 O ATOM 1127 ND2 ASN A 77 21.100 36.239 7.768 1.00 0.00 N ATOM 0 H ASN A 77 19.375 39.550 10.109 1.00 0.00 H new ATOM 0 HA ASN A 77 18.005 38.599 8.559 1.00 0.00 H new ATOM 0 HB2 ASN A 77 19.248 36.034 9.684 1.00 0.00 H new ATOM 0 HB3 ASN A 77 18.328 36.105 8.194 1.00 0.00 H new ATOM 0 HD21 ASN A 77 21.943 36.517 7.266 1.00 0.00 H new ATOM 0 HD22 ASN A 77 20.948 35.259 8.006 1.00 0.00 H new ATOM 1134 N TYR A 78 16.094 38.407 10.443 1.00 0.00 N ATOM 1135 CA TYR A 78 14.767 38.054 11.022 1.00 0.00 C ATOM 1136 C TYR A 78 13.676 38.821 10.264 1.00 0.00 C ATOM 1137 O TYR A 78 13.937 39.853 9.665 1.00 0.00 O ATOM 1138 CB TYR A 78 14.715 38.431 12.505 1.00 0.00 C ATOM 1139 CG TYR A 78 13.291 38.309 12.989 1.00 0.00 C ATOM 1140 CD1 TYR A 78 12.723 37.045 13.195 1.00 0.00 C ATOM 1141 CD2 TYR A 78 12.534 39.463 13.222 1.00 0.00 C ATOM 1142 CE1 TYR A 78 11.393 36.933 13.633 1.00 0.00 C ATOM 1143 CE2 TYR A 78 11.207 39.355 13.662 1.00 0.00 C ATOM 1144 CZ TYR A 78 10.635 38.091 13.868 1.00 0.00 C ATOM 1145 OH TYR A 78 9.324 37.988 14.290 1.00 0.00 O ATOM 0 H TYR A 78 16.308 39.404 10.433 1.00 0.00 H new ATOM 0 HA TYR A 78 14.608 36.980 10.928 1.00 0.00 H new ATOM 0 HB2 TYR A 78 15.367 37.777 13.084 1.00 0.00 H new ATOM 0 HB3 TYR A 78 15.076 39.449 12.648 1.00 0.00 H new ATOM 0 HD1 TYR A 78 13.309 36.155 13.017 1.00 0.00 H new ATOM 0 HD2 TYR A 78 12.972 40.437 13.063 1.00 0.00 H new ATOM 0 HE1 TYR A 78 10.955 35.958 13.789 1.00 0.00 H new ATOM 0 HE2 TYR A 78 10.625 40.246 13.843 1.00 0.00 H new ATOM 0 HH TYR A 78 8.882 38.858 14.199 1.00 0.00 H new ATOM 1155 N THR A 79 12.459 38.343 10.303 1.00 0.00 N ATOM 1156 CA THR A 79 11.342 39.056 9.599 1.00 0.00 C ATOM 1157 C THR A 79 10.104 39.056 10.498 1.00 0.00 C ATOM 1158 O THR A 79 9.817 40.016 11.193 1.00 0.00 O ATOM 1159 CB THR A 79 11.004 38.342 8.277 1.00 0.00 C ATOM 1160 OG1 THR A 79 10.386 37.086 8.552 1.00 0.00 O ATOM 1161 CG2 THR A 79 12.281 38.117 7.464 1.00 0.00 C ATOM 0 H THR A 79 12.187 37.490 10.791 1.00 0.00 H new ATOM 0 HA THR A 79 11.652 40.079 9.383 1.00 0.00 H new ATOM 0 HB THR A 79 10.318 38.965 7.703 1.00 0.00 H new ATOM 0 HG1 THR A 79 9.472 37.087 8.198 1.00 0.00 H new ATOM 0 HG21 THR A 79 12.034 37.612 6.530 1.00 0.00 H new ATOM 0 HG22 THR A 79 12.746 39.078 7.244 1.00 0.00 H new ATOM 0 HG23 THR A 79 12.974 37.501 8.038 1.00 0.00 H new ATOM 1169 N SER A 80 9.373 37.986 10.475 1.00 0.00 N ATOM 1170 CA SER A 80 8.143 37.884 11.307 1.00 0.00 C ATOM 1171 C SER A 80 7.920 36.421 11.680 1.00 0.00 C ATOM 1172 O SER A 80 7.374 35.659 10.903 1.00 0.00 O ATOM 1173 CB SER A 80 6.941 38.386 10.500 1.00 0.00 C ATOM 1174 OG SER A 80 5.848 37.490 10.676 1.00 0.00 O ATOM 0 H SER A 80 9.575 37.163 9.908 1.00 0.00 H new ATOM 0 HA SER A 80 8.255 38.487 12.208 1.00 0.00 H new ATOM 0 HB2 SER A 80 6.661 39.387 10.827 1.00 0.00 H new ATOM 0 HB3 SER A 80 7.202 38.457 9.444 1.00 0.00 H new ATOM 0 HG SER A 80 6.043 36.643 10.223 1.00 0.00 H new ATOM 1180 N GLY A 81 8.312 36.022 12.856 1.00 0.00 N ATOM 1181 CA GLY A 81 8.107 34.592 13.260 1.00 0.00 C ATOM 1182 C GLY A 81 9.065 34.225 14.402 1.00 0.00 C ATOM 1183 O GLY A 81 8.836 34.582 15.537 1.00 0.00 O ATOM 0 H GLY A 81 8.762 36.613 13.554 1.00 0.00 H new ATOM 0 HA2 GLY A 81 7.075 34.440 13.577 1.00 0.00 H new ATOM 0 HA3 GLY A 81 8.278 33.936 12.406 1.00 0.00 H new ATOM 1187 N PHE A 82 10.142 33.535 14.105 1.00 0.00 N ATOM 1188 CA PHE A 82 11.126 33.162 15.171 1.00 0.00 C ATOM 1189 C PHE A 82 12.550 33.516 14.700 1.00 0.00 C ATOM 1190 O PHE A 82 12.740 34.066 13.628 1.00 0.00 O ATOM 1191 CB PHE A 82 11.018 31.658 15.461 1.00 0.00 C ATOM 1192 CG PHE A 82 11.654 31.343 16.799 1.00 0.00 C ATOM 1193 CD1 PHE A 82 10.978 31.638 17.994 1.00 0.00 C ATOM 1194 CD2 PHE A 82 12.920 30.750 16.840 1.00 0.00 C ATOM 1195 CE1 PHE A 82 11.574 31.336 19.228 1.00 0.00 C ATOM 1196 CE2 PHE A 82 13.514 30.449 18.070 1.00 0.00 C ATOM 1197 CZ PHE A 82 12.842 30.741 19.265 1.00 0.00 C ATOM 0 H PHE A 82 10.382 33.214 13.167 1.00 0.00 H new ATOM 0 HA PHE A 82 10.909 33.715 16.085 1.00 0.00 H new ATOM 0 HB2 PHE A 82 9.971 31.354 15.466 1.00 0.00 H new ATOM 0 HB3 PHE A 82 11.511 31.090 14.672 1.00 0.00 H new ATOM 0 HD1 PHE A 82 10.001 32.097 17.963 1.00 0.00 H new ATOM 0 HD2 PHE A 82 13.440 30.524 15.921 1.00 0.00 H new ATOM 0 HE1 PHE A 82 11.056 31.562 20.148 1.00 0.00 H new ATOM 0 HE2 PHE A 82 14.492 29.991 18.099 1.00 0.00 H new ATOM 0 HZ PHE A 82 13.302 30.507 20.214 1.00 0.00 H new ATOM 1207 N ARG A 83 13.543 33.224 15.501 1.00 0.00 N ATOM 1208 CA ARG A 83 14.952 33.560 15.124 1.00 0.00 C ATOM 1209 C ARG A 83 15.520 32.506 14.160 1.00 0.00 C ATOM 1210 O ARG A 83 14.809 31.901 13.387 1.00 0.00 O ATOM 1211 CB ARG A 83 15.819 33.592 16.393 1.00 0.00 C ATOM 1212 CG ARG A 83 14.961 33.900 17.625 1.00 0.00 C ATOM 1213 CD ARG A 83 15.827 34.567 18.700 1.00 0.00 C ATOM 1214 NE ARG A 83 17.140 33.847 18.811 1.00 0.00 N ATOM 1215 CZ ARG A 83 18.142 34.393 19.446 1.00 0.00 C ATOM 1216 NH1 ARG A 83 17.991 35.539 20.012 1.00 0.00 N ATOM 1217 NH2 ARG A 83 19.290 33.791 19.505 1.00 0.00 N ATOM 0 H ARG A 83 13.439 32.765 16.406 1.00 0.00 H new ATOM 0 HA ARG A 83 14.961 34.532 14.632 1.00 0.00 H new ATOM 0 HB2 ARG A 83 16.319 32.632 16.522 1.00 0.00 H new ATOM 0 HB3 ARG A 83 16.599 34.346 16.288 1.00 0.00 H new ATOM 0 HG2 ARG A 83 14.135 34.556 17.351 1.00 0.00 H new ATOM 0 HG3 ARG A 83 14.523 32.981 18.015 1.00 0.00 H new ATOM 0 HD2 ARG A 83 15.996 35.614 18.447 1.00 0.00 H new ATOM 0 HD3 ARG A 83 15.310 34.550 19.659 1.00 0.00 H new ATOM 0 HE ARG A 83 17.250 32.926 18.388 1.00 0.00 H new ATOM 0 HH11 ARG A 83 17.091 36.017 19.964 1.00 0.00 H new ATOM 0 HH12 ARG A 83 18.771 35.969 20.509 1.00 0.00 H new ATOM 0 HH21 ARG A 83 19.415 32.885 19.053 1.00 0.00 H new ATOM 0 HH22 ARG A 83 20.068 34.224 20.003 1.00 0.00 H new ATOM 1231 N ASN A 84 16.809 32.289 14.224 1.00 0.00 N ATOM 1232 CA ASN A 84 17.463 31.281 13.343 1.00 0.00 C ATOM 1233 C ASN A 84 18.896 31.038 13.847 1.00 0.00 C ATOM 1234 O ASN A 84 19.123 30.908 15.038 1.00 0.00 O ATOM 1235 CB ASN A 84 17.475 31.800 11.896 1.00 0.00 C ATOM 1236 CG ASN A 84 18.101 33.197 11.848 1.00 0.00 C ATOM 1237 OD1 ASN A 84 18.714 33.641 12.807 1.00 0.00 O ATOM 1238 ND2 ASN A 84 17.963 33.922 10.781 1.00 0.00 N ATOM 0 H ASN A 84 17.442 32.775 14.859 1.00 0.00 H new ATOM 0 HA ASN A 84 16.913 30.340 13.368 1.00 0.00 H new ATOM 0 HB2 ASN A 84 18.039 31.117 11.260 1.00 0.00 H new ATOM 0 HB3 ASN A 84 16.458 31.834 11.504 1.00 0.00 H new ATOM 0 HD21 ASN A 84 18.366 34.859 10.745 1.00 0.00 H new ATOM 0 HD22 ASN A 84 17.452 33.555 9.978 1.00 0.00 H new ATOM 1245 N SER A 85 19.862 30.976 12.968 1.00 0.00 N ATOM 1246 CA SER A 85 21.269 30.736 13.416 1.00 0.00 C ATOM 1247 C SER A 85 22.114 31.983 13.134 1.00 0.00 C ATOM 1248 O SER A 85 23.221 32.117 13.617 1.00 0.00 O ATOM 1249 CB SER A 85 21.846 29.538 12.659 0.50 0.00 C ATOM 1250 OG SER A 85 22.267 29.959 11.367 0.50 0.00 O ATOM 0 H SER A 85 19.739 31.081 11.961 1.00 0.00 H new ATOM 0 HA SER A 85 21.282 30.527 14.486 1.00 0.00 H new ATOM 0 HB2 SER A 85 22.687 29.116 13.209 0.50 0.00 H new ATOM 0 HB3 SER A 85 21.096 28.752 12.572 0.50 0.00 H new ATOM 0 HG SER A 85 23.107 29.511 11.135 0.50 0.00 H new ATOM 1256 N ASP A 86 21.579 32.895 12.357 1.00 0.00 N ATOM 1257 CA ASP A 86 22.304 34.154 12.012 1.00 0.00 C ATOM 1258 C ASP A 86 22.389 35.067 13.241 1.00 0.00 C ATOM 1259 O ASP A 86 21.383 35.574 13.714 1.00 0.00 O ATOM 1260 CB ASP A 86 21.515 34.874 10.917 1.00 0.00 C ATOM 1261 CG ASP A 86 21.836 34.249 9.570 1.00 0.00 C ATOM 1262 OD1 ASP A 86 23.002 34.195 9.230 1.00 0.00 O ATOM 1263 OD2 ASP A 86 20.910 33.829 8.902 1.00 0.00 O ATOM 0 H ASP A 86 20.651 32.815 11.940 1.00 0.00 H new ATOM 0 HA ASP A 86 23.313 33.916 11.674 1.00 0.00 H new ATOM 0 HB2 ASP A 86 20.446 34.803 11.118 1.00 0.00 H new ATOM 0 HB3 ASP A 86 21.768 35.934 10.908 1.00 0.00 H new ATOM 1268 N ARG A 87 23.567 35.266 13.780 1.00 0.00 N ATOM 1269 CA ARG A 87 23.694 36.144 14.983 1.00 0.00 C ATOM 1270 C ARG A 87 24.972 36.981 14.867 1.00 0.00 C ATOM 1271 O ARG A 87 25.985 36.508 14.375 1.00 0.00 O ATOM 1272 CB ARG A 87 23.730 35.259 16.235 1.00 0.00 C ATOM 1273 CG ARG A 87 22.365 34.582 16.388 1.00 0.00 C ATOM 1274 CD ARG A 87 21.419 35.527 17.151 1.00 0.00 C ATOM 1275 NE ARG A 87 19.956 35.362 16.799 1.00 0.00 N ATOM 1276 CZ ARG A 87 19.569 34.818 15.673 1.00 0.00 C ATOM 1277 NH1 ARG A 87 20.156 33.780 15.182 1.00 0.00 N ATOM 1278 NH2 ARG A 87 18.439 35.175 15.154 1.00 0.00 N ATOM 0 H ARG A 87 24.440 34.861 13.441 1.00 0.00 H new ATOM 0 HA ARG A 87 22.845 36.824 15.054 1.00 0.00 H new ATOM 0 HB2 ARG A 87 24.517 34.510 16.147 1.00 0.00 H new ATOM 0 HB3 ARG A 87 23.957 35.858 17.117 1.00 0.00 H new ATOM 0 HG2 ARG A 87 21.950 34.345 15.408 1.00 0.00 H new ATOM 0 HG3 ARG A 87 22.470 33.640 16.926 1.00 0.00 H new ATOM 0 HD2 ARG A 87 21.544 35.361 18.221 1.00 0.00 H new ATOM 0 HD3 ARG A 87 21.715 36.557 16.951 1.00 0.00 H new ATOM 0 HE ARG A 87 19.249 35.685 17.460 1.00 0.00 H new ATOM 0 HH11 ARG A 87 20.945 33.360 15.673 1.00 0.00 H new ATOM 0 HH12 ARG A 87 19.831 33.379 14.302 1.00 0.00 H new ATOM 0 HH21 ARG A 87 17.861 35.873 15.622 1.00 0.00 H new ATOM 0 HH22 ARG A 87 18.126 34.758 14.277 1.00 0.00 H new ATOM 1292 N ILE A 88 24.917 38.226 15.292 1.00 0.00 N ATOM 1293 CA ILE A 88 26.122 39.124 15.197 1.00 0.00 C ATOM 1294 C ILE A 88 26.581 39.556 16.596 1.00 0.00 C ATOM 1295 O ILE A 88 25.794 39.749 17.501 1.00 0.00 O ATOM 1296 CB ILE A 88 25.767 40.374 14.392 1.00 0.00 C ATOM 1297 CG1 ILE A 88 27.023 41.221 14.204 1.00 0.00 C ATOM 1298 CG2 ILE A 88 24.715 41.198 15.136 1.00 0.00 C ATOM 1299 CD1 ILE A 88 26.694 42.428 13.326 1.00 0.00 C ATOM 0 H ILE A 88 24.090 38.660 15.701 1.00 0.00 H new ATOM 0 HA ILE A 88 26.925 38.573 14.706 1.00 0.00 H new ATOM 0 HB ILE A 88 25.367 40.074 13.423 1.00 0.00 H new ATOM 0 HG12 ILE A 88 27.399 41.553 15.172 1.00 0.00 H new ATOM 0 HG13 ILE A 88 27.811 40.626 13.743 1.00 0.00 H new ATOM 0 HG21 ILE A 88 24.470 42.086 14.554 1.00 0.00 H new ATOM 0 HG22 ILE A 88 23.816 40.598 15.278 1.00 0.00 H new ATOM 0 HG23 ILE A 88 25.108 41.498 16.107 1.00 0.00 H new ATOM 0 HD11 ILE A 88 27.590 43.034 13.190 1.00 0.00 H new ATOM 0 HD12 ILE A 88 26.338 42.085 12.355 1.00 0.00 H new ATOM 0 HD13 ILE A 88 25.920 43.027 13.806 1.00 0.00 H new ATOM 1311 N LEU A 89 27.862 39.703 16.776 1.00 0.00 N ATOM 1312 CA LEU A 89 28.395 40.112 18.102 1.00 0.00 C ATOM 1313 C LEU A 89 29.163 41.431 17.964 1.00 0.00 C ATOM 1314 O LEU A 89 30.009 41.571 17.095 1.00 0.00 O ATOM 1315 CB LEU A 89 29.334 39.014 18.609 1.00 0.00 C ATOM 1316 CG LEU A 89 28.585 38.070 19.555 1.00 0.00 C ATOM 1317 CD1 LEU A 89 28.282 38.803 20.863 1.00 0.00 C ATOM 1318 CD2 LEU A 89 27.276 37.603 18.906 1.00 0.00 C ATOM 0 H LEU A 89 28.568 39.556 16.055 1.00 0.00 H new ATOM 0 HA LEU A 89 27.576 40.255 18.807 1.00 0.00 H new ATOM 0 HB2 LEU A 89 29.736 38.452 17.766 1.00 0.00 H new ATOM 0 HB3 LEU A 89 30.182 39.462 19.127 1.00 0.00 H new ATOM 0 HG LEU A 89 29.206 37.198 19.760 1.00 0.00 H new ATOM 0 HD11 LEU A 89 27.749 38.135 21.539 1.00 0.00 H new ATOM 0 HD12 LEU A 89 29.216 39.120 21.327 1.00 0.00 H new ATOM 0 HD13 LEU A 89 27.665 39.677 20.656 1.00 0.00 H new ATOM 0 HD21 LEU A 89 26.751 36.932 19.587 1.00 0.00 H new ATOM 0 HD22 LEU A 89 26.647 38.467 18.692 1.00 0.00 H new ATOM 0 HD23 LEU A 89 27.498 37.077 17.978 1.00 0.00 H new ATOM 1330 N TYR A 90 28.892 42.385 18.824 1.00 0.00 N ATOM 1331 CA TYR A 90 29.613 43.691 18.751 1.00 0.00 C ATOM 1332 C TYR A 90 30.148 44.073 20.144 1.00 0.00 C ATOM 1333 O TYR A 90 29.501 43.842 21.152 1.00 0.00 O ATOM 1334 CB TYR A 90 28.654 44.762 18.214 1.00 0.00 C ATOM 1335 CG TYR A 90 27.757 45.287 19.314 1.00 0.00 C ATOM 1336 CD1 TYR A 90 26.567 44.617 19.641 1.00 0.00 C ATOM 1337 CD2 TYR A 90 28.099 46.467 19.979 1.00 0.00 C ATOM 1338 CE1 TYR A 90 25.717 45.137 20.634 1.00 0.00 C ATOM 1339 CE2 TYR A 90 27.259 46.982 20.971 1.00 0.00 C ATOM 1340 CZ TYR A 90 26.068 46.325 21.299 1.00 0.00 C ATOM 1341 OH TYR A 90 25.249 46.851 22.279 1.00 0.00 O ATOM 0 H TYR A 90 28.202 42.313 19.572 1.00 0.00 H new ATOM 0 HA TYR A 90 30.465 43.611 18.075 1.00 0.00 H new ATOM 0 HB2 TYR A 90 29.226 45.584 17.783 1.00 0.00 H new ATOM 0 HB3 TYR A 90 28.046 44.342 17.413 1.00 0.00 H new ATOM 0 HD1 TYR A 90 26.304 43.702 19.130 1.00 0.00 H new ATOM 0 HD2 TYR A 90 29.014 46.982 19.726 1.00 0.00 H new ATOM 0 HE1 TYR A 90 24.799 44.626 20.884 1.00 0.00 H new ATOM 0 HE2 TYR A 90 27.531 47.891 21.487 1.00 0.00 H new ATOM 0 HH TYR A 90 24.767 46.125 22.727 1.00 0.00 H new ATOM 1351 N SER A 91 31.341 44.621 20.200 1.00 0.00 N ATOM 1352 CA SER A 91 31.965 44.980 21.524 1.00 0.00 C ATOM 1353 C SER A 91 31.947 46.490 21.787 1.00 0.00 C ATOM 1354 O SER A 91 31.527 47.281 20.968 1.00 0.00 O ATOM 1355 CB SER A 91 33.426 44.564 21.481 1.00 0.00 C ATOM 1356 OG SER A 91 34.057 45.305 20.444 1.00 0.00 O ATOM 0 H SER A 91 31.914 44.837 19.384 1.00 0.00 H new ATOM 0 HA SER A 91 31.396 44.477 22.306 1.00 0.00 H new ATOM 0 HB2 SER A 91 33.908 44.760 22.439 1.00 0.00 H new ATOM 0 HB3 SER A 91 33.513 43.494 21.294 1.00 0.00 H new ATOM 0 HG SER A 91 35.029 45.278 20.567 1.00 0.00 H new ATOM 1362 N SER A 92 32.458 46.883 22.933 1.00 0.00 N ATOM 1363 CA SER A 92 32.554 48.336 23.294 1.00 0.00 C ATOM 1364 C SER A 92 33.303 49.072 22.188 1.00 0.00 C ATOM 1365 O SER A 92 32.851 50.065 21.655 1.00 0.00 O ATOM 1366 CB SER A 92 33.354 48.478 24.598 1.00 0.00 C ATOM 1367 OG SER A 92 34.063 47.251 24.856 1.00 0.00 O ATOM 0 H SER A 92 32.818 46.247 23.644 1.00 0.00 H new ATOM 0 HA SER A 92 31.554 48.751 23.418 1.00 0.00 H new ATOM 0 HB2 SER A 92 34.056 49.308 24.519 1.00 0.00 H new ATOM 0 HB3 SER A 92 32.684 48.706 25.427 1.00 0.00 H new ATOM 0 HG SER A 92 34.801 47.159 24.218 1.00 0.00 H new ATOM 1373 N ASP A 93 34.457 48.571 21.873 1.00 0.00 N ATOM 1374 CA ASP A 93 35.328 49.168 20.817 1.00 0.00 C ATOM 1375 C ASP A 93 34.660 49.028 19.442 1.00 0.00 C ATOM 1376 O ASP A 93 35.238 49.359 18.426 1.00 0.00 O ATOM 1377 CB ASP A 93 36.651 48.394 20.832 1.00 0.00 C ATOM 1378 CG ASP A 93 36.387 46.987 21.368 1.00 0.00 C ATOM 1379 OD1 ASP A 93 36.333 46.825 22.584 1.00 0.00 O ATOM 1380 OD2 ASP A 93 36.219 46.100 20.563 1.00 0.00 O ATOM 0 H ASP A 93 34.852 47.742 22.317 1.00 0.00 H new ATOM 0 HA ASP A 93 35.493 50.228 21.007 1.00 0.00 H new ATOM 0 HB2 ASP A 93 37.071 48.343 19.827 1.00 0.00 H new ATOM 0 HB3 ASP A 93 37.382 48.906 21.458 1.00 0.00 H new ATOM 1385 N TRP A 94 33.454 48.534 19.417 1.00 0.00 N ATOM 1386 CA TRP A 94 32.706 48.352 18.144 1.00 0.00 C ATOM 1387 C TRP A 94 33.326 47.240 17.289 1.00 0.00 C ATOM 1388 O TRP A 94 33.123 47.206 16.090 1.00 0.00 O ATOM 1389 CB TRP A 94 32.660 49.673 17.358 1.00 0.00 C ATOM 1390 CG TRP A 94 32.080 50.745 18.232 1.00 0.00 C ATOM 1391 CD1 TRP A 94 32.718 51.876 18.606 1.00 0.00 C ATOM 1392 CD2 TRP A 94 30.759 50.798 18.846 1.00 0.00 C ATOM 1393 NE1 TRP A 94 31.874 52.617 19.411 1.00 0.00 N ATOM 1394 CE2 TRP A 94 30.657 51.996 19.584 1.00 0.00 C ATOM 1395 CE3 TRP A 94 29.651 49.931 18.834 1.00 0.00 C ATOM 1396 CZ2 TRP A 94 29.499 52.327 20.285 1.00 0.00 C ATOM 1397 CZ3 TRP A 94 28.483 50.260 19.539 1.00 0.00 C ATOM 1398 CH2 TRP A 94 28.407 51.457 20.263 1.00 0.00 C ATOM 0 H TRP A 94 32.943 48.241 20.250 1.00 0.00 H new ATOM 0 HA TRP A 94 31.687 48.054 18.391 1.00 0.00 H new ATOM 0 HB2 TRP A 94 33.663 49.953 17.035 1.00 0.00 H new ATOM 0 HB3 TRP A 94 32.056 49.554 16.458 1.00 0.00 H new ATOM 0 HD1 TRP A 94 33.722 52.155 18.322 1.00 0.00 H new ATOM 0 HE1 TRP A 94 32.122 53.515 19.827 1.00 0.00 H new ATOM 0 HE3 TRP A 94 29.700 49.006 18.279 1.00 0.00 H new ATOM 0 HZ2 TRP A 94 29.446 53.251 20.842 1.00 0.00 H new ATOM 0 HZ3 TRP A 94 27.638 49.587 19.523 1.00 0.00 H new ATOM 0 HH2 TRP A 94 27.506 51.706 20.803 1.00 0.00 H new ATOM 1409 N LEU A 95 34.051 46.311 17.873 1.00 0.00 N ATOM 1410 CA LEU A 95 34.613 45.200 17.043 1.00 0.00 C ATOM 1411 C LEU A 95 33.454 44.244 16.746 1.00 0.00 C ATOM 1412 O LEU A 95 32.776 43.791 17.650 1.00 0.00 O ATOM 1413 CB LEU A 95 35.726 44.475 17.815 1.00 0.00 C ATOM 1414 CG LEU A 95 37.039 45.254 17.679 1.00 0.00 C ATOM 1415 CD1 LEU A 95 38.162 44.507 18.397 1.00 0.00 C ATOM 1416 CD2 LEU A 95 37.400 45.420 16.198 1.00 0.00 C ATOM 0 H LEU A 95 34.273 46.275 18.868 1.00 0.00 H new ATOM 0 HA LEU A 95 35.050 45.579 16.119 1.00 0.00 H new ATOM 0 HB2 LEU A 95 35.453 44.384 18.866 1.00 0.00 H new ATOM 0 HB3 LEU A 95 35.850 43.463 17.429 1.00 0.00 H new ATOM 0 HG LEU A 95 36.913 46.238 18.130 1.00 0.00 H new ATOM 0 HD11 LEU A 95 39.093 45.066 18.297 1.00 0.00 H new ATOM 0 HD12 LEU A 95 37.913 44.403 19.453 1.00 0.00 H new ATOM 0 HD13 LEU A 95 38.283 43.518 17.954 1.00 0.00 H new ATOM 0 HD21 LEU A 95 38.334 45.975 16.111 1.00 0.00 H new ATOM 0 HD22 LEU A 95 37.517 44.438 15.740 1.00 0.00 H new ATOM 0 HD23 LEU A 95 36.606 45.966 15.689 1.00 0.00 H new ATOM 1428 N ILE A 96 33.168 43.980 15.500 1.00 0.00 N ATOM 1429 CA ILE A 96 31.999 43.100 15.207 1.00 0.00 C ATOM 1430 C ILE A 96 32.423 41.748 14.615 1.00 0.00 C ATOM 1431 O ILE A 96 33.265 41.653 13.733 1.00 0.00 O ATOM 1432 CB ILE A 96 31.055 43.803 14.244 1.00 0.00 C ATOM 1433 CG1 ILE A 96 30.694 45.186 14.799 1.00 0.00 C ATOM 1434 CG2 ILE A 96 29.790 42.962 14.092 1.00 0.00 C ATOM 1435 CD1 ILE A 96 31.338 46.256 13.920 1.00 0.00 C ATOM 0 H ILE A 96 33.679 44.326 14.688 1.00 0.00 H new ATOM 0 HA ILE A 96 31.494 42.903 16.153 1.00 0.00 H new ATOM 0 HB ILE A 96 31.536 43.924 13.273 1.00 0.00 H new ATOM 0 HG12 ILE A 96 29.612 45.314 14.817 1.00 0.00 H new ATOM 0 HG13 ILE A 96 31.043 45.282 15.827 1.00 0.00 H new ATOM 0 HG21 ILE A 96 29.105 43.456 13.403 1.00 0.00 H new ATOM 0 HG22 ILE A 96 30.052 41.979 13.700 1.00 0.00 H new ATOM 0 HG23 ILE A 96 29.309 42.849 15.064 1.00 0.00 H new ATOM 0 HD11 ILE A 96 31.087 47.244 14.307 1.00 0.00 H new ATOM 0 HD12 ILE A 96 32.420 46.128 13.926 1.00 0.00 H new ATOM 0 HD13 ILE A 96 30.967 46.161 12.900 1.00 0.00 H new ATOM 1447 N TYR A 97 31.807 40.705 15.113 1.00 0.00 N ATOM 1448 CA TYR A 97 32.094 39.319 14.632 1.00 0.00 C ATOM 1449 C TYR A 97 30.764 38.660 14.258 1.00 0.00 C ATOM 1450 O TYR A 97 29.727 39.036 14.780 1.00 0.00 O ATOM 1451 CB TYR A 97 32.782 38.511 15.736 1.00 0.00 C ATOM 1452 CG TYR A 97 34.219 38.948 15.834 1.00 0.00 C ATOM 1453 CD1 TYR A 97 34.528 40.251 16.247 1.00 0.00 C ATOM 1454 CD2 TYR A 97 35.245 38.056 15.495 1.00 0.00 C ATOM 1455 CE1 TYR A 97 35.858 40.664 16.318 1.00 0.00 C ATOM 1456 CE2 TYR A 97 36.578 38.471 15.572 1.00 0.00 C ATOM 1457 CZ TYR A 97 36.880 39.776 15.982 1.00 0.00 C ATOM 1458 OH TYR A 97 38.190 40.195 16.043 1.00 0.00 O ATOM 0 H TYR A 97 31.102 40.758 15.848 1.00 0.00 H new ATOM 0 HA TYR A 97 32.757 39.353 13.767 1.00 0.00 H new ATOM 0 HB2 TYR A 97 32.275 38.665 16.688 1.00 0.00 H new ATOM 0 HB3 TYR A 97 32.726 37.445 15.514 1.00 0.00 H new ATOM 0 HD1 TYR A 97 33.736 40.936 16.510 1.00 0.00 H new ATOM 0 HD2 TYR A 97 35.007 37.052 15.176 1.00 0.00 H new ATOM 0 HE1 TYR A 97 36.096 41.669 16.632 1.00 0.00 H new ATOM 0 HE2 TYR A 97 37.373 37.787 15.316 1.00 0.00 H new ATOM 0 HH TYR A 97 38.781 39.459 15.780 1.00 0.00 H new ATOM 1468 N LYS A 98 30.781 37.698 13.356 1.00 0.00 N ATOM 1469 CA LYS A 98 29.488 37.042 12.938 1.00 0.00 C ATOM 1470 C LYS A 98 29.477 35.523 13.189 1.00 0.00 C ATOM 1471 O LYS A 98 30.468 34.829 13.016 1.00 0.00 O ATOM 1472 CB LYS A 98 29.248 37.296 11.439 1.00 0.00 C ATOM 1473 CG LYS A 98 30.006 36.254 10.600 1.00 0.00 C ATOM 1474 CD LYS A 98 29.767 36.508 9.105 1.00 0.00 C ATOM 1475 CE LYS A 98 28.277 36.755 8.819 1.00 0.00 C ATOM 1476 NZ LYS A 98 27.441 35.748 9.532 1.00 0.00 N ATOM 0 H LYS A 98 31.619 37.342 12.897 1.00 0.00 H new ATOM 0 HA LYS A 98 28.698 37.483 13.546 1.00 0.00 H new ATOM 0 HB2 LYS A 98 28.182 37.245 11.220 1.00 0.00 H new ATOM 0 HB3 LYS A 98 29.581 38.300 11.174 1.00 0.00 H new ATOM 0 HG2 LYS A 98 31.072 36.304 10.820 1.00 0.00 H new ATOM 0 HG3 LYS A 98 29.673 35.250 10.864 1.00 0.00 H new ATOM 0 HD2 LYS A 98 30.351 37.370 8.781 1.00 0.00 H new ATOM 0 HD3 LYS A 98 30.115 35.652 8.527 1.00 0.00 H new ATOM 0 HE2 LYS A 98 28.000 37.760 9.138 1.00 0.00 H new ATOM 0 HE3 LYS A 98 28.091 36.699 7.746 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 26.860 35.228 8.843 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 28.058 35.081 10.038 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 26.821 36.231 10.213 1.00 0.00 H new ATOM 1490 N THR A 99 28.329 35.012 13.554 1.00 0.00 N ATOM 1491 CA THR A 99 28.166 33.549 13.788 1.00 0.00 C ATOM 1492 C THR A 99 26.815 33.123 13.190 1.00 0.00 C ATOM 1493 O THR A 99 25.791 33.767 13.401 1.00 0.00 O ATOM 1494 CB THR A 99 28.239 33.237 15.295 1.00 0.00 C ATOM 1495 OG1 THR A 99 27.664 31.962 15.545 1.00 0.00 O ATOM 1496 CG2 THR A 99 27.497 34.300 16.108 1.00 0.00 C ATOM 0 H THR A 99 27.482 35.560 13.702 1.00 0.00 H new ATOM 0 HA THR A 99 28.969 32.991 13.307 1.00 0.00 H new ATOM 0 HB THR A 99 29.286 33.237 15.598 1.00 0.00 H new ATOM 0 HG1 THR A 99 28.116 31.286 14.998 1.00 0.00 H new ATOM 0 HG21 THR A 99 27.562 34.058 17.169 1.00 0.00 H new ATOM 0 HG22 THR A 99 27.949 35.276 15.930 1.00 0.00 H new ATOM 0 HG23 THR A 99 26.450 34.324 15.805 1.00 0.00 H new ATOM 1504 N THR A 100 26.823 32.073 12.401 1.00 0.00 N ATOM 1505 CA THR A 100 25.576 31.579 11.729 1.00 0.00 C ATOM 1506 C THR A 100 25.281 30.154 12.186 1.00 0.00 C ATOM 1507 O THR A 100 24.497 29.447 11.575 1.00 0.00 O ATOM 1508 CB THR A 100 25.786 31.564 10.212 1.00 0.00 C ATOM 1509 OG1 THR A 100 27.069 31.016 9.927 1.00 0.00 O ATOM 1510 CG2 THR A 100 25.707 32.992 9.670 1.00 0.00 C ATOM 0 H THR A 100 27.658 31.527 12.190 1.00 0.00 H new ATOM 0 HA THR A 100 24.747 32.237 11.989 1.00 0.00 H new ATOM 0 HB THR A 100 25.013 30.958 9.739 1.00 0.00 H new ATOM 0 HG1 THR A 100 27.210 31.001 8.957 1.00 0.00 H new ATOM 0 HG21 THR A 100 25.857 32.980 8.590 1.00 0.00 H new ATOM 0 HG22 THR A 100 24.727 33.413 9.896 1.00 0.00 H new ATOM 0 HG23 THR A 100 26.481 33.602 10.137 1.00 0.00 H new ATOM 1518 N ASP A 101 25.897 29.723 13.243 1.00 0.00 N ATOM 1519 CA ASP A 101 25.654 28.344 13.734 1.00 0.00 C ATOM 1520 C ASP A 101 25.061 28.425 15.139 1.00 0.00 C ATOM 1521 O ASP A 101 25.310 27.588 15.981 1.00 0.00 O ATOM 1522 CB ASP A 101 26.987 27.598 13.765 1.00 0.00 C ATOM 1523 CG ASP A 101 28.115 28.622 13.894 1.00 0.00 C ATOM 1524 OD1 ASP A 101 27.988 29.535 14.709 1.00 0.00 O ATOM 1525 OD2 ASP A 101 29.102 28.468 13.209 1.00 0.00 O ATOM 0 H ASP A 101 26.562 30.268 13.792 1.00 0.00 H new ATOM 0 HA ASP A 101 24.960 27.815 13.081 1.00 0.00 H new ATOM 0 HB2 ASP A 101 27.011 26.901 14.603 1.00 0.00 H new ATOM 0 HB3 ASP A 101 27.112 27.009 12.856 1.00 0.00 H new ATOM 1530 N ALA A 102 24.253 29.423 15.390 1.00 0.00 N ATOM 1531 CA ALA A 102 23.617 29.558 16.736 1.00 0.00 C ATOM 1532 C ALA A 102 24.683 29.757 17.827 1.00 0.00 C ATOM 1533 O ALA A 102 24.861 28.927 18.696 1.00 0.00 O ATOM 1534 CB ALA A 102 22.802 28.296 17.022 1.00 0.00 C ATOM 0 H ALA A 102 24.006 30.151 14.720 1.00 0.00 H new ATOM 0 HA ALA A 102 22.966 30.432 16.741 1.00 0.00 H new ATOM 0 HB1 ALA A 102 22.332 28.381 18.002 1.00 0.00 H new ATOM 0 HB2 ALA A 102 22.032 28.179 16.259 1.00 0.00 H new ATOM 0 HB3 ALA A 102 23.460 27.427 17.009 1.00 0.00 H new ATOM 1540 N TYR A 103 25.377 30.861 17.788 1.00 0.00 N ATOM 1541 CA TYR A 103 26.422 31.150 18.815 1.00 0.00 C ATOM 1542 C TYR A 103 27.483 30.039 18.827 1.00 0.00 C ATOM 1543 O TYR A 103 27.829 29.529 19.872 1.00 0.00 O ATOM 1544 CB TYR A 103 25.776 31.236 20.212 1.00 0.00 C ATOM 1545 CG TYR A 103 24.609 32.206 20.228 1.00 0.00 C ATOM 1546 CD1 TYR A 103 24.785 33.558 19.894 1.00 0.00 C ATOM 1547 CD2 TYR A 103 23.346 31.746 20.613 1.00 0.00 C ATOM 1548 CE1 TYR A 103 23.693 34.439 19.948 1.00 0.00 C ATOM 1549 CE2 TYR A 103 22.260 32.625 20.661 1.00 0.00 C ATOM 1550 CZ TYR A 103 22.434 33.969 20.330 1.00 0.00 C ATOM 1551 OH TYR A 103 21.362 34.837 20.390 1.00 0.00 O ATOM 0 H TYR A 103 25.264 31.586 17.079 1.00 0.00 H new ATOM 0 HA TYR A 103 26.894 32.100 18.565 1.00 0.00 H new ATOM 0 HB2 TYR A 103 25.433 30.247 20.516 1.00 0.00 H new ATOM 0 HB3 TYR A 103 26.523 31.552 20.940 1.00 0.00 H new ATOM 0 HD1 TYR A 103 25.758 33.920 19.596 1.00 0.00 H new ATOM 0 HD2 TYR A 103 23.209 30.707 20.874 1.00 0.00 H new ATOM 0 HE1 TYR A 103 23.826 35.480 19.694 1.00 0.00 H new ATOM 0 HE2 TYR A 103 21.286 32.263 20.955 1.00 0.00 H new ATOM 0 HH TYR A 103 21.688 35.750 20.536 1.00 0.00 H new ATOM 1561 N GLN A 104 28.019 29.670 17.691 1.00 0.00 N ATOM 1562 CA GLN A 104 29.079 28.595 17.674 1.00 0.00 C ATOM 1563 C GLN A 104 30.376 29.155 17.059 1.00 0.00 C ATOM 1564 O GLN A 104 31.334 29.431 17.766 1.00 0.00 O ATOM 1565 CB GLN A 104 28.599 27.385 16.863 1.00 0.00 C ATOM 1566 CG GLN A 104 27.467 26.652 17.609 1.00 0.00 C ATOM 1567 CD GLN A 104 28.035 25.477 18.416 1.00 0.00 C ATOM 1568 OE1 GLN A 104 29.168 25.090 18.231 1.00 0.00 O ATOM 1569 NE2 GLN A 104 27.290 24.883 19.306 1.00 0.00 N ATOM 0 H GLN A 104 27.777 30.057 16.779 1.00 0.00 H new ATOM 0 HA GLN A 104 29.273 28.275 18.698 1.00 0.00 H new ATOM 0 HB2 GLN A 104 28.246 27.712 15.885 1.00 0.00 H new ATOM 0 HB3 GLN A 104 29.431 26.702 16.690 1.00 0.00 H new ATOM 0 HG2 GLN A 104 26.953 27.345 18.275 1.00 0.00 H new ATOM 0 HG3 GLN A 104 26.728 26.288 16.895 1.00 0.00 H new ATOM 0 HE21 GLN A 104 26.335 25.203 19.467 1.00 0.00 H new ATOM 0 HE22 GLN A 104 27.662 24.098 19.841 1.00 0.00 H new ATOM 1578 N THR A 105 30.436 29.320 15.758 1.00 0.00 N ATOM 1579 CA THR A 105 31.691 29.862 15.148 1.00 0.00 C ATOM 1580 C THR A 105 31.569 31.387 15.031 1.00 0.00 C ATOM 1581 O THR A 105 30.620 31.908 14.467 1.00 0.00 O ATOM 1582 CB THR A 105 31.937 29.245 13.761 1.00 0.00 C ATOM 1583 OG1 THR A 105 30.987 29.757 12.845 1.00 0.00 O ATOM 1584 CG2 THR A 105 31.826 27.713 13.830 1.00 0.00 C ATOM 0 H THR A 105 29.684 29.107 15.103 1.00 0.00 H new ATOM 0 HA THR A 105 32.537 29.605 15.785 1.00 0.00 H new ATOM 0 HB THR A 105 32.942 29.505 13.428 1.00 0.00 H new ATOM 0 HG1 THR A 105 30.103 29.386 13.049 1.00 0.00 H new ATOM 0 HG21 THR A 105 32.003 27.290 12.841 1.00 0.00 H new ATOM 0 HG22 THR A 105 32.568 27.325 14.528 1.00 0.00 H new ATOM 0 HG23 THR A 105 30.828 27.435 14.170 1.00 0.00 H new ATOM 1592 N PHE A 106 32.519 32.107 15.570 1.00 0.00 N ATOM 1593 CA PHE A 106 32.459 33.602 15.506 1.00 0.00 C ATOM 1594 C PHE A 106 33.500 34.118 14.504 1.00 0.00 C ATOM 1595 O PHE A 106 34.598 34.488 14.880 1.00 0.00 O ATOM 1596 CB PHE A 106 32.766 34.195 16.889 1.00 0.00 C ATOM 1597 CG PHE A 106 31.712 33.755 17.873 1.00 0.00 C ATOM 1598 CD1 PHE A 106 31.692 32.431 18.314 1.00 0.00 C ATOM 1599 CD2 PHE A 106 30.751 34.663 18.340 1.00 0.00 C ATOM 1600 CE1 PHE A 106 30.718 32.008 19.218 1.00 0.00 C ATOM 1601 CE2 PHE A 106 29.772 34.238 19.247 1.00 0.00 C ATOM 1602 CZ PHE A 106 29.757 32.909 19.685 1.00 0.00 C ATOM 0 H PHE A 106 33.334 31.727 16.052 1.00 0.00 H new ATOM 0 HA PHE A 106 31.460 33.902 15.190 1.00 0.00 H new ATOM 0 HB2 PHE A 106 33.750 33.869 17.225 1.00 0.00 H new ATOM 0 HB3 PHE A 106 32.793 35.283 16.832 1.00 0.00 H new ATOM 0 HD1 PHE A 106 32.433 31.732 17.954 1.00 0.00 H new ATOM 0 HD2 PHE A 106 30.766 35.688 18.001 1.00 0.00 H new ATOM 0 HE1 PHE A 106 30.706 30.983 19.558 1.00 0.00 H new ATOM 0 HE2 PHE A 106 29.030 34.935 19.608 1.00 0.00 H new ATOM 0 HZ PHE A 106 29.003 32.579 20.384 1.00 0.00 H new ATOM 1612 N THR A 107 33.164 34.163 13.235 1.00 0.00 N ATOM 1613 CA THR A 107 34.142 34.691 12.224 1.00 0.00 C ATOM 1614 C THR A 107 34.134 36.228 12.312 1.00 0.00 C ATOM 1615 O THR A 107 33.112 36.837 12.617 1.00 0.00 O ATOM 1616 CB THR A 107 33.751 34.232 10.802 1.00 0.00 C ATOM 1617 OG1 THR A 107 34.070 32.853 10.664 1.00 0.00 O ATOM 1618 CG2 THR A 107 34.519 35.040 9.741 1.00 0.00 C ATOM 0 H THR A 107 32.266 33.861 12.857 1.00 0.00 H new ATOM 0 HA THR A 107 35.140 34.307 12.433 1.00 0.00 H new ATOM 0 HB THR A 107 32.683 34.393 10.655 1.00 0.00 H new ATOM 0 HG1 THR A 107 33.825 32.549 9.765 1.00 0.00 H new ATOM 0 HG21 THR A 107 34.230 34.702 8.746 1.00 0.00 H new ATOM 0 HG22 THR A 107 34.282 36.099 9.848 1.00 0.00 H new ATOM 0 HG23 THR A 107 35.590 34.893 9.877 1.00 0.00 H new ATOM 1626 N LYS A 108 35.263 36.867 12.078 1.00 0.00 N ATOM 1627 CA LYS A 108 35.328 38.363 12.176 1.00 0.00 C ATOM 1628 C LYS A 108 34.769 39.017 10.906 1.00 0.00 C ATOM 1629 O LYS A 108 34.952 38.527 9.810 1.00 0.00 O ATOM 1630 CB LYS A 108 36.794 38.787 12.352 1.00 0.00 C ATOM 1631 CG LYS A 108 36.882 40.314 12.519 1.00 0.00 C ATOM 1632 CD LYS A 108 38.330 40.716 12.841 1.00 0.00 C ATOM 1633 CE LYS A 108 38.495 42.236 12.715 1.00 0.00 C ATOM 1634 NZ LYS A 108 37.918 42.896 13.923 1.00 0.00 N ATOM 0 H LYS A 108 36.141 36.414 11.823 1.00 0.00 H new ATOM 0 HA LYS A 108 34.730 38.685 13.028 1.00 0.00 H new ATOM 0 HB2 LYS A 108 37.223 38.292 13.223 1.00 0.00 H new ATOM 0 HB3 LYS A 108 37.379 38.473 11.487 1.00 0.00 H new ATOM 0 HG2 LYS A 108 36.551 40.809 11.606 1.00 0.00 H new ATOM 0 HG3 LYS A 108 36.217 40.641 13.318 1.00 0.00 H new ATOM 0 HD2 LYS A 108 38.588 40.397 13.851 1.00 0.00 H new ATOM 0 HD3 LYS A 108 39.016 40.210 12.161 1.00 0.00 H new ATOM 0 HE2 LYS A 108 39.550 42.492 12.615 1.00 0.00 H new ATOM 0 HE3 LYS A 108 37.994 42.595 11.816 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 38.285 43.866 13.997 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 36.882 42.923 13.842 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 38.185 42.359 14.773 1.00 0.00 H new ATOM 1648 N ILE A 109 34.116 40.141 11.058 1.00 0.00 N ATOM 1649 CA ILE A 109 33.559 40.874 9.881 1.00 0.00 C ATOM 1650 C ILE A 109 34.043 42.334 9.928 1.00 0.00 C ATOM 1651 O ILE A 109 34.180 42.986 8.904 1.00 0.00 O ATOM 1652 CB ILE A 109 32.029 40.811 9.924 1.00 0.00 C ATOM 1653 CG1 ILE A 109 31.513 41.393 11.251 1.00 0.00 C ATOM 1654 CG2 ILE A 109 31.597 39.342 9.805 1.00 0.00 C ATOM 1655 CD1 ILE A 109 30.055 40.976 11.463 1.00 0.00 C ATOM 0 H ILE A 109 33.943 40.587 11.959 1.00 0.00 H new ATOM 0 HA ILE A 109 33.901 40.416 8.953 1.00 0.00 H new ATOM 0 HB ILE A 109 31.614 41.394 9.102 1.00 0.00 H new ATOM 0 HG12 ILE A 109 32.127 41.038 12.079 1.00 0.00 H new ATOM 0 HG13 ILE A 109 31.593 42.480 11.238 1.00 0.00 H new ATOM 0 HG21 ILE A 109 30.509 39.279 9.834 1.00 0.00 H new ATOM 0 HG22 ILE A 109 31.959 38.931 8.862 1.00 0.00 H new ATOM 0 HG23 ILE A 109 32.016 38.771 10.634 1.00 0.00 H new ATOM 0 HD11 ILE A 109 29.691 41.389 12.404 1.00 0.00 H new ATOM 0 HD12 ILE A 109 29.446 41.353 10.642 1.00 0.00 H new ATOM 0 HD13 ILE A 109 29.989 39.888 11.495 1.00 0.00 H new ATOM 1667 N ARG A 110 34.309 42.839 11.113 1.00 0.00 N ATOM 1668 CA ARG A 110 34.794 44.249 11.270 1.00 0.00 C ATOM 1669 C ARG A 110 35.834 44.317 12.412 1.00 0.00 C ATOM 1670 O ARG A 110 35.719 43.552 13.363 1.00 0.00 O ATOM 1671 CB ARG A 110 33.601 45.157 11.607 1.00 0.00 C ATOM 1672 CG ARG A 110 32.654 45.250 10.398 1.00 0.00 C ATOM 1673 CD ARG A 110 32.706 46.661 9.805 1.00 0.00 C ATOM 1674 NE ARG A 110 31.575 46.849 8.834 1.00 0.00 N ATOM 1675 CZ ARG A 110 31.365 46.023 7.847 1.00 0.00 C ATOM 1676 NH1 ARG A 110 32.194 45.066 7.575 1.00 0.00 N ATOM 1677 NH2 ARG A 110 30.344 46.209 7.084 1.00 0.00 N ATOM 1678 OXT ARG A 110 36.734 45.130 12.318 1.00 0.00 O ATOM 0 H ARG A 110 34.209 42.326 11.989 1.00 0.00 H new ATOM 0 HA ARG A 110 35.259 44.581 10.342 1.00 0.00 H new ATOM 0 HB2 ARG A 110 33.065 44.762 12.470 1.00 0.00 H new ATOM 0 HB3 ARG A 110 33.955 46.151 11.879 1.00 0.00 H new ATOM 0 HG2 ARG A 110 32.940 44.518 9.643 1.00 0.00 H new ATOM 0 HG3 ARG A 110 31.635 45.011 10.703 1.00 0.00 H new ATOM 0 HD2 ARG A 110 32.640 47.402 10.601 1.00 0.00 H new ATOM 0 HD3 ARG A 110 33.660 46.818 9.301 1.00 0.00 H new ATOM 0 HE ARG A 110 30.952 47.648 8.950 1.00 0.00 H new ATOM 0 HH11 ARG A 110 33.035 44.944 8.139 1.00 0.00 H new ATOM 0 HH12 ARG A 110 32.006 44.434 6.797 1.00 0.00 H new ATOM 0 HH21 ARG A 110 29.715 46.993 7.256 1.00 0.00 H new ATOM 0 HH22 ARG A 110 30.165 45.572 6.307 1.00 0.00 H new