USER MOD reduce.3.24.130724 H: found=0, std=0, add=892, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 896 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 103 THR OG1 : rot -76:sc= 0.326 USER MOD Set 1.2: A 127 CYS SG : rot 134:sc= -4.21! USER MOD Set 2.1: A 105 THR OG1 : rot 129:sc= 1.84 USER MOD Set 2.2: A 108 THR OG1 : rot -40:sc= 0.523 USER MOD Set 3.1: A 9 ASN : amide:sc= -11.4! C(o=-26!,f=-27!) USER MOD Set 3.2: A 16 CYS SG : rot 107:sc= -7.01! USER MOD Set 3.3: A 130 MET CE :methyl 167:sc= -7.5! (180deg=-5.82!) USER MOD Set 4.1: A 6 TYR OH : rot 150:sc= -4.53! USER MOD Set 4.2: A 133 HIS : no HD1:sc= -4.67 X(o=-9.2,f=-8.7!) USER MOD Single : A 4 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 11 MET CE :methyl 142:sc= -0.98 (180deg=-3.75!) USER MOD Single : A 15 THR OG1 : rot 12:sc= 0.0874 USER MOD Single : A 17 GLN : amide:sc= -0.446 X(o=-0.45,f=-0.5) USER MOD Single : A 24 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ -140:sc= -0.187 (180deg=-1.46!) USER MOD Single : A 27 SER OG : rot 39:sc= 0.235 USER MOD Single : A 29 SER OG : rot 87:sc= 0.0335 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 THR OG1 : rot 39:sc= 1.04 USER MOD Single : A 41 ASN : amide:sc= -0.218 K(o=-0.22,f=-3!) USER MOD Single : A 43 THR OG1 : rot 180:sc= -1.52 USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 61 ASN : amide:sc= -5.56! C(o=-5.6!,f=-8.8!) USER MOD Single : A 64 THR OG1 : rot 170:sc= -2.15! USER MOD Single : A 68 GLN : amide:sc= -3.01 K(o=-3,f=-2.1) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 CYS SG : rot 32:sc= -0.47 USER MOD Single : A 71 SER OG : rot -57:sc= -3.65! USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 161:sc= -0.185 USER MOD Single : A 85 MET CE :methyl -127:sc= -1.95 (180deg=-8.75!) USER MOD Single : A 89 THR OG1 : rot -11:sc= 0.864 USER MOD Single : A 90 LYS NZ :NH3+ -130:sc= -0.944 (180deg=-4.19!) USER MOD Single : A 99 ASN : amide:sc= -1.05! C(o=-1.1!,f=-0.52!) USER MOD Single : A 101 THR OG1 : rot -140:sc= 0 USER MOD Single : A 104 LYS NZ :NH3+ 155:sc= -0.23 (180deg=-0.988) USER MOD Single : A 107 LYS NZ :NH3+ -148:sc= 0.279 (180deg=0.00952) USER MOD Single : A 113 MET CE :methyl 165:sc= -0.409 (180deg=-0.703) USER MOD Single : A 124 ASN : amide:sc= -1.29 K(o=-1.3,f=-2.3!) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 LYS NZ :NH3+ -162:sc= -0.102 (180deg=-0.573) USER MOD Single : A 128 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 SER OG : rot 40:sc= 0.403 USER MOD Single : A 137 SER OG : rot -46:sc= 0.753 USER MOD Single : A 138 GLN : amide:sc= -0.109 K(o=-0.11,f=-0.91) USER MOD Single : A 139 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 20 N TRP A 3 -17.136 14.119 0.866 1.00 0.00 N ATOM 21 CA TRP A 3 -16.918 12.922 -0.029 1.00 0.00 C ATOM 22 C TRP A 3 -17.511 13.190 -1.453 1.00 0.00 C ATOM 23 O TRP A 3 -16.839 13.030 -2.470 1.00 0.00 O ATOM 24 CB TRP A 3 -17.639 11.736 0.545 1.00 0.00 C ATOM 25 CG TRP A 3 -16.818 10.984 1.570 1.00 0.00 C ATOM 26 CD1 TRP A 3 -17.213 9.819 2.082 1.00 0.00 C ATOM 27 CD2 TRP A 3 -15.519 11.286 2.216 1.00 0.00 C ATOM 28 NE1 TRP A 3 -16.280 9.369 2.995 1.00 0.00 N ATOM 29 CE2 TRP A 3 -15.222 10.233 3.115 1.00 0.00 C ATOM 30 CE3 TRP A 3 -14.589 12.341 2.125 1.00 0.00 C ATOM 31 CZ2 TRP A 3 -14.063 10.223 3.881 1.00 0.00 C ATOM 32 CZ3 TRP A 3 -13.414 12.328 2.901 1.00 0.00 C ATOM 33 CH2 TRP A 3 -13.158 11.272 3.777 1.00 0.00 C ATOM 0 HA TRP A 3 -15.846 12.736 -0.099 1.00 0.00 H new ATOM 0 HB2 TRP A 3 -18.568 12.071 1.007 1.00 0.00 H new ATOM 0 HB3 TRP A 3 -17.911 11.057 -0.263 1.00 0.00 H new ATOM 0 HD1 TRP A 3 -18.126 9.304 1.822 1.00 0.00 H new ATOM 0 HE1 TRP A 3 -16.367 8.498 3.518 1.00 0.00 H new ATOM 0 HE3 TRP A 3 -14.779 13.166 1.455 1.00 0.00 H new ATOM 0 HZ2 TRP A 3 -13.866 9.402 4.555 1.00 0.00 H new ATOM 0 HZ3 TRP A 3 -12.707 13.140 2.818 1.00 0.00 H new ATOM 0 HH2 TRP A 3 -12.258 11.270 4.373 1.00 0.00 H new ATOM 44 N ASN A 4 -18.791 13.557 -1.502 1.00 0.00 N ATOM 45 CA ASN A 4 -19.508 13.804 -2.817 1.00 0.00 C ATOM 46 C ASN A 4 -18.805 14.859 -3.669 1.00 0.00 C ATOM 47 O ASN A 4 -18.853 14.797 -4.883 1.00 0.00 O ATOM 48 CB ASN A 4 -20.938 14.267 -2.532 1.00 0.00 C ATOM 49 CG ASN A 4 -21.838 13.054 -2.291 1.00 0.00 C ATOM 50 OD1 ASN A 4 -22.452 12.548 -3.208 1.00 0.00 O ATOM 51 ND2 ASN A 4 -21.943 12.565 -1.085 1.00 0.00 N ATOM 0 H ASN A 4 -19.372 13.696 -0.676 1.00 0.00 H new ATOM 0 HA ASN A 4 -19.506 12.868 -3.375 1.00 0.00 H new ATOM 0 HB2 ASN A 4 -20.951 14.920 -1.659 1.00 0.00 H new ATOM 0 HB3 ASN A 4 -21.315 14.850 -3.372 1.00 0.00 H new ATOM 0 HD21 ASN A 4 -22.541 11.757 -0.913 1.00 0.00 H new ATOM 0 HD22 ASN A 4 -21.427 12.991 -0.315 1.00 0.00 H new ATOM 58 N ALA A 5 -18.157 15.807 -3.047 1.00 0.00 N ATOM 59 CA ALA A 5 -17.405 16.890 -3.823 1.00 0.00 C ATOM 60 C ALA A 5 -16.162 16.236 -4.435 1.00 0.00 C ATOM 61 O ALA A 5 -15.727 16.558 -5.545 1.00 0.00 O ATOM 62 CB ALA A 5 -16.991 18.014 -2.863 1.00 0.00 C ATOM 0 H ALA A 5 -18.104 15.896 -2.032 1.00 0.00 H new ATOM 0 HA ALA A 5 -18.033 17.319 -4.604 1.00 0.00 H new ATOM 0 HB1 ALA A 5 -16.455 18.786 -3.416 1.00 0.00 H new ATOM 0 HB2 ALA A 5 -17.880 18.447 -2.405 1.00 0.00 H new ATOM 0 HB3 ALA A 5 -16.343 17.608 -2.086 1.00 0.00 H new ATOM 68 N TYR A 6 -15.618 15.289 -3.722 1.00 0.00 N ATOM 69 CA TYR A 6 -14.430 14.531 -4.199 1.00 0.00 C ATOM 70 C TYR A 6 -14.880 13.640 -5.367 1.00 0.00 C ATOM 71 O TYR A 6 -14.094 13.210 -6.182 1.00 0.00 O ATOM 72 CB TYR A 6 -13.866 13.761 -2.975 1.00 0.00 C ATOM 73 CG TYR A 6 -13.790 14.752 -1.777 1.00 0.00 C ATOM 74 CD1 TYR A 6 -13.685 16.151 -2.006 1.00 0.00 C ATOM 75 CD2 TYR A 6 -13.883 14.289 -0.494 1.00 0.00 C ATOM 76 CE1 TYR A 6 -13.672 17.042 -0.948 1.00 0.00 C ATOM 77 CE2 TYR A 6 -13.880 15.198 0.581 1.00 0.00 C ATOM 78 CZ TYR A 6 -13.774 16.571 0.343 1.00 0.00 C ATOM 79 OH TYR A 6 -13.796 17.456 1.389 1.00 0.00 O ATOM 0 H TYR A 6 -15.958 15.003 -2.804 1.00 0.00 H new ATOM 0 HA TYR A 6 -13.625 15.157 -4.585 1.00 0.00 H new ATOM 0 HB2 TYR A 6 -14.507 12.914 -2.729 1.00 0.00 H new ATOM 0 HB3 TYR A 6 -12.878 13.359 -3.200 1.00 0.00 H new ATOM 0 HD1 TYR A 6 -13.615 16.523 -3.018 1.00 0.00 H new ATOM 0 HD2 TYR A 6 -13.959 13.228 -0.306 1.00 0.00 H new ATOM 0 HE1 TYR A 6 -13.582 18.102 -1.133 1.00 0.00 H new ATOM 0 HE2 TYR A 6 -13.960 14.833 1.594 1.00 0.00 H new ATOM 0 HH TYR A 6 -14.323 17.080 2.125 1.00 0.00 H new ATOM 89 N ILE A 7 -16.181 13.452 -5.468 1.00 0.00 N ATOM 90 CA ILE A 7 -16.801 12.712 -6.612 1.00 0.00 C ATOM 91 C ILE A 7 -17.140 13.793 -7.722 1.00 0.00 C ATOM 92 O ILE A 7 -17.146 13.534 -8.959 1.00 0.00 O ATOM 93 CB ILE A 7 -18.031 11.988 -6.094 1.00 0.00 C ATOM 94 CG1 ILE A 7 -17.527 10.791 -5.246 1.00 0.00 C ATOM 95 CG2 ILE A 7 -18.928 11.527 -7.250 1.00 0.00 C ATOM 96 CD1 ILE A 7 -17.173 9.583 -6.122 1.00 0.00 C ATOM 0 H ILE A 7 -16.854 13.793 -4.782 1.00 0.00 H new ATOM 0 HA ILE A 7 -16.145 11.959 -7.049 1.00 0.00 H new ATOM 0 HB ILE A 7 -18.644 12.651 -5.484 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -16.651 11.094 -4.673 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -18.295 10.506 -4.527 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -19.801 11.012 -6.850 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -19.251 12.393 -7.828 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -18.370 10.848 -7.895 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -16.824 8.766 -5.491 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -18.056 9.263 -6.675 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -16.387 9.861 -6.824 1.00 0.00 H new ATOM 108 N ASP A 8 -17.363 15.026 -7.263 1.00 0.00 N ATOM 109 CA ASP A 8 -17.623 16.151 -8.179 1.00 0.00 C ATOM 110 C ASP A 8 -16.351 16.391 -9.018 1.00 0.00 C ATOM 111 O ASP A 8 -16.396 17.007 -10.044 1.00 0.00 O ATOM 112 CB ASP A 8 -18.004 17.379 -7.360 1.00 0.00 C ATOM 113 CG ASP A 8 -19.521 17.415 -7.166 1.00 0.00 C ATOM 114 OD1 ASP A 8 -20.062 16.429 -6.691 1.00 0.00 O ATOM 115 OD2 ASP A 8 -20.117 18.429 -7.495 1.00 0.00 O ATOM 0 H ASP A 8 -17.370 15.275 -6.274 1.00 0.00 H new ATOM 0 HA ASP A 8 -18.449 15.933 -8.856 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -17.504 17.353 -6.392 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -17.670 18.285 -7.867 1.00 0.00 H new ATOM 120 N ASN A 9 -15.225 15.850 -8.558 1.00 0.00 N ATOM 121 CA ASN A 9 -13.922 15.934 -9.262 1.00 0.00 C ATOM 122 C ASN A 9 -14.076 15.276 -10.621 1.00 0.00 C ATOM 123 O ASN A 9 -14.112 15.915 -11.619 1.00 0.00 O ATOM 124 CB ASN A 9 -12.915 15.184 -8.282 1.00 0.00 C ATOM 125 CG ASN A 9 -11.877 14.165 -8.947 1.00 0.00 C ATOM 126 OD1 ASN A 9 -11.106 14.545 -9.795 1.00 0.00 O ATOM 127 ND2 ASN A 9 -11.814 12.843 -8.493 1.00 0.00 N ATOM 0 H ASN A 9 -15.178 15.334 -7.679 1.00 0.00 H new ATOM 0 HA ASN A 9 -13.558 16.941 -9.466 1.00 0.00 H new ATOM 0 HB2 ASN A 9 -12.347 15.939 -7.738 1.00 0.00 H new ATOM 0 HB3 ASN A 9 -13.504 14.636 -7.546 1.00 0.00 H new ATOM 0 HD21 ASN A 9 -11.118 12.204 -8.878 1.00 0.00 H new ATOM 0 HD22 ASN A 9 -12.464 12.518 -7.777 1.00 0.00 H new ATOM 134 N LEU A 10 -14.179 14.012 -10.610 1.00 0.00 N ATOM 135 CA LEU A 10 -14.378 13.131 -11.878 1.00 0.00 C ATOM 136 C LEU A 10 -15.289 13.747 -12.824 1.00 0.00 C ATOM 137 O LEU A 10 -15.160 13.610 -14.044 1.00 0.00 O ATOM 138 CB LEU A 10 -15.071 11.848 -11.475 1.00 0.00 C ATOM 139 CG LEU A 10 -14.349 11.153 -10.369 1.00 0.00 C ATOM 140 CD1 LEU A 10 -12.783 11.313 -10.543 1.00 0.00 C ATOM 141 CD2 LEU A 10 -14.874 11.713 -8.993 1.00 0.00 C ATOM 0 H LEU A 10 -14.138 13.467 -9.749 1.00 0.00 H new ATOM 0 HA LEU A 10 -13.392 12.984 -12.319 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -16.091 12.069 -11.161 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -15.139 11.185 -12.338 1.00 0.00 H new ATOM 0 HG LEU A 10 -14.549 10.082 -10.395 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -12.272 10.800 -9.728 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -12.476 10.878 -11.494 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -12.521 12.371 -10.527 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -14.355 11.214 -8.175 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -14.686 12.785 -8.941 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -15.945 11.528 -8.910 1.00 0.00 H new ATOM 153 N MET A 11 -16.250 14.350 -12.288 1.00 0.00 N ATOM 154 CA MET A 11 -17.279 14.938 -13.100 1.00 0.00 C ATOM 155 C MET A 11 -16.700 16.254 -13.735 1.00 0.00 C ATOM 156 O MET A 11 -16.824 16.500 -14.922 1.00 0.00 O ATOM 157 CB MET A 11 -18.496 15.136 -12.158 1.00 0.00 C ATOM 158 CG MET A 11 -18.745 13.783 -11.281 1.00 0.00 C ATOM 159 SD MET A 11 -20.002 12.773 -12.101 1.00 0.00 S ATOM 160 CE MET A 11 -18.948 12.157 -13.435 1.00 0.00 C ATOM 0 H MET A 11 -16.374 14.466 -11.282 1.00 0.00 H new ATOM 0 HA MET A 11 -17.608 14.329 -13.942 1.00 0.00 H new ATOM 0 HB2 MET A 11 -18.319 15.983 -11.495 1.00 0.00 H new ATOM 0 HB3 MET A 11 -19.386 15.370 -12.743 1.00 0.00 H new ATOM 0 HG2 MET A 11 -17.816 13.222 -11.183 1.00 0.00 H new ATOM 0 HG3 MET A 11 -19.069 14.042 -10.273 1.00 0.00 H new ATOM 0 HE1 MET A 11 -19.195 11.116 -13.643 1.00 0.00 H new ATOM 0 HE2 MET A 11 -19.110 12.755 -14.332 1.00 0.00 H new ATOM 0 HE3 MET A 11 -17.902 12.229 -13.135 1.00 0.00 H new ATOM 170 N ALA A 12 -16.060 17.047 -12.923 1.00 0.00 N ATOM 171 CA ALA A 12 -15.403 18.361 -13.346 1.00 0.00 C ATOM 172 C ALA A 12 -13.963 18.212 -13.972 1.00 0.00 C ATOM 173 O ALA A 12 -13.352 19.211 -14.323 1.00 0.00 O ATOM 174 CB ALA A 12 -15.261 19.211 -12.082 1.00 0.00 C ATOM 0 H ALA A 12 -15.950 16.844 -11.929 1.00 0.00 H new ATOM 0 HA ALA A 12 -16.034 18.798 -14.120 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -14.795 20.163 -12.334 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -16.246 19.392 -11.653 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -14.641 18.684 -11.357 1.00 0.00 H new ATOM 180 N ASP A 13 -13.394 17.022 -13.998 1.00 0.00 N ATOM 181 CA ASP A 13 -11.904 16.856 -14.487 1.00 0.00 C ATOM 182 C ASP A 13 -11.735 16.343 -15.915 1.00 0.00 C ATOM 183 O ASP A 13 -10.612 16.252 -16.383 1.00 0.00 O ATOM 184 CB ASP A 13 -11.181 15.867 -13.552 1.00 0.00 C ATOM 185 CG ASP A 13 -12.113 14.798 -13.104 1.00 0.00 C ATOM 186 OD1 ASP A 13 -12.853 14.299 -13.925 1.00 0.00 O ATOM 187 OD2 ASP A 13 -12.045 14.465 -11.968 1.00 0.00 O ATOM 0 H ASP A 13 -13.853 16.156 -13.716 1.00 0.00 H new ATOM 0 HA ASP A 13 -11.483 17.861 -14.466 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -10.331 15.423 -14.070 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -10.785 16.399 -12.687 1.00 0.00 H new ATOM 192 N GLY A 14 -12.800 16.044 -16.602 1.00 0.00 N ATOM 193 CA GLY A 14 -12.717 15.533 -18.058 1.00 0.00 C ATOM 194 C GLY A 14 -11.415 14.705 -18.377 1.00 0.00 C ATOM 195 O GLY A 14 -10.898 14.753 -19.481 1.00 0.00 O ATOM 0 H GLY A 14 -13.750 16.123 -16.239 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -13.589 14.912 -18.264 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -12.767 16.386 -18.734 1.00 0.00 H new ATOM 199 N THR A 15 -10.937 13.949 -17.423 1.00 0.00 N ATOM 200 CA THR A 15 -9.723 13.079 -17.589 1.00 0.00 C ATOM 201 C THR A 15 -9.991 11.887 -16.725 1.00 0.00 C ATOM 202 O THR A 15 -10.034 10.749 -17.180 1.00 0.00 O ATOM 203 CB THR A 15 -8.479 13.825 -17.112 1.00 0.00 C ATOM 204 OG1 THR A 15 -8.083 14.776 -18.089 1.00 0.00 O ATOM 205 CG2 THR A 15 -7.376 12.821 -16.897 1.00 0.00 C ATOM 0 H THR A 15 -11.355 13.895 -16.494 1.00 0.00 H new ATOM 0 HA THR A 15 -9.544 12.798 -18.627 1.00 0.00 H new ATOM 0 HB THR A 15 -8.692 14.351 -16.181 1.00 0.00 H new ATOM 0 HG1 THR A 15 -8.793 14.873 -18.758 1.00 0.00 H new ATOM 0 HG21 THR A 15 -6.478 13.335 -16.556 1.00 0.00 H new ATOM 0 HG22 THR A 15 -7.686 12.095 -16.146 1.00 0.00 H new ATOM 0 HG23 THR A 15 -7.165 12.306 -17.834 1.00 0.00 H new ATOM 213 N CYS A 16 -10.269 12.177 -15.493 1.00 0.00 N ATOM 214 CA CYS A 16 -10.661 11.137 -14.541 1.00 0.00 C ATOM 215 C CYS A 16 -12.141 10.926 -14.677 1.00 0.00 C ATOM 216 O CYS A 16 -12.948 11.828 -14.522 1.00 0.00 O ATOM 217 CB CYS A 16 -10.095 11.366 -13.113 1.00 0.00 C ATOM 218 SG CYS A 16 -9.719 13.068 -12.765 1.00 0.00 S ATOM 0 H CYS A 16 -10.237 13.120 -15.104 1.00 0.00 H new ATOM 0 HA CYS A 16 -10.191 10.183 -14.778 1.00 0.00 H new ATOM 0 HB2 CYS A 16 -10.818 11.005 -12.382 1.00 0.00 H new ATOM 0 HB3 CYS A 16 -9.191 10.770 -12.989 1.00 0.00 H new ATOM 0 HG CYS A 16 -10.611 13.552 -11.952 1.00 0.00 H new ATOM 224 N GLN A 17 -12.473 9.718 -15.125 1.00 0.00 N ATOM 225 CA GLN A 17 -13.865 9.367 -15.474 1.00 0.00 C ATOM 226 C GLN A 17 -14.610 8.837 -14.264 1.00 0.00 C ATOM 227 O GLN A 17 -15.775 9.163 -14.054 1.00 0.00 O ATOM 228 CB GLN A 17 -13.788 8.283 -16.524 1.00 0.00 C ATOM 229 CG GLN A 17 -14.979 8.371 -17.482 1.00 0.00 C ATOM 230 CD GLN A 17 -16.259 7.913 -16.784 1.00 0.00 C ATOM 231 OE1 GLN A 17 -16.389 6.760 -16.415 1.00 0.00 O ATOM 232 NE2 GLN A 17 -17.223 8.773 -16.595 1.00 0.00 N ATOM 0 H GLN A 17 -11.804 8.959 -15.258 1.00 0.00 H new ATOM 0 HA GLN A 17 -14.398 10.247 -15.834 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -12.857 8.377 -17.083 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -13.773 7.305 -16.043 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -15.096 9.396 -17.834 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -14.794 7.752 -18.360 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -17.113 9.739 -16.905 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -18.086 8.479 -16.138 1.00 0.00 H new ATOM 241 N ASP A 18 -13.943 8.039 -13.449 1.00 0.00 N ATOM 242 CA ASP A 18 -14.604 7.494 -12.215 1.00 0.00 C ATOM 243 C ASP A 18 -13.759 7.893 -10.998 1.00 0.00 C ATOM 244 O ASP A 18 -12.816 8.650 -11.122 1.00 0.00 O ATOM 245 CB ASP A 18 -14.780 5.973 -12.312 1.00 0.00 C ATOM 246 CG ASP A 18 -16.035 5.544 -11.549 1.00 0.00 C ATOM 247 OD1 ASP A 18 -17.116 5.736 -12.081 1.00 0.00 O ATOM 248 OD2 ASP A 18 -15.896 5.018 -10.456 1.00 0.00 O ATOM 0 H ASP A 18 -12.976 7.745 -13.587 1.00 0.00 H new ATOM 0 HA ASP A 18 -15.604 7.915 -12.111 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -14.859 5.673 -13.357 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -13.905 5.470 -11.901 1.00 0.00 H new ATOM 253 N ALA A 19 -14.139 7.447 -9.829 1.00 0.00 N ATOM 254 CA ALA A 19 -13.428 7.838 -8.554 1.00 0.00 C ATOM 255 C ALA A 19 -13.957 6.987 -7.447 1.00 0.00 C ATOM 256 O ALA A 19 -15.170 7.005 -7.229 1.00 0.00 O ATOM 257 CB ALA A 19 -13.836 9.212 -8.251 1.00 0.00 C ATOM 0 H ALA A 19 -14.928 6.815 -9.692 1.00 0.00 H new ATOM 0 HA ALA A 19 -12.348 7.731 -8.656 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -13.347 9.543 -7.335 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -13.547 9.867 -9.073 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -14.917 9.250 -8.120 1.00 0.00 H new ATOM 263 N ALA A 20 -13.140 6.247 -6.713 1.00 0.00 N ATOM 264 CA ALA A 20 -13.775 5.443 -5.586 1.00 0.00 C ATOM 265 C ALA A 20 -13.124 5.650 -4.253 1.00 0.00 C ATOM 266 O ALA A 20 -12.112 5.042 -3.919 1.00 0.00 O ATOM 267 CB ALA A 20 -13.835 3.983 -5.898 1.00 0.00 C ATOM 0 H ALA A 20 -12.130 6.162 -6.827 1.00 0.00 H new ATOM 0 HA ALA A 20 -14.790 5.832 -5.512 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -14.295 3.452 -5.065 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -14.428 3.828 -6.800 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -12.826 3.603 -6.057 1.00 0.00 H new ATOM 273 N ILE A 21 -13.791 6.427 -3.443 1.00 0.00 N ATOM 274 CA ILE A 21 -13.352 6.628 -2.044 1.00 0.00 C ATOM 275 C ILE A 21 -13.935 5.422 -1.337 1.00 0.00 C ATOM 276 O ILE A 21 -15.134 5.287 -1.274 1.00 0.00 O ATOM 277 CB ILE A 21 -13.930 7.924 -1.492 1.00 0.00 C ATOM 278 CG1 ILE A 21 -13.467 9.085 -2.410 1.00 0.00 C ATOM 279 CG2 ILE A 21 -13.423 8.129 -0.045 1.00 0.00 C ATOM 280 CD1 ILE A 21 -13.781 10.434 -1.774 1.00 0.00 C ATOM 0 H ILE A 21 -14.635 6.937 -3.702 1.00 0.00 H new ATOM 0 HA ILE A 21 -12.272 6.710 -1.926 1.00 0.00 H new ATOM 0 HB ILE A 21 -15.019 7.892 -1.471 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -12.396 9.005 -2.594 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -13.963 9.010 -3.378 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -13.833 9.056 0.356 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -13.744 7.292 0.575 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -12.334 8.184 -0.045 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -13.448 11.234 -2.435 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -14.856 10.519 -1.614 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -13.264 10.514 -0.818 1.00 0.00 H new ATOM 292 N VAL A 22 -13.111 4.492 -0.900 1.00 0.00 N ATOM 293 CA VAL A 22 -13.653 3.230 -0.306 1.00 0.00 C ATOM 294 C VAL A 22 -13.177 3.023 1.132 1.00 0.00 C ATOM 295 O VAL A 22 -12.010 2.806 1.350 1.00 0.00 O ATOM 296 CB VAL A 22 -13.133 2.039 -1.152 1.00 0.00 C ATOM 297 CG1 VAL A 22 -13.751 0.720 -0.657 1.00 0.00 C ATOM 298 CG2 VAL A 22 -13.492 2.245 -2.632 1.00 0.00 C ATOM 0 H VAL A 22 -12.093 4.555 -0.930 1.00 0.00 H new ATOM 0 HA VAL A 22 -14.741 3.295 -0.304 1.00 0.00 H new ATOM 0 HB VAL A 22 -12.049 1.989 -1.045 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -13.376 -0.107 -1.261 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -13.479 0.560 0.386 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -14.836 0.771 -0.745 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -13.122 1.403 -3.217 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -14.575 2.312 -2.738 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -13.034 3.166 -2.993 1.00 0.00 H new ATOM 308 N GLY A 23 -14.094 3.027 2.102 1.00 0.00 N ATOM 309 CA GLY A 23 -13.703 2.746 3.540 1.00 0.00 C ATOM 310 C GLY A 23 -13.245 1.275 3.595 1.00 0.00 C ATOM 311 O GLY A 23 -14.019 0.379 3.856 1.00 0.00 O ATOM 0 H GLY A 23 -15.086 3.212 1.956 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -12.903 3.413 3.861 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -14.546 2.914 4.210 1.00 0.00 H new ATOM 315 N TYR A 24 -11.990 1.056 3.288 1.00 0.00 N ATOM 316 CA TYR A 24 -11.374 -0.316 3.218 1.00 0.00 C ATOM 317 C TYR A 24 -10.961 -0.850 4.632 1.00 0.00 C ATOM 318 O TYR A 24 -10.000 -1.602 4.747 1.00 0.00 O ATOM 319 CB TYR A 24 -10.124 -0.174 2.280 1.00 0.00 C ATOM 320 CG TYR A 24 -8.900 0.273 3.076 1.00 0.00 C ATOM 321 CD1 TYR A 24 -8.981 1.334 3.991 1.00 0.00 C ATOM 322 CD2 TYR A 24 -7.709 -0.398 2.909 1.00 0.00 C ATOM 323 CE1 TYR A 24 -7.853 1.708 4.721 1.00 0.00 C ATOM 324 CE2 TYR A 24 -6.582 -0.030 3.632 1.00 0.00 C ATOM 325 CZ TYR A 24 -6.651 1.023 4.543 1.00 0.00 C ATOM 326 OH TYR A 24 -5.530 1.392 5.259 1.00 0.00 O ATOM 0 H TYR A 24 -11.334 1.806 3.072 1.00 0.00 H new ATOM 0 HA TYR A 24 -12.089 -1.042 2.832 1.00 0.00 H new ATOM 0 HB2 TYR A 24 -9.919 -1.127 1.793 1.00 0.00 H new ATOM 0 HB3 TYR A 24 -10.335 0.548 1.492 1.00 0.00 H new ATOM 0 HD1 TYR A 24 -9.914 1.859 4.129 1.00 0.00 H new ATOM 0 HD2 TYR A 24 -7.651 -1.218 2.209 1.00 0.00 H new ATOM 0 HE1 TYR A 24 -7.910 2.527 5.423 1.00 0.00 H new ATOM 0 HE2 TYR A 24 -5.652 -0.560 3.489 1.00 0.00 H new ATOM 0 HH TYR A 24 -4.780 0.811 5.015 1.00 0.00 H new ATOM 336 N LYS A 25 -11.676 -0.475 5.685 1.00 0.00 N ATOM 337 CA LYS A 25 -11.336 -0.957 7.053 1.00 0.00 C ATOM 338 C LYS A 25 -11.685 -2.441 7.141 1.00 0.00 C ATOM 339 O LYS A 25 -11.707 -3.123 6.128 1.00 0.00 O ATOM 340 CB LYS A 25 -12.114 -0.136 8.062 1.00 0.00 C ATOM 341 CG LYS A 25 -11.335 1.144 8.358 1.00 0.00 C ATOM 342 CD LYS A 25 -11.545 2.138 7.229 1.00 0.00 C ATOM 343 CE LYS A 25 -11.929 3.497 7.810 1.00 0.00 C ATOM 344 NZ LYS A 25 -13.141 3.358 8.660 1.00 0.00 N ATOM 0 H LYS A 25 -12.482 0.148 5.640 1.00 0.00 H new ATOM 0 HA LYS A 25 -10.274 -0.840 7.267 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -13.102 0.105 7.671 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -12.264 -0.707 8.978 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -11.668 1.575 9.302 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -10.274 0.920 8.466 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -10.635 2.228 6.636 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -12.328 1.783 6.559 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -11.104 3.897 8.400 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -12.118 4.207 7.005 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -13.769 4.173 8.506 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -13.642 2.482 8.409 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -12.861 3.322 9.661 1.00 0.00 H new ATOM 358 N ASP A 26 -11.951 -2.949 8.343 1.00 0.00 N ATOM 359 CA ASP A 26 -12.319 -4.433 8.539 1.00 0.00 C ATOM 360 C ASP A 26 -13.192 -4.918 7.364 1.00 0.00 C ATOM 361 O ASP A 26 -12.792 -5.782 6.591 1.00 0.00 O ATOM 362 CB ASP A 26 -13.093 -4.628 9.860 1.00 0.00 C ATOM 363 CG ASP A 26 -14.006 -3.421 10.173 1.00 0.00 C ATOM 364 OD1 ASP A 26 -13.497 -2.420 10.649 1.00 0.00 O ATOM 365 OD2 ASP A 26 -15.200 -3.533 9.942 1.00 0.00 O ATOM 0 H ASP A 26 -11.931 -2.405 9.206 1.00 0.00 H new ATOM 0 HA ASP A 26 -11.397 -5.013 8.576 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -13.696 -5.534 9.798 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -12.387 -4.771 10.678 1.00 0.00 H new ATOM 370 N SER A 27 -14.344 -4.308 7.207 1.00 0.00 N ATOM 371 CA SER A 27 -15.241 -4.614 6.096 1.00 0.00 C ATOM 372 C SER A 27 -15.157 -3.402 5.158 1.00 0.00 C ATOM 373 O SER A 27 -15.345 -2.284 5.618 1.00 0.00 O ATOM 374 CB SER A 27 -16.657 -4.779 6.621 1.00 0.00 C ATOM 375 OG SER A 27 -16.942 -3.752 7.563 1.00 0.00 O ATOM 0 H SER A 27 -14.693 -3.587 7.839 1.00 0.00 H new ATOM 0 HA SER A 27 -14.968 -5.536 5.583 1.00 0.00 H new ATOM 0 HB2 SER A 27 -17.368 -4.737 5.796 1.00 0.00 H new ATOM 0 HB3 SER A 27 -16.770 -5.757 7.089 1.00 0.00 H new ATOM 0 HG SER A 27 -16.540 -2.911 7.262 1.00 0.00 H new ATOM 381 N PRO A 28 -14.831 -3.627 3.880 1.00 0.00 N ATOM 382 CA PRO A 28 -14.670 -2.543 2.938 1.00 0.00 C ATOM 383 C PRO A 28 -16.011 -2.064 2.445 1.00 0.00 C ATOM 384 O PRO A 28 -16.974 -2.822 2.396 1.00 0.00 O ATOM 385 CB PRO A 28 -13.830 -3.137 1.825 1.00 0.00 C ATOM 386 CG PRO A 28 -13.997 -4.666 1.933 1.00 0.00 C ATOM 387 CD PRO A 28 -14.617 -4.956 3.290 1.00 0.00 C ATOM 0 HA PRO A 28 -14.194 -1.665 3.374 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -14.162 -2.776 0.851 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -12.784 -2.851 1.931 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -14.633 -5.041 1.131 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -13.033 -5.166 1.836 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -15.554 -5.503 3.191 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -13.957 -5.564 3.908 1.00 0.00 H new ATOM 395 N SER A 29 -16.080 -0.804 2.081 1.00 0.00 N ATOM 396 CA SER A 29 -17.331 -0.223 1.589 1.00 0.00 C ATOM 397 C SER A 29 -17.010 0.959 0.730 1.00 0.00 C ATOM 398 O SER A 29 -15.916 1.506 0.783 1.00 0.00 O ATOM 399 CB SER A 29 -18.204 0.214 2.759 1.00 0.00 C ATOM 400 OG SER A 29 -17.433 1.007 3.653 1.00 0.00 O ATOM 0 H SER A 29 -15.294 -0.155 2.112 1.00 0.00 H new ATOM 0 HA SER A 29 -17.875 -0.968 1.009 1.00 0.00 H new ATOM 0 HB2 SER A 29 -19.060 0.783 2.396 1.00 0.00 H new ATOM 0 HB3 SER A 29 -18.599 -0.659 3.278 1.00 0.00 H new ATOM 0 HG SER A 29 -17.459 1.943 3.365 1.00 0.00 H new ATOM 406 N VAL A 30 -17.949 1.351 -0.069 1.00 0.00 N ATOM 407 CA VAL A 30 -17.760 2.477 -0.960 1.00 0.00 C ATOM 408 C VAL A 30 -18.216 3.743 -0.249 1.00 0.00 C ATOM 409 O VAL A 30 -19.400 4.041 -0.174 1.00 0.00 O ATOM 410 CB VAL A 30 -18.560 2.195 -2.206 1.00 0.00 C ATOM 411 CG1 VAL A 30 -18.549 3.394 -3.136 1.00 0.00 C ATOM 412 CG2 VAL A 30 -17.913 1.014 -2.903 1.00 0.00 C ATOM 0 H VAL A 30 -18.867 0.911 -0.131 1.00 0.00 H new ATOM 0 HA VAL A 30 -16.716 2.621 -1.238 1.00 0.00 H new ATOM 0 HB VAL A 30 -19.596 1.982 -1.942 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -19.132 3.168 -4.028 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -18.984 4.254 -2.626 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -17.522 3.623 -3.422 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -18.467 0.780 -3.812 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -16.883 1.262 -3.159 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -17.923 0.149 -2.239 1.00 0.00 H new ATOM 422 N TRP A 31 -17.261 4.476 0.279 1.00 0.00 N ATOM 423 CA TRP A 31 -17.559 5.733 1.006 1.00 0.00 C ATOM 424 C TRP A 31 -18.049 6.787 0.022 1.00 0.00 C ATOM 425 O TRP A 31 -18.734 7.729 0.400 1.00 0.00 O ATOM 426 CB TRP A 31 -16.270 6.209 1.704 1.00 0.00 C ATOM 427 CG TRP A 31 -16.151 5.556 3.063 1.00 0.00 C ATOM 428 CD1 TRP A 31 -16.932 4.540 3.521 1.00 0.00 C ATOM 429 CD2 TRP A 31 -15.215 5.852 4.141 1.00 0.00 C ATOM 430 NE1 TRP A 31 -16.552 4.217 4.784 1.00 0.00 N ATOM 431 CE2 TRP A 31 -15.497 4.993 5.224 1.00 0.00 C ATOM 432 CE3 TRP A 31 -14.162 6.778 4.286 1.00 0.00 C ATOM 433 CZ2 TRP A 31 -14.771 5.048 6.406 1.00 0.00 C ATOM 434 CZ3 TRP A 31 -13.428 6.833 5.478 1.00 0.00 C ATOM 435 CH2 TRP A 31 -13.735 5.972 6.536 1.00 0.00 C ATOM 0 H TRP A 31 -16.269 4.242 0.230 1.00 0.00 H new ATOM 0 HA TRP A 31 -18.338 5.567 1.750 1.00 0.00 H new ATOM 0 HB2 TRP A 31 -15.402 5.960 1.094 1.00 0.00 H new ATOM 0 HB3 TRP A 31 -16.283 7.294 1.812 1.00 0.00 H new ATOM 0 HD1 TRP A 31 -17.729 4.065 2.967 1.00 0.00 H new ATOM 0 HE1 TRP A 31 -16.994 3.487 5.343 1.00 0.00 H new ATOM 0 HE3 TRP A 31 -13.920 7.448 3.474 1.00 0.00 H new ATOM 0 HZ2 TRP A 31 -15.007 4.379 7.220 1.00 0.00 H new ATOM 0 HZ3 TRP A 31 -12.621 7.544 5.580 1.00 0.00 H new ATOM 0 HH2 TRP A 31 -13.169 6.023 7.455 1.00 0.00 H new ATOM 446 N ALA A 32 -17.720 6.624 -1.252 1.00 0.00 N ATOM 447 CA ALA A 32 -18.178 7.602 -2.297 1.00 0.00 C ATOM 448 C ALA A 32 -17.575 7.236 -3.665 1.00 0.00 C ATOM 449 O ALA A 32 -16.572 7.802 -4.080 1.00 0.00 O ATOM 450 CB ALA A 32 -17.741 9.034 -1.901 1.00 0.00 C ATOM 0 H ALA A 32 -17.154 5.853 -1.606 1.00 0.00 H new ATOM 0 HA ALA A 32 -19.265 7.562 -2.366 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -18.075 9.740 -2.661 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -18.185 9.298 -0.941 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -16.655 9.074 -1.821 1.00 0.00 H new ATOM 456 N ALA A 33 -18.200 6.311 -4.382 1.00 0.00 N ATOM 457 CA ALA A 33 -17.688 5.932 -5.732 1.00 0.00 C ATOM 458 C ALA A 33 -18.761 6.224 -6.762 1.00 0.00 C ATOM 459 O ALA A 33 -19.916 5.854 -6.587 1.00 0.00 O ATOM 460 CB ALA A 33 -17.335 4.442 -5.800 1.00 0.00 C ATOM 0 H ALA A 33 -19.037 5.812 -4.082 1.00 0.00 H new ATOM 0 HA ALA A 33 -16.785 6.510 -5.930 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -16.966 4.201 -6.797 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -16.564 4.217 -5.063 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -18.224 3.847 -5.589 1.00 0.00 H new ATOM 466 N VAL A 34 -18.389 6.876 -7.843 1.00 0.00 N ATOM 467 CA VAL A 34 -19.384 7.204 -8.942 1.00 0.00 C ATOM 468 C VAL A 34 -20.180 5.898 -9.312 1.00 0.00 C ATOM 469 O VAL A 34 -19.577 4.939 -9.761 1.00 0.00 O ATOM 470 CB VAL A 34 -18.613 7.726 -10.166 1.00 0.00 C ATOM 471 CG1 VAL A 34 -19.581 7.975 -11.339 1.00 0.00 C ATOM 472 CG2 VAL A 34 -17.910 9.038 -9.796 1.00 0.00 C ATOM 0 H VAL A 34 -17.438 7.199 -8.019 1.00 0.00 H new ATOM 0 HA VAL A 34 -20.087 7.968 -8.610 1.00 0.00 H new ATOM 0 HB VAL A 34 -17.876 6.982 -10.469 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -19.023 8.344 -12.199 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -20.080 7.043 -11.603 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -20.326 8.714 -11.045 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -17.361 9.413 -10.660 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -18.653 9.775 -9.490 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -17.216 8.860 -8.975 1.00 0.00 H new ATOM 482 N PRO A 35 -21.514 5.888 -9.069 1.00 0.00 N ATOM 483 CA PRO A 35 -22.349 4.703 -9.335 1.00 0.00 C ATOM 484 C PRO A 35 -22.692 4.566 -10.817 1.00 0.00 C ATOM 485 O PRO A 35 -22.976 5.548 -11.493 1.00 0.00 O ATOM 486 CB PRO A 35 -23.622 4.956 -8.519 1.00 0.00 C ATOM 487 CG PRO A 35 -23.699 6.496 -8.296 1.00 0.00 C ATOM 488 CD PRO A 35 -22.271 7.042 -8.524 1.00 0.00 C ATOM 0 HA PRO A 35 -21.836 3.780 -9.065 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -24.503 4.596 -9.051 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -23.585 4.427 -7.567 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -24.405 6.954 -8.989 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -24.046 6.726 -7.289 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -22.273 7.880 -9.221 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -21.831 7.402 -7.594 1.00 0.00 H new ATOM 496 N GLY A 36 -22.693 3.335 -11.317 1.00 0.00 N ATOM 497 CA GLY A 36 -23.045 3.090 -12.749 1.00 0.00 C ATOM 498 C GLY A 36 -21.855 2.495 -13.518 1.00 0.00 C ATOM 499 O GLY A 36 -22.029 1.999 -14.625 1.00 0.00 O ATOM 0 H GLY A 36 -22.463 2.497 -10.784 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -23.895 2.410 -12.806 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -23.353 4.026 -13.216 1.00 0.00 H new ATOM 503 N LYS A 37 -20.636 2.565 -12.965 1.00 0.00 N ATOM 504 CA LYS A 37 -19.442 2.023 -13.711 1.00 0.00 C ATOM 505 C LYS A 37 -18.940 0.679 -13.141 1.00 0.00 C ATOM 506 O LYS A 37 -19.352 -0.375 -13.615 1.00 0.00 O ATOM 507 CB LYS A 37 -18.306 3.073 -13.703 1.00 0.00 C ATOM 508 CG LYS A 37 -18.782 4.396 -14.374 1.00 0.00 C ATOM 509 CD LYS A 37 -19.510 4.097 -15.705 1.00 0.00 C ATOM 510 CE LYS A 37 -19.834 5.396 -16.443 1.00 0.00 C ATOM 511 NZ LYS A 37 -19.359 5.292 -17.851 1.00 0.00 N ATOM 0 H LYS A 37 -20.432 2.967 -12.050 1.00 0.00 H new ATOM 0 HA LYS A 37 -19.758 1.826 -14.735 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -17.992 3.270 -12.678 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -17.437 2.682 -14.232 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -19.450 4.933 -13.700 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -17.926 5.045 -14.559 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -18.885 3.461 -16.333 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -20.429 3.545 -15.507 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -20.908 5.582 -16.422 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -19.355 6.240 -15.946 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -19.577 6.174 -18.357 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -18.331 5.133 -17.860 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -19.836 4.496 -18.321 1.00 0.00 H new ATOM 525 N THR A 38 -18.011 0.693 -12.175 1.00 0.00 N ATOM 526 CA THR A 38 -17.452 -0.616 -11.654 1.00 0.00 C ATOM 527 C THR A 38 -16.801 -0.468 -10.251 1.00 0.00 C ATOM 528 O THR A 38 -16.835 -1.397 -9.463 1.00 0.00 O ATOM 529 CB THR A 38 -16.417 -1.110 -12.732 1.00 0.00 C ATOM 530 OG1 THR A 38 -17.089 -1.933 -13.671 1.00 0.00 O ATOM 531 CG2 THR A 38 -15.200 -1.892 -12.144 1.00 0.00 C ATOM 0 H THR A 38 -17.631 1.534 -11.741 1.00 0.00 H new ATOM 0 HA THR A 38 -18.251 -1.344 -11.512 1.00 0.00 H new ATOM 0 HB THR A 38 -16.006 -0.214 -13.198 1.00 0.00 H new ATOM 0 HG1 THR A 38 -17.979 -1.565 -13.850 1.00 0.00 H new ATOM 0 HG21 THR A 38 -14.537 -2.196 -12.954 1.00 0.00 H new ATOM 0 HG22 THR A 38 -14.656 -1.251 -11.451 1.00 0.00 H new ATOM 0 HG23 THR A 38 -15.557 -2.777 -11.616 1.00 0.00 H new ATOM 539 N PHE A 39 -16.173 0.649 -9.973 1.00 0.00 N ATOM 540 CA PHE A 39 -15.458 0.832 -8.655 1.00 0.00 C ATOM 541 C PHE A 39 -16.402 0.722 -7.469 1.00 0.00 C ATOM 542 O PHE A 39 -16.053 0.158 -6.454 1.00 0.00 O ATOM 543 CB PHE A 39 -14.839 2.199 -8.612 1.00 0.00 C ATOM 544 CG PHE A 39 -13.588 2.303 -9.512 1.00 0.00 C ATOM 545 CD1 PHE A 39 -13.375 1.412 -10.591 1.00 0.00 C ATOM 546 CD2 PHE A 39 -12.643 3.312 -9.259 1.00 0.00 C ATOM 547 CE1 PHE A 39 -12.242 1.537 -11.387 1.00 0.00 C ATOM 548 CE2 PHE A 39 -11.507 3.427 -10.063 1.00 0.00 C ATOM 549 CZ PHE A 39 -11.312 2.534 -11.130 1.00 0.00 C ATOM 0 H PHE A 39 -16.121 1.451 -10.602 1.00 0.00 H new ATOM 0 HA PHE A 39 -14.708 0.044 -8.585 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -15.574 2.939 -8.928 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -14.566 2.440 -7.585 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -14.094 0.633 -10.796 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -12.796 4.000 -8.441 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -12.085 0.855 -12.209 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -10.780 4.201 -9.865 1.00 0.00 H new ATOM 0 HZ PHE A 39 -10.434 2.624 -11.753 1.00 0.00 H new ATOM 559 N VAL A 40 -17.577 1.290 -7.587 1.00 0.00 N ATOM 560 CA VAL A 40 -18.582 1.269 -6.460 1.00 0.00 C ATOM 561 C VAL A 40 -18.934 -0.190 -6.116 1.00 0.00 C ATOM 562 O VAL A 40 -19.434 -0.479 -5.033 1.00 0.00 O ATOM 563 CB VAL A 40 -19.847 2.069 -6.862 1.00 0.00 C ATOM 564 CG1 VAL A 40 -20.254 1.695 -8.273 1.00 0.00 C ATOM 565 CG2 VAL A 40 -21.007 1.771 -5.885 1.00 0.00 C ATOM 0 H VAL A 40 -17.894 1.776 -8.426 1.00 0.00 H new ATOM 0 HA VAL A 40 -18.153 1.741 -5.576 1.00 0.00 H new ATOM 0 HB VAL A 40 -19.621 3.134 -6.818 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -21.144 2.257 -8.556 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -19.442 1.931 -8.961 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -20.470 0.628 -8.319 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -21.888 2.341 -6.181 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -21.239 0.706 -5.909 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -20.714 2.056 -4.875 1.00 0.00 H new ATOM 575 N ASN A 41 -18.653 -1.112 -7.014 1.00 0.00 N ATOM 576 CA ASN A 41 -18.918 -2.527 -6.749 1.00 0.00 C ATOM 577 C ASN A 41 -17.687 -3.121 -6.030 1.00 0.00 C ATOM 578 O ASN A 41 -17.431 -4.319 -6.112 1.00 0.00 O ATOM 579 CB ASN A 41 -19.122 -3.228 -8.090 1.00 0.00 C ATOM 580 CG ASN A 41 -20.427 -2.750 -8.769 1.00 0.00 C ATOM 581 OD1 ASN A 41 -21.026 -1.759 -8.377 1.00 0.00 O ATOM 582 ND2 ASN A 41 -20.886 -3.417 -9.790 1.00 0.00 N ATOM 0 H ASN A 41 -18.245 -0.918 -7.928 1.00 0.00 H new ATOM 0 HA ASN A 41 -19.803 -2.656 -6.126 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -18.273 -3.027 -8.743 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -19.160 -4.307 -7.939 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -21.740 -3.111 -10.257 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -20.391 -4.245 -10.122 1.00 0.00 H new ATOM 589 N ILE A 42 -16.887 -2.268 -5.346 1.00 0.00 N ATOM 590 CA ILE A 42 -15.676 -2.749 -4.673 1.00 0.00 C ATOM 591 C ILE A 42 -16.033 -3.521 -3.356 1.00 0.00 C ATOM 592 O ILE A 42 -16.698 -3.026 -2.465 1.00 0.00 O ATOM 593 CB ILE A 42 -14.731 -1.521 -4.417 1.00 0.00 C ATOM 594 CG1 ILE A 42 -13.868 -1.306 -5.676 1.00 0.00 C ATOM 595 CG2 ILE A 42 -13.808 -1.754 -3.206 1.00 0.00 C ATOM 596 CD1 ILE A 42 -13.329 0.132 -5.720 1.00 0.00 C ATOM 0 H ILE A 42 -17.060 -1.267 -5.252 1.00 0.00 H new ATOM 0 HA ILE A 42 -15.152 -3.466 -5.305 1.00 0.00 H new ATOM 0 HB ILE A 42 -15.345 -0.646 -4.204 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -13.038 -2.012 -5.680 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -14.461 -1.506 -6.569 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -13.170 -0.882 -3.062 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -14.413 -1.913 -2.313 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -13.188 -2.632 -3.385 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -12.722 0.266 -6.615 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -14.164 0.833 -5.739 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -12.719 0.319 -4.837 1.00 0.00 H new ATOM 608 N THR A 43 -15.543 -4.725 -3.287 1.00 0.00 N ATOM 609 CA THR A 43 -15.725 -5.658 -2.118 1.00 0.00 C ATOM 610 C THR A 43 -14.312 -5.883 -1.479 1.00 0.00 C ATOM 611 O THR A 43 -13.346 -5.358 -1.997 1.00 0.00 O ATOM 612 CB THR A 43 -16.257 -6.993 -2.707 1.00 0.00 C ATOM 613 OG1 THR A 43 -15.590 -7.273 -3.934 1.00 0.00 O ATOM 614 CG2 THR A 43 -17.759 -6.880 -2.964 1.00 0.00 C ATOM 0 H THR A 43 -14.987 -5.132 -4.039 1.00 0.00 H new ATOM 0 HA THR A 43 -16.411 -5.271 -1.364 1.00 0.00 H new ATOM 0 HB THR A 43 -16.069 -7.798 -1.997 1.00 0.00 H new ATOM 0 HG1 THR A 43 -15.926 -8.116 -4.304 1.00 0.00 H new ATOM 0 HG21 THR A 43 -18.129 -7.818 -3.377 1.00 0.00 H new ATOM 0 HG22 THR A 43 -18.274 -6.668 -2.027 1.00 0.00 H new ATOM 0 HG23 THR A 43 -17.947 -6.073 -3.672 1.00 0.00 H new ATOM 622 N PRO A 44 -14.198 -6.696 -0.389 1.00 0.00 N ATOM 623 CA PRO A 44 -12.871 -6.983 0.229 1.00 0.00 C ATOM 624 C PRO A 44 -11.991 -7.875 -0.660 1.00 0.00 C ATOM 625 O PRO A 44 -10.853 -8.179 -0.313 1.00 0.00 O ATOM 626 CB PRO A 44 -13.201 -7.652 1.543 1.00 0.00 C ATOM 627 CG PRO A 44 -14.652 -8.197 1.420 1.00 0.00 C ATOM 628 CD PRO A 44 -15.332 -7.366 0.303 1.00 0.00 C ATOM 0 HA PRO A 44 -12.285 -6.074 0.364 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -12.501 -8.461 1.751 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -13.123 -6.943 2.367 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -14.650 -9.258 1.169 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -15.188 -8.094 2.363 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -15.897 -8.001 -0.379 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -16.032 -6.640 0.716 1.00 0.00 H new ATOM 636 N ALA A 45 -12.495 -8.251 -1.803 1.00 0.00 N ATOM 637 CA ALA A 45 -11.716 -9.079 -2.772 1.00 0.00 C ATOM 638 C ALA A 45 -10.864 -8.138 -3.600 1.00 0.00 C ATOM 639 O ALA A 45 -9.620 -8.153 -3.550 1.00 0.00 O ATOM 640 CB ALA A 45 -12.693 -9.807 -3.681 1.00 0.00 C ATOM 0 H ALA A 45 -13.437 -8.014 -2.115 1.00 0.00 H new ATOM 0 HA ALA A 45 -11.088 -9.805 -2.255 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -12.140 -10.417 -4.395 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -13.340 -10.447 -3.081 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -13.301 -9.079 -4.219 1.00 0.00 H new ATOM 646 N GLU A 46 -11.533 -7.293 -4.337 1.00 0.00 N ATOM 647 CA GLU A 46 -10.817 -6.269 -5.190 1.00 0.00 C ATOM 648 C GLU A 46 -9.996 -5.360 -4.273 1.00 0.00 C ATOM 649 O GLU A 46 -8.900 -4.933 -4.619 1.00 0.00 O ATOM 650 CB GLU A 46 -11.802 -5.425 -6.056 1.00 0.00 C ATOM 651 CG GLU A 46 -13.150 -5.271 -5.395 1.00 0.00 C ATOM 652 CD GLU A 46 -14.163 -6.240 -6.031 1.00 0.00 C ATOM 653 OE1 GLU A 46 -13.931 -7.437 -5.974 1.00 0.00 O ATOM 654 OE2 GLU A 46 -15.152 -5.766 -6.562 1.00 0.00 O ATOM 0 H GLU A 46 -12.551 -7.259 -4.393 1.00 0.00 H new ATOM 0 HA GLU A 46 -10.165 -6.795 -5.887 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -11.372 -4.440 -6.236 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -11.928 -5.901 -7.029 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -13.065 -5.470 -4.327 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -13.501 -4.244 -5.501 1.00 0.00 H new ATOM 661 N VAL A 47 -10.499 -5.127 -3.077 1.00 0.00 N ATOM 662 CA VAL A 47 -9.774 -4.331 -2.057 1.00 0.00 C ATOM 663 C VAL A 47 -8.752 -5.221 -1.331 1.00 0.00 C ATOM 664 O VAL A 47 -7.777 -4.727 -0.799 1.00 0.00 O ATOM 665 CB VAL A 47 -10.812 -3.637 -1.126 1.00 0.00 C ATOM 666 CG1 VAL A 47 -10.344 -3.535 0.276 1.00 0.00 C ATOM 667 CG2 VAL A 47 -10.943 -2.175 -1.555 1.00 0.00 C ATOM 0 H VAL A 47 -11.409 -5.471 -2.769 1.00 0.00 H new ATOM 0 HA VAL A 47 -9.189 -3.532 -2.513 1.00 0.00 H new ATOM 0 HB VAL A 47 -11.726 -4.227 -1.195 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -11.107 -3.043 0.879 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -10.157 -4.534 0.671 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -9.423 -2.953 0.311 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -11.667 -1.671 -0.914 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -9.975 -1.682 -1.467 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -11.281 -2.128 -2.590 1.00 0.00 H new ATOM 677 N GLY A 48 -8.961 -6.519 -1.339 1.00 0.00 N ATOM 678 CA GLY A 48 -7.995 -7.457 -0.686 1.00 0.00 C ATOM 679 C GLY A 48 -6.635 -7.328 -1.353 1.00 0.00 C ATOM 680 O GLY A 48 -5.621 -7.540 -0.728 1.00 0.00 O ATOM 0 H GLY A 48 -9.766 -6.969 -1.774 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -7.914 -7.230 0.377 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -8.356 -8.482 -0.767 1.00 0.00 H new ATOM 684 N VAL A 49 -6.616 -6.988 -2.625 1.00 0.00 N ATOM 685 CA VAL A 49 -5.294 -6.826 -3.365 1.00 0.00 C ATOM 686 C VAL A 49 -4.892 -5.346 -3.409 1.00 0.00 C ATOM 687 O VAL A 49 -3.720 -5.006 -3.307 1.00 0.00 O ATOM 688 CB VAL A 49 -5.375 -7.407 -4.802 1.00 0.00 C ATOM 689 CG1 VAL A 49 -6.309 -6.572 -5.690 1.00 0.00 C ATOM 690 CG2 VAL A 49 -3.963 -7.411 -5.417 1.00 0.00 C ATOM 0 H VAL A 49 -7.448 -6.814 -3.189 1.00 0.00 H new ATOM 0 HA VAL A 49 -4.533 -7.386 -2.822 1.00 0.00 H new ATOM 0 HB VAL A 49 -5.774 -8.420 -4.745 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -6.344 -7.005 -6.690 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -7.311 -6.568 -5.261 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -5.936 -5.550 -5.750 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -4.007 -7.817 -6.427 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -3.579 -6.392 -5.452 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -3.302 -8.027 -4.807 1.00 0.00 H new ATOM 700 N LEU A 50 -5.868 -4.475 -3.514 1.00 0.00 N ATOM 701 CA LEU A 50 -5.617 -3.007 -3.524 1.00 0.00 C ATOM 702 C LEU A 50 -5.030 -2.576 -2.190 1.00 0.00 C ATOM 703 O LEU A 50 -4.516 -1.469 -2.059 1.00 0.00 O ATOM 704 CB LEU A 50 -6.962 -2.305 -3.679 1.00 0.00 C ATOM 705 CG LEU A 50 -7.339 -2.020 -5.124 1.00 0.00 C ATOM 706 CD1 LEU A 50 -8.860 -1.773 -5.180 1.00 0.00 C ATOM 707 CD2 LEU A 50 -6.625 -0.753 -5.586 1.00 0.00 C ATOM 0 H LEU A 50 -6.852 -4.732 -3.595 1.00 0.00 H new ATOM 0 HA LEU A 50 -4.931 -2.757 -4.333 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -7.738 -2.921 -3.225 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -6.937 -1.365 -3.127 1.00 0.00 H new ATOM 0 HG LEU A 50 -7.057 -2.858 -5.762 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -9.157 -1.566 -6.208 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -9.386 -2.658 -4.822 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -9.114 -0.920 -4.550 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -6.891 -0.543 -6.622 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -6.926 0.084 -4.957 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -5.547 -0.895 -5.510 1.00 0.00 H new ATOM 719 N VAL A 51 -5.199 -3.401 -1.178 1.00 0.00 N ATOM 720 CA VAL A 51 -4.765 -3.013 0.199 1.00 0.00 C ATOM 721 C VAL A 51 -4.227 -4.231 1.003 1.00 0.00 C ATOM 722 O VAL A 51 -3.728 -4.064 2.110 1.00 0.00 O ATOM 723 CB VAL A 51 -6.037 -2.374 0.907 1.00 0.00 C ATOM 724 CG1 VAL A 51 -6.871 -1.569 -0.115 1.00 0.00 C ATOM 725 CG2 VAL A 51 -6.951 -3.474 1.525 1.00 0.00 C ATOM 0 H VAL A 51 -5.620 -4.327 -1.251 1.00 0.00 H new ATOM 0 HA VAL A 51 -3.940 -2.303 0.153 1.00 0.00 H new ATOM 0 HB VAL A 51 -5.673 -1.719 1.699 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -7.739 -1.137 0.383 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -6.259 -0.771 -0.536 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -7.204 -2.231 -0.915 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -7.812 -3.006 2.002 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -7.293 -4.147 0.739 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -6.388 -4.040 2.267 1.00 0.00 H new ATOM 735 N GLY A 52 -4.332 -5.446 0.459 1.00 0.00 N ATOM 736 CA GLY A 52 -3.847 -6.656 1.178 1.00 0.00 C ATOM 737 C GLY A 52 -2.410 -6.473 1.612 1.00 0.00 C ATOM 738 O GLY A 52 -1.787 -5.448 1.359 1.00 0.00 O ATOM 0 H GLY A 52 -4.738 -5.630 -0.458 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -4.475 -6.845 2.049 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -3.929 -7.529 0.530 1.00 0.00 H new ATOM 822 N PHE A 58 0.200 -9.004 -7.624 1.00 0.00 N ATOM 823 CA PHE A 58 -0.494 -7.918 -8.432 1.00 0.00 C ATOM 824 C PHE A 58 0.467 -6.841 -9.014 1.00 0.00 C ATOM 825 O PHE A 58 0.093 -6.160 -9.954 1.00 0.00 O ATOM 826 CB PHE A 58 -1.596 -7.257 -7.599 1.00 0.00 C ATOM 827 CG PHE A 58 -1.017 -6.509 -6.439 1.00 0.00 C ATOM 828 CD1 PHE A 58 -0.648 -5.172 -6.591 1.00 0.00 C ATOM 829 CD2 PHE A 58 -0.869 -7.143 -5.205 1.00 0.00 C ATOM 830 CE1 PHE A 58 -0.128 -4.469 -5.509 1.00 0.00 C ATOM 831 CE2 PHE A 58 -0.349 -6.441 -4.119 1.00 0.00 C ATOM 832 CZ PHE A 58 0.025 -5.101 -4.269 1.00 0.00 C ATOM 0 HA PHE A 58 -0.930 -8.422 -9.295 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -2.171 -6.575 -8.226 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -2.288 -8.017 -7.237 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -0.766 -4.684 -7.547 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -1.157 -8.178 -5.091 1.00 0.00 H new ATOM 0 HE1 PHE A 58 0.158 -3.434 -5.626 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -0.235 -6.931 -3.163 1.00 0.00 H new ATOM 0 HZ PHE A 58 0.431 -4.555 -3.430 1.00 0.00 H new ATOM 842 N TYR A 59 1.694 -6.646 -8.482 1.00 0.00 N ATOM 843 CA TYR A 59 2.579 -5.571 -9.079 1.00 0.00 C ATOM 844 C TYR A 59 2.886 -5.829 -10.555 1.00 0.00 C ATOM 845 O TYR A 59 3.460 -4.970 -11.220 1.00 0.00 O ATOM 846 CB TYR A 59 3.931 -5.414 -8.342 1.00 0.00 C ATOM 847 CG TYR A 59 3.784 -5.115 -6.876 1.00 0.00 C ATOM 848 CD1 TYR A 59 2.819 -4.235 -6.462 1.00 0.00 C ATOM 849 CD2 TYR A 59 4.683 -5.670 -5.943 1.00 0.00 C ATOM 850 CE1 TYR A 59 2.720 -3.881 -5.111 1.00 0.00 C ATOM 851 CE2 TYR A 59 4.581 -5.327 -4.597 1.00 0.00 C ATOM 852 CZ TYR A 59 3.602 -4.427 -4.180 1.00 0.00 C ATOM 853 OH TYR A 59 3.505 -4.079 -2.850 1.00 0.00 O ATOM 0 H TYR A 59 2.090 -7.165 -7.699 1.00 0.00 H new ATOM 0 HA TYR A 59 2.000 -4.654 -8.967 1.00 0.00 H new ATOM 0 HB2 TYR A 59 4.509 -6.330 -8.462 1.00 0.00 H new ATOM 0 HB3 TYR A 59 4.501 -4.613 -8.813 1.00 0.00 H new ATOM 0 HD1 TYR A 59 2.132 -3.813 -7.180 1.00 0.00 H new ATOM 0 HD2 TYR A 59 5.448 -6.359 -6.271 1.00 0.00 H new ATOM 0 HE1 TYR A 59 1.960 -3.184 -4.790 1.00 0.00 H new ATOM 0 HE2 TYR A 59 5.260 -5.758 -3.877 1.00 0.00 H new ATOM 0 HH TYR A 59 4.194 -4.551 -2.337 1.00 0.00 H new ATOM 863 N VAL A 60 2.546 -6.977 -11.063 1.00 0.00 N ATOM 864 CA VAL A 60 2.838 -7.306 -12.479 1.00 0.00 C ATOM 865 C VAL A 60 1.546 -7.651 -13.229 1.00 0.00 C ATOM 866 O VAL A 60 1.437 -7.384 -14.423 1.00 0.00 O ATOM 867 CB VAL A 60 3.807 -8.495 -12.540 1.00 0.00 C ATOM 868 CG1 VAL A 60 5.238 -7.968 -12.534 1.00 0.00 C ATOM 869 CG2 VAL A 60 3.617 -9.434 -11.332 1.00 0.00 C ATOM 0 H VAL A 60 2.069 -7.715 -10.545 1.00 0.00 H new ATOM 0 HA VAL A 60 3.294 -6.438 -12.955 1.00 0.00 H new ATOM 0 HB VAL A 60 3.604 -9.058 -13.451 1.00 0.00 H new ATOM 0 HG11 VAL A 60 5.934 -8.805 -12.577 1.00 0.00 H new ATOM 0 HG12 VAL A 60 5.392 -7.323 -13.399 1.00 0.00 H new ATOM 0 HG13 VAL A 60 5.412 -7.398 -11.621 1.00 0.00 H new ATOM 0 HG21 VAL A 60 4.317 -10.266 -11.404 1.00 0.00 H new ATOM 0 HG22 VAL A 60 3.802 -8.883 -10.410 1.00 0.00 H new ATOM 0 HG23 VAL A 60 2.597 -9.818 -11.327 1.00 0.00 H new ATOM 879 N ASN A 61 0.559 -8.244 -12.547 1.00 0.00 N ATOM 880 CA ASN A 61 -0.704 -8.597 -13.220 1.00 0.00 C ATOM 881 C ASN A 61 -1.692 -7.432 -13.077 1.00 0.00 C ATOM 882 O ASN A 61 -2.311 -7.021 -14.050 1.00 0.00 O ATOM 883 CB ASN A 61 -1.263 -9.906 -12.635 1.00 0.00 C ATOM 884 CG ASN A 61 -1.684 -9.758 -11.179 1.00 0.00 C ATOM 885 OD1 ASN A 61 -2.610 -9.042 -10.863 1.00 0.00 O ATOM 886 ND2 ASN A 61 -1.047 -10.442 -10.266 1.00 0.00 N ATOM 0 H ASN A 61 0.603 -8.486 -11.557 1.00 0.00 H new ATOM 0 HA ASN A 61 -0.532 -8.766 -14.283 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -2.119 -10.229 -13.227 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -0.508 -10.688 -12.714 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -1.329 -10.373 -9.288 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -0.268 -11.045 -10.531 1.00 0.00 H new ATOM 893 N GLY A 62 -1.810 -6.874 -11.880 1.00 0.00 N ATOM 894 CA GLY A 62 -2.717 -5.705 -11.654 1.00 0.00 C ATOM 895 C GLY A 62 -3.729 -6.008 -10.547 1.00 0.00 C ATOM 896 O GLY A 62 -4.220 -7.123 -10.422 1.00 0.00 O ATOM 0 H GLY A 62 -1.308 -7.189 -11.050 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -2.128 -4.829 -11.384 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -3.243 -5.463 -12.578 1.00 0.00 H new ATOM 900 N LEU A 63 -4.051 -4.993 -9.746 1.00 0.00 N ATOM 901 CA LEU A 63 -5.047 -5.153 -8.637 1.00 0.00 C ATOM 902 C LEU A 63 -6.393 -5.490 -9.267 1.00 0.00 C ATOM 903 O LEU A 63 -6.441 -6.062 -10.341 1.00 0.00 O ATOM 904 CB LEU A 63 -5.172 -3.826 -7.820 1.00 0.00 C ATOM 905 CG LEU A 63 -3.814 -3.307 -7.378 1.00 0.00 C ATOM 906 CD1 LEU A 63 -3.941 -1.807 -7.063 1.00 0.00 C ATOM 907 CD2 LEU A 63 -3.392 -4.058 -6.123 1.00 0.00 C ATOM 0 H LEU A 63 -3.655 -4.056 -9.825 1.00 0.00 H new ATOM 0 HA LEU A 63 -4.725 -5.943 -7.959 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -5.670 -3.070 -8.428 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -5.799 -3.995 -6.945 1.00 0.00 H new ATOM 0 HG LEU A 63 -3.072 -3.456 -8.162 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -2.974 -1.419 -6.744 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -4.269 -1.274 -7.956 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -4.670 -1.663 -6.266 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -2.418 -3.697 -5.793 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -4.127 -3.892 -5.335 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -3.328 -5.124 -6.341 1.00 0.00 H new ATOM 919 N THR A 64 -7.487 -5.114 -8.621 1.00 0.00 N ATOM 920 CA THR A 64 -8.811 -5.374 -9.146 1.00 0.00 C ATOM 921 C THR A 64 -9.730 -4.441 -8.452 1.00 0.00 C ATOM 922 O THR A 64 -9.647 -4.278 -7.248 1.00 0.00 O ATOM 923 CB THR A 64 -9.228 -6.809 -8.850 1.00 0.00 C ATOM 924 OG1 THR A 64 -8.940 -7.109 -7.508 1.00 0.00 O ATOM 925 CG2 THR A 64 -8.461 -7.762 -9.742 1.00 0.00 C ATOM 0 H THR A 64 -7.479 -4.625 -7.726 1.00 0.00 H new ATOM 0 HA THR A 64 -8.833 -5.234 -10.227 1.00 0.00 H new ATOM 0 HB THR A 64 -10.297 -6.916 -9.036 1.00 0.00 H new ATOM 0 HG1 THR A 64 -9.349 -7.967 -7.269 1.00 0.00 H new ATOM 0 HG21 THR A 64 -8.764 -8.786 -9.525 1.00 0.00 H new ATOM 0 HG22 THR A 64 -8.674 -7.534 -10.786 1.00 0.00 H new ATOM 0 HG23 THR A 64 -7.392 -7.653 -9.557 1.00 0.00 H new ATOM 933 N LEU A 65 -10.567 -3.812 -9.189 1.00 0.00 N ATOM 934 CA LEU A 65 -11.532 -2.848 -8.611 1.00 0.00 C ATOM 935 C LEU A 65 -12.896 -3.062 -9.245 1.00 0.00 C ATOM 936 O LEU A 65 -13.158 -2.655 -10.365 1.00 0.00 O ATOM 937 CB LEU A 65 -11.054 -1.399 -8.781 1.00 0.00 C ATOM 938 CG LEU A 65 -10.181 -1.205 -10.036 1.00 0.00 C ATOM 939 CD1 LEU A 65 -11.045 -1.209 -11.282 1.00 0.00 C ATOM 940 CD2 LEU A 65 -9.460 0.138 -9.921 1.00 0.00 C ATOM 0 H LEU A 65 -10.633 -3.922 -10.201 1.00 0.00 H new ATOM 0 HA LEU A 65 -11.608 -3.026 -7.538 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -11.920 -0.740 -8.840 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -10.487 -1.102 -7.899 1.00 0.00 H new ATOM 0 HG LEU A 65 -9.460 -2.019 -10.110 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -10.416 -1.071 -12.161 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -11.570 -2.161 -11.357 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -11.771 -0.398 -11.224 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -8.836 0.293 -10.802 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -10.194 0.940 -9.851 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -8.834 0.140 -9.028 1.00 0.00 H new ATOM 952 N GLY A 66 -13.759 -3.740 -8.520 1.00 0.00 N ATOM 953 CA GLY A 66 -15.124 -4.041 -9.020 1.00 0.00 C ATOM 954 C GLY A 66 -15.032 -5.140 -10.062 1.00 0.00 C ATOM 955 O GLY A 66 -15.796 -5.163 -11.020 1.00 0.00 O ATOM 0 H GLY A 66 -13.562 -4.100 -7.586 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -15.767 -4.354 -8.197 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -15.573 -3.147 -9.453 1.00 0.00 H new ATOM 959 N GLY A 67 -14.085 -6.048 -9.886 1.00 0.00 N ATOM 960 CA GLY A 67 -13.901 -7.162 -10.855 1.00 0.00 C ATOM 961 C GLY A 67 -13.125 -6.670 -12.083 1.00 0.00 C ATOM 962 O GLY A 67 -13.059 -7.370 -13.086 1.00 0.00 O ATOM 0 H GLY A 67 -13.433 -6.053 -9.102 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -13.363 -7.982 -10.380 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -14.872 -7.552 -11.161 1.00 0.00 H new ATOM 966 N GLN A 68 -12.518 -5.470 -12.022 1.00 0.00 N ATOM 967 CA GLN A 68 -11.732 -4.968 -13.214 1.00 0.00 C ATOM 968 C GLN A 68 -10.264 -4.893 -12.837 1.00 0.00 C ATOM 969 O GLN A 68 -9.814 -3.944 -12.208 1.00 0.00 O ATOM 970 CB GLN A 68 -12.258 -3.611 -13.650 1.00 0.00 C ATOM 971 CG GLN A 68 -11.256 -2.850 -14.591 1.00 0.00 C ATOM 972 CD GLN A 68 -10.699 -3.790 -15.688 1.00 0.00 C ATOM 973 OE1 GLN A 68 -11.412 -4.624 -16.209 1.00 0.00 O ATOM 974 NE2 GLN A 68 -9.442 -3.681 -16.055 1.00 0.00 N ATOM 0 H GLN A 68 -12.539 -4.844 -11.217 1.00 0.00 H new ATOM 0 HA GLN A 68 -11.846 -5.653 -14.054 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -13.208 -3.743 -14.167 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -12.457 -3.002 -12.768 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -11.760 -2.003 -15.055 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -10.433 -2.447 -14.001 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -8.842 -2.981 -15.618 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -9.066 -4.296 -16.777 1.00 0.00 H new ATOM 983 N LYS A 69 -9.525 -5.896 -13.216 1.00 0.00 N ATOM 984 CA LYS A 69 -8.076 -5.946 -12.890 1.00 0.00 C ATOM 985 C LYS A 69 -7.342 -4.755 -13.541 1.00 0.00 C ATOM 986 O LYS A 69 -7.352 -4.587 -14.755 1.00 0.00 O ATOM 987 CB LYS A 69 -7.492 -7.347 -13.329 1.00 0.00 C ATOM 988 CG LYS A 69 -6.711 -7.291 -14.665 1.00 0.00 C ATOM 989 CD LYS A 69 -6.556 -8.710 -15.215 1.00 0.00 C ATOM 990 CE LYS A 69 -5.240 -9.319 -14.717 1.00 0.00 C ATOM 991 NZ LYS A 69 -4.626 -10.131 -15.808 1.00 0.00 N ATOM 0 H LYS A 69 -9.870 -6.696 -13.746 1.00 0.00 H new ATOM 0 HA LYS A 69 -7.924 -5.851 -11.815 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -6.832 -7.720 -12.545 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -8.310 -8.061 -13.424 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -7.240 -6.665 -15.384 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -5.731 -6.839 -14.509 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -7.396 -9.327 -14.897 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -6.569 -8.691 -16.305 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -4.555 -8.530 -14.407 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -5.423 -9.944 -13.843 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -3.733 -10.545 -15.472 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -5.279 -10.892 -16.083 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -4.438 -9.522 -16.630 1.00 0.00 H new ATOM 1005 N CYS A 70 -6.682 -3.946 -12.725 1.00 0.00 N ATOM 1006 CA CYS A 70 -5.913 -2.791 -13.245 1.00 0.00 C ATOM 1007 C CYS A 70 -4.489 -3.028 -12.874 1.00 0.00 C ATOM 1008 O CYS A 70 -4.189 -3.394 -11.768 1.00 0.00 O ATOM 1009 CB CYS A 70 -6.394 -1.504 -12.629 1.00 0.00 C ATOM 1010 SG CYS A 70 -6.405 -1.649 -10.824 1.00 0.00 S ATOM 0 H CYS A 70 -6.654 -4.053 -11.711 1.00 0.00 H new ATOM 0 HA CYS A 70 -6.038 -2.701 -14.324 1.00 0.00 H new ATOM 0 HB2 CYS A 70 -5.746 -0.681 -12.932 1.00 0.00 H new ATOM 0 HB3 CYS A 70 -7.396 -1.270 -12.990 1.00 0.00 H new ATOM 0 HG CYS A 70 -5.449 -2.445 -10.447 1.00 0.00 H new ATOM 1016 N SER A 71 -3.636 -2.830 -13.788 1.00 0.00 N ATOM 1017 CA SER A 71 -2.163 -3.046 -13.554 1.00 0.00 C ATOM 1018 C SER A 71 -1.611 -1.936 -12.772 1.00 0.00 C ATOM 1019 O SER A 71 -2.156 -0.939 -12.768 1.00 0.00 O ATOM 1020 CB SER A 71 -1.488 -3.085 -14.864 1.00 0.00 C ATOM 1021 OG SER A 71 -1.421 -1.755 -15.447 1.00 0.00 O ATOM 0 H SER A 71 -3.872 -2.517 -14.730 1.00 0.00 H new ATOM 0 HA SER A 71 -2.011 -3.978 -13.010 1.00 0.00 H new ATOM 0 HB2 SER A 71 -0.482 -3.488 -14.748 1.00 0.00 H new ATOM 0 HB3 SER A 71 -2.025 -3.755 -15.535 1.00 0.00 H new ATOM 0 HG SER A 71 -2.325 -1.385 -15.522 1.00 0.00 H new ATOM 1027 N VAL A 72 -0.490 -2.129 -12.152 1.00 0.00 N ATOM 1028 CA VAL A 72 0.171 -1.033 -11.378 1.00 0.00 C ATOM 1029 C VAL A 72 1.282 -0.470 -12.192 1.00 0.00 C ATOM 1030 O VAL A 72 1.993 -1.191 -12.888 1.00 0.00 O ATOM 1031 CB VAL A 72 0.746 -1.541 -10.082 1.00 0.00 C ATOM 1032 CG1 VAL A 72 1.032 -0.362 -9.166 1.00 0.00 C ATOM 1033 CG2 VAL A 72 -0.233 -2.478 -9.399 1.00 0.00 C ATOM 0 H VAL A 72 0.013 -3.016 -12.144 1.00 0.00 H new ATOM 0 HA VAL A 72 -0.581 -0.276 -11.155 1.00 0.00 H new ATOM 0 HB VAL A 72 1.667 -2.085 -10.293 1.00 0.00 H new ATOM 0 HG11 VAL A 72 1.449 -0.724 -8.226 1.00 0.00 H new ATOM 0 HG12 VAL A 72 1.747 0.307 -9.646 1.00 0.00 H new ATOM 0 HG13 VAL A 72 0.106 0.178 -8.968 1.00 0.00 H new ATOM 0 HG21 VAL A 72 0.198 -2.836 -8.464 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -1.161 -1.946 -9.190 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -0.440 -3.326 -10.051 1.00 0.00 H new ATOM 1043 N ILE A 73 1.459 0.800 -12.077 1.00 0.00 N ATOM 1044 CA ILE A 73 2.530 1.494 -12.780 1.00 0.00 C ATOM 1045 C ILE A 73 3.115 2.567 -11.803 1.00 0.00 C ATOM 1046 O ILE A 73 2.895 3.727 -11.914 1.00 0.00 O ATOM 1047 CB ILE A 73 2.001 2.094 -14.092 1.00 0.00 C ATOM 1048 CG1 ILE A 73 1.728 0.937 -15.132 1.00 0.00 C ATOM 1049 CG2 ILE A 73 3.028 3.075 -14.690 1.00 0.00 C ATOM 1050 CD1 ILE A 73 0.207 0.807 -15.453 1.00 0.00 C ATOM 0 H ILE A 73 0.876 1.405 -11.498 1.00 0.00 H new ATOM 0 HA ILE A 73 3.331 0.813 -13.067 1.00 0.00 H new ATOM 0 HB ILE A 73 1.076 2.631 -13.879 1.00 0.00 H new ATOM 0 HG12 ILE A 73 2.280 1.134 -16.051 1.00 0.00 H new ATOM 0 HG13 ILE A 73 2.099 -0.007 -14.734 1.00 0.00 H new ATOM 0 HG21 ILE A 73 2.637 3.490 -15.619 1.00 0.00 H new ATOM 0 HG22 ILE A 73 3.215 3.882 -13.982 1.00 0.00 H new ATOM 0 HG23 ILE A 73 3.960 2.547 -14.893 1.00 0.00 H new ATOM 0 HD11 ILE A 73 0.054 0.002 -16.172 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -0.340 0.585 -14.537 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -0.157 1.744 -15.875 1.00 0.00 H new ATOM 1062 N ARG A 74 3.816 2.077 -10.834 1.00 0.00 N ATOM 1063 CA ARG A 74 4.501 2.881 -9.723 1.00 0.00 C ATOM 1064 C ARG A 74 3.761 2.643 -8.421 1.00 0.00 C ATOM 1065 O ARG A 74 2.990 3.482 -7.956 1.00 0.00 O ATOM 1066 CB ARG A 74 4.587 4.391 -10.015 1.00 0.00 C ATOM 1067 CG ARG A 74 5.741 4.986 -9.204 1.00 0.00 C ATOM 1068 CD ARG A 74 6.388 6.131 -9.981 1.00 0.00 C ATOM 1069 NE ARG A 74 7.788 5.755 -10.318 1.00 0.00 N ATOM 1070 CZ ARG A 74 8.196 5.791 -11.559 1.00 0.00 C ATOM 1071 NH1 ARG A 74 7.716 4.945 -12.435 1.00 0.00 N ATOM 1072 NH2 ARG A 74 9.087 6.672 -11.924 1.00 0.00 N ATOM 0 H ARG A 74 3.969 1.073 -10.737 1.00 0.00 H new ATOM 0 HA ARG A 74 5.531 2.531 -9.658 1.00 0.00 H new ATOM 0 HB2 ARG A 74 4.747 4.561 -11.080 1.00 0.00 H new ATOM 0 HB3 ARG A 74 3.649 4.880 -9.752 1.00 0.00 H new ATOM 0 HG2 ARG A 74 5.373 5.349 -8.244 1.00 0.00 H new ATOM 0 HG3 ARG A 74 6.482 4.216 -8.991 1.00 0.00 H new ATOM 0 HD2 ARG A 74 5.823 6.336 -10.891 1.00 0.00 H new ATOM 0 HD3 ARG A 74 6.376 7.044 -9.386 1.00 0.00 H new ATOM 0 HE ARG A 74 8.430 5.469 -9.579 1.00 0.00 H new ATOM 0 HH11 ARG A 74 7.021 4.255 -12.150 1.00 0.00 H new ATOM 0 HH12 ARG A 74 8.037 4.976 -13.403 1.00 0.00 H new ATOM 0 HH21 ARG A 74 9.463 7.330 -11.241 1.00 0.00 H new ATOM 0 HH22 ARG A 74 9.407 6.702 -12.892 1.00 0.00 H new ATOM 1086 N ASP A 75 3.978 1.482 -7.826 1.00 0.00 N ATOM 1087 CA ASP A 75 3.289 1.150 -6.566 1.00 0.00 C ATOM 1088 C ASP A 75 3.878 1.933 -5.393 1.00 0.00 C ATOM 1089 O ASP A 75 4.907 1.576 -4.833 1.00 0.00 O ATOM 1090 CB ASP A 75 3.294 -0.407 -6.335 1.00 0.00 C ATOM 1091 CG ASP A 75 3.322 -0.786 -4.827 1.00 0.00 C ATOM 1092 OD1 ASP A 75 4.401 -0.792 -4.263 1.00 0.00 O ATOM 1093 OD2 ASP A 75 2.272 -1.064 -4.282 1.00 0.00 O ATOM 0 H ASP A 75 4.609 0.761 -8.176 1.00 0.00 H new ATOM 0 HA ASP A 75 2.246 1.457 -6.638 1.00 0.00 H new ATOM 0 HB2 ASP A 75 2.409 -0.843 -6.799 1.00 0.00 H new ATOM 0 HB3 ASP A 75 4.161 -0.842 -6.832 1.00 0.00 H new ATOM 1098 N SER A 76 3.171 2.973 -4.993 1.00 0.00 N ATOM 1099 CA SER A 76 3.588 3.793 -3.812 1.00 0.00 C ATOM 1100 C SER A 76 2.335 4.036 -2.927 1.00 0.00 C ATOM 1101 O SER A 76 2.290 4.950 -2.142 1.00 0.00 O ATOM 1102 CB SER A 76 4.205 5.135 -4.261 1.00 0.00 C ATOM 1103 OG SER A 76 5.620 4.991 -4.341 1.00 0.00 O ATOM 0 H SER A 76 2.312 3.288 -5.445 1.00 0.00 H new ATOM 0 HA SER A 76 4.351 3.261 -3.244 1.00 0.00 H new ATOM 0 HB2 SER A 76 3.801 5.430 -5.230 1.00 0.00 H new ATOM 0 HB3 SER A 76 3.946 5.924 -3.554 1.00 0.00 H new ATOM 0 HG SER A 76 6.019 5.839 -4.627 1.00 0.00 H new ATOM 1109 N LEU A 77 1.329 3.165 -3.069 1.00 0.00 N ATOM 1110 CA LEU A 77 0.033 3.239 -2.278 1.00 0.00 C ATOM 1111 C LEU A 77 0.287 3.202 -0.794 1.00 0.00 C ATOM 1112 O LEU A 77 -0.584 3.577 -0.019 1.00 0.00 O ATOM 1113 CB LEU A 77 -0.804 2.013 -2.712 1.00 0.00 C ATOM 1114 CG LEU A 77 -2.250 2.062 -2.229 1.00 0.00 C ATOM 1115 CD1 LEU A 77 -2.872 3.426 -2.534 1.00 0.00 C ATOM 1116 CD2 LEU A 77 -3.026 0.964 -2.986 1.00 0.00 C ATOM 0 H LEU A 77 1.361 2.383 -3.724 1.00 0.00 H new ATOM 0 HA LEU A 77 -0.487 4.176 -2.478 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -0.795 1.943 -3.800 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -0.332 1.107 -2.331 1.00 0.00 H new ATOM 0 HG LEU A 77 -2.291 1.904 -1.151 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -3.904 3.442 -2.182 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -2.304 4.206 -2.028 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -2.852 3.603 -3.609 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -4.068 0.968 -2.666 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -2.975 1.156 -4.058 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -2.584 -0.009 -2.770 1.00 0.00 H new ATOM 1128 N LEU A 78 1.465 2.803 -0.368 1.00 0.00 N ATOM 1129 CA LEU A 78 1.756 2.803 1.072 1.00 0.00 C ATOM 1130 C LEU A 78 2.686 3.981 1.361 1.00 0.00 C ATOM 1131 O LEU A 78 3.653 4.179 0.687 1.00 0.00 O ATOM 1132 CB LEU A 78 2.294 1.472 1.473 1.00 0.00 C ATOM 1133 CG LEU A 78 1.101 0.474 1.468 1.00 0.00 C ATOM 1134 CD1 LEU A 78 1.585 -0.975 1.478 1.00 0.00 C ATOM 1135 CD2 LEU A 78 0.214 0.714 2.697 1.00 0.00 C ATOM 0 H LEU A 78 2.225 2.481 -0.967 1.00 0.00 H new ATOM 0 HA LEU A 78 0.861 2.945 1.678 1.00 0.00 H new ATOM 0 HB2 LEU A 78 3.071 1.147 0.781 1.00 0.00 H new ATOM 0 HB3 LEU A 78 2.749 1.523 2.462 1.00 0.00 H new ATOM 0 HG LEU A 78 0.531 0.644 0.554 1.00 0.00 H new ATOM 0 HD11 LEU A 78 0.726 -1.646 1.474 1.00 0.00 H new ATOM 0 HD12 LEU A 78 2.194 -1.161 0.594 1.00 0.00 H new ATOM 0 HD13 LEU A 78 2.181 -1.153 2.373 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -0.619 0.012 2.687 1.00 0.00 H new ATOM 0 HD22 LEU A 78 0.801 0.568 3.604 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -0.171 1.734 2.675 1.00 0.00 H new ATOM 1183 N GLU A 82 4.045 9.118 -0.370 1.00 0.00 N ATOM 1184 CA GLU A 82 3.310 9.106 -1.651 1.00 0.00 C ATOM 1185 C GLU A 82 1.866 8.558 -1.565 1.00 0.00 C ATOM 1186 O GLU A 82 0.926 9.193 -2.008 1.00 0.00 O ATOM 1187 CB GLU A 82 4.052 8.163 -2.574 1.00 0.00 C ATOM 1188 CG GLU A 82 5.121 8.873 -3.402 1.00 0.00 C ATOM 1189 CD GLU A 82 4.494 10.006 -4.227 1.00 0.00 C ATOM 1190 OE1 GLU A 82 4.041 9.729 -5.325 1.00 0.00 O ATOM 1191 OE2 GLU A 82 4.481 11.128 -3.747 1.00 0.00 O ATOM 0 HA GLU A 82 3.252 10.142 -1.986 1.00 0.00 H new ATOM 0 HB2 GLU A 82 4.519 7.375 -1.983 1.00 0.00 H new ATOM 0 HB3 GLU A 82 3.340 7.680 -3.243 1.00 0.00 H new ATOM 0 HG2 GLU A 82 5.891 9.277 -2.744 1.00 0.00 H new ATOM 0 HG3 GLU A 82 5.610 8.159 -4.065 1.00 0.00 H new ATOM 1198 N PHE A 83 1.732 7.311 -1.134 1.00 0.00 N ATOM 1199 CA PHE A 83 0.397 6.584 -1.155 1.00 0.00 C ATOM 1200 C PHE A 83 -0.215 6.585 -2.590 1.00 0.00 C ATOM 1201 O PHE A 83 -1.332 6.147 -2.757 1.00 0.00 O ATOM 1202 CB PHE A 83 -0.666 7.127 -0.213 1.00 0.00 C ATOM 1203 CG PHE A 83 -0.264 8.412 0.500 1.00 0.00 C ATOM 1204 CD1 PHE A 83 0.574 8.354 1.602 1.00 0.00 C ATOM 1205 CD2 PHE A 83 -0.754 9.649 0.059 1.00 0.00 C ATOM 1206 CE1 PHE A 83 0.935 9.526 2.279 1.00 0.00 C ATOM 1207 CE2 PHE A 83 -0.394 10.825 0.728 1.00 0.00 C ATOM 1208 CZ PHE A 83 0.451 10.762 1.842 1.00 0.00 C ATOM 0 H PHE A 83 2.503 6.756 -0.762 1.00 0.00 H new ATOM 0 HA PHE A 83 0.653 5.582 -0.811 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -1.580 7.308 -0.779 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -0.898 6.367 0.533 1.00 0.00 H new ATOM 0 HD1 PHE A 83 0.951 7.400 1.941 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -1.410 9.695 -0.798 1.00 0.00 H new ATOM 0 HE1 PHE A 83 1.587 9.474 3.138 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -0.767 11.779 0.385 1.00 0.00 H new ATOM 0 HZ PHE A 83 0.728 11.667 2.363 1.00 0.00 H new ATOM 1218 N SER A 84 0.486 7.063 -3.615 1.00 0.00 N ATOM 1219 CA SER A 84 -0.108 7.085 -4.995 1.00 0.00 C ATOM 1220 C SER A 84 0.418 5.916 -5.794 1.00 0.00 C ATOM 1221 O SER A 84 1.606 5.625 -5.796 1.00 0.00 O ATOM 1222 CB SER A 84 0.241 8.409 -5.673 1.00 0.00 C ATOM 1223 OG SER A 84 1.594 8.752 -5.386 1.00 0.00 O ATOM 0 H SER A 84 1.434 7.433 -3.547 1.00 0.00 H new ATOM 0 HA SER A 84 -1.193 6.998 -4.934 1.00 0.00 H new ATOM 0 HB2 SER A 84 0.097 8.326 -6.750 1.00 0.00 H new ATOM 0 HB3 SER A 84 -0.426 9.196 -5.322 1.00 0.00 H new ATOM 0 HG SER A 84 1.910 9.411 -6.039 1.00 0.00 H new ATOM 1229 N MET A 85 -0.480 5.237 -6.451 1.00 0.00 N ATOM 1230 CA MET A 85 -0.126 4.040 -7.268 1.00 0.00 C ATOM 1231 C MET A 85 -0.748 4.238 -8.642 1.00 0.00 C ATOM 1232 O MET A 85 -1.927 4.480 -8.733 1.00 0.00 O ATOM 1233 CB MET A 85 -0.759 2.843 -6.574 1.00 0.00 C ATOM 1234 CG MET A 85 -0.165 1.524 -7.044 1.00 0.00 C ATOM 1235 SD MET A 85 0.264 0.525 -5.600 1.00 0.00 S ATOM 1236 CE MET A 85 -0.431 -1.022 -6.161 1.00 0.00 C ATOM 0 H MET A 85 -1.473 5.468 -6.456 1.00 0.00 H new ATOM 0 HA MET A 85 0.949 3.892 -7.370 1.00 0.00 H new ATOM 0 HB2 MET A 85 -0.623 2.937 -5.497 1.00 0.00 H new ATOM 0 HB3 MET A 85 -1.833 2.843 -6.761 1.00 0.00 H new ATOM 0 HG2 MET A 85 -0.880 0.991 -7.672 1.00 0.00 H new ATOM 0 HG3 MET A 85 0.721 1.706 -7.653 1.00 0.00 H new ATOM 0 HE1 MET A 85 -1.108 -1.413 -5.402 1.00 0.00 H new ATOM 0 HE2 MET A 85 -0.980 -0.859 -7.088 1.00 0.00 H new ATOM 0 HE3 MET A 85 0.371 -1.739 -6.336 1.00 0.00 H new ATOM 1246 N ASP A 86 0.016 4.158 -9.717 1.00 0.00 N ATOM 1247 CA ASP A 86 -0.600 4.375 -11.065 1.00 0.00 C ATOM 1248 C ASP A 86 -1.089 3.053 -11.613 1.00 0.00 C ATOM 1249 O ASP A 86 -0.452 2.461 -12.469 1.00 0.00 O ATOM 1250 CB ASP A 86 0.436 4.945 -11.971 1.00 0.00 C ATOM 1251 CG ASP A 86 0.407 6.476 -11.921 1.00 0.00 C ATOM 1252 OD1 ASP A 86 0.612 7.018 -10.848 1.00 0.00 O ATOM 1253 OD2 ASP A 86 0.186 7.082 -12.959 1.00 0.00 O ATOM 0 H ASP A 86 1.016 3.956 -9.716 1.00 0.00 H new ATOM 0 HA ASP A 86 -1.444 5.061 -10.989 1.00 0.00 H new ATOM 0 HB2 ASP A 86 1.422 4.584 -11.679 1.00 0.00 H new ATOM 0 HB3 ASP A 86 0.262 4.605 -12.992 1.00 0.00 H new ATOM 1258 N LEU A 87 -2.243 2.575 -11.176 1.00 0.00 N ATOM 1259 CA LEU A 87 -2.714 1.296 -11.712 1.00 0.00 C ATOM 1260 C LEU A 87 -3.684 1.550 -12.814 1.00 0.00 C ATOM 1261 O LEU A 87 -4.691 2.200 -12.634 1.00 0.00 O ATOM 1262 CB LEU A 87 -3.248 0.278 -10.633 1.00 0.00 C ATOM 1263 CG LEU A 87 -3.954 0.906 -9.430 1.00 0.00 C ATOM 1264 CD1 LEU A 87 -3.009 1.768 -8.603 1.00 0.00 C ATOM 1265 CD2 LEU A 87 -5.139 1.703 -9.907 1.00 0.00 C ATOM 0 H LEU A 87 -2.849 3.021 -10.487 1.00 0.00 H new ATOM 0 HA LEU A 87 -1.844 0.778 -12.116 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -3.939 -0.411 -11.119 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -2.408 -0.315 -10.271 1.00 0.00 H new ATOM 0 HG LEU A 87 -4.299 0.106 -8.775 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -3.551 2.195 -7.759 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -2.187 1.155 -8.234 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -2.613 2.572 -9.224 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -5.644 2.152 -9.051 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -4.801 2.489 -10.582 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -5.831 1.046 -10.433 1.00 0.00 H new ATOM 1277 N ARG A 88 -3.332 1.085 -14.010 1.00 0.00 N ATOM 1278 CA ARG A 88 -4.210 1.364 -15.209 1.00 0.00 C ATOM 1279 C ARG A 88 -4.826 0.099 -15.800 1.00 0.00 C ATOM 1280 O ARG A 88 -4.138 -0.849 -16.104 1.00 0.00 O ATOM 1281 CB ARG A 88 -3.367 2.131 -16.305 1.00 0.00 C ATOM 1282 CG ARG A 88 -2.647 1.176 -17.310 1.00 0.00 C ATOM 1283 CD ARG A 88 -1.938 2.023 -18.373 1.00 0.00 C ATOM 1284 NE ARG A 88 -0.457 1.920 -18.212 1.00 0.00 N ATOM 1285 CZ ARG A 88 0.303 2.943 -18.513 1.00 0.00 C ATOM 1286 NH1 ARG A 88 0.319 3.394 -19.732 1.00 0.00 N ATOM 1287 NH2 ARG A 88 1.041 3.512 -17.595 1.00 0.00 N ATOM 0 H ARG A 88 -2.493 0.537 -14.201 1.00 0.00 H new ATOM 0 HA ARG A 88 -5.042 1.983 -14.872 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -4.026 2.800 -16.858 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -2.623 2.755 -15.810 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -1.927 0.549 -16.785 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -3.369 0.508 -17.779 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -2.227 1.686 -19.369 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -2.249 3.064 -18.286 1.00 0.00 H new ATOM 0 HE ARG A 88 -0.039 1.055 -17.869 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -0.258 2.951 -20.447 1.00 0.00 H new ATOM 0 HH12 ARG A 88 0.909 4.191 -19.973 1.00 0.00 H new ATOM 0 HH21 ARG A 88 1.027 3.159 -16.638 1.00 0.00 H new ATOM 0 HH22 ARG A 88 1.631 4.308 -17.836 1.00 0.00 H new ATOM 1301 N THR A 89 -6.139 0.133 -16.026 1.00 0.00 N ATOM 1302 CA THR A 89 -6.859 -1.019 -16.689 1.00 0.00 C ATOM 1303 C THR A 89 -6.159 -1.221 -18.048 1.00 0.00 C ATOM 1304 O THR A 89 -6.488 -0.566 -19.014 1.00 0.00 O ATOM 1305 CB THR A 89 -8.393 -0.655 -16.905 1.00 0.00 C ATOM 1306 OG1 THR A 89 -8.582 0.105 -18.090 1.00 0.00 O ATOM 1307 CG2 THR A 89 -8.937 0.160 -15.720 1.00 0.00 C ATOM 0 H THR A 89 -6.740 0.918 -15.775 1.00 0.00 H new ATOM 0 HA THR A 89 -6.824 -1.923 -16.081 1.00 0.00 H new ATOM 0 HB THR A 89 -8.932 -1.599 -16.986 1.00 0.00 H new ATOM 0 HG1 THR A 89 -7.712 0.395 -18.435 1.00 0.00 H new ATOM 0 HG21 THR A 89 -9.987 0.396 -15.892 1.00 0.00 H new ATOM 0 HG22 THR A 89 -8.842 -0.422 -14.804 1.00 0.00 H new ATOM 0 HG23 THR A 89 -8.369 1.085 -15.623 1.00 0.00 H new ATOM 1315 N LYS A 90 -5.153 -2.056 -18.105 1.00 0.00 N ATOM 1316 CA LYS A 90 -4.410 -2.208 -19.352 1.00 0.00 C ATOM 1317 C LYS A 90 -5.252 -3.014 -20.330 1.00 0.00 C ATOM 1318 O LYS A 90 -6.319 -3.521 -19.997 1.00 0.00 O ATOM 1319 CB LYS A 90 -3.061 -2.898 -19.131 1.00 0.00 C ATOM 1320 CG LYS A 90 -2.488 -2.666 -17.749 1.00 0.00 C ATOM 1321 CD LYS A 90 -1.016 -3.143 -17.798 1.00 0.00 C ATOM 1322 CE LYS A 90 -0.961 -4.670 -17.599 1.00 0.00 C ATOM 1323 NZ LYS A 90 0.096 -5.028 -16.598 1.00 0.00 N ATOM 0 H LYS A 90 -4.827 -2.633 -17.329 1.00 0.00 H new ATOM 0 HA LYS A 90 -4.205 -1.216 -19.755 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -3.178 -3.970 -19.293 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -2.351 -2.539 -19.876 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -2.545 -1.612 -17.477 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -3.051 -3.220 -16.998 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -0.568 -2.874 -18.755 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -0.435 -2.644 -17.022 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -1.931 -5.034 -17.260 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -0.751 -5.160 -18.550 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 0.705 -5.775 -16.989 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 0.671 -4.188 -16.385 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -0.354 -5.370 -15.725 1.00 0.00 H new ATOM 1434 N ASN A 99 -6.740 4.648 -17.270 1.00 0.00 N ATOM 1435 CA ASN A 99 -5.678 4.772 -16.196 1.00 0.00 C ATOM 1436 C ASN A 99 -6.281 5.278 -14.895 1.00 0.00 C ATOM 1437 O ASN A 99 -7.121 6.160 -14.871 1.00 0.00 O ATOM 1438 CB ASN A 99 -4.489 5.667 -16.654 1.00 0.00 C ATOM 1439 CG ASN A 99 -4.235 5.559 -18.181 1.00 0.00 C ATOM 1440 OD1 ASN A 99 -4.761 4.691 -18.854 1.00 0.00 O ATOM 1441 ND2 ASN A 99 -3.416 6.405 -18.746 1.00 0.00 N ATOM 0 HA ASN A 99 -5.275 3.775 -16.018 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -4.695 6.705 -16.393 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -3.587 5.376 -16.115 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -3.221 6.336 -19.745 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -2.972 7.135 -18.189 1.00 0.00 H new ATOM 1448 N VAL A 100 -5.847 4.670 -13.809 1.00 0.00 N ATOM 1449 CA VAL A 100 -6.350 5.003 -12.445 1.00 0.00 C ATOM 1450 C VAL A 100 -5.178 5.348 -11.536 1.00 0.00 C ATOM 1451 O VAL A 100 -4.093 4.779 -11.655 1.00 0.00 O ATOM 1452 CB VAL A 100 -7.046 3.759 -11.829 1.00 0.00 C ATOM 1453 CG1 VAL A 100 -7.899 4.183 -10.648 1.00 0.00 C ATOM 1454 CG2 VAL A 100 -7.931 3.065 -12.875 1.00 0.00 C ATOM 0 H VAL A 100 -5.141 3.934 -13.821 1.00 0.00 H new ATOM 0 HA VAL A 100 -7.042 5.841 -12.528 1.00 0.00 H new ATOM 0 HB VAL A 100 -6.279 3.060 -11.496 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -8.386 3.308 -10.218 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -7.268 4.654 -9.894 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -8.656 4.892 -10.982 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -8.411 2.195 -12.426 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -8.694 3.760 -13.225 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -7.317 2.746 -13.717 1.00 0.00 H new ATOM 1464 N THR A 101 -5.416 6.215 -10.593 1.00 0.00 N ATOM 1465 CA THR A 101 -4.400 6.579 -9.601 1.00 0.00 C ATOM 1466 C THR A 101 -5.044 6.308 -8.265 1.00 0.00 C ATOM 1467 O THR A 101 -6.121 6.805 -7.984 1.00 0.00 O ATOM 1468 CB THR A 101 -4.019 8.053 -9.718 1.00 0.00 C ATOM 1469 OG1 THR A 101 -3.555 8.316 -11.038 1.00 0.00 O ATOM 1470 CG2 THR A 101 -2.908 8.375 -8.704 1.00 0.00 C ATOM 0 H THR A 101 -6.308 6.696 -10.476 1.00 0.00 H new ATOM 0 HA THR A 101 -3.480 6.011 -9.741 1.00 0.00 H new ATOM 0 HB THR A 101 -4.889 8.675 -9.510 1.00 0.00 H new ATOM 0 HG1 THR A 101 -2.789 8.926 -11.000 1.00 0.00 H new ATOM 0 HG21 THR A 101 -2.634 9.427 -8.786 1.00 0.00 H new ATOM 0 HG22 THR A 101 -3.266 8.171 -7.695 1.00 0.00 H new ATOM 0 HG23 THR A 101 -2.035 7.756 -8.912 1.00 0.00 H new ATOM 1478 N VAL A 102 -4.431 5.487 -7.476 1.00 0.00 N ATOM 1479 CA VAL A 102 -5.005 5.100 -6.171 1.00 0.00 C ATOM 1480 C VAL A 102 -4.176 5.712 -5.025 1.00 0.00 C ATOM 1481 O VAL A 102 -3.004 5.430 -4.864 1.00 0.00 O ATOM 1482 CB VAL A 102 -5.063 3.529 -6.163 1.00 0.00 C ATOM 1483 CG1 VAL A 102 -4.886 2.933 -4.749 1.00 0.00 C ATOM 1484 CG2 VAL A 102 -6.429 3.101 -6.689 1.00 0.00 C ATOM 0 H VAL A 102 -3.531 5.056 -7.687 1.00 0.00 H new ATOM 0 HA VAL A 102 -6.013 5.486 -6.018 1.00 0.00 H new ATOM 0 HB VAL A 102 -4.245 3.163 -6.784 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -4.935 1.845 -4.804 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -3.919 3.233 -4.346 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -5.680 3.299 -4.098 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -6.493 2.013 -6.693 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -7.210 3.508 -6.047 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -6.562 3.476 -7.704 1.00 0.00 H new ATOM 1494 N THR A 103 -4.822 6.548 -4.226 1.00 0.00 N ATOM 1495 CA THR A 103 -4.142 7.202 -3.067 1.00 0.00 C ATOM 1496 C THR A 103 -4.712 6.628 -1.793 1.00 0.00 C ATOM 1497 O THR A 103 -5.901 6.723 -1.552 1.00 0.00 O ATOM 1498 CB THR A 103 -4.364 8.708 -3.071 1.00 0.00 C ATOM 1499 OG1 THR A 103 -5.728 8.995 -3.325 1.00 0.00 O ATOM 1500 CG2 THR A 103 -3.467 9.349 -4.136 1.00 0.00 C ATOM 0 H THR A 103 -5.804 6.801 -4.338 1.00 0.00 H new ATOM 0 HA THR A 103 -3.071 7.014 -3.139 1.00 0.00 H new ATOM 0 HB THR A 103 -4.105 9.120 -2.096 1.00 0.00 H new ATOM 0 HG1 THR A 103 -5.916 8.872 -4.279 1.00 0.00 H new ATOM 0 HG21 THR A 103 -3.623 10.428 -4.142 1.00 0.00 H new ATOM 0 HG22 THR A 103 -2.423 9.135 -3.909 1.00 0.00 H new ATOM 0 HG23 THR A 103 -3.716 8.941 -5.115 1.00 0.00 H new ATOM 1508 N LYS A 104 -3.876 6.027 -0.978 1.00 0.00 N ATOM 1509 CA LYS A 104 -4.353 5.422 0.296 1.00 0.00 C ATOM 1510 C LYS A 104 -3.936 6.298 1.470 1.00 0.00 C ATOM 1511 O LYS A 104 -2.773 6.645 1.626 1.00 0.00 O ATOM 1512 CB LYS A 104 -3.732 4.017 0.447 1.00 0.00 C ATOM 1513 CG LYS A 104 -4.119 3.381 1.804 1.00 0.00 C ATOM 1514 CD LYS A 104 -5.208 2.334 1.593 1.00 0.00 C ATOM 1515 CE LYS A 104 -4.654 1.154 0.778 1.00 0.00 C ATOM 1516 NZ LYS A 104 -3.326 0.730 1.325 1.00 0.00 N ATOM 0 H LYS A 104 -2.875 5.932 -1.148 1.00 0.00 H new ATOM 0 HA LYS A 104 -5.440 5.344 0.282 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -4.070 3.377 -0.368 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -2.647 4.085 0.370 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -3.244 2.921 2.263 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -4.471 4.152 2.490 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -5.575 1.980 2.556 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -6.056 2.779 1.073 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -5.353 0.319 0.811 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -4.550 1.441 -0.268 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -3.155 -0.268 1.087 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -2.576 1.318 0.910 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -3.324 0.845 2.359 1.00 0.00 H new ATOM 1530 N THR A 105 -4.883 6.608 2.317 1.00 0.00 N ATOM 1531 CA THR A 105 -4.588 7.414 3.540 1.00 0.00 C ATOM 1532 C THR A 105 -4.225 6.400 4.649 1.00 0.00 C ATOM 1533 O THR A 105 -3.641 5.361 4.357 1.00 0.00 O ATOM 1534 CB THR A 105 -5.833 8.235 3.939 1.00 0.00 C ATOM 1535 OG1 THR A 105 -6.883 7.343 4.250 1.00 0.00 O ATOM 1536 CG2 THR A 105 -6.256 9.172 2.790 1.00 0.00 C ATOM 0 H THR A 105 -5.860 6.334 2.212 1.00 0.00 H new ATOM 0 HA THR A 105 -3.772 8.118 3.373 1.00 0.00 H new ATOM 0 HB THR A 105 -5.599 8.851 4.807 1.00 0.00 H new ATOM 0 HG1 THR A 105 -7.261 7.574 5.124 1.00 0.00 H new ATOM 0 HG21 THR A 105 -7.135 9.742 3.090 1.00 0.00 H new ATOM 0 HG22 THR A 105 -5.440 9.857 2.560 1.00 0.00 H new ATOM 0 HG23 THR A 105 -6.492 8.580 1.906 1.00 0.00 H new ATOM 1544 N ASP A 106 -4.576 6.670 5.904 1.00 0.00 N ATOM 1545 CA ASP A 106 -4.268 5.708 7.002 1.00 0.00 C ATOM 1546 C ASP A 106 -5.504 4.843 7.293 1.00 0.00 C ATOM 1547 O ASP A 106 -5.396 3.805 7.938 1.00 0.00 O ATOM 1548 CB ASP A 106 -3.883 6.479 8.254 1.00 0.00 C ATOM 1549 CG ASP A 106 -3.206 5.535 9.249 1.00 0.00 C ATOM 1550 OD1 ASP A 106 -2.314 4.807 8.839 1.00 0.00 O ATOM 1551 OD2 ASP A 106 -3.585 5.557 10.406 1.00 0.00 O ATOM 0 H ASP A 106 -5.061 7.518 6.199 1.00 0.00 H new ATOM 0 HA ASP A 106 -3.441 5.065 6.700 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -3.210 7.297 7.997 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -4.769 6.925 8.706 1.00 0.00 H new ATOM 1556 N LYS A 107 -6.689 5.266 6.821 1.00 0.00 N ATOM 1557 CA LYS A 107 -7.939 4.475 7.075 1.00 0.00 C ATOM 1558 C LYS A 107 -8.948 4.652 5.899 1.00 0.00 C ATOM 1559 O LYS A 107 -10.125 4.421 6.065 1.00 0.00 O ATOM 1560 CB LYS A 107 -8.603 4.948 8.393 1.00 0.00 C ATOM 1561 CG LYS A 107 -7.546 5.201 9.475 1.00 0.00 C ATOM 1562 CD LYS A 107 -8.236 5.321 10.839 1.00 0.00 C ATOM 1563 CE LYS A 107 -7.325 6.071 11.810 1.00 0.00 C ATOM 1564 NZ LYS A 107 -6.162 5.208 12.159 1.00 0.00 N ATOM 0 H LYS A 107 -6.823 6.119 6.278 1.00 0.00 H new ATOM 0 HA LYS A 107 -7.669 3.422 7.156 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -9.171 5.861 8.212 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -9.311 4.195 8.739 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -6.823 4.386 9.491 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -6.993 6.114 9.253 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -9.184 5.848 10.733 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -8.464 4.330 11.231 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -6.980 7.001 11.358 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -7.877 6.340 12.711 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -5.859 5.411 13.133 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -6.437 4.208 12.084 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -5.377 5.402 11.505 1.00 0.00 H new ATOM 1578 N THR A 108 -8.481 5.029 4.707 1.00 0.00 N ATOM 1579 CA THR A 108 -9.408 5.189 3.525 1.00 0.00 C ATOM 1580 C THR A 108 -8.645 4.751 2.260 1.00 0.00 C ATOM 1581 O THR A 108 -7.428 4.817 2.209 1.00 0.00 O ATOM 1582 CB THR A 108 -9.886 6.653 3.413 1.00 0.00 C ATOM 1583 OG1 THR A 108 -8.856 7.472 2.888 1.00 0.00 O ATOM 1584 CG2 THR A 108 -10.295 7.160 4.805 1.00 0.00 C ATOM 0 H THR A 108 -7.500 5.230 4.511 1.00 0.00 H new ATOM 0 HA THR A 108 -10.296 4.569 3.648 1.00 0.00 H new ATOM 0 HB THR A 108 -10.741 6.698 2.739 1.00 0.00 H new ATOM 0 HG1 THR A 108 -7.997 7.209 3.280 1.00 0.00 H new ATOM 0 HG21 THR A 108 -10.633 8.194 4.731 1.00 0.00 H new ATOM 0 HG22 THR A 108 -11.103 6.541 5.195 1.00 0.00 H new ATOM 0 HG23 THR A 108 -9.439 7.106 5.478 1.00 0.00 H new ATOM 1592 N LEU A 109 -9.356 4.274 1.272 1.00 0.00 N ATOM 1593 CA LEU A 109 -8.713 3.779 0.006 1.00 0.00 C ATOM 1594 C LEU A 109 -9.282 4.641 -1.158 1.00 0.00 C ATOM 1595 O LEU A 109 -10.264 4.267 -1.777 1.00 0.00 O ATOM 1596 CB LEU A 109 -9.147 2.288 -0.158 1.00 0.00 C ATOM 1597 CG LEU A 109 -8.087 1.375 -0.843 1.00 0.00 C ATOM 1598 CD1 LEU A 109 -8.787 0.429 -1.817 1.00 0.00 C ATOM 1599 CD2 LEU A 109 -7.057 2.166 -1.591 1.00 0.00 C ATOM 0 H LEU A 109 -10.373 4.203 1.284 1.00 0.00 H new ATOM 0 HA LEU A 109 -7.625 3.852 0.017 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -9.377 1.880 0.826 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -10.068 2.253 -0.740 1.00 0.00 H new ATOM 0 HG LEU A 109 -7.578 0.817 -0.057 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -8.047 -0.211 -2.298 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -9.503 -0.188 -1.274 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -9.311 1.010 -2.575 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -6.340 1.486 -2.051 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -7.545 2.758 -2.365 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -6.536 2.830 -0.901 1.00 0.00 H new ATOM 1611 N VAL A 110 -8.691 5.812 -1.443 1.00 0.00 N ATOM 1612 CA VAL A 110 -9.251 6.690 -2.518 1.00 0.00 C ATOM 1613 C VAL A 110 -8.849 6.144 -3.885 1.00 0.00 C ATOM 1614 O VAL A 110 -7.719 5.717 -4.100 1.00 0.00 O ATOM 1615 CB VAL A 110 -8.754 8.170 -2.296 1.00 0.00 C ATOM 1616 CG1 VAL A 110 -8.676 8.961 -3.623 1.00 0.00 C ATOM 1617 CG2 VAL A 110 -9.745 8.891 -1.360 1.00 0.00 C ATOM 0 H VAL A 110 -7.860 6.174 -0.975 1.00 0.00 H new ATOM 0 HA VAL A 110 -10.340 6.697 -2.476 1.00 0.00 H new ATOM 0 HB VAL A 110 -7.754 8.126 -1.864 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -8.329 9.975 -3.422 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -7.980 8.467 -4.301 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -9.664 9.000 -4.082 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -9.412 9.916 -1.198 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -10.736 8.898 -1.815 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -9.788 8.369 -0.404 1.00 0.00 H new ATOM 1627 N LEU A 111 -9.780 6.187 -4.807 1.00 0.00 N ATOM 1628 CA LEU A 111 -9.533 5.727 -6.180 1.00 0.00 C ATOM 1629 C LEU A 111 -9.787 6.896 -7.088 1.00 0.00 C ATOM 1630 O LEU A 111 -10.707 7.678 -6.870 1.00 0.00 O ATOM 1631 CB LEU A 111 -10.495 4.547 -6.542 1.00 0.00 C ATOM 1632 CG LEU A 111 -9.922 3.249 -6.012 1.00 0.00 C ATOM 1633 CD1 LEU A 111 -10.919 2.554 -5.076 1.00 0.00 C ATOM 1634 CD2 LEU A 111 -9.552 2.282 -7.175 1.00 0.00 C ATOM 0 H LEU A 111 -10.725 6.535 -4.644 1.00 0.00 H new ATOM 0 HA LEU A 111 -8.511 5.365 -6.286 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -11.482 4.723 -6.114 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -10.623 4.486 -7.623 1.00 0.00 H new ATOM 0 HG LEU A 111 -9.018 3.497 -5.456 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -10.485 1.624 -4.708 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -11.144 3.208 -4.233 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -11.838 2.335 -5.621 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -9.143 1.359 -6.764 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -10.445 2.056 -7.758 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -8.809 2.754 -7.818 1.00 0.00 H new ATOM 1646 N LEU A 112 -8.986 7.043 -8.074 1.00 0.00 N ATOM 1647 CA LEU A 112 -9.161 8.153 -9.021 1.00 0.00 C ATOM 1648 C LEU A 112 -9.179 7.492 -10.377 1.00 0.00 C ATOM 1649 O LEU A 112 -8.150 7.125 -10.892 1.00 0.00 O ATOM 1650 CB LEU A 112 -7.962 9.072 -8.881 1.00 0.00 C ATOM 1651 CG LEU A 112 -8.274 10.546 -9.161 1.00 0.00 C ATOM 1652 CD1 LEU A 112 -8.981 10.728 -10.501 1.00 0.00 C ATOM 1653 CD2 LEU A 112 -9.133 11.080 -8.022 1.00 0.00 C ATOM 0 H LEU A 112 -8.196 6.429 -8.273 1.00 0.00 H new ATOM 0 HA LEU A 112 -10.063 8.743 -8.858 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -7.563 8.981 -7.871 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -7.180 8.740 -9.564 1.00 0.00 H new ATOM 0 HG LEU A 112 -7.340 11.104 -9.220 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -9.185 11.786 -10.664 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -8.344 10.354 -11.302 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -9.920 10.174 -10.495 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -9.366 12.129 -8.203 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -10.059 10.507 -7.965 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -8.590 10.986 -7.082 1.00 0.00 H new ATOM 1665 N MET A 113 -10.325 7.280 -10.933 1.00 0.00 N ATOM 1666 CA MET A 113 -10.371 6.538 -12.250 1.00 0.00 C ATOM 1667 C MET A 113 -10.240 7.458 -13.410 1.00 0.00 C ATOM 1668 O MET A 113 -10.679 8.602 -13.391 1.00 0.00 O ATOM 1669 CB MET A 113 -11.640 5.760 -12.390 1.00 0.00 C ATOM 1670 CG MET A 113 -11.439 4.659 -13.439 1.00 0.00 C ATOM 1671 SD MET A 113 -12.956 3.687 -13.619 1.00 0.00 S ATOM 1672 CE MET A 113 -12.231 2.312 -14.553 1.00 0.00 C ATOM 0 H MET A 113 -11.227 7.574 -10.558 1.00 0.00 H new ATOM 0 HA MET A 113 -9.523 5.854 -12.246 1.00 0.00 H new ATOM 0 HB2 MET A 113 -11.920 5.321 -11.432 1.00 0.00 H new ATOM 0 HB3 MET A 113 -12.455 6.420 -12.688 1.00 0.00 H new ATOM 0 HG2 MET A 113 -11.167 5.103 -14.396 1.00 0.00 H new ATOM 0 HG3 MET A 113 -10.615 4.010 -13.143 1.00 0.00 H new ATOM 0 HE1 MET A 113 -12.919 1.466 -14.549 1.00 0.00 H new ATOM 0 HE2 MET A 113 -12.049 2.626 -15.581 1.00 0.00 H new ATOM 0 HE3 MET A 113 -11.289 2.016 -14.092 1.00 0.00 H new ATOM 1682 N GLY A 114 -9.594 6.942 -14.428 1.00 0.00 N ATOM 1683 CA GLY A 114 -9.327 7.707 -15.642 1.00 0.00 C ATOM 1684 C GLY A 114 -9.741 6.965 -16.885 1.00 0.00 C ATOM 1685 O GLY A 114 -9.397 5.807 -17.090 1.00 0.00 O ATOM 0 H GLY A 114 -9.237 5.987 -14.448 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -9.858 8.658 -15.595 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -8.263 7.939 -15.697 1.00 0.00 H new ATOM 1773 N GLY A 121 -1.285 11.251 -15.208 1.00 0.00 N ATOM 1774 CA GLY A 121 -0.462 12.185 -14.344 1.00 0.00 C ATOM 1775 C GLY A 121 -1.369 13.273 -13.747 1.00 0.00 C ATOM 1776 O GLY A 121 -1.193 13.687 -12.609 1.00 0.00 O ATOM 0 HA2 GLY A 121 0.023 11.624 -13.545 1.00 0.00 H new ATOM 0 HA3 GLY A 121 0.329 12.643 -14.938 1.00 0.00 H new ATOM 1780 N LEU A 122 -2.353 13.715 -14.511 1.00 0.00 N ATOM 1781 CA LEU A 122 -3.322 14.766 -14.018 1.00 0.00 C ATOM 1782 C LEU A 122 -4.218 14.110 -13.026 1.00 0.00 C ATOM 1783 O LEU A 122 -4.586 14.704 -12.049 1.00 0.00 O ATOM 1784 CB LEU A 122 -4.189 15.312 -15.164 1.00 0.00 C ATOM 1785 CG LEU A 122 -3.364 15.478 -16.457 1.00 0.00 C ATOM 1786 CD1 LEU A 122 -4.068 14.742 -17.599 1.00 0.00 C ATOM 1787 CD2 LEU A 122 -3.238 16.964 -16.794 1.00 0.00 C ATOM 0 H LEU A 122 -2.528 13.391 -15.462 1.00 0.00 H new ATOM 0 HA LEU A 122 -2.763 15.597 -13.587 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -5.024 14.635 -15.346 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -4.615 16.273 -14.875 1.00 0.00 H new ATOM 0 HG LEU A 122 -2.367 15.059 -16.317 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -3.490 14.855 -18.516 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -4.153 13.684 -17.352 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -5.063 15.162 -17.743 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -2.655 17.082 -17.708 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -4.231 17.390 -16.940 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -2.738 17.482 -15.975 1.00 0.00 H new ATOM 1799 N ILE A 123 -4.552 12.853 -13.272 1.00 0.00 N ATOM 1800 CA ILE A 123 -5.398 12.087 -12.330 1.00 0.00 C ATOM 1801 C ILE A 123 -4.578 11.884 -11.079 1.00 0.00 C ATOM 1802 O ILE A 123 -5.086 11.953 -9.993 1.00 0.00 O ATOM 1803 CB ILE A 123 -5.719 10.750 -12.951 1.00 0.00 C ATOM 1804 CG1 ILE A 123 -6.597 10.975 -14.196 1.00 0.00 C ATOM 1805 CG2 ILE A 123 -6.449 9.828 -11.933 1.00 0.00 C ATOM 1806 CD1 ILE A 123 -6.871 9.658 -14.868 1.00 0.00 C ATOM 0 H ILE A 123 -4.262 12.334 -14.101 1.00 0.00 H new ATOM 0 HA ILE A 123 -6.329 12.606 -12.104 1.00 0.00 H new ATOM 0 HB ILE A 123 -4.791 10.257 -13.240 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -7.535 11.450 -13.910 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -6.096 11.651 -14.889 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -6.670 8.870 -12.403 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -5.810 9.667 -11.065 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -7.379 10.300 -11.617 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -7.493 9.821 -15.748 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -5.929 9.200 -15.169 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -7.391 8.997 -14.175 1.00 0.00 H new ATOM 1818 N ASN A 124 -3.280 11.656 -11.253 1.00 0.00 N ATOM 1819 CA ASN A 124 -2.367 11.487 -10.088 1.00 0.00 C ATOM 1820 C ASN A 124 -2.360 12.805 -9.306 1.00 0.00 C ATOM 1821 O ASN A 124 -2.171 12.826 -8.099 1.00 0.00 O ATOM 1822 CB ASN A 124 -0.949 11.170 -10.589 1.00 0.00 C ATOM 1823 CG ASN A 124 -0.031 10.833 -9.405 1.00 0.00 C ATOM 1824 OD1 ASN A 124 -0.150 11.405 -8.340 1.00 0.00 O ATOM 1825 ND2 ASN A 124 0.890 9.918 -9.552 1.00 0.00 N ATOM 0 H ASN A 124 -2.827 11.582 -12.164 1.00 0.00 H new ATOM 0 HA ASN A 124 -2.702 10.669 -9.451 1.00 0.00 H new ATOM 0 HB2 ASN A 124 -0.980 10.331 -11.285 1.00 0.00 H new ATOM 0 HB3 ASN A 124 -0.550 12.024 -11.137 1.00 0.00 H new ATOM 0 HD21 ASN A 124 1.507 9.686 -8.774 1.00 0.00 H new ATOM 0 HD22 ASN A 124 0.992 9.436 -10.445 1.00 0.00 H new ATOM 1832 N LYS A 125 -2.593 13.912 -10.009 1.00 0.00 N ATOM 1833 CA LYS A 125 -2.630 15.267 -9.341 1.00 0.00 C ATOM 1834 C LYS A 125 -4.011 15.453 -8.667 1.00 0.00 C ATOM 1835 O LYS A 125 -4.135 16.109 -7.634 1.00 0.00 O ATOM 1836 CB LYS A 125 -2.436 16.354 -10.427 1.00 0.00 C ATOM 1837 CG LYS A 125 -1.015 16.267 -11.012 1.00 0.00 C ATOM 1838 CD LYS A 125 -0.166 17.449 -10.509 1.00 0.00 C ATOM 1839 CE LYS A 125 1.215 16.946 -10.071 1.00 0.00 C ATOM 1840 NZ LYS A 125 1.115 16.351 -8.709 1.00 0.00 N ATOM 0 H LYS A 125 -2.758 13.929 -11.015 1.00 0.00 H new ATOM 0 HA LYS A 125 -1.843 15.346 -8.591 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -3.173 16.223 -11.219 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -2.601 17.342 -9.998 1.00 0.00 H new ATOM 0 HG2 LYS A 125 -0.550 15.325 -10.721 1.00 0.00 H new ATOM 0 HG3 LYS A 125 -1.060 16.278 -12.101 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -0.059 18.194 -11.298 1.00 0.00 H new ATOM 0 HD3 LYS A 125 -0.667 17.939 -9.674 1.00 0.00 H new ATOM 0 HE2 LYS A 125 1.585 16.204 -10.778 1.00 0.00 H new ATOM 0 HE3 LYS A 125 1.930 17.769 -10.069 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 2.051 16.009 -8.410 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 0.779 17.072 -8.039 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 0.445 15.556 -8.726 1.00 0.00 H new ATOM 1854 N LYS A 126 -5.041 14.864 -9.256 1.00 0.00 N ATOM 1855 CA LYS A 126 -6.431 14.970 -8.702 1.00 0.00 C ATOM 1856 C LYS A 126 -6.676 13.863 -7.664 1.00 0.00 C ATOM 1857 O LYS A 126 -7.610 13.935 -6.913 1.00 0.00 O ATOM 1858 CB LYS A 126 -7.430 14.843 -9.853 1.00 0.00 C ATOM 1859 CG LYS A 126 -7.313 16.083 -10.746 1.00 0.00 C ATOM 1860 CD LYS A 126 -8.346 16.021 -11.871 1.00 0.00 C ATOM 1861 CE LYS A 126 -7.680 15.529 -13.161 1.00 0.00 C ATOM 1862 NZ LYS A 126 -6.970 16.667 -13.806 1.00 0.00 N ATOM 0 H LYS A 126 -4.968 14.309 -10.108 1.00 0.00 H new ATOM 0 HA LYS A 126 -6.557 15.934 -8.209 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -7.228 13.941 -10.431 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -8.444 14.752 -9.464 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -7.465 16.984 -10.152 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -6.309 16.144 -11.167 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -9.160 15.352 -11.593 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -8.784 17.007 -12.030 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -6.978 14.725 -12.939 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -8.429 15.120 -13.839 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -6.780 16.438 -14.803 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -7.562 17.520 -13.754 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -6.070 16.839 -13.313 1.00 0.00 H new ATOM 1876 N CYS A 127 -5.800 12.870 -7.604 1.00 0.00 N ATOM 1877 CA CYS A 127 -5.911 11.758 -6.591 1.00 0.00 C ATOM 1878 C CYS A 127 -5.154 12.202 -5.369 1.00 0.00 C ATOM 1879 O CYS A 127 -5.522 11.916 -4.252 1.00 0.00 O ATOM 1880 CB CYS A 127 -5.245 10.490 -7.125 1.00 0.00 C ATOM 1881 SG CYS A 127 -5.806 9.063 -6.179 1.00 0.00 S ATOM 0 H CYS A 127 -4.998 12.786 -8.229 1.00 0.00 H new ATOM 0 HA CYS A 127 -6.959 11.548 -6.375 1.00 0.00 H new ATOM 0 HB2 CYS A 127 -5.487 10.357 -8.179 1.00 0.00 H new ATOM 0 HB3 CYS A 127 -4.161 10.581 -7.056 1.00 0.00 H new ATOM 0 HG CYS A 127 -6.115 8.097 -6.993 1.00 0.00 H new ATOM 1887 N TYR A 128 -4.081 12.913 -5.609 1.00 0.00 N ATOM 1888 CA TYR A 128 -3.231 13.444 -4.537 1.00 0.00 C ATOM 1889 C TYR A 128 -4.037 14.521 -3.798 1.00 0.00 C ATOM 1890 O TYR A 128 -3.919 14.682 -2.589 1.00 0.00 O ATOM 1891 CB TYR A 128 -1.997 14.043 -5.241 1.00 0.00 C ATOM 1892 CG TYR A 128 -0.847 14.341 -4.316 1.00 0.00 C ATOM 1893 CD1 TYR A 128 -0.690 13.697 -3.070 1.00 0.00 C ATOM 1894 CD2 TYR A 128 0.085 15.278 -4.740 1.00 0.00 C ATOM 1895 CE1 TYR A 128 0.407 14.014 -2.262 1.00 0.00 C ATOM 1896 CE2 TYR A 128 1.183 15.595 -3.934 1.00 0.00 C ATOM 1897 CZ TYR A 128 1.344 14.965 -2.694 1.00 0.00 C ATOM 1898 OH TYR A 128 2.425 15.280 -1.897 1.00 0.00 O ATOM 0 H TYR A 128 -3.760 13.148 -6.548 1.00 0.00 H new ATOM 0 HA TYR A 128 -2.918 12.694 -3.811 1.00 0.00 H new ATOM 0 HB2 TYR A 128 -1.659 13.350 -6.012 1.00 0.00 H new ATOM 0 HB3 TYR A 128 -2.291 14.963 -5.746 1.00 0.00 H new ATOM 0 HD1 TYR A 128 -1.412 12.964 -2.742 1.00 0.00 H new ATOM 0 HD2 TYR A 128 -0.038 15.764 -5.696 1.00 0.00 H new ATOM 0 HE1 TYR A 128 0.533 13.527 -1.306 1.00 0.00 H new ATOM 0 HE2 TYR A 128 1.906 16.325 -4.268 1.00 0.00 H new ATOM 0 HH TYR A 128 2.976 15.955 -2.345 1.00 0.00 H new ATOM 1908 N GLU A 129 -4.886 15.249 -4.533 1.00 0.00 N ATOM 1909 CA GLU A 129 -5.744 16.317 -3.891 1.00 0.00 C ATOM 1910 C GLU A 129 -7.034 15.682 -3.333 1.00 0.00 C ATOM 1911 O GLU A 129 -7.593 16.145 -2.332 1.00 0.00 O ATOM 1912 CB GLU A 129 -6.110 17.379 -4.932 1.00 0.00 C ATOM 1913 CG GLU A 129 -4.848 18.140 -5.350 1.00 0.00 C ATOM 1914 CD GLU A 129 -5.226 19.291 -6.287 1.00 0.00 C ATOM 1915 OE1 GLU A 129 -5.440 19.029 -7.459 1.00 0.00 O ATOM 1916 OE2 GLU A 129 -5.293 20.415 -5.814 1.00 0.00 O ATOM 0 H GLU A 129 -5.014 15.144 -5.539 1.00 0.00 H new ATOM 0 HA GLU A 129 -5.187 16.782 -3.078 1.00 0.00 H new ATOM 0 HB2 GLU A 129 -6.569 16.908 -5.802 1.00 0.00 H new ATOM 0 HB3 GLU A 129 -6.845 18.070 -4.519 1.00 0.00 H new ATOM 0 HG2 GLU A 129 -4.337 18.528 -4.469 1.00 0.00 H new ATOM 0 HG3 GLU A 129 -4.153 17.465 -5.849 1.00 0.00 H new ATOM 1923 N MET A 130 -7.509 14.618 -3.962 1.00 0.00 N ATOM 1924 CA MET A 130 -8.764 13.929 -3.479 1.00 0.00 C ATOM 1925 C MET A 130 -8.427 13.391 -2.054 1.00 0.00 C ATOM 1926 O MET A 130 -9.198 13.518 -1.085 1.00 0.00 O ATOM 1927 CB MET A 130 -9.075 12.751 -4.459 1.00 0.00 C ATOM 1928 CG MET A 130 -10.598 12.504 -4.616 1.00 0.00 C ATOM 1929 SD MET A 130 -11.431 14.033 -5.197 1.00 0.00 S ATOM 1930 CE MET A 130 -10.224 14.576 -6.430 1.00 0.00 C ATOM 0 H MET A 130 -7.081 14.199 -4.788 1.00 0.00 H new ATOM 0 HA MET A 130 -9.632 14.587 -3.445 1.00 0.00 H new ATOM 0 HB2 MET A 130 -8.642 12.969 -5.435 1.00 0.00 H new ATOM 0 HB3 MET A 130 -8.597 11.842 -4.094 1.00 0.00 H new ATOM 0 HG2 MET A 130 -10.771 11.695 -5.325 1.00 0.00 H new ATOM 0 HG3 MET A 130 -11.023 12.189 -3.663 1.00 0.00 H new ATOM 0 HE1 MET A 130 -10.663 15.359 -7.049 1.00 0.00 H new ATOM 0 HE2 MET A 130 -9.339 14.965 -5.926 1.00 0.00 H new ATOM 0 HE3 MET A 130 -9.942 13.732 -7.059 1.00 0.00 H new ATOM 1940 N ALA A 131 -7.232 12.846 -1.933 1.00 0.00 N ATOM 1941 CA ALA A 131 -6.727 12.327 -0.629 1.00 0.00 C ATOM 1942 C ALA A 131 -6.251 13.491 0.211 1.00 0.00 C ATOM 1943 O ALA A 131 -6.181 13.377 1.409 1.00 0.00 O ATOM 1944 CB ALA A 131 -5.564 11.366 -0.879 1.00 0.00 C ATOM 0 H ALA A 131 -6.576 12.741 -2.707 1.00 0.00 H new ATOM 0 HA ALA A 131 -7.524 11.798 -0.107 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -5.194 10.986 0.074 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -5.906 10.533 -1.494 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -4.762 11.893 -1.396 1.00 0.00 H new ATOM 1950 N SER A 132 -5.935 14.641 -0.412 1.00 0.00 N ATOM 1951 CA SER A 132 -5.494 15.834 0.382 1.00 0.00 C ATOM 1952 C SER A 132 -6.613 16.173 1.355 1.00 0.00 C ATOM 1953 O SER A 132 -6.356 16.599 2.471 1.00 0.00 O ATOM 1954 CB SER A 132 -5.207 17.027 -0.534 1.00 0.00 C ATOM 1955 OG SER A 132 -3.962 16.822 -1.194 1.00 0.00 O ATOM 0 H SER A 132 -5.969 14.782 -1.422 1.00 0.00 H new ATOM 0 HA SER A 132 -4.571 15.608 0.917 1.00 0.00 H new ATOM 0 HB2 SER A 132 -6.006 17.139 -1.267 1.00 0.00 H new ATOM 0 HB3 SER A 132 -5.176 17.948 0.048 1.00 0.00 H new ATOM 0 HG SER A 132 -3.880 15.880 -1.453 1.00 0.00 H new ATOM 1961 N HIS A 133 -7.879 15.930 0.953 1.00 0.00 N ATOM 1962 CA HIS A 133 -9.008 16.186 1.902 1.00 0.00 C ATOM 1963 C HIS A 133 -9.071 15.030 2.865 1.00 0.00 C ATOM 1964 O HIS A 133 -9.274 15.231 4.048 1.00 0.00 O ATOM 1965 CB HIS A 133 -10.354 16.346 1.209 1.00 0.00 C ATOM 1966 CG HIS A 133 -11.197 17.259 2.065 1.00 0.00 C ATOM 1967 ND1 HIS A 133 -11.377 18.603 1.767 1.00 0.00 N ATOM 1968 CD2 HIS A 133 -11.871 17.044 3.243 1.00 0.00 C ATOM 1969 CE1 HIS A 133 -12.130 19.138 2.748 1.00 0.00 C ATOM 1970 NE2 HIS A 133 -12.457 18.230 3.672 1.00 0.00 N ATOM 0 H HIS A 133 -8.147 15.577 0.034 1.00 0.00 H new ATOM 0 HA HIS A 133 -8.813 17.130 2.411 1.00 0.00 H new ATOM 0 HB2 HIS A 133 -10.225 16.766 0.212 1.00 0.00 H new ATOM 0 HB3 HIS A 133 -10.840 15.378 1.086 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -11.936 16.097 3.758 1.00 0.00 H new ATOM 0 HE1 HIS A 133 -12.432 20.174 2.783 1.00 0.00 H new ATOM 0 HE2 HIS A 133 -13.017 18.376 4.512 1.00 0.00 H new ATOM 1978 N LEU A 134 -8.869 13.788 2.374 1.00 0.00 N ATOM 1979 CA LEU A 134 -8.885 12.606 3.312 1.00 0.00 C ATOM 1980 C LEU A 134 -7.683 12.659 4.267 1.00 0.00 C ATOM 1981 O LEU A 134 -7.643 11.942 5.258 1.00 0.00 O ATOM 1982 CB LEU A 134 -8.893 11.318 2.511 1.00 0.00 C ATOM 1983 CG LEU A 134 -10.295 11.117 1.928 1.00 0.00 C ATOM 1984 CD1 LEU A 134 -10.341 11.602 0.479 1.00 0.00 C ATOM 1985 CD2 LEU A 134 -10.662 9.635 1.979 1.00 0.00 C ATOM 0 H LEU A 134 -8.701 13.566 1.393 1.00 0.00 H new ATOM 0 HA LEU A 134 -9.790 12.642 3.918 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -8.153 11.364 1.712 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -8.623 10.475 3.147 1.00 0.00 H new ATOM 0 HG LEU A 134 -11.008 11.693 2.518 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -11.343 11.453 0.077 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -10.089 12.662 0.442 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -9.624 11.037 -0.117 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -11.660 9.493 1.564 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -9.941 9.061 1.396 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -10.647 9.292 3.013 1.00 0.00 H new ATOM 1997 N ARG A 135 -6.748 13.550 4.012 1.00 0.00 N ATOM 1998 CA ARG A 135 -5.579 13.735 4.930 1.00 0.00 C ATOM 1999 C ARG A 135 -6.007 14.781 5.935 1.00 0.00 C ATOM 2000 O ARG A 135 -5.783 14.644 7.131 1.00 0.00 O ATOM 2001 CB ARG A 135 -4.355 14.205 4.144 1.00 0.00 C ATOM 2002 CG ARG A 135 -3.560 12.987 3.672 1.00 0.00 C ATOM 2003 CD ARG A 135 -2.502 12.617 4.720 1.00 0.00 C ATOM 2004 NE ARG A 135 -1.145 12.818 4.139 1.00 0.00 N ATOM 2005 CZ ARG A 135 -0.160 13.212 4.899 1.00 0.00 C ATOM 2006 NH1 ARG A 135 0.180 12.510 5.947 1.00 0.00 N ATOM 2007 NH2 ARG A 135 0.484 14.308 4.609 1.00 0.00 N ATOM 0 H ARG A 135 -6.748 14.163 3.196 1.00 0.00 H new ATOM 0 HA ARG A 135 -5.299 12.803 5.422 1.00 0.00 H new ATOM 0 HB2 ARG A 135 -4.666 14.805 3.289 1.00 0.00 H new ATOM 0 HB3 ARG A 135 -3.729 14.842 4.769 1.00 0.00 H new ATOM 0 HG2 ARG A 135 -4.232 12.145 3.507 1.00 0.00 H new ATOM 0 HG3 ARG A 135 -3.080 13.203 2.718 1.00 0.00 H new ATOM 0 HD2 ARG A 135 -2.624 13.233 5.611 1.00 0.00 H new ATOM 0 HD3 ARG A 135 -2.628 11.580 5.030 1.00 0.00 H new ATOM 0 HE ARG A 135 -0.986 12.647 3.146 1.00 0.00 H new ATOM 0 HH11 ARG A 135 -0.325 11.653 6.172 1.00 0.00 H new ATOM 0 HH12 ARG A 135 0.950 12.819 6.540 1.00 0.00 H new ATOM 0 HH21 ARG A 135 0.217 14.855 3.790 1.00 0.00 H new ATOM 0 HH22 ARG A 135 1.254 14.619 5.201 1.00 0.00 H new ATOM 2021 N ARG A 136 -6.710 15.804 5.449 1.00 0.00 N ATOM 2022 CA ARG A 136 -7.266 16.849 6.355 1.00 0.00 C ATOM 2023 C ARG A 136 -8.499 16.258 7.076 1.00 0.00 C ATOM 2024 O ARG A 136 -9.046 16.862 7.989 1.00 0.00 O ATOM 2025 CB ARG A 136 -7.694 18.075 5.540 1.00 0.00 C ATOM 2026 CG ARG A 136 -6.458 18.816 5.028 1.00 0.00 C ATOM 2027 CD ARG A 136 -6.890 20.123 4.363 1.00 0.00 C ATOM 2028 NE ARG A 136 -5.705 20.798 3.769 1.00 0.00 N ATOM 2029 CZ ARG A 136 -5.286 21.928 4.264 1.00 0.00 C ATOM 2030 NH1 ARG A 136 -6.057 22.979 4.239 1.00 0.00 N ATOM 2031 NH2 ARG A 136 -4.097 22.009 4.786 1.00 0.00 N ATOM 0 H ARG A 136 -6.913 15.944 4.459 1.00 0.00 H new ATOM 0 HA ARG A 136 -6.510 17.154 7.078 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -8.317 17.765 4.701 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -8.298 18.740 6.157 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -5.776 19.023 5.853 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -5.916 18.194 4.315 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -7.631 19.921 3.590 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -7.363 20.776 5.096 1.00 0.00 H new ATOM 0 HE ARG A 136 -5.221 20.377 2.976 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -6.990 22.917 3.831 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -5.727 23.863 4.627 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -3.493 21.188 4.808 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -3.769 22.894 5.173 1.00 0.00 H new ATOM 2045 N SER A 137 -8.924 15.058 6.662 1.00 0.00 N ATOM 2046 CA SER A 137 -10.085 14.381 7.280 1.00 0.00 C ATOM 2047 C SER A 137 -9.633 13.707 8.602 1.00 0.00 C ATOM 2048 O SER A 137 -10.455 13.330 9.420 1.00 0.00 O ATOM 2049 CB SER A 137 -10.631 13.328 6.269 1.00 0.00 C ATOM 2050 OG SER A 137 -9.857 12.132 6.330 1.00 0.00 O ATOM 0 H SER A 137 -8.487 14.532 5.905 1.00 0.00 H new ATOM 0 HA SER A 137 -10.877 15.093 7.514 1.00 0.00 H new ATOM 0 HB2 SER A 137 -11.674 13.105 6.494 1.00 0.00 H new ATOM 0 HB3 SER A 137 -10.603 13.736 5.259 1.00 0.00 H new ATOM 0 HG SER A 137 -8.904 12.359 6.331 1.00 0.00 H new ATOM 2056 N GLN A 138 -8.309 13.555 8.808 1.00 0.00 N ATOM 2057 CA GLN A 138 -7.779 12.907 10.067 1.00 0.00 C ATOM 2058 C GLN A 138 -8.026 11.397 10.002 1.00 0.00 C ATOM 2059 O GLN A 138 -8.185 10.731 11.024 1.00 0.00 O ATOM 2060 CB GLN A 138 -8.473 13.508 11.309 1.00 0.00 C ATOM 2061 CG GLN A 138 -7.483 13.547 12.477 1.00 0.00 C ATOM 2062 CD GLN A 138 -7.923 14.602 13.495 1.00 0.00 C ATOM 2063 OE1 GLN A 138 -8.354 15.678 13.129 1.00 0.00 O ATOM 2064 NE2 GLN A 138 -7.833 14.335 14.769 1.00 0.00 N ATOM 0 H GLN A 138 -7.589 13.856 8.151 1.00 0.00 H new ATOM 0 HA GLN A 138 -6.708 13.094 10.146 1.00 0.00 H new ATOM 0 HB2 GLN A 138 -8.831 14.513 11.088 1.00 0.00 H new ATOM 0 HB3 GLN A 138 -9.345 12.911 11.577 1.00 0.00 H new ATOM 0 HG2 GLN A 138 -7.430 12.568 12.954 1.00 0.00 H new ATOM 0 HG3 GLN A 138 -6.483 13.777 12.110 1.00 0.00 H new ATOM 0 HE21 GLN A 138 -7.471 13.432 15.077 1.00 0.00 H new ATOM 0 HE22 GLN A 138 -8.124 15.029 15.457 1.00 0.00 H new ATOM 2073 N TYR A 139 -8.041 10.848 8.794 1.00 0.00 N ATOM 2074 CA TYR A 139 -8.258 9.379 8.621 1.00 0.00 C ATOM 2075 C TYR A 139 -7.001 8.769 7.943 1.00 0.00 C ATOM 2076 O TYR A 139 -7.120 8.206 6.860 1.00 0.00 O ATOM 2077 CB TYR A 139 -9.533 9.134 7.765 1.00 0.00 C ATOM 2078 CG TYR A 139 -10.780 9.558 8.537 1.00 0.00 C ATOM 2079 CD1 TYR A 139 -10.937 9.208 9.893 1.00 0.00 C ATOM 2080 CD2 TYR A 139 -11.781 10.299 7.891 1.00 0.00 C ATOM 2081 CE1 TYR A 139 -12.087 9.603 10.591 1.00 0.00 C ATOM 2082 CE2 TYR A 139 -12.929 10.691 8.593 1.00 0.00 C ATOM 2083 CZ TYR A 139 -13.083 10.344 9.940 1.00 0.00 C ATOM 2084 OH TYR A 139 -14.215 10.734 10.628 1.00 0.00 O ATOM 2085 OXT TYR A 139 -5.935 8.887 8.526 1.00 0.00 O ATOM 0 H TYR A 139 -7.911 11.366 7.925 1.00 0.00 H new ATOM 0 HA TYR A 139 -8.407 8.899 9.588 1.00 0.00 H new ATOM 0 HB2 TYR A 139 -9.466 9.695 6.833 1.00 0.00 H new ATOM 0 HB3 TYR A 139 -9.603 8.079 7.499 1.00 0.00 H new ATOM 0 HD1 TYR A 139 -10.171 8.635 10.395 1.00 0.00 H new ATOM 0 HD2 TYR A 139 -11.667 10.568 6.851 1.00 0.00 H new ATOM 0 HE1 TYR A 139 -12.206 9.336 11.631 1.00 0.00 H new ATOM 0 HE2 TYR A 139 -13.697 11.262 8.093 1.00 0.00 H new ATOM 0 HH TYR A 139 -14.803 11.241 10.030 1.00 0.00 H new