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= 0.176 K(o=1.5,f=-0.45) USER MOD Set 1.2: C 92 SER OG : rot 75:sc= 1.32 USER MOD Set 2.1: B 55 THR OG1 : rot -57:sc= 1.26 USER MOD Set 2.2: B 57 SER OG : rot 180:sc= 0 USER MOD Set 3.1: B 7 THR OG1 : rot 143:sc= 1.39 USER MOD Set 3.2: B 9 THR OG1 : rot 180:sc= 1.03 USER MOD Set 4.1: B 6 LYS NZ :NH3+ 166:sc= 0.73 (180deg=0) USER MOD Set 4.2: B 12 THR OG1 : rot 150:sc= 0.628 USER MOD Set 5.1: A 68 HIS : no HD1:sc= 0.562 K(o=1.7,f=-0.68) USER MOD Set 5.2: C 117 SER OG : rot 71:sc= 1.11 USER MOD Set 6.1: A 55 THR OG1 : rot -60:sc= 1.24 USER MOD Set 6.2: A 57 SER OG : rot 180:sc= 0 USER MOD Set 7.1: A 6 LYS NZ :NH3+ 169:sc= 0.782 (180deg=0) USER MOD Set 7.2: A 12 THR OG1 : rot 150:sc= 0.695 USER MOD Set 8.1: A 7 THR OG1 : rot 133:sc= 1.37 USER MOD Set 8.2: A 9 THR OG1 : rot 180:sc= 1.05 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 175:sc= 1.15 (180deg=1.12) USER MOD Single : A 2 GLN : amide:sc=0.000144 X(o=0.00014,f=-0.46) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 THR OG1 : rot -81:sc= 0.269 USER MOD Single : A 20 SER OG : rot 180:sc= 0.00628 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0.273 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+ -165:sc= 0.562 (180deg=0.485) USER MOD Single : A 29 LYS NZ :NH3+ 171:sc= 1.13 (180deg=1.05) USER MOD Single : A 31 GLN : amide:sc= -0.405 X(o=-0.4,f=-0.86) USER MOD Single : A 33 LYS NZ :NH3+ 175:sc= 0.971 (180deg=0.953) USER MOD Single : A 40 GLN : amide:sc=-0.00183 X(o=-0.0018,f=-0.5) USER MOD Single : A 41 GLN : amide:sc= 1.11 K(o=1.1,f=-3.7!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= 0.717 K(o=0.72,f=-6.3!) USER MOD Single : A 59 TYR OH : rot 50:sc= 0.333 USER MOD Single : A 60 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 62 GLN : amide:sc= 0.577 K(o=0.58,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= 1.34 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= 1.16 (180deg=1.14) USER MOD Single : B 2 GLN : amide:sc=0.000486 X(o=0.00049,f=-0.42) USER MOD Single : B 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 14 THR OG1 : rot -76:sc= 0.247 USER MOD Single : B 20 SER OG : rot 180:sc= 0.00714 USER MOD Single : B 22 THR OG1 : rot 180:sc= 0.282 USER MOD Single : B 25 ASN : amide:sc= 1.11 K(o=1.1,f=-0.4) USER MOD Single : B 27 LYS NZ :NH3+ -156:sc= 0.132 (180deg=0.0761) USER MOD Single : B 29 LYS NZ :NH3+ 170:sc= 1.13 (180deg=1.04) USER MOD Single : B 31 GLN : amide:sc= -0.231 X(o=-0.23,f=-0.71) USER MOD Single : B 33 LYS NZ :NH3+ 175:sc= 0.91 (180deg=0.892) USER MOD Single : B 40 GLN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : B 41 GLN : amide:sc= 1.03 K(o=1,f=-3.6!) 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=-0.0069) USER MOD Single : B 59 TYR OH : rot 50:sc= 0.31 USER MOD Single : B 60 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 62 GLN : amide:sc= 0.833 K(o=0.83,f=0) USER MOD Single : B 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 65 SER OG : rot -140:sc= 0.332 USER MOD Single : B 66 THR OG1 : rot 121:sc= 1.22 USER MOD Single : C 80 THR OG1 : rot 174:sc= 1.21 USER MOD Single : C 84 GLN : amide:sc= -0.196 X(o=-0.2,f=-0.14) USER MOD Single : C 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 91 MET CE :methyl 179:sc= -0.506 (180deg=-0.51) USER MOD Single : C 94 GLN : amide:sc= -0.337 X(o=-0.34,f=0) USER MOD Single : C 100 ASN : amide:sc= 1.25 K(o=1.2,f=-9.5e-05) USER MOD Single : C 101 SER OG : rot 76:sc= 0.0523 USER MOD Single : C 102 GLN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : C 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 119 ASN : amide:sc= 1.14 K(o=1.1,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 0.976 0.066 0.878 1.00 0.00 N ATOM 2 CA MET A 1 1.651 -0.069 -0.451 1.00 0.00 C ATOM 3 C MET A 1 1.093 -1.253 -1.261 1.00 0.00 C ATOM 4 O MET A 1 0.333 -2.062 -0.736 1.00 0.00 O ATOM 5 CB MET A 1 3.200 -0.117 -0.328 1.00 0.00 C ATOM 6 CG MET A 1 3.799 -1.387 0.302 1.00 0.00 C ATOM 7 SD MET A 1 5.614 -1.438 0.286 1.00 0.00 S ATOM 8 CE MET A 1 5.893 -3.096 0.968 1.00 0.00 C ATOM 0 H1 MET A 1 1.437 0.820 1.426 1.00 0.00 H new ATOM 0 H2 MET A 1 -0.026 0.304 0.736 1.00 0.00 H new ATOM 0 H3 MET A 1 1.048 -0.833 1.397 1.00 0.00 H new ATOM 0 HA MET A 1 1.418 0.836 -1.013 1.00 0.00 H new ATOM 0 HB2 MET A 1 3.625 0.003 -1.324 1.00 0.00 H new ATOM 0 HB3 MET A 1 3.522 0.741 0.262 1.00 0.00 H new ATOM 0 HG2 MET A 1 3.453 -1.466 1.333 1.00 0.00 H new ATOM 0 HG3 MET A 1 3.417 -2.258 -0.230 1.00 0.00 H new ATOM 0 HE1 MET A 1 6.964 -3.290 1.026 1.00 0.00 H new ATOM 0 HE2 MET A 1 5.458 -3.157 1.966 1.00 0.00 H new ATOM 0 HE3 MET A 1 5.425 -3.839 0.322 1.00 0.00 H new ATOM 20 N GLN A 2 1.469 -1.373 -2.540 1.00 0.00 N ATOM 21 CA GLN A 2 1.130 -2.514 -3.409 1.00 0.00 C ATOM 22 C GLN A 2 2.397 -3.290 -3.799 1.00 0.00 C ATOM 23 O GLN A 2 3.424 -2.672 -4.090 1.00 0.00 O ATOM 24 CB GLN A 2 0.412 -2.021 -4.682 1.00 0.00 C ATOM 25 CG GLN A 2 -0.868 -1.195 -4.445 1.00 0.00 C ATOM 26 CD GLN A 2 -2.032 -1.961 -3.811 1.00 0.00 C ATOM 27 OE1 GLN A 2 -2.086 -3.182 -3.772 1.00 0.00 O ATOM 28 NE2 GLN A 2 -3.024 -1.259 -3.304 1.00 0.00 N ATOM 0 H GLN A 2 2.030 -0.665 -3.013 1.00 0.00 H new ATOM 0 HA GLN A 2 0.465 -3.178 -2.857 1.00 0.00 H new ATOM 0 HB2 GLN A 2 1.111 -1.418 -5.261 1.00 0.00 H new ATOM 0 HB3 GLN A 2 0.157 -2.887 -5.292 1.00 0.00 H new ATOM 0 HG2 GLN A 2 -0.621 -0.348 -3.805 1.00 0.00 H new ATOM 0 HG3 GLN A 2 -1.200 -0.787 -5.400 1.00 0.00 H new ATOM 0 HE21 GLN A 2 -2.993 -0.240 -3.329 1.00 0.00 H new ATOM 0 HE22 GLN A 2 -3.824 -1.734 -2.886 1.00 0.00 H new ATOM 37 N ILE A 3 2.323 -4.622 -3.853 1.00 0.00 N ATOM 38 CA ILE A 3 3.368 -5.503 -4.412 1.00 0.00 C ATOM 39 C ILE A 3 2.759 -6.488 -5.419 1.00 0.00 C ATOM 40 O ILE A 3 1.556 -6.761 -5.393 1.00 0.00 O ATOM 41 CB ILE A 3 4.184 -6.244 -3.322 1.00 0.00 C ATOM 42 CG1 ILE A 3 3.325 -7.238 -2.505 1.00 0.00 C ATOM 43 CG2 ILE A 3 4.922 -5.230 -2.428 1.00 0.00 C ATOM 44 CD1 ILE A 3 4.131 -8.146 -1.564 1.00 0.00 C ATOM 0 H ILE A 3 1.516 -5.138 -3.502 1.00 0.00 H new ATOM 0 HA ILE A 3 4.077 -4.861 -4.934 1.00 0.00 H new ATOM 0 HB ILE A 3 4.932 -6.857 -3.825 1.00 0.00 H new ATOM 0 HG12 ILE A 3 2.601 -6.675 -1.916 1.00 0.00 H new ATOM 0 HG13 ILE A 3 2.758 -7.862 -3.195 1.00 0.00 H new ATOM 0 HG21 ILE A 3 5.491 -5.763 -1.667 1.00 0.00 H new ATOM 0 HG22 ILE A 3 5.601 -4.634 -3.038 1.00 0.00 H new ATOM 0 HG23 ILE A 3 4.197 -4.574 -1.946 1.00 0.00 H new ATOM 0 HD11 ILE A 3 3.452 -8.811 -1.030 1.00 0.00 H new ATOM 0 HD12 ILE A 3 4.836 -8.739 -2.146 1.00 0.00 H new ATOM 0 HD13 ILE A 3 4.677 -7.533 -0.847 1.00 0.00 H new ATOM 56 N PHE A 4 3.599 -7.047 -6.286 1.00 0.00 N ATOM 57 CA PHE A 4 3.229 -8.053 -7.280 1.00 0.00 C ATOM 58 C PHE A 4 3.836 -9.420 -6.943 1.00 0.00 C ATOM 59 O PHE A 4 4.935 -9.506 -6.397 1.00 0.00 O ATOM 60 CB PHE A 4 3.660 -7.581 -8.676 1.00 0.00 C ATOM 61 CG PHE A 4 3.110 -6.224 -9.074 1.00 0.00 C ATOM 62 CD1 PHE A 4 1.726 -6.054 -9.267 1.00 0.00 C ATOM 63 CD2 PHE A 4 3.978 -5.126 -9.240 1.00 0.00 C ATOM 64 CE1 PHE A 4 1.211 -4.792 -9.619 1.00 0.00 C ATOM 65 CE2 PHE A 4 3.463 -3.868 -9.600 1.00 0.00 C ATOM 66 CZ PHE A 4 2.079 -3.699 -9.784 1.00 0.00 C ATOM 0 H PHE A 4 4.589 -6.805 -6.318 1.00 0.00 H new ATOM 0 HA PHE A 4 2.146 -8.174 -7.269 1.00 0.00 H new ATOM 0 HB2 PHE A 4 4.749 -7.544 -8.714 1.00 0.00 H new ATOM 0 HB3 PHE A 4 3.340 -8.319 -9.411 1.00 0.00 H new ATOM 0 HD1 PHE A 4 1.058 -6.894 -9.145 1.00 0.00 H new ATOM 0 HD2 PHE A 4 5.040 -5.251 -9.090 1.00 0.00 H new ATOM 0 HE1 PHE A 4 0.148 -4.664 -9.762 1.00 0.00 H new ATOM 0 HE2 PHE A 4 4.131 -3.030 -9.735 1.00 0.00 H new ATOM 0 HZ PHE A 4 1.684 -2.730 -10.052 1.00 0.00 H new ATOM 76 N VAL A 5 3.144 -10.499 -7.308 1.00 0.00 N ATOM 77 CA VAL A 5 3.627 -11.882 -7.164 1.00 0.00 C ATOM 78 C VAL A 5 3.379 -12.640 -8.469 1.00 0.00 C ATOM 79 O VAL A 5 2.238 -12.718 -8.920 1.00 0.00 O ATOM 80 CB VAL A 5 2.955 -12.596 -5.969 1.00 0.00 C ATOM 81 CG1 VAL A 5 3.602 -13.963 -5.725 1.00 0.00 C ATOM 82 CG2 VAL A 5 3.053 -11.793 -4.666 1.00 0.00 C ATOM 0 H VAL A 5 2.213 -10.441 -7.721 1.00 0.00 H new ATOM 0 HA VAL A 5 4.697 -11.861 -6.958 1.00 0.00 H new ATOM 0 HB VAL A 5 1.904 -12.702 -6.238 1.00 0.00 H new ATOM 0 HG11 VAL A 5 3.115 -14.450 -4.880 1.00 0.00 H new ATOM 0 HG12 VAL A 5 3.490 -14.583 -6.615 1.00 0.00 H new ATOM 0 HG13 VAL A 5 4.662 -13.830 -5.506 1.00 0.00 H new ATOM 0 HG21 VAL A 5 2.564 -12.343 -3.862 1.00 0.00 H new ATOM 0 HG22 VAL A 5 4.102 -11.636 -4.413 1.00 0.00 H new ATOM 0 HG23 VAL A 5 2.563 -10.828 -4.796 1.00 0.00 H new ATOM 92 N LYS A 6 4.429 -13.197 -9.082 1.00 0.00 N ATOM 93 CA LYS A 6 4.339 -14.016 -10.305 1.00 0.00 C ATOM 94 C LYS A 6 4.328 -15.512 -9.988 1.00 0.00 C ATOM 95 O LYS A 6 5.149 -15.983 -9.201 1.00 0.00 O ATOM 96 CB LYS A 6 5.466 -13.644 -11.288 1.00 0.00 C ATOM 97 CG LYS A 6 5.020 -12.520 -12.234 1.00 0.00 C ATOM 98 CD LYS A 6 6.157 -12.110 -13.186 1.00 0.00 C ATOM 99 CE LYS A 6 5.683 -11.296 -14.403 1.00 0.00 C ATOM 100 NZ LYS A 6 4.977 -10.034 -14.038 1.00 0.00 N1+ ATOM 0 H LYS A 6 5.384 -13.092 -8.739 1.00 0.00 H new ATOM 0 HA LYS A 6 3.387 -13.796 -10.788 1.00 0.00 H new ATOM 0 HB2 LYS A 6 6.349 -13.328 -10.732 1.00 0.00 H new ATOM 0 HB3 LYS A 6 5.752 -14.521 -11.868 1.00 0.00 H new ATOM 0 HG2 LYS A 6 4.158 -12.850 -12.814 1.00 0.00 H new ATOM 0 HG3 LYS A 6 4.701 -11.656 -11.651 1.00 0.00 H new ATOM 0 HD2 LYS A 6 6.890 -11.524 -12.631 1.00 0.00 H new ATOM 0 HD3 LYS A 6 6.666 -13.008 -13.537 1.00 0.00 H new ATOM 0 HE2 LYS A 6 6.544 -11.054 -15.026 1.00 0.00 H new ATOM 0 HE3 LYS A 6 5.017 -11.914 -15.006 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 4.851 -9.448 -14.888 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 4.046 -10.261 -13.633 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 5.541 -9.511 -13.338 1.00 0.00 H new ATOM 114 N THR A 7 3.413 -16.252 -10.610 1.00 0.00 N ATOM 115 CA THR A 7 3.261 -17.714 -10.465 1.00 0.00 C ATOM 116 C THR A 7 4.165 -18.493 -11.435 1.00 0.00 C ATOM 117 O THR A 7 4.697 -17.935 -12.398 1.00 0.00 O ATOM 118 CB THR A 7 1.798 -18.141 -10.694 1.00 0.00 C ATOM 119 OG1 THR A 7 1.472 -17.939 -12.048 1.00 0.00 O ATOM 120 CG2 THR A 7 0.784 -17.372 -9.848 1.00 0.00 C ATOM 0 H THR A 7 2.731 -15.846 -11.251 1.00 0.00 H new ATOM 0 HA THR A 7 3.562 -17.954 -9.445 1.00 0.00 H new ATOM 0 HB THR A 7 1.737 -19.189 -10.399 1.00 0.00 H new ATOM 0 HG1 THR A 7 1.025 -18.737 -12.399 1.00 0.00 H new ATOM 0 HG21 THR A 7 -0.221 -17.732 -10.068 1.00 0.00 H new ATOM 0 HG22 THR A 7 1.001 -17.526 -8.791 1.00 0.00 H new ATOM 0 HG23 THR A 7 0.848 -16.309 -10.081 1.00 0.00 H new ATOM 128 N LEU A 8 4.268 -19.817 -11.248 1.00 0.00 N ATOM 129 CA LEU A 8 4.919 -20.719 -12.219 1.00 0.00 C ATOM 130 C LEU A 8 4.156 -20.812 -13.558 1.00 0.00 C ATOM 131 O LEU A 8 4.757 -21.089 -14.596 1.00 0.00 O ATOM 132 CB LEU A 8 5.085 -22.121 -11.598 1.00 0.00 C ATOM 133 CG LEU A 8 5.913 -22.183 -10.300 1.00 0.00 C ATOM 134 CD1 LEU A 8 6.105 -23.644 -9.891 1.00 0.00 C ATOM 135 CD2 LEU A 8 7.288 -21.534 -10.451 1.00 0.00 C ATOM 0 H LEU A 8 3.905 -20.295 -10.423 1.00 0.00 H new ATOM 0 HA LEU A 8 5.897 -20.295 -12.447 1.00 0.00 H new ATOM 0 HB2 LEU A 8 4.094 -22.528 -11.395 1.00 0.00 H new ATOM 0 HB3 LEU A 8 5.552 -22.772 -12.337 1.00 0.00 H new ATOM 0 HG LEU A 8 5.362 -21.630 -9.540 1.00 0.00 H new ATOM 0 HD11 LEU A 8 6.691 -23.691 -8.973 1.00 0.00 H new ATOM 0 HD12 LEU A 8 5.132 -24.106 -9.725 1.00 0.00 H new ATOM 0 HD13 LEU A 8 6.630 -24.178 -10.683 1.00 0.00 H new ATOM 0 HD21 LEU A 8 7.830 -21.605 -9.508 1.00 0.00 H new ATOM 0 HD22 LEU A 8 7.849 -22.048 -11.231 1.00 0.00 H new ATOM 0 HD23 LEU A 8 7.167 -20.485 -10.722 1.00 0.00 H new ATOM 147 N THR A 9 2.846 -20.531 -13.548 1.00 0.00 N ATOM 148 CA THR A 9 1.981 -20.436 -14.742 1.00 0.00 C ATOM 149 C THR A 9 2.074 -19.082 -15.470 1.00 0.00 C ATOM 150 O THR A 9 1.434 -18.896 -16.507 1.00 0.00 O ATOM 151 CB THR A 9 0.518 -20.749 -14.380 1.00 0.00 C ATOM 152 OG1 THR A 9 0.085 -19.943 -13.303 1.00 0.00 O ATOM 153 CG2 THR A 9 0.342 -22.203 -13.943 1.00 0.00 C ATOM 0 H THR A 9 2.338 -20.357 -12.681 1.00 0.00 H new ATOM 0 HA THR A 9 2.354 -21.185 -15.441 1.00 0.00 H new ATOM 0 HB THR A 9 -0.067 -20.553 -15.279 1.00 0.00 H new ATOM 0 HG1 THR A 9 -0.847 -20.156 -13.089 1.00 0.00 H new ATOM 0 HG21 THR A 9 -0.704 -22.385 -13.696 1.00 0.00 H new ATOM 0 HG22 THR A 9 0.644 -22.866 -14.754 1.00 0.00 H new ATOM 0 HG23 THR A 9 0.961 -22.397 -13.067 1.00 0.00 H new ATOM 161 N GLY A 10 2.874 -18.134 -14.962 1.00 0.00 N ATOM 162 CA GLY A 10 3.095 -16.813 -15.568 1.00 0.00 C ATOM 163 C GLY A 10 2.001 -15.771 -15.281 1.00 0.00 C ATOM 164 O GLY A 10 2.006 -14.697 -15.888 1.00 0.00 O ATOM 0 H GLY A 10 3.398 -18.268 -14.097 1.00 0.00 H new ATOM 0 HA2 GLY A 10 4.049 -16.423 -15.213 1.00 0.00 H new ATOM 0 HA3 GLY A 10 3.183 -16.936 -16.647 1.00 0.00 H new ATOM 168 N LYS A 11 1.074 -16.063 -14.357 1.00 0.00 N ATOM 169 CA LYS A 11 0.052 -15.124 -13.865 1.00 0.00 C ATOM 170 C LYS A 11 0.689 -14.129 -12.890 1.00 0.00 C ATOM 171 O LYS A 11 1.536 -14.516 -12.090 1.00 0.00 O ATOM 172 CB LYS A 11 -1.092 -15.932 -13.217 1.00 0.00 C ATOM 173 CG LYS A 11 -2.285 -15.073 -12.768 1.00 0.00 C ATOM 174 CD LYS A 11 -3.367 -15.952 -12.121 1.00 0.00 C ATOM 175 CE LYS A 11 -4.559 -15.138 -11.591 1.00 0.00 C ATOM 176 NZ LYS A 11 -5.407 -14.584 -12.685 1.00 0.00 N1+ ATOM 0 H LYS A 11 1.012 -16.982 -13.919 1.00 0.00 H new ATOM 0 HA LYS A 11 -0.367 -14.542 -14.686 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -1.443 -16.680 -13.928 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -0.700 -16.471 -12.354 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -1.950 -14.317 -12.058 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -2.702 -14.543 -13.624 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -3.725 -16.677 -12.852 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -2.926 -16.518 -11.300 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -5.170 -15.772 -10.948 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -4.189 -14.320 -10.973 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -6.195 -14.045 -12.274 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -4.834 -13.957 -13.285 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -5.784 -15.364 -13.261 1.00 0.00 H new ATOM 190 N THR A 12 0.257 -12.866 -12.923 1.00 0.00 N ATOM 191 CA THR A 12 0.654 -11.843 -11.934 1.00 0.00 C ATOM 192 C THR A 12 -0.514 -11.519 -11.000 1.00 0.00 C ATOM 193 O THR A 12 -1.587 -11.109 -11.445 1.00 0.00 O ATOM 194 CB THR A 12 1.198 -10.571 -12.604 1.00 0.00 C ATOM 195 OG1 THR A 12 2.262 -10.908 -13.466 1.00 0.00 O ATOM 196 CG2 THR A 12 1.780 -9.587 -11.589 1.00 0.00 C ATOM 0 H THR A 12 -0.381 -12.516 -13.637 1.00 0.00 H new ATOM 0 HA THR A 12 1.468 -12.259 -11.340 1.00 0.00 H new ATOM 0 HB THR A 12 0.358 -10.116 -13.129 1.00 0.00 H new ATOM 0 HG1 THR A 12 2.294 -10.271 -14.210 1.00 0.00 H new ATOM 0 HG21 THR A 12 2.152 -8.704 -12.110 1.00 0.00 H new ATOM 0 HG22 THR A 12 1.004 -9.292 -10.882 1.00 0.00 H new ATOM 0 HG23 THR A 12 2.600 -10.062 -11.050 1.00 0.00 H new ATOM 204 N ILE A 13 -0.287 -11.686 -9.698 1.00 0.00 N ATOM 205 CA ILE A 13 -1.201 -11.344 -8.600 1.00 0.00 C ATOM 206 C ILE A 13 -0.766 -9.987 -8.026 1.00 0.00 C ATOM 207 O ILE A 13 0.432 -9.752 -7.871 1.00 0.00 O ATOM 208 CB ILE A 13 -1.169 -12.455 -7.517 1.00 0.00 C ATOM 209 CG1 ILE A 13 -1.420 -13.872 -8.097 1.00 0.00 C ATOM 210 CG2 ILE A 13 -2.192 -12.157 -6.401 1.00 0.00 C ATOM 211 CD1 ILE A 13 -1.005 -15.000 -7.141 1.00 0.00 C ATOM 0 H ILE A 13 0.588 -12.086 -9.358 1.00 0.00 H new ATOM 0 HA ILE A 13 -2.228 -11.271 -8.959 1.00 0.00 H new ATOM 0 HB ILE A 13 -0.161 -12.450 -7.102 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -2.478 -13.978 -8.335 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -0.871 -13.977 -9.033 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -2.154 -12.948 -5.652 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -1.952 -11.202 -5.933 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -3.194 -12.110 -6.829 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -1.207 -15.965 -7.607 1.00 0.00 H new ATOM 0 HD12 ILE A 13 0.060 -14.918 -6.922 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -1.573 -14.919 -6.214 1.00 0.00 H new ATOM 223 N THR A 14 -1.710 -9.110 -7.670 1.00 0.00 N ATOM 224 CA THR A 14 -1.425 -7.851 -6.945 1.00 0.00 C ATOM 225 C THR A 14 -1.911 -7.962 -5.501 1.00 0.00 C ATOM 226 O THR A 14 -3.043 -8.391 -5.270 1.00 0.00 O ATOM 227 CB THR A 14 -2.060 -6.634 -7.642 1.00 0.00 C ATOM 228 OG1 THR A 14 -1.720 -6.617 -9.013 1.00 0.00 O ATOM 229 CG2 THR A 14 -1.576 -5.308 -7.052 1.00 0.00 C ATOM 0 H THR A 14 -2.700 -9.247 -7.874 1.00 0.00 H new ATOM 0 HA THR A 14 -0.346 -7.696 -6.948 1.00 0.00 H new ATOM 0 HB THR A 14 -3.136 -6.732 -7.495 1.00 0.00 H new ATOM 0 HG1 THR A 14 -0.823 -6.239 -9.123 1.00 0.00 H new ATOM 0 HG21 THR A 14 -2.053 -4.480 -7.577 1.00 0.00 H new ATOM 0 HG22 THR A 14 -1.836 -5.264 -5.994 1.00 0.00 H new ATOM 0 HG23 THR A 14 -0.494 -5.234 -7.163 1.00 0.00 H new ATOM 237 N LEU A 15 -1.074 -7.588 -4.530 1.00 0.00 N ATOM 238 CA LEU A 15 -1.364 -7.667 -3.092 1.00 0.00 C ATOM 239 C LEU A 15 -1.161 -6.304 -2.413 1.00 0.00 C ATOM 240 O LEU A 15 -0.113 -5.675 -2.575 1.00 0.00 O ATOM 241 CB LEU A 15 -0.461 -8.726 -2.424 1.00 0.00 C ATOM 242 CG LEU A 15 -0.512 -10.149 -3.008 1.00 0.00 C ATOM 243 CD1 LEU A 15 0.465 -11.035 -2.242 1.00 0.00 C ATOM 244 CD2 LEU A 15 -1.898 -10.785 -2.902 1.00 0.00 C ATOM 0 H LEU A 15 -0.147 -7.210 -4.726 1.00 0.00 H new ATOM 0 HA LEU A 15 -2.408 -7.958 -2.973 1.00 0.00 H new ATOM 0 HB2 LEU A 15 0.570 -8.375 -2.475 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -0.727 -8.782 -1.368 1.00 0.00 H new ATOM 0 HG LEU A 15 -0.253 -10.069 -4.064 1.00 0.00 H new ATOM 0 HD11 LEU A 15 0.436 -12.046 -2.649 1.00 0.00 H new ATOM 0 HD12 LEU A 15 1.474 -10.634 -2.340 1.00 0.00 H new ATOM 0 HD13 LEU A 15 0.185 -11.060 -1.189 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -1.872 -11.787 -3.330 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -2.191 -10.845 -1.854 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -2.620 -10.177 -3.446 1.00 0.00 H new ATOM 256 N GLU A 16 -2.132 -5.887 -1.598 1.00 0.00 N ATOM 257 CA GLU A 16 -2.026 -4.692 -0.752 1.00 0.00 C ATOM 258 C GLU A 16 -1.406 -5.065 0.601 1.00 0.00 C ATOM 259 O GLU A 16 -1.917 -5.938 1.310 1.00 0.00 O ATOM 260 CB GLU A 16 -3.407 -4.037 -0.606 1.00 0.00 C ATOM 261 CG GLU A 16 -3.328 -2.675 0.092 1.00 0.00 C ATOM 262 CD GLU A 16 -4.712 -2.002 0.121 1.00 0.00 C ATOM 263 OE1 GLU A 16 -5.154 -1.484 -0.934 1.00 0.00 O1- ATOM 264 OE2 GLU A 16 -5.362 -1.986 1.195 1.00 0.00 O ATOM 0 H GLU A 16 -3.024 -6.373 -1.504 1.00 0.00 H new ATOM 0 HA GLU A 16 -1.367 -3.959 -1.217 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -3.855 -3.913 -1.592 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -4.063 -4.697 -0.038 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -2.958 -2.802 1.109 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -2.616 -2.034 -0.428 1.00 0.00 H new ATOM 271 N VAL A 17 -0.287 -4.426 0.946 1.00 0.00 N ATOM 272 CA VAL A 17 0.577 -4.771 2.089 1.00 0.00 C ATOM 273 C VAL A 17 1.251 -3.527 2.668 1.00 0.00 C ATOM 274 O VAL A 17 1.368 -2.508 1.993 1.00 0.00 O ATOM 275 CB VAL A 17 1.685 -5.775 1.681 1.00 0.00 C ATOM 276 CG1 VAL A 17 1.134 -7.122 1.202 1.00 0.00 C ATOM 277 CG2 VAL A 17 2.605 -5.222 0.582 1.00 0.00 C ATOM 0 H VAL A 17 0.060 -3.623 0.421 1.00 0.00 H new ATOM 0 HA VAL A 17 -0.070 -5.226 2.839 1.00 0.00 H new ATOM 0 HB VAL A 17 2.255 -5.929 2.597 1.00 0.00 H new ATOM 0 HG11 VAL A 17 1.961 -7.778 0.932 1.00 0.00 H new ATOM 0 HG12 VAL A 17 0.552 -7.582 2.001 1.00 0.00 H new ATOM 0 HG13 VAL A 17 0.496 -6.966 0.332 1.00 0.00 H new ATOM 0 HG21 VAL A 17 3.363 -5.965 0.334 1.00 0.00 H new ATOM 0 HG22 VAL A 17 2.015 -4.995 -0.306 1.00 0.00 H new ATOM 0 HG23 VAL A 17 3.091 -4.313 0.937 1.00 0.00 H new ATOM 287 N GLU A 18 1.748 -3.614 3.895 1.00 0.00 N ATOM 288 CA GLU A 18 2.617 -2.607 4.521 1.00 0.00 C ATOM 289 C GLU A 18 4.032 -3.192 4.708 1.00 0.00 C ATOM 290 O GLU A 18 4.170 -4.411 4.826 1.00 0.00 O ATOM 291 CB GLU A 18 2.018 -2.144 5.861 1.00 0.00 C ATOM 292 CG GLU A 18 0.761 -1.276 5.701 1.00 0.00 C ATOM 293 CD GLU A 18 1.090 0.112 5.112 1.00 0.00 C ATOM 294 OE1 GLU A 18 1.455 1.029 5.888 1.00 0.00 O ATOM 295 OE2 GLU A 18 0.987 0.298 3.874 1.00 0.00 O1- ATOM 0 H GLU A 18 1.556 -4.408 4.506 1.00 0.00 H new ATOM 0 HA GLU A 18 2.689 -1.733 3.873 1.00 0.00 H new ATOM 0 HB2 GLU A 18 1.772 -3.019 6.462 1.00 0.00 H new ATOM 0 HB3 GLU A 18 2.771 -1.581 6.412 1.00 0.00 H new ATOM 0 HG2 GLU A 18 0.048 -1.786 5.053 1.00 0.00 H new ATOM 0 HG3 GLU A 18 0.279 -1.154 6.671 1.00 0.00 H new ATOM 302 N PRO A 19 5.106 -2.378 4.784 1.00 0.00 N ATOM 303 CA PRO A 19 6.470 -2.889 4.994 1.00 0.00 C ATOM 304 C PRO A 19 6.631 -3.743 6.268 1.00 0.00 C ATOM 305 O PRO A 19 7.491 -4.622 6.326 1.00 0.00 O ATOM 306 CB PRO A 19 7.364 -1.644 5.030 1.00 0.00 C ATOM 307 CG PRO A 19 6.589 -0.622 4.199 1.00 0.00 C ATOM 308 CD PRO A 19 5.137 -0.942 4.542 1.00 0.00 C ATOM 0 HA PRO A 19 6.741 -3.576 4.192 1.00 0.00 H new ATOM 0 HB2 PRO A 19 7.523 -1.294 6.050 1.00 0.00 H new ATOM 0 HB3 PRO A 19 8.347 -1.844 4.605 1.00 0.00 H new ATOM 0 HG2 PRO A 19 6.852 0.401 4.467 1.00 0.00 H new ATOM 0 HG3 PRO A 19 6.787 -0.733 3.133 1.00 0.00 H new ATOM 0 HD2 PRO A 19 4.809 -0.388 5.422 1.00 0.00 H new ATOM 0 HD3 PRO A 19 4.470 -0.666 3.725 1.00 0.00 H new ATOM 316 N SER A 20 5.776 -3.519 7.271 1.00 0.00 N ATOM 317 CA SER A 20 5.706 -4.277 8.527 1.00 0.00 C ATOM 318 C SER A 20 4.948 -5.617 8.436 1.00 0.00 C ATOM 319 O SER A 20 4.957 -6.373 9.411 1.00 0.00 O ATOM 320 CB SER A 20 5.083 -3.388 9.611 1.00 0.00 C ATOM 321 OG SER A 20 3.808 -2.915 9.198 1.00 0.00 O ATOM 0 H SER A 20 5.083 -2.772 7.229 1.00 0.00 H new ATOM 0 HA SER A 20 6.731 -4.550 8.777 1.00 0.00 H new ATOM 0 HB2 SER A 20 4.985 -3.951 10.539 1.00 0.00 H new ATOM 0 HB3 SER A 20 5.740 -2.544 9.819 1.00 0.00 H new ATOM 0 HG SER A 20 3.425 -2.351 9.902 1.00 0.00 H new ATOM 327 N ASP A 21 4.314 -5.957 7.304 1.00 0.00 N ATOM 328 CA ASP A 21 3.694 -7.278 7.118 1.00 0.00 C ATOM 329 C ASP A 21 4.743 -8.397 7.120 1.00 0.00 C ATOM 330 O ASP A 21 5.802 -8.286 6.492 1.00 0.00 O ATOM 331 CB ASP A 21 2.861 -7.366 5.825 1.00 0.00 C ATOM 332 CG ASP A 21 1.413 -6.909 6.032 1.00 0.00 C ATOM 333 OD1 ASP A 21 0.719 -7.531 6.873 1.00 0.00 O ATOM 334 OD2 ASP A 21 0.957 -5.979 5.326 1.00 0.00 O1- ATOM 0 H ASP A 21 4.217 -5.334 6.502 1.00 0.00 H new ATOM 0 HA ASP A 21 3.021 -7.411 7.965 1.00 0.00 H new ATOM 0 HB2 ASP A 21 3.326 -6.752 5.054 1.00 0.00 H new ATOM 0 HB3 ASP A 21 2.867 -8.394 5.461 1.00 0.00 H new ATOM 339 N THR A 22 4.424 -9.498 7.803 1.00 0.00 N ATOM 340 CA THR A 22 5.224 -10.728 7.785 1.00 0.00 C ATOM 341 C THR A 22 5.078 -11.471 6.458 1.00 0.00 C ATOM 342 O THR A 22 4.061 -11.352 5.771 1.00 0.00 O ATOM 343 CB THR A 22 4.847 -11.671 8.936 1.00 0.00 C ATOM 344 OG1 THR A 22 3.474 -11.973 8.863 1.00 0.00 O ATOM 345 CG2 THR A 22 5.133 -11.068 10.309 1.00 0.00 C ATOM 0 H THR A 22 3.594 -9.563 8.392 1.00 0.00 H new ATOM 0 HA THR A 22 6.262 -10.421 7.910 1.00 0.00 H new ATOM 0 HB THR A 22 5.458 -12.567 8.826 1.00 0.00 H new ATOM 0 HG1 THR A 22 3.232 -12.576 9.596 1.00 0.00 H new ATOM 0 HG21 THR A 22 4.847 -11.778 11.085 1.00 0.00 H new ATOM 0 HG22 THR A 22 6.197 -10.846 10.394 1.00 0.00 H new ATOM 0 HG23 THR A 22 4.560 -10.149 10.429 1.00 0.00 H new ATOM 353 N ILE A 23 6.053 -12.313 6.108 1.00 0.00 N ATOM 354 CA ILE A 23 5.906 -13.232 4.965 1.00 0.00 C ATOM 355 C ILE A 23 4.740 -14.209 5.206 1.00 0.00 C ATOM 356 O ILE A 23 4.027 -14.545 4.267 1.00 0.00 O ATOM 357 CB ILE A 23 7.235 -13.961 4.674 1.00 0.00 C ATOM 358 CG1 ILE A 23 8.429 -12.994 4.495 1.00 0.00 C ATOM 359 CG2 ILE A 23 7.121 -14.875 3.441 1.00 0.00 C ATOM 360 CD1 ILE A 23 8.268 -11.924 3.404 1.00 0.00 C ATOM 0 H ILE A 23 6.948 -12.381 6.592 1.00 0.00 H new ATOM 0 HA ILE A 23 5.662 -12.653 4.074 1.00 0.00 H new ATOM 0 HB ILE A 23 7.433 -14.571 5.556 1.00 0.00 H new ATOM 0 HG12 ILE A 23 8.611 -12.492 5.445 1.00 0.00 H new ATOM 0 HG13 ILE A 23 9.318 -13.583 4.271 1.00 0.00 H new ATOM 0 HG21 ILE A 23 8.076 -15.372 3.267 1.00 0.00 H new ATOM 0 HG22 ILE A 23 6.348 -15.624 3.614 1.00 0.00 H new ATOM 0 HG23 ILE A 23 6.858 -14.277 2.568 1.00 0.00 H new ATOM 0 HD11 ILE A 23 9.164 -11.304 3.368 1.00 0.00 H new ATOM 0 HD12 ILE A 23 8.122 -12.408 2.438 1.00 0.00 H new ATOM 0 HD13 ILE A 23 7.404 -11.300 3.631 1.00 0.00 H new ATOM 372 N GLU A 24 4.458 -14.581 6.460 1.00 0.00 N ATOM 373 CA GLU A 24 3.257 -15.349 6.825 1.00 0.00 C ATOM 374 C GLU A 24 1.949 -14.622 6.439 1.00 0.00 C ATOM 375 O GLU A 24 1.051 -15.249 5.871 1.00 0.00 O ATOM 376 CB GLU A 24 3.307 -15.661 8.330 1.00 0.00 C ATOM 377 CG GLU A 24 2.182 -16.601 8.780 1.00 0.00 C ATOM 378 CD GLU A 24 2.327 -16.952 10.273 1.00 0.00 C ATOM 379 OE1 GLU A 24 1.920 -16.134 11.134 1.00 0.00 O ATOM 380 OE2 GLU A 24 2.838 -18.051 10.600 1.00 0.00 O1- ATOM 0 H GLU A 24 5.057 -14.358 7.255 1.00 0.00 H new ATOM 0 HA GLU A 24 3.254 -16.280 6.258 1.00 0.00 H new ATOM 0 HB2 GLU A 24 4.269 -16.112 8.571 1.00 0.00 H new ATOM 0 HB3 GLU A 24 3.242 -14.729 8.892 1.00 0.00 H new ATOM 0 HG2 GLU A 24 1.215 -16.129 8.605 1.00 0.00 H new ATOM 0 HG3 GLU A 24 2.204 -17.513 8.184 1.00 0.00 H new ATOM 387 N ASN A 25 1.854 -13.300 6.641 1.00 0.00 N ATOM 388 CA ASN A 25 0.713 -12.505 6.166 1.00 0.00 C ATOM 389 C ASN A 25 0.629 -12.497 4.629 1.00 0.00 C ATOM 390 O ASN A 25 -0.465 -12.608 4.080 1.00 0.00 O ATOM 391 CB ASN A 25 0.779 -11.063 6.710 1.00 0.00 C ATOM 392 CG ASN A 25 0.463 -10.914 8.193 1.00 0.00 C ATOM 393 OD1 ASN A 25 0.202 -11.858 8.925 1.00 0.00 O ATOM 394 ND2 ASN A 25 0.443 -9.690 8.673 1.00 0.00 N ATOM 0 H ASN A 25 2.561 -12.755 7.135 1.00 0.00 H new ATOM 0 HA ASN A 25 -0.192 -12.977 6.548 1.00 0.00 H new ATOM 0 HB2 ASN A 25 1.778 -10.668 6.526 1.00 0.00 H new ATOM 0 HB3 ASN A 25 0.083 -10.445 6.143 1.00 0.00 H new ATOM 0 HD21 ASN A 25 0.210 -9.530 9.653 1.00 0.00 H new ATOM 0 HD22 ASN A 25 0.660 -8.900 8.065 1.00 0.00 H new ATOM 401 N VAL A 26 1.761 -12.435 3.916 1.00 0.00 N ATOM 402 CA VAL A 26 1.778 -12.521 2.438 1.00 0.00 C ATOM 403 C VAL A 26 1.302 -13.901 1.962 1.00 0.00 C ATOM 404 O VAL A 26 0.458 -13.969 1.069 1.00 0.00 O ATOM 405 CB VAL A 26 3.158 -12.147 1.854 1.00 0.00 C ATOM 406 CG1 VAL A 26 3.148 -12.153 0.319 1.00 0.00 C ATOM 407 CG2 VAL A 26 3.569 -10.730 2.277 1.00 0.00 C ATOM 0 H VAL A 26 2.684 -12.325 4.335 1.00 0.00 H new ATOM 0 HA VAL A 26 1.073 -11.783 2.056 1.00 0.00 H new ATOM 0 HB VAL A 26 3.855 -12.893 2.236 1.00 0.00 H new ATOM 0 HG11 VAL A 26 4.137 -11.885 -0.052 1.00 0.00 H new ATOM 0 HG12 VAL A 26 2.883 -13.148 -0.039 1.00 0.00 H new ATOM 0 HG13 VAL A 26 2.416 -11.431 -0.043 1.00 0.00 H new ATOM 0 HG21 VAL A 26 4.544 -10.492 1.852 1.00 0.00 H new ATOM 0 HG22 VAL A 26 2.831 -10.014 1.915 1.00 0.00 H new ATOM 0 HG23 VAL A 26 3.624 -10.676 3.364 1.00 0.00 H new ATOM 417 N LYS A 27 1.724 -14.999 2.609 1.00 0.00 N ATOM 418 CA LYS A 27 1.201 -16.350 2.315 1.00 0.00 C ATOM 419 C LYS A 27 -0.310 -16.446 2.542 1.00 0.00 C ATOM 420 O LYS A 27 -1.012 -17.019 1.710 1.00 0.00 O ATOM 421 CB LYS A 27 1.907 -17.436 3.147 1.00 0.00 C ATOM 422 CG LYS A 27 3.398 -17.649 2.838 1.00 0.00 C ATOM 423 CD LYS A 27 3.917 -18.811 3.706 1.00 0.00 C ATOM 424 CE LYS A 27 5.445 -18.916 3.807 1.00 0.00 C ATOM 425 NZ LYS A 27 6.094 -19.382 2.550 1.00 0.00 N1+ ATOM 0 H LYS A 27 2.431 -14.980 3.344 1.00 0.00 H new ATOM 0 HA LYS A 27 1.409 -16.523 1.259 1.00 0.00 H new ATOM 0 HB2 LYS A 27 1.806 -17.182 4.202 1.00 0.00 H new ATOM 0 HB3 LYS A 27 1.385 -18.381 2.995 1.00 0.00 H new ATOM 0 HG2 LYS A 27 3.537 -17.875 1.781 1.00 0.00 H new ATOM 0 HG3 LYS A 27 3.962 -16.740 3.047 1.00 0.00 H new ATOM 0 HD2 LYS A 27 3.508 -18.704 4.711 1.00 0.00 H new ATOM 0 HD3 LYS A 27 3.530 -19.747 3.302 1.00 0.00 H new ATOM 0 HE2 LYS A 27 5.851 -17.941 4.076 1.00 0.00 H new ATOM 0 HE3 LYS A 27 5.701 -19.602 4.614 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 7.072 -19.673 2.751 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 5.565 -20.190 2.165 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 6.099 -18.609 1.855 1.00 0.00 H new ATOM 439 N ALA A 28 -0.824 -15.849 3.619 1.00 0.00 N ATOM 440 CA ALA A 28 -2.259 -15.809 3.922 1.00 0.00 C ATOM 441 C ALA A 28 -3.060 -14.976 2.898 1.00 0.00 C ATOM 442 O ALA A 28 -4.135 -15.395 2.471 1.00 0.00 O ATOM 443 CB ALA A 28 -2.438 -15.289 5.354 1.00 0.00 C ATOM 0 H ALA A 28 -0.250 -15.373 4.315 1.00 0.00 H new ATOM 0 HA ALA A 28 -2.665 -16.818 3.846 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -3.500 -15.252 5.598 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -1.929 -15.956 6.050 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -2.013 -14.289 5.434 1.00 0.00 H new ATOM 449 N LYS A 29 -2.514 -13.847 2.422 1.00 0.00 N ATOM 450 CA LYS A 29 -3.109 -13.036 1.339 1.00 0.00 C ATOM 451 C LYS A 29 -3.164 -13.799 0.006 1.00 0.00 C ATOM 452 O LYS A 29 -4.171 -13.737 -0.696 1.00 0.00 O ATOM 453 CB LYS A 29 -2.339 -11.709 1.210 1.00 0.00 C ATOM 454 CG LYS A 29 -2.630 -10.750 2.379 1.00 0.00 C ATOM 455 CD LYS A 29 -1.618 -9.593 2.416 1.00 0.00 C ATOM 456 CE LYS A 29 -1.891 -8.626 3.583 1.00 0.00 C ATOM 457 NZ LYS A 29 -2.997 -7.673 3.285 1.00 0.00 N1+ ATOM 0 H LYS A 29 -1.638 -13.464 2.779 1.00 0.00 H new ATOM 0 HA LYS A 29 -4.144 -12.817 1.600 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -1.269 -11.914 1.169 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -2.607 -11.225 0.271 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -3.639 -10.350 2.282 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -2.593 -11.299 3.320 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -0.609 -9.996 2.507 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -1.658 -9.046 1.474 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -2.140 -9.200 4.476 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -0.983 -8.066 3.807 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -3.245 -7.148 4.148 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -2.691 -7.005 2.549 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -3.828 -8.200 2.950 1.00 0.00 H new ATOM 471 N ILE A 30 -2.133 -14.592 -0.308 1.00 0.00 N ATOM 472 CA ILE A 30 -2.125 -15.500 -1.474 1.00 0.00 C ATOM 473 C ILE A 30 -3.130 -16.649 -1.284 1.00 0.00 C ATOM 474 O ILE A 30 -3.864 -16.969 -2.215 1.00 0.00 O ATOM 475 CB ILE A 30 -0.691 -16.008 -1.756 1.00 0.00 C ATOM 476 CG1 ILE A 30 0.214 -14.831 -2.185 1.00 0.00 C ATOM 477 CG2 ILE A 30 -0.673 -17.101 -2.845 1.00 0.00 C ATOM 478 CD1 ILE A 30 1.711 -15.156 -2.135 1.00 0.00 C ATOM 0 H ILE A 30 -1.273 -14.626 0.239 1.00 0.00 H new ATOM 0 HA ILE A 30 -2.448 -14.944 -2.354 1.00 0.00 H new ATOM 0 HB ILE A 30 -0.311 -16.447 -0.833 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -0.050 -14.532 -3.199 1.00 0.00 H new ATOM 0 HG13 ILE A 30 0.015 -13.976 -1.538 1.00 0.00 H new ATOM 0 HG21 ILE A 30 0.352 -17.430 -3.013 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -1.278 -17.948 -2.521 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -1.081 -16.698 -3.772 1.00 0.00 H new ATOM 0 HD11 ILE A 30 2.283 -14.283 -2.449 1.00 0.00 H new ATOM 0 HD12 ILE A 30 1.991 -15.426 -1.117 1.00 0.00 H new ATOM 0 HD13 ILE A 30 1.925 -15.990 -2.803 1.00 0.00 H new ATOM 490 N GLN A 31 -3.233 -17.230 -0.082 1.00 0.00 N ATOM 491 CA GLN A 31 -4.229 -18.267 0.232 1.00 0.00 C ATOM 492 C GLN A 31 -5.665 -17.743 0.046 1.00 0.00 C ATOM 493 O GLN A 31 -6.503 -18.441 -0.520 1.00 0.00 O ATOM 494 CB GLN A 31 -4.004 -18.778 1.668 1.00 0.00 C ATOM 495 CG GLN A 31 -4.914 -19.968 2.030 1.00 0.00 C ATOM 496 CD GLN A 31 -4.811 -20.396 3.498 1.00 0.00 C ATOM 497 OE1 GLN A 31 -4.224 -19.737 4.347 1.00 0.00 O ATOM 498 NE2 GLN A 31 -5.389 -21.524 3.856 1.00 0.00 N ATOM 0 H GLN A 31 -2.627 -16.995 0.704 1.00 0.00 H new ATOM 0 HA GLN A 31 -4.101 -19.097 -0.463 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -2.962 -19.076 1.783 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -4.182 -17.964 2.370 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -5.948 -19.704 1.809 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -4.659 -20.816 1.394 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -5.883 -22.086 3.163 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -5.343 -21.835 4.826 1.00 0.00 H new ATOM 507 N ASP A 32 -5.949 -16.505 0.463 1.00 0.00 N ATOM 508 CA ASP A 32 -7.273 -15.885 0.325 1.00 0.00 C ATOM 509 C ASP A 32 -7.692 -15.655 -1.143 1.00 0.00 C ATOM 510 O ASP A 32 -8.874 -15.804 -1.470 1.00 0.00 O ATOM 511 CB ASP A 32 -7.286 -14.570 1.113 1.00 0.00 C ATOM 512 CG ASP A 32 -8.684 -13.931 1.129 1.00 0.00 C ATOM 513 OD1 ASP A 32 -9.585 -14.466 1.820 1.00 0.00 O ATOM 514 OD2 ASP A 32 -8.882 -12.882 0.471 1.00 0.00 O1- ATOM 0 H ASP A 32 -5.261 -15.899 0.910 1.00 0.00 H new ATOM 0 HA ASP A 32 -8.010 -16.578 0.731 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -6.959 -14.756 2.136 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -6.573 -13.874 0.672 1.00 0.00 H new ATOM 519 N LYS A 33 -6.738 -15.343 -2.038 1.00 0.00 N ATOM 520 CA LYS A 33 -7.001 -15.114 -3.473 1.00 0.00 C ATOM 521 C LYS A 33 -6.950 -16.385 -4.333 1.00 0.00 C ATOM 522 O LYS A 33 -7.807 -16.568 -5.198 1.00 0.00 O ATOM 523 CB LYS A 33 -6.054 -14.033 -4.029 1.00 0.00 C ATOM 524 CG LYS A 33 -6.351 -12.650 -3.427 1.00 0.00 C ATOM 525 CD LYS A 33 -5.681 -11.524 -4.230 1.00 0.00 C ATOM 526 CE LYS A 33 -6.052 -10.165 -3.619 1.00 0.00 C ATOM 527 NZ LYS A 33 -5.727 -9.029 -4.530 1.00 0.00 N1+ ATOM 0 H LYS A 33 -5.755 -15.242 -1.786 1.00 0.00 H new ATOM 0 HA LYS A 33 -8.031 -14.763 -3.536 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -5.022 -14.309 -3.814 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -6.153 -13.986 -5.114 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -7.429 -12.488 -3.402 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -6.000 -12.619 -2.395 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -4.599 -11.654 -4.224 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -6.001 -11.566 -5.271 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -7.117 -10.151 -3.389 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -5.521 -10.036 -2.676 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -6.071 -8.140 -4.113 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -4.697 -8.974 -4.662 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -6.186 -9.180 -5.451 1.00 0.00 H new ATOM 541 N GLU A 34 -5.973 -17.265 -4.099 1.00 0.00 N ATOM 542 CA GLU A 34 -5.667 -18.417 -4.969 1.00 0.00 C ATOM 543 C GLU A 34 -6.037 -19.788 -4.371 1.00 0.00 C ATOM 544 O GLU A 34 -6.029 -20.793 -5.086 1.00 0.00 O ATOM 545 CB GLU A 34 -4.169 -18.403 -5.331 1.00 0.00 C ATOM 546 CG GLU A 34 -3.682 -17.123 -6.020 1.00 0.00 C ATOM 547 CD GLU A 34 -4.442 -16.826 -7.330 1.00 0.00 C ATOM 548 OE1 GLU A 34 -4.421 -17.675 -8.255 1.00 0.00 O ATOM 549 OE2 GLU A 34 -5.060 -15.741 -7.448 1.00 0.00 O1- ATOM 0 H GLU A 34 -5.359 -17.201 -3.287 1.00 0.00 H new ATOM 0 HA GLU A 34 -6.292 -18.298 -5.854 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -3.589 -18.551 -4.420 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -3.960 -19.251 -5.983 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -3.799 -16.281 -5.338 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -2.617 -17.213 -6.235 1.00 0.00 H new ATOM 556 N GLY A 35 -6.340 -19.862 -3.069 1.00 0.00 N ATOM 557 CA GLY A 35 -6.655 -21.110 -2.356 1.00 0.00 C ATOM 558 C GLY A 35 -5.447 -22.002 -2.023 1.00 0.00 C ATOM 559 O GLY A 35 -5.636 -23.109 -1.518 1.00 0.00 O ATOM 0 H GLY A 35 -6.374 -19.039 -2.467 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -7.167 -20.859 -1.427 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -7.356 -21.687 -2.960 1.00 0.00 H new ATOM 563 N ILE A 36 -4.212 -21.549 -2.291 1.00 0.00 N ATOM 564 CA ILE A 36 -2.975 -22.331 -2.094 1.00 0.00 C ATOM 565 C ILE A 36 -2.605 -22.348 -0.596 1.00 0.00 C ATOM 566 O ILE A 36 -2.362 -21.272 -0.041 1.00 0.00 O ATOM 567 CB ILE A 36 -1.806 -21.762 -2.943 1.00 0.00 C ATOM 568 CG1 ILE A 36 -2.159 -21.611 -4.443 1.00 0.00 C ATOM 569 CG2 ILE A 36 -0.573 -22.681 -2.805 1.00 0.00 C ATOM 570 CD1 ILE A 36 -1.184 -20.709 -5.215 1.00 0.00 C ATOM 0 H ILE A 36 -4.039 -20.613 -2.657 1.00 0.00 H new ATOM 0 HA ILE A 36 -3.154 -23.353 -2.429 1.00 0.00 H new ATOM 0 HB ILE A 36 -1.596 -20.764 -2.559 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -2.172 -22.598 -4.906 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -3.166 -21.204 -4.532 1.00 0.00 H new ATOM 0 HG21 ILE A 36 0.247 -22.281 -3.401 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -0.271 -22.730 -1.759 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -0.824 -23.682 -3.158 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -1.493 -20.649 -6.259 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -1.188 -19.711 -4.777 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -0.179 -21.127 -5.157 1.00 0.00 H new ATOM 582 N PRO A 37 -2.492 -23.513 0.076 1.00 0.00 N ATOM 583 CA PRO A 37 -2.113 -23.579 1.492 1.00 0.00 C ATOM 584 C PRO A 37 -0.705 -23.007 1.754 1.00 0.00 C ATOM 585 O PRO A 37 0.204 -23.298 0.976 1.00 0.00 O ATOM 586 CB PRO A 37 -2.194 -25.062 1.879 1.00 0.00 C ATOM 587 CG PRO A 37 -3.182 -25.636 0.866 1.00 0.00 C ATOM 588 CD PRO A 37 -2.862 -24.839 -0.395 1.00 0.00 C ATOM 0 HA PRO A 37 -2.783 -22.967 2.096 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -1.221 -25.549 1.812 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -2.546 -25.192 2.902 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -3.036 -26.706 0.718 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -4.215 -25.496 1.183 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -2.048 -25.299 -0.956 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -3.723 -24.794 -1.062 1.00 0.00 H new ATOM 596 N PRO A 38 -0.465 -22.250 2.846 1.00 0.00 N ATOM 597 CA PRO A 38 0.843 -21.656 3.155 1.00 0.00 C ATOM 598 C PRO A 38 2.012 -22.654 3.188 1.00 0.00 C ATOM 599 O PRO A 38 3.112 -22.320 2.753 1.00 0.00 O ATOM 600 CB PRO A 38 0.657 -20.974 4.516 1.00 0.00 C ATOM 601 CG PRO A 38 -0.809 -20.553 4.480 1.00 0.00 C ATOM 602 CD PRO A 38 -1.465 -21.735 3.772 1.00 0.00 C ATOM 0 HA PRO A 38 1.128 -20.965 2.362 1.00 0.00 H new ATOM 0 HB2 PRO A 38 0.863 -21.655 5.342 1.00 0.00 H new ATOM 0 HB3 PRO A 38 1.322 -20.118 4.635 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -1.214 -20.402 5.481 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -0.952 -19.621 3.934 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -1.766 -22.501 4.487 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -2.365 -21.423 3.242 1.00 0.00 H new ATOM 610 N ASP A 39 1.768 -23.899 3.614 1.00 0.00 N ATOM 611 CA ASP A 39 2.773 -24.977 3.636 1.00 0.00 C ATOM 612 C ASP A 39 3.241 -25.418 2.233 1.00 0.00 C ATOM 613 O ASP A 39 4.324 -25.989 2.095 1.00 0.00 O ATOM 614 CB ASP A 39 2.201 -26.182 4.395 1.00 0.00 C ATOM 615 CG ASP A 39 1.928 -25.862 5.873 1.00 0.00 C ATOM 616 OD1 ASP A 39 2.892 -25.832 6.675 1.00 0.00 O ATOM 617 OD2 ASP A 39 0.746 -25.649 6.237 1.00 0.00 O1- ATOM 0 H ASP A 39 0.854 -24.194 3.959 1.00 0.00 H new ATOM 0 HA ASP A 39 3.654 -24.579 4.140 1.00 0.00 H new ATOM 0 HB2 ASP A 39 1.275 -26.503 3.918 1.00 0.00 H new ATOM 0 HB3 ASP A 39 2.900 -27.016 4.329 1.00 0.00 H new ATOM 622 N GLN A 40 2.448 -25.141 1.187 1.00 0.00 N ATOM 623 CA GLN A 40 2.783 -25.424 -0.216 1.00 0.00 C ATOM 624 C GLN A 40 3.460 -24.235 -0.928 1.00 0.00 C ATOM 625 O GLN A 40 3.981 -24.405 -2.030 1.00 0.00 O ATOM 626 CB GLN A 40 1.513 -25.856 -0.975 1.00 0.00 C ATOM 627 CG GLN A 40 0.849 -27.111 -0.381 1.00 0.00 C ATOM 628 CD GLN A 40 -0.366 -27.597 -1.176 1.00 0.00 C ATOM 629 OE1 GLN A 40 -0.632 -27.194 -2.299 1.00 0.00 O ATOM 630 NE2 GLN A 40 -1.147 -28.505 -0.628 1.00 0.00 N ATOM 0 H GLN A 40 1.533 -24.703 1.297 1.00 0.00 H new ATOM 0 HA GLN A 40 3.511 -26.235 -0.216 1.00 0.00 H new ATOM 0 HB2 GLN A 40 0.796 -25.035 -0.967 1.00 0.00 H new ATOM 0 HB3 GLN A 40 1.768 -26.047 -2.018 1.00 0.00 H new ATOM 0 HG2 GLN A 40 1.586 -27.913 -0.333 1.00 0.00 H new ATOM 0 HG3 GLN A 40 0.541 -26.899 0.643 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -0.943 -28.855 0.308 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -1.956 -28.858 -1.140 1.00 0.00 H new ATOM 639 N GLN A 41 3.456 -23.035 -0.328 1.00 0.00 N ATOM 640 CA GLN A 41 3.977 -21.804 -0.935 1.00 0.00 C ATOM 641 C GLN A 41 5.437 -21.516 -0.546 1.00 0.00 C ATOM 642 O GLN A 41 5.764 -21.441 0.640 1.00 0.00 O ATOM 643 CB GLN A 41 3.136 -20.591 -0.497 1.00 0.00 C ATOM 644 CG GLN A 41 1.649 -20.594 -0.889 1.00 0.00 C ATOM 645 CD GLN A 41 0.967 -19.317 -0.394 1.00 0.00 C ATOM 646 OE1 GLN A 41 1.550 -18.246 -0.398 1.00 0.00 O ATOM 647 NE2 GLN A 41 -0.258 -19.355 0.082 1.00 0.00 N ATOM 0 H GLN A 41 3.083 -22.892 0.611 1.00 0.00 H new ATOM 0 HA GLN A 41 3.923 -21.959 -2.013 1.00 0.00 H new ATOM 0 HB2 GLN A 41 3.200 -20.508 0.588 1.00 0.00 H new ATOM 0 HB3 GLN A 41 3.594 -19.693 -0.913 1.00 0.00 H new ATOM 0 HG2 GLN A 41 1.552 -20.670 -1.972 1.00 0.00 H new ATOM 0 HG3 GLN A 41 1.155 -21.467 -0.462 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -0.772 -20.236 0.099 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -0.695 -18.503 0.435 1.00 0.00 H new ATOM 656 N ARG A 42 6.288 -21.216 -1.532 1.00 0.00 N ATOM 657 CA ARG A 42 7.659 -20.695 -1.356 1.00 0.00 C ATOM 658 C ARG A 42 7.765 -19.356 -2.091 1.00 0.00 C ATOM 659 O ARG A 42 7.521 -19.304 -3.291 1.00 0.00 O ATOM 660 CB ARG A 42 8.681 -21.712 -1.898 1.00 0.00 C ATOM 661 CG ARG A 42 8.825 -22.959 -1.016 1.00 0.00 C ATOM 662 CD ARG A 42 9.798 -23.943 -1.679 1.00 0.00 C ATOM 663 NE ARG A 42 9.996 -25.149 -0.851 1.00 0.00 N ATOM 664 CZ ARG A 42 11.103 -25.538 -0.237 1.00 0.00 C ATOM 665 NH1 ARG A 42 12.178 -24.803 -0.188 1.00 0.00 N1+ ATOM 666 NH2 ARG A 42 11.146 -26.697 0.356 1.00 0.00 N ATOM 0 H ARG A 42 6.037 -21.332 -2.514 1.00 0.00 H new ATOM 0 HA ARG A 42 7.876 -20.541 -0.299 1.00 0.00 H new ATOM 0 HB2 ARG A 42 8.382 -22.018 -2.901 1.00 0.00 H new ATOM 0 HB3 ARG A 42 9.653 -21.226 -1.989 1.00 0.00 H new ATOM 0 HG2 ARG A 42 9.191 -22.679 -0.028 1.00 0.00 H new ATOM 0 HG3 ARG A 42 7.853 -23.432 -0.874 1.00 0.00 H new ATOM 0 HD2 ARG A 42 9.415 -24.231 -2.658 1.00 0.00 H new ATOM 0 HD3 ARG A 42 10.757 -23.452 -1.844 1.00 0.00 H new ATOM 0 HE ARG A 42 9.183 -25.755 -0.738 1.00 0.00 H new ATOM 0 HH11 ARG A 42 12.190 -23.886 -0.635 1.00 0.00 H new ATOM 0 HH12 ARG A 42 13.008 -25.145 0.297 1.00 0.00 H new ATOM 0 HH21 ARG A 42 10.327 -27.305 0.347 1.00 0.00 H new ATOM 0 HH22 ARG A 42 11.999 -26.997 0.829 1.00 0.00 H new ATOM 680 N LEU A 43 8.113 -18.278 -1.388 1.00 0.00 N ATOM 681 CA LEU A 43 8.281 -16.938 -1.974 1.00 0.00 C ATOM 682 C LEU A 43 9.767 -16.608 -2.101 1.00 0.00 C ATOM 683 O LEU A 43 10.527 -16.791 -1.154 1.00 0.00 O ATOM 684 CB LEU A 43 7.522 -15.892 -1.135 1.00 0.00 C ATOM 685 CG LEU A 43 5.992 -15.935 -1.316 1.00 0.00 C ATOM 686 CD1 LEU A 43 5.320 -15.092 -0.232 1.00 0.00 C ATOM 687 CD2 LEU A 43 5.567 -15.381 -2.679 1.00 0.00 C ATOM 0 H LEU A 43 8.289 -18.306 -0.384 1.00 0.00 H new ATOM 0 HA LEU A 43 7.854 -16.920 -2.977 1.00 0.00 H new ATOM 0 HB2 LEU A 43 7.758 -16.045 -0.082 1.00 0.00 H new ATOM 0 HB3 LEU A 43 7.881 -14.898 -1.401 1.00 0.00 H new ATOM 0 HG LEU A 43 5.686 -16.979 -1.246 1.00 0.00 H new ATOM 0 HD11 LEU A 43 4.238 -15.125 -0.364 1.00 0.00 H new ATOM 0 HD12 LEU A 43 5.578 -15.489 0.750 1.00 0.00 H new ATOM 0 HD13 LEU A 43 5.663 -14.060 -0.308 1.00 0.00 H new ATOM 0 HD21 LEU A 43 4.482 -15.428 -2.769 1.00 0.00 H new ATOM 0 HD22 LEU A 43 5.894 -14.345 -2.769 1.00 0.00 H new ATOM 0 HD23 LEU A 43 6.023 -15.975 -3.471 1.00 0.00 H new ATOM 699 N ILE A 44 10.174 -16.145 -3.280 1.00 0.00 N ATOM 700 CA ILE A 44 11.550 -15.789 -3.632 1.00 0.00 C ATOM 701 C ILE A 44 11.574 -14.313 -4.071 1.00 0.00 C ATOM 702 O ILE A 44 10.678 -13.858 -4.782 1.00 0.00 O ATOM 703 CB ILE A 44 12.096 -16.754 -4.720 1.00 0.00 C ATOM 704 CG1 ILE A 44 12.269 -18.231 -4.285 1.00 0.00 C ATOM 705 CG2 ILE A 44 13.472 -16.303 -5.247 1.00 0.00 C ATOM 706 CD1 ILE A 44 10.997 -19.050 -4.028 1.00 0.00 C ATOM 0 H ILE A 44 9.525 -16.000 -4.053 1.00 0.00 H new ATOM 0 HA ILE A 44 12.211 -15.898 -2.772 1.00 0.00 H new ATOM 0 HB ILE A 44 11.318 -16.707 -5.482 1.00 0.00 H new ATOM 0 HG12 ILE A 44 12.848 -18.742 -5.054 1.00 0.00 H new ATOM 0 HG13 ILE A 44 12.867 -18.245 -3.374 1.00 0.00 H new ATOM 0 HG21 ILE A 44 13.819 -17.004 -6.006 1.00 0.00 H new ATOM 0 HG22 ILE A 44 13.386 -15.308 -5.684 1.00 0.00 H new ATOM 0 HG23 ILE A 44 14.186 -16.277 -4.424 1.00 0.00 H new ATOM 0 HD11 ILE A 44 11.270 -20.063 -3.732 1.00 0.00 H new ATOM 0 HD12 ILE A 44 10.418 -18.582 -3.232 1.00 0.00 H new ATOM 0 HD13 ILE A 44 10.398 -19.087 -4.938 1.00 0.00 H new ATOM 718 N PHE A 45 12.599 -13.562 -3.665 1.00 0.00 N ATOM 719 CA PHE A 45 12.855 -12.186 -4.114 1.00 0.00 C ATOM 720 C PHE A 45 14.364 -11.920 -4.192 1.00 0.00 C ATOM 721 O PHE A 45 15.109 -12.346 -3.310 1.00 0.00 O ATOM 722 CB PHE A 45 12.171 -11.202 -3.153 1.00 0.00 C ATOM 723 CG PHE A 45 12.418 -9.736 -3.458 1.00 0.00 C ATOM 724 CD1 PHE A 45 11.740 -9.113 -4.523 1.00 0.00 C ATOM 725 CD2 PHE A 45 13.335 -8.996 -2.685 1.00 0.00 C ATOM 726 CE1 PHE A 45 11.980 -7.758 -4.816 1.00 0.00 C ATOM 727 CE2 PHE A 45 13.570 -7.641 -2.975 1.00 0.00 C ATOM 728 CZ PHE A 45 12.892 -7.021 -4.040 1.00 0.00 C ATOM 0 H PHE A 45 13.293 -13.899 -2.998 1.00 0.00 H new ATOM 0 HA PHE A 45 12.442 -12.047 -5.113 1.00 0.00 H new ATOM 0 HB2 PHE A 45 11.097 -11.386 -3.171 1.00 0.00 H new ATOM 0 HB3 PHE A 45 12.513 -11.410 -2.139 1.00 0.00 H new ATOM 0 HD1 PHE A 45 11.035 -9.676 -5.116 1.00 0.00 H new ATOM 0 HD2 PHE A 45 13.858 -9.471 -1.868 1.00 0.00 H new ATOM 0 HE1 PHE A 45 11.463 -7.284 -5.637 1.00 0.00 H new ATOM 0 HE2 PHE A 45 14.272 -7.076 -2.380 1.00 0.00 H new ATOM 0 HZ PHE A 45 13.072 -5.979 -4.262 1.00 0.00 H new ATOM 738 N ALA A 46 14.823 -11.236 -5.247 1.00 0.00 N ATOM 739 CA ALA A 46 16.234 -10.892 -5.485 1.00 0.00 C ATOM 740 C ALA A 46 17.225 -12.075 -5.316 1.00 0.00 C ATOM 741 O ALA A 46 18.363 -11.895 -4.874 1.00 0.00 O ATOM 742 CB ALA A 46 16.581 -9.643 -4.657 1.00 0.00 C ATOM 0 H ALA A 46 14.205 -10.895 -5.983 1.00 0.00 H new ATOM 0 HA ALA A 46 16.358 -10.652 -6.541 1.00 0.00 H new ATOM 0 HB1 ALA A 46 17.624 -9.375 -4.823 1.00 0.00 H new ATOM 0 HB2 ALA A 46 15.941 -8.815 -4.962 1.00 0.00 H new ATOM 0 HB3 ALA A 46 16.424 -9.853 -3.599 1.00 0.00 H new ATOM 748 N GLY A 47 16.788 -13.299 -5.647 1.00 0.00 N ATOM 749 CA GLY A 47 17.584 -14.531 -5.513 1.00 0.00 C ATOM 750 C GLY A 47 17.670 -15.121 -4.097 1.00 0.00 C ATOM 751 O GLY A 47 18.601 -15.875 -3.810 1.00 0.00 O ATOM 0 H GLY A 47 15.854 -13.465 -6.022 1.00 0.00 H new ATOM 0 HA2 GLY A 47 17.163 -15.287 -6.176 1.00 0.00 H new ATOM 0 HA3 GLY A 47 18.596 -14.327 -5.863 1.00 0.00 H new ATOM 755 N LYS A 48 16.719 -14.790 -3.212 1.00 0.00 N ATOM 756 CA LYS A 48 16.645 -15.248 -1.811 1.00 0.00 C ATOM 757 C LYS A 48 15.246 -15.784 -1.497 1.00 0.00 C ATOM 758 O LYS A 48 14.257 -15.154 -1.867 1.00 0.00 O ATOM 759 CB LYS A 48 16.998 -14.081 -0.867 1.00 0.00 C ATOM 760 CG LYS A 48 18.439 -13.576 -1.060 1.00 0.00 C ATOM 761 CD LYS A 48 18.789 -12.380 -0.163 1.00 0.00 C ATOM 762 CE LYS A 48 18.022 -11.112 -0.573 1.00 0.00 C ATOM 763 NZ LYS A 48 18.494 -9.920 0.188 1.00 0.00 N1+ ATOM 0 H LYS A 48 15.947 -14.171 -3.460 1.00 0.00 H new ATOM 0 HA LYS A 48 17.361 -16.056 -1.662 1.00 0.00 H new ATOM 0 HB2 LYS A 48 16.303 -13.259 -1.037 1.00 0.00 H new ATOM 0 HB3 LYS A 48 16.865 -14.402 0.166 1.00 0.00 H new ATOM 0 HG2 LYS A 48 19.133 -14.391 -0.854 1.00 0.00 H new ATOM 0 HG3 LYS A 48 18.581 -13.293 -2.103 1.00 0.00 H new ATOM 0 HD2 LYS A 48 18.559 -12.624 0.874 1.00 0.00 H new ATOM 0 HD3 LYS A 48 19.861 -12.189 -0.215 1.00 0.00 H new ATOM 0 HE2 LYS A 48 18.150 -10.937 -1.641 1.00 0.00 H new ATOM 0 HE3 LYS A 48 16.956 -11.258 -0.399 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 17.957 -9.082 -0.112 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 18.349 -10.078 1.206 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 19.506 -9.768 0.002 1.00 0.00 H new ATOM 777 N GLN A 49 15.151 -16.924 -0.812 1.00 0.00 N ATOM 778 CA GLN A 49 13.876 -17.468 -0.321 1.00 0.00 C ATOM 779 C GLN A 49 13.471 -16.767 0.991 1.00 0.00 C ATOM 780 O GLN A 49 14.303 -16.566 1.879 1.00 0.00 O ATOM 781 CB GLN A 49 13.989 -18.995 -0.172 1.00 0.00 C ATOM 782 CG GLN A 49 12.625 -19.668 0.066 1.00 0.00 C ATOM 783 CD GLN A 49 12.760 -21.170 0.311 1.00 0.00 C ATOM 784 OE1 GLN A 49 12.442 -22.001 -0.531 1.00 0.00 O ATOM 785 NE2 GLN A 49 13.229 -21.579 1.471 1.00 0.00 N ATOM 0 H GLN A 49 15.958 -17.502 -0.579 1.00 0.00 H new ATOM 0 HA GLN A 49 13.081 -17.271 -1.041 1.00 0.00 H new ATOM 0 HB2 GLN A 49 14.444 -19.412 -1.071 1.00 0.00 H new ATOM 0 HB3 GLN A 49 14.655 -19.227 0.659 1.00 0.00 H new ATOM 0 HG2 GLN A 49 12.137 -19.204 0.923 1.00 0.00 H new ATOM 0 HG3 GLN A 49 11.982 -19.498 -0.798 1.00 0.00 H new ATOM 0 HE21 GLN A 49 13.498 -20.898 2.181 1.00 0.00 H new ATOM 0 HE22 GLN A 49 13.324 -22.577 1.660 1.00 0.00 H new ATOM 794 N LEU A 50 12.196 -16.388 1.109 1.00 0.00 N ATOM 795 CA LEU A 50 11.669 -15.551 2.193 1.00 0.00 C ATOM 796 C LEU A 50 11.062 -16.398 3.331 1.00 0.00 C ATOM 797 O LEU A 50 10.445 -17.436 3.081 1.00 0.00 O ATOM 798 CB LEU A 50 10.677 -14.523 1.609 1.00 0.00 C ATOM 799 CG LEU A 50 11.175 -13.718 0.387 1.00 0.00 C ATOM 800 CD1 LEU A 50 10.123 -12.676 0.003 1.00 0.00 C ATOM 801 CD2 LEU A 50 12.493 -12.995 0.654 1.00 0.00 C ATOM 0 H LEU A 50 11.481 -16.662 0.435 1.00 0.00 H new ATOM 0 HA LEU A 50 12.490 -15.001 2.653 1.00 0.00 H new ATOM 0 HB2 LEU A 50 9.765 -15.049 1.326 1.00 0.00 H new ATOM 0 HB3 LEU A 50 10.408 -13.820 2.397 1.00 0.00 H new ATOM 0 HG LEU A 50 11.340 -14.433 -0.419 1.00 0.00 H new ATOM 0 HD11 LEU A 50 10.472 -12.107 -0.859 1.00 0.00 H new ATOM 0 HD12 LEU A 50 9.188 -13.178 -0.248 1.00 0.00 H new ATOM 0 HD13 LEU A 50 9.958 -12.000 0.842 1.00 0.00 H new ATOM 0 HD21 LEU A 50 12.794 -12.446 -0.238 1.00 0.00 H new ATOM 0 HD22 LEU A 50 12.364 -12.298 1.482 1.00 0.00 H new ATOM 0 HD23 LEU A 50 13.263 -13.724 0.909 1.00 0.00 H new ATOM 813 N GLU A 51 11.229 -15.957 4.582 1.00 0.00 N ATOM 814 CA GLU A 51 10.912 -16.728 5.799 1.00 0.00 C ATOM 815 C GLU A 51 9.721 -16.156 6.587 1.00 0.00 C ATOM 816 O GLU A 51 9.625 -14.947 6.792 1.00 0.00 O ATOM 817 CB GLU A 51 12.152 -16.803 6.709 1.00 0.00 C ATOM 818 CG GLU A 51 13.340 -17.520 6.053 1.00 0.00 C ATOM 819 CD GLU A 51 14.532 -17.600 7.024 1.00 0.00 C ATOM 820 OE1 GLU A 51 14.602 -18.566 7.826 1.00 0.00 O1- ATOM 821 OE2 GLU A 51 15.413 -16.706 6.991 1.00 0.00 O ATOM 0 H GLU A 51 11.598 -15.029 4.787 1.00 0.00 H new ATOM 0 HA GLU A 51 10.622 -17.726 5.471 1.00 0.00 H new ATOM 0 HB2 GLU A 51 12.453 -15.793 6.986 1.00 0.00 H new ATOM 0 HB3 GLU A 51 11.887 -17.321 7.631 1.00 0.00 H new ATOM 0 HG2 GLU A 51 13.043 -18.524 5.751 1.00 0.00 H new ATOM 0 HG3 GLU A 51 13.637 -16.989 5.148 1.00 0.00 H new ATOM 828 N ASP A 52 8.836 -17.029 7.084 1.00 0.00 N ATOM 829 CA ASP A 52 7.547 -16.685 7.715 1.00 0.00 C ATOM 830 C ASP A 52 7.638 -15.628 8.828 1.00 0.00 C ATOM 831 O ASP A 52 6.799 -14.728 8.891 1.00 0.00 O ATOM 832 CB ASP A 52 6.933 -17.961 8.310 1.00 0.00 C ATOM 833 CG ASP A 52 6.388 -18.898 7.226 1.00 0.00 C ATOM 834 OD1 ASP A 52 7.180 -19.678 6.646 1.00 0.00 O ATOM 835 OD2 ASP A 52 5.167 -18.844 6.951 1.00 0.00 O1- ATOM 0 H ASP A 52 9.001 -18.035 7.059 1.00 0.00 H new ATOM 0 HA ASP A 52 6.932 -16.251 6.926 1.00 0.00 H new ATOM 0 HB2 ASP A 52 7.687 -18.486 8.897 1.00 0.00 H new ATOM 0 HB3 ASP A 52 6.128 -17.691 8.993 1.00 0.00 H new ATOM 840 N GLY A 53 8.655 -15.734 9.692 1.00 0.00 N ATOM 841 CA GLY A 53 8.863 -14.855 10.850 1.00 0.00 C ATOM 842 C GLY A 53 9.527 -13.505 10.539 1.00 0.00 C ATOM 843 O GLY A 53 9.692 -12.688 11.448 1.00 0.00 O ATOM 0 H GLY A 53 9.374 -16.452 9.603 1.00 0.00 H new ATOM 0 HA2 GLY A 53 7.898 -14.667 11.320 1.00 0.00 H new ATOM 0 HA3 GLY A 53 9.476 -15.383 11.581 1.00 0.00 H new ATOM 847 N ARG A 54 9.920 -13.259 9.281 1.00 0.00 N ATOM 848 CA ARG A 54 10.487 -11.984 8.800 1.00 0.00 C ATOM 849 C ARG A 54 9.409 -11.120 8.142 1.00 0.00 C ATOM 850 O ARG A 54 8.336 -11.608 7.785 1.00 0.00 O ATOM 851 CB ARG A 54 11.658 -12.264 7.839 1.00 0.00 C ATOM 852 CG ARG A 54 12.840 -13.021 8.467 1.00 0.00 C ATOM 853 CD ARG A 54 13.533 -12.237 9.590 1.00 0.00 C ATOM 854 NE ARG A 54 14.717 -12.962 10.091 1.00 0.00 N ATOM 855 CZ ARG A 54 14.760 -13.882 11.041 1.00 0.00 C ATOM 856 NH1 ARG A 54 13.700 -14.253 11.704 1.00 0.00 N1+ ATOM 857 NH2 ARG A 54 15.890 -14.455 11.348 1.00 0.00 N ATOM 0 H ARG A 54 9.851 -13.962 8.545 1.00 0.00 H new ATOM 0 HA ARG A 54 10.871 -11.422 9.651 1.00 0.00 H new ATOM 0 HB2 ARG A 54 11.285 -12.840 6.992 1.00 0.00 H new ATOM 0 HB3 ARG A 54 12.021 -11.315 7.444 1.00 0.00 H new ATOM 0 HG2 ARG A 54 12.485 -13.972 8.863 1.00 0.00 H new ATOM 0 HG3 ARG A 54 13.569 -13.251 7.690 1.00 0.00 H new ATOM 0 HD2 ARG A 54 13.832 -11.256 9.222 1.00 0.00 H new ATOM 0 HD3 ARG A 54 12.832 -12.070 10.408 1.00 0.00 H new ATOM 0 HE ARG A 54 15.607 -12.726 9.653 1.00 0.00 H new ATOM 0 HH11 ARG A 54 12.795 -13.830 11.497 1.00 0.00 H new ATOM 0 HH12 ARG A 54 13.776 -14.966 12.429 1.00 0.00 H new ATOM 0 HH21 ARG A 54 16.744 -14.194 10.855 1.00 0.00 H new ATOM 0 HH22 ARG A 54 15.920 -15.164 12.081 1.00 0.00 H new ATOM 871 N THR A 55 9.693 -9.832 7.979 1.00 0.00 N ATOM 872 CA THR A 55 8.801 -8.829 7.375 1.00 0.00 C ATOM 873 C THR A 55 9.346 -8.283 6.058 1.00 0.00 C ATOM 874 O THR A 55 10.536 -8.407 5.767 1.00 0.00 O ATOM 875 CB THR A 55 8.509 -7.671 8.342 1.00 0.00 C ATOM 876 OG1 THR A 55 9.683 -6.956 8.648 1.00 0.00 O ATOM 877 CG2 THR A 55 7.881 -8.136 9.656 1.00 0.00 C ATOM 0 H THR A 55 10.585 -9.435 8.274 1.00 0.00 H new ATOM 0 HA THR A 55 7.867 -9.348 7.161 1.00 0.00 H new ATOM 0 HB THR A 55 7.796 -7.031 7.822 1.00 0.00 H new ATOM 0 HG1 THR A 55 10.329 -7.556 9.076 1.00 0.00 H new ATOM 0 HG21 THR A 55 7.698 -7.274 10.297 1.00 0.00 H new ATOM 0 HG22 THR A 55 6.937 -8.641 9.450 1.00 0.00 H new ATOM 0 HG23 THR A 55 8.559 -8.825 10.159 1.00 0.00 H new ATOM 885 N LEU A 56 8.489 -7.657 5.246 1.00 0.00 N ATOM 886 CA LEU A 56 8.883 -7.094 3.947 1.00 0.00 C ATOM 887 C LEU A 56 10.026 -6.061 4.064 1.00 0.00 C ATOM 888 O LEU A 56 10.924 -6.047 3.220 1.00 0.00 O ATOM 889 CB LEU A 56 7.636 -6.498 3.261 1.00 0.00 C ATOM 890 CG LEU A 56 6.573 -7.533 2.839 1.00 0.00 C ATOM 891 CD1 LEU A 56 5.375 -6.813 2.224 1.00 0.00 C ATOM 892 CD2 LEU A 56 7.105 -8.517 1.795 1.00 0.00 C ATOM 0 H LEU A 56 7.502 -7.525 5.469 1.00 0.00 H new ATOM 0 HA LEU A 56 9.286 -7.898 3.331 1.00 0.00 H new ATOM 0 HB2 LEU A 56 7.174 -5.780 3.938 1.00 0.00 H new ATOM 0 HB3 LEU A 56 7.954 -5.944 2.378 1.00 0.00 H new ATOM 0 HG LEU A 56 6.294 -8.085 3.736 1.00 0.00 H new ATOM 0 HD11 LEU A 56 4.624 -7.545 1.926 1.00 0.00 H new ATOM 0 HD12 LEU A 56 4.945 -6.130 2.957 1.00 0.00 H new ATOM 0 HD13 LEU A 56 5.699 -6.249 1.349 1.00 0.00 H new ATOM 0 HD21 LEU A 56 6.320 -9.226 1.530 1.00 0.00 H new ATOM 0 HD22 LEU A 56 7.416 -7.970 0.905 1.00 0.00 H new ATOM 0 HD23 LEU A 56 7.958 -9.057 2.206 1.00 0.00 H new ATOM 904 N SER A 57 10.062 -5.261 5.135 1.00 0.00 N ATOM 905 CA SER A 57 11.151 -4.309 5.401 1.00 0.00 C ATOM 906 C SER A 57 12.481 -4.971 5.800 1.00 0.00 C ATOM 907 O SER A 57 13.536 -4.395 5.528 1.00 0.00 O ATOM 908 CB SER A 57 10.732 -3.280 6.458 1.00 0.00 C ATOM 909 OG SER A 57 10.499 -3.896 7.712 1.00 0.00 O ATOM 0 H SER A 57 9.332 -5.254 5.848 1.00 0.00 H new ATOM 0 HA SER A 57 11.335 -3.806 4.452 1.00 0.00 H new ATOM 0 HB2 SER A 57 11.510 -2.524 6.561 1.00 0.00 H new ATOM 0 HB3 SER A 57 9.829 -2.765 6.130 1.00 0.00 H new ATOM 0 HG SER A 57 10.235 -3.216 8.366 1.00 0.00 H new ATOM 915 N ASP A 58 12.481 -6.196 6.349 1.00 0.00 N ATOM 916 CA ASP A 58 13.720 -6.948 6.628 1.00 0.00 C ATOM 917 C ASP A 58 14.456 -7.342 5.331 1.00 0.00 C ATOM 918 O ASP A 58 15.687 -7.424 5.310 1.00 0.00 O ATOM 919 CB ASP A 58 13.439 -8.212 7.458 1.00 0.00 C ATOM 920 CG ASP A 58 12.874 -7.915 8.854 1.00 0.00 C ATOM 921 OD1 ASP A 58 13.533 -7.187 9.635 1.00 0.00 O ATOM 922 OD2 ASP A 58 11.786 -8.448 9.184 1.00 0.00 O1- ATOM 0 H ASP A 58 11.630 -6.693 6.611 1.00 0.00 H new ATOM 0 HA ASP A 58 14.361 -6.281 7.204 1.00 0.00 H new ATOM 0 HB2 ASP A 58 12.735 -8.843 6.916 1.00 0.00 H new ATOM 0 HB3 ASP A 58 14.363 -8.781 7.562 1.00 0.00 H new ATOM 927 N TYR A 59 13.704 -7.527 4.238 1.00 0.00 N ATOM 928 CA TYR A 59 14.212 -7.793 2.887 1.00 0.00 C ATOM 929 C TYR A 59 14.325 -6.527 2.010 1.00 0.00 C ATOM 930 O TYR A 59 14.643 -6.624 0.825 1.00 0.00 O ATOM 931 CB TYR A 59 13.329 -8.870 2.239 1.00 0.00 C ATOM 932 CG TYR A 59 13.321 -10.191 2.986 1.00 0.00 C ATOM 933 CD1 TYR A 59 14.478 -10.997 2.992 1.00 0.00 C ATOM 934 CD2 TYR A 59 12.163 -10.618 3.663 1.00 0.00 C ATOM 935 CE1 TYR A 59 14.478 -12.229 3.672 1.00 0.00 C ATOM 936 CE2 TYR A 59 12.154 -11.858 4.328 1.00 0.00 C ATOM 937 CZ TYR A 59 13.312 -12.664 4.339 1.00 0.00 C ATOM 938 OH TYR A 59 13.301 -13.861 4.982 1.00 0.00 O ATOM 0 H TYR A 59 12.685 -7.494 4.273 1.00 0.00 H new ATOM 0 HA TYR A 59 15.237 -8.155 2.971 1.00 0.00 H new ATOM 0 HB2 TYR A 59 12.307 -8.496 2.172 1.00 0.00 H new ATOM 0 HB3 TYR A 59 13.673 -9.043 1.219 1.00 0.00 H new ATOM 0 HD1 TYR A 59 15.366 -10.668 2.473 1.00 0.00 H new ATOM 0 HD2 TYR A 59 11.282 -9.994 3.672 1.00 0.00 H new ATOM 0 HE1 TYR A 59 15.368 -12.841 3.684 1.00 0.00 H new ATOM 0 HE2 TYR A 59 11.259 -12.193 4.831 1.00 0.00 H new ATOM 0 HH TYR A 59 14.084 -13.925 5.568 1.00 0.00 H new ATOM 948 N ASN A 60 14.067 -5.340 2.580 1.00 0.00 N ATOM 949 CA ASN A 60 13.996 -4.042 1.886 1.00 0.00 C ATOM 950 C ASN A 60 13.012 -4.016 0.689 1.00 0.00 C ATOM 951 O ASN A 60 13.205 -3.264 -0.273 1.00 0.00 O ATOM 952 CB ASN A 60 15.416 -3.529 1.557 1.00 0.00 C ATOM 953 CG ASN A 60 16.281 -3.349 2.795 1.00 0.00 C ATOM 954 OD1 ASN A 60 16.121 -2.407 3.559 1.00 0.00 O ATOM 955 ND2 ASN A 60 17.220 -4.238 3.039 1.00 0.00 N ATOM 0 H ASN A 60 13.894 -5.253 3.582 1.00 0.00 H new ATOM 0 HA ASN A 60 13.550 -3.327 2.577 1.00 0.00 H new ATOM 0 HB2 ASN A 60 15.902 -4.230 0.879 1.00 0.00 H new ATOM 0 HB3 ASN A 60 15.340 -2.577 1.031 1.00 0.00 H new ATOM 0 HD21 ASN A 60 17.812 -4.141 3.864 1.00 0.00 H new ATOM 0 HD22 ASN A 60 17.355 -5.024 2.404 1.00 0.00 H new ATOM 962 N ILE A 61 11.943 -4.823 0.747 1.00 0.00 N ATOM 963 CA ILE A 61 10.878 -4.861 -0.268 1.00 0.00 C ATOM 964 C ILE A 61 10.034 -3.578 -0.167 1.00 0.00 C ATOM 965 O ILE A 61 9.663 -3.140 0.924 1.00 0.00 O ATOM 966 CB ILE A 61 10.040 -6.160 -0.146 1.00 0.00 C ATOM 967 CG1 ILE A 61 10.916 -7.391 -0.479 1.00 0.00 C ATOM 968 CG2 ILE A 61 8.819 -6.122 -1.087 1.00 0.00 C ATOM 969 CD1 ILE A 61 10.296 -8.744 -0.104 1.00 0.00 C ATOM 0 H ILE A 61 11.791 -5.479 1.513 1.00 0.00 H new ATOM 0 HA ILE A 61 11.315 -4.887 -1.266 1.00 0.00 H new ATOM 0 HB ILE A 61 9.682 -6.236 0.881 1.00 0.00 H new ATOM 0 HG12 ILE A 61 11.129 -7.389 -1.548 1.00 0.00 H new ATOM 0 HG13 ILE A 61 11.871 -7.290 0.037 1.00 0.00 H new ATOM 0 HG21 ILE A 61 8.249 -7.045 -0.981 1.00 0.00 H new ATOM 0 HG22 ILE A 61 8.186 -5.273 -0.828 1.00 0.00 H new ATOM 0 HG23 ILE A 61 9.157 -6.021 -2.118 1.00 0.00 H new ATOM 0 HD11 ILE A 61 10.982 -9.546 -0.375 1.00 0.00 H new ATOM 0 HD12 ILE A 61 10.109 -8.774 0.969 1.00 0.00 H new ATOM 0 HD13 ILE A 61 9.356 -8.874 -0.640 1.00 0.00 H new ATOM 981 N GLN A 62 9.758 -2.970 -1.323 1.00 0.00 N ATOM 982 CA GLN A 62 9.150 -1.638 -1.480 1.00 0.00 C ATOM 983 C GLN A 62 7.957 -1.677 -2.455 1.00 0.00 C ATOM 984 O GLN A 62 7.692 -2.708 -3.079 1.00 0.00 O ATOM 985 CB GLN A 62 10.253 -0.674 -1.967 1.00 0.00 C ATOM 986 CG GLN A 62 11.268 -0.326 -0.865 1.00 0.00 C ATOM 987 CD GLN A 62 12.570 0.212 -1.449 1.00 0.00 C ATOM 988 OE1 GLN A 62 12.693 1.377 -1.810 1.00 0.00 O ATOM 989 NE2 GLN A 62 13.585 -0.618 -1.587 1.00 0.00 N ATOM 0 H GLN A 62 9.960 -3.410 -2.220 1.00 0.00 H new ATOM 0 HA GLN A 62 8.750 -1.292 -0.527 1.00 0.00 H new ATOM 0 HB2 GLN A 62 10.778 -1.125 -2.809 1.00 0.00 H new ATOM 0 HB3 GLN A 62 9.792 0.243 -2.333 1.00 0.00 H new ATOM 0 HG2 GLN A 62 10.836 0.416 -0.193 1.00 0.00 H new ATOM 0 HG3 GLN A 62 11.476 -1.214 -0.268 1.00 0.00 H new ATOM 0 HE21 GLN A 62 13.493 -1.589 -1.290 1.00 0.00 H new ATOM 0 HE22 GLN A 62 14.462 -0.289 -1.991 1.00 0.00 H new ATOM 998 N LYS A 63 7.249 -0.552 -2.623 1.00 0.00 N ATOM 999 CA LYS A 63 6.123 -0.432 -3.569 1.00 0.00 C ATOM 1000 C LYS A 63 6.493 -0.900 -4.988 1.00 0.00 C ATOM 1001 O LYS A 63 7.604 -0.667 -5.467 1.00 0.00 O ATOM 1002 CB LYS A 63 5.567 1.008 -3.563 1.00 0.00 C ATOM 1003 CG LYS A 63 6.538 2.061 -4.128 1.00 0.00 C ATOM 1004 CD LYS A 63 5.955 3.476 -4.023 1.00 0.00 C ATOM 1005 CE LYS A 63 6.944 4.490 -4.618 1.00 0.00 C ATOM 1006 NZ LYS A 63 6.418 5.880 -4.545 1.00 0.00 N1+ ATOM 0 H LYS A 63 7.439 0.306 -2.106 1.00 0.00 H new ATOM 0 HA LYS A 63 5.334 -1.103 -3.230 1.00 0.00 H new ATOM 0 HB2 LYS A 63 4.645 1.032 -4.143 1.00 0.00 H new ATOM 0 HB3 LYS A 63 5.307 1.281 -2.540 1.00 0.00 H new ATOM 0 HG2 LYS A 63 7.483 2.014 -3.586 1.00 0.00 H new ATOM 0 HG3 LYS A 63 6.757 1.833 -5.171 1.00 0.00 H new ATOM 0 HD2 LYS A 63 5.004 3.528 -4.553 1.00 0.00 H new ATOM 0 HD3 LYS A 63 5.753 3.720 -2.980 1.00 0.00 H new ATOM 0 HE2 LYS A 63 7.892 4.431 -4.083 1.00 0.00 H new ATOM 0 HE3 LYS A 63 7.148 4.232 -5.657 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 7.113 6.536 -4.956 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 5.526 5.942 -5.077 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 6.247 6.135 -3.551 1.00 0.00 H new ATOM 1020 N GLU A 64 5.547 -1.567 -5.648 1.00 0.00 N ATOM 1021 CA GLU A 64 5.670 -2.123 -7.009 1.00 0.00 C ATOM 1022 C GLU A 64 6.799 -3.168 -7.193 1.00 0.00 C ATOM 1023 O GLU A 64 7.206 -3.453 -8.323 1.00 0.00 O ATOM 1024 CB GLU A 64 5.700 -0.992 -8.062 1.00 0.00 C ATOM 1025 CG GLU A 64 4.476 -0.067 -7.989 1.00 0.00 C ATOM 1026 CD GLU A 64 4.531 0.999 -9.098 1.00 0.00 C ATOM 1027 OE1 GLU A 64 5.112 2.090 -8.872 1.00 0.00 O ATOM 1028 OE2 GLU A 64 3.989 0.758 -10.206 1.00 0.00 O1- ATOM 0 H GLU A 64 4.631 -1.746 -5.237 1.00 0.00 H new ATOM 0 HA GLU A 64 4.768 -2.712 -7.175 1.00 0.00 H new ATOM 0 HB2 GLU A 64 6.604 -0.399 -7.924 1.00 0.00 H new ATOM 0 HB3 GLU A 64 5.756 -1.432 -9.058 1.00 0.00 H new ATOM 0 HG2 GLU A 64 3.564 -0.655 -8.088 1.00 0.00 H new ATOM 0 HG3 GLU A 64 4.438 0.418 -7.014 1.00 0.00 H new ATOM 1035 N SER A 65 7.293 -3.777 -6.104 1.00 0.00 N ATOM 1036 CA SER A 65 8.231 -4.917 -6.172 1.00 0.00 C ATOM 1037 C SER A 65 7.537 -6.187 -6.679 1.00 0.00 C ATOM 1038 O SER A 65 6.371 -6.418 -6.353 1.00 0.00 O ATOM 1039 CB SER A 65 8.845 -5.232 -4.803 1.00 0.00 C ATOM 1040 OG SER A 65 9.559 -4.123 -4.294 1.00 0.00 O ATOM 0 H SER A 65 7.057 -3.497 -5.152 1.00 0.00 H new ATOM 0 HA SER A 65 9.015 -4.617 -6.867 1.00 0.00 H new ATOM 0 HB2 SER A 65 8.057 -5.512 -4.104 1.00 0.00 H new ATOM 0 HB3 SER A 65 9.513 -6.089 -4.890 1.00 0.00 H new ATOM 0 HG SER A 65 8.927 -3.432 -4.005 1.00 0.00 H new ATOM 1046 N THR A 66 8.264 -7.043 -7.406 1.00 0.00 N ATOM 1047 CA THR A 66 7.749 -8.328 -7.923 1.00 0.00 C ATOM 1048 C THR A 66 8.447 -9.514 -7.258 1.00 0.00 C ATOM 1049 O THR A 66 9.661 -9.679 -7.385 1.00 0.00 O ATOM 1050 CB THR A 66 7.874 -8.415 -9.453 1.00 0.00 C ATOM 1051 OG1 THR A 66 7.220 -7.315 -10.050 1.00 0.00 O ATOM 1052 CG2 THR A 66 7.214 -9.676 -10.020 1.00 0.00 C ATOM 0 H THR A 66 9.237 -6.867 -7.658 1.00 0.00 H new ATOM 0 HA THR A 66 6.689 -8.372 -7.672 1.00 0.00 H new ATOM 0 HB THR A 66 8.941 -8.429 -9.674 1.00 0.00 H new ATOM 0 HG1 THR A 66 7.304 -7.374 -11.025 1.00 0.00 H new ATOM 0 HG21 THR A 66 7.329 -9.691 -11.104 1.00 0.00 H new ATOM 0 HG22 THR A 66 7.689 -10.559 -9.592 1.00 0.00 H new ATOM 0 HG23 THR A 66 6.154 -9.676 -9.768 1.00 0.00 H new ATOM 1060 N LEU A 67 7.671 -10.349 -6.564 1.00 0.00 N ATOM 1061 CA LEU A 67 8.106 -11.599 -5.934 1.00 0.00 C ATOM 1062 C LEU A 67 7.817 -12.795 -6.861 1.00 0.00 C ATOM 1063 O LEU A 67 6.881 -12.763 -7.661 1.00 0.00 O ATOM 1064 CB LEU A 67 7.400 -11.778 -4.571 1.00 0.00 C ATOM 1065 CG LEU A 67 7.822 -10.837 -3.421 1.00 0.00 C ATOM 1066 CD1 LEU A 67 7.492 -9.358 -3.647 1.00 0.00 C ATOM 1067 CD2 LEU A 67 7.104 -11.274 -2.140 1.00 0.00 C ATOM 0 H LEU A 67 6.678 -10.165 -6.419 1.00 0.00 H new ATOM 0 HA LEU A 67 9.182 -11.554 -5.763 1.00 0.00 H new ATOM 0 HB2 LEU A 67 6.328 -11.657 -4.729 1.00 0.00 H new ATOM 0 HB3 LEU A 67 7.560 -12.805 -4.242 1.00 0.00 H new ATOM 0 HG LEU A 67 8.907 -10.917 -3.358 1.00 0.00 H new ATOM 0 HD11 LEU A 67 7.825 -8.776 -2.788 1.00 0.00 H new ATOM 0 HD12 LEU A 67 8.000 -9.005 -4.544 1.00 0.00 H new ATOM 0 HD13 LEU A 67 6.415 -9.240 -3.770 1.00 0.00 H new ATOM 0 HD21 LEU A 67 7.393 -10.618 -1.319 1.00 0.00 H new ATOM 0 HD22 LEU A 67 6.026 -11.216 -2.289 1.00 0.00 H new ATOM 0 HD23 LEU A 67 7.382 -12.300 -1.899 1.00 0.00 H new ATOM 1079 N HIS A 68 8.581 -13.876 -6.715 1.00 0.00 N ATOM 1080 CA HIS A 68 8.430 -15.131 -7.461 1.00 0.00 C ATOM 1081 C HIS A 68 7.842 -16.214 -6.544 1.00 0.00 C ATOM 1082 O HIS A 68 8.425 -16.523 -5.505 1.00 0.00 O ATOM 1083 CB HIS A 68 9.806 -15.525 -8.038 1.00 0.00 C ATOM 1084 CG HIS A 68 10.403 -14.460 -8.931 1.00 0.00 C ATOM 1085 ND1 HIS A 68 11.459 -13.605 -8.587 1.00 0.00 N ATOM 1086 CD2 HIS A 68 9.941 -14.122 -10.169 1.00 0.00 C ATOM 1087 CE1 HIS A 68 11.592 -12.761 -9.628 1.00 0.00 C ATOM 1088 NE2 HIS A 68 10.706 -13.057 -10.593 1.00 0.00 N ATOM 0 H HIS A 68 9.353 -13.906 -6.049 1.00 0.00 H new ATOM 0 HA HIS A 68 7.735 -15.011 -8.292 1.00 0.00 H new ATOM 0 HB2 HIS A 68 10.493 -15.728 -7.216 1.00 0.00 H new ATOM 0 HB3 HIS A 68 9.704 -16.450 -8.605 1.00 0.00 H new ATOM 0 HD2 HIS A 68 9.135 -14.595 -10.710 1.00 0.00 H new ATOM 0 HE1 HIS A 68 12.312 -11.957 -9.680 1.00 0.00 H new ATOM 0 HE2 HIS A 68 10.615 -12.575 -11.488 1.00 0.00 H new ATOM 1096 N LEU A 69 6.690 -16.787 -6.906 1.00 0.00 N ATOM 1097 CA LEU A 69 6.007 -17.842 -6.145 1.00 0.00 C ATOM 1098 C LEU A 69 6.290 -19.223 -6.753 1.00 0.00 C ATOM 1099 O LEU A 69 5.897 -19.513 -7.883 1.00 0.00 O ATOM 1100 CB LEU A 69 4.501 -17.518 -6.070 1.00 0.00 C ATOM 1101 CG LEU A 69 3.619 -18.588 -5.393 1.00 0.00 C ATOM 1102 CD1 LEU A 69 3.962 -18.792 -3.917 1.00 0.00 C ATOM 1103 CD2 LEU A 69 2.151 -18.172 -5.481 1.00 0.00 C ATOM 0 H LEU A 69 6.193 -16.525 -7.757 1.00 0.00 H new ATOM 0 HA LEU A 69 6.392 -17.876 -5.126 1.00 0.00 H new ATOM 0 HB2 LEU A 69 4.377 -16.578 -5.532 1.00 0.00 H new ATOM 0 HB3 LEU A 69 4.132 -17.357 -7.083 1.00 0.00 H new ATOM 0 HG LEU A 69 3.804 -19.524 -5.920 1.00 0.00 H new ATOM 0 HD11 LEU A 69 3.309 -19.556 -3.494 1.00 0.00 H new ATOM 0 HD12 LEU A 69 5.000 -19.111 -3.825 1.00 0.00 H new ATOM 0 HD13 LEU A 69 3.821 -17.855 -3.378 1.00 0.00 H new ATOM 0 HD21 LEU A 69 1.529 -18.929 -5.003 1.00 0.00 H new ATOM 0 HD22 LEU A 69 2.013 -17.216 -4.976 1.00 0.00 H new ATOM 0 HD23 LEU A 69 1.863 -18.074 -6.528 1.00 0.00 H new ATOM 1115 N VAL A 70 6.924 -20.086 -5.959 1.00 0.00 N ATOM 1116 CA VAL A 70 7.170 -21.509 -6.241 1.00 0.00 C ATOM 1117 C VAL A 70 6.198 -22.365 -5.415 1.00 0.00 C ATOM 1118 O VAL A 70 5.936 -22.065 -4.249 1.00 0.00 O ATOM 1119 CB VAL A 70 8.651 -21.856 -5.962 1.00 0.00 C ATOM 1120 CG1 VAL A 70 8.934 -23.359 -6.078 1.00 0.00 C ATOM 1121 CG2 VAL A 70 9.599 -21.124 -6.922 1.00 0.00 C ATOM 0 H VAL A 70 7.301 -19.802 -5.055 1.00 0.00 H new ATOM 0 HA VAL A 70 6.987 -21.724 -7.294 1.00 0.00 H new ATOM 0 HB VAL A 70 8.832 -21.532 -4.937 1.00 0.00 H new ATOM 0 HG11 VAL A 70 9.988 -23.548 -5.873 1.00 0.00 H new ATOM 0 HG12 VAL A 70 8.321 -23.901 -5.358 1.00 0.00 H new ATOM 0 HG13 VAL A 70 8.694 -23.698 -7.086 1.00 0.00 H new ATOM 0 HG21 VAL A 70 10.630 -21.395 -6.693 1.00 0.00 H new ATOM 0 HG22 VAL A 70 9.369 -21.409 -7.949 1.00 0.00 H new ATOM 0 HG23 VAL A 70 9.473 -20.047 -6.807 1.00 0.00 H new ATOM 1131 N LEU A 71 5.667 -23.435 -6.012 1.00 0.00 N ATOM 1132 CA LEU A 71 4.836 -24.449 -5.349 1.00 0.00 C ATOM 1133 C LEU A 71 4.958 -25.818 -6.048 1.00 0.00 C ATOM 1134 O LEU A 71 5.210 -25.875 -7.254 1.00 0.00 O ATOM 1135 CB LEU A 71 3.361 -23.988 -5.249 1.00 0.00 C ATOM 1136 CG LEU A 71 2.603 -23.745 -6.575 1.00 0.00 C ATOM 1137 CD1 LEU A 71 1.104 -23.950 -6.353 1.00 0.00 C ATOM 1138 CD2 LEU A 71 2.790 -22.323 -7.116 1.00 0.00 C ATOM 0 H LEU A 71 5.807 -23.628 -7.004 1.00 0.00 H new ATOM 0 HA LEU A 71 5.209 -24.570 -4.332 1.00 0.00 H new ATOM 0 HB2 LEU A 71 2.811 -24.737 -4.678 1.00 0.00 H new ATOM 0 HB3 LEU A 71 3.335 -23.064 -4.671 1.00 0.00 H new ATOM 0 HG LEU A 71 3.012 -24.452 -7.297 1.00 0.00 H new ATOM 0 HD11 LEU A 71 0.571 -23.778 -7.288 1.00 0.00 H new ATOM 0 HD12 LEU A 71 0.923 -24.970 -6.014 1.00 0.00 H new ATOM 0 HD13 LEU A 71 0.749 -23.248 -5.599 1.00 0.00 H new ATOM 0 HD21 LEU A 71 2.235 -22.212 -8.048 1.00 0.00 H new ATOM 0 HD22 LEU A 71 2.420 -21.604 -6.385 1.00 0.00 H new ATOM 0 HD23 LEU A 71 3.849 -22.140 -7.300 1.00 0.00 H new ATOM 1232 N MET B 1 0.593 -40.560 10.154 1.00 0.00 N ATOM 1233 CA MET B 1 0.541 -40.443 8.662 1.00 0.00 C ATOM 1234 C MET B 1 -0.304 -41.563 8.026 1.00 0.00 C ATOM 1235 O MET B 1 -0.670 -42.520 8.702 1.00 0.00 O ATOM 1236 CB MET B 1 1.956 -40.337 8.024 1.00 0.00 C ATOM 1237 CG MET B 1 2.828 -41.606 8.082 1.00 0.00 C ATOM 1238 SD MET B 1 4.414 -41.453 7.214 1.00 0.00 S ATOM 1239 CE MET B 1 5.030 -43.152 7.377 1.00 0.00 C ATOM 0 H1 MET B 1 1.239 -39.840 10.536 1.00 0.00 H new ATOM 0 H2 MET B 1 -0.359 -40.415 10.547 1.00 0.00 H new ATOM 0 H3 MET B 1 0.936 -41.506 10.416 1.00 0.00 H new ATOM 0 HA MET B 1 0.036 -39.503 8.441 1.00 0.00 H new ATOM 0 HB2 MET B 1 1.839 -40.050 6.979 1.00 0.00 H new ATOM 0 HB3 MET B 1 2.495 -39.529 8.519 1.00 0.00 H new ATOM 0 HG2 MET B 1 3.019 -41.855 9.126 1.00 0.00 H new ATOM 0 HG3 MET B 1 2.270 -42.438 7.653 1.00 0.00 H new ATOM 0 HE1 MET B 1 6.004 -43.234 6.894 1.00 0.00 H new ATOM 0 HE2 MET B 1 5.126 -43.404 8.433 1.00 0.00 H new ATOM 0 HE3 MET B 1 4.330 -43.840 6.902 1.00 0.00 H new ATOM 1251 N GLN B 2 -0.611 -41.461 6.728 1.00 0.00 N ATOM 1252 CA GLN B 2 -1.302 -42.506 5.949 1.00 0.00 C ATOM 1253 C GLN B 2 -0.370 -43.079 4.870 1.00 0.00 C ATOM 1254 O GLN B 2 0.314 -42.312 4.189 1.00 0.00 O ATOM 1255 CB GLN B 2 -2.570 -41.926 5.286 1.00 0.00 C ATOM 1256 CG GLN B 2 -3.587 -41.281 6.247 1.00 0.00 C ATOM 1257 CD GLN B 2 -4.263 -42.245 7.227 1.00 0.00 C ATOM 1258 OE1 GLN B 2 -4.254 -43.459 7.083 1.00 0.00 O ATOM 1259 NE2 GLN B 2 -4.894 -41.726 8.260 1.00 0.00 N ATOM 0 H GLN B 2 -0.383 -40.635 6.175 1.00 0.00 H new ATOM 0 HA GLN B 2 -1.588 -43.308 6.630 1.00 0.00 H new ATOM 0 HB2 GLN B 2 -2.266 -41.179 4.553 1.00 0.00 H new ATOM 0 HB3 GLN B 2 -3.070 -42.725 4.739 1.00 0.00 H new ATOM 0 HG2 GLN B 2 -3.080 -40.504 6.819 1.00 0.00 H new ATOM 0 HG3 GLN B 2 -4.359 -40.789 5.656 1.00 0.00 H new ATOM 0 HE21 GLN B 2 -4.910 -40.715 8.393 1.00 0.00 H new ATOM 0 HE22 GLN B 2 -5.367 -42.335 8.927 1.00 0.00 H new ATOM 1268 N ILE B 3 -0.377 -44.400 4.674 1.00 0.00 N ATOM 1269 CA ILE B 3 0.288 -45.087 3.548 1.00 0.00 C ATOM 1270 C ILE B 3 -0.713 -45.941 2.761 1.00 0.00 C ATOM 1271 O ILE B 3 -1.744 -46.359 3.296 1.00 0.00 O ATOM 1272 CB ILE B 3 1.514 -45.924 3.993 1.00 0.00 C ATOM 1273 CG1 ILE B 3 1.133 -47.093 4.932 1.00 0.00 C ATOM 1274 CG2 ILE B 3 2.583 -45.002 4.606 1.00 0.00 C ATOM 1275 CD1 ILE B 3 2.279 -48.070 5.227 1.00 0.00 C ATOM 0 H ILE B 3 -0.855 -45.043 5.305 1.00 0.00 H new ATOM 0 HA ILE B 3 0.672 -44.309 2.888 1.00 0.00 H new ATOM 0 HB ILE B 3 1.937 -46.397 3.107 1.00 0.00 H new ATOM 0 HG12 ILE B 3 0.771 -46.682 5.874 1.00 0.00 H new ATOM 0 HG13 ILE B 3 0.306 -47.646 4.486 1.00 0.00 H new ATOM 0 HG21 ILE B 3 3.442 -45.597 4.917 1.00 0.00 H new ATOM 0 HG22 ILE B 3 2.899 -44.268 3.865 1.00 0.00 H new ATOM 0 HG23 ILE B 3 2.166 -44.487 5.472 1.00 0.00 H new ATOM 0 HD11 ILE B 3 1.924 -48.857 5.892 1.00 0.00 H new ATOM 0 HD12 ILE B 3 2.628 -48.513 4.294 1.00 0.00 H new ATOM 0 HD13 ILE B 3 3.100 -47.535 5.704 1.00 0.00 H new ATOM 1287 N PHE B 4 -0.389 -46.232 1.501 1.00 0.00 N ATOM 1288 CA PHE B 4 -1.177 -47.108 0.631 1.00 0.00 C ATOM 1289 C PHE B 4 -0.462 -48.443 0.407 1.00 0.00 C ATOM 1290 O PHE B 4 0.760 -48.480 0.271 1.00 0.00 O ATOM 1291 CB PHE B 4 -1.468 -46.395 -0.697 1.00 0.00 C ATOM 1292 CG PHE B 4 -2.220 -45.085 -0.544 1.00 0.00 C ATOM 1293 CD1 PHE B 4 -3.524 -45.078 -0.009 1.00 0.00 C ATOM 1294 CD2 PHE B 4 -1.617 -43.871 -0.927 1.00 0.00 C ATOM 1295 CE1 PHE B 4 -4.215 -43.864 0.149 1.00 0.00 C ATOM 1296 CE2 PHE B 4 -2.315 -42.658 -0.776 1.00 0.00 C ATOM 1297 CZ PHE B 4 -3.611 -42.654 -0.233 1.00 0.00 C ATOM 0 H PHE B 4 0.445 -45.859 1.047 1.00 0.00 H new ATOM 0 HA PHE B 4 -2.127 -47.330 1.117 1.00 0.00 H new ATOM 0 HB2 PHE B 4 -0.525 -46.203 -1.208 1.00 0.00 H new ATOM 0 HB3 PHE B 4 -2.047 -47.062 -1.336 1.00 0.00 H new ATOM 0 HD1 PHE B 4 -3.993 -46.007 0.280 1.00 0.00 H new ATOM 0 HD2 PHE B 4 -0.618 -43.871 -1.337 1.00 0.00 H new ATOM 0 HE1 PHE B 4 -5.212 -43.861 0.565 1.00 0.00 H new ATOM 0 HE2 PHE B 4 -1.854 -41.729 -1.078 1.00 0.00 H new ATOM 0 HZ PHE B 4 -4.142 -41.722 -0.109 1.00 0.00 H new ATOM 1307 N VAL B 5 -1.219 -49.538 0.324 1.00 0.00 N ATOM 1308 CA VAL B 5 -0.704 -50.883 0.020 1.00 0.00 C ATOM 1309 C VAL B 5 -1.533 -51.498 -1.108 1.00 0.00 C ATOM 1310 O VAL B 5 -2.735 -51.699 -0.942 1.00 0.00 O ATOM 1311 CB VAL B 5 -0.700 -51.794 1.268 1.00 0.00 C ATOM 1312 CG1 VAL B 5 0.051 -53.098 0.972 1.00 0.00 C ATOM 1313 CG2 VAL B 5 -0.039 -51.137 2.487 1.00 0.00 C ATOM 0 H VAL B 5 -2.229 -49.519 0.468 1.00 0.00 H new ATOM 0 HA VAL B 5 0.333 -50.792 -0.302 1.00 0.00 H new ATOM 0 HB VAL B 5 -1.747 -51.985 1.503 1.00 0.00 H new ATOM 0 HG11 VAL B 5 0.046 -53.730 1.860 1.00 0.00 H new ATOM 0 HG12 VAL B 5 -0.439 -53.622 0.151 1.00 0.00 H new ATOM 0 HG13 VAL B 5 1.080 -52.870 0.695 1.00 0.00 H new ATOM 0 HG21 VAL B 5 -0.067 -51.826 3.331 1.00 0.00 H new ATOM 0 HG22 VAL B 5 0.997 -50.893 2.252 1.00 0.00 H new ATOM 0 HG23 VAL B 5 -0.577 -50.225 2.745 1.00 0.00 H new ATOM 1323 N LYS B 6 -0.913 -51.803 -2.252 1.00 0.00 N ATOM 1324 CA LYS B 6 -1.565 -52.481 -3.388 1.00 0.00 C ATOM 1325 C LYS B 6 -1.398 -53.999 -3.310 1.00 0.00 C ATOM 1326 O LYS B 6 -0.293 -54.483 -3.077 1.00 0.00 O ATOM 1327 CB LYS B 6 -1.051 -51.908 -4.722 1.00 0.00 C ATOM 1328 CG LYS B 6 -1.905 -50.706 -5.152 1.00 0.00 C ATOM 1329 CD LYS B 6 -1.358 -50.052 -6.430 1.00 0.00 C ATOM 1330 CE LYS B 6 -2.371 -49.123 -7.123 1.00 0.00 C ATOM 1331 NZ LYS B 6 -2.850 -48.012 -6.250 1.00 0.00 N1+ ATOM 0 H LYS B 6 0.069 -51.585 -2.422 1.00 0.00 H new ATOM 0 HA LYS B 6 -2.636 -52.286 -3.334 1.00 0.00 H new ATOM 0 HB2 LYS B 6 -0.010 -51.604 -4.617 1.00 0.00 H new ATOM 0 HB3 LYS B 6 -1.082 -52.679 -5.492 1.00 0.00 H new ATOM 0 HG2 LYS B 6 -2.932 -51.030 -5.319 1.00 0.00 H new ATOM 0 HG3 LYS B 6 -1.930 -49.970 -4.348 1.00 0.00 H new ATOM 0 HD2 LYS B 6 -0.463 -49.481 -6.183 1.00 0.00 H new ATOM 0 HD3 LYS B 6 -1.056 -50.833 -7.128 1.00 0.00 H new ATOM 0 HE2 LYS B 6 -1.913 -48.701 -8.017 1.00 0.00 H new ATOM 0 HE3 LYS B 6 -3.227 -49.712 -7.451 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 -3.333 -47.298 -6.831 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 -3.512 -48.388 -5.542 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 -2.039 -47.575 -5.768 1.00 0.00 H new ATOM 1345 N THR B 7 -2.482 -54.746 -3.512 1.00 0.00 N ATOM 1346 CA THR B 7 -2.505 -56.223 -3.503 1.00 0.00 C ATOM 1347 C THR B 7 -2.152 -56.817 -4.875 1.00 0.00 C ATOM 1348 O THR B 7 -2.163 -56.122 -5.893 1.00 0.00 O ATOM 1349 CB THR B 7 -3.890 -56.748 -3.074 1.00 0.00 C ATOM 1350 OG1 THR B 7 -4.826 -56.435 -4.077 1.00 0.00 O ATOM 1351 CG2 THR B 7 -4.398 -56.163 -1.758 1.00 0.00 C ATOM 0 H THR B 7 -3.399 -54.337 -3.692 1.00 0.00 H new ATOM 0 HA THR B 7 -1.749 -56.539 -2.784 1.00 0.00 H new ATOM 0 HB THR B 7 -3.777 -57.822 -2.927 1.00 0.00 H new ATOM 0 HG1 THR B 7 -5.472 -57.167 -4.162 1.00 0.00 H new ATOM 0 HG21 THR B 7 -5.377 -56.583 -1.527 1.00 0.00 H new ATOM 0 HG22 THR B 7 -3.700 -56.408 -0.957 1.00 0.00 H new ATOM 0 HG23 THR B 7 -4.480 -55.080 -1.849 1.00 0.00 H new ATOM 1359 N LEU B 8 -1.931 -58.140 -4.933 1.00 0.00 N ATOM 1360 CA LEU B 8 -1.799 -58.874 -6.205 1.00 0.00 C ATOM 1361 C LEU B 8 -3.098 -58.850 -7.043 1.00 0.00 C ATOM 1362 O LEU B 8 -3.043 -58.915 -8.270 1.00 0.00 O ATOM 1363 CB LEU B 8 -1.366 -60.328 -5.923 1.00 0.00 C ATOM 1364 CG LEU B 8 0.023 -60.510 -5.280 1.00 0.00 C ATOM 1365 CD1 LEU B 8 0.375 -61.999 -5.263 1.00 0.00 C ATOM 1366 CD2 LEU B 8 1.119 -59.734 -6.017 1.00 0.00 C ATOM 0 H LEU B 8 -1.839 -58.729 -4.106 1.00 0.00 H new ATOM 0 HA LEU B 8 -1.035 -58.369 -6.797 1.00 0.00 H new ATOM 0 HB2 LEU B 8 -2.109 -60.787 -5.270 1.00 0.00 H new ATOM 0 HB3 LEU B 8 -1.384 -60.880 -6.863 1.00 0.00 H new ATOM 0 HG LEU B 8 -0.028 -60.112 -4.267 1.00 0.00 H new ATOM 0 HD11 LEU B 8 1.357 -62.136 -4.809 1.00 0.00 H new ATOM 0 HD12 LEU B 8 -0.371 -62.543 -4.684 1.00 0.00 H new ATOM 0 HD13 LEU B 8 0.391 -62.381 -6.284 1.00 0.00 H new ATOM 0 HD21 LEU B 8 2.076 -59.898 -5.522 1.00 0.00 H new ATOM 0 HD22 LEU B 8 1.180 -60.081 -7.048 1.00 0.00 H new ATOM 0 HD23 LEU B 8 0.882 -58.670 -6.006 1.00 0.00 H new ATOM 1378 N THR B 9 -4.257 -58.706 -6.390 1.00 0.00 N ATOM 1379 CA THR B 9 -5.583 -58.549 -7.024 1.00 0.00 C ATOM 1380 C THR B 9 -5.879 -57.119 -7.511 1.00 0.00 C ATOM 1381 O THR B 9 -6.934 -56.877 -8.101 1.00 0.00 O ATOM 1382 CB THR B 9 -6.699 -59.031 -6.079 1.00 0.00 C ATOM 1383 OG1 THR B 9 -6.587 -58.405 -4.817 1.00 0.00 O ATOM 1384 CG2 THR B 9 -6.620 -60.537 -5.833 1.00 0.00 C ATOM 0 H THR B 9 -4.306 -58.694 -5.371 1.00 0.00 H new ATOM 0 HA THR B 9 -5.558 -59.175 -7.916 1.00 0.00 H new ATOM 0 HB THR B 9 -7.642 -58.778 -6.564 1.00 0.00 H new ATOM 0 HG1 THR B 9 -7.305 -58.722 -4.230 1.00 0.00 H new ATOM 0 HG21 THR B 9 -7.424 -60.839 -5.162 1.00 0.00 H new ATOM 0 HG22 THR B 9 -6.721 -61.066 -6.781 1.00 0.00 H new ATOM 0 HG23 THR B 9 -5.659 -60.782 -5.381 1.00 0.00 H new ATOM 1392 N GLY B 10 -4.963 -56.163 -7.297 1.00 0.00 N ATOM 1393 CA GLY B 10 -5.092 -54.767 -7.741 1.00 0.00 C ATOM 1394 C GLY B 10 -5.949 -53.871 -6.833 1.00 0.00 C ATOM 1395 O GLY B 10 -6.259 -52.738 -7.210 1.00 0.00 O ATOM 0 H GLY B 10 -4.091 -56.343 -6.799 1.00 0.00 H new ATOM 0 HA2 GLY B 10 -4.095 -54.333 -7.818 1.00 0.00 H new ATOM 0 HA3 GLY B 10 -5.521 -54.759 -8.743 1.00 0.00 H new ATOM 1399 N LYS B 11 -6.323 -54.352 -5.639 1.00 0.00 N ATOM 1400 CA LYS B 11 -7.006 -53.571 -4.593 1.00 0.00 C ATOM 1401 C LYS B 11 -5.998 -52.654 -3.894 1.00 0.00 C ATOM 1402 O LYS B 11 -4.861 -53.061 -3.665 1.00 0.00 O ATOM 1403 CB LYS B 11 -7.687 -54.552 -3.615 1.00 0.00 C ATOM 1404 CG LYS B 11 -8.540 -53.872 -2.533 1.00 0.00 C ATOM 1405 CD LYS B 11 -9.156 -54.925 -1.598 1.00 0.00 C ATOM 1406 CE LYS B 11 -9.976 -54.305 -0.454 1.00 0.00 C ATOM 1407 NZ LYS B 11 -11.263 -53.718 -0.924 1.00 0.00 N1+ ATOM 0 H LYS B 11 -6.155 -55.320 -5.365 1.00 0.00 H new ATOM 0 HA LYS B 11 -7.776 -52.930 -5.023 1.00 0.00 H new ATOM 0 HB2 LYS B 11 -8.318 -55.235 -4.184 1.00 0.00 H new ATOM 0 HB3 LYS B 11 -6.920 -55.156 -3.131 1.00 0.00 H new ATOM 0 HG2 LYS B 11 -7.925 -53.180 -1.957 1.00 0.00 H new ATOM 0 HG3 LYS B 11 -9.330 -53.284 -3.000 1.00 0.00 H new ATOM 0 HD2 LYS B 11 -9.797 -55.589 -2.179 1.00 0.00 H new ATOM 0 HD3 LYS B 11 -8.360 -55.539 -1.176 1.00 0.00 H new ATOM 0 HE2 LYS B 11 -10.182 -55.069 0.296 1.00 0.00 H new ATOM 0 HE3 LYS B 11 -9.384 -53.530 0.034 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 -11.776 -53.314 -0.115 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 -11.070 -52.970 -1.620 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 -11.842 -54.460 -1.366 1.00 0.00 H new ATOM 1421 N THR B 12 -6.410 -51.442 -3.519 1.00 0.00 N ATOM 1422 CA THR B 12 -5.599 -50.530 -2.684 1.00 0.00 C ATOM 1423 C THR B 12 -6.173 -50.451 -1.268 1.00 0.00 C ATOM 1424 O THR B 12 -7.321 -50.051 -1.070 1.00 0.00 O ATOM 1425 CB THR B 12 -5.469 -49.133 -3.311 1.00 0.00 C ATOM 1426 OG1 THR B 12 -4.937 -49.246 -4.613 1.00 0.00 O ATOM 1427 CG2 THR B 12 -4.493 -48.244 -2.540 1.00 0.00 C ATOM 0 H THR B 12 -7.317 -51.056 -3.782 1.00 0.00 H new ATOM 0 HA THR B 12 -4.592 -50.943 -2.627 1.00 0.00 H new ATOM 0 HB THR B 12 -6.467 -48.696 -3.300 1.00 0.00 H new ATOM 0 HG1 THR B 12 -5.278 -48.515 -5.170 1.00 0.00 H new ATOM 0 HG21 THR B 12 -4.434 -47.267 -3.020 1.00 0.00 H new ATOM 0 HG22 THR B 12 -4.842 -48.124 -1.515 1.00 0.00 H new ATOM 0 HG23 THR B 12 -3.506 -48.706 -2.535 1.00 0.00 H new ATOM 1435 N ILE B 13 -5.355 -50.818 -0.282 1.00 0.00 N ATOM 1436 CA ILE B 13 -5.626 -50.709 1.158 1.00 0.00 C ATOM 1437 C ILE B 13 -4.988 -49.406 1.666 1.00 0.00 C ATOM 1438 O ILE B 13 -3.870 -49.081 1.269 1.00 0.00 O ATOM 1439 CB ILE B 13 -5.069 -51.953 1.901 1.00 0.00 C ATOM 1440 CG1 ILE B 13 -5.586 -53.284 1.299 1.00 0.00 C ATOM 1441 CG2 ILE B 13 -5.410 -51.886 3.405 1.00 0.00 C ATOM 1442 CD1 ILE B 13 -4.815 -54.519 1.786 1.00 0.00 C ATOM 0 H ILE B 13 -4.437 -51.221 -0.472 1.00 0.00 H new ATOM 0 HA ILE B 13 -6.699 -50.678 1.349 1.00 0.00 H new ATOM 0 HB ILE B 13 -3.987 -51.936 1.774 1.00 0.00 H new ATOM 0 HG12 ILE B 13 -6.640 -53.402 1.550 1.00 0.00 H new ATOM 0 HG13 ILE B 13 -5.521 -53.231 0.212 1.00 0.00 H new ATOM 0 HG21 ILE B 13 -5.011 -52.767 3.908 1.00 0.00 H new ATOM 0 HG22 ILE B 13 -4.968 -50.989 3.839 1.00 0.00 H new ATOM 0 HG23 ILE B 13 -6.492 -51.855 3.532 1.00 0.00 H new ATOM 0 HD11 ILE B 13 -5.232 -55.414 1.324 1.00 0.00 H new ATOM 0 HD12 ILE B 13 -3.765 -54.424 1.511 1.00 0.00 H new ATOM 0 HD13 ILE B 13 -4.901 -54.597 2.870 1.00 0.00 H new ATOM 1454 N THR B 14 -5.658 -48.676 2.562 1.00 0.00 N ATOM 1455 CA THR B 14 -5.076 -47.508 3.259 1.00 0.00 C ATOM 1456 C THR B 14 -4.794 -47.868 4.717 1.00 0.00 C ATOM 1457 O THR B 14 -5.666 -48.427 5.385 1.00 0.00 O ATOM 1458 CB THR B 14 -5.992 -46.274 3.167 1.00 0.00 C ATOM 1459 OG1 THR B 14 -6.368 -46.039 1.826 1.00 0.00 O ATOM 1460 CG2 THR B 14 -5.300 -45.000 3.658 1.00 0.00 C ATOM 0 H THR B 14 -6.622 -48.873 2.830 1.00 0.00 H new ATOM 0 HA THR B 14 -4.139 -47.248 2.766 1.00 0.00 H new ATOM 0 HB THR B 14 -6.855 -46.492 3.796 1.00 0.00 H new ATOM 0 HG1 THR B 14 -5.618 -45.634 1.342 1.00 0.00 H new ATOM 0 HG21 THR B 14 -5.986 -44.157 3.573 1.00 0.00 H new ATOM 0 HG22 THR B 14 -5.005 -45.125 4.700 1.00 0.00 H new ATOM 0 HG23 THR B 14 -4.415 -44.809 3.051 1.00 0.00 H new ATOM 1468 N LEU B 15 -3.594 -47.562 5.216 1.00 0.00 N ATOM 1469 CA LEU B 15 -3.160 -47.861 6.588 1.00 0.00 C ATOM 1470 C LEU B 15 -2.682 -46.591 7.305 1.00 0.00 C ATOM 1471 O LEU B 15 -1.852 -45.850 6.777 1.00 0.00 O ATOM 1472 CB LEU B 15 -2.033 -48.916 6.577 1.00 0.00 C ATOM 1473 CG LEU B 15 -2.339 -50.249 5.874 1.00 0.00 C ATOM 1474 CD1 LEU B 15 -1.101 -51.139 5.940 1.00 0.00 C ATOM 1475 CD2 LEU B 15 -3.494 -51.011 6.524 1.00 0.00 C ATOM 0 H LEU B 15 -2.878 -47.088 4.666 1.00 0.00 H new ATOM 0 HA LEU B 15 -4.017 -48.260 7.131 1.00 0.00 H new ATOM 0 HB2 LEU B 15 -1.158 -48.474 6.101 1.00 0.00 H new ATOM 0 HB3 LEU B 15 -1.759 -49.131 7.610 1.00 0.00 H new ATOM 0 HG LEU B 15 -2.621 -50.011 4.848 1.00 0.00 H new ATOM 0 HD11 LEU B 15 -1.308 -52.087 5.444 1.00 0.00 H new ATOM 0 HD12 LEU B 15 -0.269 -50.642 5.441 1.00 0.00 H new ATOM 0 HD13 LEU B 15 -0.841 -51.324 6.982 1.00 0.00 H new ATOM 0 HD21 LEU B 15 -3.664 -51.943 5.985 1.00 0.00 H new ATOM 0 HD22 LEU B 15 -3.246 -51.232 7.562 1.00 0.00 H new ATOM 0 HD23 LEU B 15 -4.397 -50.402 6.489 1.00 0.00 H new ATOM 1487 N GLU B 16 -3.153 -46.386 8.538 1.00 0.00 N ATOM 1488 CA GLU B 16 -2.678 -45.315 9.421 1.00 0.00 C ATOM 1489 C GLU B 16 -1.468 -45.804 10.229 1.00 0.00 C ATOM 1490 O GLU B 16 -1.551 -46.809 10.943 1.00 0.00 O ATOM 1491 CB GLU B 16 -3.829 -44.835 10.316 1.00 0.00 C ATOM 1492 CG GLU B 16 -3.453 -43.579 11.112 1.00 0.00 C ATOM 1493 CD GLU B 16 -4.663 -43.066 11.913 1.00 0.00 C ATOM 1494 OE1 GLU B 16 -5.579 -42.460 11.304 1.00 0.00 O1- ATOM 1495 OE2 GLU B 16 -4.706 -43.265 13.151 1.00 0.00 O ATOM 0 H GLU B 16 -3.882 -46.964 8.956 1.00 0.00 H new ATOM 0 HA GLU B 16 -2.347 -44.460 8.831 1.00 0.00 H new ATOM 0 HB2 GLU B 16 -4.704 -44.626 9.700 1.00 0.00 H new ATOM 0 HB3 GLU B 16 -4.108 -45.631 11.006 1.00 0.00 H new ATOM 0 HG2 GLU B 16 -2.630 -43.804 11.790 1.00 0.00 H new ATOM 0 HG3 GLU B 16 -3.103 -42.802 10.432 1.00 0.00 H new ATOM 1502 N VAL B 17 -0.337 -45.112 10.091 1.00 0.00 N ATOM 1503 CA VAL B 17 0.983 -45.519 10.607 1.00 0.00 C ATOM 1504 C VAL B 17 1.824 -44.300 10.984 1.00 0.00 C ATOM 1505 O VAL B 17 1.569 -43.194 10.513 1.00 0.00 O ATOM 1506 CB VAL B 17 1.770 -46.345 9.559 1.00 0.00 C ATOM 1507 CG1 VAL B 17 1.085 -47.667 9.195 1.00 0.00 C ATOM 1508 CG2 VAL B 17 2.016 -45.567 8.260 1.00 0.00 C ATOM 0 H VAL B 17 -0.307 -44.219 9.600 1.00 0.00 H new ATOM 0 HA VAL B 17 0.798 -46.131 11.490 1.00 0.00 H new ATOM 0 HB VAL B 17 2.721 -46.558 10.047 1.00 0.00 H new ATOM 0 HG11 VAL B 17 1.687 -48.197 8.457 1.00 0.00 H new ATOM 0 HG12 VAL B 17 0.982 -48.282 10.089 1.00 0.00 H new ATOM 0 HG13 VAL B 17 0.098 -47.463 8.780 1.00 0.00 H new ATOM 0 HG21 VAL B 17 2.571 -46.192 7.561 1.00 0.00 H new ATOM 0 HG22 VAL B 17 1.060 -45.287 7.817 1.00 0.00 H new ATOM 0 HG23 VAL B 17 2.592 -44.667 8.478 1.00 0.00 H new ATOM 1518 N GLU B 18 2.864 -44.495 11.785 1.00 0.00 N ATOM 1519 CA GLU B 18 3.902 -43.497 12.071 1.00 0.00 C ATOM 1520 C GLU B 18 5.242 -43.955 11.458 1.00 0.00 C ATOM 1521 O GLU B 18 5.447 -45.159 11.288 1.00 0.00 O ATOM 1522 CB GLU B 18 4.026 -43.275 13.589 1.00 0.00 C ATOM 1523 CG GLU B 18 2.827 -42.530 14.196 1.00 0.00 C ATOM 1524 CD GLU B 18 2.783 -41.053 13.754 1.00 0.00 C ATOM 1525 OE1 GLU B 18 3.461 -40.209 14.390 1.00 0.00 O ATOM 1526 OE2 GLU B 18 2.072 -40.723 12.773 1.00 0.00 O1- ATOM 0 H GLU B 18 3.018 -45.378 12.272 1.00 0.00 H new ATOM 0 HA GLU B 18 3.625 -42.544 11.620 1.00 0.00 H new ATOM 0 HB2 GLU B 18 4.132 -44.241 14.083 1.00 0.00 H new ATOM 0 HB3 GLU B 18 4.936 -42.711 13.793 1.00 0.00 H new ATOM 0 HG2 GLU B 18 1.903 -43.026 13.898 1.00 0.00 H new ATOM 0 HG3 GLU B 18 2.880 -42.582 15.283 1.00 0.00 H new ATOM 1533 N PRO B 19 6.197 -43.054 11.146 1.00 0.00 N ATOM 1534 CA PRO B 19 7.501 -43.447 10.590 1.00 0.00 C ATOM 1535 C PRO B 19 8.284 -44.447 11.466 1.00 0.00 C ATOM 1536 O PRO B 19 9.080 -45.234 10.955 1.00 0.00 O ATOM 1537 CB PRO B 19 8.271 -42.134 10.404 1.00 0.00 C ATOM 1538 CG PRO B 19 7.167 -41.092 10.234 1.00 0.00 C ATOM 1539 CD PRO B 19 6.074 -41.603 11.168 1.00 0.00 C ATOM 0 HA PRO B 19 7.361 -43.987 9.653 1.00 0.00 H new ATOM 0 HB2 PRO B 19 8.902 -41.913 11.265 1.00 0.00 H new ATOM 0 HB3 PRO B 19 8.924 -42.172 9.532 1.00 0.00 H new ATOM 0 HG2 PRO B 19 7.505 -40.095 10.515 1.00 0.00 H new ATOM 0 HG3 PRO B 19 6.822 -41.033 9.202 1.00 0.00 H new ATOM 0 HD2 PRO B 19 6.205 -41.212 12.177 1.00 0.00 H new ATOM 0 HD3 PRO B 19 5.087 -41.287 10.829 1.00 0.00 H new ATOM 1547 N SER B 20 8.024 -44.449 12.778 1.00 0.00 N ATOM 1548 CA SER B 20 8.595 -45.374 13.764 1.00 0.00 C ATOM 1549 C SER B 20 7.918 -46.758 13.827 1.00 0.00 C ATOM 1550 O SER B 20 8.420 -47.634 14.536 1.00 0.00 O ATOM 1551 CB SER B 20 8.567 -44.707 15.146 1.00 0.00 C ATOM 1552 OG SER B 20 7.245 -44.313 15.483 1.00 0.00 O ATOM 0 H SER B 20 7.383 -43.778 13.200 1.00 0.00 H new ATOM 0 HA SER B 20 9.616 -45.576 13.439 1.00 0.00 H new ATOM 0 HB2 SER B 20 8.949 -45.398 15.897 1.00 0.00 H new ATOM 0 HB3 SER B 20 9.224 -43.837 15.150 1.00 0.00 H new ATOM 0 HG SER B 20 7.245 -43.891 16.368 1.00 0.00 H new ATOM 1558 N ASP B 21 6.818 -47.003 13.100 1.00 0.00 N ATOM 1559 CA ASP B 21 6.214 -48.342 13.018 1.00 0.00 C ATOM 1560 C ASP B 21 7.152 -49.341 12.332 1.00 0.00 C ATOM 1561 O ASP B 21 7.770 -49.042 11.304 1.00 0.00 O ATOM 1562 CB ASP B 21 4.857 -48.337 12.290 1.00 0.00 C ATOM 1563 CG ASP B 21 3.686 -48.063 13.241 1.00 0.00 C ATOM 1564 OD1 ASP B 21 3.506 -48.863 14.191 1.00 0.00 O ATOM 1565 OD2 ASP B 21 2.924 -47.094 13.011 1.00 0.00 O1- ATOM 0 H ASP B 21 6.328 -46.290 12.559 1.00 0.00 H new ATOM 0 HA ASP B 21 6.045 -48.654 14.049 1.00 0.00 H new ATOM 0 HB2 ASP B 21 4.871 -47.579 11.507 1.00 0.00 H new ATOM 0 HB3 ASP B 21 4.707 -49.299 11.800 1.00 0.00 H new ATOM 1570 N THR B 22 7.226 -50.553 12.887 1.00 0.00 N ATOM 1571 CA THR B 22 7.946 -51.682 12.287 1.00 0.00 C ATOM 1572 C THR B 22 7.187 -52.259 11.091 1.00 0.00 C ATOM 1573 O THR B 22 5.962 -52.153 11.004 1.00 0.00 O ATOM 1574 CB THR B 22 8.208 -52.799 13.306 1.00 0.00 C ATOM 1575 OG1 THR B 22 6.984 -53.228 13.855 1.00 0.00 O ATOM 1576 CG2 THR B 22 9.115 -52.352 14.450 1.00 0.00 C ATOM 0 H THR B 22 6.783 -50.782 13.777 1.00 0.00 H new ATOM 0 HA THR B 22 8.903 -51.288 11.946 1.00 0.00 H new ATOM 0 HB THR B 22 8.710 -53.605 12.771 1.00 0.00 H new ATOM 0 HG1 THR B 22 7.150 -53.943 14.505 1.00 0.00 H new ATOM 0 HG21 THR B 22 9.266 -53.182 15.140 1.00 0.00 H new ATOM 0 HG22 THR B 22 10.077 -52.034 14.049 1.00 0.00 H new ATOM 0 HG23 THR B 22 8.650 -51.520 14.979 1.00 0.00 H new ATOM 1584 N ILE B 23 7.887 -52.951 10.189 1.00 0.00 N ATOM 1585 CA ILE B 23 7.226 -53.726 9.126 1.00 0.00 C ATOM 1586 C ILE B 23 6.351 -54.838 9.733 1.00 0.00 C ATOM 1587 O ILE B 23 5.278 -55.120 9.209 1.00 0.00 O ATOM 1588 CB ILE B 23 8.263 -54.273 8.124 1.00 0.00 C ATOM 1589 CG1 ILE B 23 9.190 -53.175 7.553 1.00 0.00 C ATOM 1590 CG2 ILE B 23 7.589 -55.033 6.966 1.00 0.00 C ATOM 1591 CD1 ILE B 23 8.486 -51.996 6.863 1.00 0.00 C ATOM 0 H ILE B 23 8.906 -52.993 10.170 1.00 0.00 H new ATOM 0 HA ILE B 23 6.563 -53.066 8.567 1.00 0.00 H new ATOM 0 HB ILE B 23 8.882 -54.965 8.695 1.00 0.00 H new ATOM 0 HG12 ILE B 23 9.801 -52.783 8.366 1.00 0.00 H new ATOM 0 HG13 ILE B 23 9.870 -53.637 6.837 1.00 0.00 H new ATOM 0 HG21 ILE B 23 8.352 -55.403 6.281 1.00 0.00 H new ATOM 0 HG22 ILE B 23 7.020 -55.873 7.364 1.00 0.00 H new ATOM 0 HG23 ILE B 23 6.917 -54.361 6.432 1.00 0.00 H new ATOM 0 HD11 ILE B 23 9.232 -51.288 6.502 1.00 0.00 H new ATOM 0 HD12 ILE B 23 7.898 -52.365 6.022 1.00 0.00 H new ATOM 0 HD13 ILE B 23 7.828 -51.498 7.575 1.00 0.00 H new ATOM 1603 N GLU B 24 6.727 -55.396 10.889 1.00 0.00 N ATOM 1604 CA GLU B 24 5.876 -56.317 11.657 1.00 0.00 C ATOM 1605 C GLU B 24 4.532 -55.676 12.069 1.00 0.00 C ATOM 1606 O GLU B 24 3.484 -56.308 11.912 1.00 0.00 O ATOM 1607 CB GLU B 24 6.663 -56.820 12.878 1.00 0.00 C ATOM 1608 CG GLU B 24 5.921 -57.915 13.652 1.00 0.00 C ATOM 1609 CD GLU B 24 6.786 -58.450 14.810 1.00 0.00 C ATOM 1610 OE1 GLU B 24 6.834 -57.802 15.884 1.00 0.00 O ATOM 1611 OE2 GLU B 24 7.415 -59.526 14.661 1.00 0.00 O1- ATOM 0 H GLU B 24 7.634 -55.222 11.322 1.00 0.00 H new ATOM 0 HA GLU B 24 5.615 -57.162 11.020 1.00 0.00 H new ATOM 0 HB2 GLU B 24 7.629 -57.204 12.549 1.00 0.00 H new ATOM 0 HB3 GLU B 24 6.864 -55.982 13.546 1.00 0.00 H new ATOM 0 HG2 GLU B 24 4.985 -57.518 14.045 1.00 0.00 H new ATOM 0 HG3 GLU B 24 5.663 -58.732 12.978 1.00 0.00 H new ATOM 1618 N ASN B 25 4.520 -54.406 12.501 1.00 0.00 N ATOM 1619 CA ASN B 25 3.274 -53.673 12.769 1.00 0.00 C ATOM 1620 C ASN B 25 2.445 -53.473 11.487 1.00 0.00 C ATOM 1621 O ASN B 25 1.225 -53.614 11.525 1.00 0.00 O ATOM 1622 CB ASN B 25 3.566 -52.315 13.442 1.00 0.00 C ATOM 1623 CG ASN B 25 4.012 -52.396 14.896 1.00 0.00 C ATOM 1624 OD1 ASN B 25 4.165 -53.451 15.498 1.00 0.00 O ATOM 1625 ND2 ASN B 25 4.200 -51.255 15.521 1.00 0.00 N ATOM 0 H ASN B 25 5.366 -53.862 12.673 1.00 0.00 H new ATOM 0 HA ASN B 25 2.683 -54.279 13.456 1.00 0.00 H new ATOM 0 HB2 ASN B 25 4.339 -51.802 12.869 1.00 0.00 H new ATOM 0 HB3 ASN B 25 2.668 -51.700 13.388 1.00 0.00 H new ATOM 0 HD21 ASN B 25 4.472 -51.251 16.504 1.00 0.00 H new ATOM 0 HD22 ASN B 25 4.074 -50.374 15.023 1.00 0.00 H new ATOM 1632 N VAL B 26 3.078 -53.209 10.336 1.00 0.00 N ATOM 1633 CA VAL B 26 2.368 -53.099 9.043 1.00 0.00 C ATOM 1634 C VAL B 26 1.749 -54.444 8.638 1.00 0.00 C ATOM 1635 O VAL B 26 0.574 -54.480 8.272 1.00 0.00 O ATOM 1636 CB VAL B 26 3.272 -52.517 7.935 1.00 0.00 C ATOM 1637 CG1 VAL B 26 2.514 -52.329 6.615 1.00 0.00 C ATOM 1638 CG2 VAL B 26 3.801 -51.132 8.332 1.00 0.00 C ATOM 0 H VAL B 26 4.086 -53.066 10.268 1.00 0.00 H new ATOM 0 HA VAL B 26 1.550 -52.391 9.176 1.00 0.00 H new ATOM 0 HB VAL B 26 4.084 -53.233 7.807 1.00 0.00 H new ATOM 0 HG11 VAL B 26 3.188 -51.918 5.864 1.00 0.00 H new ATOM 0 HG12 VAL B 26 2.134 -53.292 6.273 1.00 0.00 H new ATOM 0 HG13 VAL B 26 1.680 -51.644 6.769 1.00 0.00 H new ATOM 0 HG21 VAL B 26 4.435 -50.743 7.536 1.00 0.00 H new ATOM 0 HG22 VAL B 26 2.962 -50.454 8.492 1.00 0.00 H new ATOM 0 HG23 VAL B 26 4.382 -51.214 9.251 1.00 0.00 H new ATOM 1648 N LYS B 27 2.465 -55.567 8.805 1.00 0.00 N ATOM 1649 CA LYS B 27 1.900 -56.916 8.589 1.00 0.00 C ATOM 1650 C LYS B 27 0.702 -57.194 9.502 1.00 0.00 C ATOM 1651 O LYS B 27 -0.301 -57.732 9.038 1.00 0.00 O ATOM 1652 CB LYS B 27 2.955 -58.016 8.795 1.00 0.00 C ATOM 1653 CG LYS B 27 4.096 -58.049 7.764 1.00 0.00 C ATOM 1654 CD LYS B 27 5.035 -59.215 8.123 1.00 0.00 C ATOM 1655 CE LYS B 27 6.374 -59.233 7.373 1.00 0.00 C ATOM 1656 NZ LYS B 27 6.246 -59.640 5.947 1.00 0.00 N1+ ATOM 0 H LYS B 27 3.444 -55.571 9.091 1.00 0.00 H new ATOM 0 HA LYS B 27 1.562 -56.935 7.553 1.00 0.00 H new ATOM 0 HB2 LYS B 27 3.390 -57.895 9.787 1.00 0.00 H new ATOM 0 HB3 LYS B 27 2.452 -58.983 8.783 1.00 0.00 H new ATOM 0 HG2 LYS B 27 3.696 -58.179 6.758 1.00 0.00 H new ATOM 0 HG3 LYS B 27 4.642 -57.105 7.771 1.00 0.00 H new ATOM 0 HD2 LYS B 27 5.237 -59.181 9.194 1.00 0.00 H new ATOM 0 HD3 LYS B 27 4.515 -60.153 7.927 1.00 0.00 H new ATOM 0 HE2 LYS B 27 6.823 -58.241 7.421 1.00 0.00 H new ATOM 0 HE3 LYS B 27 7.056 -59.916 7.879 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 7.154 -60.022 5.612 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 5.510 -60.369 5.859 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 5.985 -58.813 5.372 1.00 0.00 H new ATOM 1670 N ALA B 28 0.774 -56.789 10.772 1.00 0.00 N ATOM 1671 CA ALA B 28 -0.317 -56.937 11.741 1.00 0.00 C ATOM 1672 C ALA B 28 -1.543 -56.064 11.395 1.00 0.00 C ATOM 1673 O ALA B 28 -2.676 -56.533 11.491 1.00 0.00 O ATOM 1674 CB ALA B 28 0.229 -56.630 13.140 1.00 0.00 C ATOM 0 H ALA B 28 1.604 -56.342 11.163 1.00 0.00 H new ATOM 0 HA ALA B 28 -0.680 -57.964 11.708 1.00 0.00 H new ATOM 0 HB1 ALA B 28 -0.570 -56.735 13.874 1.00 0.00 H new ATOM 0 HB2 ALA B 28 1.034 -57.326 13.377 1.00 0.00 H new ATOM 0 HB3 ALA B 28 0.612 -55.610 13.165 1.00 0.00 H new ATOM 1680 N LYS B 29 -1.339 -54.833 10.902 1.00 0.00 N ATOM 1681 CA LYS B 29 -2.418 -53.957 10.398 1.00 0.00 C ATOM 1682 C LYS B 29 -3.111 -54.550 9.161 1.00 0.00 C ATOM 1683 O LYS B 29 -4.335 -54.515 9.066 1.00 0.00 O ATOM 1684 CB LYS B 29 -1.850 -52.552 10.120 1.00 0.00 C ATOM 1685 CG LYS B 29 -1.544 -51.783 11.417 1.00 0.00 C ATOM 1686 CD LYS B 29 -0.675 -50.544 11.143 1.00 0.00 C ATOM 1687 CE LYS B 29 -0.353 -49.769 12.432 1.00 0.00 C ATOM 1688 NZ LYS B 29 -1.481 -48.897 12.870 1.00 0.00 N1+ ATOM 0 H LYS B 29 -0.413 -54.410 10.840 1.00 0.00 H new ATOM 0 HA LYS B 29 -3.189 -53.878 11.165 1.00 0.00 H new ATOM 0 HB2 LYS B 29 -0.939 -52.641 9.528 1.00 0.00 H new ATOM 0 HB3 LYS B 29 -2.564 -51.985 9.523 1.00 0.00 H new ATOM 0 HG2 LYS B 29 -2.478 -51.477 11.889 1.00 0.00 H new ATOM 0 HG3 LYS B 29 -1.032 -52.441 12.119 1.00 0.00 H new ATOM 0 HD2 LYS B 29 0.254 -50.852 10.663 1.00 0.00 H new ATOM 0 HD3 LYS B 29 -1.192 -49.886 10.444 1.00 0.00 H new ATOM 0 HE2 LYS B 29 -0.114 -50.475 13.227 1.00 0.00 H new ATOM 0 HE3 LYS B 29 0.535 -49.157 12.272 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 -1.286 -48.529 13.823 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 -1.584 -48.103 12.207 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 -2.361 -49.450 12.886 1.00 0.00 H new ATOM 1702 N ILE B 30 -2.352 -55.178 8.258 1.00 0.00 N ATOM 1703 CA ILE B 30 -2.901 -55.926 7.108 1.00 0.00 C ATOM 1704 C ILE B 30 -3.637 -57.193 7.574 1.00 0.00 C ATOM 1705 O ILE B 30 -4.724 -57.478 7.077 1.00 0.00 O ATOM 1706 CB ILE B 30 -1.783 -56.233 6.083 1.00 0.00 C ATOM 1707 CG1 ILE B 30 -1.259 -54.914 5.469 1.00 0.00 C ATOM 1708 CG2 ILE B 30 -2.272 -57.171 4.961 1.00 0.00 C ATOM 1709 CD1 ILE B 30 0.070 -55.067 4.722 1.00 0.00 C ATOM 0 H ILE B 30 -1.333 -55.186 8.299 1.00 0.00 H new ATOM 0 HA ILE B 30 -3.641 -55.305 6.604 1.00 0.00 H new ATOM 0 HB ILE B 30 -0.978 -56.742 6.614 1.00 0.00 H new ATOM 0 HG12 ILE B 30 -2.008 -54.521 4.782 1.00 0.00 H new ATOM 0 HG13 ILE B 30 -1.136 -54.177 6.263 1.00 0.00 H new ATOM 0 HG21 ILE B 30 -1.456 -57.360 4.264 1.00 0.00 H new ATOM 0 HG22 ILE B 30 -2.605 -58.114 5.394 1.00 0.00 H new ATOM 0 HG23 ILE B 30 -3.101 -56.703 4.431 1.00 0.00 H new ATOM 0 HD11 ILE B 30 0.374 -54.101 4.319 1.00 0.00 H new ATOM 0 HD12 ILE B 30 0.834 -55.430 5.409 1.00 0.00 H new ATOM 0 HD13 ILE B 30 -0.051 -55.779 3.905 1.00 0.00 H new ATOM 1721 N GLN B 31 -3.114 -57.923 8.566 1.00 0.00 N ATOM 1722 CA GLN B 31 -3.792 -59.085 9.159 1.00 0.00 C ATOM 1723 C GLN B 31 -5.137 -58.687 9.800 1.00 0.00 C ATOM 1724 O GLN B 31 -6.126 -59.397 9.634 1.00 0.00 O ATOM 1725 CB GLN B 31 -2.859 -59.758 10.181 1.00 0.00 C ATOM 1726 CG GLN B 31 -3.428 -61.077 10.736 1.00 0.00 C ATOM 1727 CD GLN B 31 -2.562 -61.707 11.830 1.00 0.00 C ATOM 1728 OE1 GLN B 31 -1.620 -61.126 12.355 1.00 0.00 O ATOM 1729 NE2 GLN B 31 -2.857 -62.928 12.228 1.00 0.00 N ATOM 0 H GLN B 31 -2.204 -57.725 8.983 1.00 0.00 H new ATOM 0 HA GLN B 31 -4.020 -59.799 8.368 1.00 0.00 H new ATOM 0 HB2 GLN B 31 -1.895 -59.953 9.711 1.00 0.00 H new ATOM 0 HB3 GLN B 31 -2.678 -59.071 11.007 1.00 0.00 H new ATOM 0 HG2 GLN B 31 -4.425 -60.893 11.135 1.00 0.00 H new ATOM 0 HG3 GLN B 31 -3.538 -61.788 9.917 1.00 0.00 H new ATOM 0 HE21 GLN B 31 -3.638 -63.428 11.803 1.00 0.00 H new ATOM 0 HE22 GLN B 31 -2.305 -63.373 12.961 1.00 0.00 H new ATOM 1738 N ASP B 32 -5.206 -57.537 10.477 1.00 0.00 N ATOM 1739 CA ASP B 32 -6.439 -57.035 11.097 1.00 0.00 C ATOM 1740 C ASP B 32 -7.531 -56.662 10.071 1.00 0.00 C ATOM 1741 O ASP B 32 -8.714 -56.913 10.322 1.00 0.00 O ATOM 1742 CB ASP B 32 -6.092 -55.839 11.994 1.00 0.00 C ATOM 1743 CG ASP B 32 -7.319 -55.345 12.777 1.00 0.00 C ATOM 1744 OD1 ASP B 32 -7.749 -56.042 13.728 1.00 0.00 O ATOM 1745 OD2 ASP B 32 -7.843 -54.251 12.460 1.00 0.00 O1- ATOM 0 H ASP B 32 -4.403 -56.923 10.612 1.00 0.00 H new ATOM 0 HA ASP B 32 -6.865 -57.842 11.694 1.00 0.00 H new ATOM 0 HB2 ASP B 32 -5.304 -56.123 12.692 1.00 0.00 H new ATOM 0 HB3 ASP B 32 -5.698 -55.027 11.383 1.00 0.00 H new ATOM 1750 N LYS B 33 -7.149 -56.111 8.905 1.00 0.00 N ATOM 1751 CA LYS B 33 -8.093 -55.726 7.836 1.00 0.00 C ATOM 1752 C LYS B 33 -8.459 -56.869 6.877 1.00 0.00 C ATOM 1753 O LYS B 33 -9.628 -57.004 6.513 1.00 0.00 O ATOM 1754 CB LYS B 33 -7.562 -54.507 7.060 1.00 0.00 C ATOM 1755 CG LYS B 33 -7.552 -53.233 7.924 1.00 0.00 C ATOM 1756 CD LYS B 33 -7.388 -51.967 7.070 1.00 0.00 C ATOM 1757 CE LYS B 33 -7.439 -50.726 7.973 1.00 0.00 C ATOM 1758 NZ LYS B 33 -7.627 -49.467 7.195 1.00 0.00 N1+ ATOM 0 H LYS B 33 -6.174 -55.919 8.675 1.00 0.00 H new ATOM 0 HA LYS B 33 -9.022 -55.461 8.340 1.00 0.00 H new ATOM 0 HB2 LYS B 33 -6.552 -54.714 6.707 1.00 0.00 H new ATOM 0 HB3 LYS B 33 -8.180 -54.342 6.177 1.00 0.00 H new ATOM 0 HG2 LYS B 33 -8.481 -53.171 8.491 1.00 0.00 H new ATOM 0 HG3 LYS B 33 -6.739 -53.291 8.648 1.00 0.00 H new ATOM 0 HD2 LYS B 33 -6.440 -51.999 6.532 1.00 0.00 H new ATOM 0 HD3 LYS B 33 -8.178 -51.917 6.321 1.00 0.00 H new ATOM 0 HE2 LYS B 33 -8.254 -50.833 8.689 1.00 0.00 H new ATOM 0 HE3 LYS B 33 -6.516 -50.660 8.549 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 -7.740 -48.667 7.850 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 -6.796 -49.305 6.591 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 -8.476 -49.550 6.600 1.00 0.00 H new ATOM 1772 N GLU B 34 -7.488 -57.695 6.479 1.00 0.00 N ATOM 1773 CA GLU B 34 -7.636 -58.697 5.406 1.00 0.00 C ATOM 1774 C GLU B 34 -7.619 -60.164 5.886 1.00 0.00 C ATOM 1775 O GLU B 34 -7.948 -61.065 5.112 1.00 0.00 O ATOM 1776 CB GLU B 34 -6.533 -58.486 4.351 1.00 0.00 C ATOM 1777 CG GLU B 34 -6.483 -57.084 3.730 1.00 0.00 C ATOM 1778 CD GLU B 34 -7.805 -56.693 3.035 1.00 0.00 C ATOM 1779 OE1 GLU B 34 -8.253 -57.422 2.117 1.00 0.00 O ATOM 1780 OE2 GLU B 34 -8.400 -55.648 3.395 1.00 0.00 O1- ATOM 0 H GLU B 34 -6.558 -57.691 6.897 1.00 0.00 H new ATOM 0 HA GLU B 34 -8.627 -58.536 4.982 1.00 0.00 H new ATOM 0 HB2 GLU B 34 -5.568 -58.697 4.811 1.00 0.00 H new ATOM 0 HB3 GLU B 34 -6.672 -59.215 3.553 1.00 0.00 H new ATOM 0 HG2 GLU B 34 -6.256 -56.355 4.508 1.00 0.00 H new ATOM 0 HG3 GLU B 34 -5.670 -57.041 3.006 1.00 0.00 H new ATOM 1787 N GLY B 35 -7.230 -60.429 7.141 1.00 0.00 N ATOM 1788 CA GLY B 35 -7.126 -61.783 7.711 1.00 0.00 C ATOM 1789 C GLY B 35 -5.898 -62.596 7.266 1.00 0.00 C ATOM 1790 O GLY B 35 -5.814 -63.786 7.575 1.00 0.00 O ATOM 0 H GLY B 35 -6.974 -59.696 7.802 1.00 0.00 H new ATOM 0 HA2 GLY B 35 -7.111 -61.701 8.798 1.00 0.00 H new ATOM 0 HA3 GLY B 35 -8.025 -62.340 7.446 1.00 0.00 H new ATOM 1794 N ILE B 36 -4.950 -61.986 6.539 1.00 0.00 N ATOM 1795 CA ILE B 36 -3.801 -62.678 5.922 1.00 0.00 C ATOM 1796 C ILE B 36 -2.685 -62.909 6.963 1.00 0.00 C ATOM 1797 O ILE B 36 -2.203 -61.924 7.534 1.00 0.00 O ATOM 1798 CB ILE B 36 -3.267 -61.886 4.701 1.00 0.00 C ATOM 1799 CG1 ILE B 36 -4.383 -61.604 3.663 1.00 0.00 C ATOM 1800 CG2 ILE B 36 -2.120 -62.663 4.026 1.00 0.00 C ATOM 1801 CD1 ILE B 36 -3.962 -60.668 2.523 1.00 0.00 C ATOM 0 H ILE B 36 -4.957 -60.982 6.359 1.00 0.00 H new ATOM 0 HA ILE B 36 -4.140 -63.650 5.565 1.00 0.00 H new ATOM 0 HB ILE B 36 -2.899 -60.928 5.069 1.00 0.00 H new ATOM 0 HG12 ILE B 36 -4.714 -62.551 3.237 1.00 0.00 H new ATOM 0 HG13 ILE B 36 -5.240 -61.169 4.177 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -1.752 -62.098 3.170 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -1.309 -62.808 4.740 1.00 0.00 H new ATOM 0 HG23 ILE B 36 -2.486 -63.633 3.690 1.00 0.00 H new ATOM 0 HD11 ILE B 36 -4.801 -60.524 1.842 1.00 0.00 H new ATOM 0 HD12 ILE B 36 -3.660 -59.705 2.935 1.00 0.00 H new ATOM 0 HD13 ILE B 36 -3.126 -61.109 1.980 1.00 0.00 H new ATOM 1813 N PRO B 37 -2.201 -64.149 7.186 1.00 0.00 N ATOM 1814 CA PRO B 37 -1.114 -64.429 8.132 1.00 0.00 C ATOM 1815 C PRO B 37 0.194 -63.687 7.787 1.00 0.00 C ATOM 1816 O PRO B 37 0.609 -63.725 6.628 1.00 0.00 O ATOM 1817 CB PRO B 37 -0.910 -65.951 8.093 1.00 0.00 C ATOM 1818 CG PRO B 37 -2.266 -66.480 7.635 1.00 0.00 C ATOM 1819 CD PRO B 37 -2.733 -65.401 6.665 1.00 0.00 C ATOM 0 HA PRO B 37 -1.381 -64.074 9.127 1.00 0.00 H new ATOM 0 HB2 PRO B 37 -0.115 -66.232 7.402 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -0.635 -66.344 9.072 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -2.179 -67.452 7.149 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -2.957 -66.602 8.469 1.00 0.00 H new ATOM 0 HD2 PRO B 37 -2.365 -65.594 5.657 1.00 0.00 H new ATOM 0 HD3 PRO B 37 -3.821 -65.371 6.607 1.00 0.00 H new ATOM 1827 N PRO B 38 0.898 -63.061 8.754 1.00 0.00 N ATOM 1828 CA PRO B 38 2.154 -62.335 8.513 1.00 0.00 C ATOM 1829 C PRO B 38 3.251 -63.143 7.800 1.00 0.00 C ATOM 1830 O PRO B 38 4.008 -62.579 7.013 1.00 0.00 O ATOM 1831 CB PRO B 38 2.616 -61.878 9.903 1.00 0.00 C ATOM 1832 CG PRO B 38 1.298 -61.660 10.637 1.00 0.00 C ATOM 1833 CD PRO B 38 0.447 -62.816 10.119 1.00 0.00 C ATOM 0 HA PRO B 38 1.971 -61.512 7.822 1.00 0.00 H new ATOM 0 HB2 PRO B 38 3.233 -62.631 10.393 1.00 0.00 H new ATOM 0 HB3 PRO B 38 3.208 -60.964 9.853 1.00 0.00 H new ATOM 0 HG2 PRO B 38 1.423 -61.699 11.719 1.00 0.00 H new ATOM 0 HG3 PRO B 38 0.856 -60.692 10.402 1.00 0.00 H new ATOM 0 HD2 PRO B 38 0.575 -63.704 10.738 1.00 0.00 H new ATOM 0 HD3 PRO B 38 -0.613 -62.562 10.141 1.00 0.00 H new ATOM 1841 N ASP B 39 3.301 -64.464 8.005 1.00 0.00 N ATOM 1842 CA ASP B 39 4.248 -65.370 7.331 1.00 0.00 C ATOM 1843 C ASP B 39 3.969 -65.538 5.823 1.00 0.00 C ATOM 1844 O ASP B 39 4.888 -65.840 5.057 1.00 0.00 O ATOM 1845 CB ASP B 39 4.211 -66.742 8.020 1.00 0.00 C ATOM 1846 CG ASP B 39 4.731 -66.680 9.464 1.00 0.00 C ATOM 1847 OD1 ASP B 39 5.971 -66.664 9.659 1.00 0.00 O ATOM 1848 OD2 ASP B 39 3.904 -66.664 10.407 1.00 0.00 O1- ATOM 0 H ASP B 39 2.677 -64.944 8.653 1.00 0.00 H new ATOM 0 HA ASP B 39 5.236 -64.918 7.414 1.00 0.00 H new ATOM 0 HB2 ASP B 39 3.188 -67.119 8.020 1.00 0.00 H new ATOM 0 HB3 ASP B 39 4.812 -67.450 7.449 1.00 0.00 H new ATOM 1853 N GLN B 40 2.722 -65.324 5.384 1.00 0.00 N ATOM 1854 CA GLN B 40 2.309 -65.380 3.974 1.00 0.00 C ATOM 1855 C GLN B 40 2.455 -64.029 3.253 1.00 0.00 C ATOM 1856 O GLN B 40 2.459 -63.992 2.022 1.00 0.00 O ATOM 1857 CB GLN B 40 0.861 -65.894 3.877 1.00 0.00 C ATOM 1858 CG GLN B 40 0.719 -67.341 4.385 1.00 0.00 C ATOM 1859 CD GLN B 40 -0.673 -67.938 4.161 1.00 0.00 C ATOM 1860 OE1 GLN B 40 -1.610 -67.306 3.685 1.00 0.00 O ATOM 1861 NE2 GLN B 40 -0.869 -69.193 4.511 1.00 0.00 N ATOM 0 H GLN B 40 1.952 -65.101 6.015 1.00 0.00 H new ATOM 0 HA GLN B 40 2.980 -66.072 3.466 1.00 0.00 H new ATOM 0 HB2 GLN B 40 0.207 -65.242 4.456 1.00 0.00 H new ATOM 0 HB3 GLN B 40 0.528 -65.841 2.841 1.00 0.00 H new ATOM 0 HG2 GLN B 40 1.458 -67.967 3.884 1.00 0.00 H new ATOM 0 HG3 GLN B 40 0.949 -67.367 5.450 1.00 0.00 H new ATOM 0 HE21 GLN B 40 -0.103 -69.737 4.909 1.00 0.00 H new ATOM 0 HE22 GLN B 40 -1.786 -69.621 4.384 1.00 0.00 H new ATOM 1870 N GLN B 41 2.588 -62.925 3.998 1.00 0.00 N ATOM 1871 CA GLN B 41 2.748 -61.569 3.461 1.00 0.00 C ATOM 1872 C GLN B 41 4.215 -61.235 3.136 1.00 0.00 C ATOM 1873 O GLN B 41 5.091 -61.377 3.990 1.00 0.00 O ATOM 1874 CB GLN B 41 2.236 -60.530 4.476 1.00 0.00 C ATOM 1875 CG GLN B 41 0.753 -60.621 4.874 1.00 0.00 C ATOM 1876 CD GLN B 41 0.398 -59.520 5.875 1.00 0.00 C ATOM 1877 OE1 GLN B 41 0.877 -58.403 5.782 1.00 0.00 O ATOM 1878 NE2 GLN B 41 -0.411 -59.768 6.884 1.00 0.00 N ATOM 0 H GLN B 41 2.587 -62.951 5.018 1.00 0.00 H new ATOM 0 HA GLN B 41 2.168 -61.532 2.539 1.00 0.00 H new ATOM 0 HB2 GLN B 41 2.837 -60.615 5.382 1.00 0.00 H new ATOM 0 HB3 GLN B 41 2.417 -59.537 4.066 1.00 0.00 H new ATOM 0 HG2 GLN B 41 0.126 -60.530 3.987 1.00 0.00 H new ATOM 0 HG3 GLN B 41 0.547 -61.598 5.311 1.00 0.00 H new ATOM 0 HE21 GLN B 41 -0.827 -60.693 6.988 1.00 0.00 H new ATOM 0 HE22 GLN B 41 -0.621 -59.035 7.561 1.00 0.00 H new ATOM 1887 N ARG B 42 4.471 -60.667 1.954 1.00 0.00 N ATOM 1888 CA ARG B 42 5.761 -60.074 1.543 1.00 0.00 C ATOM 1889 C ARG B 42 5.519 -58.628 1.101 1.00 0.00 C ATOM 1890 O ARG B 42 4.768 -58.396 0.162 1.00 0.00 O ATOM 1891 CB ARG B 42 6.384 -60.928 0.420 1.00 0.00 C ATOM 1892 CG ARG B 42 7.030 -62.212 0.960 1.00 0.00 C ATOM 1893 CD ARG B 42 7.615 -63.046 -0.187 1.00 0.00 C ATOM 1894 NE ARG B 42 8.472 -64.135 0.325 1.00 0.00 N ATOM 1895 CZ ARG B 42 9.208 -64.959 -0.400 1.00 0.00 C ATOM 1896 NH1 ARG B 42 9.181 -64.945 -1.703 1.00 0.00 N1+ ATOM 1897 NH2 ARG B 42 9.991 -65.827 0.176 1.00 0.00 N ATOM 0 H ARG B 42 3.762 -60.602 1.224 1.00 0.00 H new ATOM 0 HA ARG B 42 6.466 -60.062 2.374 1.00 0.00 H new ATOM 0 HB2 ARG B 42 5.614 -61.188 -0.306 1.00 0.00 H new ATOM 0 HB3 ARG B 42 7.134 -60.340 -0.108 1.00 0.00 H new ATOM 0 HG2 ARG B 42 7.817 -61.959 1.671 1.00 0.00 H new ATOM 0 HG3 ARG B 42 6.288 -62.799 1.502 1.00 0.00 H new ATOM 0 HD2 ARG B 42 6.805 -63.467 -0.783 1.00 0.00 H new ATOM 0 HD3 ARG B 42 8.196 -62.403 -0.848 1.00 0.00 H new ATOM 0 HE ARG B 42 8.498 -64.263 1.337 1.00 0.00 H new ATOM 0 HH11 ARG B 42 8.579 -64.284 -2.194 1.00 0.00 H new ATOM 0 HH12 ARG B 42 9.762 -65.595 -2.232 1.00 0.00 H new ATOM 0 HH21 ARG B 42 10.039 -65.874 1.194 1.00 0.00 H new ATOM 0 HH22 ARG B 42 10.556 -66.459 -0.391 1.00 0.00 H new ATOM 1911 N LEU B 43 6.120 -57.653 1.784 1.00 0.00 N ATOM 1912 CA LEU B 43 5.941 -56.223 1.490 1.00 0.00 C ATOM 1913 C LEU B 43 7.151 -55.677 0.733 1.00 0.00 C ATOM 1914 O LEU B 43 8.291 -55.909 1.128 1.00 0.00 O ATOM 1915 CB LEU B 43 5.676 -55.440 2.791 1.00 0.00 C ATOM 1916 CG LEU B 43 4.256 -55.629 3.356 1.00 0.00 C ATOM 1917 CD1 LEU B 43 4.187 -55.067 4.775 1.00 0.00 C ATOM 1918 CD2 LEU B 43 3.211 -54.902 2.504 1.00 0.00 C ATOM 0 H LEU B 43 6.751 -57.831 2.565 1.00 0.00 H new ATOM 0 HA LEU B 43 5.071 -56.097 0.846 1.00 0.00 H new ATOM 0 HB2 LEU B 43 6.400 -55.751 3.544 1.00 0.00 H new ATOM 0 HB3 LEU B 43 5.844 -54.379 2.605 1.00 0.00 H new ATOM 0 HG LEU B 43 4.040 -56.697 3.350 1.00 0.00 H new ATOM 0 HD11 LEU B 43 3.181 -55.203 5.171 1.00 0.00 H new ATOM 0 HD12 LEU B 43 4.901 -55.592 5.410 1.00 0.00 H new ATOM 0 HD13 LEU B 43 4.430 -54.005 4.758 1.00 0.00 H new ATOM 0 HD21 LEU B 43 2.221 -55.057 2.932 1.00 0.00 H new ATOM 0 HD22 LEU B 43 3.435 -53.835 2.485 1.00 0.00 H new ATOM 0 HD23 LEU B 43 3.233 -55.295 1.488 1.00 0.00 H new ATOM 1930 N ILE B 44 6.889 -54.960 -0.357 1.00 0.00 N ATOM 1931 CA ILE B 44 7.884 -54.334 -1.230 1.00 0.00 C ATOM 1932 C ILE B 44 7.633 -52.816 -1.281 1.00 0.00 C ATOM 1933 O ILE B 44 6.485 -52.372 -1.303 1.00 0.00 O ATOM 1934 CB ILE B 44 7.858 -55.002 -2.635 1.00 0.00 C ATOM 1935 CG1 ILE B 44 8.400 -56.455 -2.667 1.00 0.00 C ATOM 1936 CG2 ILE B 44 8.692 -54.207 -3.659 1.00 0.00 C ATOM 1937 CD1 ILE B 44 7.495 -57.539 -2.065 1.00 0.00 C ATOM 0 H ILE B 44 5.934 -54.791 -0.672 1.00 0.00 H new ATOM 0 HA ILE B 44 8.888 -54.485 -0.833 1.00 0.00 H new ATOM 0 HB ILE B 44 6.798 -55.012 -2.890 1.00 0.00 H new ATOM 0 HG12 ILE B 44 8.605 -56.720 -3.704 1.00 0.00 H new ATOM 0 HG13 ILE B 44 9.353 -56.475 -2.139 1.00 0.00 H new ATOM 0 HG21 ILE B 44 8.649 -54.705 -4.628 1.00 0.00 H new ATOM 0 HG22 ILE B 44 8.290 -53.198 -3.751 1.00 0.00 H new ATOM 0 HG23 ILE B 44 9.728 -54.155 -3.323 1.00 0.00 H new ATOM 0 HD11 ILE B 44 7.985 -58.509 -2.148 1.00 0.00 H new ATOM 0 HD12 ILE B 44 7.308 -57.315 -1.015 1.00 0.00 H new ATOM 0 HD13 ILE B 44 6.548 -57.564 -2.605 1.00 0.00 H new ATOM 1949 N PHE B 45 8.700 -52.016 -1.327 1.00 0.00 N ATOM 1950 CA PHE B 45 8.664 -50.572 -1.595 1.00 0.00 C ATOM 1951 C PHE B 45 9.844 -50.183 -2.495 1.00 0.00 C ATOM 1952 O PHE B 45 10.966 -50.635 -2.275 1.00 0.00 O ATOM 1953 CB PHE B 45 8.688 -49.778 -0.282 1.00 0.00 C ATOM 1954 CG PHE B 45 8.764 -48.274 -0.461 1.00 0.00 C ATOM 1955 CD1 PHE B 45 7.638 -47.565 -0.917 1.00 0.00 C ATOM 1956 CD2 PHE B 45 9.965 -47.586 -0.202 1.00 0.00 C ATOM 1957 CE1 PHE B 45 7.714 -46.177 -1.126 1.00 0.00 C ATOM 1958 CE2 PHE B 45 10.036 -46.194 -0.394 1.00 0.00 C ATOM 1959 CZ PHE B 45 8.912 -45.490 -0.860 1.00 0.00 C ATOM 0 H PHE B 45 9.646 -52.365 -1.174 1.00 0.00 H new ATOM 0 HA PHE B 45 7.736 -50.329 -2.113 1.00 0.00 H new ATOM 0 HB2 PHE B 45 7.792 -50.019 0.290 1.00 0.00 H new ATOM 0 HB3 PHE B 45 9.542 -50.105 0.311 1.00 0.00 H new ATOM 0 HD1 PHE B 45 6.713 -48.088 -1.107 1.00 0.00 H new ATOM 0 HD2 PHE B 45 10.833 -48.128 0.144 1.00 0.00 H new ATOM 0 HE1 PHE B 45 6.852 -45.638 -1.491 1.00 0.00 H new ATOM 0 HE2 PHE B 45 10.954 -45.666 -0.183 1.00 0.00 H new ATOM 0 HZ PHE B 45 8.968 -44.422 -1.014 1.00 0.00 H new ATOM 1969 N ALA B 46 9.592 -49.373 -3.529 1.00 0.00 N ATOM 1970 CA ALA B 46 10.579 -48.986 -4.544 1.00 0.00 C ATOM 1971 C ALA B 46 11.364 -50.177 -5.158 1.00 0.00 C ATOM 1972 O ALA B 46 12.549 -50.063 -5.482 1.00 0.00 O ATOM 1973 CB ALA B 46 11.458 -47.859 -3.975 1.00 0.00 C ATOM 0 H ALA B 46 8.674 -48.958 -3.687 1.00 0.00 H new ATOM 0 HA ALA B 46 10.051 -48.597 -5.414 1.00 0.00 H new ATOM 0 HB1 ALA B 46 12.196 -47.562 -4.720 1.00 0.00 H new ATOM 0 HB2 ALA B 46 10.833 -47.003 -3.722 1.00 0.00 H new ATOM 0 HB3 ALA B 46 11.969 -48.213 -3.079 1.00 0.00 H new ATOM 1979 N GLY B 47 10.710 -51.340 -5.286 1.00 0.00 N ATOM 1980 CA GLY B 47 11.305 -52.594 -5.777 1.00 0.00 C ATOM 1981 C GLY B 47 12.155 -53.382 -4.760 1.00 0.00 C ATOM 1982 O GLY B 47 12.654 -54.456 -5.104 1.00 0.00 O ATOM 0 H GLY B 47 9.724 -51.439 -5.044 1.00 0.00 H new ATOM 0 HA2 GLY B 47 10.501 -53.241 -6.128 1.00 0.00 H new ATOM 0 HA3 GLY B 47 11.929 -52.363 -6.641 1.00 0.00 H new ATOM 1986 N LYS B 48 12.307 -52.895 -3.518 1.00 0.00 N ATOM 1987 CA LYS B 48 13.047 -53.549 -2.417 1.00 0.00 C ATOM 1988 C LYS B 48 12.090 -54.240 -1.441 1.00 0.00 C ATOM 1989 O LYS B 48 11.084 -53.650 -1.053 1.00 0.00 O ATOM 1990 CB LYS B 48 13.905 -52.506 -1.673 1.00 0.00 C ATOM 1991 CG LYS B 48 14.959 -51.845 -2.578 1.00 0.00 C ATOM 1992 CD LYS B 48 15.841 -50.833 -1.829 1.00 0.00 C ATOM 1993 CE LYS B 48 15.045 -49.607 -1.353 1.00 0.00 C ATOM 1994 NZ LYS B 48 15.935 -48.589 -0.726 1.00 0.00 N1+ ATOM 0 H LYS B 48 11.904 -52.001 -3.238 1.00 0.00 H new ATOM 0 HA LYS B 48 13.697 -54.312 -2.846 1.00 0.00 H new ATOM 0 HB2 LYS B 48 13.254 -51.736 -1.259 1.00 0.00 H new ATOM 0 HB3 LYS B 48 14.405 -52.987 -0.832 1.00 0.00 H new ATOM 0 HG2 LYS B 48 15.592 -52.618 -3.014 1.00 0.00 H new ATOM 0 HG3 LYS B 48 14.457 -51.341 -3.403 1.00 0.00 H new ATOM 0 HD2 LYS B 48 16.301 -51.321 -0.970 1.00 0.00 H new ATOM 0 HD3 LYS B 48 16.651 -50.507 -2.482 1.00 0.00 H new ATOM 0 HE2 LYS B 48 14.520 -49.162 -2.198 1.00 0.00 H new ATOM 0 HE3 LYS B 48 14.286 -49.920 -0.636 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 15.367 -47.775 -0.416 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 16.417 -49.008 0.095 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 16.643 -48.273 -1.419 1.00 0.00 H new ATOM 2008 N GLN B 49 12.398 -55.467 -1.018 1.00 0.00 N ATOM 2009 CA GLN B 49 11.604 -56.199 -0.017 1.00 0.00 C ATOM 2010 C GLN B 49 11.931 -55.726 1.413 1.00 0.00 C ATOM 2011 O GLN B 49 13.091 -55.458 1.740 1.00 0.00 O ATOM 2012 CB GLN B 49 11.798 -57.713 -0.206 1.00 0.00 C ATOM 2013 CG GLN B 49 10.806 -58.543 0.627 1.00 0.00 C ATOM 2014 CD GLN B 49 10.928 -60.037 0.330 1.00 0.00 C ATOM 2015 OE1 GLN B 49 10.162 -60.609 -0.432 1.00 0.00 O ATOM 2016 NE2 GLN B 49 11.893 -60.724 0.908 1.00 0.00 N ATOM 0 H GLN B 49 13.207 -55.987 -1.358 1.00 0.00 H new ATOM 0 HA GLN B 49 10.547 -55.982 -0.168 1.00 0.00 H new ATOM 0 HB2 GLN B 49 11.679 -57.962 -1.260 1.00 0.00 H new ATOM 0 HB3 GLN B 49 12.817 -57.983 0.073 1.00 0.00 H new ATOM 0 HG2 GLN B 49 10.986 -58.367 1.688 1.00 0.00 H new ATOM 0 HG3 GLN B 49 9.789 -58.212 0.417 1.00 0.00 H new ATOM 0 HE21 GLN B 49 12.539 -60.259 1.546 1.00 0.00 H new ATOM 0 HE22 GLN B 49 11.994 -61.721 0.717 1.00 0.00 H new ATOM 2025 N LEU B 50 10.904 -55.623 2.260 1.00 0.00 N ATOM 2026 CA LEU B 50 10.968 -55.017 3.595 1.00 0.00 C ATOM 2027 C LEU B 50 11.022 -56.080 4.711 1.00 0.00 C ATOM 2028 O LEU B 50 10.411 -57.145 4.594 1.00 0.00 O ATOM 2029 CB LEU B 50 9.791 -54.033 3.761 1.00 0.00 C ATOM 2030 CG LEU B 50 9.571 -53.035 2.602 1.00 0.00 C ATOM 2031 CD1 LEU B 50 8.423 -52.089 2.953 1.00 0.00 C ATOM 2032 CD2 LEU B 50 10.814 -52.202 2.302 1.00 0.00 C ATOM 0 H LEU B 50 9.973 -55.970 2.029 1.00 0.00 H new ATOM 0 HA LEU B 50 11.898 -54.457 3.690 1.00 0.00 H new ATOM 0 HB2 LEU B 50 8.877 -54.611 3.894 1.00 0.00 H new ATOM 0 HB3 LEU B 50 9.945 -53.465 4.678 1.00 0.00 H new ATOM 0 HG LEU B 50 9.338 -53.623 1.714 1.00 0.00 H new ATOM 0 HD11 LEU B 50 8.268 -51.385 2.135 1.00 0.00 H new ATOM 0 HD12 LEU B 50 7.512 -52.666 3.113 1.00 0.00 H new ATOM 0 HD13 LEU B 50 8.669 -51.540 3.862 1.00 0.00 H new ATOM 0 HD21 LEU B 50 10.604 -51.518 1.480 1.00 0.00 H new ATOM 0 HD22 LEU B 50 11.091 -51.630 3.188 1.00 0.00 H new ATOM 0 HD23 LEU B 50 11.636 -52.862 2.024 1.00 0.00 H new ATOM 2044 N GLU B 51 11.748 -55.795 5.797 1.00 0.00 N ATOM 2045 CA GLU B 51 12.088 -56.759 6.860 1.00 0.00 C ATOM 2046 C GLU B 51 11.424 -56.427 8.207 1.00 0.00 C ATOM 2047 O GLU B 51 11.411 -55.275 8.635 1.00 0.00 O ATOM 2048 CB GLU B 51 13.616 -56.832 7.034 1.00 0.00 C ATOM 2049 CG GLU B 51 14.342 -57.330 5.776 1.00 0.00 C ATOM 2050 CD GLU B 51 15.857 -57.434 6.025 1.00 0.00 C ATOM 2051 OE1 GLU B 51 16.325 -58.493 6.513 1.00 0.00 O1- ATOM 2052 OE2 GLU B 51 16.596 -56.463 5.727 1.00 0.00 O ATOM 0 H GLU B 51 12.128 -54.864 5.970 1.00 0.00 H new ATOM 0 HA GLU B 51 11.699 -57.727 6.544 1.00 0.00 H new ATOM 0 HB2 GLU B 51 13.993 -55.844 7.297 1.00 0.00 H new ATOM 0 HB3 GLU B 51 13.850 -57.495 7.867 1.00 0.00 H new ATOM 0 HG2 GLU B 51 13.949 -58.304 5.485 1.00 0.00 H new ATOM 0 HG3 GLU B 51 14.151 -56.649 4.947 1.00 0.00 H new ATOM 2059 N ASP B 52 10.912 -57.447 8.908 1.00 0.00 N ATOM 2060 CA ASP B 52 10.074 -57.329 10.117 1.00 0.00 C ATOM 2061 C ASP B 52 10.644 -56.408 11.209 1.00 0.00 C ATOM 2062 O ASP B 52 9.903 -55.613 11.791 1.00 0.00 O ATOM 2063 CB ASP B 52 9.876 -58.728 10.720 1.00 0.00 C ATOM 2064 CG ASP B 52 8.917 -59.586 9.887 1.00 0.00 C ATOM 2065 OD1 ASP B 52 9.355 -60.171 8.867 1.00 0.00 O ATOM 2066 OD2 ASP B 52 7.722 -59.670 10.253 1.00 0.00 O1- ATOM 0 H ASP B 52 11.075 -58.418 8.641 1.00 0.00 H new ATOM 0 HA ASP B 52 9.138 -56.876 9.790 1.00 0.00 H new ATOM 0 HB2 ASP B 52 10.841 -59.230 10.793 1.00 0.00 H new ATOM 0 HB3 ASP B 52 9.489 -58.633 11.734 1.00 0.00 H new ATOM 2071 N GLY B 53 11.952 -56.511 11.476 1.00 0.00 N ATOM 2072 CA GLY B 53 12.653 -55.762 12.529 1.00 0.00 C ATOM 2073 C GLY B 53 13.051 -54.326 12.159 1.00 0.00 C ATOM 2074 O GLY B 53 13.575 -53.605 13.013 1.00 0.00 O ATOM 0 H GLY B 53 12.568 -57.133 10.953 1.00 0.00 H new ATOM 0 HA2 GLY B 53 12.017 -55.729 13.413 1.00 0.00 H new ATOM 0 HA3 GLY B 53 13.553 -56.311 12.805 1.00 0.00 H new ATOM 2078 N ARG B 54 12.824 -53.899 10.909 1.00 0.00 N ATOM 2079 CA ARG B 54 13.058 -52.525 10.428 1.00 0.00 C ATOM 2080 C ARG B 54 11.780 -51.689 10.518 1.00 0.00 C ATOM 2081 O ARG B 54 10.681 -52.227 10.658 1.00 0.00 O ATOM 2082 CB ARG B 54 13.616 -52.562 8.992 1.00 0.00 C ATOM 2083 CG ARG B 54 14.969 -53.277 8.845 1.00 0.00 C ATOM 2084 CD ARG B 54 16.105 -52.583 9.609 1.00 0.00 C ATOM 2085 NE ARG B 54 17.400 -53.248 9.354 1.00 0.00 N ATOM 2086 CZ ARG B 54 17.922 -54.279 9.999 1.00 0.00 C ATOM 2087 NH1 ARG B 54 17.325 -54.842 11.015 1.00 0.00 N1+ ATOM 2088 NH2 ARG B 54 19.070 -54.769 9.631 1.00 0.00 N ATOM 0 H ARG B 54 12.462 -54.516 10.182 1.00 0.00 H new ATOM 0 HA ARG B 54 13.798 -52.045 11.068 1.00 0.00 H new ATOM 0 HB2 ARG B 54 12.888 -53.055 8.347 1.00 0.00 H new ATOM 0 HB3 ARG B 54 13.720 -51.539 8.631 1.00 0.00 H new ATOM 0 HG2 ARG B 54 14.872 -54.302 9.203 1.00 0.00 H new ATOM 0 HG3 ARG B 54 15.231 -53.332 7.788 1.00 0.00 H new ATOM 0 HD2 ARG B 54 16.164 -51.537 9.308 1.00 0.00 H new ATOM 0 HD3 ARG B 54 15.890 -52.596 10.678 1.00 0.00 H new ATOM 0 HE ARG B 54 17.958 -52.867 8.590 1.00 0.00 H new ATOM 0 HH11 ARG B 54 16.424 -54.488 11.337 1.00 0.00 H new ATOM 0 HH12 ARG B 54 17.760 -55.635 11.486 1.00 0.00 H new ATOM 0 HH21 ARG B 54 19.571 -54.358 8.843 1.00 0.00 H new ATOM 0 HH22 ARG B 54 19.469 -55.564 10.131 1.00 0.00 H new ATOM 2102 N THR B 55 11.919 -50.370 10.440 1.00 0.00 N ATOM 2103 CA THR B 55 10.826 -49.388 10.523 1.00 0.00 C ATOM 2104 C THR B 55 10.637 -48.610 9.223 1.00 0.00 C ATOM 2105 O THR B 55 11.531 -48.567 8.378 1.00 0.00 O ATOM 2106 CB THR B 55 11.026 -48.411 11.693 1.00 0.00 C ATOM 2107 OG1 THR B 55 12.186 -47.634 11.515 1.00 0.00 O ATOM 2108 CG2 THR B 55 11.131 -49.116 13.046 1.00 0.00 C ATOM 0 H THR B 55 12.830 -49.930 10.312 1.00 0.00 H new ATOM 0 HA THR B 55 9.919 -49.966 10.701 1.00 0.00 H new ATOM 0 HB THR B 55 10.139 -47.778 11.696 1.00 0.00 H new ATOM 0 HG1 THR B 55 12.962 -48.224 11.415 1.00 0.00 H new ATOM 0 HG21 THR B 55 11.271 -48.375 13.833 1.00 0.00 H new ATOM 0 HG22 THR B 55 10.216 -49.678 13.236 1.00 0.00 H new ATOM 0 HG23 THR B 55 11.980 -49.799 13.035 1.00 0.00 H new ATOM 2116 N LEU B 56 9.476 -47.974 9.047 1.00 0.00 N ATOM 2117 CA LEU B 56 9.159 -47.207 7.834 1.00 0.00 C ATOM 2118 C LEU B 56 10.179 -46.084 7.546 1.00 0.00 C ATOM 2119 O LEU B 56 10.525 -45.858 6.384 1.00 0.00 O ATOM 2120 CB LEU B 56 7.719 -46.663 7.950 1.00 0.00 C ATOM 2121 CG LEU B 56 6.617 -47.741 7.941 1.00 0.00 C ATOM 2122 CD1 LEU B 56 5.251 -47.075 8.083 1.00 0.00 C ATOM 2123 CD2 LEU B 56 6.605 -48.547 6.640 1.00 0.00 C ATOM 0 H LEU B 56 8.728 -47.975 9.740 1.00 0.00 H new ATOM 0 HA LEU B 56 9.227 -47.877 6.977 1.00 0.00 H new ATOM 0 HB2 LEU B 56 7.637 -46.087 8.872 1.00 0.00 H new ATOM 0 HB3 LEU B 56 7.539 -45.973 7.126 1.00 0.00 H new ATOM 0 HG LEU B 56 6.825 -48.415 8.772 1.00 0.00 H new ATOM 0 HD11 LEU B 56 4.472 -47.837 8.077 1.00 0.00 H new ATOM 0 HD12 LEU B 56 5.211 -46.523 9.022 1.00 0.00 H new ATOM 0 HD13 LEU B 56 5.093 -46.388 7.252 1.00 0.00 H new ATOM 0 HD21 LEU B 56 5.812 -49.293 6.682 1.00 0.00 H new ATOM 0 HD22 LEU B 56 6.429 -47.877 5.799 1.00 0.00 H new ATOM 0 HD23 LEU B 56 7.566 -49.045 6.512 1.00 0.00 H new ATOM 2135 N SER B 57 10.731 -45.438 8.579 1.00 0.00 N ATOM 2136 CA SER B 57 11.785 -44.424 8.432 1.00 0.00 C ATOM 2137 C SER B 57 13.149 -44.994 8.005 1.00 0.00 C ATOM 2138 O SER B 57 13.912 -44.280 7.351 1.00 0.00 O ATOM 2139 CB SER B 57 11.934 -43.603 9.720 1.00 0.00 C ATOM 2140 OG SER B 57 12.369 -44.411 10.797 1.00 0.00 O ATOM 0 H SER B 57 10.458 -45.604 9.548 1.00 0.00 H new ATOM 0 HA SER B 57 11.457 -43.778 7.618 1.00 0.00 H new ATOM 0 HB2 SER B 57 12.647 -42.794 9.558 1.00 0.00 H new ATOM 0 HB3 SER B 57 10.979 -43.141 9.972 1.00 0.00 H new ATOM 0 HG SER B 57 12.456 -43.861 11.604 1.00 0.00 H new ATOM 2146 N ASP B 58 13.451 -46.274 8.270 1.00 0.00 N ATOM 2147 CA ASP B 58 14.679 -46.927 7.772 1.00 0.00 C ATOM 2148 C ASP B 58 14.672 -47.065 6.236 1.00 0.00 C ATOM 2149 O ASP B 58 15.729 -47.030 5.600 1.00 0.00 O ATOM 2150 CB ASP B 58 14.876 -48.313 8.407 1.00 0.00 C ATOM 2151 CG ASP B 58 15.071 -48.267 9.931 1.00 0.00 C ATOM 2152 OD1 ASP B 58 16.015 -47.589 10.403 1.00 0.00 O ATOM 2153 OD2 ASP B 58 14.302 -48.947 10.652 1.00 0.00 O1- ATOM 0 H ASP B 58 12.858 -46.885 8.831 1.00 0.00 H new ATOM 0 HA ASP B 58 15.509 -46.283 8.060 1.00 0.00 H new ATOM 0 HB2 ASP B 58 14.011 -48.935 8.178 1.00 0.00 H new ATOM 0 HB3 ASP B 58 15.743 -48.792 7.952 1.00 0.00 H new ATOM 2158 N TYR B 59 13.477 -47.166 5.640 1.00 0.00 N ATOM 2159 CA TYR B 59 13.244 -47.206 4.191 1.00 0.00 C ATOM 2160 C TYR B 59 12.860 -45.837 3.592 1.00 0.00 C ATOM 2161 O TYR B 59 12.556 -45.748 2.401 1.00 0.00 O ATOM 2162 CB TYR B 59 12.187 -48.280 3.898 1.00 0.00 C ATOM 2163 CG TYR B 59 12.591 -49.672 4.344 1.00 0.00 C ATOM 2164 CD1 TYR B 59 13.621 -50.353 3.663 1.00 0.00 C ATOM 2165 CD2 TYR B 59 11.936 -50.291 5.427 1.00 0.00 C ATOM 2166 CE1 TYR B 59 13.994 -51.652 4.058 1.00 0.00 C ATOM 2167 CE2 TYR B 59 12.295 -51.596 5.814 1.00 0.00 C ATOM 2168 CZ TYR B 59 13.326 -52.277 5.133 1.00 0.00 C ATOM 2169 OH TYR B 59 13.668 -53.538 5.507 1.00 0.00 O ATOM 0 H TYR B 59 12.611 -47.224 6.176 1.00 0.00 H new ATOM 0 HA TYR B 59 14.182 -47.465 3.700 1.00 0.00 H new ATOM 0 HB2 TYR B 59 11.256 -48.005 4.394 1.00 0.00 H new ATOM 0 HB3 TYR B 59 11.985 -48.296 2.827 1.00 0.00 H new ATOM 0 HD1 TYR B 59 14.126 -49.877 2.835 1.00 0.00 H new ATOM 0 HD2 TYR B 59 11.158 -49.764 5.960 1.00 0.00 H new ATOM 0 HE1 TYR B 59 14.789 -52.169 3.540 1.00 0.00 H new ATOM 0 HE2 TYR B 59 11.781 -52.076 6.633 1.00 0.00 H new ATOM 0 HH TYR B 59 14.640 -53.594 5.618 1.00 0.00 H new ATOM 2179 N ASN B 60 12.870 -44.766 4.400 1.00 0.00 N ATOM 2180 CA ASN B 60 12.418 -43.410 4.048 1.00 0.00 C ATOM 2181 C ASN B 60 10.972 -43.349 3.491 1.00 0.00 C ATOM 2182 O ASN B 60 10.644 -42.481 2.677 1.00 0.00 O ATOM 2183 CB ASN B 60 13.468 -42.701 3.166 1.00 0.00 C ATOM 2184 CG ASN B 60 14.830 -42.594 3.834 1.00 0.00 C ATOM 2185 OD1 ASN B 60 15.047 -41.780 4.721 1.00 0.00 O ATOM 2186 ND2 ASN B 60 15.789 -43.404 3.440 1.00 0.00 N ATOM 0 H ASN B 60 13.209 -44.824 5.360 1.00 0.00 H new ATOM 0 HA ASN B 60 12.344 -42.843 4.976 1.00 0.00 H new ATOM 0 HB2 ASN B 60 13.572 -43.244 2.227 1.00 0.00 H new ATOM 0 HB3 ASN B 60 13.111 -41.701 2.918 1.00 0.00 H new ATOM 0 HD21 ASN B 60 16.711 -43.352 3.874 1.00 0.00 H new ATOM 0 HD22 ASN B 60 15.611 -44.084 2.701 1.00 0.00 H new ATOM 2193 N ILE B 61 10.093 -44.256 3.939 1.00 0.00 N ATOM 2194 CA ILE B 61 8.663 -44.269 3.591 1.00 0.00 C ATOM 2195 C ILE B 61 7.966 -43.082 4.282 1.00 0.00 C ATOM 2196 O ILE B 61 8.238 -42.777 5.447 1.00 0.00 O ATOM 2197 CB ILE B 61 8.040 -45.648 3.920 1.00 0.00 C ATOM 2198 CG1 ILE B 61 8.653 -46.732 3.001 1.00 0.00 C ATOM 2199 CG2 ILE B 61 6.509 -45.627 3.756 1.00 0.00 C ATOM 2200 CD1 ILE B 61 8.350 -48.180 3.410 1.00 0.00 C ATOM 0 H ILE B 61 10.360 -45.016 4.565 1.00 0.00 H new ATOM 0 HA ILE B 61 8.523 -44.136 2.518 1.00 0.00 H new ATOM 0 HB ILE B 61 8.263 -45.880 4.961 1.00 0.00 H new ATOM 0 HG12 ILE B 61 8.289 -46.574 1.986 1.00 0.00 H new ATOM 0 HG13 ILE B 61 9.734 -46.596 2.977 1.00 0.00 H new ATOM 0 HG21 ILE B 61 6.104 -46.610 3.995 1.00 0.00 H new ATOM 0 HG22 ILE B 61 6.081 -44.885 4.430 1.00 0.00 H new ATOM 0 HG23 ILE B 61 6.257 -45.371 2.727 1.00 0.00 H new ATOM 0 HD11 ILE B 61 8.823 -48.864 2.705 1.00 0.00 H new ATOM 0 HD12 ILE B 61 8.740 -48.364 4.411 1.00 0.00 H new ATOM 0 HD13 ILE B 61 7.272 -48.342 3.405 1.00 0.00 H new ATOM 2212 N GLN B 62 7.086 -42.396 3.547 1.00 0.00 N ATOM 2213 CA GLN B 62 6.469 -41.113 3.918 1.00 0.00 C ATOM 2214 C GLN B 62 4.938 -41.139 3.729 1.00 0.00 C ATOM 2215 O GLN B 62 4.365 -42.152 3.325 1.00 0.00 O ATOM 2216 CB GLN B 62 7.142 -40.020 3.058 1.00 0.00 C ATOM 2217 CG GLN B 62 8.575 -39.700 3.519 1.00 0.00 C ATOM 2218 CD GLN B 62 9.386 -39.030 2.414 1.00 0.00 C ATOM 2219 OE1 GLN B 62 9.256 -37.844 2.137 1.00 0.00 O ATOM 2220 NE2 GLN B 62 10.235 -39.765 1.725 1.00 0.00 N ATOM 0 H GLN B 62 6.769 -42.731 2.638 1.00 0.00 H new ATOM 0 HA GLN B 62 6.625 -40.907 4.977 1.00 0.00 H new ATOM 0 HB2 GLN B 62 7.163 -40.344 2.017 1.00 0.00 H new ATOM 0 HB3 GLN B 62 6.541 -39.112 3.097 1.00 0.00 H new ATOM 0 HG2 GLN B 62 8.540 -39.047 4.391 1.00 0.00 H new ATOM 0 HG3 GLN B 62 9.072 -40.619 3.829 1.00 0.00 H new ATOM 0 HE21 GLN B 62 10.351 -40.754 1.947 1.00 0.00 H new ATOM 0 HE22 GLN B 62 10.776 -39.345 0.969 1.00 0.00 H new ATOM 2229 N LYS B 63 4.262 -40.015 4.006 1.00 0.00 N ATOM 2230 CA LYS B 63 2.828 -39.874 3.727 1.00 0.00 C ATOM 2231 C LYS B 63 2.514 -40.136 2.243 1.00 0.00 C ATOM 2232 O LYS B 63 3.251 -39.705 1.354 1.00 0.00 O ATOM 2233 CB LYS B 63 2.289 -38.504 4.186 1.00 0.00 C ATOM 2234 CG LYS B 63 2.897 -37.281 3.473 1.00 0.00 C ATOM 2235 CD LYS B 63 2.060 -36.020 3.729 1.00 0.00 C ATOM 2236 CE LYS B 63 2.610 -34.817 2.954 1.00 0.00 C ATOM 2237 NZ LYS B 63 3.770 -34.251 3.635 1.00 0.00 N ATOM 0 H LYS B 63 4.688 -39.188 4.425 1.00 0.00 H new ATOM 0 HA LYS B 63 2.310 -40.635 4.310 1.00 0.00 H new ATOM 0 HB2 LYS B 63 1.209 -38.490 4.038 1.00 0.00 H new ATOM 0 HB3 LYS B 63 2.465 -38.404 5.257 1.00 0.00 H new ATOM 0 HG2 LYS B 63 3.917 -37.122 3.823 1.00 0.00 H new ATOM 0 HG3 LYS B 63 2.954 -37.472 2.401 1.00 0.00 H new ATOM 0 HD2 LYS B 63 1.026 -36.202 3.436 1.00 0.00 H new ATOM 0 HD3 LYS B 63 2.054 -35.796 4.796 1.00 0.00 H new ATOM 0 HE2 LYS B 63 2.888 -35.124 1.946 1.00 0.00 H new ATOM 0 HE3 LYS B 63 1.835 -34.057 2.854 1.00 0.00 H new ATOM 0 HZ1 LYS B 63 4.127 -33.438 3.094 1.00 0.00 H new ATOM 0 HZ2 LYS B 63 3.495 -33.939 4.588 1.00 0.00 H new ATOM 0 HZ3 LYS B 63 4.516 -34.972 3.709 1.00 0.00 H new ATOM 2249 N GLU B 64 1.409 -40.833 1.973 1.00 0.00 N ATOM 2250 CA GLU B 64 0.929 -41.194 0.627 1.00 0.00 C ATOM 2251 C GLU B 64 1.891 -42.078 -0.205 1.00 0.00 C ATOM 2252 O GLU B 64 1.667 -42.271 -1.404 1.00 0.00 O ATOM 2253 CB GLU B 64 0.445 -39.943 -0.140 1.00 0.00 C ATOM 2254 CG GLU B 64 -0.620 -39.140 0.619 1.00 0.00 C ATOM 2255 CD GLU B 64 -1.111 -37.954 -0.231 1.00 0.00 C ATOM 2256 OE1 GLU B 64 -0.470 -36.874 -0.199 1.00 0.00 O ATOM 2257 OE2 GLU B 64 -2.145 -38.089 -0.932 1.00 0.00 O1- ATOM 0 H GLU B 64 0.796 -41.178 2.712 1.00 0.00 H new ATOM 0 HA GLU B 64 0.072 -41.848 0.790 1.00 0.00 H new ATOM 0 HB2 GLU B 64 1.299 -39.298 -0.345 1.00 0.00 H new ATOM 0 HB3 GLU B 64 0.040 -40.251 -1.104 1.00 0.00 H new ATOM 0 HG2 GLU B 64 -1.460 -39.787 0.871 1.00 0.00 H new ATOM 0 HG3 GLU B 64 -0.207 -38.774 1.559 1.00 0.00 H new ATOM 2264 N SER B 65 2.935 -42.659 0.405 1.00 0.00 N ATOM 2265 CA SER B 65 3.789 -43.674 -0.237 1.00 0.00 C ATOM 2266 C SER B 65 3.003 -44.957 -0.563 1.00 0.00 C ATOM 2267 O SER B 65 2.155 -45.391 0.224 1.00 0.00 O ATOM 2268 CB SER B 65 4.977 -44.032 0.665 1.00 0.00 C ATOM 2269 OG SER B 65 5.913 -42.968 0.764 1.00 0.00 O ATOM 0 H SER B 65 3.213 -42.438 1.361 1.00 0.00 H new ATOM 0 HA SER B 65 4.151 -43.240 -1.169 1.00 0.00 H new ATOM 0 HB2 SER B 65 4.612 -44.287 1.660 1.00 0.00 H new ATOM 0 HB3 SER B 65 5.476 -44.918 0.272 1.00 0.00 H new ATOM 0 HG SER B 65 6.823 -43.331 0.747 1.00 0.00 H new ATOM 2275 N THR B 66 3.323 -45.589 -1.699 1.00 0.00 N ATOM 2276 CA THR B 66 2.686 -46.837 -2.166 1.00 0.00 C ATOM 2277 C THR B 66 3.607 -48.035 -1.949 1.00 0.00 C ATOM 2278 O THR B 66 4.667 -48.128 -2.569 1.00 0.00 O ATOM 2279 CB THR B 66 2.317 -46.776 -3.660 1.00 0.00 C ATOM 2280 OG1 THR B 66 1.657 -45.581 -4.000 1.00 0.00 O ATOM 2281 CG2 THR B 66 1.398 -47.932 -4.071 1.00 0.00 C ATOM 0 H THR B 66 4.044 -45.245 -2.334 1.00 0.00 H new ATOM 0 HA THR B 66 1.775 -46.951 -1.579 1.00 0.00 H new ATOM 0 HB THR B 66 3.268 -46.840 -4.188 1.00 0.00 H new ATOM 0 HG1 THR B 66 2.167 -45.111 -4.693 1.00 0.00 H new ATOM 0 HG21 THR B 66 1.163 -47.850 -5.132 1.00 0.00 H new ATOM 0 HG22 THR B 66 1.900 -48.881 -3.883 1.00 0.00 H new ATOM 0 HG23 THR B 66 0.476 -47.888 -3.491 1.00 0.00 H new ATOM 2289 N LEU B 67 3.184 -48.969 -1.098 1.00 0.00 N ATOM 2290 CA LEU B 67 3.803 -50.282 -0.906 1.00 0.00 C ATOM 2291 C LEU B 67 3.068 -51.330 -1.758 1.00 0.00 C ATOM 2292 O LEU B 67 1.897 -51.163 -2.108 1.00 0.00 O ATOM 2293 CB LEU B 67 3.779 -50.678 0.587 1.00 0.00 C ATOM 2294 CG LEU B 67 4.700 -49.890 1.542 1.00 0.00 C ATOM 2295 CD1 LEU B 67 4.296 -48.426 1.733 1.00 0.00 C ATOM 2296 CD2 LEU B 67 4.675 -50.566 2.915 1.00 0.00 C ATOM 0 H LEU B 67 2.370 -48.827 -0.500 1.00 0.00 H new ATOM 0 HA LEU B 67 4.844 -50.235 -1.226 1.00 0.00 H new ATOM 0 HB2 LEU B 67 2.755 -50.578 0.946 1.00 0.00 H new ATOM 0 HB3 LEU B 67 4.040 -51.734 0.660 1.00 0.00 H new ATOM 0 HG LEU B 67 5.690 -49.895 1.087 1.00 0.00 H new ATOM 0 HD11 LEU B 67 4.993 -47.943 2.418 1.00 0.00 H new ATOM 0 HD12 LEU B 67 4.318 -47.914 0.771 1.00 0.00 H new ATOM 0 HD13 LEU B 67 3.289 -48.378 2.147 1.00 0.00 H new ATOM 0 HD21 LEU B 67 5.322 -50.020 3.601 1.00 0.00 H new ATOM 0 HD22 LEU B 67 3.656 -50.568 3.301 1.00 0.00 H new ATOM 0 HD23 LEU B 67 5.030 -51.593 2.822 1.00 0.00 H new ATOM 2308 N HIS B 68 3.734 -52.444 -2.043 1.00 0.00 N ATOM 2309 CA HIS B 68 3.223 -53.533 -2.878 1.00 0.00 C ATOM 2310 C HIS B 68 3.252 -54.846 -2.086 1.00 0.00 C ATOM 2311 O HIS B 68 4.306 -55.265 -1.608 1.00 0.00 O ATOM 2312 CB HIS B 68 4.030 -53.575 -4.189 1.00 0.00 C ATOM 2313 CG HIS B 68 3.976 -52.260 -4.932 1.00 0.00 C ATOM 2314 ND1 HIS B 68 4.814 -51.164 -4.696 1.00 0.00 N ATOM 2315 CD2 HIS B 68 2.996 -51.887 -5.805 1.00 0.00 C ATOM 2316 CE1 HIS B 68 4.296 -50.149 -5.407 1.00 0.00 C ATOM 2317 NE2 HIS B 68 3.221 -50.561 -6.103 1.00 0.00 N ATOM 0 H HIS B 68 4.674 -52.623 -1.690 1.00 0.00 H new ATOM 0 HA HIS B 68 2.181 -53.370 -3.153 1.00 0.00 H new ATOM 0 HB2 HIS B 68 5.068 -53.823 -3.967 1.00 0.00 H new ATOM 0 HB3 HIS B 68 3.642 -54.368 -4.828 1.00 0.00 H new ATOM 0 HD2 HIS B 68 2.200 -52.509 -6.187 1.00 0.00 H new ATOM 0 HE1 HIS B 68 4.688 -49.143 -5.418 1.00 0.00 H new ATOM 0 HE2 HIS B 68 2.668 -49.990 -6.742 1.00 0.00 H new ATOM 2325 N LEU B 69 2.087 -55.473 -1.913 1.00 0.00 N ATOM 2326 CA LEU B 69 1.896 -56.697 -1.133 1.00 0.00 C ATOM 2327 C LEU B 69 1.892 -57.924 -2.053 1.00 0.00 C ATOM 2328 O LEU B 69 0.923 -58.189 -2.766 1.00 0.00 O ATOM 2329 CB LEU B 69 0.607 -56.565 -0.296 1.00 0.00 C ATOM 2330 CG LEU B 69 0.203 -57.821 0.502 1.00 0.00 C ATOM 2331 CD1 LEU B 69 1.244 -58.205 1.554 1.00 0.00 C ATOM 2332 CD2 LEU B 69 -1.124 -57.565 1.214 1.00 0.00 C ATOM 0 H LEU B 69 1.220 -55.130 -2.327 1.00 0.00 H new ATOM 0 HA LEU B 69 2.726 -56.840 -0.441 1.00 0.00 H new ATOM 0 HB2 LEU B 69 0.731 -55.737 0.402 1.00 0.00 H new ATOM 0 HB3 LEU B 69 -0.213 -56.300 -0.963 1.00 0.00 H new ATOM 0 HG LEU B 69 0.120 -58.641 -0.212 1.00 0.00 H new ATOM 0 HD11 LEU B 69 0.911 -59.095 2.087 1.00 0.00 H new ATOM 0 HD12 LEU B 69 2.197 -58.410 1.065 1.00 0.00 H new ATOM 0 HD13 LEU B 69 1.368 -57.384 2.260 1.00 0.00 H new ATOM 0 HD21 LEU B 69 -1.411 -58.452 1.779 1.00 0.00 H new ATOM 0 HD22 LEU B 69 -1.015 -56.721 1.895 1.00 0.00 H new ATOM 0 HD23 LEU B 69 -1.895 -57.339 0.477 1.00 0.00 H new ATOM 2344 N VAL B 70 2.985 -58.678 -1.992 1.00 0.00 N ATOM 2345 CA VAL B 70 3.158 -60.004 -2.595 1.00 0.00 C ATOM 2346 C VAL B 70 2.692 -61.055 -1.578 1.00 0.00 C ATOM 2347 O VAL B 70 2.839 -60.863 -0.371 1.00 0.00 O ATOM 2348 CB VAL B 70 4.628 -60.186 -3.033 1.00 0.00 C ATOM 2349 CG1 VAL B 70 4.955 -61.610 -3.501 1.00 0.00 C ATOM 2350 CG2 VAL B 70 4.966 -59.223 -4.180 1.00 0.00 C ATOM 0 H VAL B 70 3.820 -58.368 -1.495 1.00 0.00 H new ATOM 0 HA VAL B 70 2.554 -60.120 -3.495 1.00 0.00 H new ATOM 0 HB VAL B 70 5.226 -59.975 -2.146 1.00 0.00 H new ATOM 0 HG11 VAL B 70 6.004 -61.665 -3.793 1.00 0.00 H new ATOM 0 HG12 VAL B 70 4.767 -62.312 -2.689 1.00 0.00 H new ATOM 0 HG13 VAL B 70 4.327 -61.866 -4.354 1.00 0.00 H new ATOM 0 HG21 VAL B 70 6.005 -59.363 -4.478 1.00 0.00 H new ATOM 0 HG22 VAL B 70 4.314 -59.426 -5.030 1.00 0.00 H new ATOM 0 HG23 VAL B 70 4.819 -58.195 -3.848 1.00 0.00 H new ATOM 2360 N LEU B 71 2.114 -62.160 -2.050 1.00 0.00 N ATOM 2361 CA LEU B 71 1.562 -63.228 -1.206 1.00 0.00 C ATOM 2362 C LEU B 71 2.124 -64.598 -1.606 1.00 0.00 C ATOM 2363 O LEU B 71 2.228 -64.901 -2.798 1.00 0.00 O ATOM 2364 CB LEU B 71 0.022 -63.218 -1.292 1.00 0.00 C ATOM 2365 CG LEU B 71 -0.660 -61.926 -0.799 1.00 0.00 C ATOM 2366 CD1 LEU B 71 -2.169 -62.021 -1.013 1.00 0.00 C ATOM 2367 CD2 LEU B 71 -0.408 -61.688 0.690 1.00 0.00 C ATOM 0 H LEU B 71 2.013 -62.344 -3.048 1.00 0.00 H new ATOM 0 HA LEU B 71 1.859 -63.043 -0.174 1.00 0.00 H new ATOM 0 HB2 LEU B 71 -0.268 -63.389 -2.329 1.00 0.00 H new ATOM 0 HB3 LEU B 71 -0.363 -64.056 -0.711 1.00 0.00 H new ATOM 0 HG LEU B 71 -0.237 -61.099 -1.370 1.00 0.00 H new ATOM 0 HD11 LEU B 71 -2.645 -61.105 -0.663 1.00 0.00 H new ATOM 0 HD12 LEU B 71 -2.378 -62.155 -2.074 1.00 0.00 H new ATOM 0 HD13 LEU B 71 -2.563 -62.871 -0.455 1.00 0.00 H new ATOM 0 HD21 LEU B 71 -0.904 -60.769 1.001 1.00 0.00 H new ATOM 0 HD22 LEU B 71 -0.804 -62.526 1.264 1.00 0.00 H new ATOM 0 HD23 LEU B 71 0.664 -61.600 0.868 1.00 0.00 H new ATOM 2481 N THR C 80 -0.555 -68.194 -10.171 1.00 0.00 N ATOM 2482 CA THR C 80 0.840 -67.945 -10.600 1.00 0.00 C ATOM 2483 C THR C 80 1.517 -66.974 -9.626 1.00 0.00 C ATOM 2484 O THR C 80 0.938 -65.959 -9.241 1.00 0.00 O ATOM 2485 CB THR C 80 0.912 -67.484 -12.069 1.00 0.00 C ATOM 2486 OG1 THR C 80 2.254 -67.350 -12.471 1.00 0.00 O ATOM 2487 CG2 THR C 80 0.225 -66.147 -12.344 1.00 0.00 C ATOM 0 HA THR C 80 1.396 -68.882 -10.566 1.00 0.00 H new ATOM 0 HB THR C 80 0.386 -68.256 -12.630 1.00 0.00 H new ATOM 0 HG1 THR C 80 2.290 -67.151 -13.430 1.00 0.00 H new ATOM 0 HG21 THR C 80 0.323 -65.898 -13.401 1.00 0.00 H new ATOM 0 HG22 THR C 80 -0.831 -66.221 -12.085 1.00 0.00 H new ATOM 0 HG23 THR C 80 0.692 -65.367 -11.743 1.00 0.00 H new ATOM 2495 N GLU C 81 2.712 -67.326 -9.151 1.00 0.00 N ATOM 2496 CA GLU C 81 3.483 -66.572 -8.162 1.00 0.00 C ATOM 2497 C GLU C 81 4.481 -65.635 -8.844 1.00 0.00 C ATOM 2498 O GLU C 81 4.520 -64.453 -8.525 1.00 0.00 O ATOM 2499 CB GLU C 81 4.128 -67.561 -7.175 1.00 0.00 C ATOM 2500 CG GLU C 81 4.629 -66.931 -5.865 1.00 0.00 C ATOM 2501 CD GLU C 81 5.974 -66.178 -5.974 1.00 0.00 C ATOM 2502 OE1 GLU C 81 6.886 -66.634 -6.708 1.00 0.00 O ATOM 2503 OE2 GLU C 81 6.152 -65.163 -5.257 1.00 0.00 O1- ATOM 0 H GLU C 81 3.187 -68.176 -9.456 1.00 0.00 H new ATOM 0 HA GLU C 81 2.829 -65.918 -7.585 1.00 0.00 H new ATOM 0 HB2 GLU C 81 3.402 -68.337 -6.934 1.00 0.00 H new ATOM 0 HB3 GLU C 81 4.966 -68.051 -7.670 1.00 0.00 H new ATOM 0 HG2 GLU C 81 3.871 -66.238 -5.500 1.00 0.00 H new ATOM 0 HG3 GLU C 81 4.730 -67.717 -5.117 1.00 0.00 H new ATOM 2510 N GLU C 82 5.239 -66.137 -9.825 1.00 0.00 N ATOM 2511 CA GLU C 82 6.371 -65.411 -10.427 1.00 0.00 C ATOM 2512 C GLU C 82 5.942 -64.228 -11.301 1.00 0.00 C ATOM 2513 O GLU C 82 6.580 -63.176 -11.284 1.00 0.00 O ATOM 2514 CB GLU C 82 7.272 -66.368 -11.225 1.00 0.00 C ATOM 2515 CG GLU C 82 6.623 -67.018 -12.457 1.00 0.00 C ATOM 2516 CD GLU C 82 7.574 -68.043 -13.100 1.00 0.00 C ATOM 2517 OE1 GLU C 82 8.397 -67.657 -13.968 1.00 0.00 O1- ATOM 2518 OE2 GLU C 82 7.505 -69.248 -12.751 1.00 0.00 O ATOM 0 H GLU C 82 5.087 -67.062 -10.228 1.00 0.00 H new ATOM 0 HA GLU C 82 6.936 -64.992 -9.595 1.00 0.00 H new ATOM 0 HB2 GLU C 82 8.157 -65.820 -11.549 1.00 0.00 H new ATOM 0 HB3 GLU C 82 7.614 -67.159 -10.557 1.00 0.00 H new ATOM 0 HG2 GLU C 82 5.694 -67.509 -12.167 1.00 0.00 H new ATOM 0 HG3 GLU C 82 6.364 -66.249 -13.185 1.00 0.00 H new ATOM 2525 N GLU C 83 4.840 -64.385 -12.038 1.00 0.00 N ATOM 2526 CA GLU C 83 4.282 -63.331 -12.893 1.00 0.00 C ATOM 2527 C GLU C 83 3.723 -62.197 -12.021 1.00 0.00 C ATOM 2528 O GLU C 83 4.110 -61.041 -12.165 1.00 0.00 O ATOM 2529 CB GLU C 83 3.194 -63.914 -13.811 1.00 0.00 C ATOM 2530 CG GLU C 83 3.748 -64.918 -14.832 1.00 0.00 C ATOM 2531 CD GLU C 83 2.609 -65.668 -15.542 1.00 0.00 C ATOM 2532 OE1 GLU C 83 2.093 -65.168 -16.573 1.00 0.00 O1- ATOM 2533 OE2 GLU C 83 2.227 -66.767 -15.068 1.00 0.00 O ATOM 0 H GLU C 83 4.305 -65.253 -12.059 1.00 0.00 H new ATOM 0 HA GLU C 83 5.070 -62.922 -13.525 1.00 0.00 H new ATOM 0 HB2 GLU C 83 2.436 -64.405 -13.201 1.00 0.00 H new ATOM 0 HB3 GLU C 83 2.699 -63.100 -14.341 1.00 0.00 H new ATOM 0 HG2 GLU C 83 4.358 -64.394 -15.568 1.00 0.00 H new ATOM 0 HG3 GLU C 83 4.400 -65.632 -14.328 1.00 0.00 H new ATOM 2540 N GLN C 84 2.880 -62.539 -11.042 1.00 0.00 N ATOM 2541 CA GLN C 84 2.341 -61.606 -10.046 1.00 0.00 C ATOM 2542 C GLN C 84 3.440 -60.911 -9.229 1.00 0.00 C ATOM 2543 O GLN C 84 3.386 -59.698 -9.019 1.00 0.00 O ATOM 2544 CB GLN C 84 1.403 -62.373 -9.103 1.00 0.00 C ATOM 2545 CG GLN C 84 0.099 -62.842 -9.767 1.00 0.00 C ATOM 2546 CD GLN C 84 -0.718 -61.719 -10.409 1.00 0.00 C ATOM 2547 OE1 GLN C 84 -1.259 -61.850 -11.499 1.00 0.00 O ATOM 2548 NE2 GLN C 84 -0.841 -60.578 -9.761 1.00 0.00 N ATOM 0 H GLN C 84 2.545 -63.494 -10.917 1.00 0.00 H new ATOM 0 HA GLN C 84 1.801 -60.825 -10.581 1.00 0.00 H new ATOM 0 HB2 GLN C 84 1.931 -63.241 -8.709 1.00 0.00 H new ATOM 0 HB3 GLN C 84 1.158 -61.736 -8.253 1.00 0.00 H new ATOM 0 HG2 GLN C 84 0.339 -63.583 -10.530 1.00 0.00 H new ATOM 0 HG3 GLN C 84 -0.517 -63.342 -9.019 1.00 0.00 H new ATOM 0 HE21 GLN C 84 -0.395 -60.457 -8.852 1.00 0.00 H new ATOM 0 HE22 GLN C 84 -1.383 -59.816 -10.169 1.00 0.00 H new ATOM 2557 N PHE C 85 4.462 -61.658 -8.816 1.00 0.00 N ATOM 2558 CA PHE C 85 5.660 -61.110 -8.165 1.00 0.00 C ATOM 2559 C PHE C 85 6.380 -60.075 -9.047 1.00 0.00 C ATOM 2560 O PHE C 85 6.555 -58.925 -8.637 1.00 0.00 O ATOM 2561 CB PHE C 85 6.588 -62.269 -7.793 1.00 0.00 C ATOM 2562 CG PHE C 85 7.933 -61.881 -7.222 1.00 0.00 C ATOM 2563 CD1 PHE C 85 7.996 -61.136 -6.034 1.00 0.00 C ATOM 2564 CD2 PHE C 85 9.120 -62.304 -7.848 1.00 0.00 C ATOM 2565 CE1 PHE C 85 9.238 -60.861 -5.433 1.00 0.00 C ATOM 2566 CE2 PHE C 85 10.366 -62.022 -7.255 1.00 0.00 C ATOM 2567 CZ PHE C 85 10.423 -61.315 -6.040 1.00 0.00 C ATOM 0 H PHE C 85 4.486 -62.672 -8.923 1.00 0.00 H new ATOM 0 HA PHE C 85 5.358 -60.577 -7.264 1.00 0.00 H new ATOM 0 HB2 PHE C 85 6.076 -62.901 -7.067 1.00 0.00 H new ATOM 0 HB3 PHE C 85 6.754 -62.876 -8.683 1.00 0.00 H new ATOM 0 HD1 PHE C 85 7.087 -60.772 -5.579 1.00 0.00 H new ATOM 0 HD2 PHE C 85 9.076 -62.844 -8.782 1.00 0.00 H new ATOM 0 HE1 PHE C 85 9.281 -60.303 -4.509 1.00 0.00 H new ATOM 0 HE2 PHE C 85 11.278 -62.349 -7.733 1.00 0.00 H new ATOM 0 HZ PHE C 85 11.377 -61.121 -5.573 1.00 0.00 H new ATOM 2577 N ALA C 86 6.717 -60.433 -10.290 1.00 0.00 N ATOM 2578 CA ALA C 86 7.311 -59.512 -11.258 1.00 0.00 C ATOM 2579 C ALA C 86 6.442 -58.265 -11.493 1.00 0.00 C ATOM 2580 O ALA C 86 6.966 -57.162 -11.648 1.00 0.00 O ATOM 2581 CB ALA C 86 7.501 -60.259 -12.578 1.00 0.00 C ATOM 0 H ALA C 86 6.583 -61.377 -10.653 1.00 0.00 H new ATOM 0 HA ALA C 86 8.264 -59.166 -10.859 1.00 0.00 H new ATOM 0 HB1 ALA C 86 7.944 -59.589 -13.315 1.00 0.00 H new ATOM 0 HB2 ALA C 86 8.161 -61.113 -12.421 1.00 0.00 H new ATOM 0 HB3 ALA C 86 6.534 -60.609 -12.940 1.00 0.00 H new ATOM 2587 N LEU C 87 5.114 -58.426 -11.463 1.00 0.00 N ATOM 2588 CA LEU C 87 4.151 -57.340 -11.638 1.00 0.00 C ATOM 2589 C LEU C 87 4.232 -56.357 -10.466 1.00 0.00 C ATOM 2590 O LEU C 87 4.297 -55.148 -10.679 1.00 0.00 O ATOM 2591 CB LEU C 87 2.712 -57.905 -11.778 1.00 0.00 C ATOM 2592 CG LEU C 87 2.068 -57.880 -13.176 1.00 0.00 C ATOM 2593 CD1 LEU C 87 2.173 -56.506 -13.839 1.00 0.00 C ATOM 2594 CD2 LEU C 87 2.657 -58.942 -14.100 1.00 0.00 C ATOM 0 H LEU C 87 4.673 -59.334 -11.313 1.00 0.00 H new ATOM 0 HA LEU C 87 4.399 -56.804 -12.554 1.00 0.00 H new ATOM 0 HB2 LEU C 87 2.722 -58.938 -11.431 1.00 0.00 H new ATOM 0 HB3 LEU C 87 2.065 -57.348 -11.100 1.00 0.00 H new ATOM 0 HG LEU C 87 1.013 -58.105 -13.018 1.00 0.00 H new ATOM 0 HD11 LEU C 87 1.704 -56.540 -14.823 1.00 0.00 H new ATOM 0 HD12 LEU C 87 1.667 -55.764 -13.221 1.00 0.00 H new ATOM 0 HD13 LEU C 87 3.223 -56.233 -13.946 1.00 0.00 H new ATOM 0 HD21 LEU C 87 2.172 -58.886 -15.074 1.00 0.00 H new ATOM 0 HD22 LEU C 87 3.727 -58.770 -14.217 1.00 0.00 H new ATOM 0 HD23 LEU C 87 2.494 -59.930 -13.670 1.00 0.00 H new ATOM 2606 N ALA C 88 4.274 -56.877 -9.237 1.00 0.00 N ATOM 2607 CA ALA C 88 4.382 -56.071 -8.019 1.00 0.00 C ATOM 2608 C ALA C 88 5.683 -55.254 -8.018 1.00 0.00 C ATOM 2609 O ALA C 88 5.655 -54.034 -7.851 1.00 0.00 O ATOM 2610 CB ALA C 88 4.269 -57.002 -6.804 1.00 0.00 C ATOM 0 H ALA C 88 4.234 -57.880 -9.058 1.00 0.00 H new ATOM 0 HA ALA C 88 3.570 -55.345 -7.973 1.00 0.00 H new ATOM 0 HB1 ALA C 88 4.348 -56.416 -5.888 1.00 0.00 H new ATOM 0 HB2 ALA C 88 3.307 -57.514 -6.826 1.00 0.00 H new ATOM 0 HB3 ALA C 88 5.072 -57.738 -6.834 1.00 0.00 H new ATOM 2616 N LEU C 89 6.808 -55.909 -8.323 1.00 0.00 N ATOM 2617 CA LEU C 89 8.124 -55.274 -8.475 1.00 0.00 C ATOM 2618 C LEU C 89 8.115 -54.179 -9.552 1.00 0.00 C ATOM 2619 O LEU C 89 8.621 -53.086 -9.316 1.00 0.00 O ATOM 2620 CB LEU C 89 9.145 -56.371 -8.827 1.00 0.00 C ATOM 2621 CG LEU C 89 9.745 -57.149 -7.639 1.00 0.00 C ATOM 2622 CD1 LEU C 89 8.785 -57.483 -6.494 1.00 0.00 C ATOM 2623 CD2 LEU C 89 10.307 -58.466 -8.166 1.00 0.00 C ATOM 0 H LEU C 89 6.831 -56.917 -8.475 1.00 0.00 H new ATOM 0 HA LEU C 89 8.394 -54.785 -7.539 1.00 0.00 H new ATOM 0 HB2 LEU C 89 8.664 -57.085 -9.496 1.00 0.00 H new ATOM 0 HB3 LEU C 89 9.962 -55.913 -9.384 1.00 0.00 H new ATOM 0 HG LEU C 89 10.494 -56.482 -7.213 1.00 0.00 H new ATOM 0 HD11 LEU C 89 9.321 -58.030 -5.718 1.00 0.00 H new ATOM 0 HD12 LEU C 89 8.383 -56.560 -6.076 1.00 0.00 H new ATOM 0 HD13 LEU C 89 7.967 -58.097 -6.872 1.00 0.00 H new ATOM 0 HD21 LEU C 89 10.737 -59.034 -7.341 1.00 0.00 H new ATOM 0 HD22 LEU C 89 9.506 -59.045 -8.626 1.00 0.00 H new ATOM 0 HD23 LEU C 89 11.079 -58.261 -8.907 1.00 0.00 H new ATOM 2635 N LYS C 90 7.487 -54.433 -10.705 1.00 0.00 N ATOM 2636 CA LYS C 90 7.376 -53.486 -11.828 1.00 0.00 C ATOM 2637 C LYS C 90 6.545 -52.253 -11.479 1.00 0.00 C ATOM 2638 O LYS C 90 6.975 -51.133 -11.725 1.00 0.00 O ATOM 2639 CB LYS C 90 6.832 -54.278 -13.027 1.00 0.00 C ATOM 2640 CG LYS C 90 6.720 -53.504 -14.353 1.00 0.00 C ATOM 2641 CD LYS C 90 5.390 -52.768 -14.597 1.00 0.00 C ATOM 2642 CE LYS C 90 4.184 -53.722 -14.548 1.00 0.00 C ATOM 2643 NZ LYS C 90 2.975 -53.132 -15.199 1.00 0.00 N1+ ATOM 0 H LYS C 90 7.029 -55.325 -10.891 1.00 0.00 H new ATOM 0 HA LYS C 90 8.352 -53.070 -12.078 1.00 0.00 H new ATOM 0 HB2 LYS C 90 7.475 -55.143 -13.188 1.00 0.00 H new ATOM 0 HB3 LYS C 90 5.844 -54.659 -12.767 1.00 0.00 H new ATOM 0 HG2 LYS C 90 7.529 -52.774 -14.394 1.00 0.00 H new ATOM 0 HG3 LYS C 90 6.881 -54.204 -15.173 1.00 0.00 H new ATOM 0 HD2 LYS C 90 5.265 -51.987 -13.847 1.00 0.00 H new ATOM 0 HD3 LYS C 90 5.422 -52.274 -15.568 1.00 0.00 H new ATOM 0 HE2 LYS C 90 4.442 -54.658 -15.044 1.00 0.00 H new ATOM 0 HE3 LYS C 90 3.955 -53.964 -13.510 1.00 0.00 H new ATOM 0 HZ1 LYS C 90 2.186 -53.808 -15.144 1.00 0.00 H new ATOM 0 HZ2 LYS C 90 2.712 -52.252 -14.711 1.00 0.00 H new ATOM 0 HZ3 LYS C 90 3.184 -52.925 -16.197 1.00 0.00 H new ATOM 2657 N MET C 91 5.386 -52.421 -10.840 1.00 0.00 N ATOM 2658 CA MET C 91 4.589 -51.281 -10.339 1.00 0.00 C ATOM 2659 C MET C 91 5.371 -50.448 -9.314 1.00 0.00 C ATOM 2660 O MET C 91 5.389 -49.218 -9.378 1.00 0.00 O ATOM 2661 CB MET C 91 3.263 -51.795 -9.762 1.00 0.00 C ATOM 2662 CG MET C 91 2.404 -52.300 -10.921 1.00 0.00 C ATOM 2663 SD MET C 91 0.774 -52.961 -10.470 1.00 0.00 S ATOM 2664 CE MET C 91 1.248 -54.625 -9.930 1.00 0.00 C ATOM 0 H MET C 91 4.971 -53.334 -10.653 1.00 0.00 H new ATOM 0 HA MET C 91 4.371 -50.614 -11.173 1.00 0.00 H new ATOM 0 HB2 MET C 91 3.445 -52.596 -9.046 1.00 0.00 H new ATOM 0 HB3 MET C 91 2.748 -50.999 -9.225 1.00 0.00 H new ATOM 0 HG2 MET C 91 2.260 -51.481 -11.625 1.00 0.00 H new ATOM 0 HG3 MET C 91 2.958 -53.078 -11.446 1.00 0.00 H new ATOM 0 HE1 MET C 91 0.362 -55.167 -9.600 1.00 0.00 H new ATOM 0 HE2 MET C 91 1.711 -55.159 -10.760 1.00 0.00 H new ATOM 0 HE3 MET C 91 1.957 -54.552 -9.105 1.00 0.00 H new ATOM 2674 N SER C 92 6.109 -51.136 -8.448 1.00 0.00 N ATOM 2675 CA SER C 92 7.002 -50.520 -7.458 1.00 0.00 C ATOM 2676 C SER C 92 8.155 -49.732 -8.098 1.00 0.00 C ATOM 2677 O SER C 92 8.491 -48.634 -7.647 1.00 0.00 O ATOM 2678 CB SER C 92 7.537 -51.618 -6.534 1.00 0.00 C ATOM 2679 OG SER C 92 7.712 -51.108 -5.227 1.00 0.00 O ATOM 0 H SER C 92 6.107 -52.155 -8.410 1.00 0.00 H new ATOM 0 HA SER C 92 6.427 -49.791 -6.888 1.00 0.00 H new ATOM 0 HB2 SER C 92 6.843 -52.459 -6.515 1.00 0.00 H new ATOM 0 HB3 SER C 92 8.486 -51.996 -6.916 1.00 0.00 H new ATOM 0 HG SER C 92 6.838 -51.004 -4.797 1.00 0.00 H new ATOM 2685 N GLU C 93 8.728 -50.244 -9.194 1.00 0.00 N ATOM 2686 CA GLU C 93 9.848 -49.570 -9.871 1.00 0.00 C ATOM 2687 C GLU C 93 9.365 -48.350 -10.668 1.00 0.00 C ATOM 2688 O GLU C 93 10.022 -47.311 -10.637 1.00 0.00 O ATOM 2689 CB GLU C 93 10.726 -50.556 -10.670 1.00 0.00 C ATOM 2690 CG GLU C 93 10.448 -50.722 -12.176 1.00 0.00 C ATOM 2691 CD GLU C 93 11.094 -49.621 -13.052 1.00 0.00 C ATOM 2692 OE1 GLU C 93 12.333 -49.429 -12.985 1.00 0.00 O1- ATOM 2693 OE2 GLU C 93 10.380 -48.978 -13.861 1.00 0.00 O ATOM 0 H GLU C 93 8.438 -51.119 -9.631 1.00 0.00 H new ATOM 0 HA GLU C 93 10.517 -49.171 -9.109 1.00 0.00 H new ATOM 0 HB2 GLU C 93 11.764 -50.245 -10.555 1.00 0.00 H new ATOM 0 HB3 GLU C 93 10.633 -51.537 -10.204 1.00 0.00 H new ATOM 0 HG2 GLU C 93 10.817 -51.695 -12.500 1.00 0.00 H new ATOM 0 HG3 GLU C 93 9.370 -50.719 -12.340 1.00 0.00 H new ATOM 2700 N GLN C 94 8.174 -48.425 -11.281 1.00 0.00 N ATOM 2701 CA GLN C 94 7.553 -47.270 -11.933 1.00 0.00 C ATOM 2702 C GLN C 94 7.256 -46.152 -10.929 1.00 0.00 C ATOM 2703 O GLN C 94 7.659 -45.015 -11.175 1.00 0.00 O ATOM 2704 CB GLN C 94 6.258 -47.662 -12.652 1.00 0.00 C ATOM 2705 CG GLN C 94 6.475 -48.539 -13.894 1.00 0.00 C ATOM 2706 CD GLN C 94 5.147 -48.841 -14.581 1.00 0.00 C ATOM 2707 OE1 GLN C 94 4.914 -48.498 -15.733 1.00 0.00 O ATOM 2708 NE2 GLN C 94 4.212 -49.473 -13.897 1.00 0.00 N ATOM 0 H GLN C 94 7.622 -49.281 -11.337 1.00 0.00 H new ATOM 0 HA GLN C 94 8.269 -46.904 -12.668 1.00 0.00 H new ATOM 0 HB2 GLN C 94 5.613 -48.193 -11.953 1.00 0.00 H new ATOM 0 HB3 GLN C 94 5.730 -46.756 -12.948 1.00 0.00 H new ATOM 0 HG2 GLN C 94 7.143 -48.032 -14.590 1.00 0.00 H new ATOM 0 HG3 GLN C 94 6.961 -49.471 -13.606 1.00 0.00 H new ATOM 0 HE21 GLN C 94 4.392 -49.765 -12.936 1.00 0.00 H new ATOM 0 HE22 GLN C 94 3.309 -49.670 -14.329 1.00 0.00 H new ATOM 2717 N GLU C 95 6.627 -46.474 -9.786 1.00 0.00 N ATOM 2718 CA GLU C 95 6.394 -45.505 -8.701 1.00 0.00 C ATOM 2719 C GLU C 95 7.709 -44.837 -8.265 1.00 0.00 C ATOM 2720 O GLU C 95 7.807 -43.608 -8.235 1.00 0.00 O ATOM 2721 CB GLU C 95 5.735 -46.196 -7.490 1.00 0.00 C ATOM 2722 CG GLU C 95 4.254 -46.554 -7.688 1.00 0.00 C ATOM 2723 CD GLU C 95 3.332 -45.333 -7.486 1.00 0.00 C ATOM 2724 OE1 GLU C 95 3.147 -44.543 -8.442 1.00 0.00 O1- ATOM 2725 OE2 GLU C 95 2.777 -45.171 -6.371 1.00 0.00 O ATOM 0 H GLU C 95 6.267 -47.408 -9.588 1.00 0.00 H new ATOM 0 HA GLU C 95 5.723 -44.735 -9.082 1.00 0.00 H new ATOM 0 HB2 GLU C 95 6.288 -47.107 -7.262 1.00 0.00 H new ATOM 0 HB3 GLU C 95 5.825 -45.543 -6.622 1.00 0.00 H new ATOM 0 HG2 GLU C 95 4.109 -46.956 -8.691 1.00 0.00 H new ATOM 0 HG3 GLU C 95 3.974 -47.340 -6.986 1.00 0.00 H new ATOM 2732 N ALA C 96 8.760 -45.628 -8.010 1.00 0.00 N ATOM 2733 CA ALA C 96 10.068 -45.086 -7.638 1.00 0.00 C ATOM 2734 C ALA C 96 10.656 -44.152 -8.712 1.00 0.00 C ATOM 2735 O ALA C 96 11.218 -43.102 -8.387 1.00 0.00 O ATOM 2736 CB ALA C 96 11.012 -46.258 -7.350 1.00 0.00 C ATOM 0 H ALA C 96 8.727 -46.646 -8.055 1.00 0.00 H new ATOM 0 HA ALA C 96 9.946 -44.469 -6.747 1.00 0.00 H new ATOM 0 HB1 ALA C 96 11.993 -45.875 -7.071 1.00 0.00 H new ATOM 0 HB2 ALA C 96 10.610 -46.857 -6.532 1.00 0.00 H new ATOM 0 HB3 ALA C 96 11.105 -46.878 -8.242 1.00 0.00 H new ATOM 2742 N ARG C 97 10.499 -44.500 -9.993 1.00 0.00 N ATOM 2743 CA ARG C 97 11.073 -43.775 -11.134 1.00 0.00 C ATOM 2744 C ARG C 97 10.422 -42.408 -11.314 1.00 0.00 C ATOM 2745 O ARG C 97 11.121 -41.401 -11.399 1.00 0.00 O ATOM 2746 CB ARG C 97 10.932 -44.664 -12.380 1.00 0.00 C ATOM 2747 CG ARG C 97 11.816 -44.226 -13.554 1.00 0.00 C ATOM 2748 CD ARG C 97 11.791 -45.317 -14.633 1.00 0.00 C ATOM 2749 NE ARG C 97 12.781 -45.060 -15.697 1.00 0.00 N ATOM 2750 CZ ARG C 97 13.342 -45.966 -16.481 1.00 0.00 C ATOM 2751 NH1 ARG C 97 13.048 -47.235 -16.396 1.00 0.00 N1+ ATOM 2752 NH2 ARG C 97 14.221 -45.611 -17.376 1.00 0.00 N ATOM 0 H ARG C 97 9.955 -45.316 -10.274 1.00 0.00 H new ATOM 0 HA ARG C 97 12.129 -43.571 -10.958 1.00 0.00 H new ATOM 0 HB2 ARG C 97 11.181 -45.691 -12.113 1.00 0.00 H new ATOM 0 HB3 ARG C 97 9.890 -44.662 -12.701 1.00 0.00 H new ATOM 0 HG2 ARG C 97 11.456 -43.282 -13.964 1.00 0.00 H new ATOM 0 HG3 ARG C 97 12.837 -44.057 -13.213 1.00 0.00 H new ATOM 0 HD2 ARG C 97 11.993 -46.285 -14.175 1.00 0.00 H new ATOM 0 HD3 ARG C 97 10.794 -45.373 -15.070 1.00 0.00 H new ATOM 0 HE ARG C 97 13.060 -44.090 -15.842 1.00 0.00 H new ATOM 0 HH11 ARG C 97 12.366 -47.556 -15.709 1.00 0.00 H new ATOM 0 HH12 ARG C 97 13.500 -47.906 -17.017 1.00 0.00 H new ATOM 0 HH21 ARG C 97 14.480 -44.629 -17.475 1.00 0.00 H new ATOM 0 HH22 ARG C 97 14.650 -46.315 -17.977 1.00 0.00 H new ATOM 2766 N GLU C 98 9.091 -42.352 -11.281 1.00 0.00 N ATOM 2767 CA GLU C 98 8.361 -41.082 -11.384 1.00 0.00 C ATOM 2768 C GLU C 98 8.552 -40.196 -10.144 1.00 0.00 C ATOM 2769 O GLU C 98 8.681 -38.979 -10.292 1.00 0.00 O ATOM 2770 CB GLU C 98 6.880 -41.305 -11.713 1.00 0.00 C ATOM 2771 CG GLU C 98 6.089 -42.020 -10.614 1.00 0.00 C ATOM 2772 CD GLU C 98 4.621 -42.183 -11.055 1.00 0.00 C ATOM 2773 OE1 GLU C 98 4.308 -43.128 -11.823 1.00 0.00 O1- ATOM 2774 OE2 GLU C 98 3.774 -41.337 -10.677 1.00 0.00 O ATOM 0 H GLU C 98 8.492 -43.172 -11.184 1.00 0.00 H new ATOM 0 HA GLU C 98 8.796 -40.535 -12.221 1.00 0.00 H new ATOM 0 HB2 GLU C 98 6.414 -40.339 -11.909 1.00 0.00 H new ATOM 0 HB3 GLU C 98 6.808 -41.886 -12.632 1.00 0.00 H new ATOM 0 HG2 GLU C 98 6.529 -42.997 -10.412 1.00 0.00 H new ATOM 0 HG3 GLU C 98 6.139 -41.450 -9.686 1.00 0.00 H new ATOM 2781 N VAL C 99 8.673 -40.786 -8.944 1.00 0.00 N ATOM 2782 CA VAL C 99 9.003 -40.038 -7.720 1.00 0.00 C ATOM 2783 C VAL C 99 10.383 -39.378 -7.830 1.00 0.00 C ATOM 2784 O VAL C 99 10.518 -38.179 -7.578 1.00 0.00 O ATOM 2785 CB VAL C 99 8.891 -40.943 -6.482 1.00 0.00 C ATOM 2786 CG1 VAL C 99 9.437 -40.272 -5.219 1.00 0.00 C ATOM 2787 CG2 VAL C 99 7.420 -41.277 -6.206 1.00 0.00 C ATOM 0 H VAL C 99 8.546 -41.787 -8.795 1.00 0.00 H new ATOM 0 HA VAL C 99 8.276 -39.234 -7.602 1.00 0.00 H new ATOM 0 HB VAL C 99 9.476 -41.836 -6.703 1.00 0.00 H new ATOM 0 HG11 VAL C 99 9.335 -40.952 -4.373 1.00 0.00 H new ATOM 0 HG12 VAL C 99 10.489 -40.027 -5.363 1.00 0.00 H new ATOM 0 HG13 VAL C 99 8.876 -39.359 -5.021 1.00 0.00 H new ATOM 0 HG21 VAL C 99 7.351 -41.918 -5.327 1.00 0.00 H new ATOM 0 HG22 VAL C 99 6.865 -40.356 -6.027 1.00 0.00 H new ATOM 0 HG23 VAL C 99 6.997 -41.794 -7.067 1.00 0.00 H new ATOM 2797 N ASN C 100 11.401 -40.118 -8.282 1.00 0.00 N ATOM 2798 CA ASN C 100 12.729 -39.547 -8.523 1.00 0.00 C ATOM 2799 C ASN C 100 12.683 -38.431 -9.585 1.00 0.00 C ATOM 2800 O ASN C 100 13.280 -37.371 -9.383 1.00 0.00 O ATOM 2801 CB ASN C 100 13.717 -40.666 -8.900 1.00 0.00 C ATOM 2802 CG ASN C 100 14.285 -41.356 -7.669 1.00 0.00 C ATOM 2803 OD1 ASN C 100 15.330 -40.987 -7.150 1.00 0.00 O ATOM 2804 ND2 ASN C 100 13.613 -42.355 -7.146 1.00 0.00 N ATOM 0 H ASN C 100 11.330 -41.114 -8.488 1.00 0.00 H new ATOM 0 HA ASN C 100 13.081 -39.078 -7.604 1.00 0.00 H new ATOM 0 HB2 ASN C 100 13.212 -41.400 -9.528 1.00 0.00 H new ATOM 0 HB3 ASN C 100 14.532 -40.248 -9.491 1.00 0.00 H new ATOM 0 HD21 ASN C 100 13.962 -42.822 -6.309 1.00 0.00 H new ATOM 0 HD22 ASN C 100 12.742 -42.664 -7.577 1.00 0.00 H new ATOM 2811 N SER C 101 11.921 -38.618 -10.669 1.00 0.00 N ATOM 2812 CA SER C 101 11.785 -37.598 -11.722 1.00 0.00 C ATOM 2813 C SER C 101 11.126 -36.311 -11.214 1.00 0.00 C ATOM 2814 O SER C 101 11.632 -35.224 -11.492 1.00 0.00 O ATOM 2815 CB SER C 101 11.010 -38.137 -12.931 1.00 0.00 C ATOM 2816 OG SER C 101 11.757 -39.148 -13.588 1.00 0.00 O ATOM 0 H SER C 101 11.386 -39.469 -10.843 1.00 0.00 H new ATOM 0 HA SER C 101 12.800 -37.352 -12.033 1.00 0.00 H new ATOM 0 HB2 SER C 101 10.050 -38.539 -12.606 1.00 0.00 H new ATOM 0 HB3 SER C 101 10.797 -37.325 -13.626 1.00 0.00 H new ATOM 0 HG SER C 101 11.708 -39.979 -13.071 1.00 0.00 H new ATOM 2822 N GLN C 102 10.038 -36.398 -10.436 1.00 0.00 N ATOM 2823 CA GLN C 102 9.355 -35.198 -9.932 1.00 0.00 C ATOM 2824 C GLN C 102 10.147 -34.487 -8.820 1.00 0.00 C ATOM 2825 O GLN C 102 10.115 -33.259 -8.753 1.00 0.00 O ATOM 2826 CB GLN C 102 7.895 -35.502 -9.551 1.00 0.00 C ATOM 2827 CG GLN C 102 7.728 -36.315 -8.260 1.00 0.00 C ATOM 2828 CD GLN C 102 6.280 -36.740 -8.026 1.00 0.00 C ATOM 2829 OE1 GLN C 102 5.903 -37.892 -8.195 1.00 0.00 O ATOM 2830 NE2 GLN C 102 5.407 -35.835 -7.627 1.00 0.00 N ATOM 0 H GLN C 102 9.615 -37.279 -10.144 1.00 0.00 H new ATOM 0 HA GLN C 102 9.315 -34.478 -10.750 1.00 0.00 H new ATOM 0 HB2 GLN C 102 7.358 -34.560 -9.444 1.00 0.00 H new ATOM 0 HB3 GLN C 102 7.425 -36.046 -10.371 1.00 0.00 H new ATOM 0 HG2 GLN C 102 8.361 -37.201 -8.307 1.00 0.00 H new ATOM 0 HG3 GLN C 102 8.072 -35.722 -7.413 1.00 0.00 H new ATOM 0 HE21 GLN C 102 5.703 -34.870 -7.481 1.00 0.00 H new ATOM 0 HE22 GLN C 102 4.436 -36.100 -7.464 1.00 0.00 H new ATOM 2839 N GLU C 103 10.913 -35.215 -7.997 1.00 0.00 N ATOM 2840 CA GLU C 103 11.828 -34.604 -7.017 1.00 0.00 C ATOM 2841 C GLU C 103 13.008 -33.868 -7.688 1.00 0.00 C ATOM 2842 O GLU C 103 13.340 -32.746 -7.287 1.00 0.00 O ATOM 2843 CB GLU C 103 12.356 -35.673 -6.047 1.00 0.00 C ATOM 2844 CG GLU C 103 11.297 -36.181 -5.057 1.00 0.00 C ATOM 2845 CD GLU C 103 10.903 -35.101 -4.032 1.00 0.00 C ATOM 2846 OE1 GLU C 103 11.664 -34.878 -3.058 1.00 0.00 O ATOM 2847 OE2 GLU C 103 9.824 -34.478 -4.184 1.00 0.00 O1- ATOM 0 H GLU C 103 10.918 -36.235 -7.989 1.00 0.00 H new ATOM 0 HA GLU C 103 11.255 -33.858 -6.466 1.00 0.00 H new ATOM 0 HB2 GLU C 103 12.738 -36.516 -6.622 1.00 0.00 H new ATOM 0 HB3 GLU C 103 13.196 -35.261 -5.488 1.00 0.00 H new ATOM 0 HG2 GLU C 103 10.411 -36.501 -5.606 1.00 0.00 H new ATOM 0 HG3 GLU C 103 11.681 -37.056 -4.533 1.00 0.00 H new ATOM 2854 N GLU C 104 13.612 -34.450 -8.734 1.00 0.00 N ATOM 2855 CA GLU C 104 14.673 -33.785 -9.506 1.00 0.00 C ATOM 2856 C GLU C 104 14.158 -32.515 -10.207 1.00 0.00 C ATOM 2857 O GLU C 104 14.820 -31.475 -10.173 1.00 0.00 O ATOM 2858 CB GLU C 104 15.264 -34.750 -10.548 1.00 0.00 C ATOM 2859 CG GLU C 104 16.185 -35.821 -9.946 1.00 0.00 C ATOM 2860 CD GLU C 104 17.533 -35.229 -9.494 1.00 0.00 C ATOM 2861 OE1 GLU C 104 18.434 -35.038 -10.349 1.00 0.00 O1- ATOM 2862 OE2 GLU C 104 17.712 -34.963 -8.280 1.00 0.00 O ATOM 0 H GLU C 104 13.382 -35.386 -9.067 1.00 0.00 H new ATOM 0 HA GLU C 104 15.451 -33.490 -8.802 1.00 0.00 H new ATOM 0 HB2 GLU C 104 14.448 -35.241 -11.079 1.00 0.00 H new ATOM 0 HB3 GLU C 104 15.824 -34.175 -11.286 1.00 0.00 H new ATOM 0 HG2 GLU C 104 15.690 -36.289 -9.095 1.00 0.00 H new ATOM 0 HG3 GLU C 104 16.361 -36.605 -10.683 1.00 0.00 H new ATOM 2869 N GLU C 105 12.959 -32.574 -10.799 1.00 0.00 N ATOM 2870 CA GLU C 105 12.317 -31.416 -11.432 1.00 0.00 C ATOM 2871 C GLU C 105 11.921 -30.328 -10.419 1.00 0.00 C ATOM 2872 O GLU C 105 12.082 -29.149 -10.720 1.00 0.00 O ATOM 2873 CB GLU C 105 11.088 -31.869 -12.236 1.00 0.00 C ATOM 2874 CG GLU C 105 11.455 -32.631 -13.518 1.00 0.00 C ATOM 2875 CD GLU C 105 12.003 -31.687 -14.604 1.00 0.00 C ATOM 2876 OE1 GLU C 105 11.193 -31.058 -15.330 1.00 0.00 O ATOM 2877 OE2 GLU C 105 13.245 -31.567 -14.749 1.00 0.00 O1- ATOM 0 H GLU C 105 12.405 -33.429 -10.853 1.00 0.00 H new ATOM 0 HA GLU C 105 13.051 -30.970 -12.103 1.00 0.00 H new ATOM 0 HB2 GLU C 105 10.465 -32.505 -11.608 1.00 0.00 H new ATOM 0 HB3 GLU C 105 10.490 -30.996 -12.498 1.00 0.00 H new ATOM 0 HG2 GLU C 105 12.200 -33.393 -13.288 1.00 0.00 H new ATOM 0 HG3 GLU C 105 10.575 -33.150 -13.897 1.00 0.00 H new ATOM 2884 N GLU C 106 11.454 -30.687 -9.215 1.00 0.00 N ATOM 2885 CA GLU C 106 11.172 -29.724 -8.140 1.00 0.00 C ATOM 2886 C GLU C 106 12.444 -28.988 -7.687 1.00 0.00 C ATOM 2887 O GLU C 106 12.441 -27.755 -7.609 1.00 0.00 O ATOM 2888 CB GLU C 106 10.496 -30.447 -6.964 1.00 0.00 C ATOM 2889 CG GLU C 106 9.965 -29.513 -5.862 1.00 0.00 C ATOM 2890 CD GLU C 106 11.032 -28.968 -4.886 1.00 0.00 C ATOM 2891 OE1 GLU C 106 11.890 -29.747 -4.402 1.00 0.00 O1- ATOM 2892 OE2 GLU C 106 10.959 -27.767 -4.530 1.00 0.00 O ATOM 0 H GLU C 106 11.261 -31.655 -8.958 1.00 0.00 H new ATOM 0 HA GLU C 106 10.492 -28.965 -8.526 1.00 0.00 H new ATOM 0 HB2 GLU C 106 9.668 -31.043 -7.348 1.00 0.00 H new ATOM 0 HB3 GLU C 106 11.210 -31.141 -6.521 1.00 0.00 H new ATOM 0 HG2 GLU C 106 9.464 -28.668 -6.335 1.00 0.00 H new ATOM 0 HG3 GLU C 106 9.211 -30.049 -5.287 1.00 0.00 H new ATOM 2899 N GLU C 107 13.541 -29.716 -7.444 1.00 0.00 N ATOM 2900 CA GLU C 107 14.808 -29.104 -7.027 1.00 0.00 C ATOM 2901 C GLU C 107 15.395 -28.189 -8.119 1.00 0.00 C ATOM 2902 O GLU C 107 15.808 -27.060 -7.831 1.00 0.00 O ATOM 2903 CB GLU C 107 15.804 -30.198 -6.611 1.00 0.00 C ATOM 2904 CG GLU C 107 17.070 -29.599 -5.985 1.00 0.00 C ATOM 2905 CD GLU C 107 18.019 -30.699 -5.477 1.00 0.00 C ATOM 2906 OE1 GLU C 107 17.831 -31.191 -4.336 1.00 0.00 O1- ATOM 2907 OE2 GLU C 107 18.978 -31.063 -6.201 1.00 0.00 O ATOM 0 H GLU C 107 13.576 -30.732 -7.529 1.00 0.00 H new ATOM 0 HA GLU C 107 14.610 -28.466 -6.166 1.00 0.00 H new ATOM 0 HB2 GLU C 107 15.329 -30.872 -5.898 1.00 0.00 H new ATOM 0 HB3 GLU C 107 16.075 -30.795 -7.482 1.00 0.00 H new ATOM 0 HG2 GLU C 107 17.586 -28.983 -6.722 1.00 0.00 H new ATOM 0 HG3 GLU C 107 16.794 -28.944 -5.159 1.00 0.00 H new ATOM 2914 N GLU C 108 15.396 -28.637 -9.381 1.00 0.00 N ATOM 2915 CA GLU C 108 15.908 -27.845 -10.503 1.00 0.00 C ATOM 2916 C GLU C 108 15.028 -26.616 -10.802 1.00 0.00 C ATOM 2917 O GLU C 108 15.558 -25.540 -11.082 1.00 0.00 O ATOM 2918 CB GLU C 108 16.064 -28.747 -11.739 1.00 0.00 C ATOM 2919 CG GLU C 108 16.990 -28.151 -12.808 1.00 0.00 C ATOM 2920 CD GLU C 108 18.473 -28.230 -12.396 1.00 0.00 C ATOM 2921 OE1 GLU C 108 19.133 -29.256 -12.691 1.00 0.00 O ATOM 2922 OE2 GLU C 108 18.996 -27.262 -11.791 1.00 0.00 O1- ATOM 0 H GLU C 108 15.043 -29.555 -9.651 1.00 0.00 H new ATOM 0 HA GLU C 108 16.886 -27.452 -10.226 1.00 0.00 H new ATOM 0 HB2 GLU C 108 16.455 -29.715 -11.427 1.00 0.00 H new ATOM 0 HB3 GLU C 108 15.082 -28.926 -12.177 1.00 0.00 H new ATOM 0 HG2 GLU C 108 16.846 -28.682 -13.749 1.00 0.00 H new ATOM 0 HG3 GLU C 108 16.718 -27.110 -12.984 1.00 0.00 H new ATOM 2929 N LEU C 109 13.695 -26.725 -10.688 1.00 0.00 N ATOM 2930 CA LEU C 109 12.773 -25.592 -10.778 1.00 0.00 C ATOM 2931 C LEU C 109 13.081 -24.543 -9.706 1.00 0.00 C ATOM 2932 O LEU C 109 13.257 -23.370 -10.034 1.00 0.00 O ATOM 2933 CB LEU C 109 11.325 -26.118 -10.675 1.00 0.00 C ATOM 2934 CG LEU C 109 10.184 -25.084 -10.728 1.00 0.00 C ATOM 2935 CD1 LEU C 109 9.994 -24.281 -9.437 1.00 0.00 C ATOM 2936 CD2 LEU C 109 10.372 -24.124 -11.896 1.00 0.00 C ATOM 0 H LEU C 109 13.225 -27.616 -10.529 1.00 0.00 H new ATOM 0 HA LEU C 109 12.897 -25.093 -11.739 1.00 0.00 H new ATOM 0 HB2 LEU C 109 11.169 -26.832 -11.484 1.00 0.00 H new ATOM 0 HB3 LEU C 109 11.234 -26.671 -9.740 1.00 0.00 H new ATOM 0 HG LEU C 109 9.278 -25.675 -10.863 1.00 0.00 H new ATOM 0 HD11 LEU C 109 9.171 -23.578 -9.564 1.00 0.00 H new ATOM 0 HD12 LEU C 109 9.767 -24.961 -8.616 1.00 0.00 H new ATOM 0 HD13 LEU C 109 10.908 -23.732 -9.212 1.00 0.00 H new ATOM 0 HD21 LEU C 109 9.553 -23.404 -11.911 1.00 0.00 H new ATOM 0 HD22 LEU C 109 11.318 -23.595 -11.783 1.00 0.00 H new ATOM 0 HD23 LEU C 109 10.379 -24.685 -12.831 1.00 0.00 H new ATOM 2948 N LEU C 110 13.178 -24.953 -8.438 1.00 0.00 N ATOM 2949 CA LEU C 110 13.497 -24.048 -7.331 1.00 0.00 C ATOM 2950 C LEU C 110 14.828 -23.322 -7.590 1.00 0.00 C ATOM 2951 O LEU C 110 14.877 -22.094 -7.520 1.00 0.00 O ATOM 2952 CB LEU C 110 13.493 -24.843 -6.011 1.00 0.00 C ATOM 2953 CG LEU C 110 13.797 -24.005 -4.753 1.00 0.00 C ATOM 2954 CD1 LEU C 110 12.746 -22.920 -4.492 1.00 0.00 C ATOM 2955 CD2 LEU C 110 13.849 -24.912 -3.524 1.00 0.00 C ATOM 0 H LEU C 110 13.038 -25.922 -8.150 1.00 0.00 H new ATOM 0 HA LEU C 110 12.738 -23.270 -7.252 1.00 0.00 H new ATOM 0 HB2 LEU C 110 12.518 -25.315 -5.890 1.00 0.00 H new ATOM 0 HB3 LEU C 110 14.228 -25.645 -6.083 1.00 0.00 H new ATOM 0 HG LEU C 110 14.756 -23.520 -4.932 1.00 0.00 H new ATOM 0 HD11 LEU C 110 13.013 -22.363 -3.594 1.00 0.00 H new ATOM 0 HD12 LEU C 110 12.706 -22.240 -5.343 1.00 0.00 H new ATOM 0 HD13 LEU C 110 11.770 -23.385 -4.353 1.00 0.00 H new ATOM 0 HD21 LEU C 110 14.064 -24.313 -2.639 1.00 0.00 H new ATOM 0 HD22 LEU C 110 12.888 -25.411 -3.399 1.00 0.00 H new ATOM 0 HD23 LEU C 110 14.632 -25.659 -3.656 1.00 0.00 H new ATOM 2967 N ARG C 111 15.879 -24.051 -7.994 1.00 0.00 N ATOM 2968 CA ARG C 111 17.177 -23.466 -8.377 1.00 0.00 C ATOM 2969 C ARG C 111 17.018 -22.436 -9.504 1.00 0.00 C ATOM 2970 O ARG C 111 17.475 -21.302 -9.357 1.00 0.00 O ATOM 2971 CB ARG C 111 18.148 -24.608 -8.748 1.00 0.00 C ATOM 2972 CG ARG C 111 19.643 -24.244 -8.733 1.00 0.00 C ATOM 2973 CD ARG C 111 20.024 -23.051 -9.621 1.00 0.00 C ATOM 2974 NE ARG C 111 21.476 -23.044 -9.901 1.00 0.00 N ATOM 2975 CZ ARG C 111 22.102 -22.514 -10.938 1.00 0.00 C ATOM 2976 NH1 ARG C 111 21.468 -21.919 -11.910 1.00 0.00 N1+ ATOM 2977 NH2 ARG C 111 23.400 -22.570 -11.014 1.00 0.00 N ATOM 0 H ARG C 111 15.854 -25.068 -8.065 1.00 0.00 H new ATOM 0 HA ARG C 111 17.596 -22.917 -7.534 1.00 0.00 H new ATOM 0 HB2 ARG C 111 17.987 -25.436 -8.057 1.00 0.00 H new ATOM 0 HB3 ARG C 111 17.891 -24.970 -9.744 1.00 0.00 H new ATOM 0 HG2 ARG C 111 19.939 -24.024 -7.707 1.00 0.00 H new ATOM 0 HG3 ARG C 111 20.218 -25.114 -9.051 1.00 0.00 H new ATOM 0 HD2 ARG C 111 19.469 -23.098 -10.558 1.00 0.00 H new ATOM 0 HD3 ARG C 111 19.740 -22.121 -9.129 1.00 0.00 H new ATOM 0 HE ARG C 111 22.067 -23.505 -9.209 1.00 0.00 H new ATOM 0 HH11 ARG C 111 20.451 -21.849 -11.888 1.00 0.00 H new ATOM 0 HH12 ARG C 111 21.990 -21.523 -12.692 1.00 0.00 H new ATOM 0 HH21 ARG C 111 23.935 -23.023 -10.273 1.00 0.00 H new ATOM 0 HH22 ARG C 111 23.882 -22.161 -11.814 1.00 0.00 H new ATOM 2991 N LYS C 112 16.344 -22.791 -10.604 1.00 0.00 N ATOM 2992 CA LYS C 112 16.087 -21.883 -11.743 1.00 0.00 C ATOM 2993 C LYS C 112 15.358 -20.614 -11.303 1.00 0.00 C ATOM 2994 O LYS C 112 15.764 -19.521 -11.681 1.00 0.00 O ATOM 2995 CB LYS C 112 15.254 -22.590 -12.826 1.00 0.00 C ATOM 2996 CG LYS C 112 16.088 -23.494 -13.742 1.00 0.00 C ATOM 2997 CD LYS C 112 15.203 -24.113 -14.840 1.00 0.00 C ATOM 2998 CE LYS C 112 15.068 -25.633 -14.685 1.00 0.00 C ATOM 2999 NZ LYS C 112 14.219 -26.223 -15.758 1.00 0.00 N1+ ATOM 0 H LYS C 112 15.955 -23.725 -10.736 1.00 0.00 H new ATOM 0 HA LYS C 112 17.059 -21.603 -12.150 1.00 0.00 H new ATOM 0 HB2 LYS C 112 14.479 -23.188 -12.346 1.00 0.00 H new ATOM 0 HB3 LYS C 112 14.747 -21.839 -13.432 1.00 0.00 H new ATOM 0 HG2 LYS C 112 16.893 -22.917 -14.198 1.00 0.00 H new ATOM 0 HG3 LYS C 112 16.556 -24.284 -13.155 1.00 0.00 H new ATOM 0 HD2 LYS C 112 14.214 -23.657 -14.807 1.00 0.00 H new ATOM 0 HD3 LYS C 112 15.627 -23.885 -15.818 1.00 0.00 H new ATOM 0 HE2 LYS C 112 16.057 -26.091 -14.710 1.00 0.00 H new ATOM 0 HE3 LYS C 112 14.636 -25.863 -13.711 1.00 0.00 H new ATOM 0 HZ1 LYS C 112 14.151 -27.252 -15.620 1.00 0.00 H new ATOM 0 HZ2 LYS C 112 13.268 -25.804 -15.718 1.00 0.00 H new ATOM 0 HZ3 LYS C 112 14.645 -26.025 -16.686 1.00 0.00 H new ATOM 3013 N ALA C 113 14.342 -20.754 -10.453 1.00 0.00 N ATOM 3014 CA ALA C 113 13.564 -19.625 -9.932 1.00 0.00 C ATOM 3015 C ALA C 113 14.448 -18.662 -9.122 1.00 0.00 C ATOM 3016 O ALA C 113 14.440 -17.459 -9.393 1.00 0.00 O ATOM 3017 CB ALA C 113 12.372 -20.130 -9.107 1.00 0.00 C ATOM 0 H ALA C 113 14.031 -21.660 -10.102 1.00 0.00 H new ATOM 0 HA ALA C 113 13.172 -19.061 -10.778 1.00 0.00 H new ATOM 0 HB1 ALA C 113 11.805 -19.279 -8.728 1.00 0.00 H new ATOM 0 HB2 ALA C 113 11.728 -20.744 -9.737 1.00 0.00 H new ATOM 0 HB3 ALA C 113 12.735 -20.726 -8.270 1.00 0.00 H new ATOM 3023 N ILE C 114 15.276 -19.182 -8.201 1.00 0.00 N ATOM 3024 CA ILE C 114 16.266 -18.367 -7.476 1.00 0.00 C ATOM 3025 C ILE C 114 17.195 -17.664 -8.467 1.00 0.00 C ATOM 3026 O ILE C 114 17.318 -16.446 -8.399 1.00 0.00 O ATOM 3027 CB ILE C 114 17.049 -19.187 -6.412 1.00 0.00 C ATOM 3028 CG1 ILE C 114 16.276 -19.268 -5.075 1.00 0.00 C ATOM 3029 CG2 ILE C 114 18.428 -18.564 -6.108 1.00 0.00 C ATOM 3030 CD1 ILE C 114 15.115 -20.262 -5.081 1.00 0.00 C ATOM 0 H ILE C 114 15.279 -20.168 -7.940 1.00 0.00 H new ATOM 0 HA ILE C 114 15.726 -17.604 -6.916 1.00 0.00 H new ATOM 0 HB ILE C 114 17.174 -20.182 -6.839 1.00 0.00 H new ATOM 0 HG12 ILE C 114 16.972 -19.544 -4.282 1.00 0.00 H new ATOM 0 HG13 ILE C 114 15.891 -18.278 -4.831 1.00 0.00 H new ATOM 0 HG21 ILE C 114 18.943 -19.167 -5.360 1.00 0.00 H new ATOM 0 HG22 ILE C 114 19.023 -18.533 -7.021 1.00 0.00 H new ATOM 0 HG23 ILE C 114 18.294 -17.551 -5.728 1.00 0.00 H new ATOM 0 HD11 ILE C 114 14.627 -20.257 -4.107 1.00 0.00 H new ATOM 0 HD12 ILE C 114 14.396 -19.977 -5.849 1.00 0.00 H new ATOM 0 HD13 ILE C 114 15.493 -21.262 -5.292 1.00 0.00 H new ATOM 3042 N ALA C 115 17.804 -18.388 -9.408 1.00 0.00 N ATOM 3043 CA ALA C 115 18.794 -17.821 -10.320 1.00 0.00 C ATOM 3044 C ALA C 115 18.188 -16.712 -11.196 1.00 0.00 C ATOM 3045 O ALA C 115 18.722 -15.608 -11.285 1.00 0.00 O ATOM 3046 CB ALA C 115 19.392 -18.968 -11.145 1.00 0.00 C ATOM 0 H ALA C 115 17.624 -19.381 -9.558 1.00 0.00 H new ATOM 0 HA ALA C 115 19.591 -17.337 -9.756 1.00 0.00 H new ATOM 0 HB1 ALA C 115 20.136 -18.570 -11.835 1.00 0.00 H new ATOM 0 HB2 ALA C 115 19.865 -19.688 -10.477 1.00 0.00 H new ATOM 0 HB3 ALA C 115 18.601 -19.462 -11.709 1.00 0.00 H new ATOM 3052 N GLU C 116 17.022 -16.959 -11.782 1.00 0.00 N ATOM 3053 CA GLU C 116 16.307 -15.998 -12.625 1.00 0.00 C ATOM 3054 C GLU C 116 15.716 -14.823 -11.828 1.00 0.00 C ATOM 3055 O GLU C 116 15.564 -13.735 -12.381 1.00 0.00 O ATOM 3056 CB GLU C 116 15.262 -16.740 -13.463 1.00 0.00 C ATOM 3057 CG GLU C 116 15.966 -17.596 -14.529 1.00 0.00 C ATOM 3058 CD GLU C 116 14.945 -18.243 -15.482 1.00 0.00 C ATOM 3059 OE1 GLU C 116 14.457 -19.365 -15.199 1.00 0.00 O ATOM 3060 OE2 GLU C 116 14.628 -17.634 -16.535 1.00 0.00 O1- ATOM 0 H GLU C 116 16.535 -17.850 -11.685 1.00 0.00 H new ATOM 0 HA GLU C 116 17.023 -15.532 -13.302 1.00 0.00 H new ATOM 0 HB2 GLU C 116 14.649 -17.373 -12.821 1.00 0.00 H new ATOM 0 HB3 GLU C 116 14.591 -16.026 -13.941 1.00 0.00 H new ATOM 0 HG2 GLU C 116 16.658 -16.976 -15.099 1.00 0.00 H new ATOM 0 HG3 GLU C 116 16.558 -18.372 -14.044 1.00 0.00 H new ATOM 3067 N SER C 117 15.499 -14.980 -10.518 1.00 0.00 N ATOM 3068 CA SER C 117 15.119 -13.877 -9.623 1.00 0.00 C ATOM 3069 C SER C 117 16.163 -12.752 -9.580 1.00 0.00 C ATOM 3070 O SER C 117 15.785 -11.579 -9.579 1.00 0.00 O ATOM 3071 CB SER C 117 14.916 -14.401 -8.203 1.00 0.00 C ATOM 3072 OG SER C 117 14.216 -13.465 -7.403 1.00 0.00 O ATOM 0 H SER C 117 15.582 -15.880 -10.044 1.00 0.00 H new ATOM 0 HA SER C 117 14.194 -13.463 -10.024 1.00 0.00 H new ATOM 0 HB2 SER C 117 14.363 -15.340 -8.235 1.00 0.00 H new ATOM 0 HB3 SER C 117 15.884 -14.617 -7.751 1.00 0.00 H new ATOM 0 HG SER C 117 13.283 -13.416 -7.697 1.00 0.00 H new ATOM 3078 N LEU C 118 17.470 -13.081 -9.585 1.00 0.00 N ATOM 3079 CA LEU C 118 18.532 -12.063 -9.686 1.00 0.00 C ATOM 3080 C LEU C 118 18.919 -11.735 -11.140 1.00 0.00 C ATOM 3081 O LEU C 118 19.203 -10.579 -11.450 1.00 0.00 O ATOM 3082 CB LEU C 118 19.754 -12.397 -8.803 1.00 0.00 C ATOM 3083 CG LEU C 118 20.567 -13.658 -9.162 1.00 0.00 C ATOM 3084 CD1 LEU C 118 22.062 -13.404 -9.022 1.00 0.00 C ATOM 3085 CD2 LEU C 118 20.234 -14.821 -8.235 1.00 0.00 C ATOM 0 H LEU C 118 17.813 -14.039 -9.521 1.00 0.00 H new ATOM 0 HA LEU C 118 18.105 -11.144 -9.284 1.00 0.00 H new ATOM 0 HB2 LEU C 118 20.430 -11.542 -8.827 1.00 0.00 H new ATOM 0 HB3 LEU C 118 19.408 -12.501 -7.775 1.00 0.00 H new ATOM 0 HG LEU C 118 20.306 -13.902 -10.192 1.00 0.00 H new ATOM 0 HD11 LEU C 118 22.611 -14.309 -9.281 1.00 0.00 H new ATOM 0 HD12 LEU C 118 22.358 -12.596 -9.691 1.00 0.00 H new ATOM 0 HD13 LEU C 118 22.289 -13.124 -7.993 1.00 0.00 H new ATOM 0 HD21 LEU C 118 20.825 -15.692 -8.517 1.00 0.00 H new ATOM 0 HD22 LEU C 118 20.465 -14.544 -7.206 1.00 0.00 H new ATOM 0 HD23 LEU C 118 19.174 -15.060 -8.317 1.00 0.00 H new ATOM 3097 N ASN C 119 18.884 -12.723 -12.045 1.00 0.00 N ATOM 3098 CA ASN C 119 19.284 -12.541 -13.449 1.00 0.00 C ATOM 3099 C ASN C 119 18.253 -11.752 -14.286 1.00 0.00 C ATOM 3100 O ASN C 119 18.613 -11.142 -15.294 1.00 0.00 O ATOM 3101 CB ASN C 119 19.585 -13.913 -14.082 1.00 0.00 C ATOM 3102 CG ASN C 119 20.973 -14.427 -13.743 1.00 0.00 C ATOM 3103 OD1 ASN C 119 21.952 -14.141 -14.420 1.00 0.00 O ATOM 3104 ND2 ASN C 119 21.107 -15.195 -12.688 1.00 0.00 N ATOM 0 H ASN C 119 18.578 -13.671 -11.825 1.00 0.00 H new ATOM 0 HA ASN C 119 20.187 -11.930 -13.451 1.00 0.00 H new ATOM 0 HB2 ASN C 119 18.842 -14.635 -13.743 1.00 0.00 H new ATOM 0 HB3 ASN C 119 19.485 -13.838 -15.165 1.00 0.00 H new ATOM 0 HD21 ASN C 119 22.027 -15.554 -12.432 1.00 0.00 H new ATOM 0 HD22 ASN C 119 20.291 -15.433 -12.124 1.00 0.00 H new