USER MOD reduce.3.24.130724 H: found=0, std=0, add=1479, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1476 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 68 HIS : no HD1:sc= -0.102 K(o=1.1,f=-0.48) USER MOD Set 1.2: C 92 SER OG : rot 76:sc= 1.16 USER MOD Set 2.1: B 55 THR OG1 : rot -65:sc= 1.27 USER MOD Set 2.2: B 57 SER OG : rot 180:sc= 0 USER MOD Set 3.1: B 6 LYS NZ :NH3+ 167:sc= 0.729 (180deg=0) USER MOD Set 3.2: B 12 THR OG1 : rot 150:sc= 0.657 USER MOD Set 4.1: B 7 THR OG1 : rot 135:sc= 1.34 USER MOD Set 4.2: B 9 THR OG1 : rot 180:sc= 1.01 USER MOD Set 5.1: A 68 HIS : no HD1:sc= 0.742 K(o=1.9,f=-0.62) USER MOD Set 5.2: C 117 SER OG : rot 78:sc= 1.14 USER MOD Set 6.1: A 55 THR OG1 : rot -50:sc= 1.26 USER MOD Set 6.2: A 57 SER OG : rot 180:sc= 0 USER MOD Set 7.1: A 6 LYS NZ :NH3+ 167:sc= 0.788 (180deg=0) USER MOD Set 7.2: A 12 THR OG1 : rot 150:sc= 0.667 USER MOD Set 8.1: A 7 THR OG1 : rot 132:sc= 1.39 USER MOD Set 8.2: A 9 THR OG1 : rot 180:sc= 0.99 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 176:sc= 1.15 (180deg=1.14) USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=-0.4) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 THR OG1 : rot -76:sc= 0.258 USER MOD Single : A 20 SER OG : rot 180:sc= 0.00529 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0.272 USER MOD Single : A 25 ASN : amide:sc= 1.1 K(o=1.1,f=-0.35) USER MOD Single : A 27 LYS NZ :NH3+ -167:sc= 0.556 (180deg=0.483) USER MOD Single : A 29 LYS NZ :NH3+ 170:sc= 1.12 (180deg=1.04) USER MOD Single : A 31 GLN : amide:sc= -0.268 X(o=-0.27,f=-0.73) USER MOD Single : A 33 LYS NZ :NH3+ 175:sc= 0.947 (180deg=0.927) USER MOD Single : A 40 GLN : amide:sc= 0 X(o=0,f=-0.39) USER MOD Single : A 41 GLN : amide:sc= 1.22 K(o=1.2,f=-3.5!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= 0.196 K(o=0.2,f=-6.1!) USER MOD Single : A 59 TYR OH : rot 60:sc= 0.378 USER MOD Single : A 60 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 62 GLN : amide:sc= 0.208 X(o=0.21,f=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 73:sc= 1.35 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ 175:sc= 1.17 (180deg=1.16) USER MOD Single : B 2 GLN : amide:sc= 0 X(o=0,f=-0.36) USER MOD Single : B 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 14 THR OG1 : rot -75:sc= 0.252 USER MOD Single : B 20 SER OG : rot 180:sc= 0.00495 USER MOD Single : B 22 THR OG1 : rot 180:sc= 0.286 USER MOD Single : B 25 ASN : amide:sc= 1.11 K(o=1.1,f=-0.39) USER MOD Single : B 27 LYS NZ :NH3+ -166:sc= 0.424 (180deg=0.367) USER MOD Single : B 29 LYS NZ :NH3+ 170:sc= 1.13 (180deg=1.03) USER MOD Single : B 31 GLN : amide:sc= -0.359 X(o=-0.36,f=-0.81) USER MOD Single : B 33 LYS NZ :NH3+ 176:sc= 0.904 (180deg=0.893) USER MOD Single : B 40 GLN : amide:sc= 0 X(o=0,f=-0.45) USER MOD Single : B 41 GLN : amide:sc= 1.15 K(o=1.1,f=-3.4!) USER MOD Single : B 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 49 GLN : amide:sc= 0 X(o=0,f=-0.046) USER MOD Single : B 59 TYR OH : rot 50:sc= 0.33 USER MOD Single : B 60 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 62 GLN : amide:sc= 0.269 X(o=0.27,f=0) USER MOD Single : B 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 65 SER OG : rot 75:sc= 1.5 USER MOD Single : B 66 THR OG1 : rot 139:sc= 1.24 USER MOD Single : C 80 THR OG1 : rot 180:sc= 0 USER MOD Single : C 84 GLN : amide:sc= -0.39 X(o=-0.39,f=-0.0087) USER MOD Single : C 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 91 MET CE :methyl -179:sc= -0.453 (180deg=-0.455) USER MOD Single : C 94 GLN : amide:sc= -0.325 X(o=-0.32,f=0) USER MOD Single : C 100 ASN : amide:sc= 1.13 K(o=1.1,f=0) USER MOD Single : C 101 SER OG : rot 68:sc= 0.0151 USER MOD Single : C 102 GLN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : C 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 119 ASN : amide:sc= 1.12 K(o=1.1,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.521 0.529 0.949 1.00 0.00 N ATOM 2 CA MET A 1 2.193 0.363 -0.378 1.00 0.00 C ATOM 3 C MET A 1 1.571 -0.784 -1.195 1.00 0.00 C ATOM 4 O MET A 1 0.766 -1.552 -0.675 1.00 0.00 O ATOM 5 CB MET A 1 3.736 0.226 -0.251 1.00 0.00 C ATOM 6 CG MET A 1 4.261 -1.078 0.377 1.00 0.00 C ATOM 7 SD MET A 1 6.069 -1.231 0.365 1.00 0.00 S ATOM 8 CE MET A 1 6.252 -2.905 1.043 1.00 0.00 C ATOM 0 H1 MET A 1 2.011 1.265 1.497 1.00 0.00 H new ATOM 0 H2 MET A 1 0.530 0.808 0.804 1.00 0.00 H new ATOM 0 H3 MET A 1 1.555 -0.370 1.470 1.00 0.00 H new ATOM 0 HA MET A 1 2.015 1.283 -0.935 1.00 0.00 H new ATOM 0 HB2 MET A 1 4.170 0.324 -1.246 1.00 0.00 H new ATOM 0 HB3 MET A 1 4.105 1.063 0.342 1.00 0.00 H new ATOM 0 HG2 MET A 1 3.909 -1.140 1.407 1.00 0.00 H new ATOM 0 HG3 MET A 1 3.832 -1.925 -0.158 1.00 0.00 H new ATOM 0 HE1 MET A 1 7.310 -3.159 1.103 1.00 0.00 H new ATOM 0 HE2 MET A 1 5.812 -2.944 2.039 1.00 0.00 H new ATOM 0 HE3 MET A 1 5.744 -3.618 0.394 1.00 0.00 H new ATOM 20 N GLN A 2 1.944 -0.918 -2.473 1.00 0.00 N ATOM 21 CA GLN A 2 1.543 -2.033 -3.350 1.00 0.00 C ATOM 22 C GLN A 2 2.766 -2.878 -3.738 1.00 0.00 C ATOM 23 O GLN A 2 3.827 -2.320 -4.021 1.00 0.00 O ATOM 24 CB GLN A 2 0.862 -1.492 -4.623 1.00 0.00 C ATOM 25 CG GLN A 2 -0.375 -0.605 -4.389 1.00 0.00 C ATOM 26 CD GLN A 2 -1.584 -1.320 -3.780 1.00 0.00 C ATOM 27 OE1 GLN A 2 -1.695 -2.537 -3.749 1.00 0.00 O ATOM 28 NE2 GLN A 2 -2.551 -0.575 -3.286 1.00 0.00 N ATOM 0 H GLN A 2 2.547 -0.241 -2.940 1.00 0.00 H new ATOM 0 HA GLN A 2 0.837 -2.661 -2.806 1.00 0.00 H new ATOM 0 HB2 GLN A 2 1.595 -0.919 -5.191 1.00 0.00 H new ATOM 0 HB3 GLN A 2 0.568 -2.338 -5.244 1.00 0.00 H new ATOM 0 HG2 GLN A 2 -0.093 0.219 -3.734 1.00 0.00 H new ATOM 0 HG3 GLN A 2 -0.674 -0.167 -5.341 1.00 0.00 H new ATOM 0 HE21 GLN A 2 -2.472 0.442 -3.305 1.00 0.00 H new ATOM 0 HE22 GLN A 2 -3.379 -1.015 -2.884 1.00 0.00 H new ATOM 37 N ILE A 3 2.616 -4.203 -3.800 1.00 0.00 N ATOM 38 CA ILE A 3 3.610 -5.141 -4.359 1.00 0.00 C ATOM 39 C ILE A 3 2.951 -6.083 -5.377 1.00 0.00 C ATOM 40 O ILE A 3 1.736 -6.292 -5.353 1.00 0.00 O ATOM 41 CB ILE A 3 4.375 -5.935 -3.269 1.00 0.00 C ATOM 42 CG1 ILE A 3 3.453 -6.878 -2.461 1.00 0.00 C ATOM 43 CG2 ILE A 3 5.168 -4.971 -2.368 1.00 0.00 C ATOM 44 CD1 ILE A 3 4.197 -7.837 -1.520 1.00 0.00 C ATOM 0 H ILE A 3 1.779 -4.673 -3.455 1.00 0.00 H new ATOM 0 HA ILE A 3 4.358 -4.538 -4.874 1.00 0.00 H new ATOM 0 HB ILE A 3 5.087 -6.590 -3.771 1.00 0.00 H new ATOM 0 HG12 ILE A 3 2.761 -6.275 -1.873 1.00 0.00 H new ATOM 0 HG13 ILE A 3 2.853 -7.464 -3.157 1.00 0.00 H new ATOM 0 HG21 ILE A 3 5.701 -5.540 -1.606 1.00 0.00 H new ATOM 0 HG22 ILE A 3 5.884 -4.414 -2.972 1.00 0.00 H new ATOM 0 HG23 ILE A 3 4.481 -4.275 -1.886 1.00 0.00 H new ATOM 0 HD11 ILE A 3 3.476 -8.462 -0.993 1.00 0.00 H new ATOM 0 HD12 ILE A 3 4.868 -8.469 -2.101 1.00 0.00 H new ATOM 0 HD13 ILE A 3 4.776 -7.262 -0.797 1.00 0.00 H new ATOM 56 N PHE A 4 3.762 -6.675 -6.249 1.00 0.00 N ATOM 57 CA PHE A 4 3.342 -7.650 -7.255 1.00 0.00 C ATOM 58 C PHE A 4 3.870 -9.050 -6.926 1.00 0.00 C ATOM 59 O PHE A 4 4.963 -9.202 -6.381 1.00 0.00 O ATOM 60 CB PHE A 4 3.804 -7.192 -8.645 1.00 0.00 C ATOM 61 CG PHE A 4 3.323 -5.806 -9.036 1.00 0.00 C ATOM 62 CD1 PHE A 4 1.950 -5.568 -9.235 1.00 0.00 C ATOM 63 CD2 PHE A 4 4.244 -4.751 -9.188 1.00 0.00 C ATOM 64 CE1 PHE A 4 1.499 -4.280 -9.580 1.00 0.00 C ATOM 65 CE2 PHE A 4 3.792 -3.467 -9.541 1.00 0.00 C ATOM 66 CZ PHE A 4 2.420 -3.229 -9.732 1.00 0.00 C ATOM 0 H PHE A 4 4.764 -6.484 -6.277 1.00 0.00 H new ATOM 0 HA PHE A 4 2.254 -7.710 -7.251 1.00 0.00 H new ATOM 0 HB2 PHE A 4 4.893 -7.209 -8.677 1.00 0.00 H new ATOM 0 HB3 PHE A 4 3.452 -7.909 -9.387 1.00 0.00 H new ATOM 0 HD1 PHE A 4 1.241 -6.375 -9.123 1.00 0.00 H new ATOM 0 HD2 PHE A 4 5.298 -4.928 -9.033 1.00 0.00 H new ATOM 0 HE1 PHE A 4 0.445 -4.099 -9.728 1.00 0.00 H new ATOM 0 HE2 PHE A 4 4.501 -2.662 -9.666 1.00 0.00 H new ATOM 0 HZ PHE A 4 2.074 -2.240 -9.995 1.00 0.00 H new ATOM 76 N VAL A 5 3.118 -10.085 -7.297 1.00 0.00 N ATOM 77 CA VAL A 5 3.516 -11.495 -7.150 1.00 0.00 C ATOM 78 C VAL A 5 3.237 -12.233 -8.459 1.00 0.00 C ATOM 79 O VAL A 5 2.096 -12.241 -8.919 1.00 0.00 O ATOM 80 CB VAL A 5 2.791 -12.165 -5.963 1.00 0.00 C ATOM 81 CG1 VAL A 5 3.344 -13.572 -5.718 1.00 0.00 C ATOM 82 CG2 VAL A 5 2.935 -11.374 -4.655 1.00 0.00 C ATOM 0 H VAL A 5 2.196 -9.971 -7.717 1.00 0.00 H new ATOM 0 HA VAL A 5 4.583 -11.542 -6.933 1.00 0.00 H new ATOM 0 HB VAL A 5 1.737 -12.200 -6.240 1.00 0.00 H new ATOM 0 HG11 VAL A 5 2.820 -14.028 -4.878 1.00 0.00 H new ATOM 0 HG12 VAL A 5 3.197 -14.181 -6.610 1.00 0.00 H new ATOM 0 HG13 VAL A 5 4.408 -13.510 -5.492 1.00 0.00 H new ATOM 0 HG21 VAL A 5 2.405 -11.893 -3.856 1.00 0.00 H new ATOM 0 HG22 VAL A 5 3.990 -11.289 -4.395 1.00 0.00 H new ATOM 0 HG23 VAL A 5 2.512 -10.378 -4.784 1.00 0.00 H new ATOM 92 N LYS A 6 4.256 -12.852 -9.064 1.00 0.00 N ATOM 93 CA LYS A 6 4.128 -13.660 -10.290 1.00 0.00 C ATOM 94 C LYS A 6 4.046 -15.156 -9.977 1.00 0.00 C ATOM 95 O LYS A 6 4.835 -15.663 -9.183 1.00 0.00 O ATOM 96 CB LYS A 6 5.274 -13.342 -11.269 1.00 0.00 C ATOM 97 CG LYS A 6 4.888 -12.190 -12.210 1.00 0.00 C ATOM 98 CD LYS A 6 6.047 -11.834 -13.158 1.00 0.00 C ATOM 99 CE LYS A 6 5.617 -10.985 -14.366 1.00 0.00 C ATOM 100 NZ LYS A 6 4.978 -9.691 -13.989 1.00 0.00 N1+ ATOM 0 H LYS A 6 5.212 -12.807 -8.712 1.00 0.00 H new ATOM 0 HA LYS A 6 3.189 -13.391 -10.774 1.00 0.00 H new ATOM 0 HB2 LYS A 6 6.171 -13.075 -10.710 1.00 0.00 H new ATOM 0 HB3 LYS A 6 5.515 -14.230 -11.854 1.00 0.00 H new ATOM 0 HG2 LYS A 6 4.011 -12.471 -12.793 1.00 0.00 H new ATOM 0 HG3 LYS A 6 4.613 -11.314 -11.623 1.00 0.00 H new ATOM 0 HD2 LYS A 6 6.810 -11.293 -12.598 1.00 0.00 H new ATOM 0 HD3 LYS A 6 6.507 -12.755 -13.517 1.00 0.00 H new ATOM 0 HE2 LYS A 6 6.490 -10.782 -14.986 1.00 0.00 H new ATOM 0 HE3 LYS A 6 4.920 -11.561 -14.975 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 4.914 -9.078 -14.827 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 4.023 -9.870 -13.618 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 5.551 -9.221 -13.259 1.00 0.00 H new ATOM 114 N THR A 7 3.104 -15.855 -10.609 1.00 0.00 N ATOM 115 CA THR A 7 2.880 -17.307 -10.458 1.00 0.00 C ATOM 116 C THR A 7 3.742 -18.136 -11.425 1.00 0.00 C ATOM 117 O THR A 7 4.291 -17.613 -12.398 1.00 0.00 O ATOM 118 CB THR A 7 1.396 -17.659 -10.687 1.00 0.00 C ATOM 119 OG1 THR A 7 1.083 -17.446 -12.041 1.00 0.00 O ATOM 120 CG2 THR A 7 0.422 -16.833 -9.849 1.00 0.00 C ATOM 0 H THR A 7 2.452 -15.421 -11.262 1.00 0.00 H new ATOM 0 HA THR A 7 3.170 -17.557 -9.438 1.00 0.00 H new ATOM 0 HB THR A 7 1.281 -18.700 -10.386 1.00 0.00 H new ATOM 0 HG1 THR A 7 0.609 -18.228 -12.394 1.00 0.00 H new ATOM 0 HG21 THR A 7 -0.600 -17.142 -10.069 1.00 0.00 H new ATOM 0 HG22 THR A 7 0.629 -16.990 -8.790 1.00 0.00 H new ATOM 0 HG23 THR A 7 0.541 -15.776 -10.089 1.00 0.00 H new ATOM 128 N LEU A 8 3.790 -19.462 -11.222 1.00 0.00 N ATOM 129 CA LEU A 8 4.392 -20.401 -12.189 1.00 0.00 C ATOM 130 C LEU A 8 3.622 -20.457 -13.527 1.00 0.00 C ATOM 131 O LEU A 8 4.206 -20.769 -14.566 1.00 0.00 O ATOM 132 CB LEU A 8 4.482 -21.809 -11.563 1.00 0.00 C ATOM 133 CG LEU A 8 5.389 -21.930 -10.324 1.00 0.00 C ATOM 134 CD1 LEU A 8 5.442 -23.389 -9.871 1.00 0.00 C ATOM 135 CD2 LEU A 8 6.816 -21.454 -10.595 1.00 0.00 C ATOM 0 H LEU A 8 3.415 -19.914 -10.388 1.00 0.00 H new ATOM 0 HA LEU A 8 5.392 -20.033 -12.418 1.00 0.00 H new ATOM 0 HB2 LEU A 8 3.477 -22.130 -11.288 1.00 0.00 H new ATOM 0 HB3 LEU A 8 4.841 -22.503 -12.323 1.00 0.00 H new ATOM 0 HG LEU A 8 4.961 -21.293 -9.550 1.00 0.00 H new ATOM 0 HD11 LEU A 8 6.084 -23.475 -8.994 1.00 0.00 H new ATOM 0 HD12 LEU A 8 4.437 -23.729 -9.620 1.00 0.00 H new ATOM 0 HD13 LEU A 8 5.843 -24.005 -10.676 1.00 0.00 H new ATOM 0 HD21 LEU A 8 7.413 -21.561 -9.689 1.00 0.00 H new ATOM 0 HD22 LEU A 8 7.255 -22.055 -11.392 1.00 0.00 H new ATOM 0 HD23 LEU A 8 6.799 -20.407 -10.897 1.00 0.00 H new ATOM 147 N THR A 9 2.328 -20.110 -13.516 1.00 0.00 N ATOM 148 CA THR A 9 1.469 -19.973 -14.712 1.00 0.00 C ATOM 149 C THR A 9 1.630 -18.628 -15.444 1.00 0.00 C ATOM 150 O THR A 9 1.002 -18.415 -16.484 1.00 0.00 O ATOM 151 CB THR A 9 -0.009 -20.213 -14.352 1.00 0.00 C ATOM 152 OG1 THR A 9 -0.403 -19.384 -13.276 1.00 0.00 O ATOM 153 CG2 THR A 9 -0.259 -21.655 -13.915 1.00 0.00 C ATOM 0 H THR A 9 1.829 -19.909 -12.649 1.00 0.00 H new ATOM 0 HA THR A 9 1.806 -20.741 -15.409 1.00 0.00 H new ATOM 0 HB THR A 9 -0.582 -19.989 -15.252 1.00 0.00 H new ATOM 0 HG1 THR A 9 -1.345 -19.550 -13.063 1.00 0.00 H new ATOM 0 HG21 THR A 9 -1.313 -21.783 -13.670 1.00 0.00 H new ATOM 0 HG22 THR A 9 0.010 -22.333 -14.725 1.00 0.00 H new ATOM 0 HG23 THR A 9 0.348 -21.880 -13.038 1.00 0.00 H new ATOM 161 N GLY A 10 2.474 -17.717 -14.936 1.00 0.00 N ATOM 162 CA GLY A 10 2.764 -16.412 -15.549 1.00 0.00 C ATOM 163 C GLY A 10 1.725 -15.314 -15.272 1.00 0.00 C ATOM 164 O GLY A 10 1.787 -14.245 -15.886 1.00 0.00 O ATOM 0 H GLY A 10 2.986 -17.871 -14.067 1.00 0.00 H new ATOM 0 HA2 GLY A 10 3.735 -16.069 -15.193 1.00 0.00 H new ATOM 0 HA3 GLY A 10 2.849 -16.546 -16.627 1.00 0.00 H new ATOM 168 N LYS A 11 0.782 -15.551 -14.350 1.00 0.00 N ATOM 169 CA LYS A 11 -0.191 -14.555 -13.865 1.00 0.00 C ATOM 170 C LYS A 11 0.492 -13.592 -12.891 1.00 0.00 C ATOM 171 O LYS A 11 1.321 -14.022 -12.090 1.00 0.00 O ATOM 172 CB LYS A 11 -1.381 -15.299 -13.222 1.00 0.00 C ATOM 173 CG LYS A 11 -2.525 -14.374 -12.773 1.00 0.00 C ATOM 174 CD LYS A 11 -3.660 -15.191 -12.136 1.00 0.00 C ATOM 175 CE LYS A 11 -4.804 -14.311 -11.607 1.00 0.00 C ATOM 176 NZ LYS A 11 -5.612 -13.701 -12.701 1.00 0.00 N1+ ATOM 0 H LYS A 11 0.670 -16.463 -13.908 1.00 0.00 H new ATOM 0 HA LYS A 11 -0.573 -13.953 -14.690 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -1.772 -16.024 -13.936 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -1.022 -15.862 -12.360 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -2.149 -13.643 -12.057 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -2.906 -13.816 -13.628 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -4.056 -15.890 -12.873 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -3.257 -15.786 -11.317 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -5.455 -14.911 -10.971 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -4.390 -13.520 -10.982 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -6.369 -13.118 -12.290 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -5.000 -13.105 -13.294 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -6.032 -14.453 -13.283 1.00 0.00 H new ATOM 190 N THR A 12 0.122 -12.310 -12.921 1.00 0.00 N ATOM 191 CA THR A 12 0.560 -11.309 -11.926 1.00 0.00 C ATOM 192 C THR A 12 -0.597 -10.933 -10.997 1.00 0.00 C ATOM 193 O THR A 12 -1.658 -10.502 -11.448 1.00 0.00 O ATOM 194 CB THR A 12 1.167 -10.062 -12.586 1.00 0.00 C ATOM 195 OG1 THR A 12 2.221 -10.446 -13.444 1.00 0.00 O ATOM 196 CG2 THR A 12 1.790 -9.110 -11.564 1.00 0.00 C ATOM 0 H THR A 12 -0.494 -11.927 -13.638 1.00 0.00 H new ATOM 0 HA THR A 12 1.350 -11.766 -11.330 1.00 0.00 H new ATOM 0 HB THR A 12 0.352 -9.566 -13.113 1.00 0.00 H new ATOM 0 HG1 THR A 12 2.288 -9.809 -14.185 1.00 0.00 H new ATOM 0 HG21 THR A 12 2.206 -8.244 -12.079 1.00 0.00 H new ATOM 0 HG22 THR A 12 1.026 -8.781 -10.860 1.00 0.00 H new ATOM 0 HG23 THR A 12 2.584 -9.626 -11.023 1.00 0.00 H new ATOM 204 N ILE A 13 -0.370 -11.079 -9.691 1.00 0.00 N ATOM 205 CA ILE A 13 -1.271 -10.691 -8.596 1.00 0.00 C ATOM 206 C ILE A 13 -0.761 -9.366 -8.010 1.00 0.00 C ATOM 207 O ILE A 13 0.448 -9.200 -7.852 1.00 0.00 O ATOM 208 CB ILE A 13 -1.312 -11.811 -7.521 1.00 0.00 C ATOM 209 CG1 ILE A 13 -1.642 -13.205 -8.113 1.00 0.00 C ATOM 210 CG2 ILE A 13 -2.323 -11.460 -6.409 1.00 0.00 C ATOM 211 CD1 ILE A 13 -1.309 -14.362 -7.163 1.00 0.00 C ATOM 0 H ILE A 13 0.495 -11.494 -9.346 1.00 0.00 H new ATOM 0 HA ILE A 13 -2.289 -10.555 -8.961 1.00 0.00 H new ATOM 0 HB ILE A 13 -0.309 -11.870 -7.099 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -2.702 -13.244 -8.364 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -1.089 -13.337 -9.043 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -2.337 -12.257 -5.665 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -2.030 -10.524 -5.933 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -3.317 -11.350 -6.842 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -1.564 -15.309 -7.639 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -0.244 -14.348 -6.932 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -1.882 -14.253 -6.242 1.00 0.00 H new ATOM 223 N THR A 14 -1.656 -8.441 -7.649 1.00 0.00 N ATOM 224 CA THR A 14 -1.302 -7.203 -6.916 1.00 0.00 C ATOM 225 C THR A 14 -1.798 -7.296 -5.474 1.00 0.00 C ATOM 226 O THR A 14 -2.953 -7.663 -5.247 1.00 0.00 O ATOM 227 CB THR A 14 -1.865 -5.949 -7.608 1.00 0.00 C ATOM 228 OG1 THR A 14 -1.522 -5.944 -8.978 1.00 0.00 O ATOM 229 CG2 THR A 14 -1.305 -4.655 -7.010 1.00 0.00 C ATOM 0 H THR A 14 -2.652 -8.522 -7.854 1.00 0.00 H new ATOM 0 HA THR A 14 -0.216 -7.108 -6.915 1.00 0.00 H new ATOM 0 HB THR A 14 -2.945 -5.986 -7.464 1.00 0.00 H new ATOM 0 HG1 THR A 14 -0.579 -5.696 -9.078 1.00 0.00 H new ATOM 0 HG21 THR A 14 -1.732 -3.798 -7.532 1.00 0.00 H new ATOM 0 HG22 THR A 14 -1.563 -4.601 -5.952 1.00 0.00 H new ATOM 0 HG23 THR A 14 -0.221 -4.643 -7.120 1.00 0.00 H new ATOM 237 N LEU A 15 -0.945 -6.971 -4.498 1.00 0.00 N ATOM 238 CA LEU A 15 -1.244 -7.037 -3.062 1.00 0.00 C ATOM 239 C LEU A 15 -0.965 -5.689 -2.378 1.00 0.00 C ATOM 240 O LEU A 15 0.119 -5.124 -2.531 1.00 0.00 O ATOM 241 CB LEU A 15 -0.407 -8.149 -2.394 1.00 0.00 C ATOM 242 CG LEU A 15 -0.537 -9.565 -2.982 1.00 0.00 C ATOM 243 CD1 LEU A 15 0.385 -10.508 -2.215 1.00 0.00 C ATOM 244 CD2 LEU A 15 -1.958 -10.122 -2.882 1.00 0.00 C ATOM 0 H LEU A 15 0.002 -6.645 -4.690 1.00 0.00 H new ATOM 0 HA LEU A 15 -2.303 -7.267 -2.947 1.00 0.00 H new ATOM 0 HB2 LEU A 15 0.642 -7.858 -2.439 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -0.680 -8.193 -1.340 1.00 0.00 H new ATOM 0 HG LEU A 15 -0.270 -9.496 -4.037 1.00 0.00 H new ATOM 0 HD11 LEU A 15 0.299 -11.514 -2.625 1.00 0.00 H new ATOM 0 HD12 LEU A 15 1.415 -10.165 -2.308 1.00 0.00 H new ATOM 0 HD13 LEU A 15 0.100 -10.520 -1.163 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -1.988 -11.123 -3.313 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -2.258 -10.168 -1.835 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -2.643 -9.472 -3.427 1.00 0.00 H new ATOM 256 N GLU A 16 -1.914 -5.218 -1.567 1.00 0.00 N ATOM 257 CA GLU A 16 -1.741 -4.036 -0.714 1.00 0.00 C ATOM 258 C GLU A 16 -1.147 -4.453 0.639 1.00 0.00 C ATOM 259 O GLU A 16 -1.710 -5.301 1.340 1.00 0.00 O ATOM 260 CB GLU A 16 -3.081 -3.301 -0.566 1.00 0.00 C ATOM 261 CG GLU A 16 -2.923 -1.952 0.145 1.00 0.00 C ATOM 262 CD GLU A 16 -4.269 -1.205 0.191 1.00 0.00 C ATOM 263 OE1 GLU A 16 -4.677 -0.628 -0.847 1.00 0.00 O1- ATOM 264 OE2 GLU A 16 -4.923 -1.190 1.262 1.00 0.00 O ATOM 0 H GLU A 16 -2.834 -5.649 -1.482 1.00 0.00 H new ATOM 0 HA GLU A 16 -1.039 -3.341 -1.175 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -3.518 -3.142 -1.552 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -3.777 -3.926 -0.006 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -2.553 -2.109 1.158 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -2.181 -1.345 -0.374 1.00 0.00 H new ATOM 271 N VAL A 17 0.005 -3.881 0.993 1.00 0.00 N ATOM 272 CA VAL A 17 0.842 -4.280 2.140 1.00 0.00 C ATOM 273 C VAL A 17 1.582 -3.080 2.727 1.00 0.00 C ATOM 274 O VAL A 17 1.764 -2.066 2.055 1.00 0.00 O ATOM 275 CB VAL A 17 1.893 -5.343 1.733 1.00 0.00 C ATOM 276 CG1 VAL A 17 1.267 -6.655 1.245 1.00 0.00 C ATOM 277 CG2 VAL A 17 2.847 -4.840 0.640 1.00 0.00 C ATOM 0 H VAL A 17 0.401 -3.098 0.473 1.00 0.00 H new ATOM 0 HA VAL A 17 0.166 -4.700 2.885 1.00 0.00 H new ATOM 0 HB VAL A 17 2.450 -5.532 2.651 1.00 0.00 H new ATOM 0 HG11 VAL A 17 2.056 -7.357 0.976 1.00 0.00 H new ATOM 0 HG12 VAL A 17 0.656 -7.084 2.039 1.00 0.00 H new ATOM 0 HG13 VAL A 17 0.643 -6.458 0.373 1.00 0.00 H new ATOM 0 HG21 VAL A 17 3.563 -5.624 0.393 1.00 0.00 H new ATOM 0 HG22 VAL A 17 2.275 -4.577 -0.250 1.00 0.00 H new ATOM 0 HG23 VAL A 17 3.382 -3.961 1.000 1.00 0.00 H new ATOM 287 N GLU A 18 2.064 -3.196 3.958 1.00 0.00 N ATOM 288 CA GLU A 18 2.984 -2.243 4.592 1.00 0.00 C ATOM 289 C GLU A 18 4.363 -2.907 4.784 1.00 0.00 C ATOM 290 O GLU A 18 4.432 -4.131 4.900 1.00 0.00 O ATOM 291 CB GLU A 18 2.405 -1.751 5.931 1.00 0.00 C ATOM 292 CG GLU A 18 1.198 -0.814 5.768 1.00 0.00 C ATOM 293 CD GLU A 18 1.607 0.555 5.186 1.00 0.00 C ATOM 294 OE1 GLU A 18 2.019 1.447 5.965 1.00 0.00 O ATOM 295 OE2 GLU A 18 1.520 0.749 3.948 1.00 0.00 O1- ATOM 0 H GLU A 18 1.822 -3.978 4.567 1.00 0.00 H new ATOM 0 HA GLU A 18 3.108 -1.373 3.948 1.00 0.00 H new ATOM 0 HB2 GLU A 18 2.108 -2.613 6.528 1.00 0.00 H new ATOM 0 HB3 GLU A 18 3.186 -1.232 6.487 1.00 0.00 H new ATOM 0 HG2 GLU A 18 0.462 -1.281 5.114 1.00 0.00 H new ATOM 0 HG3 GLU A 18 0.718 -0.668 6.736 1.00 0.00 H new ATOM 302 N PRO A 19 5.481 -2.155 4.866 1.00 0.00 N ATOM 303 CA PRO A 19 6.813 -2.742 5.080 1.00 0.00 C ATOM 304 C PRO A 19 6.922 -3.606 6.353 1.00 0.00 C ATOM 305 O PRO A 19 7.730 -4.533 6.411 1.00 0.00 O ATOM 306 CB PRO A 19 7.776 -1.549 5.123 1.00 0.00 C ATOM 307 CG PRO A 19 7.062 -0.485 4.292 1.00 0.00 C ATOM 308 CD PRO A 19 5.593 -0.722 4.629 1.00 0.00 C ATOM 0 HA PRO A 19 7.047 -3.441 4.277 1.00 0.00 H new ATOM 0 HB2 PRO A 19 7.950 -1.211 6.144 1.00 0.00 H new ATOM 0 HB3 PRO A 19 8.748 -1.803 4.701 1.00 0.00 H new ATOM 0 HG2 PRO A 19 7.382 0.521 4.563 1.00 0.00 H new ATOM 0 HG3 PRO A 19 7.257 -0.606 3.226 1.00 0.00 H new ATOM 0 HD2 PRO A 19 5.294 -0.153 5.509 1.00 0.00 H new ATOM 0 HD3 PRO A 19 4.946 -0.407 3.811 1.00 0.00 H new ATOM 316 N SER A 20 6.077 -3.337 7.353 1.00 0.00 N ATOM 317 CA SER A 20 5.960 -4.092 8.607 1.00 0.00 C ATOM 318 C SER A 20 5.124 -5.385 8.512 1.00 0.00 C ATOM 319 O SER A 20 5.084 -6.145 9.484 1.00 0.00 O ATOM 320 CB SER A 20 5.389 -3.169 9.691 1.00 0.00 C ATOM 321 OG SER A 20 4.139 -2.629 9.282 1.00 0.00 O ATOM 0 H SER A 20 5.427 -2.553 7.310 1.00 0.00 H new ATOM 0 HA SER A 20 6.966 -4.427 8.859 1.00 0.00 H new ATOM 0 HB2 SER A 20 5.264 -3.725 10.620 1.00 0.00 H new ATOM 0 HB3 SER A 20 6.091 -2.361 9.895 1.00 0.00 H new ATOM 0 HG SER A 20 3.789 -2.044 9.986 1.00 0.00 H new ATOM 327 N ASP A 21 4.474 -5.687 7.377 1.00 0.00 N ATOM 328 CA ASP A 21 3.779 -6.969 7.186 1.00 0.00 C ATOM 329 C ASP A 21 4.762 -8.147 7.192 1.00 0.00 C ATOM 330 O ASP A 21 5.828 -8.097 6.570 1.00 0.00 O ATOM 331 CB ASP A 21 2.951 -7.007 5.889 1.00 0.00 C ATOM 332 CG ASP A 21 1.528 -6.471 6.088 1.00 0.00 C ATOM 333 OD1 ASP A 21 0.795 -7.058 6.922 1.00 0.00 O ATOM 334 OD2 ASP A 21 1.129 -5.516 5.382 1.00 0.00 O1- ATOM 0 H ASP A 21 4.416 -5.058 6.576 1.00 0.00 H new ATOM 0 HA ASP A 21 3.095 -7.063 8.029 1.00 0.00 H new ATOM 0 HB2 ASP A 21 3.454 -6.418 5.122 1.00 0.00 H new ATOM 0 HB3 ASP A 21 2.902 -8.032 5.522 1.00 0.00 H new ATOM 339 N THR A 22 4.375 -9.229 7.871 1.00 0.00 N ATOM 340 CA THR A 22 5.105 -10.502 7.855 1.00 0.00 C ATOM 341 C THR A 22 4.925 -11.232 6.525 1.00 0.00 C ATOM 342 O THR A 22 3.920 -11.054 5.832 1.00 0.00 O ATOM 343 CB THR A 22 4.669 -11.426 9.002 1.00 0.00 C ATOM 344 OG1 THR A 22 3.282 -11.655 8.918 1.00 0.00 O ATOM 345 CG2 THR A 22 4.975 -10.841 10.379 1.00 0.00 C ATOM 0 H THR A 22 3.538 -9.248 8.454 1.00 0.00 H new ATOM 0 HA THR A 22 6.158 -10.254 7.987 1.00 0.00 H new ATOM 0 HB THR A 22 5.233 -12.352 8.895 1.00 0.00 H new ATOM 0 HG1 THR A 22 3.003 -12.246 9.649 1.00 0.00 H new ATOM 0 HG21 THR A 22 4.646 -11.536 11.151 1.00 0.00 H new ATOM 0 HG22 THR A 22 6.048 -10.675 10.474 1.00 0.00 H new ATOM 0 HG23 THR A 22 4.450 -9.893 10.496 1.00 0.00 H new ATOM 353 N ILE A 23 5.853 -12.127 6.179 1.00 0.00 N ATOM 354 CA ILE A 23 5.664 -13.031 5.031 1.00 0.00 C ATOM 355 C ILE A 23 4.445 -13.942 5.258 1.00 0.00 C ATOM 356 O ILE A 23 3.722 -14.234 4.311 1.00 0.00 O ATOM 357 CB ILE A 23 6.952 -13.831 4.748 1.00 0.00 C ATOM 358 CG1 ILE A 23 8.201 -12.931 4.590 1.00 0.00 C ATOM 359 CG2 ILE A 23 6.798 -14.727 3.506 1.00 0.00 C ATOM 360 CD1 ILE A 23 8.109 -11.842 3.510 1.00 0.00 C ATOM 0 H ILE A 23 6.739 -12.249 6.670 1.00 0.00 H new ATOM 0 HA ILE A 23 5.459 -12.436 4.141 1.00 0.00 H new ATOM 0 HB ILE A 23 7.107 -14.458 5.626 1.00 0.00 H new ATOM 0 HG12 ILE A 23 8.403 -12.450 5.547 1.00 0.00 H new ATOM 0 HG13 ILE A 23 9.058 -13.567 4.366 1.00 0.00 H new ATOM 0 HG21 ILE A 23 7.724 -15.276 3.336 1.00 0.00 H new ATOM 0 HG22 ILE A 23 5.982 -15.432 3.665 1.00 0.00 H new ATOM 0 HG23 ILE A 23 6.578 -14.108 2.636 1.00 0.00 H new ATOM 0 HD11 ILE A 23 9.038 -11.273 3.487 1.00 0.00 H new ATOM 0 HD12 ILE A 23 7.944 -12.307 2.538 1.00 0.00 H new ATOM 0 HD13 ILE A 23 7.279 -11.173 3.738 1.00 0.00 H new ATOM 372 N GLU A 24 4.134 -14.305 6.507 1.00 0.00 N ATOM 373 CA GLU A 24 2.892 -15.009 6.861 1.00 0.00 C ATOM 374 C GLU A 24 1.628 -14.211 6.469 1.00 0.00 C ATOM 375 O GLU A 24 0.701 -14.784 5.892 1.00 0.00 O ATOM 376 CB GLU A 24 2.914 -15.332 8.364 1.00 0.00 C ATOM 377 CG GLU A 24 1.738 -16.216 8.799 1.00 0.00 C ATOM 378 CD GLU A 24 1.857 -16.588 10.288 1.00 0.00 C ATOM 379 OE1 GLU A 24 1.491 -15.757 11.156 1.00 0.00 O ATOM 380 OE2 GLU A 24 2.305 -17.717 10.607 1.00 0.00 O1- ATOM 0 H GLU A 24 4.739 -14.119 7.307 1.00 0.00 H new ATOM 0 HA GLU A 24 2.844 -15.936 6.290 1.00 0.00 H new ATOM 0 HB2 GLU A 24 3.850 -15.834 8.610 1.00 0.00 H new ATOM 0 HB3 GLU A 24 2.893 -14.402 8.931 1.00 0.00 H new ATOM 0 HG2 GLU A 24 0.799 -15.692 8.624 1.00 0.00 H new ATOM 0 HG3 GLU A 24 1.715 -17.122 8.194 1.00 0.00 H new ATOM 387 N ASN A 25 1.604 -12.886 6.679 1.00 0.00 N ATOM 388 CA ASN A 25 0.513 -12.027 6.198 1.00 0.00 C ATOM 389 C ASN A 25 0.438 -12.011 4.661 1.00 0.00 C ATOM 390 O ASN A 25 -0.658 -12.055 4.107 1.00 0.00 O ATOM 391 CB ASN A 25 0.655 -10.592 6.747 1.00 0.00 C ATOM 392 CG ASN A 25 0.342 -10.428 8.228 1.00 0.00 C ATOM 393 OD1 ASN A 25 0.024 -11.358 8.957 1.00 0.00 O ATOM 394 ND2 ASN A 25 0.390 -9.207 8.711 1.00 0.00 N ATOM 0 H ASN A 25 2.335 -12.384 7.183 1.00 0.00 H new ATOM 0 HA ASN A 25 -0.419 -12.449 6.573 1.00 0.00 H new ATOM 0 HB2 ASN A 25 1.675 -10.252 6.568 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -0.004 -9.936 6.178 1.00 0.00 H new ATOM 0 HD21 ASN A 25 0.163 -9.037 9.691 1.00 0.00 H new ATOM 0 HD22 ASN A 25 0.655 -8.429 8.106 1.00 0.00 H new ATOM 401 N VAL A 26 1.576 -12.012 3.954 1.00 0.00 N ATOM 402 CA VAL A 26 1.596 -12.091 2.478 1.00 0.00 C ATOM 403 C VAL A 26 1.052 -13.441 1.989 1.00 0.00 C ATOM 404 O VAL A 26 0.208 -13.458 1.092 1.00 0.00 O ATOM 405 CB VAL A 26 2.995 -11.782 1.900 1.00 0.00 C ATOM 406 CG1 VAL A 26 2.991 -11.777 0.366 1.00 0.00 C ATOM 407 CG2 VAL A 26 3.476 -10.392 2.337 1.00 0.00 C ATOM 0 H VAL A 26 2.502 -11.959 4.379 1.00 0.00 H new ATOM 0 HA VAL A 26 0.930 -11.316 2.099 1.00 0.00 H new ATOM 0 HB VAL A 26 3.652 -12.566 2.277 1.00 0.00 H new ATOM 0 HG11 VAL A 26 3.994 -11.556 0.000 1.00 0.00 H new ATOM 0 HG12 VAL A 26 2.679 -12.755 -0.000 1.00 0.00 H new ATOM 0 HG13 VAL A 26 2.298 -11.017 0.006 1.00 0.00 H new ATOM 0 HG21 VAL A 26 4.463 -10.200 1.916 1.00 0.00 H new ATOM 0 HG22 VAL A 26 2.776 -9.636 1.981 1.00 0.00 H new ATOM 0 HG23 VAL A 26 3.531 -10.351 3.425 1.00 0.00 H new ATOM 417 N LYS A 27 1.414 -14.565 2.628 1.00 0.00 N ATOM 418 CA LYS A 27 0.820 -15.883 2.323 1.00 0.00 C ATOM 419 C LYS A 27 -0.695 -15.901 2.547 1.00 0.00 C ATOM 420 O LYS A 27 -1.424 -16.440 1.715 1.00 0.00 O ATOM 421 CB LYS A 27 1.463 -17.009 3.151 1.00 0.00 C ATOM 422 CG LYS A 27 2.942 -17.301 2.848 1.00 0.00 C ATOM 423 CD LYS A 27 3.389 -18.500 3.705 1.00 0.00 C ATOM 424 CE LYS A 27 4.909 -18.693 3.807 1.00 0.00 C ATOM 425 NZ LYS A 27 5.531 -19.190 2.549 1.00 0.00 N1+ ATOM 0 H LYS A 27 2.120 -14.590 3.364 1.00 0.00 H new ATOM 0 HA LYS A 27 1.021 -16.059 1.266 1.00 0.00 H new ATOM 0 HB2 LYS A 27 1.371 -16.756 4.207 1.00 0.00 H new ATOM 0 HB3 LYS A 27 0.892 -17.923 2.992 1.00 0.00 H new ATOM 0 HG2 LYS A 27 3.075 -17.522 1.789 1.00 0.00 H new ATOM 0 HG3 LYS A 27 3.554 -16.427 3.071 1.00 0.00 H new ATOM 0 HD2 LYS A 27 2.985 -18.380 4.710 1.00 0.00 H new ATOM 0 HD3 LYS A 27 2.949 -19.407 3.291 1.00 0.00 H new ATOM 0 HE2 LYS A 27 5.370 -17.744 4.080 1.00 0.00 H new ATOM 0 HE3 LYS A 27 5.125 -19.396 4.612 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 6.503 -19.506 2.743 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 4.975 -19.987 2.178 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 5.550 -18.425 1.845 1.00 0.00 H new ATOM 439 N ALA A 28 -1.180 -15.277 3.622 1.00 0.00 N ATOM 440 CA ALA A 28 -2.611 -15.160 3.922 1.00 0.00 C ATOM 441 C ALA A 28 -3.361 -14.279 2.900 1.00 0.00 C ATOM 442 O ALA A 28 -4.455 -14.639 2.464 1.00 0.00 O ATOM 443 CB ALA A 28 -2.767 -14.638 5.356 1.00 0.00 C ATOM 0 H ALA A 28 -0.583 -14.832 4.319 1.00 0.00 H new ATOM 0 HA ALA A 28 -3.071 -16.145 3.841 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -3.826 -14.545 5.596 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -2.298 -15.335 6.050 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -2.288 -13.663 5.442 1.00 0.00 H new ATOM 449 N LYS A 29 -2.754 -13.177 2.433 1.00 0.00 N ATOM 450 CA LYS A 29 -3.299 -12.331 1.351 1.00 0.00 C ATOM 451 C LYS A 29 -3.388 -13.084 0.015 1.00 0.00 C ATOM 452 O LYS A 29 -4.387 -12.967 -0.691 1.00 0.00 O ATOM 453 CB LYS A 29 -2.457 -11.047 1.229 1.00 0.00 C ATOM 454 CG LYS A 29 -2.701 -10.075 2.398 1.00 0.00 C ATOM 455 CD LYS A 29 -1.627 -8.975 2.442 1.00 0.00 C ATOM 456 CE LYS A 29 -1.852 -7.995 3.606 1.00 0.00 C ATOM 457 NZ LYS A 29 -2.900 -6.980 3.302 1.00 0.00 N1+ ATOM 0 H LYS A 29 -1.862 -12.842 2.797 1.00 0.00 H new ATOM 0 HA LYS A 29 -4.322 -12.058 1.609 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -1.400 -11.310 1.193 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -2.693 -10.548 0.289 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -3.686 -9.620 2.296 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -2.699 -10.626 3.339 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -0.643 -9.433 2.539 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -1.632 -8.426 1.500 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -2.139 -8.554 4.497 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -0.915 -7.488 3.836 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -3.135 -6.454 4.168 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -2.545 -6.320 2.581 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -3.752 -7.457 2.945 1.00 0.00 H new ATOM 471 N ILE A 30 -2.398 -13.929 -0.298 1.00 0.00 N ATOM 472 CA ILE A 30 -2.435 -14.833 -1.467 1.00 0.00 C ATOM 473 C ILE A 30 -3.501 -15.927 -1.284 1.00 0.00 C ATOM 474 O ILE A 30 -4.250 -16.203 -2.218 1.00 0.00 O ATOM 475 CB ILE A 30 -1.030 -15.417 -1.744 1.00 0.00 C ATOM 476 CG1 ILE A 30 -0.058 -14.290 -2.165 1.00 0.00 C ATOM 477 CG2 ILE A 30 -1.067 -16.506 -2.836 1.00 0.00 C ATOM 478 CD1 ILE A 30 1.419 -14.696 -2.121 1.00 0.00 C ATOM 0 H ILE A 30 -1.542 -14.009 0.252 1.00 0.00 H new ATOM 0 HA ILE A 30 -2.725 -14.258 -2.347 1.00 0.00 H new ATOM 0 HB ILE A 30 -0.680 -15.878 -0.821 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -0.306 -13.968 -3.176 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -0.208 -13.431 -1.511 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -0.060 -16.890 -3.001 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -1.718 -17.319 -2.517 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -1.448 -16.079 -3.763 1.00 0.00 H new ATOM 0 HD11 ILE A 30 2.037 -13.853 -2.430 1.00 0.00 H new ATOM 0 HD12 ILE A 30 1.686 -14.989 -1.106 1.00 0.00 H new ATOM 0 HD13 ILE A 30 1.586 -15.535 -2.797 1.00 0.00 H new ATOM 490 N GLN A 31 -3.639 -16.507 -0.087 1.00 0.00 N ATOM 491 CA GLN A 31 -4.687 -17.493 0.221 1.00 0.00 C ATOM 492 C GLN A 31 -6.097 -16.894 0.041 1.00 0.00 C ATOM 493 O GLN A 31 -6.972 -17.546 -0.524 1.00 0.00 O ATOM 494 CB GLN A 31 -4.487 -18.029 1.651 1.00 0.00 C ATOM 495 CG GLN A 31 -5.448 -19.179 2.002 1.00 0.00 C ATOM 496 CD GLN A 31 -5.352 -19.635 3.461 1.00 0.00 C ATOM 497 OE1 GLN A 31 -4.714 -19.027 4.312 1.00 0.00 O ATOM 498 NE2 GLN A 31 -5.995 -20.729 3.814 1.00 0.00 N ATOM 0 H GLN A 31 -3.024 -16.306 0.702 1.00 0.00 H new ATOM 0 HA GLN A 31 -4.603 -18.322 -0.482 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -3.459 -18.375 1.763 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -4.629 -17.215 2.362 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -6.470 -18.863 1.796 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -5.239 -20.027 1.350 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -6.532 -21.251 3.122 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -5.956 -21.055 4.780 1.00 0.00 H new ATOM 507 N ASP A 32 -6.315 -15.643 0.455 1.00 0.00 N ATOM 508 CA ASP A 32 -7.605 -14.952 0.315 1.00 0.00 C ATOM 509 C ASP A 32 -8.005 -14.700 -1.156 1.00 0.00 C ATOM 510 O ASP A 32 -9.193 -14.780 -1.487 1.00 0.00 O ATOM 511 CB ASP A 32 -7.549 -13.639 1.104 1.00 0.00 C ATOM 512 CG ASP A 32 -8.909 -12.927 1.115 1.00 0.00 C ATOM 513 OD1 ASP A 32 -9.840 -13.413 1.802 1.00 0.00 O ATOM 514 OD2 ASP A 32 -9.048 -11.867 0.459 1.00 0.00 O1- ATOM 0 H ASP A 32 -5.596 -15.074 0.901 1.00 0.00 H new ATOM 0 HA ASP A 32 -8.380 -15.602 0.720 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -7.236 -13.842 2.128 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -6.798 -12.982 0.666 1.00 0.00 H new ATOM 519 N LYS A 33 -7.031 -14.443 -2.048 1.00 0.00 N ATOM 520 CA LYS A 33 -7.275 -14.203 -3.484 1.00 0.00 C ATOM 521 C LYS A 33 -7.284 -15.475 -4.345 1.00 0.00 C ATOM 522 O LYS A 33 -8.136 -15.608 -5.223 1.00 0.00 O ATOM 523 CB LYS A 33 -6.272 -13.171 -4.032 1.00 0.00 C ATOM 524 CG LYS A 33 -6.498 -11.774 -3.430 1.00 0.00 C ATOM 525 CD LYS A 33 -5.763 -10.684 -4.225 1.00 0.00 C ATOM 526 CE LYS A 33 -6.058 -9.308 -3.608 1.00 0.00 C ATOM 527 NZ LYS A 33 -5.665 -8.188 -4.512 1.00 0.00 N1+ ATOM 0 H LYS A 33 -6.045 -14.395 -1.792 1.00 0.00 H new ATOM 0 HA LYS A 33 -8.287 -13.803 -3.554 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -5.256 -13.500 -3.813 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -6.363 -13.118 -5.117 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -7.565 -11.554 -3.413 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -6.154 -11.764 -2.396 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -4.690 -10.875 -4.217 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -6.082 -10.702 -5.267 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -7.122 -9.234 -3.382 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -5.524 -9.214 -2.663 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -5.959 -7.283 -4.092 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -4.633 -8.191 -4.640 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -6.129 -8.308 -5.435 1.00 0.00 H new ATOM 541 N GLU A 34 -6.365 -16.411 -4.096 1.00 0.00 N ATOM 542 CA GLU A 34 -6.109 -17.579 -4.962 1.00 0.00 C ATOM 543 C GLU A 34 -6.530 -18.934 -4.357 1.00 0.00 C ATOM 544 O GLU A 34 -6.575 -19.937 -5.073 1.00 0.00 O ATOM 545 CB GLU A 34 -4.615 -17.626 -5.332 1.00 0.00 C ATOM 546 CG GLU A 34 -4.076 -16.367 -6.025 1.00 0.00 C ATOM 547 CD GLU A 34 -4.832 -16.037 -7.330 1.00 0.00 C ATOM 548 OE1 GLU A 34 -4.879 -16.896 -8.244 1.00 0.00 O ATOM 549 OE2 GLU A 34 -5.372 -14.912 -7.456 1.00 0.00 O1- ATOM 0 H GLU A 34 -5.763 -16.384 -3.273 1.00 0.00 H new ATOM 0 HA GLU A 34 -6.734 -17.438 -5.844 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -4.037 -17.798 -4.424 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -4.445 -18.482 -5.985 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -4.151 -15.521 -5.342 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -3.018 -16.504 -6.247 1.00 0.00 H new ATOM 556 N GLY A 35 -6.823 -18.996 -3.052 1.00 0.00 N ATOM 557 CA GLY A 35 -7.204 -20.227 -2.342 1.00 0.00 C ATOM 558 C GLY A 35 -6.054 -21.198 -2.029 1.00 0.00 C ATOM 559 O GLY A 35 -6.311 -22.300 -1.540 1.00 0.00 O ATOM 0 H GLY A 35 -6.802 -18.176 -2.446 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -7.686 -19.950 -1.405 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -7.948 -20.754 -2.940 1.00 0.00 H new ATOM 563 N ILE A 36 -4.794 -20.823 -2.300 1.00 0.00 N ATOM 564 CA ILE A 36 -3.613 -21.694 -2.130 1.00 0.00 C ATOM 565 C ILE A 36 -3.234 -21.777 -0.636 1.00 0.00 C ATOM 566 O ILE A 36 -2.967 -20.726 -0.042 1.00 0.00 O ATOM 567 CB ILE A 36 -2.413 -21.197 -2.980 1.00 0.00 C ATOM 568 CG1 ILE A 36 -2.782 -20.988 -4.471 1.00 0.00 C ATOM 569 CG2 ILE A 36 -1.252 -22.211 -2.880 1.00 0.00 C ATOM 570 CD1 ILE A 36 -1.723 -20.212 -5.267 1.00 0.00 C ATOM 0 H ILE A 36 -4.560 -19.893 -2.649 1.00 0.00 H new ATOM 0 HA ILE A 36 -3.869 -22.692 -2.486 1.00 0.00 H new ATOM 0 HB ILE A 36 -2.115 -20.229 -2.578 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -2.934 -21.961 -4.938 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -3.731 -20.455 -4.530 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -0.410 -21.861 -3.477 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -0.943 -22.309 -1.839 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -1.583 -23.181 -3.253 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -2.051 -20.105 -6.301 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -1.587 -19.225 -4.826 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -0.778 -20.754 -5.240 1.00 0.00 H new ATOM 582 N PRO A 37 -3.139 -22.969 -0.011 1.00 0.00 N ATOM 583 CA PRO A 37 -2.747 -23.103 1.396 1.00 0.00 C ATOM 584 C PRO A 37 -1.334 -22.554 1.674 1.00 0.00 C ATOM 585 O PRO A 37 -0.416 -22.883 0.920 1.00 0.00 O ATOM 586 CB PRO A 37 -2.829 -24.604 1.711 1.00 0.00 C ATOM 587 CG PRO A 37 -3.833 -25.127 0.688 1.00 0.00 C ATOM 588 CD PRO A 37 -3.532 -24.269 -0.538 1.00 0.00 C ATOM 0 HA PRO A 37 -3.408 -22.515 2.033 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -1.859 -25.090 1.606 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -3.166 -24.782 2.732 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -3.690 -26.188 0.485 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -4.861 -25.003 1.028 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -2.735 -24.707 -1.138 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -4.407 -24.184 -1.183 1.00 0.00 H new ATOM 596 N PRO A 38 -1.100 -21.779 2.753 1.00 0.00 N ATOM 597 CA PRO A 38 0.221 -21.232 3.097 1.00 0.00 C ATOM 598 C PRO A 38 1.346 -22.277 3.190 1.00 0.00 C ATOM 599 O PRO A 38 2.473 -22.001 2.785 1.00 0.00 O ATOM 600 CB PRO A 38 0.016 -20.513 4.436 1.00 0.00 C ATOM 601 CG PRO A 38 -1.428 -20.031 4.337 1.00 0.00 C ATOM 602 CD PRO A 38 -2.110 -21.199 3.629 1.00 0.00 C ATOM 0 HA PRO A 38 0.563 -20.570 2.302 1.00 0.00 H new ATOM 0 HB2 PRO A 38 0.162 -21.184 5.283 1.00 0.00 H new ATOM 0 HB3 PRO A 38 0.712 -19.684 4.562 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -1.862 -19.841 5.319 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -1.510 -19.105 3.767 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -2.472 -21.934 4.348 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -2.974 -20.859 3.058 1.00 0.00 H new ATOM 610 N ASP A 39 1.034 -23.499 3.632 1.00 0.00 N ATOM 611 CA ASP A 39 1.981 -24.627 3.707 1.00 0.00 C ATOM 612 C ASP A 39 2.463 -25.131 2.327 1.00 0.00 C ATOM 613 O ASP A 39 3.486 -25.813 2.242 1.00 0.00 O ATOM 614 CB ASP A 39 1.325 -25.778 4.483 1.00 0.00 C ATOM 615 CG ASP A 39 1.048 -25.406 5.948 1.00 0.00 C ATOM 616 OD1 ASP A 39 1.991 -25.457 6.773 1.00 0.00 O ATOM 617 OD2 ASP A 39 -0.115 -25.075 6.279 1.00 0.00 O1- ATOM 0 H ASP A 39 0.098 -23.742 3.956 1.00 0.00 H new ATOM 0 HA ASP A 39 2.870 -24.262 4.221 1.00 0.00 H new ATOM 0 HB2 ASP A 39 0.389 -26.055 3.997 1.00 0.00 H new ATOM 0 HB3 ASP A 39 1.973 -26.653 4.448 1.00 0.00 H new ATOM 622 N GLN A 40 1.746 -24.786 1.248 1.00 0.00 N ATOM 623 CA GLN A 40 2.072 -25.117 -0.146 1.00 0.00 C ATOM 624 C GLN A 40 2.557 -23.895 -0.961 1.00 0.00 C ATOM 625 O GLN A 40 2.816 -24.026 -2.157 1.00 0.00 O ATOM 626 CB GLN A 40 0.861 -25.816 -0.794 1.00 0.00 C ATOM 627 CG GLN A 40 0.587 -27.200 -0.174 1.00 0.00 C ATOM 628 CD GLN A 40 -0.591 -27.934 -0.821 1.00 0.00 C ATOM 629 OE1 GLN A 40 -1.493 -27.354 -1.414 1.00 0.00 O ATOM 630 NE2 GLN A 40 -0.644 -29.248 -0.726 1.00 0.00 N ATOM 0 H GLN A 40 0.885 -24.245 1.327 1.00 0.00 H new ATOM 0 HA GLN A 40 2.919 -25.803 -0.148 1.00 0.00 H new ATOM 0 HB2 GLN A 40 -0.022 -25.188 -0.681 1.00 0.00 H new ATOM 0 HB3 GLN A 40 1.038 -25.928 -1.864 1.00 0.00 H new ATOM 0 HG2 GLN A 40 1.483 -27.814 -0.265 1.00 0.00 H new ATOM 0 HG3 GLN A 40 0.390 -27.080 0.891 1.00 0.00 H new ATOM 0 HE21 GLN A 40 0.095 -29.754 -0.237 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -1.424 -29.758 -1.141 1.00 0.00 H new ATOM 639 N GLN A 41 2.712 -22.720 -0.332 1.00 0.00 N ATOM 640 CA GLN A 41 3.261 -21.505 -0.953 1.00 0.00 C ATOM 641 C GLN A 41 4.729 -21.268 -0.563 1.00 0.00 C ATOM 642 O GLN A 41 5.056 -21.217 0.625 1.00 0.00 O ATOM 643 CB GLN A 41 2.472 -20.259 -0.508 1.00 0.00 C ATOM 644 CG GLN A 41 0.992 -20.169 -0.912 1.00 0.00 C ATOM 645 CD GLN A 41 0.385 -18.861 -0.396 1.00 0.00 C ATOM 646 OE1 GLN A 41 1.027 -17.825 -0.386 1.00 0.00 O ATOM 647 NE2 GLN A 41 -0.839 -18.837 0.085 1.00 0.00 N ATOM 0 H GLN A 41 2.453 -22.585 0.645 1.00 0.00 H new ATOM 0 HA GLN A 41 3.183 -21.658 -2.029 1.00 0.00 H new ATOM 0 HB2 GLN A 41 2.527 -20.197 0.579 1.00 0.00 H new ATOM 0 HB3 GLN A 41 2.982 -19.380 -0.903 1.00 0.00 H new ATOM 0 HG2 GLN A 41 0.899 -20.219 -1.997 1.00 0.00 H new ATOM 0 HG3 GLN A 41 0.444 -21.019 -0.506 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -1.402 -19.688 0.090 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -1.226 -17.968 0.452 1.00 0.00 H new ATOM 656 N ARG A 42 5.596 -20.992 -1.541 1.00 0.00 N ATOM 657 CA ARG A 42 6.983 -20.517 -1.341 1.00 0.00 C ATOM 658 C ARG A 42 7.162 -19.191 -2.082 1.00 0.00 C ATOM 659 O ARG A 42 6.873 -19.118 -3.270 1.00 0.00 O ATOM 660 CB ARG A 42 7.990 -21.572 -1.834 1.00 0.00 C ATOM 661 CG ARG A 42 8.111 -22.774 -0.886 1.00 0.00 C ATOM 662 CD ARG A 42 9.217 -23.707 -1.390 1.00 0.00 C ATOM 663 NE ARG A 42 9.402 -24.873 -0.502 1.00 0.00 N ATOM 664 CZ ARG A 42 10.539 -25.487 -0.214 1.00 0.00 C ATOM 665 NH1 ARG A 42 11.703 -24.995 -0.530 1.00 0.00 N1+ ATOM 666 NH2 ARG A 42 10.525 -26.627 0.415 1.00 0.00 N ATOM 0 H ARG A 42 5.352 -21.093 -2.526 1.00 0.00 H new ATOM 0 HA ARG A 42 7.171 -20.360 -0.279 1.00 0.00 H new ATOM 0 HB2 ARG A 42 7.687 -21.923 -2.820 1.00 0.00 H new ATOM 0 HB3 ARG A 42 8.969 -21.106 -1.949 1.00 0.00 H new ATOM 0 HG2 ARG A 42 8.339 -22.434 0.124 1.00 0.00 H new ATOM 0 HG3 ARG A 42 7.163 -23.309 -0.836 1.00 0.00 H new ATOM 0 HD2 ARG A 42 8.972 -24.051 -2.395 1.00 0.00 H new ATOM 0 HD3 ARG A 42 10.153 -23.154 -1.463 1.00 0.00 H new ATOM 0 HE ARG A 42 8.561 -25.246 -0.062 1.00 0.00 H new ATOM 0 HH11 ARG A 42 11.763 -24.102 -1.019 1.00 0.00 H new ATOM 0 HH12 ARG A 42 12.554 -25.503 -0.288 1.00 0.00 H new ATOM 0 HH21 ARG A 42 9.637 -27.049 0.687 1.00 0.00 H new ATOM 0 HH22 ARG A 42 11.402 -27.098 0.636 1.00 0.00 H new ATOM 680 N LEU A 43 7.635 -18.149 -1.400 1.00 0.00 N ATOM 681 CA LEU A 43 7.902 -16.832 -1.999 1.00 0.00 C ATOM 682 C LEU A 43 9.411 -16.616 -2.109 1.00 0.00 C ATOM 683 O LEU A 43 10.136 -16.812 -1.137 1.00 0.00 O ATOM 684 CB LEU A 43 7.214 -15.726 -1.174 1.00 0.00 C ATOM 685 CG LEU A 43 5.683 -15.676 -1.342 1.00 0.00 C ATOM 686 CD1 LEU A 43 5.071 -14.780 -0.267 1.00 0.00 C ATOM 687 CD2 LEU A 43 5.280 -15.116 -2.709 1.00 0.00 C ATOM 0 H LEU A 43 7.848 -18.191 -0.403 1.00 0.00 H new ATOM 0 HA LEU A 43 7.486 -16.790 -3.006 1.00 0.00 H new ATOM 0 HB2 LEU A 43 7.448 -15.875 -0.120 1.00 0.00 H new ATOM 0 HB3 LEU A 43 7.632 -14.761 -1.460 1.00 0.00 H new ATOM 0 HG LEU A 43 5.317 -16.699 -1.253 1.00 0.00 H new ATOM 0 HD11 LEU A 43 3.989 -14.749 -0.392 1.00 0.00 H new ATOM 0 HD12 LEU A 43 5.311 -15.178 0.719 1.00 0.00 H new ATOM 0 HD13 LEU A 43 5.476 -13.772 -0.360 1.00 0.00 H new ATOM 0 HD21 LEU A 43 4.193 -15.097 -2.788 1.00 0.00 H new ATOM 0 HD22 LEU A 43 5.669 -14.104 -2.817 1.00 0.00 H new ATOM 0 HD23 LEU A 43 5.690 -15.748 -3.496 1.00 0.00 H new ATOM 699 N ILE A 44 9.876 -16.238 -3.297 1.00 0.00 N ATOM 700 CA ILE A 44 11.279 -15.953 -3.611 1.00 0.00 C ATOM 701 C ILE A 44 11.381 -14.485 -4.064 1.00 0.00 C ATOM 702 O ILE A 44 10.546 -14.010 -4.835 1.00 0.00 O ATOM 703 CB ILE A 44 11.832 -16.960 -4.659 1.00 0.00 C ATOM 704 CG1 ILE A 44 11.881 -18.438 -4.196 1.00 0.00 C ATOM 705 CG2 ILE A 44 13.272 -16.596 -5.078 1.00 0.00 C ATOM 706 CD1 ILE A 44 10.540 -19.168 -4.039 1.00 0.00 C ATOM 0 H ILE A 44 9.262 -16.116 -4.103 1.00 0.00 H new ATOM 0 HA ILE A 44 11.906 -16.083 -2.729 1.00 0.00 H new ATOM 0 HB ILE A 44 11.119 -16.878 -5.480 1.00 0.00 H new ATOM 0 HG12 ILE A 44 12.488 -18.996 -4.909 1.00 0.00 H new ATOM 0 HG13 ILE A 44 12.400 -18.475 -3.238 1.00 0.00 H new ATOM 0 HG21 ILE A 44 13.631 -17.318 -5.811 1.00 0.00 H new ATOM 0 HG22 ILE A 44 13.282 -15.598 -5.516 1.00 0.00 H new ATOM 0 HG23 ILE A 44 13.921 -16.614 -4.203 1.00 0.00 H new ATOM 0 HD11 ILE A 44 10.719 -20.192 -3.711 1.00 0.00 H new ATOM 0 HD12 ILE A 44 9.929 -18.651 -3.299 1.00 0.00 H new ATOM 0 HD13 ILE A 44 10.018 -19.180 -4.996 1.00 0.00 H new ATOM 718 N PHE A 45 12.397 -13.758 -3.598 1.00 0.00 N ATOM 719 CA PHE A 45 12.714 -12.390 -4.035 1.00 0.00 C ATOM 720 C PHE A 45 14.233 -12.185 -4.070 1.00 0.00 C ATOM 721 O PHE A 45 14.928 -12.610 -3.147 1.00 0.00 O ATOM 722 CB PHE A 45 12.041 -11.381 -3.094 1.00 0.00 C ATOM 723 CG PHE A 45 12.372 -9.928 -3.383 1.00 0.00 C ATOM 724 CD1 PHE A 45 11.745 -9.260 -4.451 1.00 0.00 C ATOM 725 CD2 PHE A 45 13.323 -9.249 -2.596 1.00 0.00 C ATOM 726 CE1 PHE A 45 12.069 -7.920 -4.733 1.00 0.00 C ATOM 727 CE2 PHE A 45 13.644 -7.908 -2.875 1.00 0.00 C ATOM 728 CZ PHE A 45 13.017 -7.243 -3.944 1.00 0.00 C ATOM 0 H PHE A 45 13.041 -14.109 -2.889 1.00 0.00 H new ATOM 0 HA PHE A 45 12.331 -12.232 -5.043 1.00 0.00 H new ATOM 0 HB2 PHE A 45 10.961 -11.513 -3.154 1.00 0.00 H new ATOM 0 HB3 PHE A 45 12.333 -11.609 -2.069 1.00 0.00 H new ATOM 0 HD1 PHE A 45 11.014 -9.777 -5.055 1.00 0.00 H new ATOM 0 HD2 PHE A 45 13.807 -9.759 -1.776 1.00 0.00 H new ATOM 0 HE1 PHE A 45 11.590 -7.411 -5.556 1.00 0.00 H new ATOM 0 HE2 PHE A 45 14.372 -7.389 -2.268 1.00 0.00 H new ATOM 0 HZ PHE A 45 13.263 -6.214 -4.159 1.00 0.00 H new ATOM 738 N ALA A 46 14.757 -11.568 -5.135 1.00 0.00 N ATOM 739 CA ALA A 46 16.195 -11.366 -5.361 1.00 0.00 C ATOM 740 C ALA A 46 17.054 -12.644 -5.140 1.00 0.00 C ATOM 741 O ALA A 46 18.174 -12.578 -4.630 1.00 0.00 O ATOM 742 CB ALA A 46 16.656 -10.139 -4.558 1.00 0.00 C ATOM 0 H ALA A 46 14.179 -11.185 -5.883 1.00 0.00 H new ATOM 0 HA ALA A 46 16.358 -11.158 -6.418 1.00 0.00 H new ATOM 0 HB1 ALA A 46 17.722 -9.979 -4.718 1.00 0.00 H new ATOM 0 HB2 ALA A 46 16.104 -9.259 -4.888 1.00 0.00 H new ATOM 0 HB3 ALA A 46 16.469 -10.307 -3.497 1.00 0.00 H new ATOM 748 N GLY A 47 16.508 -13.820 -5.486 1.00 0.00 N ATOM 749 CA GLY A 47 17.155 -15.132 -5.305 1.00 0.00 C ATOM 750 C GLY A 47 17.115 -15.730 -3.893 1.00 0.00 C ATOM 751 O GLY A 47 17.810 -16.715 -3.637 1.00 0.00 O ATOM 0 H GLY A 47 15.583 -13.888 -5.910 1.00 0.00 H new ATOM 0 HA2 GLY A 47 16.686 -15.840 -5.988 1.00 0.00 H new ATOM 0 HA3 GLY A 47 18.198 -15.042 -5.607 1.00 0.00 H new ATOM 755 N LYS A 48 16.327 -15.157 -2.977 1.00 0.00 N ATOM 756 CA LYS A 48 16.222 -15.557 -1.562 1.00 0.00 C ATOM 757 C LYS A 48 14.804 -16.028 -1.251 1.00 0.00 C ATOM 758 O LYS A 48 13.842 -15.345 -1.598 1.00 0.00 O ATOM 759 CB LYS A 48 16.624 -14.377 -0.656 1.00 0.00 C ATOM 760 CG LYS A 48 18.095 -13.966 -0.853 1.00 0.00 C ATOM 761 CD LYS A 48 18.503 -12.751 -0.008 1.00 0.00 C ATOM 762 CE LYS A 48 17.813 -11.462 -0.485 1.00 0.00 C ATOM 763 NZ LYS A 48 18.346 -10.265 0.225 1.00 0.00 N1+ ATOM 0 H LYS A 48 15.719 -14.370 -3.206 1.00 0.00 H new ATOM 0 HA LYS A 48 16.902 -16.387 -1.370 1.00 0.00 H new ATOM 0 HB2 LYS A 48 15.979 -13.524 -0.866 1.00 0.00 H new ATOM 0 HB3 LYS A 48 16.462 -14.650 0.387 1.00 0.00 H new ATOM 0 HG2 LYS A 48 18.738 -14.809 -0.599 1.00 0.00 H new ATOM 0 HG3 LYS A 48 18.265 -13.741 -1.906 1.00 0.00 H new ATOM 0 HD2 LYS A 48 18.249 -12.933 1.036 1.00 0.00 H new ATOM 0 HD3 LYS A 48 19.584 -12.623 -0.055 1.00 0.00 H new ATOM 0 HE2 LYS A 48 17.959 -11.345 -1.559 1.00 0.00 H new ATOM 0 HE3 LYS A 48 16.739 -11.539 -0.316 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 17.860 -9.412 -0.119 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 18.184 -10.367 1.247 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 19.366 -10.179 0.043 1.00 0.00 H new ATOM 777 N GLN A 49 14.667 -17.181 -0.599 1.00 0.00 N ATOM 778 CA GLN A 49 13.375 -17.702 -0.140 1.00 0.00 C ATOM 779 C GLN A 49 12.958 -16.994 1.162 1.00 0.00 C ATOM 780 O GLN A 49 13.756 -16.873 2.094 1.00 0.00 O ATOM 781 CB GLN A 49 13.471 -19.229 0.010 1.00 0.00 C ATOM 782 CG GLN A 49 12.101 -19.894 0.213 1.00 0.00 C ATOM 783 CD GLN A 49 12.244 -21.404 0.391 1.00 0.00 C ATOM 784 OE1 GLN A 49 12.162 -22.180 -0.551 1.00 0.00 O ATOM 785 NE2 GLN A 49 12.480 -21.881 1.595 1.00 0.00 N ATOM 0 H GLN A 49 15.455 -17.787 -0.371 1.00 0.00 H new ATOM 0 HA GLN A 49 12.594 -17.495 -0.872 1.00 0.00 H new ATOM 0 HB2 GLN A 49 13.945 -19.648 -0.878 1.00 0.00 H new ATOM 0 HB3 GLN A 49 14.114 -19.467 0.857 1.00 0.00 H new ATOM 0 HG2 GLN A 49 11.612 -19.466 1.088 1.00 0.00 H new ATOM 0 HG3 GLN A 49 11.461 -19.685 -0.644 1.00 0.00 H new ATOM 0 HE21 GLN A 49 12.551 -21.246 2.390 1.00 0.00 H new ATOM 0 HE22 GLN A 49 12.592 -22.885 1.733 1.00 0.00 H new ATOM 794 N LEU A 50 11.714 -16.510 1.220 1.00 0.00 N ATOM 795 CA LEU A 50 11.219 -15.633 2.287 1.00 0.00 C ATOM 796 C LEU A 50 10.560 -16.437 3.427 1.00 0.00 C ATOM 797 O LEU A 50 9.834 -17.402 3.178 1.00 0.00 O ATOM 798 CB LEU A 50 10.296 -14.557 1.680 1.00 0.00 C ATOM 799 CG LEU A 50 10.858 -13.785 0.464 1.00 0.00 C ATOM 800 CD1 LEU A 50 9.878 -12.678 0.070 1.00 0.00 C ATOM 801 CD2 LEU A 50 12.216 -13.146 0.743 1.00 0.00 C ATOM 0 H LEU A 50 11.009 -16.720 0.514 1.00 0.00 H new ATOM 0 HA LEU A 50 12.059 -15.119 2.753 1.00 0.00 H new ATOM 0 HB2 LEU A 50 9.363 -15.034 1.382 1.00 0.00 H new ATOM 0 HB3 LEU A 50 10.050 -13.836 2.460 1.00 0.00 H new ATOM 0 HG LEU A 50 10.987 -14.510 -0.339 1.00 0.00 H new ATOM 0 HD11 LEU A 50 10.272 -12.132 -0.787 1.00 0.00 H new ATOM 0 HD12 LEU A 50 8.916 -13.120 -0.191 1.00 0.00 H new ATOM 0 HD13 LEU A 50 9.747 -11.993 0.908 1.00 0.00 H new ATOM 0 HD21 LEU A 50 12.560 -12.618 -0.147 1.00 0.00 H new ATOM 0 HD22 LEU A 50 12.124 -12.442 1.570 1.00 0.00 H new ATOM 0 HD23 LEU A 50 12.936 -13.921 1.006 1.00 0.00 H new ATOM 813 N GLU A 51 10.810 -16.042 4.678 1.00 0.00 N ATOM 814 CA GLU A 51 10.451 -16.800 5.892 1.00 0.00 C ATOM 815 C GLU A 51 9.288 -16.169 6.675 1.00 0.00 C ATOM 816 O GLU A 51 9.253 -14.958 6.883 1.00 0.00 O ATOM 817 CB GLU A 51 11.683 -16.943 6.804 1.00 0.00 C ATOM 818 CG GLU A 51 12.831 -17.724 6.149 1.00 0.00 C ATOM 819 CD GLU A 51 14.014 -17.868 7.123 1.00 0.00 C ATOM 820 OE1 GLU A 51 14.030 -18.836 7.923 1.00 0.00 O1- ATOM 821 OE2 GLU A 51 14.942 -17.023 7.092 1.00 0.00 O ATOM 0 H GLU A 51 11.281 -15.162 4.886 1.00 0.00 H new ATOM 0 HA GLU A 51 10.112 -17.782 5.562 1.00 0.00 H new ATOM 0 HB2 GLU A 51 12.039 -15.951 7.082 1.00 0.00 H new ATOM 0 HB3 GLU A 51 11.389 -17.446 7.725 1.00 0.00 H new ATOM 0 HG2 GLU A 51 12.480 -18.711 5.846 1.00 0.00 H new ATOM 0 HG3 GLU A 51 13.158 -17.210 5.245 1.00 0.00 H new ATOM 828 N ASP A 52 8.354 -16.995 7.163 1.00 0.00 N ATOM 829 CA ASP A 52 7.083 -16.581 7.786 1.00 0.00 C ATOM 830 C ASP A 52 7.226 -15.538 8.907 1.00 0.00 C ATOM 831 O ASP A 52 6.433 -14.596 8.975 1.00 0.00 O ATOM 832 CB ASP A 52 6.389 -17.824 8.364 1.00 0.00 C ATOM 833 CG ASP A 52 5.804 -18.717 7.265 1.00 0.00 C ATOM 834 OD1 ASP A 52 6.551 -19.555 6.704 1.00 0.00 O ATOM 835 OD2 ASP A 52 4.599 -18.570 6.958 1.00 0.00 O1- ATOM 0 H ASP A 52 8.464 -18.009 7.135 1.00 0.00 H new ATOM 0 HA ASP A 52 6.501 -16.105 6.997 1.00 0.00 H new ATOM 0 HB2 ASP A 52 7.104 -18.397 8.955 1.00 0.00 H new ATOM 0 HB3 ASP A 52 5.593 -17.513 9.041 1.00 0.00 H new ATOM 840 N GLY A 53 8.236 -15.700 9.772 1.00 0.00 N ATOM 841 CA GLY A 53 8.494 -14.833 10.930 1.00 0.00 C ATOM 842 C GLY A 53 9.231 -13.522 10.619 1.00 0.00 C ATOM 843 O GLY A 53 9.431 -12.711 11.526 1.00 0.00 O ATOM 0 H GLY A 53 8.914 -16.457 9.684 1.00 0.00 H new ATOM 0 HA2 GLY A 53 7.541 -14.592 11.401 1.00 0.00 H new ATOM 0 HA3 GLY A 53 9.078 -15.394 11.660 1.00 0.00 H new ATOM 847 N ARG A 54 9.650 -13.304 9.365 1.00 0.00 N ATOM 848 CA ARG A 54 10.288 -12.063 8.885 1.00 0.00 C ATOM 849 C ARG A 54 9.260 -11.136 8.231 1.00 0.00 C ATOM 850 O ARG A 54 8.157 -11.558 7.884 1.00 0.00 O ATOM 851 CB ARG A 54 11.437 -12.408 7.919 1.00 0.00 C ATOM 852 CG ARG A 54 12.576 -13.232 8.540 1.00 0.00 C ATOM 853 CD ARG A 54 13.321 -12.488 9.658 1.00 0.00 C ATOM 854 NE ARG A 54 14.467 -13.280 10.150 1.00 0.00 N ATOM 855 CZ ARG A 54 14.464 -14.207 11.093 1.00 0.00 C ATOM 856 NH1 ARG A 54 13.386 -14.524 11.758 1.00 0.00 N1+ ATOM 857 NH2 ARG A 54 15.561 -14.842 11.392 1.00 0.00 N ATOM 0 H ARG A 54 9.553 -14.006 8.631 1.00 0.00 H new ATOM 0 HA ARG A 54 10.706 -11.526 9.737 1.00 0.00 H new ATOM 0 HB2 ARG A 54 11.028 -12.960 7.073 1.00 0.00 H new ATOM 0 HB3 ARG A 54 11.852 -11.481 7.524 1.00 0.00 H new ATOM 0 HG2 ARG A 54 12.168 -14.160 8.940 1.00 0.00 H new ATOM 0 HG3 ARG A 54 13.285 -13.506 7.759 1.00 0.00 H new ATOM 0 HD2 ARG A 54 13.672 -11.525 9.287 1.00 0.00 H new ATOM 0 HD3 ARG A 54 12.637 -12.282 10.481 1.00 0.00 H new ATOM 0 HE ARG A 54 15.367 -13.089 9.710 1.00 0.00 H new ATOM 0 HH11 ARG A 54 12.505 -14.051 11.557 1.00 0.00 H new ATOM 0 HH12 ARG A 54 13.425 -15.245 12.478 1.00 0.00 H new ATOM 0 HH21 ARG A 54 16.427 -14.625 10.898 1.00 0.00 H new ATOM 0 HH22 ARG A 54 15.554 -15.556 12.120 1.00 0.00 H new ATOM 871 N THR A 55 9.621 -9.868 8.060 1.00 0.00 N ATOM 872 CA THR A 55 8.791 -8.815 7.455 1.00 0.00 C ATOM 873 C THR A 55 9.370 -8.297 6.141 1.00 0.00 C ATOM 874 O THR A 55 10.552 -8.490 5.854 1.00 0.00 O ATOM 875 CB THR A 55 8.562 -7.643 8.423 1.00 0.00 C ATOM 876 OG1 THR A 55 9.775 -6.999 8.735 1.00 0.00 O ATOM 877 CG2 THR A 55 7.905 -8.073 9.735 1.00 0.00 C ATOM 0 H THR A 55 10.537 -9.525 8.349 1.00 0.00 H new ATOM 0 HA THR A 55 7.830 -9.282 7.237 1.00 0.00 H new ATOM 0 HB THR A 55 7.889 -6.963 7.901 1.00 0.00 H new ATOM 0 HG1 THR A 55 10.438 -7.666 9.011 1.00 0.00 H new ATOM 0 HG21 THR A 55 7.769 -7.202 10.377 1.00 0.00 H new ATOM 0 HG22 THR A 55 6.935 -8.524 9.526 1.00 0.00 H new ATOM 0 HG23 THR A 55 8.542 -8.800 10.240 1.00 0.00 H new ATOM 885 N LEU A 56 8.553 -7.621 5.328 1.00 0.00 N ATOM 886 CA LEU A 56 8.984 -7.079 4.031 1.00 0.00 C ATOM 887 C LEU A 56 10.185 -6.115 4.153 1.00 0.00 C ATOM 888 O LEU A 56 11.084 -6.150 3.310 1.00 0.00 O ATOM 889 CB LEU A 56 7.776 -6.410 3.343 1.00 0.00 C ATOM 890 CG LEU A 56 6.658 -7.381 2.911 1.00 0.00 C ATOM 891 CD1 LEU A 56 5.504 -6.590 2.297 1.00 0.00 C ATOM 892 CD2 LEU A 56 7.137 -8.387 1.863 1.00 0.00 C ATOM 0 H LEU A 56 7.575 -7.433 5.548 1.00 0.00 H new ATOM 0 HA LEU A 56 9.342 -7.904 3.414 1.00 0.00 H new ATOM 0 HB2 LEU A 56 7.353 -5.670 4.022 1.00 0.00 H new ATOM 0 HB3 LEU A 56 8.129 -5.871 2.464 1.00 0.00 H new ATOM 0 HG LEU A 56 6.345 -7.923 3.804 1.00 0.00 H new ATOM 0 HD11 LEU A 56 4.714 -7.276 1.992 1.00 0.00 H new ATOM 0 HD12 LEU A 56 5.111 -5.889 3.033 1.00 0.00 H new ATOM 0 HD13 LEU A 56 5.862 -6.040 1.427 1.00 0.00 H new ATOM 0 HD21 LEU A 56 6.314 -9.049 1.591 1.00 0.00 H new ATOM 0 HD22 LEU A 56 7.482 -7.853 0.977 1.00 0.00 H new ATOM 0 HD23 LEU A 56 7.957 -8.977 2.273 1.00 0.00 H new ATOM 904 N SER A 57 10.265 -5.321 5.225 1.00 0.00 N ATOM 905 CA SER A 57 11.406 -4.433 5.496 1.00 0.00 C ATOM 906 C SER A 57 12.695 -5.172 5.896 1.00 0.00 C ATOM 907 O SER A 57 13.781 -4.655 5.630 1.00 0.00 O ATOM 908 CB SER A 57 11.045 -3.384 6.554 1.00 0.00 C ATOM 909 OG SER A 57 10.774 -3.987 7.807 1.00 0.00 O ATOM 0 H SER A 57 9.535 -5.274 5.936 1.00 0.00 H new ATOM 0 HA SER A 57 11.621 -3.939 4.549 1.00 0.00 H new ATOM 0 HB2 SER A 57 11.865 -2.674 6.660 1.00 0.00 H new ATOM 0 HB3 SER A 57 10.174 -2.818 6.225 1.00 0.00 H new ATOM 0 HG SER A 57 10.548 -3.294 8.462 1.00 0.00 H new ATOM 915 N ASP A 58 12.624 -6.397 6.441 1.00 0.00 N ATOM 916 CA ASP A 58 13.818 -7.218 6.722 1.00 0.00 C ATOM 917 C ASP A 58 14.536 -7.650 5.427 1.00 0.00 C ATOM 918 O ASP A 58 15.761 -7.798 5.411 1.00 0.00 O ATOM 919 CB ASP A 58 13.461 -8.466 7.547 1.00 0.00 C ATOM 920 CG ASP A 58 12.908 -8.141 8.943 1.00 0.00 C ATOM 921 OD1 ASP A 58 13.606 -7.455 9.728 1.00 0.00 O ATOM 922 OD2 ASP A 58 11.790 -8.609 9.266 1.00 0.00 O1- ATOM 0 H ASP A 58 11.745 -6.846 6.699 1.00 0.00 H new ATOM 0 HA ASP A 58 14.494 -6.589 7.302 1.00 0.00 H new ATOM 0 HB2 ASP A 58 12.723 -9.054 7.001 1.00 0.00 H new ATOM 0 HB3 ASP A 58 14.350 -9.088 7.653 1.00 0.00 H new ATOM 927 N TYR A 59 13.779 -7.791 4.331 1.00 0.00 N ATOM 928 CA TYR A 59 14.278 -8.082 2.982 1.00 0.00 C ATOM 929 C TYR A 59 14.468 -6.822 2.111 1.00 0.00 C ATOM 930 O TYR A 59 14.787 -6.933 0.926 1.00 0.00 O ATOM 931 CB TYR A 59 13.339 -9.105 2.325 1.00 0.00 C ATOM 932 CG TYR A 59 13.257 -10.426 3.066 1.00 0.00 C ATOM 933 CD1 TYR A 59 14.360 -11.302 3.059 1.00 0.00 C ATOM 934 CD2 TYR A 59 12.080 -10.783 3.754 1.00 0.00 C ATOM 935 CE1 TYR A 59 14.290 -12.535 3.735 1.00 0.00 C ATOM 936 CE2 TYR A 59 11.999 -12.023 4.414 1.00 0.00 C ATOM 937 CZ TYR A 59 13.106 -12.899 4.411 1.00 0.00 C ATOM 938 OH TYR A 59 13.027 -14.095 5.051 1.00 0.00 O ATOM 0 H TYR A 59 12.763 -7.702 4.362 1.00 0.00 H new ATOM 0 HA TYR A 59 15.279 -8.504 3.070 1.00 0.00 H new ATOM 0 HB2 TYR A 59 12.340 -8.675 2.256 1.00 0.00 H new ATOM 0 HB3 TYR A 59 13.676 -9.291 1.305 1.00 0.00 H new ATOM 0 HD1 TYR A 59 15.262 -11.027 2.533 1.00 0.00 H new ATOM 0 HD2 TYR A 59 11.240 -10.105 3.775 1.00 0.00 H new ATOM 0 HE1 TYR A 59 15.140 -13.201 3.736 1.00 0.00 H new ATOM 0 HE2 TYR A 59 11.089 -12.305 4.923 1.00 0.00 H new ATOM 0 HH TYR A 59 13.719 -14.142 5.744 1.00 0.00 H new ATOM 948 N ASN A 60 14.275 -5.622 2.682 1.00 0.00 N ATOM 949 CA ASN A 60 14.283 -4.321 1.992 1.00 0.00 C ATOM 950 C ASN A 60 13.309 -4.235 0.789 1.00 0.00 C ATOM 951 O ASN A 60 13.558 -3.503 -0.176 1.00 0.00 O ATOM 952 CB ASN A 60 15.731 -3.888 1.673 1.00 0.00 C ATOM 953 CG ASN A 60 16.598 -3.759 2.916 1.00 0.00 C ATOM 954 OD1 ASN A 60 16.471 -2.822 3.694 1.00 0.00 O ATOM 955 ND2 ASN A 60 17.502 -4.686 3.150 1.00 0.00 N ATOM 0 H ASN A 60 14.101 -5.528 3.683 1.00 0.00 H new ATOM 0 HA ASN A 60 13.874 -3.584 2.684 1.00 0.00 H new ATOM 0 HB2 ASN A 60 16.181 -4.614 0.996 1.00 0.00 H new ATOM 0 HB3 ASN A 60 15.712 -2.933 1.149 1.00 0.00 H new ATOM 0 HD21 ASN A 60 18.095 -4.623 3.978 1.00 0.00 H new ATOM 0 HD22 ASN A 60 17.610 -5.468 2.504 1.00 0.00 H new ATOM 962 N ILE A 61 12.189 -4.970 0.845 1.00 0.00 N ATOM 963 CA ILE A 61 11.129 -4.942 -0.174 1.00 0.00 C ATOM 964 C ILE A 61 10.367 -3.608 -0.078 1.00 0.00 C ATOM 965 O ILE A 61 10.018 -3.149 1.012 1.00 0.00 O ATOM 966 CB ILE A 61 10.210 -6.185 -0.057 1.00 0.00 C ATOM 967 CG1 ILE A 61 11.010 -7.468 -0.390 1.00 0.00 C ATOM 968 CG2 ILE A 61 8.998 -6.072 -1.002 1.00 0.00 C ATOM 969 CD1 ILE A 61 10.307 -8.781 -0.022 1.00 0.00 C ATOM 0 H ILE A 61 11.991 -5.612 1.613 1.00 0.00 H new ATOM 0 HA ILE A 61 11.569 -4.997 -1.170 1.00 0.00 H new ATOM 0 HB ILE A 61 9.844 -6.238 0.968 1.00 0.00 H new ATOM 0 HG12 ILE A 61 11.227 -7.476 -1.458 1.00 0.00 H new ATOM 0 HG13 ILE A 61 11.967 -7.427 0.130 1.00 0.00 H new ATOM 0 HG21 ILE A 61 8.372 -6.958 -0.898 1.00 0.00 H new ATOM 0 HG22 ILE A 61 8.418 -5.185 -0.746 1.00 0.00 H new ATOM 0 HG23 ILE A 61 9.346 -5.993 -2.032 1.00 0.00 H new ATOM 0 HD11 ILE A 61 10.944 -9.623 -0.293 1.00 0.00 H new ATOM 0 HD12 ILE A 61 10.114 -8.802 1.051 1.00 0.00 H new ATOM 0 HD13 ILE A 61 9.363 -8.852 -0.562 1.00 0.00 H new ATOM 981 N GLN A 62 10.135 -2.984 -1.235 1.00 0.00 N ATOM 982 CA GLN A 62 9.604 -1.620 -1.394 1.00 0.00 C ATOM 983 C GLN A 62 8.410 -1.592 -2.367 1.00 0.00 C ATOM 984 O GLN A 62 8.088 -2.607 -2.993 1.00 0.00 O ATOM 985 CB GLN A 62 10.757 -0.720 -1.887 1.00 0.00 C ATOM 986 CG GLN A 62 11.794 -0.433 -0.788 1.00 0.00 C ATOM 987 CD GLN A 62 13.100 0.098 -1.374 1.00 0.00 C ATOM 988 OE1 GLN A 62 13.249 1.275 -1.676 1.00 0.00 O ATOM 989 NE2 GLN A 62 14.087 -0.753 -1.577 1.00 0.00 N ATOM 0 H GLN A 62 10.320 -3.434 -2.132 1.00 0.00 H new ATOM 0 HA GLN A 62 9.227 -1.252 -0.440 1.00 0.00 H new ATOM 0 HB2 GLN A 62 11.252 -1.199 -2.732 1.00 0.00 H new ATOM 0 HB3 GLN A 62 10.348 0.223 -2.250 1.00 0.00 H new ATOM 0 HG2 GLN A 62 11.388 0.294 -0.084 1.00 0.00 H new ATOM 0 HG3 GLN A 62 11.991 -1.346 -0.225 1.00 0.00 H new ATOM 0 HE21 GLN A 62 13.972 -1.736 -1.329 1.00 0.00 H new ATOM 0 HE22 GLN A 62 14.965 -0.428 -1.982 1.00 0.00 H new ATOM 998 N LYS A 63 7.766 -0.429 -2.536 1.00 0.00 N ATOM 999 CA LYS A 63 6.652 -0.245 -3.485 1.00 0.00 C ATOM 1000 C LYS A 63 6.999 -0.731 -4.904 1.00 0.00 C ATOM 1001 O LYS A 63 8.123 -0.559 -5.378 1.00 0.00 O ATOM 1002 CB LYS A 63 6.176 1.223 -3.477 1.00 0.00 C ATOM 1003 CG LYS A 63 7.207 2.221 -4.035 1.00 0.00 C ATOM 1004 CD LYS A 63 6.704 3.667 -3.928 1.00 0.00 C ATOM 1005 CE LYS A 63 7.749 4.626 -4.516 1.00 0.00 C ATOM 1006 NZ LYS A 63 7.302 6.044 -4.439 1.00 0.00 N1+ ATOM 0 H LYS A 63 8.002 0.417 -2.017 1.00 0.00 H new ATOM 0 HA LYS A 63 5.826 -0.872 -3.150 1.00 0.00 H new ATOM 0 HB2 LYS A 63 5.259 1.300 -4.061 1.00 0.00 H new ATOM 0 HB3 LYS A 63 5.927 1.508 -2.455 1.00 0.00 H new ATOM 0 HG2 LYS A 63 8.145 2.120 -3.490 1.00 0.00 H new ATOM 0 HG3 LYS A 63 7.417 1.984 -5.078 1.00 0.00 H new ATOM 0 HD2 LYS A 63 5.759 3.773 -4.461 1.00 0.00 H new ATOM 0 HD3 LYS A 63 6.512 3.919 -2.885 1.00 0.00 H new ATOM 0 HE2 LYS A 63 8.690 4.512 -3.979 1.00 0.00 H new ATOM 0 HE3 LYS A 63 7.941 4.361 -5.556 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 8.034 6.661 -4.846 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 6.417 6.158 -4.973 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 7.143 6.304 -3.445 1.00 0.00 H new ATOM 1020 N GLU A 64 6.019 -1.340 -5.570 1.00 0.00 N ATOM 1021 CA GLU A 64 6.116 -1.898 -6.932 1.00 0.00 C ATOM 1022 C GLU A 64 7.186 -3.005 -7.115 1.00 0.00 C ATOM 1023 O GLU A 64 7.580 -3.309 -8.244 1.00 0.00 O ATOM 1024 CB GLU A 64 6.215 -0.767 -7.980 1.00 0.00 C ATOM 1025 CG GLU A 64 5.046 0.226 -7.908 1.00 0.00 C ATOM 1026 CD GLU A 64 5.164 1.288 -9.016 1.00 0.00 C ATOM 1027 OE1 GLU A 64 5.805 2.344 -8.786 1.00 0.00 O ATOM 1028 OE2 GLU A 64 4.611 1.081 -10.125 1.00 0.00 O1- ATOM 0 H GLU A 64 5.092 -1.467 -5.163 1.00 0.00 H new ATOM 0 HA GLU A 64 5.183 -2.435 -7.104 1.00 0.00 H new ATOM 0 HB2 GLU A 64 7.151 -0.228 -7.836 1.00 0.00 H new ATOM 0 HB3 GLU A 64 6.250 -1.206 -8.977 1.00 0.00 H new ATOM 0 HG2 GLU A 64 4.102 -0.309 -8.009 1.00 0.00 H new ATOM 0 HG3 GLU A 64 5.034 0.711 -6.932 1.00 0.00 H new ATOM 1035 N SER A 65 7.640 -3.646 -6.027 1.00 0.00 N ATOM 1036 CA SER A 65 8.511 -4.837 -6.095 1.00 0.00 C ATOM 1037 C SER A 65 7.750 -6.062 -6.617 1.00 0.00 C ATOM 1038 O SER A 65 6.569 -6.224 -6.307 1.00 0.00 O ATOM 1039 CB SER A 65 9.096 -5.195 -4.723 1.00 0.00 C ATOM 1040 OG SER A 65 9.869 -4.132 -4.202 1.00 0.00 O ATOM 0 H SER A 65 7.416 -3.356 -5.075 1.00 0.00 H new ATOM 0 HA SER A 65 9.317 -4.579 -6.782 1.00 0.00 H new ATOM 0 HB2 SER A 65 8.288 -5.433 -4.031 1.00 0.00 H new ATOM 0 HB3 SER A 65 9.714 -6.088 -4.811 1.00 0.00 H new ATOM 0 HG SER A 65 9.276 -3.406 -3.915 1.00 0.00 H new ATOM 1046 N THR A 66 8.434 -6.958 -7.338 1.00 0.00 N ATOM 1047 CA THR A 66 7.851 -8.205 -7.873 1.00 0.00 C ATOM 1048 C THR A 66 8.472 -9.436 -7.209 1.00 0.00 C ATOM 1049 O THR A 66 9.675 -9.670 -7.322 1.00 0.00 O ATOM 1050 CB THR A 66 7.994 -8.287 -9.401 1.00 0.00 C ATOM 1051 OG1 THR A 66 7.410 -7.148 -9.997 1.00 0.00 O ATOM 1052 CG2 THR A 66 7.274 -9.506 -9.988 1.00 0.00 C ATOM 0 H THR A 66 9.420 -6.841 -7.572 1.00 0.00 H new ATOM 0 HA THR A 66 6.787 -8.189 -7.637 1.00 0.00 H new ATOM 0 HB THR A 66 9.062 -8.358 -9.608 1.00 0.00 H new ATOM 0 HG1 THR A 66 7.505 -7.203 -10.971 1.00 0.00 H new ATOM 0 HG21 THR A 66 7.404 -9.519 -11.070 1.00 0.00 H new ATOM 0 HG22 THR A 66 7.693 -10.417 -9.561 1.00 0.00 H new ATOM 0 HG23 THR A 66 6.211 -9.450 -9.751 1.00 0.00 H new ATOM 1060 N LEU A 67 7.640 -10.231 -6.532 1.00 0.00 N ATOM 1061 CA LEU A 67 8.002 -11.499 -5.890 1.00 0.00 C ATOM 1062 C LEU A 67 7.650 -12.687 -6.805 1.00 0.00 C ATOM 1063 O LEU A 67 6.701 -12.623 -7.588 1.00 0.00 O ATOM 1064 CB LEU A 67 7.283 -11.627 -4.528 1.00 0.00 C ATOM 1065 CG LEU A 67 7.739 -10.691 -3.386 1.00 0.00 C ATOM 1066 CD1 LEU A 67 7.463 -9.204 -3.624 1.00 0.00 C ATOM 1067 CD2 LEU A 67 7.005 -11.090 -2.102 1.00 0.00 C ATOM 0 H LEU A 67 6.654 -10.000 -6.411 1.00 0.00 H new ATOM 0 HA LEU A 67 9.078 -11.511 -5.718 1.00 0.00 H new ATOM 0 HB2 LEU A 67 6.219 -11.461 -4.693 1.00 0.00 H new ATOM 0 HB3 LEU A 67 7.395 -12.655 -4.184 1.00 0.00 H new ATOM 0 HG LEU A 67 8.821 -10.810 -3.322 1.00 0.00 H new ATOM 0 HD11 LEU A 67 7.817 -8.627 -2.770 1.00 0.00 H new ATOM 0 HD12 LEU A 67 7.984 -8.877 -4.524 1.00 0.00 H new ATOM 0 HD13 LEU A 67 6.391 -9.048 -3.748 1.00 0.00 H new ATOM 0 HD21 LEU A 67 7.317 -10.437 -1.287 1.00 0.00 H new ATOM 0 HD22 LEU A 67 5.930 -10.994 -2.253 1.00 0.00 H new ATOM 0 HD23 LEU A 67 7.245 -12.123 -1.852 1.00 0.00 H new ATOM 1079 N HIS A 68 8.374 -13.797 -6.667 1.00 0.00 N ATOM 1080 CA HIS A 68 8.170 -15.045 -7.414 1.00 0.00 C ATOM 1081 C HIS A 68 7.492 -16.088 -6.513 1.00 0.00 C ATOM 1082 O HIS A 68 8.073 -16.510 -5.514 1.00 0.00 O ATOM 1083 CB HIS A 68 9.537 -15.520 -7.950 1.00 0.00 C ATOM 1084 CG HIS A 68 10.194 -14.511 -8.864 1.00 0.00 C ATOM 1085 ND1 HIS A 68 11.247 -13.653 -8.516 1.00 0.00 N ATOM 1086 CD2 HIS A 68 9.795 -14.226 -10.138 1.00 0.00 C ATOM 1087 CE1 HIS A 68 11.442 -12.864 -9.588 1.00 0.00 C ATOM 1088 NE2 HIS A 68 10.595 -13.194 -10.577 1.00 0.00 N ATOM 0 H HIS A 68 9.150 -13.858 -6.007 1.00 0.00 H new ATOM 0 HA HIS A 68 7.507 -14.889 -8.265 1.00 0.00 H new ATOM 0 HB2 HIS A 68 10.199 -15.726 -7.109 1.00 0.00 H new ATOM 0 HB3 HIS A 68 9.404 -16.458 -8.489 1.00 0.00 H new ATOM 0 HD2 HIS A 68 9.007 -14.714 -10.693 1.00 0.00 H new ATOM 0 HE1 HIS A 68 12.177 -12.075 -9.645 1.00 0.00 H new ATOM 0 HE2 HIS A 68 10.552 -12.755 -11.497 1.00 0.00 H new ATOM 1096 N LEU A 69 6.266 -16.503 -6.848 1.00 0.00 N ATOM 1097 CA LEU A 69 5.507 -17.526 -6.118 1.00 0.00 C ATOM 1098 C LEU A 69 5.726 -18.912 -6.740 1.00 0.00 C ATOM 1099 O LEU A 69 5.333 -19.173 -7.878 1.00 0.00 O ATOM 1100 CB LEU A 69 4.018 -17.128 -6.065 1.00 0.00 C ATOM 1101 CG LEU A 69 3.070 -18.161 -5.420 1.00 0.00 C ATOM 1102 CD1 LEU A 69 3.379 -18.409 -3.944 1.00 0.00 C ATOM 1103 CD2 LEU A 69 1.629 -17.665 -5.521 1.00 0.00 C ATOM 0 H LEU A 69 5.762 -16.129 -7.652 1.00 0.00 H new ATOM 0 HA LEU A 69 5.869 -17.587 -5.092 1.00 0.00 H new ATOM 0 HB2 LEU A 69 3.931 -16.190 -5.516 1.00 0.00 H new ATOM 0 HB3 LEU A 69 3.677 -16.935 -7.082 1.00 0.00 H new ATOM 0 HG LEU A 69 3.213 -19.096 -5.962 1.00 0.00 H new ATOM 0 HD11 LEU A 69 2.680 -19.144 -3.544 1.00 0.00 H new ATOM 0 HD12 LEU A 69 4.397 -18.784 -3.844 1.00 0.00 H new ATOM 0 HD13 LEU A 69 3.280 -17.476 -3.390 1.00 0.00 H new ATOM 0 HD21 LEU A 69 0.960 -18.395 -5.065 1.00 0.00 H new ATOM 0 HD22 LEU A 69 1.535 -16.712 -5.000 1.00 0.00 H new ATOM 0 HD23 LEU A 69 1.362 -17.533 -6.570 1.00 0.00 H new ATOM 1115 N VAL A 70 6.305 -19.809 -5.944 1.00 0.00 N ATOM 1116 CA VAL A 70 6.475 -21.239 -6.225 1.00 0.00 C ATOM 1117 C VAL A 70 5.425 -22.038 -5.437 1.00 0.00 C ATOM 1118 O VAL A 70 5.113 -21.720 -4.290 1.00 0.00 O ATOM 1119 CB VAL A 70 7.925 -21.667 -5.915 1.00 0.00 C ATOM 1120 CG1 VAL A 70 8.120 -23.184 -5.996 1.00 0.00 C ATOM 1121 CG2 VAL A 70 8.911 -21.007 -6.891 1.00 0.00 C ATOM 0 H VAL A 70 6.690 -19.547 -5.036 1.00 0.00 H new ATOM 0 HA VAL A 70 6.311 -21.446 -7.282 1.00 0.00 H new ATOM 0 HB VAL A 70 8.121 -21.341 -4.893 1.00 0.00 H new ATOM 0 HG11 VAL A 70 9.157 -23.430 -5.769 1.00 0.00 H new ATOM 0 HG12 VAL A 70 7.465 -23.674 -5.276 1.00 0.00 H new ATOM 0 HG13 VAL A 70 7.877 -23.529 -7.001 1.00 0.00 H new ATOM 0 HG21 VAL A 70 9.926 -21.324 -6.652 1.00 0.00 H new ATOM 0 HG22 VAL A 70 8.668 -21.305 -7.911 1.00 0.00 H new ATOM 0 HG23 VAL A 70 8.839 -19.923 -6.803 1.00 0.00 H new ATOM 1131 N LEU A 71 4.871 -23.072 -6.073 1.00 0.00 N ATOM 1132 CA LEU A 71 3.847 -23.973 -5.529 1.00 0.00 C ATOM 1133 C LEU A 71 3.988 -25.385 -6.148 1.00 0.00 C ATOM 1134 O LEU A 71 5.017 -25.687 -6.755 1.00 0.00 O ATOM 1135 CB LEU A 71 2.447 -23.340 -5.735 1.00 0.00 C ATOM 1136 CG LEU A 71 1.988 -23.162 -7.201 1.00 0.00 C ATOM 1137 CD1 LEU A 71 0.476 -23.354 -7.312 1.00 0.00 C ATOM 1138 CD2 LEU A 71 2.314 -21.767 -7.745 1.00 0.00 C ATOM 0 H LEU A 71 5.135 -23.318 -7.027 1.00 0.00 H new ATOM 0 HA LEU A 71 3.983 -24.104 -4.455 1.00 0.00 H new ATOM 0 HB2 LEU A 71 1.712 -23.958 -5.218 1.00 0.00 H new ATOM 0 HB3 LEU A 71 2.438 -22.363 -5.252 1.00 0.00 H new ATOM 0 HG LEU A 71 2.525 -23.911 -7.783 1.00 0.00 H new ATOM 0 HD11 LEU A 71 0.168 -23.226 -8.350 1.00 0.00 H new ATOM 0 HD12 LEU A 71 0.211 -24.357 -6.976 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -0.031 -22.617 -6.689 1.00 0.00 H new ATOM 0 HD21 LEU A 71 1.973 -21.690 -8.777 1.00 0.00 H new ATOM 0 HD22 LEU A 71 1.811 -21.013 -7.139 1.00 0.00 H new ATOM 0 HD23 LEU A 71 3.391 -21.604 -7.706 1.00 0.00 H new ATOM 1232 N MET B 1 1.344 -40.525 10.099 1.00 0.00 N ATOM 1233 CA MET B 1 1.307 -40.393 8.609 1.00 0.00 C ATOM 1234 C MET B 1 0.402 -41.454 7.957 1.00 0.00 C ATOM 1235 O MET B 1 -0.033 -42.389 8.623 1.00 0.00 O ATOM 1236 CB MET B 1 2.728 -40.365 7.978 1.00 0.00 C ATOM 1237 CG MET B 1 3.530 -41.679 8.025 1.00 0.00 C ATOM 1238 SD MET B 1 5.090 -41.624 7.102 1.00 0.00 S ATOM 1239 CE MET B 1 5.639 -43.342 7.303 1.00 0.00 C ATOM 0 H1 MET B 1 2.029 -39.847 10.491 1.00 0.00 H new ATOM 0 H2 MET B 1 0.400 -40.327 10.489 1.00 0.00 H new ATOM 0 H3 MET B 1 1.629 -41.492 10.355 1.00 0.00 H new ATOM 0 HA MET B 1 0.859 -39.422 8.396 1.00 0.00 H new ATOM 0 HB2 MET B 1 2.632 -40.062 6.935 1.00 0.00 H new ATOM 0 HB3 MET B 1 3.309 -39.593 8.482 1.00 0.00 H new ATOM 0 HG2 MET B 1 3.744 -41.925 9.065 1.00 0.00 H new ATOM 0 HG3 MET B 1 2.912 -42.484 7.627 1.00 0.00 H new ATOM 0 HE1 MET B 1 6.592 -43.482 6.792 1.00 0.00 H new ATOM 0 HE2 MET B 1 5.760 -43.564 8.363 1.00 0.00 H new ATOM 0 HE3 MET B 1 4.895 -44.014 6.875 1.00 0.00 H new ATOM 1251 N GLN B 2 0.121 -41.327 6.654 1.00 0.00 N ATOM 1252 CA GLN B 2 -0.630 -42.315 5.857 1.00 0.00 C ATOM 1253 C GLN B 2 0.267 -42.931 4.771 1.00 0.00 C ATOM 1254 O GLN B 2 1.010 -42.204 4.109 1.00 0.00 O ATOM 1255 CB GLN B 2 -1.858 -41.650 5.202 1.00 0.00 C ATOM 1256 CG GLN B 2 -2.839 -40.965 6.172 1.00 0.00 C ATOM 1257 CD GLN B 2 -3.580 -41.908 7.123 1.00 0.00 C ATOM 1258 OE1 GLN B 2 -3.638 -43.118 6.957 1.00 0.00 O ATOM 1259 NE2 GLN B 2 -4.197 -41.375 8.158 1.00 0.00 N ATOM 0 H GLN B 2 0.415 -40.517 6.109 1.00 0.00 H new ATOM 0 HA GLN B 2 -0.966 -43.108 6.526 1.00 0.00 H new ATOM 0 HB2 GLN B 2 -1.508 -40.909 4.484 1.00 0.00 H new ATOM 0 HB3 GLN B 2 -2.402 -42.408 4.638 1.00 0.00 H new ATOM 0 HG2 GLN B 2 -2.288 -40.235 6.766 1.00 0.00 H new ATOM 0 HG3 GLN B 2 -3.575 -40.411 5.589 1.00 0.00 H new ATOM 0 HE21 GLN B 2 -4.159 -40.367 8.311 1.00 0.00 H new ATOM 0 HE22 GLN B 2 -4.713 -41.970 8.806 1.00 0.00 H new ATOM 1268 N ILE B 3 0.167 -44.244 4.550 1.00 0.00 N ATOM 1269 CA ILE B 3 0.787 -44.959 3.415 1.00 0.00 C ATOM 1270 C ILE B 3 -0.261 -45.790 2.663 1.00 0.00 C ATOM 1271 O ILE B 3 -1.303 -46.149 3.218 1.00 0.00 O ATOM 1272 CB ILE B 3 1.997 -45.827 3.846 1.00 0.00 C ATOM 1273 CG1 ILE B 3 1.592 -46.975 4.801 1.00 0.00 C ATOM 1274 CG2 ILE B 3 3.104 -44.935 4.437 1.00 0.00 C ATOM 1275 CD1 ILE B 3 2.715 -47.980 5.093 1.00 0.00 C ATOM 0 H ILE B 3 -0.360 -44.862 5.168 1.00 0.00 H new ATOM 0 HA ILE B 3 1.181 -44.204 2.735 1.00 0.00 H new ATOM 0 HB ILE B 3 2.395 -46.316 2.957 1.00 0.00 H new ATOM 0 HG12 ILE B 3 1.251 -46.545 5.743 1.00 0.00 H new ATOM 0 HG13 ILE B 3 0.745 -47.509 4.370 1.00 0.00 H new ATOM 0 HG21 ILE B 3 3.949 -45.555 4.737 1.00 0.00 H new ATOM 0 HG22 ILE B 3 3.430 -44.215 3.687 1.00 0.00 H new ATOM 0 HG23 ILE B 3 2.718 -44.404 5.307 1.00 0.00 H new ATOM 0 HD11 ILE B 3 2.347 -48.751 5.770 1.00 0.00 H new ATOM 0 HD12 ILE B 3 3.042 -48.441 4.161 1.00 0.00 H new ATOM 0 HD13 ILE B 3 3.555 -47.462 5.556 1.00 0.00 H new ATOM 1287 N PHE B 4 0.034 -46.126 1.410 1.00 0.00 N ATOM 1288 CA PHE B 4 -0.801 -46.971 0.557 1.00 0.00 C ATOM 1289 C PHE B 4 -0.147 -48.336 0.332 1.00 0.00 C ATOM 1290 O PHE B 4 1.069 -48.426 0.174 1.00 0.00 O ATOM 1291 CB PHE B 4 -1.072 -46.251 -0.771 1.00 0.00 C ATOM 1292 CG PHE B 4 -1.745 -44.900 -0.616 1.00 0.00 C ATOM 1293 CD1 PHE B 4 -3.051 -44.819 -0.095 1.00 0.00 C ATOM 1294 CD2 PHE B 4 -1.066 -43.720 -0.980 1.00 0.00 C ATOM 1295 CE1 PHE B 4 -3.671 -43.568 0.068 1.00 0.00 C ATOM 1296 CE2 PHE B 4 -1.692 -42.470 -0.825 1.00 0.00 C ATOM 1297 CZ PHE B 4 -2.992 -42.392 -0.297 1.00 0.00 C ATOM 0 H PHE B 4 0.885 -45.809 0.945 1.00 0.00 H new ATOM 0 HA PHE B 4 -1.754 -47.151 1.055 1.00 0.00 H new ATOM 0 HB2 PHE B 4 -0.128 -46.116 -1.298 1.00 0.00 H new ATOM 0 HB3 PHE B 4 -1.698 -46.888 -1.396 1.00 0.00 H new ATOM 0 HD1 PHE B 4 -3.578 -45.721 0.180 1.00 0.00 H new ATOM 0 HD2 PHE B 4 -0.064 -43.776 -1.378 1.00 0.00 H new ATOM 0 HE1 PHE B 4 -4.670 -43.510 0.474 1.00 0.00 H new ATOM 0 HE2 PHE B 4 -1.172 -41.568 -1.112 1.00 0.00 H new ATOM 0 HZ PHE B 4 -3.469 -41.431 -0.172 1.00 0.00 H new ATOM 1307 N VAL B 5 -0.949 -49.401 0.269 1.00 0.00 N ATOM 1308 CA VAL B 5 -0.496 -50.765 -0.048 1.00 0.00 C ATOM 1309 C VAL B 5 -1.337 -51.322 -1.196 1.00 0.00 C ATOM 1310 O VAL B 5 -2.555 -51.435 -1.059 1.00 0.00 O ATOM 1311 CB VAL B 5 -0.549 -51.695 1.185 1.00 0.00 C ATOM 1312 CG1 VAL B 5 0.121 -53.038 0.874 1.00 0.00 C ATOM 1313 CG2 VAL B 5 0.154 -51.092 2.407 1.00 0.00 C ATOM 0 H VAL B 5 -1.953 -49.342 0.440 1.00 0.00 H new ATOM 0 HA VAL B 5 0.549 -50.719 -0.355 1.00 0.00 H new ATOM 0 HB VAL B 5 -1.606 -51.830 1.417 1.00 0.00 H new ATOM 0 HG11 VAL B 5 0.074 -53.680 1.754 1.00 0.00 H new ATOM 0 HG12 VAL B 5 -0.397 -53.520 0.045 1.00 0.00 H new ATOM 0 HG13 VAL B 5 1.163 -52.870 0.602 1.00 0.00 H new ATOM 0 HG21 VAL B 5 0.087 -51.786 3.245 1.00 0.00 H new ATOM 0 HG22 VAL B 5 1.202 -50.909 2.170 1.00 0.00 H new ATOM 0 HG23 VAL B 5 -0.327 -50.151 2.676 1.00 0.00 H new ATOM 1323 N LYS B 6 -0.710 -51.672 -2.324 1.00 0.00 N ATOM 1324 CA LYS B 6 -1.375 -52.302 -3.478 1.00 0.00 C ATOM 1325 C LYS B 6 -1.276 -53.828 -3.422 1.00 0.00 C ATOM 1326 O LYS B 6 -0.199 -54.369 -3.179 1.00 0.00 O ATOM 1327 CB LYS B 6 -0.826 -51.729 -4.797 1.00 0.00 C ATOM 1328 CG LYS B 6 -1.625 -50.485 -5.215 1.00 0.00 C ATOM 1329 CD LYS B 6 -1.055 -49.853 -6.494 1.00 0.00 C ATOM 1330 CE LYS B 6 -2.017 -48.858 -7.168 1.00 0.00 C ATOM 1331 NZ LYS B 6 -2.419 -47.727 -6.284 1.00 0.00 N1+ ATOM 0 H LYS B 6 0.289 -51.525 -2.467 1.00 0.00 H new ATOM 0 HA LYS B 6 -2.437 -52.062 -3.433 1.00 0.00 H new ATOM 0 HB2 LYS B 6 0.226 -51.470 -4.678 1.00 0.00 H new ATOM 0 HB3 LYS B 6 -0.882 -52.485 -5.580 1.00 0.00 H new ATOM 0 HG2 LYS B 6 -2.668 -50.758 -5.377 1.00 0.00 H new ATOM 0 HG3 LYS B 6 -1.609 -49.753 -4.408 1.00 0.00 H new ATOM 0 HD2 LYS B 6 -0.124 -49.340 -6.253 1.00 0.00 H new ATOM 0 HD3 LYS B 6 -0.808 -50.644 -7.202 1.00 0.00 H new ATOM 0 HE2 LYS B 6 -1.543 -48.457 -8.064 1.00 0.00 H new ATOM 0 HE3 LYS B 6 -2.911 -49.391 -7.491 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 -2.879 -46.988 -6.853 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 -3.082 -48.071 -5.561 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 -1.576 -47.332 -5.821 1.00 0.00 H new ATOM 1345 N THR B 7 -2.394 -54.514 -3.654 1.00 0.00 N ATOM 1346 CA THR B 7 -2.502 -55.986 -3.652 1.00 0.00 C ATOM 1347 C THR B 7 -2.165 -56.601 -5.019 1.00 0.00 C ATOM 1348 O THR B 7 -2.113 -55.906 -6.038 1.00 0.00 O ATOM 1349 CB THR B 7 -3.919 -56.433 -3.242 1.00 0.00 C ATOM 1350 OG1 THR B 7 -4.821 -56.065 -4.257 1.00 0.00 O ATOM 1351 CG2 THR B 7 -4.411 -55.821 -1.931 1.00 0.00 C ATOM 0 H THR B 7 -3.282 -54.054 -3.856 1.00 0.00 H new ATOM 0 HA THR B 7 -1.773 -56.343 -2.925 1.00 0.00 H new ATOM 0 HB THR B 7 -3.869 -57.512 -3.095 1.00 0.00 H new ATOM 0 HG1 THR B 7 -5.424 -56.814 -4.446 1.00 0.00 H new ATOM 0 HG21 THR B 7 -5.415 -56.186 -1.713 1.00 0.00 H new ATOM 0 HG22 THR B 7 -3.738 -56.105 -1.122 1.00 0.00 H new ATOM 0 HG23 THR B 7 -4.431 -54.735 -2.021 1.00 0.00 H new ATOM 1359 N LEU B 8 -2.032 -57.934 -5.071 1.00 0.00 N ATOM 1360 CA LEU B 8 -1.927 -58.690 -6.331 1.00 0.00 C ATOM 1361 C LEU B 8 -3.190 -58.582 -7.212 1.00 0.00 C ATOM 1362 O LEU B 8 -3.103 -58.708 -8.433 1.00 0.00 O ATOM 1363 CB LEU B 8 -1.644 -60.171 -6.010 1.00 0.00 C ATOM 1364 CG LEU B 8 -0.283 -60.471 -5.358 1.00 0.00 C ATOM 1365 CD1 LEU B 8 -0.107 -61.987 -5.245 1.00 0.00 C ATOM 1366 CD2 LEU B 8 0.880 -59.873 -6.154 1.00 0.00 C ATOM 0 H LEU B 8 -1.994 -58.522 -4.238 1.00 0.00 H new ATOM 0 HA LEU B 8 -1.109 -58.252 -6.902 1.00 0.00 H new ATOM 0 HB2 LEU B 8 -2.430 -60.536 -5.348 1.00 0.00 H new ATOM 0 HB3 LEU B 8 -1.715 -60.743 -6.935 1.00 0.00 H new ATOM 0 HG LEU B 8 -0.272 -60.011 -4.370 1.00 0.00 H new ATOM 0 HD11 LEU B 8 0.856 -62.208 -4.784 1.00 0.00 H new ATOM 0 HD12 LEU B 8 -0.907 -62.401 -4.632 1.00 0.00 H new ATOM 0 HD13 LEU B 8 -0.144 -62.433 -6.239 1.00 0.00 H new ATOM 0 HD21 LEU B 8 1.821 -60.110 -5.657 1.00 0.00 H new ATOM 0 HD22 LEU B 8 0.886 -60.292 -7.160 1.00 0.00 H new ATOM 0 HD23 LEU B 8 0.763 -58.791 -6.212 1.00 0.00 H new ATOM 1378 N THR B 9 -4.350 -58.315 -6.598 1.00 0.00 N ATOM 1379 CA THR B 9 -5.645 -58.081 -7.269 1.00 0.00 C ATOM 1380 C THR B 9 -5.850 -56.630 -7.741 1.00 0.00 C ATOM 1381 O THR B 9 -6.876 -56.322 -8.352 1.00 0.00 O ATOM 1382 CB THR B 9 -6.810 -58.514 -6.360 1.00 0.00 C ATOM 1383 OG1 THR B 9 -6.704 -57.899 -5.090 1.00 0.00 O ATOM 1384 CG2 THR B 9 -6.815 -60.023 -6.124 1.00 0.00 C ATOM 0 H THR B 9 -4.420 -58.253 -5.582 1.00 0.00 H new ATOM 0 HA THR B 9 -5.629 -58.695 -8.170 1.00 0.00 H new ATOM 0 HB THR B 9 -7.725 -58.213 -6.870 1.00 0.00 H new ATOM 0 HG1 THR B 9 -7.453 -58.183 -4.525 1.00 0.00 H new ATOM 0 HG21 THR B 9 -7.652 -60.287 -5.478 1.00 0.00 H new ATOM 0 HG22 THR B 9 -6.916 -60.540 -7.078 1.00 0.00 H new ATOM 0 HG23 THR B 9 -5.881 -60.320 -5.647 1.00 0.00 H new ATOM 1392 N GLY B 10 -4.890 -55.730 -7.485 1.00 0.00 N ATOM 1393 CA GLY B 10 -4.936 -54.320 -7.897 1.00 0.00 C ATOM 1394 C GLY B 10 -5.767 -53.402 -6.986 1.00 0.00 C ATOM 1395 O GLY B 10 -6.007 -52.244 -7.342 1.00 0.00 O ATOM 0 H GLY B 10 -4.040 -55.968 -6.974 1.00 0.00 H new ATOM 0 HA2 GLY B 10 -3.917 -53.937 -7.941 1.00 0.00 H new ATOM 0 HA3 GLY B 10 -5.340 -54.266 -8.908 1.00 0.00 H new ATOM 1399 N LYS B 11 -6.196 -53.889 -5.813 1.00 0.00 N ATOM 1400 CA LYS B 11 -6.853 -53.092 -4.762 1.00 0.00 C ATOM 1401 C LYS B 11 -5.812 -52.229 -4.042 1.00 0.00 C ATOM 1402 O LYS B 11 -4.694 -52.687 -3.813 1.00 0.00 O ATOM 1403 CB LYS B 11 -7.590 -54.049 -3.802 1.00 0.00 C ATOM 1404 CG LYS B 11 -8.411 -53.340 -2.713 1.00 0.00 C ATOM 1405 CD LYS B 11 -9.090 -54.369 -1.794 1.00 0.00 C ATOM 1406 CE LYS B 11 -9.865 -53.718 -0.637 1.00 0.00 C ATOM 1407 NZ LYS B 11 -11.112 -53.038 -1.093 1.00 0.00 N1+ ATOM 0 H LYS B 11 -6.094 -54.872 -5.561 1.00 0.00 H new ATOM 0 HA LYS B 11 -7.589 -52.413 -5.193 1.00 0.00 H new ATOM 0 HB2 LYS B 11 -8.254 -54.689 -4.383 1.00 0.00 H new ATOM 0 HB3 LYS B 11 -6.858 -54.700 -3.324 1.00 0.00 H new ATOM 0 HG2 LYS B 11 -7.762 -52.691 -2.125 1.00 0.00 H new ATOM 0 HG3 LYS B 11 -9.165 -52.703 -3.175 1.00 0.00 H new ATOM 0 HD2 LYS B 11 -9.773 -54.980 -2.384 1.00 0.00 H new ATOM 0 HD3 LYS B 11 -8.333 -55.039 -1.386 1.00 0.00 H new ATOM 0 HE2 LYS B 11 -10.120 -54.480 0.099 1.00 0.00 H new ATOM 0 HE3 LYS B 11 -9.223 -52.993 -0.136 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 -11.596 -52.616 -0.275 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 -10.871 -52.291 -1.775 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 -11.740 -53.732 -1.547 1.00 0.00 H new ATOM 1421 N THR B 12 -6.180 -51.008 -3.648 1.00 0.00 N ATOM 1422 CA THR B 12 -5.341 -50.140 -2.795 1.00 0.00 C ATOM 1423 C THR B 12 -5.929 -50.046 -1.384 1.00 0.00 C ATOM 1424 O THR B 12 -7.075 -49.635 -1.202 1.00 0.00 O ATOM 1425 CB THR B 12 -5.144 -48.746 -3.409 1.00 0.00 C ATOM 1426 OG1 THR B 12 -4.595 -48.872 -4.703 1.00 0.00 O ATOM 1427 CG2 THR B 12 -4.145 -47.903 -2.616 1.00 0.00 C ATOM 0 H THR B 12 -7.071 -50.585 -3.909 1.00 0.00 H new ATOM 0 HA THR B 12 -4.354 -50.598 -2.728 1.00 0.00 H new ATOM 0 HB THR B 12 -6.124 -48.268 -3.411 1.00 0.00 H new ATOM 0 HG1 THR B 12 -4.897 -48.125 -5.260 1.00 0.00 H new ATOM 0 HG21 THR B 12 -4.038 -46.926 -3.088 1.00 0.00 H new ATOM 0 HG22 THR B 12 -4.506 -47.776 -1.595 1.00 0.00 H new ATOM 0 HG23 THR B 12 -3.178 -48.405 -2.599 1.00 0.00 H new ATOM 1435 N ILE B 13 -5.122 -50.409 -0.388 1.00 0.00 N ATOM 1436 CA ILE B 13 -5.404 -50.295 1.051 1.00 0.00 C ATOM 1437 C ILE B 13 -4.710 -49.029 1.572 1.00 0.00 C ATOM 1438 O ILE B 13 -3.572 -48.761 1.188 1.00 0.00 O ATOM 1439 CB ILE B 13 -4.907 -51.565 1.792 1.00 0.00 C ATOM 1440 CG1 ILE B 13 -5.462 -52.876 1.176 1.00 0.00 C ATOM 1441 CG2 ILE B 13 -5.265 -51.497 3.291 1.00 0.00 C ATOM 1442 CD1 ILE B 13 -4.699 -54.128 1.628 1.00 0.00 C ATOM 0 H ILE B 13 -4.203 -50.813 -0.568 1.00 0.00 H new ATOM 0 HA ILE B 13 -6.476 -50.216 1.231 1.00 0.00 H new ATOM 0 HB ILE B 13 -3.823 -51.585 1.676 1.00 0.00 H new ATOM 0 HG12 ILE B 13 -6.512 -52.981 1.448 1.00 0.00 H new ATOM 0 HG13 ILE B 13 -5.419 -52.805 0.089 1.00 0.00 H new ATOM 0 HG21 ILE B 13 -4.908 -52.397 3.792 1.00 0.00 H new ATOM 0 HG22 ILE B 13 -4.794 -50.622 3.738 1.00 0.00 H new ATOM 0 HG23 ILE B 13 -6.347 -51.424 3.404 1.00 0.00 H new ATOM 0 HD11 ILE B 13 -5.138 -55.010 1.161 1.00 0.00 H new ATOM 0 HD12 ILE B 13 -3.653 -54.043 1.332 1.00 0.00 H new ATOM 0 HD13 ILE B 13 -4.763 -54.222 2.712 1.00 0.00 H new ATOM 1454 N THR B 14 -5.349 -48.269 2.466 1.00 0.00 N ATOM 1455 CA THR B 14 -4.714 -47.130 3.167 1.00 0.00 C ATOM 1456 C THR B 14 -4.438 -47.509 4.621 1.00 0.00 C ATOM 1457 O THR B 14 -5.329 -48.029 5.296 1.00 0.00 O ATOM 1458 CB THR B 14 -5.577 -45.858 3.088 1.00 0.00 C ATOM 1459 OG1 THR B 14 -5.950 -45.599 1.750 1.00 0.00 O ATOM 1460 CG2 THR B 14 -4.830 -44.618 3.584 1.00 0.00 C ATOM 0 H THR B 14 -6.323 -48.420 2.730 1.00 0.00 H new ATOM 0 HA THR B 14 -3.770 -46.907 2.669 1.00 0.00 H new ATOM 0 HB THR B 14 -6.445 -46.043 3.720 1.00 0.00 H new ATOM 0 HG1 THR B 14 -5.181 -45.241 1.259 1.00 0.00 H new ATOM 0 HG21 THR B 14 -5.481 -43.747 3.508 1.00 0.00 H new ATOM 0 HG22 THR B 14 -4.536 -44.762 4.624 1.00 0.00 H new ATOM 0 HG23 THR B 14 -3.941 -44.461 2.974 1.00 0.00 H new ATOM 1468 N LEU B 15 -3.221 -47.259 5.112 1.00 0.00 N ATOM 1469 CA LEU B 15 -2.790 -47.577 6.480 1.00 0.00 C ATOM 1470 C LEU B 15 -2.252 -46.329 7.196 1.00 0.00 C ATOM 1471 O LEU B 15 -1.385 -45.629 6.668 1.00 0.00 O ATOM 1472 CB LEU B 15 -1.708 -48.678 6.460 1.00 0.00 C ATOM 1473 CG LEU B 15 -2.081 -50.002 5.771 1.00 0.00 C ATOM 1474 CD1 LEU B 15 -0.886 -50.950 5.850 1.00 0.00 C ATOM 1475 CD2 LEU B 15 -3.271 -50.701 6.429 1.00 0.00 C ATOM 0 H LEU B 15 -2.488 -46.818 4.556 1.00 0.00 H new ATOM 0 HA LEU B 15 -3.659 -47.939 7.029 1.00 0.00 H new ATOM 0 HB2 LEU B 15 -0.823 -48.276 5.967 1.00 0.00 H new ATOM 0 HB3 LEU B 15 -1.427 -48.898 7.490 1.00 0.00 H new ATOM 0 HG LEU B 15 -2.353 -49.762 4.743 1.00 0.00 H new ATOM 0 HD11 LEU B 15 -1.137 -51.893 5.365 1.00 0.00 H new ATOM 0 HD12 LEU B 15 -0.030 -50.500 5.347 1.00 0.00 H new ATOM 0 HD13 LEU B 15 -0.636 -51.135 6.895 1.00 0.00 H new ATOM 0 HD21 LEU B 15 -3.487 -51.629 5.899 1.00 0.00 H new ATOM 0 HD22 LEU B 15 -3.032 -50.924 7.469 1.00 0.00 H new ATOM 0 HD23 LEU B 15 -4.144 -50.049 6.389 1.00 0.00 H new ATOM 1487 N GLU B 16 -2.714 -46.101 8.428 1.00 0.00 N ATOM 1488 CA GLU B 16 -2.181 -45.063 9.317 1.00 0.00 C ATOM 1489 C GLU B 16 -1.005 -45.629 10.125 1.00 0.00 C ATOM 1490 O GLU B 16 -1.147 -46.631 10.832 1.00 0.00 O ATOM 1491 CB GLU B 16 -3.304 -44.522 10.214 1.00 0.00 C ATOM 1492 CG GLU B 16 -2.856 -43.302 11.025 1.00 0.00 C ATOM 1493 CD GLU B 16 -4.033 -42.733 11.838 1.00 0.00 C ATOM 1494 OE1 GLU B 16 -4.902 -42.045 11.247 1.00 0.00 O1- ATOM 1495 OE2 GLU B 16 -4.095 -42.967 13.070 1.00 0.00 O ATOM 0 H GLU B 16 -3.477 -46.637 8.842 1.00 0.00 H new ATOM 0 HA GLU B 16 -1.801 -44.225 8.733 1.00 0.00 H new ATOM 0 HB2 GLU B 16 -4.162 -44.252 9.598 1.00 0.00 H new ATOM 0 HB3 GLU B 16 -3.635 -45.307 10.894 1.00 0.00 H new ATOM 0 HG2 GLU B 16 -2.044 -43.582 11.696 1.00 0.00 H new ATOM 0 HG3 GLU B 16 -2.465 -42.536 10.355 1.00 0.00 H new ATOM 1502 N VAL B 17 0.166 -45.003 9.997 1.00 0.00 N ATOM 1503 CA VAL B 17 1.457 -45.486 10.519 1.00 0.00 C ATOM 1504 C VAL B 17 2.362 -44.319 10.909 1.00 0.00 C ATOM 1505 O VAL B 17 2.187 -43.204 10.422 1.00 0.00 O ATOM 1506 CB VAL B 17 2.205 -46.349 9.474 1.00 0.00 C ATOM 1507 CG1 VAL B 17 1.450 -47.629 9.099 1.00 0.00 C ATOM 1508 CG2 VAL B 17 2.504 -45.580 8.179 1.00 0.00 C ATOM 0 H VAL B 17 0.250 -44.111 9.509 1.00 0.00 H new ATOM 0 HA VAL B 17 1.230 -46.092 11.396 1.00 0.00 H new ATOM 0 HB VAL B 17 3.139 -46.616 9.968 1.00 0.00 H new ATOM 0 HG11 VAL B 17 2.027 -48.189 8.363 1.00 0.00 H new ATOM 0 HG12 VAL B 17 1.306 -48.241 9.990 1.00 0.00 H new ATOM 0 HG13 VAL B 17 0.479 -47.369 8.677 1.00 0.00 H new ATOM 0 HG21 VAL B 17 3.029 -46.232 7.481 1.00 0.00 H new ATOM 0 HG22 VAL B 17 1.569 -45.247 7.730 1.00 0.00 H new ATOM 0 HG23 VAL B 17 3.127 -44.714 8.405 1.00 0.00 H new ATOM 1518 N GLU B 18 3.365 -44.568 11.741 1.00 0.00 N ATOM 1519 CA GLU B 18 4.453 -43.628 12.043 1.00 0.00 C ATOM 1520 C GLU B 18 5.773 -44.151 11.437 1.00 0.00 C ATOM 1521 O GLU B 18 5.918 -45.362 11.265 1.00 0.00 O ATOM 1522 CB GLU B 18 4.576 -43.424 13.564 1.00 0.00 C ATOM 1523 CG GLU B 18 3.410 -42.625 14.168 1.00 0.00 C ATOM 1524 CD GLU B 18 3.435 -41.147 13.732 1.00 0.00 C ATOM 1525 OE1 GLU B 18 4.145 -40.337 14.378 1.00 0.00 O ATOM 1526 OE2 GLU B 18 2.751 -40.782 12.745 1.00 0.00 O1- ATOM 0 H GLU B 18 3.453 -45.452 12.242 1.00 0.00 H new ATOM 0 HA GLU B 18 4.230 -42.659 11.596 1.00 0.00 H new ATOM 0 HB2 GLU B 18 4.630 -44.398 14.051 1.00 0.00 H new ATOM 0 HB3 GLU B 18 5.511 -42.907 13.780 1.00 0.00 H new ATOM 0 HG2 GLU B 18 2.466 -43.077 13.864 1.00 0.00 H new ATOM 0 HG3 GLU B 18 3.456 -42.683 15.255 1.00 0.00 H new ATOM 1533 N PRO B 19 6.774 -43.299 11.134 1.00 0.00 N ATOM 1534 CA PRO B 19 8.059 -43.756 10.583 1.00 0.00 C ATOM 1535 C PRO B 19 8.787 -44.795 11.462 1.00 0.00 C ATOM 1536 O PRO B 19 9.545 -45.620 10.955 1.00 0.00 O ATOM 1537 CB PRO B 19 8.894 -42.483 10.402 1.00 0.00 C ATOM 1538 CG PRO B 19 7.843 -41.390 10.224 1.00 0.00 C ATOM 1539 CD PRO B 19 6.723 -41.843 11.156 1.00 0.00 C ATOM 0 HA PRO B 19 7.897 -44.287 9.645 1.00 0.00 H new ATOM 0 HB2 PRO B 19 9.528 -42.293 11.268 1.00 0.00 H new ATOM 0 HB3 PRO B 19 9.551 -42.554 9.535 1.00 0.00 H new ATOM 0 HG2 PRO B 19 8.229 -40.409 10.502 1.00 0.00 H new ATOM 0 HG3 PRO B 19 7.505 -41.318 9.190 1.00 0.00 H new ATOM 0 HD2 PRO B 19 6.871 -41.459 12.165 1.00 0.00 H new ATOM 0 HD3 PRO B 19 5.754 -41.478 10.815 1.00 0.00 H new ATOM 1547 N SER B 20 8.519 -44.786 12.772 1.00 0.00 N ATOM 1548 CA SER B 20 9.035 -45.741 13.761 1.00 0.00 C ATOM 1549 C SER B 20 8.288 -47.090 13.816 1.00 0.00 C ATOM 1550 O SER B 20 8.738 -47.994 14.525 1.00 0.00 O ATOM 1551 CB SER B 20 9.033 -45.074 15.143 1.00 0.00 C ATOM 1552 OG SER B 20 7.727 -44.624 15.480 1.00 0.00 O ATOM 0 H SER B 20 7.910 -44.083 13.191 1.00 0.00 H new ATOM 0 HA SER B 20 10.046 -45.996 13.444 1.00 0.00 H new ATOM 0 HB2 SER B 20 9.385 -45.781 15.894 1.00 0.00 H new ATOM 0 HB3 SER B 20 9.726 -44.233 15.148 1.00 0.00 H new ATOM 0 HG SER B 20 7.744 -44.203 16.365 1.00 0.00 H new ATOM 1558 N ASP B 21 7.180 -47.277 13.082 1.00 0.00 N ATOM 1559 CA ASP B 21 6.510 -48.582 12.991 1.00 0.00 C ATOM 1560 C ASP B 21 7.401 -49.626 12.305 1.00 0.00 C ATOM 1561 O ASP B 21 8.038 -49.352 11.281 1.00 0.00 O ATOM 1562 CB ASP B 21 5.160 -48.507 12.256 1.00 0.00 C ATOM 1563 CG ASP B 21 3.998 -48.174 13.200 1.00 0.00 C ATOM 1564 OD1 ASP B 21 3.773 -48.965 14.148 1.00 0.00 O ATOM 1565 OD2 ASP B 21 3.286 -47.170 12.964 1.00 0.00 O1- ATOM 0 H ASP B 21 6.729 -46.539 12.542 1.00 0.00 H new ATOM 0 HA ASP B 21 6.320 -48.888 14.020 1.00 0.00 H new ATOM 0 HB2 ASP B 21 5.217 -47.750 11.473 1.00 0.00 H new ATOM 0 HB3 ASP B 21 4.964 -49.460 11.764 1.00 0.00 H new ATOM 1570 N THR B 22 7.411 -50.842 12.855 1.00 0.00 N ATOM 1571 CA THR B 22 8.076 -52.002 12.252 1.00 0.00 C ATOM 1572 C THR B 22 7.295 -52.534 11.051 1.00 0.00 C ATOM 1573 O THR B 22 6.077 -52.367 10.959 1.00 0.00 O ATOM 1574 CB THR B 22 8.277 -53.136 13.268 1.00 0.00 C ATOM 1575 OG1 THR B 22 7.030 -53.508 13.807 1.00 0.00 O ATOM 1576 CG2 THR B 22 9.199 -52.741 14.419 1.00 0.00 C ATOM 0 H THR B 22 6.953 -51.053 13.742 1.00 0.00 H new ATOM 0 HA THR B 22 9.053 -51.655 11.916 1.00 0.00 H new ATOM 0 HB THR B 22 8.742 -53.963 12.732 1.00 0.00 H new ATOM 0 HG1 THR B 22 7.157 -54.233 14.454 1.00 0.00 H new ATOM 0 HG21 THR B 22 9.304 -53.581 15.106 1.00 0.00 H new ATOM 0 HG22 THR B 22 10.178 -52.470 14.024 1.00 0.00 H new ATOM 0 HG23 THR B 22 8.774 -51.889 14.950 1.00 0.00 H new ATOM 1584 N ILE B 23 7.962 -53.257 10.149 1.00 0.00 N ATOM 1585 CA ILE B 23 7.267 -53.992 9.080 1.00 0.00 C ATOM 1586 C ILE B 23 6.336 -55.062 9.678 1.00 0.00 C ATOM 1587 O ILE B 23 5.254 -55.290 9.146 1.00 0.00 O ATOM 1588 CB ILE B 23 8.279 -54.587 8.077 1.00 0.00 C ATOM 1589 CG1 ILE B 23 9.260 -53.533 7.515 1.00 0.00 C ATOM 1590 CG2 ILE B 23 7.570 -55.309 6.917 1.00 0.00 C ATOM 1591 CD1 ILE B 23 8.619 -52.322 6.820 1.00 0.00 C ATOM 0 H ILE B 23 8.977 -53.352 10.134 1.00 0.00 H new ATOM 0 HA ILE B 23 6.641 -53.296 8.522 1.00 0.00 H new ATOM 0 HB ILE B 23 8.863 -55.312 8.644 1.00 0.00 H new ATOM 0 HG12 ILE B 23 9.881 -53.170 8.334 1.00 0.00 H new ATOM 0 HG13 ILE B 23 9.924 -54.025 6.805 1.00 0.00 H new ATOM 0 HG21 ILE B 23 8.314 -55.715 6.232 1.00 0.00 H new ATOM 0 HG22 ILE B 23 6.960 -56.121 7.312 1.00 0.00 H new ATOM 0 HG23 ILE B 23 6.933 -54.603 6.384 1.00 0.00 H new ATOM 0 HD11 ILE B 23 9.401 -51.650 6.466 1.00 0.00 H new ATOM 0 HD12 ILE B 23 8.022 -52.662 5.974 1.00 0.00 H new ATOM 0 HD13 ILE B 23 7.979 -51.794 7.527 1.00 0.00 H new ATOM 1603 N GLU B 24 6.677 -55.641 10.834 1.00 0.00 N ATOM 1604 CA GLU B 24 5.777 -56.526 11.591 1.00 0.00 C ATOM 1605 C GLU B 24 4.463 -55.822 11.999 1.00 0.00 C ATOM 1606 O GLU B 24 3.387 -56.400 11.831 1.00 0.00 O ATOM 1607 CB GLU B 24 6.531 -57.074 12.814 1.00 0.00 C ATOM 1608 CG GLU B 24 5.733 -58.139 13.573 1.00 0.00 C ATOM 1609 CD GLU B 24 6.565 -58.726 14.729 1.00 0.00 C ATOM 1610 OE1 GLU B 24 6.647 -58.088 15.807 1.00 0.00 O ATOM 1611 OE2 GLU B 24 7.136 -59.835 14.575 1.00 0.00 O1- ATOM 0 H GLU B 24 7.587 -55.510 11.275 1.00 0.00 H new ATOM 0 HA GLU B 24 5.480 -57.354 10.947 1.00 0.00 H new ATOM 0 HB2 GLU B 24 7.480 -57.500 12.489 1.00 0.00 H new ATOM 0 HB3 GLU B 24 6.765 -56.251 13.490 1.00 0.00 H new ATOM 0 HG2 GLU B 24 4.815 -57.701 13.965 1.00 0.00 H new ATOM 0 HG3 GLU B 24 5.439 -58.936 12.889 1.00 0.00 H new ATOM 1618 N ASN B 25 4.512 -54.556 12.442 1.00 0.00 N ATOM 1619 CA ASN B 25 3.304 -53.761 12.703 1.00 0.00 C ATOM 1620 C ASN B 25 2.497 -53.514 11.416 1.00 0.00 C ATOM 1621 O ASN B 25 1.271 -53.594 11.444 1.00 0.00 O ATOM 1622 CB ASN B 25 3.660 -52.422 13.383 1.00 0.00 C ATOM 1623 CG ASN B 25 4.096 -52.527 14.838 1.00 0.00 C ATOM 1624 OD1 ASN B 25 4.193 -53.591 15.438 1.00 0.00 O ATOM 1625 ND2 ASN B 25 4.338 -51.399 15.467 1.00 0.00 N ATOM 0 H ASN B 25 5.383 -54.059 12.628 1.00 0.00 H new ATOM 0 HA ASN B 25 2.677 -54.339 13.383 1.00 0.00 H new ATOM 0 HB2 ASN B 25 4.459 -51.946 12.815 1.00 0.00 H new ATOM 0 HB3 ASN B 25 2.793 -51.763 13.327 1.00 0.00 H new ATOM 0 HD21 ASN B 25 4.606 -51.411 16.451 1.00 0.00 H new ATOM 0 HD22 ASN B 25 4.258 -50.511 14.971 1.00 0.00 H new ATOM 1632 N VAL B 26 3.152 -53.277 10.273 1.00 0.00 N ATOM 1633 CA VAL B 26 2.461 -53.127 8.973 1.00 0.00 C ATOM 1634 C VAL B 26 1.776 -54.436 8.555 1.00 0.00 C ATOM 1635 O VAL B 26 0.606 -54.408 8.177 1.00 0.00 O ATOM 1636 CB VAL B 26 3.405 -52.586 7.877 1.00 0.00 C ATOM 1637 CG1 VAL B 26 2.676 -52.371 6.544 1.00 0.00 C ATOM 1638 CG2 VAL B 26 3.986 -51.224 8.280 1.00 0.00 C ATOM 0 H VAL B 26 4.166 -53.183 10.216 1.00 0.00 H new ATOM 0 HA VAL B 26 1.678 -52.379 9.101 1.00 0.00 H new ATOM 0 HB VAL B 26 4.188 -53.335 7.762 1.00 0.00 H new ATOM 0 HG11 VAL B 26 3.378 -51.990 5.803 1.00 0.00 H new ATOM 0 HG12 VAL B 26 2.262 -53.318 6.199 1.00 0.00 H new ATOM 0 HG13 VAL B 26 1.869 -51.652 6.683 1.00 0.00 H new ATOM 0 HG21 VAL B 26 4.648 -50.863 7.492 1.00 0.00 H new ATOM 0 HG22 VAL B 26 3.174 -50.511 8.427 1.00 0.00 H new ATOM 0 HG23 VAL B 26 4.549 -51.329 9.207 1.00 0.00 H new ATOM 1648 N LYS B 27 2.429 -55.598 8.724 1.00 0.00 N ATOM 1649 CA LYS B 27 1.792 -56.911 8.493 1.00 0.00 C ATOM 1650 C LYS B 27 0.573 -57.128 9.394 1.00 0.00 C ATOM 1651 O LYS B 27 -0.457 -57.602 8.916 1.00 0.00 O ATOM 1652 CB LYS B 27 2.781 -58.072 8.695 1.00 0.00 C ATOM 1653 CG LYS B 27 3.930 -58.155 7.676 1.00 0.00 C ATOM 1654 CD LYS B 27 4.770 -59.407 7.991 1.00 0.00 C ATOM 1655 CE LYS B 27 6.141 -59.462 7.303 1.00 0.00 C ATOM 1656 NZ LYS B 27 6.063 -59.743 5.843 1.00 0.00 N1+ ATOM 0 H LYS B 27 3.403 -55.657 9.021 1.00 0.00 H new ATOM 0 HA LYS B 27 1.462 -56.902 7.454 1.00 0.00 H new ATOM 0 HB2 LYS B 27 3.211 -57.989 9.693 1.00 0.00 H new ATOM 0 HB3 LYS B 27 2.224 -59.009 8.664 1.00 0.00 H new ATOM 0 HG2 LYS B 27 3.534 -58.209 6.662 1.00 0.00 H new ATOM 0 HG3 LYS B 27 4.549 -57.260 7.729 1.00 0.00 H new ATOM 0 HD2 LYS B 27 4.920 -59.463 9.069 1.00 0.00 H new ATOM 0 HD3 LYS B 27 4.200 -60.290 7.702 1.00 0.00 H new ATOM 0 HE2 LYS B 27 6.653 -58.512 7.455 1.00 0.00 H new ATOM 0 HE3 LYS B 27 6.748 -60.231 7.781 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 7.006 -60.000 5.488 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 5.404 -60.530 5.676 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 5.725 -58.896 5.344 1.00 0.00 H new ATOM 1670 N ALA B 28 0.654 -56.738 10.668 1.00 0.00 N ATOM 1671 CA ALA B 28 -0.455 -56.831 11.624 1.00 0.00 C ATOM 1672 C ALA B 28 -1.627 -55.891 11.267 1.00 0.00 C ATOM 1673 O ALA B 28 -2.786 -56.300 11.338 1.00 0.00 O ATOM 1674 CB ALA B 28 0.092 -56.561 13.030 1.00 0.00 C ATOM 0 H ALA B 28 1.503 -56.343 11.072 1.00 0.00 H new ATOM 0 HA ALA B 28 -0.874 -57.836 11.583 1.00 0.00 H new ATOM 0 HB1 ALA B 28 -0.719 -56.626 13.755 1.00 0.00 H new ATOM 0 HB2 ALA B 28 0.855 -57.301 13.272 1.00 0.00 H new ATOM 0 HB3 ALA B 28 0.530 -55.564 13.065 1.00 0.00 H new ATOM 1680 N LYS B 29 -1.348 -54.668 10.791 1.00 0.00 N ATOM 1681 CA LYS B 29 -2.370 -53.729 10.279 1.00 0.00 C ATOM 1682 C LYS B 29 -3.082 -54.274 9.031 1.00 0.00 C ATOM 1683 O LYS B 29 -4.300 -54.164 8.922 1.00 0.00 O ATOM 1684 CB LYS B 29 -1.719 -52.358 10.014 1.00 0.00 C ATOM 1685 CG LYS B 29 -1.390 -51.607 11.317 1.00 0.00 C ATOM 1686 CD LYS B 29 -0.455 -50.415 11.052 1.00 0.00 C ATOM 1687 CE LYS B 29 -0.114 -49.652 12.345 1.00 0.00 C ATOM 1688 NZ LYS B 29 -1.203 -48.721 12.761 1.00 0.00 N1+ ATOM 0 H LYS B 29 -0.400 -54.295 10.748 1.00 0.00 H new ATOM 0 HA LYS B 29 -3.143 -53.611 11.038 1.00 0.00 H new ATOM 0 HB2 LYS B 29 -0.805 -52.498 9.437 1.00 0.00 H new ATOM 0 HB3 LYS B 29 -2.390 -51.751 9.407 1.00 0.00 H new ATOM 0 HG2 LYS B 29 -2.312 -51.254 11.779 1.00 0.00 H new ATOM 0 HG3 LYS B 29 -0.921 -52.290 12.025 1.00 0.00 H new ATOM 0 HD2 LYS B 29 0.465 -50.772 10.588 1.00 0.00 H new ATOM 0 HD3 LYS B 29 -0.927 -49.735 10.343 1.00 0.00 H new ATOM 0 HE2 LYS B 29 0.075 -50.367 13.146 1.00 0.00 H new ATOM 0 HE3 LYS B 29 0.807 -49.087 12.198 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 -1.005 -48.360 13.716 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 -1.253 -47.925 12.093 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 -2.111 -49.228 12.764 1.00 0.00 H new ATOM 1702 N ILE B 30 -2.350 -54.944 8.133 1.00 0.00 N ATOM 1703 CA ILE B 30 -2.930 -55.649 6.972 1.00 0.00 C ATOM 1704 C ILE B 30 -3.742 -56.877 7.418 1.00 0.00 C ATOM 1705 O ILE B 30 -4.839 -57.091 6.912 1.00 0.00 O ATOM 1706 CB ILE B 30 -1.824 -56.010 5.952 1.00 0.00 C ATOM 1707 CG1 ILE B 30 -1.219 -54.720 5.355 1.00 0.00 C ATOM 1708 CG2 ILE B 30 -2.359 -56.909 4.817 1.00 0.00 C ATOM 1709 CD1 ILE B 30 0.103 -54.947 4.615 1.00 0.00 C ATOM 0 H ILE B 30 -1.334 -55.016 8.187 1.00 0.00 H new ATOM 0 HA ILE B 30 -3.629 -54.981 6.469 1.00 0.00 H new ATOM 0 HB ILE B 30 -1.054 -56.569 6.484 1.00 0.00 H new ATOM 0 HG12 ILE B 30 -1.939 -54.276 4.667 1.00 0.00 H new ATOM 0 HG13 ILE B 30 -1.058 -54.000 6.157 1.00 0.00 H new ATOM 0 HG21 ILE B 30 -1.550 -57.139 4.123 1.00 0.00 H new ATOM 0 HG22 ILE B 30 -2.749 -57.835 5.239 1.00 0.00 H new ATOM 0 HG23 ILE B 30 -3.156 -56.389 4.286 1.00 0.00 H new ATOM 0 HD11 ILE B 30 0.468 -53.998 4.223 1.00 0.00 H new ATOM 0 HD12 ILE B 30 0.839 -55.362 5.304 1.00 0.00 H new ATOM 0 HD13 ILE B 30 -0.056 -55.643 3.791 1.00 0.00 H new ATOM 1721 N GLN B 31 -3.268 -57.646 8.406 1.00 0.00 N ATOM 1722 CA GLN B 31 -4.015 -58.778 8.976 1.00 0.00 C ATOM 1723 C GLN B 31 -5.349 -58.317 9.599 1.00 0.00 C ATOM 1724 O GLN B 31 -6.373 -58.967 9.402 1.00 0.00 O ATOM 1725 CB GLN B 31 -3.136 -59.503 10.012 1.00 0.00 C ATOM 1726 CG GLN B 31 -3.780 -60.798 10.542 1.00 0.00 C ATOM 1727 CD GLN B 31 -2.989 -61.459 11.674 1.00 0.00 C ATOM 1728 OE1 GLN B 31 -2.045 -60.918 12.236 1.00 0.00 O ATOM 1729 NE2 GLN B 31 -3.347 -62.666 12.061 1.00 0.00 N ATOM 0 H GLN B 31 -2.354 -57.502 8.835 1.00 0.00 H new ATOM 0 HA GLN B 31 -4.264 -59.473 8.174 1.00 0.00 H new ATOM 0 HB2 GLN B 31 -2.172 -59.740 9.561 1.00 0.00 H new ATOM 0 HB3 GLN B 31 -2.940 -58.832 10.848 1.00 0.00 H new ATOM 0 HG2 GLN B 31 -4.786 -60.575 10.896 1.00 0.00 H new ATOM 0 HG3 GLN B 31 -3.881 -61.506 9.720 1.00 0.00 H new ATOM 0 HE21 GLN B 31 -4.130 -63.136 11.607 1.00 0.00 H new ATOM 0 HE22 GLN B 31 -2.841 -63.131 12.815 1.00 0.00 H new ATOM 1738 N ASP B 32 -5.366 -57.175 10.293 1.00 0.00 N ATOM 1739 CA ASP B 32 -6.579 -56.615 10.906 1.00 0.00 C ATOM 1740 C ASP B 32 -7.640 -56.178 9.872 1.00 0.00 C ATOM 1741 O ASP B 32 -8.839 -56.346 10.120 1.00 0.00 O ATOM 1742 CB ASP B 32 -6.178 -55.447 11.814 1.00 0.00 C ATOM 1743 CG ASP B 32 -7.382 -54.900 12.596 1.00 0.00 C ATOM 1744 OD1 ASP B 32 -7.856 -55.589 13.531 1.00 0.00 O ATOM 1745 OD2 ASP B 32 -7.843 -53.773 12.296 1.00 0.00 O1- ATOM 0 H ASP B 32 -4.533 -56.607 10.448 1.00 0.00 H new ATOM 0 HA ASP B 32 -7.053 -57.402 11.492 1.00 0.00 H new ATOM 0 HB2 ASP B 32 -5.409 -55.776 12.513 1.00 0.00 H new ATOM 0 HB3 ASP B 32 -5.742 -54.650 11.212 1.00 0.00 H new ATOM 1750 N LYS B 33 -7.219 -55.665 8.703 1.00 0.00 N ATOM 1751 CA LYS B 33 -8.128 -55.224 7.625 1.00 0.00 C ATOM 1752 C LYS B 33 -8.530 -56.335 6.643 1.00 0.00 C ATOM 1753 O LYS B 33 -9.699 -56.417 6.263 1.00 0.00 O ATOM 1754 CB LYS B 33 -7.531 -54.018 6.878 1.00 0.00 C ATOM 1755 CG LYS B 33 -7.468 -52.763 7.765 1.00 0.00 C ATOM 1756 CD LYS B 33 -7.226 -51.492 6.937 1.00 0.00 C ATOM 1757 CE LYS B 33 -7.217 -50.265 7.863 1.00 0.00 C ATOM 1758 NZ LYS B 33 -7.332 -48.984 7.108 1.00 0.00 N1+ ATOM 0 H LYS B 33 -6.232 -55.543 8.476 1.00 0.00 H new ATOM 0 HA LYS B 33 -9.054 -54.927 8.118 1.00 0.00 H new ATOM 0 HB2 LYS B 33 -6.528 -54.267 6.531 1.00 0.00 H new ATOM 0 HB3 LYS B 33 -8.131 -53.807 5.993 1.00 0.00 H new ATOM 0 HG2 LYS B 33 -8.401 -52.663 8.320 1.00 0.00 H new ATOM 0 HG3 LYS B 33 -6.670 -52.876 8.499 1.00 0.00 H new ATOM 0 HD2 LYS B 33 -6.276 -51.567 6.407 1.00 0.00 H new ATOM 0 HD3 LYS B 33 -8.005 -51.384 6.182 1.00 0.00 H new ATOM 0 HE2 LYS B 33 -8.042 -50.342 8.572 1.00 0.00 H new ATOM 0 HE3 LYS B 33 -6.296 -50.259 8.446 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 -7.390 -48.190 7.778 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 -6.497 -48.864 6.499 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 -8.189 -49.004 6.520 1.00 0.00 H new ATOM 1772 N GLU B 34 -7.589 -57.193 6.241 1.00 0.00 N ATOM 1773 CA GLU B 34 -7.763 -58.172 5.150 1.00 0.00 C ATOM 1774 C GLU B 34 -7.811 -59.644 5.606 1.00 0.00 C ATOM 1775 O GLU B 34 -8.178 -60.518 4.819 1.00 0.00 O ATOM 1776 CB GLU B 34 -6.632 -57.995 4.118 1.00 0.00 C ATOM 1777 CG GLU B 34 -6.521 -56.591 3.510 1.00 0.00 C ATOM 1778 CD GLU B 34 -7.819 -56.141 2.807 1.00 0.00 C ATOM 1779 OE1 GLU B 34 -8.284 -56.842 1.875 1.00 0.00 O ATOM 1780 OE2 GLU B 34 -8.377 -55.079 3.173 1.00 0.00 O1- ATOM 0 H GLU B 34 -6.664 -57.232 6.669 1.00 0.00 H new ATOM 0 HA GLU B 34 -8.740 -57.962 4.715 1.00 0.00 H new ATOM 0 HB2 GLU B 34 -5.684 -58.244 4.595 1.00 0.00 H new ATOM 0 HB3 GLU B 34 -6.781 -58.713 3.311 1.00 0.00 H new ATOM 0 HG2 GLU B 34 -6.273 -55.878 4.296 1.00 0.00 H new ATOM 0 HG3 GLU B 34 -5.700 -56.574 2.793 1.00 0.00 H new ATOM 1787 N GLY B 35 -7.431 -59.945 6.855 1.00 0.00 N ATOM 1788 CA GLY B 35 -7.393 -61.309 7.405 1.00 0.00 C ATOM 1789 C GLY B 35 -6.212 -62.180 6.944 1.00 0.00 C ATOM 1790 O GLY B 35 -6.167 -63.363 7.285 1.00 0.00 O ATOM 0 H GLY B 35 -7.136 -59.235 7.525 1.00 0.00 H new ATOM 0 HA2 GLY B 35 -7.369 -61.242 8.493 1.00 0.00 H new ATOM 0 HA3 GLY B 35 -8.320 -61.815 7.137 1.00 0.00 H new ATOM 1794 N ILE B 36 -5.257 -61.629 6.180 1.00 0.00 N ATOM 1795 CA ILE B 36 -4.116 -62.375 5.612 1.00 0.00 C ATOM 1796 C ILE B 36 -3.058 -62.622 6.710 1.00 0.00 C ATOM 1797 O ILE B 36 -2.566 -61.643 7.278 1.00 0.00 O ATOM 1798 CB ILE B 36 -3.495 -61.637 4.397 1.00 0.00 C ATOM 1799 CG1 ILE B 36 -4.552 -61.276 3.324 1.00 0.00 C ATOM 1800 CG2 ILE B 36 -2.395 -62.513 3.761 1.00 0.00 C ATOM 1801 CD1 ILE B 36 -4.035 -60.326 2.235 1.00 0.00 C ATOM 0 H ILE B 36 -5.252 -60.639 5.934 1.00 0.00 H new ATOM 0 HA ILE B 36 -4.482 -63.335 5.247 1.00 0.00 H new ATOM 0 HB ILE B 36 -3.069 -60.704 4.767 1.00 0.00 H new ATOM 0 HG12 ILE B 36 -4.906 -62.194 2.854 1.00 0.00 H new ATOM 0 HG13 ILE B 36 -5.411 -60.818 3.814 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -1.962 -61.991 2.908 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -1.617 -62.712 4.498 1.00 0.00 H new ATOM 0 HG23 ILE B 36 -2.828 -63.456 3.427 1.00 0.00 H new ATOM 0 HD11 ILE B 36 -4.833 -60.121 1.522 1.00 0.00 H new ATOM 0 HD12 ILE B 36 -3.708 -59.392 2.692 1.00 0.00 H new ATOM 0 HD13 ILE B 36 -3.195 -60.789 1.717 1.00 0.00 H new ATOM 1813 N PRO B 37 -2.643 -63.874 6.998 1.00 0.00 N ATOM 1814 CA PRO B 37 -1.624 -64.163 8.013 1.00 0.00 C ATOM 1815 C PRO B 37 -0.269 -63.503 7.703 1.00 0.00 C ATOM 1816 O PRO B 37 0.171 -63.567 6.554 1.00 0.00 O ATOM 1817 CB PRO B 37 -1.495 -65.693 8.051 1.00 0.00 C ATOM 1818 CG PRO B 37 -2.846 -66.178 7.532 1.00 0.00 C ATOM 1819 CD PRO B 37 -3.203 -65.120 6.493 1.00 0.00 C ATOM 0 HA PRO B 37 -1.924 -63.752 8.977 1.00 0.00 H new ATOM 0 HB2 PRO B 37 -0.675 -66.042 7.423 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -1.300 -66.054 9.061 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -2.777 -67.172 7.091 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -3.590 -66.233 8.327 1.00 0.00 H new ATOM 0 HD2 PRO B 37 -2.786 -65.371 5.518 1.00 0.00 H new ATOM 0 HD3 PRO B 37 -4.283 -65.042 6.367 1.00 0.00 H new ATOM 1827 N PRO B 38 0.455 -62.927 8.686 1.00 0.00 N ATOM 1828 CA PRO B 38 1.776 -62.318 8.475 1.00 0.00 C ATOM 1829 C PRO B 38 2.809 -63.248 7.818 1.00 0.00 C ATOM 1830 O PRO B 38 3.630 -62.789 7.025 1.00 0.00 O ATOM 1831 CB PRO B 38 2.235 -61.873 9.870 1.00 0.00 C ATOM 1832 CG PRO B 38 0.918 -61.552 10.571 1.00 0.00 C ATOM 1833 CD PRO B 38 -0.004 -62.647 10.040 1.00 0.00 C ATOM 0 HA PRO B 38 1.694 -61.493 7.767 1.00 0.00 H new ATOM 0 HB2 PRO B 38 2.786 -62.660 10.385 1.00 0.00 H new ATOM 0 HB3 PRO B 38 2.891 -61.003 9.822 1.00 0.00 H new ATOM 0 HG2 PRO B 38 1.014 -61.591 11.656 1.00 0.00 H new ATOM 0 HG3 PRO B 38 0.555 -60.556 10.319 1.00 0.00 H new ATOM 0 HD2 PRO B 38 0.049 -63.539 10.664 1.00 0.00 H new ATOM 0 HD3 PRO B 38 -1.043 -62.318 10.041 1.00 0.00 H new ATOM 1841 N ASP B 39 2.722 -64.559 8.066 1.00 0.00 N ATOM 1842 CA ASP B 39 3.573 -65.585 7.438 1.00 0.00 C ATOM 1843 C ASP B 39 3.292 -65.792 5.936 1.00 0.00 C ATOM 1844 O ASP B 39 4.133 -66.343 5.226 1.00 0.00 O ATOM 1845 CB ASP B 39 3.400 -66.911 8.193 1.00 0.00 C ATOM 1846 CG ASP B 39 3.923 -66.831 9.634 1.00 0.00 C ATOM 1847 OD1 ASP B 39 5.159 -66.928 9.835 1.00 0.00 O ATOM 1848 OD2 ASP B 39 3.102 -66.687 10.572 1.00 0.00 O1- ATOM 0 H ASP B 39 2.045 -64.949 8.722 1.00 0.00 H new ATOM 0 HA ASP B 39 4.601 -65.230 7.504 1.00 0.00 H new ATOM 0 HB2 ASP B 39 2.345 -67.185 8.206 1.00 0.00 H new ATOM 0 HB3 ASP B 39 3.928 -67.702 7.660 1.00 0.00 H new ATOM 1853 N GLN B 40 2.133 -65.352 5.430 1.00 0.00 N ATOM 1854 CA GLN B 40 1.763 -65.405 4.007 1.00 0.00 C ATOM 1855 C GLN B 40 1.997 -64.072 3.273 1.00 0.00 C ATOM 1856 O GLN B 40 1.974 -64.050 2.043 1.00 0.00 O ATOM 1857 CB GLN B 40 0.297 -65.857 3.873 1.00 0.00 C ATOM 1858 CG GLN B 40 0.079 -67.296 4.374 1.00 0.00 C ATOM 1859 CD GLN B 40 -1.345 -67.815 4.155 1.00 0.00 C ATOM 1860 OE1 GLN B 40 -2.224 -67.163 3.607 1.00 0.00 O ATOM 1861 NE2 GLN B 40 -1.633 -69.028 4.584 1.00 0.00 N ATOM 0 H GLN B 40 1.406 -64.938 6.014 1.00 0.00 H new ATOM 0 HA GLN B 40 2.418 -66.131 3.525 1.00 0.00 H new ATOM 0 HB2 GLN B 40 -0.343 -65.178 4.437 1.00 0.00 H new ATOM 0 HB3 GLN B 40 -0.008 -65.789 2.829 1.00 0.00 H new ATOM 0 HG2 GLN B 40 0.780 -67.958 3.866 1.00 0.00 H new ATOM 0 HG3 GLN B 40 0.313 -67.340 5.438 1.00 0.00 H new ATOM 0 HE21 GLN B 40 -0.916 -69.590 5.044 1.00 0.00 H new ATOM 0 HE22 GLN B 40 -2.572 -69.405 4.456 1.00 0.00 H new ATOM 1870 N GLN B 41 2.242 -62.969 3.992 1.00 0.00 N ATOM 1871 CA GLN B 41 2.461 -61.634 3.418 1.00 0.00 C ATOM 1872 C GLN B 41 3.941 -61.354 3.101 1.00 0.00 C ATOM 1873 O GLN B 41 4.801 -61.475 3.975 1.00 0.00 O ATOM 1874 CB GLN B 41 1.985 -60.547 4.402 1.00 0.00 C ATOM 1875 CG GLN B 41 0.488 -60.535 4.761 1.00 0.00 C ATOM 1876 CD GLN B 41 0.187 -59.403 5.745 1.00 0.00 C ATOM 1877 OE1 GLN B 41 0.738 -58.319 5.651 1.00 0.00 O ATOM 1878 NE2 GLN B 41 -0.651 -59.592 6.741 1.00 0.00 N ATOM 0 H GLN B 41 2.295 -62.980 5.011 1.00 0.00 H new ATOM 0 HA GLN B 41 1.892 -61.610 2.489 1.00 0.00 H new ATOM 0 HB2 GLN B 41 2.554 -60.654 5.326 1.00 0.00 H new ATOM 0 HB3 GLN B 41 2.240 -59.574 3.981 1.00 0.00 H new ATOM 0 HG2 GLN B 41 -0.109 -60.409 3.858 1.00 0.00 H new ATOM 0 HG3 GLN B 41 0.204 -61.492 5.199 1.00 0.00 H new ATOM 0 HE21 GLN B 41 -1.126 -60.489 6.844 1.00 0.00 H new ATOM 0 HE22 GLN B 41 -0.826 -58.842 7.410 1.00 0.00 H new ATOM 1887 N ARG B 42 4.228 -60.852 1.896 1.00 0.00 N ATOM 1888 CA ARG B 42 5.535 -60.306 1.470 1.00 0.00 C ATOM 1889 C ARG B 42 5.334 -58.848 1.050 1.00 0.00 C ATOM 1890 O ARG B 42 4.520 -58.579 0.176 1.00 0.00 O ATOM 1891 CB ARG B 42 6.111 -61.151 0.318 1.00 0.00 C ATOM 1892 CG ARG B 42 6.844 -62.406 0.809 1.00 0.00 C ATOM 1893 CD ARG B 42 7.383 -63.197 -0.390 1.00 0.00 C ATOM 1894 NE ARG B 42 8.259 -64.308 0.035 1.00 0.00 N ATOM 1895 CZ ARG B 42 8.725 -65.278 -0.734 1.00 0.00 C ATOM 1896 NH1 ARG B 42 8.439 -65.348 -2.002 1.00 0.00 N1+ ATOM 1897 NH2 ARG B 42 9.486 -66.208 -0.236 1.00 0.00 N ATOM 0 H ARG B 42 3.530 -60.810 1.153 1.00 0.00 H new ATOM 0 HA ARG B 42 6.251 -60.345 2.291 1.00 0.00 H new ATOM 0 HB2 ARG B 42 5.302 -61.447 -0.349 1.00 0.00 H new ATOM 0 HB3 ARG B 42 6.799 -60.540 -0.266 1.00 0.00 H new ATOM 0 HG2 ARG B 42 7.665 -62.124 1.469 1.00 0.00 H new ATOM 0 HG3 ARG B 42 6.166 -63.029 1.392 1.00 0.00 H new ATOM 0 HD2 ARG B 42 6.549 -63.593 -0.969 1.00 0.00 H new ATOM 0 HD3 ARG B 42 7.938 -62.528 -1.047 1.00 0.00 H new ATOM 0 HE ARG B 42 8.531 -64.329 1.018 1.00 0.00 H new ATOM 0 HH11 ARG B 42 7.840 -64.642 -2.429 1.00 0.00 H new ATOM 0 HH12 ARG B 42 8.814 -66.109 -2.568 1.00 0.00 H new ATOM 0 HH21 ARG B 42 9.728 -66.193 0.755 1.00 0.00 H new ATOM 0 HH22 ARG B 42 9.841 -66.952 -0.836 1.00 0.00 H new ATOM 1911 N LEU B 43 6.044 -57.908 1.677 1.00 0.00 N ATOM 1912 CA LEU B 43 5.924 -56.467 1.403 1.00 0.00 C ATOM 1913 C LEU B 43 7.168 -55.944 0.687 1.00 0.00 C ATOM 1914 O LEU B 43 8.289 -56.312 1.036 1.00 0.00 O ATOM 1915 CB LEU B 43 5.667 -55.694 2.713 1.00 0.00 C ATOM 1916 CG LEU B 43 4.228 -55.810 3.250 1.00 0.00 C ATOM 1917 CD1 LEU B 43 4.166 -55.244 4.668 1.00 0.00 C ATOM 1918 CD2 LEU B 43 3.240 -55.026 2.381 1.00 0.00 C ATOM 0 H LEU B 43 6.729 -58.125 2.400 1.00 0.00 H new ATOM 0 HA LEU B 43 5.072 -56.309 0.741 1.00 0.00 H new ATOM 0 HB2 LEU B 43 6.356 -56.057 3.475 1.00 0.00 H new ATOM 0 HB3 LEU B 43 5.897 -54.641 2.550 1.00 0.00 H new ATOM 0 HG LEU B 43 3.954 -56.865 3.237 1.00 0.00 H new ATOM 0 HD11 LEU B 43 3.148 -55.326 5.048 1.00 0.00 H new ATOM 0 HD12 LEU B 43 4.841 -55.806 5.314 1.00 0.00 H new ATOM 0 HD13 LEU B 43 4.465 -54.196 4.655 1.00 0.00 H new ATOM 0 HD21 LEU B 43 2.235 -55.130 2.789 1.00 0.00 H new ATOM 0 HD22 LEU B 43 3.520 -53.973 2.371 1.00 0.00 H new ATOM 0 HD23 LEU B 43 3.261 -55.417 1.364 1.00 0.00 H new ATOM 1930 N ILE B 44 6.960 -55.073 -0.298 1.00 0.00 N ATOM 1931 CA ILE B 44 8.000 -54.486 -1.149 1.00 0.00 C ATOM 1932 C ILE B 44 7.823 -52.962 -1.235 1.00 0.00 C ATOM 1933 O ILE B 44 6.699 -52.466 -1.301 1.00 0.00 O ATOM 1934 CB ILE B 44 7.973 -55.168 -2.542 1.00 0.00 C ATOM 1935 CG1 ILE B 44 8.286 -56.685 -2.449 1.00 0.00 C ATOM 1936 CG2 ILE B 44 8.962 -54.526 -3.531 1.00 0.00 C ATOM 1937 CD1 ILE B 44 7.037 -57.566 -2.579 1.00 0.00 C ATOM 0 H ILE B 44 6.025 -54.742 -0.537 1.00 0.00 H new ATOM 0 HA ILE B 44 8.983 -54.663 -0.713 1.00 0.00 H new ATOM 0 HB ILE B 44 6.958 -55.026 -2.913 1.00 0.00 H new ATOM 0 HG12 ILE B 44 8.995 -56.952 -3.233 1.00 0.00 H new ATOM 0 HG13 ILE B 44 8.772 -56.892 -1.495 1.00 0.00 H new ATOM 0 HG21 ILE B 44 8.903 -55.041 -4.490 1.00 0.00 H new ATOM 0 HG22 ILE B 44 8.709 -53.474 -3.667 1.00 0.00 H new ATOM 0 HG23 ILE B 44 9.975 -54.608 -3.137 1.00 0.00 H new ATOM 0 HD11 ILE B 44 7.323 -58.615 -2.506 1.00 0.00 H new ATOM 0 HD12 ILE B 44 6.336 -57.324 -1.780 1.00 0.00 H new ATOM 0 HD13 ILE B 44 6.563 -57.385 -3.544 1.00 0.00 H new ATOM 1949 N PHE B 45 8.933 -52.223 -1.266 1.00 0.00 N ATOM 1950 CA PHE B 45 8.984 -50.785 -1.562 1.00 0.00 C ATOM 1951 C PHE B 45 10.175 -50.494 -2.485 1.00 0.00 C ATOM 1952 O PHE B 45 11.273 -51.004 -2.261 1.00 0.00 O ATOM 1953 CB PHE B 45 9.073 -49.972 -0.263 1.00 0.00 C ATOM 1954 CG PHE B 45 9.230 -48.478 -0.469 1.00 0.00 C ATOM 1955 CD1 PHE B 45 8.143 -47.712 -0.928 1.00 0.00 C ATOM 1956 CD2 PHE B 45 10.467 -47.853 -0.218 1.00 0.00 C ATOM 1957 CE1 PHE B 45 8.292 -46.331 -1.144 1.00 0.00 C ATOM 1958 CE2 PHE B 45 10.613 -46.468 -0.418 1.00 0.00 C ATOM 1959 CZ PHE B 45 9.526 -45.707 -0.883 1.00 0.00 C ATOM 0 H PHE B 45 9.854 -52.620 -1.080 1.00 0.00 H new ATOM 0 HA PHE B 45 8.068 -50.488 -2.073 1.00 0.00 H new ATOM 0 HB2 PHE B 45 8.174 -50.153 0.327 1.00 0.00 H new ATOM 0 HB3 PHE B 45 9.917 -50.337 0.322 1.00 0.00 H new ATOM 0 HD1 PHE B 45 7.191 -48.186 -1.115 1.00 0.00 H new ATOM 0 HD2 PHE B 45 11.306 -48.438 0.129 1.00 0.00 H new ATOM 0 HE1 PHE B 45 7.459 -45.749 -1.510 1.00 0.00 H new ATOM 0 HE2 PHE B 45 11.560 -45.990 -0.214 1.00 0.00 H new ATOM 0 HZ PHE B 45 9.638 -44.644 -1.040 1.00 0.00 H new ATOM 1969 N ALA B 46 9.960 -49.706 -3.543 1.00 0.00 N ATOM 1970 CA ALA B 46 10.957 -49.403 -4.577 1.00 0.00 C ATOM 1971 C ALA B 46 11.676 -50.647 -5.163 1.00 0.00 C ATOM 1972 O ALA B 46 12.863 -50.605 -5.493 1.00 0.00 O ATOM 1973 CB ALA B 46 11.899 -48.306 -4.053 1.00 0.00 C ATOM 0 H ALA B 46 9.064 -49.248 -3.709 1.00 0.00 H new ATOM 0 HA ALA B 46 10.436 -49.016 -5.453 1.00 0.00 H new ATOM 0 HB1 ALA B 46 12.644 -48.073 -4.813 1.00 0.00 H new ATOM 0 HB2 ALA B 46 11.322 -47.410 -3.823 1.00 0.00 H new ATOM 0 HB3 ALA B 46 12.399 -48.657 -3.150 1.00 0.00 H new ATOM 1979 N GLY B 47 10.961 -51.777 -5.260 1.00 0.00 N ATOM 1980 CA GLY B 47 11.490 -53.070 -5.725 1.00 0.00 C ATOM 1981 C GLY B 47 12.305 -53.871 -4.690 1.00 0.00 C ATOM 1982 O GLY B 47 12.731 -54.986 -4.999 1.00 0.00 O ATOM 0 H GLY B 47 9.973 -51.819 -5.011 1.00 0.00 H new ATOM 0 HA2 GLY B 47 10.654 -53.686 -6.057 1.00 0.00 H new ATOM 0 HA3 GLY B 47 12.120 -52.892 -6.597 1.00 0.00 H new ATOM 1986 N LYS B 48 12.500 -53.351 -3.468 1.00 0.00 N ATOM 1987 CA LYS B 48 13.209 -54.012 -2.352 1.00 0.00 C ATOM 1988 C LYS B 48 12.220 -54.656 -1.377 1.00 0.00 C ATOM 1989 O LYS B 48 11.258 -54.011 -0.964 1.00 0.00 O ATOM 1990 CB LYS B 48 14.099 -52.992 -1.617 1.00 0.00 C ATOM 1991 CG LYS B 48 15.181 -52.381 -2.527 1.00 0.00 C ATOM 1992 CD LYS B 48 16.101 -51.400 -1.785 1.00 0.00 C ATOM 1993 CE LYS B 48 15.353 -50.140 -1.318 1.00 0.00 C ATOM 1994 NZ LYS B 48 16.282 -49.153 -0.699 1.00 0.00 N1+ ATOM 0 H LYS B 48 12.157 -52.424 -3.217 1.00 0.00 H new ATOM 0 HA LYS B 48 13.837 -54.802 -2.764 1.00 0.00 H new ATOM 0 HB2 LYS B 48 13.474 -52.194 -1.216 1.00 0.00 H new ATOM 0 HB3 LYS B 48 14.578 -53.479 -0.768 1.00 0.00 H new ATOM 0 HG2 LYS B 48 15.783 -53.182 -2.956 1.00 0.00 H new ATOM 0 HG3 LYS B 48 14.701 -51.864 -3.357 1.00 0.00 H new ATOM 0 HD2 LYS B 48 16.541 -51.900 -0.922 1.00 0.00 H new ATOM 0 HD3 LYS B 48 16.923 -51.110 -2.439 1.00 0.00 H new ATOM 0 HE2 LYS B 48 14.845 -49.681 -2.166 1.00 0.00 H new ATOM 0 HE3 LYS B 48 14.583 -50.418 -0.598 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 15.746 -48.315 -0.395 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 16.748 -49.584 0.125 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 17.002 -48.870 -1.395 1.00 0.00 H new ATOM 2008 N GLN B 49 12.452 -55.913 -0.990 1.00 0.00 N ATOM 2009 CA GLN B 49 11.609 -56.627 -0.020 1.00 0.00 C ATOM 2010 C GLN B 49 11.920 -56.186 1.424 1.00 0.00 C ATOM 2011 O GLN B 49 13.080 -55.965 1.780 1.00 0.00 O ATOM 2012 CB GLN B 49 11.749 -58.144 -0.228 1.00 0.00 C ATOM 2013 CG GLN B 49 10.707 -58.952 0.564 1.00 0.00 C ATOM 2014 CD GLN B 49 10.779 -60.441 0.234 1.00 0.00 C ATOM 2015 OE1 GLN B 49 10.028 -60.959 -0.580 1.00 0.00 O ATOM 2016 NE2 GLN B 49 11.684 -61.184 0.839 1.00 0.00 N ATOM 0 H GLN B 49 13.232 -56.469 -1.340 1.00 0.00 H new ATOM 0 HA GLN B 49 10.564 -56.368 -0.191 1.00 0.00 H new ATOM 0 HB2 GLN B 49 11.649 -58.372 -1.289 1.00 0.00 H new ATOM 0 HB3 GLN B 49 12.749 -58.457 0.072 1.00 0.00 H new ATOM 0 HG2 GLN B 49 10.869 -58.807 1.632 1.00 0.00 H new ATOM 0 HG3 GLN B 49 9.708 -58.577 0.340 1.00 0.00 H new ATOM 0 HE21 GLN B 49 12.316 -60.764 1.520 1.00 0.00 H new ATOM 0 HE22 GLN B 49 11.752 -62.179 0.626 1.00 0.00 H new ATOM 2025 N LEU B 50 10.876 -56.054 2.248 1.00 0.00 N ATOM 2026 CA LEU B 50 10.934 -55.449 3.584 1.00 0.00 C ATOM 2027 C LEU B 50 10.928 -56.512 4.701 1.00 0.00 C ATOM 2028 O LEU B 50 10.239 -57.530 4.595 1.00 0.00 O ATOM 2029 CB LEU B 50 9.792 -54.419 3.724 1.00 0.00 C ATOM 2030 CG LEU B 50 9.632 -53.421 2.557 1.00 0.00 C ATOM 2031 CD1 LEU B 50 8.510 -52.431 2.871 1.00 0.00 C ATOM 2032 CD2 LEU B 50 10.906 -52.629 2.278 1.00 0.00 C ATOM 0 H LEU B 50 9.940 -56.374 1.998 1.00 0.00 H new ATOM 0 HA LEU B 50 11.882 -54.923 3.699 1.00 0.00 H new ATOM 0 HB2 LEU B 50 8.854 -54.961 3.843 1.00 0.00 H new ATOM 0 HB3 LEU B 50 9.952 -53.852 4.641 1.00 0.00 H new ATOM 0 HG LEU B 50 9.399 -54.013 1.672 1.00 0.00 H new ATOM 0 HD11 LEU B 50 8.402 -51.729 2.044 1.00 0.00 H new ATOM 0 HD12 LEU B 50 7.575 -52.973 3.011 1.00 0.00 H new ATOM 0 HD13 LEU B 50 8.752 -51.884 3.782 1.00 0.00 H new ATOM 0 HD21 LEU B 50 10.734 -51.944 1.448 1.00 0.00 H new ATOM 0 HD22 LEU B 50 11.183 -52.061 3.166 1.00 0.00 H new ATOM 0 HD23 LEU B 50 11.712 -53.316 2.020 1.00 0.00 H new ATOM 2044 N GLU B 51 11.688 -56.278 5.774 1.00 0.00 N ATOM 2045 CA GLU B 51 11.976 -57.261 6.836 1.00 0.00 C ATOM 2046 C GLU B 51 11.322 -56.900 8.180 1.00 0.00 C ATOM 2047 O GLU B 51 11.363 -55.749 8.610 1.00 0.00 O ATOM 2048 CB GLU B 51 13.498 -57.408 7.015 1.00 0.00 C ATOM 2049 CG GLU B 51 14.203 -57.939 5.760 1.00 0.00 C ATOM 2050 CD GLU B 51 15.711 -58.114 6.015 1.00 0.00 C ATOM 2051 OE1 GLU B 51 16.125 -59.193 6.508 1.00 0.00 O1- ATOM 2052 OE2 GLU B 51 16.496 -57.180 5.718 1.00 0.00 O ATOM 0 H GLU B 51 12.135 -55.376 5.938 1.00 0.00 H new ATOM 0 HA GLU B 51 11.543 -58.209 6.518 1.00 0.00 H new ATOM 0 HB2 GLU B 51 13.922 -56.439 7.280 1.00 0.00 H new ATOM 0 HB3 GLU B 51 13.696 -58.082 7.849 1.00 0.00 H new ATOM 0 HG2 GLU B 51 13.766 -58.894 5.468 1.00 0.00 H new ATOM 0 HG3 GLU B 51 14.047 -57.250 4.930 1.00 0.00 H new ATOM 2059 N ASP B 52 10.759 -57.894 8.878 1.00 0.00 N ATOM 2060 CA ASP B 52 9.929 -57.733 10.087 1.00 0.00 C ATOM 2061 C ASP B 52 10.558 -56.860 11.187 1.00 0.00 C ATOM 2062 O ASP B 52 9.865 -56.036 11.787 1.00 0.00 O ATOM 2063 CB ASP B 52 9.640 -59.123 10.677 1.00 0.00 C ATOM 2064 CG ASP B 52 8.625 -59.903 9.836 1.00 0.00 C ATOM 2065 OD1 ASP B 52 9.028 -60.535 8.830 1.00 0.00 O ATOM 2066 OD2 ASP B 52 7.420 -59.874 10.178 1.00 0.00 O1- ATOM 0 H ASP B 52 10.871 -58.872 8.609 1.00 0.00 H new ATOM 0 HA ASP B 52 9.024 -57.218 9.765 1.00 0.00 H new ATOM 0 HB2 ASP B 52 10.569 -59.690 10.742 1.00 0.00 H new ATOM 0 HB3 ASP B 52 9.261 -59.014 11.693 1.00 0.00 H new ATOM 2071 N GLY B 53 11.861 -57.035 11.441 1.00 0.00 N ATOM 2072 CA GLY B 53 12.611 -56.332 12.490 1.00 0.00 C ATOM 2073 C GLY B 53 13.077 -54.915 12.128 1.00 0.00 C ATOM 2074 O GLY B 53 13.657 -54.233 12.976 1.00 0.00 O ATOM 0 H GLY B 53 12.438 -57.686 10.909 1.00 0.00 H new ATOM 0 HA2 GLY B 53 11.988 -56.274 13.382 1.00 0.00 H new ATOM 0 HA3 GLY B 53 13.485 -56.929 12.750 1.00 0.00 H new ATOM 2078 N ARG B 54 12.848 -54.462 10.886 1.00 0.00 N ATOM 2079 CA ARG B 54 13.149 -53.098 10.411 1.00 0.00 C ATOM 2080 C ARG B 54 11.913 -52.200 10.504 1.00 0.00 C ATOM 2081 O ARG B 54 10.788 -52.683 10.633 1.00 0.00 O ATOM 2082 CB ARG B 54 13.703 -53.156 8.974 1.00 0.00 C ATOM 2083 CG ARG B 54 15.019 -53.938 8.823 1.00 0.00 C ATOM 2084 CD ARG B 54 16.190 -53.305 9.589 1.00 0.00 C ATOM 2085 NE ARG B 54 17.449 -54.036 9.332 1.00 0.00 N ATOM 2086 CZ ARG B 54 17.916 -55.093 9.977 1.00 0.00 C ATOM 2087 NH1 ARG B 54 17.292 -55.625 10.991 1.00 0.00 N1+ ATOM 2088 NH2 ARG B 54 19.035 -55.643 9.606 1.00 0.00 N ATOM 0 H ARG B 54 12.436 -55.050 10.161 1.00 0.00 H new ATOM 0 HA ARG B 54 13.912 -52.659 11.054 1.00 0.00 H new ATOM 0 HB2 ARG B 54 12.951 -53.609 8.327 1.00 0.00 H new ATOM 0 HB3 ARG B 54 13.859 -52.138 8.618 1.00 0.00 H new ATOM 0 HG2 ARG B 54 14.871 -54.958 9.177 1.00 0.00 H new ATOM 0 HG3 ARG B 54 15.277 -54.002 7.766 1.00 0.00 H new ATOM 0 HD2 ARG B 54 16.303 -52.263 9.291 1.00 0.00 H new ATOM 0 HD3 ARG B 54 15.975 -53.309 10.658 1.00 0.00 H new ATOM 0 HE ARG B 54 18.026 -53.684 8.568 1.00 0.00 H new ATOM 0 HH11 ARG B 54 16.410 -55.226 11.314 1.00 0.00 H new ATOM 0 HH12 ARG B 54 17.686 -56.440 11.461 1.00 0.00 H new ATOM 0 HH21 ARG B 54 19.555 -55.260 8.816 1.00 0.00 H new ATOM 0 HH22 ARG B 54 19.393 -56.458 10.105 1.00 0.00 H new ATOM 2102 N THR B 55 12.120 -50.889 10.439 1.00 0.00 N ATOM 2103 CA THR B 55 11.078 -49.853 10.516 1.00 0.00 C ATOM 2104 C THR B 55 10.940 -49.065 9.216 1.00 0.00 C ATOM 2105 O THR B 55 11.840 -49.069 8.377 1.00 0.00 O ATOM 2106 CB THR B 55 11.320 -48.890 11.690 1.00 0.00 C ATOM 2107 OG1 THR B 55 12.518 -48.172 11.521 1.00 0.00 O ATOM 2108 CG2 THR B 55 11.381 -49.602 13.042 1.00 0.00 C ATOM 0 H THR B 55 13.054 -50.496 10.327 1.00 0.00 H new ATOM 0 HA THR B 55 10.141 -50.383 10.686 1.00 0.00 H new ATOM 0 HB THR B 55 10.466 -48.213 11.689 1.00 0.00 H new ATOM 0 HG1 THR B 55 13.277 -48.792 11.545 1.00 0.00 H new ATOM 0 HG21 THR B 55 11.554 -48.870 13.831 1.00 0.00 H new ATOM 0 HG22 THR B 55 10.438 -50.117 13.225 1.00 0.00 H new ATOM 0 HG23 THR B 55 12.195 -50.327 13.035 1.00 0.00 H new ATOM 2116 N LEU B 56 9.817 -48.365 9.033 1.00 0.00 N ATOM 2117 CA LEU B 56 9.553 -47.577 7.822 1.00 0.00 C ATOM 2118 C LEU B 56 10.635 -46.507 7.553 1.00 0.00 C ATOM 2119 O LEU B 56 11.007 -46.292 6.398 1.00 0.00 O ATOM 2120 CB LEU B 56 8.142 -46.961 7.925 1.00 0.00 C ATOM 2121 CG LEU B 56 6.987 -47.982 7.900 1.00 0.00 C ATOM 2122 CD1 LEU B 56 5.655 -47.249 8.048 1.00 0.00 C ATOM 2123 CD2 LEU B 56 6.935 -48.769 6.589 1.00 0.00 C ATOM 0 H LEU B 56 9.064 -48.327 9.720 1.00 0.00 H new ATOM 0 HA LEU B 56 9.594 -48.244 6.961 1.00 0.00 H new ATOM 0 HB2 LEU B 56 8.079 -46.385 8.848 1.00 0.00 H new ATOM 0 HB3 LEU B 56 8.006 -46.260 7.102 1.00 0.00 H new ATOM 0 HG LEU B 56 7.160 -48.676 8.722 1.00 0.00 H new ATOM 0 HD11 LEU B 56 4.839 -47.971 8.030 1.00 0.00 H new ATOM 0 HD12 LEU B 56 5.641 -46.708 8.994 1.00 0.00 H new ATOM 0 HD13 LEU B 56 5.534 -46.544 7.225 1.00 0.00 H new ATOM 0 HD21 LEU B 56 6.105 -49.475 6.621 1.00 0.00 H new ATOM 0 HD22 LEU B 56 6.794 -48.080 5.756 1.00 0.00 H new ATOM 0 HD23 LEU B 56 7.869 -49.314 6.454 1.00 0.00 H new ATOM 2135 N SER B 57 11.208 -45.897 8.595 1.00 0.00 N ATOM 2136 CA SER B 57 12.316 -44.939 8.465 1.00 0.00 C ATOM 2137 C SER B 57 13.653 -45.581 8.051 1.00 0.00 C ATOM 2138 O SER B 57 14.459 -44.907 7.409 1.00 0.00 O ATOM 2139 CB SER B 57 12.493 -44.130 9.756 1.00 0.00 C ATOM 2140 OG SER B 57 12.873 -44.962 10.836 1.00 0.00 O ATOM 0 H SER B 57 10.916 -46.053 9.560 1.00 0.00 H new ATOM 0 HA SER B 57 12.032 -44.273 7.650 1.00 0.00 H new ATOM 0 HB2 SER B 57 13.249 -43.360 9.604 1.00 0.00 H new ATOM 0 HB3 SER B 57 11.561 -43.619 9.998 1.00 0.00 H new ATOM 0 HG SER B 57 12.980 -44.419 11.645 1.00 0.00 H new ATOM 2146 N ASP B 58 13.883 -46.877 8.312 1.00 0.00 N ATOM 2147 CA ASP B 58 15.079 -47.590 7.823 1.00 0.00 C ATOM 2148 C ASP B 58 15.081 -47.722 6.287 1.00 0.00 C ATOM 2149 O ASP B 58 16.144 -47.735 5.661 1.00 0.00 O ATOM 2150 CB ASP B 58 15.198 -48.988 8.453 1.00 0.00 C ATOM 2151 CG ASP B 58 15.383 -48.959 9.977 1.00 0.00 C ATOM 2152 OD1 ASP B 58 16.359 -48.333 10.458 1.00 0.00 O ATOM 2153 OD2 ASP B 58 14.574 -49.599 10.690 1.00 0.00 O1- ATOM 0 H ASP B 58 13.252 -47.459 8.863 1.00 0.00 H new ATOM 0 HA ASP B 58 15.938 -46.990 8.123 1.00 0.00 H new ATOM 0 HB2 ASP B 58 14.303 -49.563 8.214 1.00 0.00 H new ATOM 0 HB3 ASP B 58 16.042 -49.510 8.002 1.00 0.00 H new ATOM 2158 N TYR B 59 13.888 -47.763 5.679 1.00 0.00 N ATOM 2159 CA TYR B 59 13.666 -47.776 4.227 1.00 0.00 C ATOM 2160 C TYR B 59 13.379 -46.380 3.633 1.00 0.00 C ATOM 2161 O TYR B 59 13.083 -46.266 2.442 1.00 0.00 O ATOM 2162 CB TYR B 59 12.549 -48.783 3.913 1.00 0.00 C ATOM 2163 CG TYR B 59 12.868 -50.205 4.333 1.00 0.00 C ATOM 2164 CD1 TYR B 59 13.852 -50.936 3.638 1.00 0.00 C ATOM 2165 CD2 TYR B 59 12.177 -50.798 5.409 1.00 0.00 C ATOM 2166 CE1 TYR B 59 14.150 -52.258 4.016 1.00 0.00 C ATOM 2167 CE2 TYR B 59 12.460 -52.126 5.777 1.00 0.00 C ATOM 2168 CZ TYR B 59 13.452 -52.855 5.087 1.00 0.00 C ATOM 2169 OH TYR B 59 13.728 -54.135 5.450 1.00 0.00 O ATOM 0 H TYR B 59 13.016 -47.789 6.207 1.00 0.00 H new ATOM 0 HA TYR B 59 14.591 -48.089 3.742 1.00 0.00 H new ATOM 0 HB2 TYR B 59 11.634 -48.464 4.412 1.00 0.00 H new ATOM 0 HB3 TYR B 59 12.349 -48.767 2.842 1.00 0.00 H new ATOM 0 HD1 TYR B 59 14.379 -50.480 2.813 1.00 0.00 H new ATOM 0 HD2 TYR B 59 11.432 -50.234 5.950 1.00 0.00 H new ATOM 0 HE1 TYR B 59 14.911 -52.814 3.488 1.00 0.00 H new ATOM 0 HE2 TYR B 59 11.917 -52.588 6.588 1.00 0.00 H new ATOM 0 HH TYR B 59 14.696 -54.243 5.559 1.00 0.00 H new ATOM 2179 N ASN B 60 13.460 -45.317 4.447 1.00 0.00 N ATOM 2180 CA ASN B 60 13.111 -43.928 4.099 1.00 0.00 C ATOM 2181 C ASN B 60 11.674 -43.762 3.540 1.00 0.00 C ATOM 2182 O ASN B 60 11.409 -42.864 2.731 1.00 0.00 O ATOM 2183 CB ASN B 60 14.218 -43.290 3.231 1.00 0.00 C ATOM 2184 CG ASN B 60 15.571 -43.273 3.925 1.00 0.00 C ATOM 2185 OD1 ASN B 60 15.822 -42.491 4.834 1.00 0.00 O ATOM 2186 ND2 ASN B 60 16.485 -44.132 3.524 1.00 0.00 N ATOM 0 H ASN B 60 13.785 -45.404 5.410 1.00 0.00 H new ATOM 0 HA ASN B 60 13.075 -43.357 5.027 1.00 0.00 H new ATOM 0 HB2 ASN B 60 14.302 -43.840 2.294 1.00 0.00 H new ATOM 0 HB3 ASN B 60 13.932 -42.269 2.977 1.00 0.00 H new ATOM 0 HD21 ASN B 60 17.402 -44.146 3.970 1.00 0.00 H new ATOM 0 HD22 ASN B 60 16.276 -44.783 2.767 1.00 0.00 H new ATOM 2193 N ILE B 61 10.737 -44.613 3.980 1.00 0.00 N ATOM 2194 CA ILE B 61 9.316 -44.558 3.594 1.00 0.00 C ATOM 2195 C ILE B 61 8.651 -43.338 4.258 1.00 0.00 C ATOM 2196 O ILE B 61 8.882 -43.059 5.435 1.00 0.00 O ATOM 2197 CB ILE B 61 8.607 -45.898 3.914 1.00 0.00 C ATOM 2198 CG1 ILE B 61 9.181 -47.009 3.003 1.00 0.00 C ATOM 2199 CG2 ILE B 61 7.082 -45.793 3.714 1.00 0.00 C ATOM 2200 CD1 ILE B 61 8.783 -48.434 3.402 1.00 0.00 C ATOM 0 H ILE B 61 10.947 -45.374 4.626 1.00 0.00 H new ATOM 0 HA ILE B 61 9.226 -44.426 2.516 1.00 0.00 H new ATOM 0 HB ILE B 61 8.789 -46.141 4.961 1.00 0.00 H new ATOM 0 HG12 ILE B 61 8.852 -46.827 1.980 1.00 0.00 H new ATOM 0 HG13 ILE B 61 10.269 -46.936 3.005 1.00 0.00 H new ATOM 0 HG21 ILE B 61 6.618 -46.751 3.947 1.00 0.00 H new ATOM 0 HG22 ILE B 61 6.680 -45.025 4.375 1.00 0.00 H new ATOM 0 HG23 ILE B 61 6.868 -45.529 2.678 1.00 0.00 H new ATOM 0 HD11 ILE B 61 9.231 -49.145 2.708 1.00 0.00 H new ATOM 0 HD12 ILE B 61 9.137 -48.641 4.412 1.00 0.00 H new ATOM 0 HD13 ILE B 61 7.698 -48.531 3.371 1.00 0.00 H new ATOM 2212 N GLN B 62 7.842 -42.602 3.486 1.00 0.00 N ATOM 2213 CA GLN B 62 7.269 -41.290 3.838 1.00 0.00 C ATOM 2214 C GLN B 62 5.757 -41.217 3.542 1.00 0.00 C ATOM 2215 O GLN B 62 5.196 -42.126 2.927 1.00 0.00 O ATOM 2216 CB GLN B 62 8.036 -40.218 3.040 1.00 0.00 C ATOM 2217 CG GLN B 62 9.457 -39.978 3.578 1.00 0.00 C ATOM 2218 CD GLN B 62 10.329 -39.225 2.576 1.00 0.00 C ATOM 2219 OE1 GLN B 62 10.295 -38.005 2.469 1.00 0.00 O ATOM 2220 NE2 GLN B 62 11.135 -39.923 1.800 1.00 0.00 N ATOM 0 H GLN B 62 7.555 -42.915 2.559 1.00 0.00 H new ATOM 0 HA GLN B 62 7.375 -41.124 4.910 1.00 0.00 H new ATOM 0 HB2 GLN B 62 8.095 -40.522 1.995 1.00 0.00 H new ATOM 0 HB3 GLN B 62 7.478 -39.282 3.069 1.00 0.00 H new ATOM 0 HG2 GLN B 62 9.402 -39.412 4.508 1.00 0.00 H new ATOM 0 HG3 GLN B 62 9.921 -40.935 3.815 1.00 0.00 H new ATOM 0 HE21 GLN B 62 11.169 -40.939 1.883 1.00 0.00 H new ATOM 0 HE22 GLN B 62 11.724 -39.447 1.117 1.00 0.00 H new ATOM 2229 N LYS B 63 5.094 -40.121 3.924 1.00 0.00 N ATOM 2230 CA LYS B 63 3.661 -39.918 3.669 1.00 0.00 C ATOM 2231 C LYS B 63 3.285 -40.057 2.172 1.00 0.00 C ATOM 2232 O LYS B 63 4.016 -39.610 1.285 1.00 0.00 O ATOM 2233 CB LYS B 63 3.208 -38.589 4.303 1.00 0.00 C ATOM 2234 CG LYS B 63 3.835 -37.327 3.682 1.00 0.00 C ATOM 2235 CD LYS B 63 3.909 -36.192 4.716 1.00 0.00 C ATOM 2236 CE LYS B 63 4.518 -34.929 4.098 1.00 0.00 C ATOM 2237 NZ LYS B 63 5.134 -34.083 5.122 1.00 0.00 N ATOM 0 H LYS B 63 5.535 -39.347 4.420 1.00 0.00 H new ATOM 0 HA LYS B 63 3.106 -40.722 4.152 1.00 0.00 H new ATOM 0 HB2 LYS B 63 2.124 -38.516 4.222 1.00 0.00 H new ATOM 0 HB3 LYS B 63 3.447 -38.610 5.366 1.00 0.00 H new ATOM 0 HG2 LYS B 63 4.835 -37.555 3.313 1.00 0.00 H new ATOM 0 HG3 LYS B 63 3.244 -37.006 2.824 1.00 0.00 H new ATOM 0 HD2 LYS B 63 2.910 -35.972 5.093 1.00 0.00 H new ATOM 0 HD3 LYS B 63 4.509 -36.510 5.569 1.00 0.00 H new ATOM 0 HE2 LYS B 63 5.265 -35.208 3.355 1.00 0.00 H new ATOM 0 HE3 LYS B 63 3.744 -34.367 3.575 1.00 0.00 H new ATOM 0 HZ1 LYS B 63 5.538 -33.235 4.675 1.00 0.00 H new ATOM 0 HZ2 LYS B 63 4.414 -33.798 5.816 1.00 0.00 H new ATOM 0 HZ3 LYS B 63 5.888 -34.614 5.603 1.00 0.00 H new ATOM 2249 N GLU B 64 2.149 -40.715 1.906 1.00 0.00 N ATOM 2250 CA GLU B 64 1.646 -41.104 0.572 1.00 0.00 C ATOM 2251 C GLU B 64 2.555 -42.058 -0.242 1.00 0.00 C ATOM 2252 O GLU B 64 2.396 -42.176 -1.460 1.00 0.00 O ATOM 2253 CB GLU B 64 1.177 -39.880 -0.245 1.00 0.00 C ATOM 2254 CG GLU B 64 0.106 -39.041 0.459 1.00 0.00 C ATOM 2255 CD GLU B 64 -0.586 -38.087 -0.536 1.00 0.00 C ATOM 2256 OE1 GLU B 64 0.090 -37.200 -1.115 1.00 0.00 O ATOM 2257 OE2 GLU B 64 -1.822 -38.195 -0.725 1.00 0.00 O1- ATOM 0 H GLU B 64 1.519 -41.008 2.652 1.00 0.00 H new ATOM 0 HA GLU B 64 0.772 -41.720 0.785 1.00 0.00 H new ATOM 0 HB2 GLU B 64 2.038 -39.247 -0.460 1.00 0.00 H new ATOM 0 HB3 GLU B 64 0.786 -40.222 -1.203 1.00 0.00 H new ATOM 0 HG2 GLU B 64 -0.635 -39.698 0.915 1.00 0.00 H new ATOM 0 HG3 GLU B 64 0.561 -38.465 1.265 1.00 0.00 H new ATOM 2264 N SER B 65 3.481 -42.783 0.402 1.00 0.00 N ATOM 2265 CA SER B 65 4.264 -43.843 -0.267 1.00 0.00 C ATOM 2266 C SER B 65 3.390 -45.032 -0.685 1.00 0.00 C ATOM 2267 O SER B 65 2.491 -45.429 0.061 1.00 0.00 O ATOM 2268 CB SER B 65 5.385 -44.385 0.625 1.00 0.00 C ATOM 2269 OG SER B 65 6.328 -43.378 0.919 1.00 0.00 O ATOM 0 H SER B 65 3.710 -42.657 1.388 1.00 0.00 H new ATOM 0 HA SER B 65 4.690 -43.366 -1.150 1.00 0.00 H new ATOM 0 HB2 SER B 65 4.962 -44.774 1.551 1.00 0.00 H new ATOM 0 HB3 SER B 65 5.881 -45.218 0.127 1.00 0.00 H new ATOM 0 HG SER B 65 5.951 -42.759 1.579 1.00 0.00 H new ATOM 2275 N THR B 66 3.705 -45.651 -1.829 1.00 0.00 N ATOM 2276 CA THR B 66 3.071 -46.899 -2.293 1.00 0.00 C ATOM 2277 C THR B 66 3.964 -48.104 -2.001 1.00 0.00 C ATOM 2278 O THR B 66 5.072 -48.202 -2.530 1.00 0.00 O ATOM 2279 CB THR B 66 2.779 -46.888 -3.806 1.00 0.00 C ATOM 2280 OG1 THR B 66 2.174 -45.695 -4.243 1.00 0.00 O ATOM 2281 CG2 THR B 66 1.847 -48.035 -4.210 1.00 0.00 C ATOM 0 H THR B 66 4.416 -45.298 -2.469 1.00 0.00 H new ATOM 0 HA THR B 66 2.129 -46.973 -1.749 1.00 0.00 H new ATOM 0 HB THR B 66 3.757 -46.994 -4.276 1.00 0.00 H new ATOM 0 HG1 THR B 66 2.571 -45.420 -5.096 1.00 0.00 H new ATOM 0 HG21 THR B 66 1.664 -47.994 -5.284 1.00 0.00 H new ATOM 0 HG22 THR B 66 2.312 -48.988 -3.957 1.00 0.00 H new ATOM 0 HG23 THR B 66 0.901 -47.940 -3.677 1.00 0.00 H new ATOM 2289 N LEU B 67 3.467 -49.036 -1.191 1.00 0.00 N ATOM 2290 CA LEU B 67 4.055 -50.354 -0.955 1.00 0.00 C ATOM 2291 C LEU B 67 3.294 -51.397 -1.787 1.00 0.00 C ATOM 2292 O LEU B 67 2.119 -51.216 -2.112 1.00 0.00 O ATOM 2293 CB LEU B 67 4.017 -50.712 0.546 1.00 0.00 C ATOM 2294 CG LEU B 67 5.013 -49.973 1.461 1.00 0.00 C ATOM 2295 CD1 LEU B 67 4.732 -48.474 1.601 1.00 0.00 C ATOM 2296 CD2 LEU B 67 4.953 -50.598 2.857 1.00 0.00 C ATOM 0 H LEU B 67 2.609 -48.888 -0.659 1.00 0.00 H new ATOM 0 HA LEU B 67 5.101 -50.343 -1.261 1.00 0.00 H new ATOM 0 HB2 LEU B 67 3.010 -50.521 0.916 1.00 0.00 H new ATOM 0 HB3 LEU B 67 4.195 -51.783 0.645 1.00 0.00 H new ATOM 0 HG LEU B 67 5.995 -50.076 0.998 1.00 0.00 H new ATOM 0 HD11 LEU B 67 5.475 -48.025 2.260 1.00 0.00 H new ATOM 0 HD12 LEU B 67 4.783 -48.001 0.620 1.00 0.00 H new ATOM 0 HD13 LEU B 67 3.738 -48.328 2.023 1.00 0.00 H new ATOM 0 HD21 LEU B 67 5.653 -50.085 3.516 1.00 0.00 H new ATOM 0 HD22 LEU B 67 3.943 -50.502 3.255 1.00 0.00 H new ATOM 0 HD23 LEU B 67 5.220 -51.653 2.795 1.00 0.00 H new ATOM 2308 N HIS B 68 3.942 -52.518 -2.091 1.00 0.00 N ATOM 2309 CA HIS B 68 3.393 -53.590 -2.925 1.00 0.00 C ATOM 2310 C HIS B 68 3.350 -54.895 -2.126 1.00 0.00 C ATOM 2311 O HIS B 68 4.360 -55.312 -1.560 1.00 0.00 O ATOM 2312 CB HIS B 68 4.210 -53.678 -4.227 1.00 0.00 C ATOM 2313 CG HIS B 68 4.198 -52.379 -4.999 1.00 0.00 C ATOM 2314 ND1 HIS B 68 5.021 -51.276 -4.744 1.00 0.00 N ATOM 2315 CD2 HIS B 68 3.287 -52.037 -5.956 1.00 0.00 C ATOM 2316 CE1 HIS B 68 4.562 -50.288 -5.529 1.00 0.00 C ATOM 2317 NE2 HIS B 68 3.540 -50.723 -6.285 1.00 0.00 N ATOM 0 H HIS B 68 4.886 -52.714 -1.758 1.00 0.00 H new ATOM 0 HA HIS B 68 2.363 -53.381 -3.213 1.00 0.00 H new ATOM 0 HB2 HIS B 68 5.239 -53.948 -3.990 1.00 0.00 H new ATOM 0 HB3 HIS B 68 3.807 -54.474 -4.853 1.00 0.00 H new ATOM 0 HD2 HIS B 68 2.519 -52.671 -6.373 1.00 0.00 H new ATOM 0 HE1 HIS B 68 4.959 -49.284 -5.550 1.00 0.00 H new ATOM 0 HE2 HIS B 68 3.037 -50.175 -6.983 1.00 0.00 H new ATOM 2325 N LEU B 69 2.171 -55.520 -2.050 1.00 0.00 N ATOM 2326 CA LEU B 69 1.902 -56.731 -1.271 1.00 0.00 C ATOM 2327 C LEU B 69 1.800 -57.954 -2.192 1.00 0.00 C ATOM 2328 O LEU B 69 0.904 -58.045 -3.031 1.00 0.00 O ATOM 2329 CB LEU B 69 0.626 -56.508 -0.430 1.00 0.00 C ATOM 2330 CG LEU B 69 0.122 -57.732 0.361 1.00 0.00 C ATOM 2331 CD1 LEU B 69 1.111 -58.188 1.434 1.00 0.00 C ATOM 2332 CD2 LEU B 69 -1.197 -57.385 1.051 1.00 0.00 C ATOM 0 H LEU B 69 1.347 -55.183 -2.548 1.00 0.00 H new ATOM 0 HA LEU B 69 2.727 -56.933 -0.588 1.00 0.00 H new ATOM 0 HB2 LEU B 69 0.814 -55.697 0.273 1.00 0.00 H new ATOM 0 HB3 LEU B 69 -0.171 -56.175 -1.095 1.00 0.00 H new ATOM 0 HG LEU B 69 -0.002 -58.542 -0.357 1.00 0.00 H new ATOM 0 HD11 LEU B 69 0.705 -59.052 1.959 1.00 0.00 H new ATOM 0 HD12 LEU B 69 2.057 -58.460 0.965 1.00 0.00 H new ATOM 0 HD13 LEU B 69 1.277 -57.377 2.143 1.00 0.00 H new ATOM 0 HD21 LEU B 69 -1.554 -58.250 1.610 1.00 0.00 H new ATOM 0 HD22 LEU B 69 -1.042 -56.550 1.734 1.00 0.00 H new ATOM 0 HD23 LEU B 69 -1.938 -57.107 0.301 1.00 0.00 H new ATOM 2344 N VAL B 70 2.696 -58.915 -1.971 1.00 0.00 N ATOM 2345 CA VAL B 70 2.705 -60.257 -2.574 1.00 0.00 C ATOM 2346 C VAL B 70 2.202 -61.264 -1.532 1.00 0.00 C ATOM 2347 O VAL B 70 2.470 -61.115 -0.340 1.00 0.00 O ATOM 2348 CB VAL B 70 4.118 -60.589 -3.106 1.00 0.00 C ATOM 2349 CG1 VAL B 70 4.235 -62.009 -3.676 1.00 0.00 C ATOM 2350 CG2 VAL B 70 4.525 -59.612 -4.217 1.00 0.00 C ATOM 0 H VAL B 70 3.479 -58.776 -1.333 1.00 0.00 H new ATOM 0 HA VAL B 70 2.036 -60.304 -3.433 1.00 0.00 H new ATOM 0 HB VAL B 70 4.777 -60.504 -2.242 1.00 0.00 H new ATOM 0 HG11 VAL B 70 5.252 -62.176 -4.032 1.00 0.00 H new ATOM 0 HG12 VAL B 70 3.999 -62.734 -2.897 1.00 0.00 H new ATOM 0 HG13 VAL B 70 3.537 -62.127 -4.505 1.00 0.00 H new ATOM 0 HG21 VAL B 70 5.523 -59.865 -4.576 1.00 0.00 H new ATOM 0 HG22 VAL B 70 3.814 -59.681 -5.041 1.00 0.00 H new ATOM 0 HG23 VAL B 70 4.528 -58.595 -3.824 1.00 0.00 H new ATOM 2360 N LEU B 71 1.472 -62.293 -1.970 1.00 0.00 N ATOM 2361 CA LEU B 71 0.915 -63.346 -1.112 1.00 0.00 C ATOM 2362 C LEU B 71 1.546 -64.697 -1.500 1.00 0.00 C ATOM 2363 O LEU B 71 1.495 -65.091 -2.669 1.00 0.00 O ATOM 2364 CB LEU B 71 -0.624 -63.295 -1.233 1.00 0.00 C ATOM 2365 CG LEU B 71 -1.405 -63.846 -0.024 1.00 0.00 C ATOM 2366 CD1 LEU B 71 -2.889 -63.512 -0.187 1.00 0.00 C ATOM 2367 CD2 LEU B 71 -1.287 -65.360 0.143 1.00 0.00 C ATOM 0 H LEU B 71 1.245 -62.422 -2.956 1.00 0.00 H new ATOM 0 HA LEU B 71 1.154 -63.200 -0.059 1.00 0.00 H new ATOM 0 HB2 LEU B 71 -0.924 -62.260 -1.395 1.00 0.00 H new ATOM 0 HB3 LEU B 71 -0.920 -63.855 -2.120 1.00 0.00 H new ATOM 0 HG LEU B 71 -0.969 -63.377 0.858 1.00 0.00 H new ATOM 0 HD11 LEU B 71 -3.445 -63.900 0.666 1.00 0.00 H new ATOM 0 HD12 LEU B 71 -3.015 -62.431 -0.241 1.00 0.00 H new ATOM 0 HD13 LEU B 71 -3.266 -63.967 -1.103 1.00 0.00 H new ATOM 0 HD21 LEU B 71 -1.862 -65.676 1.013 1.00 0.00 H new ATOM 0 HD22 LEU B 71 -1.674 -65.856 -0.747 1.00 0.00 H new ATOM 0 HD23 LEU B 71 -0.240 -65.630 0.282 1.00 0.00 H new ATOM 2481 N THR C 80 -0.235 -68.796 -9.047 1.00 0.00 N ATOM 2482 CA THR C 80 1.205 -68.579 -9.300 1.00 0.00 C ATOM 2483 C THR C 80 1.788 -67.549 -8.327 1.00 0.00 C ATOM 2484 O THR C 80 1.139 -66.558 -7.992 1.00 0.00 O ATOM 2485 CB THR C 80 1.463 -68.207 -10.771 1.00 0.00 C ATOM 2486 OG1 THR C 80 2.844 -68.040 -10.987 1.00 0.00 O ATOM 2487 CG2 THR C 80 0.771 -66.921 -11.229 1.00 0.00 C ATOM 0 HA THR C 80 1.727 -69.518 -9.117 1.00 0.00 H new ATOM 0 HB THR C 80 1.047 -69.032 -11.350 1.00 0.00 H new ATOM 0 HG1 THR C 80 3.002 -67.805 -11.925 1.00 0.00 H new ATOM 0 HG21 THR C 80 1.007 -66.734 -12.277 1.00 0.00 H new ATOM 0 HG22 THR C 80 -0.308 -67.027 -11.113 1.00 0.00 H new ATOM 0 HG23 THR C 80 1.121 -66.084 -10.624 1.00 0.00 H new ATOM 2495 N GLU C 81 3.002 -67.811 -7.827 1.00 0.00 N ATOM 2496 CA GLU C 81 3.774 -66.893 -6.985 1.00 0.00 C ATOM 2497 C GLU C 81 4.743 -66.061 -7.832 1.00 0.00 C ATOM 2498 O GLU C 81 4.720 -64.840 -7.764 1.00 0.00 O ATOM 2499 CB GLU C 81 4.490 -67.681 -5.870 1.00 0.00 C ATOM 2500 CG GLU C 81 5.172 -66.763 -4.847 1.00 0.00 C ATOM 2501 CD GLU C 81 5.912 -67.578 -3.770 1.00 0.00 C ATOM 2502 OE1 GLU C 81 5.249 -68.072 -2.825 1.00 0.00 O1- ATOM 2503 OE2 GLU C 81 7.159 -67.700 -3.853 1.00 0.00 O ATOM 0 H GLU C 81 3.486 -68.691 -8.003 1.00 0.00 H new ATOM 0 HA GLU C 81 3.097 -66.186 -6.505 1.00 0.00 H new ATOM 0 HB2 GLU C 81 3.768 -68.317 -5.358 1.00 0.00 H new ATOM 0 HB3 GLU C 81 5.235 -68.340 -6.316 1.00 0.00 H new ATOM 0 HG2 GLU C 81 5.877 -66.106 -5.357 1.00 0.00 H new ATOM 0 HG3 GLU C 81 4.426 -66.124 -4.374 1.00 0.00 H new ATOM 2510 N GLU C 82 5.558 -66.713 -8.667 1.00 0.00 N ATOM 2511 CA GLU C 82 6.680 -66.081 -9.383 1.00 0.00 C ATOM 2512 C GLU C 82 6.278 -64.972 -10.367 1.00 0.00 C ATOM 2513 O GLU C 82 6.931 -63.928 -10.423 1.00 0.00 O ATOM 2514 CB GLU C 82 7.534 -67.149 -10.087 1.00 0.00 C ATOM 2515 CG GLU C 82 6.837 -67.905 -11.229 1.00 0.00 C ATOM 2516 CD GLU C 82 7.727 -69.049 -11.751 1.00 0.00 C ATOM 2517 OE1 GLU C 82 8.609 -68.799 -12.611 1.00 0.00 O1- ATOM 2518 OE2 GLU C 82 7.553 -70.211 -11.306 1.00 0.00 O ATOM 0 H GLU C 82 5.459 -67.708 -8.870 1.00 0.00 H new ATOM 0 HA GLU C 82 7.267 -65.577 -8.615 1.00 0.00 H new ATOM 0 HB2 GLU C 82 8.429 -66.670 -10.484 1.00 0.00 H new ATOM 0 HB3 GLU C 82 7.864 -67.874 -9.343 1.00 0.00 H new ATOM 0 HG2 GLU C 82 5.887 -68.308 -10.878 1.00 0.00 H new ATOM 0 HG3 GLU C 82 6.609 -67.215 -12.042 1.00 0.00 H new ATOM 2525 N GLU C 83 5.184 -65.170 -11.109 1.00 0.00 N ATOM 2526 CA GLU C 83 4.700 -64.175 -12.080 1.00 0.00 C ATOM 2527 C GLU C 83 4.153 -62.936 -11.353 1.00 0.00 C ATOM 2528 O GLU C 83 4.521 -61.803 -11.661 1.00 0.00 O ATOM 2529 CB GLU C 83 3.603 -64.779 -12.975 1.00 0.00 C ATOM 2530 CG GLU C 83 4.092 -65.877 -13.930 1.00 0.00 C ATOM 2531 CD GLU C 83 4.971 -65.305 -15.060 1.00 0.00 C ATOM 2532 OE1 GLU C 83 4.414 -64.841 -16.086 1.00 0.00 O ATOM 2533 OE2 GLU C 83 6.221 -65.322 -14.937 1.00 0.00 O1- ATOM 0 H GLU C 83 4.612 -66.013 -11.057 1.00 0.00 H new ATOM 0 HA GLU C 83 5.541 -63.877 -12.706 1.00 0.00 H new ATOM 0 HB2 GLU C 83 2.819 -65.191 -12.339 1.00 0.00 H new ATOM 0 HB3 GLU C 83 3.150 -63.980 -13.562 1.00 0.00 H new ATOM 0 HG2 GLU C 83 4.659 -66.620 -13.369 1.00 0.00 H new ATOM 0 HG3 GLU C 83 3.234 -66.391 -14.362 1.00 0.00 H new ATOM 2540 N GLN C 84 3.322 -63.162 -10.330 1.00 0.00 N ATOM 2541 CA GLN C 84 2.719 -62.120 -9.490 1.00 0.00 C ATOM 2542 C GLN C 84 3.777 -61.364 -8.677 1.00 0.00 C ATOM 2543 O GLN C 84 3.731 -60.139 -8.571 1.00 0.00 O ATOM 2544 CB GLN C 84 1.688 -62.793 -8.568 1.00 0.00 C ATOM 2545 CG GLN C 84 0.428 -63.257 -9.320 1.00 0.00 C ATOM 2546 CD GLN C 84 -0.724 -62.248 -9.289 1.00 0.00 C ATOM 2547 OE1 GLN C 84 -1.843 -62.565 -8.911 1.00 0.00 O ATOM 2548 NE2 GLN C 84 -0.520 -61.004 -9.679 1.00 0.00 N ATOM 0 H GLN C 84 3.042 -64.103 -10.055 1.00 0.00 H new ATOM 0 HA GLN C 84 2.231 -61.378 -10.122 1.00 0.00 H new ATOM 0 HB2 GLN C 84 2.150 -63.651 -8.079 1.00 0.00 H new ATOM 0 HB3 GLN C 84 1.400 -62.095 -7.782 1.00 0.00 H new ATOM 0 HG2 GLN C 84 0.691 -63.460 -10.358 1.00 0.00 H new ATOM 0 HG3 GLN C 84 0.085 -64.197 -8.888 1.00 0.00 H new ATOM 0 HE21 GLN C 84 0.404 -60.715 -9.999 1.00 0.00 H new ATOM 0 HE22 GLN C 84 -1.287 -60.332 -9.661 1.00 0.00 H new ATOM 2557 N PHE C 85 4.768 -62.095 -8.167 1.00 0.00 N ATOM 2558 CA PHE C 85 5.950 -61.530 -7.507 1.00 0.00 C ATOM 2559 C PHE C 85 6.754 -60.610 -8.438 1.00 0.00 C ATOM 2560 O PHE C 85 6.908 -59.425 -8.140 1.00 0.00 O ATOM 2561 CB PHE C 85 6.804 -62.692 -6.996 1.00 0.00 C ATOM 2562 CG PHE C 85 8.134 -62.315 -6.384 1.00 0.00 C ATOM 2563 CD1 PHE C 85 8.176 -61.529 -5.220 1.00 0.00 C ATOM 2564 CD2 PHE C 85 9.328 -62.798 -6.948 1.00 0.00 C ATOM 2565 CE1 PHE C 85 9.402 -61.290 -4.573 1.00 0.00 C ATOM 2566 CE2 PHE C 85 10.557 -62.552 -6.309 1.00 0.00 C ATOM 2567 CZ PHE C 85 10.591 -61.818 -5.109 1.00 0.00 C ATOM 0 H PHE C 85 4.774 -63.114 -8.200 1.00 0.00 H new ATOM 0 HA PHE C 85 5.632 -60.901 -6.675 1.00 0.00 H new ATOM 0 HB2 PHE C 85 6.227 -63.242 -6.253 1.00 0.00 H new ATOM 0 HB3 PHE C 85 6.988 -63.374 -7.826 1.00 0.00 H new ATOM 0 HD1 PHE C 85 7.265 -61.107 -4.821 1.00 0.00 H new ATOM 0 HD2 PHE C 85 9.302 -63.358 -7.871 1.00 0.00 H new ATOM 0 HE1 PHE C 85 9.431 -60.703 -3.667 1.00 0.00 H new ATOM 0 HE2 PHE C 85 11.474 -62.926 -6.739 1.00 0.00 H new ATOM 0 HZ PHE C 85 11.530 -61.660 -4.599 1.00 0.00 H new ATOM 2577 N ALA C 86 7.181 -61.106 -9.605 1.00 0.00 N ATOM 2578 CA ALA C 86 7.888 -60.304 -10.607 1.00 0.00 C ATOM 2579 C ALA C 86 7.098 -59.044 -10.993 1.00 0.00 C ATOM 2580 O ALA C 86 7.669 -57.962 -11.132 1.00 0.00 O ATOM 2581 CB ALA C 86 8.114 -61.170 -11.848 1.00 0.00 C ATOM 0 H ALA C 86 7.045 -62.079 -9.881 1.00 0.00 H new ATOM 0 HA ALA C 86 8.837 -59.976 -10.184 1.00 0.00 H new ATOM 0 HB1 ALA C 86 8.640 -60.589 -12.606 1.00 0.00 H new ATOM 0 HB2 ALA C 86 8.711 -62.042 -11.580 1.00 0.00 H new ATOM 0 HB3 ALA C 86 7.152 -61.497 -12.244 1.00 0.00 H new ATOM 2587 N LEU C 87 5.772 -59.174 -11.102 1.00 0.00 N ATOM 2588 CA LEU C 87 4.871 -58.067 -11.398 1.00 0.00 C ATOM 2589 C LEU C 87 4.874 -57.004 -10.299 1.00 0.00 C ATOM 2590 O LEU C 87 4.984 -55.817 -10.601 1.00 0.00 O ATOM 2591 CB LEU C 87 3.456 -58.638 -11.610 1.00 0.00 C ATOM 2592 CG LEU C 87 3.133 -58.793 -13.098 1.00 0.00 C ATOM 2593 CD1 LEU C 87 2.020 -59.816 -13.270 1.00 0.00 C ATOM 2594 CD2 LEU C 87 2.704 -57.436 -13.658 1.00 0.00 C ATOM 0 H LEU C 87 5.292 -60.066 -10.984 1.00 0.00 H new ATOM 0 HA LEU C 87 5.215 -57.565 -12.302 1.00 0.00 H new ATOM 0 HB2 LEU C 87 3.375 -59.606 -11.116 1.00 0.00 H new ATOM 0 HB3 LEU C 87 2.723 -57.980 -11.144 1.00 0.00 H new ATOM 0 HG LEU C 87 4.013 -59.140 -13.640 1.00 0.00 H new ATOM 0 HD11 LEU C 87 1.789 -59.927 -14.329 1.00 0.00 H new ATOM 0 HD12 LEU C 87 2.342 -60.776 -12.866 1.00 0.00 H new ATOM 0 HD13 LEU C 87 1.130 -59.479 -12.738 1.00 0.00 H new ATOM 0 HD21 LEU C 87 2.472 -57.537 -14.718 1.00 0.00 H new ATOM 0 HD22 LEU C 87 1.820 -57.085 -13.125 1.00 0.00 H new ATOM 0 HD23 LEU C 87 3.514 -56.717 -13.531 1.00 0.00 H new ATOM 2606 N ALA C 88 4.791 -57.420 -9.036 1.00 0.00 N ATOM 2607 CA ALA C 88 4.767 -56.506 -7.897 1.00 0.00 C ATOM 2608 C ALA C 88 6.082 -55.719 -7.796 1.00 0.00 C ATOM 2609 O ALA C 88 6.066 -54.494 -7.684 1.00 0.00 O ATOM 2610 CB ALA C 88 4.467 -57.324 -6.639 1.00 0.00 C ATOM 0 H ALA C 88 4.738 -58.404 -8.774 1.00 0.00 H new ATOM 0 HA ALA C 88 3.985 -55.757 -8.022 1.00 0.00 H new ATOM 0 HB1 ALA C 88 4.444 -56.663 -5.772 1.00 0.00 H new ATOM 0 HB2 ALA C 88 3.500 -57.816 -6.747 1.00 0.00 H new ATOM 0 HB3 ALA C 88 5.243 -58.077 -6.501 1.00 0.00 H new ATOM 2616 N LEU C 89 7.218 -56.407 -7.957 1.00 0.00 N ATOM 2617 CA LEU C 89 8.554 -55.795 -8.014 1.00 0.00 C ATOM 2618 C LEU C 89 8.670 -54.776 -9.157 1.00 0.00 C ATOM 2619 O LEU C 89 9.151 -53.663 -8.948 1.00 0.00 O ATOM 2620 CB LEU C 89 9.589 -56.916 -8.206 1.00 0.00 C ATOM 2621 CG LEU C 89 10.022 -57.689 -6.944 1.00 0.00 C ATOM 2622 CD1 LEU C 89 8.941 -57.945 -5.891 1.00 0.00 C ATOM 2623 CD2 LEU C 89 10.558 -59.051 -7.377 1.00 0.00 C ATOM 0 H LEU C 89 7.237 -57.422 -8.053 1.00 0.00 H new ATOM 0 HA LEU C 89 8.733 -55.256 -7.084 1.00 0.00 H new ATOM 0 HB2 LEU C 89 9.184 -57.633 -8.921 1.00 0.00 H new ATOM 0 HB3 LEU C 89 10.480 -56.481 -8.660 1.00 0.00 H new ATOM 0 HG LEU C 89 10.758 -57.043 -6.465 1.00 0.00 H new ATOM 0 HD11 LEU C 89 9.371 -58.496 -5.055 1.00 0.00 H new ATOM 0 HD12 LEU C 89 8.548 -56.993 -5.535 1.00 0.00 H new ATOM 0 HD13 LEU C 89 8.133 -58.529 -6.333 1.00 0.00 H new ATOM 0 HD21 LEU C 89 10.870 -59.615 -6.498 1.00 0.00 H new ATOM 0 HD22 LEU C 89 9.776 -59.600 -7.901 1.00 0.00 H new ATOM 0 HD23 LEU C 89 11.411 -58.912 -8.041 1.00 0.00 H new ATOM 2635 N LYS C 90 8.175 -55.122 -10.349 1.00 0.00 N ATOM 2636 CA LYS C 90 8.186 -54.260 -11.542 1.00 0.00 C ATOM 2637 C LYS C 90 7.328 -53.007 -11.361 1.00 0.00 C ATOM 2638 O LYS C 90 7.791 -51.899 -11.616 1.00 0.00 O ATOM 2639 CB LYS C 90 7.774 -55.144 -12.731 1.00 0.00 C ATOM 2640 CG LYS C 90 7.771 -54.458 -14.110 1.00 0.00 C ATOM 2641 CD LYS C 90 6.456 -53.748 -14.484 1.00 0.00 C ATOM 2642 CE LYS C 90 5.229 -54.675 -14.558 1.00 0.00 C ATOM 2643 NZ LYS C 90 5.269 -55.557 -15.765 1.00 0.00 N1+ ATOM 0 H LYS C 90 7.744 -56.031 -10.519 1.00 0.00 H new ATOM 0 HA LYS C 90 9.181 -53.854 -11.727 1.00 0.00 H new ATOM 0 HB2 LYS C 90 8.448 -55.999 -12.774 1.00 0.00 H new ATOM 0 HB3 LYS C 90 6.775 -55.535 -12.539 1.00 0.00 H new ATOM 0 HG2 LYS C 90 8.580 -53.728 -14.137 1.00 0.00 H new ATOM 0 HG3 LYS C 90 7.991 -55.206 -14.871 1.00 0.00 H new ATOM 0 HD2 LYS C 90 6.260 -52.964 -13.752 1.00 0.00 H new ATOM 0 HD3 LYS C 90 6.584 -53.258 -15.449 1.00 0.00 H new ATOM 0 HE2 LYS C 90 5.184 -55.291 -13.660 1.00 0.00 H new ATOM 0 HE3 LYS C 90 4.320 -54.074 -14.578 1.00 0.00 H new ATOM 0 HZ1 LYS C 90 4.426 -56.166 -15.778 1.00 0.00 H new ATOM 0 HZ2 LYS C 90 5.286 -54.970 -16.623 1.00 0.00 H new ATOM 0 HZ3 LYS C 90 6.123 -56.149 -15.734 1.00 0.00 H new ATOM 2657 N MET C 91 6.100 -53.135 -10.859 1.00 0.00 N ATOM 2658 CA MET C 91 5.256 -51.964 -10.532 1.00 0.00 C ATOM 2659 C MET C 91 5.894 -51.067 -9.465 1.00 0.00 C ATOM 2660 O MET C 91 5.862 -49.842 -9.574 1.00 0.00 O ATOM 2661 CB MET C 91 3.862 -52.439 -10.107 1.00 0.00 C ATOM 2662 CG MET C 91 3.167 -53.007 -11.345 1.00 0.00 C ATOM 2663 SD MET C 91 1.481 -53.623 -11.085 1.00 0.00 S ATOM 2664 CE MET C 91 1.857 -55.224 -10.325 1.00 0.00 C ATOM 0 H MET C 91 5.659 -54.034 -10.666 1.00 0.00 H new ATOM 0 HA MET C 91 5.164 -51.350 -11.428 1.00 0.00 H new ATOM 0 HB2 MET C 91 3.938 -53.198 -9.329 1.00 0.00 H new ATOM 0 HB3 MET C 91 3.287 -51.612 -9.691 1.00 0.00 H new ATOM 0 HG2 MET C 91 3.137 -52.232 -12.110 1.00 0.00 H new ATOM 0 HG3 MET C 91 3.775 -53.821 -11.739 1.00 0.00 H new ATOM 0 HE1 MET C 91 0.928 -55.753 -10.112 1.00 0.00 H new ATOM 0 HE2 MET C 91 2.464 -55.817 -11.008 1.00 0.00 H new ATOM 0 HE3 MET C 91 2.405 -55.066 -9.396 1.00 0.00 H new ATOM 2674 N SER C 92 6.567 -51.685 -8.498 1.00 0.00 N ATOM 2675 CA SER C 92 7.331 -50.991 -7.454 1.00 0.00 C ATOM 2676 C SER C 92 8.538 -50.221 -8.009 1.00 0.00 C ATOM 2677 O SER C 92 8.803 -49.090 -7.591 1.00 0.00 O ATOM 2678 CB SER C 92 7.771 -52.015 -6.406 1.00 0.00 C ATOM 2679 OG SER C 92 7.960 -51.394 -5.150 1.00 0.00 O ATOM 0 H SER C 92 6.600 -52.701 -8.413 1.00 0.00 H new ATOM 0 HA SER C 92 6.683 -50.241 -7.000 1.00 0.00 H new ATOM 0 HB2 SER C 92 7.020 -52.800 -6.320 1.00 0.00 H new ATOM 0 HB3 SER C 92 8.697 -52.493 -6.724 1.00 0.00 H new ATOM 0 HG SER C 92 7.088 -51.215 -4.739 1.00 0.00 H new ATOM 2685 N GLU C 93 9.245 -50.783 -8.996 1.00 0.00 N ATOM 2686 CA GLU C 93 10.423 -50.105 -9.571 1.00 0.00 C ATOM 2687 C GLU C 93 10.018 -48.969 -10.527 1.00 0.00 C ATOM 2688 O GLU C 93 10.643 -47.905 -10.510 1.00 0.00 O ATOM 2689 CB GLU C 93 11.448 -51.111 -10.134 1.00 0.00 C ATOM 2690 CG GLU C 93 11.293 -51.554 -11.599 1.00 0.00 C ATOM 2691 CD GLU C 93 11.914 -50.564 -12.608 1.00 0.00 C ATOM 2692 OE1 GLU C 93 13.138 -50.295 -12.529 1.00 0.00 O1- ATOM 2693 OE2 GLU C 93 11.198 -50.086 -13.521 1.00 0.00 O ATOM 0 H GLU C 93 9.031 -51.690 -9.411 1.00 0.00 H new ATOM 0 HA GLU C 93 10.958 -49.601 -8.766 1.00 0.00 H new ATOM 0 HB2 GLU C 93 12.441 -50.676 -10.020 1.00 0.00 H new ATOM 0 HB3 GLU C 93 11.417 -52.004 -9.510 1.00 0.00 H new ATOM 0 HG2 GLU C 93 11.759 -52.531 -11.727 1.00 0.00 H new ATOM 0 HG3 GLU C 93 10.233 -51.674 -11.824 1.00 0.00 H new ATOM 2700 N GLN C 94 8.908 -49.132 -11.260 1.00 0.00 N ATOM 2701 CA GLN C 94 8.316 -48.046 -12.048 1.00 0.00 C ATOM 2702 C GLN C 94 7.880 -46.877 -11.154 1.00 0.00 C ATOM 2703 O GLN C 94 8.291 -45.747 -11.419 1.00 0.00 O ATOM 2704 CB GLN C 94 7.121 -48.539 -12.874 1.00 0.00 C ATOM 2705 CG GLN C 94 7.518 -49.473 -14.027 1.00 0.00 C ATOM 2706 CD GLN C 94 6.306 -49.865 -14.867 1.00 0.00 C ATOM 2707 OE1 GLN C 94 6.215 -49.587 -16.056 1.00 0.00 O ATOM 2708 NE2 GLN C 94 5.317 -50.515 -14.281 1.00 0.00 N ATOM 0 H GLN C 94 8.400 -50.014 -11.322 1.00 0.00 H new ATOM 0 HA GLN C 94 9.090 -47.694 -12.730 1.00 0.00 H new ATOM 0 HB2 GLN C 94 6.426 -49.061 -12.217 1.00 0.00 H new ATOM 0 HB3 GLN C 94 6.590 -47.678 -13.280 1.00 0.00 H new ATOM 0 HG2 GLN C 94 8.257 -48.980 -14.659 1.00 0.00 H new ATOM 0 HG3 GLN C 94 7.990 -50.370 -13.625 1.00 0.00 H new ATOM 0 HE21 GLN C 94 5.379 -50.753 -13.291 1.00 0.00 H new ATOM 0 HE22 GLN C 94 4.491 -50.779 -14.818 1.00 0.00 H new ATOM 2717 N GLU C 95 7.127 -47.150 -10.073 1.00 0.00 N ATOM 2718 CA GLU C 95 6.747 -46.144 -9.067 1.00 0.00 C ATOM 2719 C GLU C 95 7.977 -45.394 -8.535 1.00 0.00 C ATOM 2720 O GLU C 95 8.005 -44.163 -8.537 1.00 0.00 O ATOM 2721 CB GLU C 95 6.006 -46.810 -7.890 1.00 0.00 C ATOM 2722 CG GLU C 95 4.520 -47.088 -8.154 1.00 0.00 C ATOM 2723 CD GLU C 95 3.650 -45.846 -7.873 1.00 0.00 C ATOM 2724 OE1 GLU C 95 3.573 -44.945 -8.742 1.00 0.00 O1- ATOM 2725 OE2 GLU C 95 3.037 -45.768 -6.779 1.00 0.00 O ATOM 0 H GLU C 95 6.763 -48.082 -9.873 1.00 0.00 H new ATOM 0 HA GLU C 95 6.086 -45.428 -9.555 1.00 0.00 H new ATOM 0 HB2 GLU C 95 6.502 -47.750 -7.649 1.00 0.00 H new ATOM 0 HB3 GLU C 95 6.093 -46.170 -7.012 1.00 0.00 H new ATOM 0 HG2 GLU C 95 4.386 -47.399 -9.190 1.00 0.00 H new ATOM 0 HG3 GLU C 95 4.187 -47.915 -7.527 1.00 0.00 H new ATOM 2732 N ALA C 96 9.033 -46.114 -8.145 1.00 0.00 N ATOM 2733 CA ALA C 96 10.267 -45.490 -7.670 1.00 0.00 C ATOM 2734 C ALA C 96 10.919 -44.566 -8.719 1.00 0.00 C ATOM 2735 O ALA C 96 11.348 -43.454 -8.391 1.00 0.00 O ATOM 2736 CB ALA C 96 11.216 -46.602 -7.219 1.00 0.00 C ATOM 0 H ALA C 96 9.056 -47.134 -8.150 1.00 0.00 H new ATOM 0 HA ALA C 96 10.032 -44.835 -6.831 1.00 0.00 H new ATOM 0 HB1 ALA C 96 12.146 -46.163 -6.859 1.00 0.00 H new ATOM 0 HB2 ALA C 96 10.751 -47.174 -6.416 1.00 0.00 H new ATOM 0 HB3 ALA C 96 11.428 -47.263 -8.060 1.00 0.00 H new ATOM 2742 N ARG C 97 10.955 -44.992 -9.987 1.00 0.00 N ATOM 2743 CA ARG C 97 11.597 -44.252 -11.087 1.00 0.00 C ATOM 2744 C ARG C 97 10.874 -42.936 -11.360 1.00 0.00 C ATOM 2745 O ARG C 97 11.496 -41.873 -11.364 1.00 0.00 O ATOM 2746 CB ARG C 97 11.663 -45.170 -12.324 1.00 0.00 C ATOM 2747 CG ARG C 97 12.693 -44.741 -13.387 1.00 0.00 C ATOM 2748 CD ARG C 97 12.240 -43.642 -14.360 1.00 0.00 C ATOM 2749 NE ARG C 97 11.168 -44.113 -15.262 1.00 0.00 N ATOM 2750 CZ ARG C 97 10.804 -43.564 -16.410 1.00 0.00 C ATOM 2751 NH1 ARG C 97 11.359 -42.478 -16.866 1.00 0.00 N1+ ATOM 2752 NH2 ARG C 97 9.865 -44.107 -17.132 1.00 0.00 N ATOM 0 H ARG C 97 10.534 -45.872 -10.285 1.00 0.00 H new ATOM 0 HA ARG C 97 12.615 -43.976 -10.812 1.00 0.00 H new ATOM 0 HB2 ARG C 97 11.899 -46.183 -11.997 1.00 0.00 H new ATOM 0 HB3 ARG C 97 10.677 -45.206 -12.786 1.00 0.00 H new ATOM 0 HG2 ARG C 97 13.592 -44.397 -12.875 1.00 0.00 H new ATOM 0 HG3 ARG C 97 12.973 -45.620 -13.968 1.00 0.00 H new ATOM 0 HD2 ARG C 97 11.886 -42.780 -13.795 1.00 0.00 H new ATOM 0 HD3 ARG C 97 13.092 -43.307 -14.952 1.00 0.00 H new ATOM 0 HE ARG C 97 10.657 -44.946 -14.970 1.00 0.00 H new ATOM 0 HH11 ARG C 97 12.100 -42.022 -16.334 1.00 0.00 H new ATOM 0 HH12 ARG C 97 11.053 -42.083 -17.755 1.00 0.00 H new ATOM 0 HH21 ARG C 97 9.406 -44.960 -16.813 1.00 0.00 H new ATOM 0 HH22 ARG C 97 9.589 -43.679 -18.016 1.00 0.00 H new ATOM 2766 N GLU C 98 9.551 -42.989 -11.511 1.00 0.00 N ATOM 2767 CA GLU C 98 8.752 -41.782 -11.753 1.00 0.00 C ATOM 2768 C GLU C 98 8.754 -40.832 -10.546 1.00 0.00 C ATOM 2769 O GLU C 98 8.866 -39.625 -10.743 1.00 0.00 O ATOM 2770 CB GLU C 98 7.333 -42.129 -12.221 1.00 0.00 C ATOM 2771 CG GLU C 98 6.487 -42.858 -11.174 1.00 0.00 C ATOM 2772 CD GLU C 98 5.098 -43.181 -11.758 1.00 0.00 C ATOM 2773 OE1 GLU C 98 4.192 -42.314 -11.675 1.00 0.00 O ATOM 2774 OE2 GLU C 98 4.911 -44.278 -12.341 1.00 0.00 O1- ATOM 0 H GLU C 98 9.008 -43.852 -11.471 1.00 0.00 H new ATOM 0 HA GLU C 98 9.231 -41.239 -12.568 1.00 0.00 H new ATOM 0 HB2 GLU C 98 6.822 -41.210 -12.508 1.00 0.00 H new ATOM 0 HB3 GLU C 98 7.399 -42.750 -13.115 1.00 0.00 H new ATOM 0 HG2 GLU C 98 6.985 -43.777 -10.867 1.00 0.00 H new ATOM 0 HG3 GLU C 98 6.382 -42.239 -10.283 1.00 0.00 H new ATOM 2781 N VAL C 99 8.734 -41.345 -9.307 1.00 0.00 N ATOM 2782 CA VAL C 99 8.867 -40.521 -8.090 1.00 0.00 C ATOM 2783 C VAL C 99 10.203 -39.766 -8.082 1.00 0.00 C ATOM 2784 O VAL C 99 10.219 -38.555 -7.847 1.00 0.00 O ATOM 2785 CB VAL C 99 8.689 -41.389 -6.830 1.00 0.00 C ATOM 2786 CG1 VAL C 99 9.077 -40.659 -5.542 1.00 0.00 C ATOM 2787 CG2 VAL C 99 7.219 -41.805 -6.672 1.00 0.00 C ATOM 0 H VAL C 99 8.625 -42.341 -9.117 1.00 0.00 H new ATOM 0 HA VAL C 99 8.076 -39.771 -8.088 1.00 0.00 H new ATOM 0 HB VAL C 99 9.345 -42.248 -6.971 1.00 0.00 H new ATOM 0 HG11 VAL C 99 8.930 -41.322 -4.690 1.00 0.00 H new ATOM 0 HG12 VAL C 99 10.124 -40.362 -5.594 1.00 0.00 H new ATOM 0 HG13 VAL C 99 8.454 -39.773 -5.424 1.00 0.00 H new ATOM 0 HG21 VAL C 99 7.108 -42.418 -5.777 1.00 0.00 H new ATOM 0 HG22 VAL C 99 6.597 -40.915 -6.581 1.00 0.00 H new ATOM 0 HG23 VAL C 99 6.907 -42.378 -7.545 1.00 0.00 H new ATOM 2797 N ASN C 100 11.310 -40.439 -8.419 1.00 0.00 N ATOM 2798 CA ASN C 100 12.610 -39.775 -8.579 1.00 0.00 C ATOM 2799 C ASN C 100 12.583 -38.703 -9.691 1.00 0.00 C ATOM 2800 O ASN C 100 13.148 -37.619 -9.505 1.00 0.00 O ATOM 2801 CB ASN C 100 13.708 -40.832 -8.803 1.00 0.00 C ATOM 2802 CG ASN C 100 14.199 -41.416 -7.489 1.00 0.00 C ATOM 2803 OD1 ASN C 100 15.166 -40.951 -6.900 1.00 0.00 O ATOM 2804 ND2 ASN C 100 13.541 -42.426 -6.967 1.00 0.00 N ATOM 0 H ASN C 100 11.332 -41.445 -8.586 1.00 0.00 H new ATOM 0 HA ASN C 100 12.841 -39.235 -7.661 1.00 0.00 H new ATOM 0 HB2 ASN C 100 13.321 -41.631 -9.435 1.00 0.00 H new ATOM 0 HB3 ASN C 100 14.545 -40.381 -9.336 1.00 0.00 H new ATOM 0 HD21 ASN C 100 13.836 -42.820 -6.074 1.00 0.00 H new ATOM 0 HD22 ASN C 100 12.735 -42.816 -7.455 1.00 0.00 H new ATOM 2811 N SER C 101 11.867 -38.941 -10.797 1.00 0.00 N ATOM 2812 CA SER C 101 11.649 -37.905 -11.824 1.00 0.00 C ATOM 2813 C SER C 101 10.894 -36.677 -11.286 1.00 0.00 C ATOM 2814 O SER C 101 11.299 -35.554 -11.586 1.00 0.00 O ATOM 2815 CB SER C 101 10.926 -38.451 -13.062 1.00 0.00 C ATOM 2816 OG SER C 101 11.658 -39.506 -13.664 1.00 0.00 O ATOM 0 H SER C 101 11.428 -39.838 -11.007 1.00 0.00 H new ATOM 0 HA SER C 101 12.649 -37.585 -12.117 1.00 0.00 H new ATOM 0 HB2 SER C 101 9.936 -38.808 -12.779 1.00 0.00 H new ATOM 0 HB3 SER C 101 10.781 -37.648 -13.785 1.00 0.00 H new ATOM 0 HG SER C 101 11.665 -40.282 -13.066 1.00 0.00 H new ATOM 2822 N GLN C 102 9.846 -36.845 -10.459 1.00 0.00 N ATOM 2823 CA GLN C 102 9.142 -35.694 -9.852 1.00 0.00 C ATOM 2824 C GLN C 102 10.068 -34.889 -8.931 1.00 0.00 C ATOM 2825 O GLN C 102 10.110 -33.661 -9.017 1.00 0.00 O ATOM 2826 CB GLN C 102 7.897 -36.087 -9.032 1.00 0.00 C ATOM 2827 CG GLN C 102 7.009 -37.137 -9.699 1.00 0.00 C ATOM 2828 CD GLN C 102 5.615 -37.280 -9.087 1.00 0.00 C ATOM 2829 OE1 GLN C 102 5.221 -36.611 -8.140 1.00 0.00 O ATOM 2830 NE2 GLN C 102 4.801 -38.175 -9.610 1.00 0.00 N ATOM 0 H GLN C 102 9.469 -37.755 -10.196 1.00 0.00 H new ATOM 0 HA GLN C 102 8.821 -35.094 -10.704 1.00 0.00 H new ATOM 0 HB2 GLN C 102 8.220 -36.465 -8.062 1.00 0.00 H new ATOM 0 HB3 GLN C 102 7.303 -35.193 -8.844 1.00 0.00 H new ATOM 0 HG2 GLN C 102 6.903 -36.886 -10.754 1.00 0.00 H new ATOM 0 HG3 GLN C 102 7.513 -38.102 -9.650 1.00 0.00 H new ATOM 0 HE21 GLN C 102 5.108 -38.744 -10.399 1.00 0.00 H new ATOM 0 HE22 GLN C 102 3.864 -38.299 -9.225 1.00 0.00 H new ATOM 2839 N GLU C 103 10.826 -35.589 -8.080 1.00 0.00 N ATOM 2840 CA GLU C 103 11.797 -34.966 -7.163 1.00 0.00 C ATOM 2841 C GLU C 103 12.843 -34.106 -7.905 1.00 0.00 C ATOM 2842 O GLU C 103 13.068 -32.945 -7.537 1.00 0.00 O ATOM 2843 CB GLU C 103 12.517 -36.041 -6.327 1.00 0.00 C ATOM 2844 CG GLU C 103 11.636 -36.704 -5.259 1.00 0.00 C ATOM 2845 CD GLU C 103 11.248 -35.728 -4.131 1.00 0.00 C ATOM 2846 OE1 GLU C 103 12.151 -35.223 -3.419 1.00 0.00 O ATOM 2847 OE2 GLU C 103 10.034 -35.479 -3.930 1.00 0.00 O1- ATOM 0 H GLU C 103 10.786 -36.605 -8.005 1.00 0.00 H new ATOM 0 HA GLU C 103 11.228 -34.306 -6.508 1.00 0.00 H new ATOM 0 HB2 GLU C 103 12.898 -36.812 -6.997 1.00 0.00 H new ATOM 0 HB3 GLU C 103 13.380 -35.588 -5.839 1.00 0.00 H new ATOM 0 HG2 GLU C 103 10.732 -37.092 -5.727 1.00 0.00 H new ATOM 0 HG3 GLU C 103 12.165 -37.556 -4.833 1.00 0.00 H new ATOM 2854 N GLU C 104 13.455 -34.638 -8.972 1.00 0.00 N ATOM 2855 CA GLU C 104 14.436 -33.890 -9.774 1.00 0.00 C ATOM 2856 C GLU C 104 13.815 -32.663 -10.471 1.00 0.00 C ATOM 2857 O GLU C 104 14.431 -31.593 -10.508 1.00 0.00 O ATOM 2858 CB GLU C 104 15.077 -34.818 -10.821 1.00 0.00 C ATOM 2859 CG GLU C 104 16.052 -35.843 -10.222 1.00 0.00 C ATOM 2860 CD GLU C 104 17.342 -35.175 -9.708 1.00 0.00 C ATOM 2861 OE1 GLU C 104 18.256 -34.906 -10.526 1.00 0.00 O ATOM 2862 OE2 GLU C 104 17.460 -34.923 -8.484 1.00 0.00 O1- ATOM 0 H GLU C 104 13.287 -35.589 -9.302 1.00 0.00 H new ATOM 0 HA GLU C 104 15.199 -33.521 -9.088 1.00 0.00 H new ATOM 0 HB2 GLU C 104 14.289 -35.348 -11.355 1.00 0.00 H new ATOM 0 HB3 GLU C 104 15.607 -34.212 -11.555 1.00 0.00 H new ATOM 0 HG2 GLU C 104 15.565 -36.372 -9.402 1.00 0.00 H new ATOM 0 HG3 GLU C 104 16.305 -36.588 -10.976 1.00 0.00 H new ATOM 2869 N GLU C 105 12.588 -32.791 -10.989 1.00 0.00 N ATOM 2870 CA GLU C 105 11.874 -31.697 -11.654 1.00 0.00 C ATOM 2871 C GLU C 105 11.498 -30.558 -10.691 1.00 0.00 C ATOM 2872 O GLU C 105 11.690 -29.393 -11.044 1.00 0.00 O ATOM 2873 CB GLU C 105 10.619 -32.236 -12.362 1.00 0.00 C ATOM 2874 CG GLU C 105 10.939 -33.032 -13.636 1.00 0.00 C ATOM 2875 CD GLU C 105 11.333 -32.106 -14.802 1.00 0.00 C ATOM 2876 OE1 GLU C 105 10.429 -31.612 -15.521 1.00 0.00 O1- ATOM 2877 OE2 GLU C 105 12.547 -31.869 -15.019 1.00 0.00 O ATOM 0 H GLU C 105 12.060 -33.663 -10.958 1.00 0.00 H new ATOM 0 HA GLU C 105 12.556 -31.273 -12.391 1.00 0.00 H new ATOM 0 HB2 GLU C 105 10.066 -32.873 -11.672 1.00 0.00 H new ATOM 0 HB3 GLU C 105 9.967 -31.401 -12.617 1.00 0.00 H new ATOM 0 HG2 GLU C 105 11.752 -33.730 -13.435 1.00 0.00 H new ATOM 0 HG3 GLU C 105 10.071 -33.627 -13.921 1.00 0.00 H new ATOM 2884 N GLU C 106 11.011 -30.847 -9.477 1.00 0.00 N ATOM 2885 CA GLU C 106 10.691 -29.796 -8.500 1.00 0.00 C ATOM 2886 C GLU C 106 11.943 -29.154 -7.869 1.00 0.00 C ATOM 2887 O GLU C 106 11.945 -27.944 -7.619 1.00 0.00 O ATOM 2888 CB GLU C 106 9.663 -30.263 -7.456 1.00 0.00 C ATOM 2889 CG GLU C 106 10.180 -31.266 -6.419 1.00 0.00 C ATOM 2890 CD GLU C 106 9.059 -31.639 -5.428 1.00 0.00 C ATOM 2891 OE1 GLU C 106 8.134 -32.401 -5.803 1.00 0.00 O ATOM 2892 OE2 GLU C 106 9.094 -31.163 -4.266 1.00 0.00 O1- ATOM 0 H GLU C 106 10.830 -31.795 -9.148 1.00 0.00 H new ATOM 0 HA GLU C 106 10.211 -28.996 -9.063 1.00 0.00 H new ATOM 0 HB2 GLU C 106 9.283 -29.387 -6.930 1.00 0.00 H new ATOM 0 HB3 GLU C 106 8.819 -30.712 -7.979 1.00 0.00 H new ATOM 0 HG2 GLU C 106 10.544 -32.163 -6.921 1.00 0.00 H new ATOM 0 HG3 GLU C 106 11.024 -30.838 -5.879 1.00 0.00 H new ATOM 2899 N GLU C 107 13.032 -29.914 -7.678 1.00 0.00 N ATOM 2900 CA GLU C 107 14.317 -29.338 -7.263 1.00 0.00 C ATOM 2901 C GLU C 107 14.869 -28.359 -8.317 1.00 0.00 C ATOM 2902 O GLU C 107 15.232 -27.226 -7.982 1.00 0.00 O ATOM 2903 CB GLU C 107 15.328 -30.460 -6.973 1.00 0.00 C ATOM 2904 CG GLU C 107 16.641 -29.944 -6.368 1.00 0.00 C ATOM 2905 CD GLU C 107 16.466 -29.513 -4.898 1.00 0.00 C ATOM 2906 OE1 GLU C 107 16.627 -30.367 -3.991 1.00 0.00 O ATOM 2907 OE2 GLU C 107 16.182 -28.320 -4.634 1.00 0.00 O1- ATOM 0 H GLU C 107 13.047 -30.926 -7.804 1.00 0.00 H new ATOM 0 HA GLU C 107 14.152 -28.767 -6.349 1.00 0.00 H new ATOM 0 HB2 GLU C 107 14.878 -31.179 -6.289 1.00 0.00 H new ATOM 0 HB3 GLU C 107 15.546 -30.993 -7.898 1.00 0.00 H new ATOM 0 HG2 GLU C 107 17.400 -30.724 -6.430 1.00 0.00 H new ATOM 0 HG3 GLU C 107 17.003 -29.099 -6.954 1.00 0.00 H new ATOM 2914 N GLU C 108 14.898 -28.750 -9.599 1.00 0.00 N ATOM 2915 CA GLU C 108 15.372 -27.859 -10.667 1.00 0.00 C ATOM 2916 C GLU C 108 14.407 -26.685 -10.921 1.00 0.00 C ATOM 2917 O GLU C 108 14.862 -25.598 -11.273 1.00 0.00 O ATOM 2918 CB GLU C 108 15.670 -28.662 -11.943 1.00 0.00 C ATOM 2919 CG GLU C 108 16.529 -27.889 -12.960 1.00 0.00 C ATOM 2920 CD GLU C 108 17.945 -27.564 -12.436 1.00 0.00 C ATOM 2921 OE1 GLU C 108 18.771 -28.498 -12.299 1.00 0.00 O1- ATOM 2922 OE2 GLU C 108 18.252 -26.372 -12.183 1.00 0.00 O ATOM 0 H GLU C 108 14.601 -29.671 -9.920 1.00 0.00 H new ATOM 0 HA GLU C 108 16.306 -27.405 -10.335 1.00 0.00 H new ATOM 0 HB2 GLU C 108 16.182 -29.585 -11.672 1.00 0.00 H new ATOM 0 HB3 GLU C 108 14.729 -28.946 -12.414 1.00 0.00 H new ATOM 0 HG2 GLU C 108 16.613 -28.475 -13.875 1.00 0.00 H new ATOM 0 HG3 GLU C 108 16.023 -26.960 -13.222 1.00 0.00 H new ATOM 2929 N LEU C 109 13.096 -26.839 -10.683 1.00 0.00 N ATOM 2930 CA LEU C 109 12.142 -25.728 -10.686 1.00 0.00 C ATOM 2931 C LEU C 109 12.521 -24.686 -9.628 1.00 0.00 C ATOM 2932 O LEU C 109 12.667 -23.510 -9.967 1.00 0.00 O ATOM 2933 CB LEU C 109 10.712 -26.269 -10.482 1.00 0.00 C ATOM 2934 CG LEU C 109 9.564 -25.240 -10.472 1.00 0.00 C ATOM 2935 CD1 LEU C 109 9.425 -24.442 -9.169 1.00 0.00 C ATOM 2936 CD2 LEU C 109 9.692 -24.263 -11.635 1.00 0.00 C ATOM 0 H LEU C 109 12.669 -27.743 -10.482 1.00 0.00 H new ATOM 0 HA LEU C 109 12.175 -25.225 -11.652 1.00 0.00 H new ATOM 0 HB2 LEU C 109 10.509 -26.994 -11.271 1.00 0.00 H new ATOM 0 HB3 LEU C 109 10.688 -26.811 -9.537 1.00 0.00 H new ATOM 0 HG LEU C 109 8.662 -25.844 -10.570 1.00 0.00 H new ATOM 0 HD11 LEU C 109 8.592 -23.744 -9.257 1.00 0.00 H new ATOM 0 HD12 LEU C 109 9.240 -25.126 -8.341 1.00 0.00 H new ATOM 0 HD13 LEU C 109 10.345 -23.887 -8.982 1.00 0.00 H new ATOM 0 HD21 LEU C 109 8.869 -23.549 -11.603 1.00 0.00 H new ATOM 0 HD22 LEU C 109 10.639 -23.729 -11.559 1.00 0.00 H new ATOM 0 HD23 LEU C 109 9.660 -24.812 -12.576 1.00 0.00 H new ATOM 2948 N LEU C 110 12.719 -25.103 -8.370 1.00 0.00 N ATOM 2949 CA LEU C 110 13.149 -24.188 -7.304 1.00 0.00 C ATOM 2950 C LEU C 110 14.445 -23.468 -7.701 1.00 0.00 C ATOM 2951 O LEU C 110 14.502 -22.238 -7.675 1.00 0.00 O ATOM 2952 CB LEU C 110 13.349 -24.927 -5.958 1.00 0.00 C ATOM 2953 CG LEU C 110 12.503 -24.464 -4.752 1.00 0.00 C ATOM 2954 CD1 LEU C 110 12.124 -22.983 -4.716 1.00 0.00 C ATOM 2955 CD2 LEU C 110 11.223 -25.293 -4.653 1.00 0.00 C ATOM 0 H LEU C 110 12.588 -26.068 -8.066 1.00 0.00 H new ATOM 0 HA LEU C 110 12.356 -23.453 -7.170 1.00 0.00 H new ATOM 0 HB2 LEU C 110 13.146 -25.985 -6.123 1.00 0.00 H new ATOM 0 HB3 LEU C 110 14.400 -24.843 -5.682 1.00 0.00 H new ATOM 0 HG LEU C 110 13.164 -24.619 -3.900 1.00 0.00 H new ATOM 0 HD11 LEU C 110 11.532 -22.781 -3.824 1.00 0.00 H new ATOM 0 HD12 LEU C 110 13.029 -22.376 -4.696 1.00 0.00 H new ATOM 0 HD13 LEU C 110 11.540 -22.735 -5.603 1.00 0.00 H new ATOM 0 HD21 LEU C 110 10.636 -24.956 -3.798 1.00 0.00 H new ATOM 0 HD22 LEU C 110 10.639 -25.171 -5.565 1.00 0.00 H new ATOM 0 HD23 LEU C 110 11.480 -26.345 -4.525 1.00 0.00 H new ATOM 2967 N ARG C 111 15.460 -24.225 -8.143 1.00 0.00 N ATOM 2968 CA ARG C 111 16.744 -23.681 -8.607 1.00 0.00 C ATOM 2969 C ARG C 111 16.533 -22.626 -9.703 1.00 0.00 C ATOM 2970 O ARG C 111 17.013 -21.504 -9.555 1.00 0.00 O ATOM 2971 CB ARG C 111 17.631 -24.860 -9.059 1.00 0.00 C ATOM 2972 CG ARG C 111 19.127 -24.554 -9.236 1.00 0.00 C ATOM 2973 CD ARG C 111 19.409 -23.398 -10.202 1.00 0.00 C ATOM 2974 NE ARG C 111 20.810 -23.392 -10.666 1.00 0.00 N ATOM 2975 CZ ARG C 111 21.346 -24.119 -11.632 1.00 0.00 C ATOM 2976 NH1 ARG C 111 20.692 -25.033 -12.291 1.00 0.00 N1+ ATOM 2977 NH2 ARG C 111 22.594 -23.934 -11.960 1.00 0.00 N ATOM 0 H ARG C 111 15.412 -25.243 -8.189 1.00 0.00 H new ATOM 0 HA ARG C 111 17.254 -23.158 -7.799 1.00 0.00 H new ATOM 0 HB2 ARG C 111 17.530 -25.664 -8.330 1.00 0.00 H new ATOM 0 HB3 ARG C 111 17.244 -25.237 -10.006 1.00 0.00 H new ATOM 0 HG2 ARG C 111 19.558 -24.316 -8.263 1.00 0.00 H new ATOM 0 HG3 ARG C 111 19.632 -25.450 -9.598 1.00 0.00 H new ATOM 0 HD2 ARG C 111 18.743 -23.474 -11.062 1.00 0.00 H new ATOM 0 HD3 ARG C 111 19.187 -22.452 -9.709 1.00 0.00 H new ATOM 0 HE ARG C 111 21.440 -22.751 -10.184 1.00 0.00 H new ATOM 0 HH11 ARG C 111 19.713 -25.218 -12.071 1.00 0.00 H new ATOM 0 HH12 ARG C 111 21.159 -25.563 -13.027 1.00 0.00 H new ATOM 0 HH21 ARG C 111 23.151 -23.232 -11.473 1.00 0.00 H new ATOM 0 HH22 ARG C 111 23.014 -24.491 -12.704 1.00 0.00 H new ATOM 2991 N LYS C 112 15.786 -22.943 -10.766 1.00 0.00 N ATOM 2992 CA LYS C 112 15.471 -22.009 -11.866 1.00 0.00 C ATOM 2993 C LYS C 112 14.800 -20.734 -11.364 1.00 0.00 C ATOM 2994 O LYS C 112 15.221 -19.643 -11.729 1.00 0.00 O ATOM 2995 CB LYS C 112 14.552 -22.681 -12.895 1.00 0.00 C ATOM 2996 CG LYS C 112 15.336 -23.475 -13.945 1.00 0.00 C ATOM 2997 CD LYS C 112 14.374 -24.040 -14.997 1.00 0.00 C ATOM 2998 CE LYS C 112 13.833 -25.424 -14.609 1.00 0.00 C ATOM 2999 NZ LYS C 112 12.905 -25.954 -15.649 1.00 0.00 N1+ ATOM 0 H LYS C 112 15.375 -23.868 -10.894 1.00 0.00 H new ATOM 0 HA LYS C 112 16.420 -21.739 -12.330 1.00 0.00 H new ATOM 0 HB2 LYS C 112 13.861 -23.348 -12.380 1.00 0.00 H new ATOM 0 HB3 LYS C 112 13.950 -21.920 -13.393 1.00 0.00 H new ATOM 0 HG2 LYS C 112 16.075 -22.832 -14.423 1.00 0.00 H new ATOM 0 HG3 LYS C 112 15.883 -24.287 -13.466 1.00 0.00 H new ATOM 0 HD2 LYS C 112 13.540 -23.351 -15.131 1.00 0.00 H new ATOM 0 HD3 LYS C 112 14.888 -24.109 -15.956 1.00 0.00 H new ATOM 0 HE2 LYS C 112 14.664 -26.116 -14.473 1.00 0.00 H new ATOM 0 HE3 LYS C 112 13.313 -25.359 -13.653 1.00 0.00 H new ATOM 0 HZ1 LYS C 112 12.556 -26.890 -15.359 1.00 0.00 H new ATOM 0 HZ2 LYS C 112 12.101 -25.304 -15.760 1.00 0.00 H new ATOM 0 HZ3 LYS C 112 13.410 -26.038 -16.554 1.00 0.00 H new ATOM 3013 N ALA C 113 13.803 -20.870 -10.495 1.00 0.00 N ATOM 3014 CA ALA C 113 13.106 -19.726 -9.894 1.00 0.00 C ATOM 3015 C ALA C 113 14.078 -18.801 -9.132 1.00 0.00 C ATOM 3016 O ALA C 113 14.072 -17.591 -9.359 1.00 0.00 O ATOM 3017 CB ALA C 113 11.950 -20.210 -9.006 1.00 0.00 C ATOM 0 H ALA C 113 13.451 -21.776 -10.184 1.00 0.00 H new ATOM 0 HA ALA C 113 12.679 -19.126 -10.698 1.00 0.00 H new ATOM 0 HB1 ALA C 113 11.443 -19.350 -8.568 1.00 0.00 H new ATOM 0 HB2 ALA C 113 11.243 -20.780 -9.608 1.00 0.00 H new ATOM 0 HB3 ALA C 113 12.343 -20.844 -8.211 1.00 0.00 H new ATOM 3023 N ILE C 114 14.979 -19.358 -8.309 1.00 0.00 N ATOM 3024 CA ILE C 114 16.046 -18.593 -7.637 1.00 0.00 C ATOM 3025 C ILE C 114 16.955 -17.910 -8.671 1.00 0.00 C ATOM 3026 O ILE C 114 17.139 -16.696 -8.610 1.00 0.00 O ATOM 3027 CB ILE C 114 16.839 -19.484 -6.639 1.00 0.00 C ATOM 3028 CG1 ILE C 114 16.134 -19.574 -5.262 1.00 0.00 C ATOM 3029 CG2 ILE C 114 18.254 -18.932 -6.375 1.00 0.00 C ATOM 3030 CD1 ILE C 114 14.886 -20.460 -5.210 1.00 0.00 C ATOM 0 H ILE C 114 14.990 -20.354 -8.089 1.00 0.00 H new ATOM 0 HA ILE C 114 15.585 -17.804 -7.043 1.00 0.00 H new ATOM 0 HB ILE C 114 16.892 -20.466 -7.109 1.00 0.00 H new ATOM 0 HG12 ILE C 114 16.852 -19.946 -4.531 1.00 0.00 H new ATOM 0 HG13 ILE C 114 15.855 -18.567 -4.951 1.00 0.00 H new ATOM 0 HG21 ILE C 114 18.774 -19.584 -5.673 1.00 0.00 H new ATOM 0 HG22 ILE C 114 18.809 -18.892 -7.312 1.00 0.00 H new ATOM 0 HG23 ILE C 114 18.181 -17.930 -5.953 1.00 0.00 H new ATOM 0 HD11 ILE C 114 14.474 -20.450 -4.201 1.00 0.00 H new ATOM 0 HD12 ILE C 114 14.141 -20.081 -5.909 1.00 0.00 H new ATOM 0 HD13 ILE C 114 15.153 -21.481 -5.483 1.00 0.00 H new ATOM 3042 N ALA C 115 17.479 -18.663 -9.643 1.00 0.00 N ATOM 3043 CA ALA C 115 18.405 -18.167 -10.665 1.00 0.00 C ATOM 3044 C ALA C 115 17.803 -17.016 -11.486 1.00 0.00 C ATOM 3045 O ALA C 115 18.458 -16.013 -11.745 1.00 0.00 O ATOM 3046 CB ALA C 115 18.794 -19.349 -11.560 1.00 0.00 C ATOM 0 H ALA C 115 17.266 -19.656 -9.743 1.00 0.00 H new ATOM 0 HA ALA C 115 19.290 -17.753 -10.181 1.00 0.00 H new ATOM 0 HB1 ALA C 115 19.484 -19.009 -12.332 1.00 0.00 H new ATOM 0 HB2 ALA C 115 19.275 -20.119 -10.957 1.00 0.00 H new ATOM 0 HB3 ALA C 115 17.900 -19.760 -12.028 1.00 0.00 H new ATOM 3052 N GLU C 116 16.530 -17.118 -11.835 1.00 0.00 N ATOM 3053 CA GLU C 116 15.784 -16.128 -12.622 1.00 0.00 C ATOM 3054 C GLU C 116 15.363 -14.918 -11.777 1.00 0.00 C ATOM 3055 O GLU C 116 15.333 -13.797 -12.282 1.00 0.00 O ATOM 3056 CB GLU C 116 14.595 -16.809 -13.312 1.00 0.00 C ATOM 3057 CG GLU C 116 15.061 -17.711 -14.469 1.00 0.00 C ATOM 3058 CD GLU C 116 15.436 -16.886 -15.716 1.00 0.00 C ATOM 3059 OE1 GLU C 116 14.538 -16.591 -16.544 1.00 0.00 O1- ATOM 3060 OE2 GLU C 116 16.627 -16.527 -15.880 1.00 0.00 O ATOM 0 H GLU C 116 15.959 -17.921 -11.571 1.00 0.00 H new ATOM 0 HA GLU C 116 16.441 -15.728 -13.395 1.00 0.00 H new ATOM 0 HB2 GLU C 116 14.042 -17.403 -12.585 1.00 0.00 H new ATOM 0 HB3 GLU C 116 13.910 -16.051 -13.692 1.00 0.00 H new ATOM 0 HG2 GLU C 116 15.921 -18.299 -14.149 1.00 0.00 H new ATOM 0 HG3 GLU C 116 14.269 -18.416 -14.723 1.00 0.00 H new ATOM 3067 N SER C 117 15.155 -15.111 -10.471 1.00 0.00 N ATOM 3068 CA SER C 117 14.963 -14.019 -9.505 1.00 0.00 C ATOM 3069 C SER C 117 16.235 -13.169 -9.337 1.00 0.00 C ATOM 3070 O SER C 117 16.152 -11.999 -8.967 1.00 0.00 O ATOM 3071 CB SER C 117 14.567 -14.610 -8.152 1.00 0.00 C ATOM 3072 OG SER C 117 13.970 -13.649 -7.303 1.00 0.00 O ATOM 0 H SER C 117 15.114 -16.038 -10.048 1.00 0.00 H new ATOM 0 HA SER C 117 14.176 -13.368 -9.886 1.00 0.00 H new ATOM 0 HB2 SER C 117 13.873 -15.436 -8.307 1.00 0.00 H new ATOM 0 HB3 SER C 117 15.450 -15.023 -7.665 1.00 0.00 H new ATOM 0 HG SER C 117 13.040 -13.504 -7.576 1.00 0.00 H new ATOM 3078 N LEU C 118 17.413 -13.736 -9.641 1.00 0.00 N ATOM 3079 CA LEU C 118 18.702 -13.035 -9.645 1.00 0.00 C ATOM 3080 C LEU C 118 18.973 -12.390 -11.015 1.00 0.00 C ATOM 3081 O LEU C 118 19.343 -11.219 -11.101 1.00 0.00 O ATOM 3082 CB LEU C 118 19.827 -14.030 -9.298 1.00 0.00 C ATOM 3083 CG LEU C 118 19.730 -14.596 -7.874 1.00 0.00 C ATOM 3084 CD1 LEU C 118 20.301 -16.012 -7.821 1.00 0.00 C ATOM 3085 CD2 LEU C 118 20.473 -13.709 -6.877 1.00 0.00 C ATOM 0 H LEU C 118 17.495 -14.720 -9.897 1.00 0.00 H new ATOM 0 HA LEU C 118 18.671 -12.242 -8.898 1.00 0.00 H new ATOM 0 HB2 LEU C 118 19.803 -14.855 -10.010 1.00 0.00 H new ATOM 0 HB3 LEU C 118 20.790 -13.533 -9.418 1.00 0.00 H new ATOM 0 HG LEU C 118 18.675 -14.622 -7.600 1.00 0.00 H new ATOM 0 HD11 LEU C 118 20.224 -16.397 -6.804 1.00 0.00 H new ATOM 0 HD12 LEU C 118 19.739 -16.656 -8.497 1.00 0.00 H new ATOM 0 HD13 LEU C 118 21.348 -15.994 -8.124 1.00 0.00 H new ATOM 0 HD21 LEU C 118 20.387 -14.134 -5.877 1.00 0.00 H new ATOM 0 HD22 LEU C 118 21.525 -13.649 -7.157 1.00 0.00 H new ATOM 0 HD23 LEU C 118 20.038 -12.710 -6.885 1.00 0.00 H new ATOM 3097 N ASN C 119 18.755 -13.162 -12.088 1.00 0.00 N ATOM 3098 CA ASN C 119 19.011 -12.770 -13.477 1.00 0.00 C ATOM 3099 C ASN C 119 18.061 -11.667 -13.986 1.00 0.00 C ATOM 3100 O ASN C 119 18.456 -10.850 -14.820 1.00 0.00 O ATOM 3101 CB ASN C 119 18.903 -14.027 -14.368 1.00 0.00 C ATOM 3102 CG ASN C 119 20.214 -14.777 -14.521 1.00 0.00 C ATOM 3103 OD1 ASN C 119 21.036 -14.475 -15.376 1.00 0.00 O ATOM 3104 ND2 ASN C 119 20.453 -15.783 -13.709 1.00 0.00 N ATOM 0 H ASN C 119 18.383 -14.108 -12.008 1.00 0.00 H new ATOM 0 HA ASN C 119 20.013 -12.344 -13.524 1.00 0.00 H new ATOM 0 HB2 ASN C 119 18.157 -14.699 -13.945 1.00 0.00 H new ATOM 0 HB3 ASN C 119 18.545 -13.733 -15.355 1.00 0.00 H new ATOM 0 HD21 ASN C 119 21.322 -16.310 -13.792 1.00 0.00 H new ATOM 0 HD22 ASN C 119 19.769 -16.036 -12.996 1.00 0.00 H new