USER MOD reduce.3.24.130724 H: found=0, std=0, add=892, rem=0, adj=36 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 9 ASN : amide:sc= -9.7! C(o=-13!,f=-15!) USER MOD Set 1.2: A 130 MET CE :methyl -144:sc= -3.56! (180deg=-7.02!) USER MOD Set 2.1: A 103 THR OG1 : rot -82:sc= -0.195! USER MOD Set 2.2: A 127 CYS SG : rot 138:sc= -1.33 USER MOD Set 3.1: A 17 GLN : amide:sc= -1.12 K(o=-2.5,f=-9.3!) USER MOD Set 3.2: A 113 MET CE :methyl -106:sc= -1.36 (180deg=-1.28) USER MOD Set 4.1: A 105 THR OG1 : rot -105:sc= 0.923 USER MOD Set 4.2: A 108 THR OG1 : rot 78:sc= 0.88 USER MOD Set 5.1: A 71 SER OG : rot -14:sc= -2.67! USER MOD Set 5.2: A 90 LYS NZ :NH3+ -179:sc= 0.645 (180deg=0) USER MOD Set 6.1: A 6 TYR OH : rot -17:sc= -2.91 USER MOD Set 6.2: A 133 HIS : no HD1:sc= -6.55! C(o=-9.5!,f=-11!) USER MOD Single : A 4 ASN : amide:sc= 0.123 K(o=0.12,f=-2.4!) USER MOD Single : A 11 MET CE :methyl -126:sc= -0.357 (180deg=-0.935) USER MOD Single : A 15 THR OG1 : rot 15:sc= 0.21 USER MOD Single : A 16 CYS SG : rot -98:sc= -4.27 USER MOD Single : A 24 TYR OH : rot -2:sc= 0.0996 USER MOD Single : A 25 LYS NZ :NH3+ -138:sc= -0.101 (180deg=-2.28!) USER MOD Single : A 27 SER OG : rot 43:sc= 0.31 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ 158:sc= -0.0612 (180deg=-0.505) USER MOD Single : A 38 THR OG1 : rot 22:sc= 1.12 USER MOD Single : A 41 ASN : amide:sc= -0.265 X(o=-0.27,f=-0.00066) USER MOD Single : A 43 THR OG1 : rot -121:sc= -1.54 USER MOD Single : A 59 TYR OH : rot -51:sc= 0.813 USER MOD Single : A 61 ASN : amide:sc= -3.2! C(o=-3.2!,f=-5.4!) USER MOD Single : A 64 THR OG1 : rot 180:sc= -1.97! USER MOD Single : A 68 GLN :FLIP amide:sc= -0.831 F(o=-1.6,f=-0.83) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 CYS SG : rot 60:sc= -4.17! USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 38:sc= 0.0345 USER MOD Single : A 85 MET CE :methyl -123:sc= -7.7! (180deg=-13.4!) USER MOD Single : A 89 THR OG1 : rot -23:sc= 0.906 USER MOD Single : A 99 ASN : amide:sc= -3.78 K(o=-3.8,f=-9.6!) USER MOD Single : A 101 THR OG1 : rot -90:sc= -0.526 USER MOD Single : A 104 LYS NZ :NH3+ -169:sc= -0.767 (180deg=-0.973) USER MOD Single : A 107 LYS NZ :NH3+ -159:sc= 0.0475 (180deg=-0.63) USER MOD Single : A 124 ASN : amide:sc= 0 K(o=0,f=-1.5!) USER MOD Single : A 125 LYS NZ :NH3+ 149:sc= -0.0669 (180deg=-0.589) USER MOD Single : A 126 LYS NZ :NH3+ 149:sc= -0.0035 (180deg=-1.05) USER MOD Single : A 128 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 SER OG : rot -34:sc= 1.08 USER MOD Single : A 137 SER OG : rot -43:sc=-0.00187 USER MOD Single : A 138 GLN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 139 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 20 N TRP A 3 -17.807 14.036 0.645 1.00 0.00 N ATOM 21 CA TRP A 3 -17.256 12.909 -0.192 1.00 0.00 C ATOM 22 C TRP A 3 -17.670 13.080 -1.675 1.00 0.00 C ATOM 23 O TRP A 3 -16.861 12.911 -2.580 1.00 0.00 O ATOM 24 CB TRP A 3 -17.796 11.615 0.302 1.00 0.00 C ATOM 25 CG TRP A 3 -16.916 10.988 1.365 1.00 0.00 C ATOM 26 CD1 TRP A 3 -17.293 9.891 2.016 1.00 0.00 C ATOM 27 CD2 TRP A 3 -15.563 11.342 1.913 1.00 0.00 C ATOM 28 NE1 TRP A 3 -16.326 9.520 2.922 1.00 0.00 N ATOM 29 CE2 TRP A 3 -15.246 10.372 2.905 1.00 0.00 C ATOM 30 CE3 TRP A 3 -14.580 12.376 1.677 1.00 0.00 C ATOM 31 CZ2 TRP A 3 -14.054 10.407 3.621 1.00 0.00 C ATOM 32 CZ3 TRP A 3 -13.385 12.386 2.411 1.00 0.00 C ATOM 33 CH2 TRP A 3 -13.129 11.407 3.377 1.00 0.00 C ATOM 0 HA TRP A 3 -16.169 12.923 -0.116 1.00 0.00 H new ATOM 0 HB2 TRP A 3 -18.795 11.773 0.708 1.00 0.00 H new ATOM 0 HB3 TRP A 3 -17.898 10.924 -0.535 1.00 0.00 H new ATOM 0 HD1 TRP A 3 -18.224 9.367 1.856 1.00 0.00 H new ATOM 0 HE1 TRP A 3 -16.401 8.708 3.535 1.00 0.00 H new ATOM 0 HE3 TRP A 3 -14.766 13.140 0.936 1.00 0.00 H new ATOM 0 HZ2 TRP A 3 -13.850 9.654 4.368 1.00 0.00 H new ATOM 0 HZ3 TRP A 3 -12.653 13.159 2.228 1.00 0.00 H new ATOM 0 HH2 TRP A 3 -12.205 11.432 3.935 1.00 0.00 H new ATOM 44 N ASN A 4 -18.943 13.392 -1.915 1.00 0.00 N ATOM 45 CA ASN A 4 -19.459 13.553 -3.329 1.00 0.00 C ATOM 46 C ASN A 4 -18.709 14.663 -4.061 1.00 0.00 C ATOM 47 O ASN A 4 -18.673 14.678 -5.272 1.00 0.00 O ATOM 48 CB ASN A 4 -20.954 13.867 -3.293 1.00 0.00 C ATOM 49 CG ASN A 4 -21.689 12.730 -2.580 1.00 0.00 C ATOM 50 OD1 ASN A 4 -21.578 12.574 -1.380 1.00 0.00 O ATOM 51 ND2 ASN A 4 -22.441 11.921 -3.272 1.00 0.00 N ATOM 0 H ASN A 4 -19.643 13.541 -1.188 1.00 0.00 H new ATOM 0 HA ASN A 4 -19.294 12.620 -3.869 1.00 0.00 H new ATOM 0 HB2 ASN A 4 -21.127 14.810 -2.774 1.00 0.00 H new ATOM 0 HB3 ASN A 4 -21.338 13.985 -4.306 1.00 0.00 H new ATOM 0 HD21 ASN A 4 -22.934 11.159 -2.806 1.00 0.00 H new ATOM 0 HD22 ASN A 4 -22.536 12.049 -4.279 1.00 0.00 H new ATOM 58 N ALA A 5 -18.098 15.567 -3.327 1.00 0.00 N ATOM 59 CA ALA A 5 -17.291 16.687 -3.954 1.00 0.00 C ATOM 60 C ALA A 5 -15.966 16.085 -4.420 1.00 0.00 C ATOM 61 O ALA A 5 -15.457 16.401 -5.496 1.00 0.00 O ATOM 62 CB ALA A 5 -17.027 17.784 -2.921 1.00 0.00 C ATOM 0 H ALA A 5 -18.120 15.583 -2.307 1.00 0.00 H new ATOM 0 HA ALA A 5 -17.832 17.130 -4.790 1.00 0.00 H new ATOM 0 HB1 ALA A 5 -16.447 18.584 -3.380 1.00 0.00 H new ATOM 0 HB2 ALA A 5 -17.976 18.183 -2.564 1.00 0.00 H new ATOM 0 HB3 ALA A 5 -16.470 17.367 -2.082 1.00 0.00 H new ATOM 68 N TYR A 6 -15.423 15.160 -3.640 1.00 0.00 N ATOM 69 CA TYR A 6 -14.156 14.467 -4.072 1.00 0.00 C ATOM 70 C TYR A 6 -14.525 13.503 -5.222 1.00 0.00 C ATOM 71 O TYR A 6 -13.678 13.048 -5.948 1.00 0.00 O ATOM 72 CB TYR A 6 -13.483 13.790 -2.884 1.00 0.00 C ATOM 73 CG TYR A 6 -13.411 14.838 -1.819 1.00 0.00 C ATOM 74 CD1 TYR A 6 -12.461 15.859 -1.877 1.00 0.00 C ATOM 75 CD2 TYR A 6 -14.364 14.836 -0.845 1.00 0.00 C ATOM 76 CE1 TYR A 6 -12.494 16.882 -0.928 1.00 0.00 C ATOM 77 CE2 TYR A 6 -14.398 15.832 0.117 1.00 0.00 C ATOM 78 CZ TYR A 6 -13.469 16.865 0.076 1.00 0.00 C ATOM 79 OH TYR A 6 -13.528 17.881 1.002 1.00 0.00 O ATOM 0 H TYR A 6 -15.798 14.862 -2.739 1.00 0.00 H new ATOM 0 HA TYR A 6 -13.415 15.174 -4.446 1.00 0.00 H new ATOM 0 HB2 TYR A 6 -14.056 12.926 -2.547 1.00 0.00 H new ATOM 0 HB3 TYR A 6 -12.489 13.429 -3.148 1.00 0.00 H new ATOM 0 HD1 TYR A 6 -11.707 15.857 -2.650 1.00 0.00 H new ATOM 0 HD2 TYR A 6 -15.102 14.048 -0.823 1.00 0.00 H new ATOM 0 HE1 TYR A 6 -11.771 17.683 -0.968 1.00 0.00 H new ATOM 0 HE2 TYR A 6 -15.145 15.806 0.897 1.00 0.00 H new ATOM 0 HH TYR A 6 -12.684 18.378 0.996 1.00 0.00 H new ATOM 89 N ILE A 7 -15.830 13.291 -5.433 1.00 0.00 N ATOM 90 CA ILE A 7 -16.315 12.510 -6.615 1.00 0.00 C ATOM 91 C ILE A 7 -16.542 13.592 -7.753 1.00 0.00 C ATOM 92 O ILE A 7 -16.370 13.350 -8.976 1.00 0.00 O ATOM 93 CB ILE A 7 -17.598 11.763 -6.260 1.00 0.00 C ATOM 94 CG1 ILE A 7 -17.199 10.561 -5.393 1.00 0.00 C ATOM 95 CG2 ILE A 7 -18.323 11.285 -7.528 1.00 0.00 C ATOM 96 CD1 ILE A 7 -16.419 9.536 -6.216 1.00 0.00 C ATOM 0 H ILE A 7 -16.570 13.636 -4.822 1.00 0.00 H new ATOM 0 HA ILE A 7 -15.609 11.746 -6.941 1.00 0.00 H new ATOM 0 HB ILE A 7 -18.282 12.421 -5.724 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -16.592 10.898 -4.553 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -18.092 10.096 -4.975 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -19.234 10.756 -7.249 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -18.578 12.145 -8.147 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -17.672 10.615 -8.089 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -16.146 8.692 -5.582 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -17.038 9.185 -7.041 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -15.515 9.999 -6.612 1.00 0.00 H new ATOM 108 N ASP A 8 -16.858 14.827 -7.323 1.00 0.00 N ATOM 109 CA ASP A 8 -17.010 15.945 -8.267 1.00 0.00 C ATOM 110 C ASP A 8 -15.656 16.170 -8.953 1.00 0.00 C ATOM 111 O ASP A 8 -15.590 16.737 -9.989 1.00 0.00 O ATOM 112 CB ASP A 8 -17.487 17.190 -7.519 1.00 0.00 C ATOM 113 CG ASP A 8 -19.017 17.230 -7.516 1.00 0.00 C ATOM 114 OD1 ASP A 8 -19.607 16.463 -6.774 1.00 0.00 O ATOM 115 OD2 ASP A 8 -19.572 18.025 -8.257 1.00 0.00 O ATOM 0 H ASP A 8 -17.011 15.072 -6.345 1.00 0.00 H new ATOM 0 HA ASP A 8 -17.759 15.722 -9.027 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -17.111 17.179 -6.496 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -17.090 18.087 -7.994 1.00 0.00 H new ATOM 120 N ASN A 9 -14.579 15.656 -8.348 1.00 0.00 N ATOM 121 CA ASN A 9 -13.206 15.719 -8.909 1.00 0.00 C ATOM 122 C ASN A 9 -13.222 15.164 -10.306 1.00 0.00 C ATOM 123 O ASN A 9 -12.769 15.770 -11.250 1.00 0.00 O ATOM 124 CB ASN A 9 -12.335 14.825 -7.916 1.00 0.00 C ATOM 125 CG ASN A 9 -11.527 13.581 -8.582 1.00 0.00 C ATOM 126 OD1 ASN A 9 -10.687 13.787 -9.433 1.00 0.00 O ATOM 127 ND2 ASN A 9 -11.781 12.257 -8.160 1.00 0.00 N ATOM 0 H ASN A 9 -14.626 15.179 -7.448 1.00 0.00 H new ATOM 0 HA ASN A 9 -12.802 16.729 -8.983 1.00 0.00 H new ATOM 0 HB2 ASN A 9 -11.614 15.473 -7.417 1.00 0.00 H new ATOM 0 HB3 ASN A 9 -12.995 14.429 -7.144 1.00 0.00 H new ATOM 0 HD21 ASN A 9 -11.260 11.482 -8.570 1.00 0.00 H new ATOM 0 HD22 ASN A 9 -12.486 12.076 -7.445 1.00 0.00 H new ATOM 134 N LEU A 10 -13.770 14.038 -10.384 1.00 0.00 N ATOM 135 CA LEU A 10 -13.936 13.266 -11.647 1.00 0.00 C ATOM 136 C LEU A 10 -14.679 13.988 -12.631 1.00 0.00 C ATOM 137 O LEU A 10 -14.442 13.884 -13.838 1.00 0.00 O ATOM 138 CB LEU A 10 -14.776 12.069 -11.333 1.00 0.00 C ATOM 139 CG LEU A 10 -14.064 11.101 -10.439 1.00 0.00 C ATOM 140 CD1 LEU A 10 -12.511 11.149 -10.586 1.00 0.00 C ATOM 141 CD2 LEU A 10 -14.478 11.323 -8.930 1.00 0.00 C ATOM 0 H LEU A 10 -14.151 13.557 -9.569 1.00 0.00 H new ATOM 0 HA LEU A 10 -12.940 13.037 -12.026 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -15.701 12.391 -10.855 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -15.054 11.568 -12.260 1.00 0.00 H new ATOM 0 HG LEU A 10 -14.377 10.107 -10.760 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -12.059 10.423 -9.910 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -12.235 10.910 -11.613 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -12.153 12.148 -10.338 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -13.949 10.609 -8.299 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -14.219 12.337 -8.627 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -15.553 11.176 -8.822 1.00 0.00 H new ATOM 153 N MET A 11 -15.628 14.645 -12.178 1.00 0.00 N ATOM 154 CA MET A 11 -16.490 15.336 -13.079 1.00 0.00 C ATOM 155 C MET A 11 -15.772 16.654 -13.499 1.00 0.00 C ATOM 156 O MET A 11 -15.871 17.098 -14.634 1.00 0.00 O ATOM 157 CB MET A 11 -17.825 15.465 -12.345 1.00 0.00 C ATOM 158 CG MET A 11 -18.275 13.986 -11.863 1.00 0.00 C ATOM 159 SD MET A 11 -19.155 13.170 -13.225 1.00 0.00 S ATOM 160 CE MET A 11 -17.760 12.185 -13.843 1.00 0.00 C ATOM 0 H MET A 11 -15.858 14.741 -11.189 1.00 0.00 H new ATOM 0 HA MET A 11 -16.705 14.837 -14.024 1.00 0.00 H new ATOM 0 HB2 MET A 11 -17.726 16.132 -11.488 1.00 0.00 H new ATOM 0 HB3 MET A 11 -18.580 15.899 -13.001 1.00 0.00 H new ATOM 0 HG2 MET A 11 -17.402 13.401 -11.574 1.00 0.00 H new ATOM 0 HG3 MET A 11 -18.918 14.054 -10.985 1.00 0.00 H new ATOM 0 HE1 MET A 11 -17.622 12.377 -14.907 1.00 0.00 H new ATOM 0 HE2 MET A 11 -16.853 12.460 -13.304 1.00 0.00 H new ATOM 0 HE3 MET A 11 -17.966 11.126 -13.689 1.00 0.00 H new ATOM 170 N ALA A 12 -15.000 17.216 -12.590 1.00 0.00 N ATOM 171 CA ALA A 12 -14.177 18.438 -12.855 1.00 0.00 C ATOM 172 C ALA A 12 -12.784 18.117 -13.521 1.00 0.00 C ATOM 173 O ALA A 12 -12.035 19.039 -13.814 1.00 0.00 O ATOM 174 CB ALA A 12 -13.948 19.176 -11.530 1.00 0.00 C ATOM 0 H ALA A 12 -14.907 16.859 -11.639 1.00 0.00 H new ATOM 0 HA ALA A 12 -14.730 19.055 -13.563 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -13.349 20.069 -11.710 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -14.909 19.463 -11.103 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -13.423 18.521 -10.835 1.00 0.00 H new ATOM 180 N ASP A 13 -12.391 16.831 -13.681 1.00 0.00 N ATOM 181 CA ASP A 13 -10.965 16.524 -14.245 1.00 0.00 C ATOM 182 C ASP A 13 -10.921 16.231 -15.742 1.00 0.00 C ATOM 183 O ASP A 13 -9.837 16.065 -16.252 1.00 0.00 O ATOM 184 CB ASP A 13 -10.296 15.306 -13.494 1.00 0.00 C ATOM 185 CG ASP A 13 -11.287 14.346 -12.996 1.00 0.00 C ATOM 186 OD1 ASP A 13 -12.112 13.962 -13.766 1.00 0.00 O ATOM 187 OD2 ASP A 13 -11.184 13.976 -11.842 1.00 0.00 O ATOM 0 H ASP A 13 -12.959 16.013 -13.460 1.00 0.00 H new ATOM 0 HA ASP A 13 -10.412 17.447 -14.071 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -9.609 14.798 -14.171 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -9.703 15.679 -12.659 1.00 0.00 H new ATOM 192 N GLY A 14 -12.058 16.217 -16.471 1.00 0.00 N ATOM 193 CA GLY A 14 -12.041 15.942 -18.014 1.00 0.00 C ATOM 194 C GLY A 14 -10.816 15.059 -18.412 1.00 0.00 C ATOM 195 O GLY A 14 -10.133 15.308 -19.394 1.00 0.00 O ATOM 0 H GLY A 14 -12.987 16.380 -16.082 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -12.964 15.443 -18.308 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -12.003 16.887 -18.555 1.00 0.00 H new ATOM 199 N THR A 15 -10.528 14.086 -17.580 1.00 0.00 N ATOM 200 CA THR A 15 -9.348 13.185 -17.748 1.00 0.00 C ATOM 201 C THR A 15 -9.710 11.794 -17.169 1.00 0.00 C ATOM 202 O THR A 15 -9.330 10.763 -17.706 1.00 0.00 O ATOM 203 CB THR A 15 -8.180 13.850 -16.984 1.00 0.00 C ATOM 204 OG1 THR A 15 -7.627 14.891 -17.783 1.00 0.00 O ATOM 205 CG2 THR A 15 -7.124 12.845 -16.701 1.00 0.00 C ATOM 0 H THR A 15 -11.090 13.873 -16.756 1.00 0.00 H new ATOM 0 HA THR A 15 -9.063 13.041 -18.790 1.00 0.00 H new ATOM 0 HB THR A 15 -8.554 14.258 -16.045 1.00 0.00 H new ATOM 0 HG1 THR A 15 -8.244 15.106 -18.514 1.00 0.00 H new ATOM 0 HG21 THR A 15 -6.304 13.320 -16.163 1.00 0.00 H new ATOM 0 HG22 THR A 15 -7.540 12.042 -16.093 1.00 0.00 H new ATOM 0 HG23 THR A 15 -6.752 12.434 -17.640 1.00 0.00 H new ATOM 213 N CYS A 16 -10.421 11.794 -16.077 1.00 0.00 N ATOM 214 CA CYS A 16 -10.838 10.540 -15.385 1.00 0.00 C ATOM 215 C CYS A 16 -11.965 9.867 -16.180 1.00 0.00 C ATOM 216 O CYS A 16 -12.313 10.279 -17.278 1.00 0.00 O ATOM 217 CB CYS A 16 -11.350 10.984 -13.964 1.00 0.00 C ATOM 218 SG CYS A 16 -13.150 11.301 -14.002 1.00 0.00 S ATOM 0 H CYS A 16 -10.743 12.646 -15.617 1.00 0.00 H new ATOM 0 HA CYS A 16 -10.021 9.823 -15.302 1.00 0.00 H new ATOM 0 HB2 CYS A 16 -11.127 10.208 -13.232 1.00 0.00 H new ATOM 0 HB3 CYS A 16 -10.823 11.884 -13.646 1.00 0.00 H new ATOM 0 HG CYS A 16 -13.363 12.577 -14.125 1.00 0.00 H new ATOM 224 N GLN A 17 -12.525 8.845 -15.591 1.00 0.00 N ATOM 225 CA GLN A 17 -13.626 8.101 -16.201 1.00 0.00 C ATOM 226 C GLN A 17 -14.446 7.537 -15.006 1.00 0.00 C ATOM 227 O GLN A 17 -15.650 7.699 -14.911 1.00 0.00 O ATOM 228 CB GLN A 17 -12.999 7.024 -17.024 1.00 0.00 C ATOM 229 CG GLN A 17 -13.813 6.698 -18.261 1.00 0.00 C ATOM 230 CD GLN A 17 -14.363 5.250 -18.217 1.00 0.00 C ATOM 231 OE1 GLN A 17 -13.975 4.446 -17.382 1.00 0.00 O ATOM 232 NE2 GLN A 17 -15.257 4.883 -19.095 1.00 0.00 N ATOM 0 H GLN A 17 -12.241 8.495 -14.676 1.00 0.00 H new ATOM 0 HA GLN A 17 -14.282 8.685 -16.846 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -11.997 7.334 -17.322 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -12.887 6.125 -16.418 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -14.642 7.400 -18.347 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -13.194 6.826 -19.149 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -15.587 5.547 -19.795 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -15.626 3.932 -19.080 1.00 0.00 H new ATOM 241 N ASP A 18 -13.724 6.908 -14.051 1.00 0.00 N ATOM 242 CA ASP A 18 -14.344 6.355 -12.799 1.00 0.00 C ATOM 243 C ASP A 18 -13.647 6.969 -11.576 1.00 0.00 C ATOM 244 O ASP A 18 -12.784 7.823 -11.710 1.00 0.00 O ATOM 245 CB ASP A 18 -14.224 4.844 -12.781 1.00 0.00 C ATOM 246 CG ASP A 18 -15.394 4.224 -12.005 1.00 0.00 C ATOM 247 OD1 ASP A 18 -16.517 4.658 -12.205 1.00 0.00 O ATOM 248 OD2 ASP A 18 -15.145 3.319 -11.225 1.00 0.00 O ATOM 0 H ASP A 18 -12.716 6.765 -14.111 1.00 0.00 H new ATOM 0 HA ASP A 18 -15.403 6.611 -12.771 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -14.213 4.461 -13.802 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -13.279 4.553 -12.321 1.00 0.00 H new ATOM 253 N ALA A 19 -14.079 6.595 -10.386 1.00 0.00 N ATOM 254 CA ALA A 19 -13.515 7.201 -9.125 1.00 0.00 C ATOM 255 C ALA A 19 -14.018 6.449 -7.909 1.00 0.00 C ATOM 256 O ALA A 19 -15.227 6.287 -7.792 1.00 0.00 O ATOM 257 CB ALA A 19 -14.060 8.554 -9.069 1.00 0.00 C ATOM 0 H ALA A 19 -14.802 5.892 -10.233 1.00 0.00 H new ATOM 0 HA ALA A 19 -12.425 7.172 -9.130 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -13.692 9.058 -8.175 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -13.747 9.109 -9.953 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -15.148 8.507 -9.037 1.00 0.00 H new ATOM 263 N ALA A 20 -13.166 5.993 -6.965 1.00 0.00 N ATOM 264 CA ALA A 20 -13.780 5.297 -5.786 1.00 0.00 C ATOM 265 C ALA A 20 -13.091 5.525 -4.466 1.00 0.00 C ATOM 266 O ALA A 20 -12.066 4.928 -4.153 1.00 0.00 O ATOM 267 CB ALA A 20 -13.872 3.840 -6.034 1.00 0.00 C ATOM 0 H ALA A 20 -12.149 6.074 -6.974 1.00 0.00 H new ATOM 0 HA ALA A 20 -14.767 5.749 -5.692 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -14.320 3.351 -5.169 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -14.490 3.659 -6.913 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -12.874 3.436 -6.203 1.00 0.00 H new ATOM 273 N ILE A 21 -13.763 6.283 -3.631 1.00 0.00 N ATOM 274 CA ILE A 21 -13.317 6.477 -2.241 1.00 0.00 C ATOM 275 C ILE A 21 -13.884 5.244 -1.563 1.00 0.00 C ATOM 276 O ILE A 21 -15.072 4.974 -1.702 1.00 0.00 O ATOM 277 CB ILE A 21 -13.918 7.755 -1.665 1.00 0.00 C ATOM 278 CG1 ILE A 21 -13.320 8.947 -2.443 1.00 0.00 C ATOM 279 CG2 ILE A 21 -13.586 7.857 -0.149 1.00 0.00 C ATOM 280 CD1 ILE A 21 -13.720 10.260 -1.796 1.00 0.00 C ATOM 0 H ILE A 21 -14.620 6.781 -3.874 1.00 0.00 H new ATOM 0 HA ILE A 21 -12.239 6.584 -2.121 1.00 0.00 H new ATOM 0 HB ILE A 21 -15.003 7.755 -1.767 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -12.233 8.864 -2.468 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -13.666 8.924 -3.477 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -14.018 8.772 0.257 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -14.003 6.996 0.373 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -12.505 7.875 -0.014 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -13.289 11.089 -2.358 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -14.806 10.349 -1.794 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -13.352 10.287 -0.770 1.00 0.00 H new ATOM 292 N VAL A 22 -13.070 4.436 -0.933 1.00 0.00 N ATOM 293 CA VAL A 22 -13.600 3.158 -0.371 1.00 0.00 C ATOM 294 C VAL A 22 -13.176 2.943 1.072 1.00 0.00 C ATOM 295 O VAL A 22 -12.005 2.844 1.349 1.00 0.00 O ATOM 296 CB VAL A 22 -13.018 1.980 -1.215 1.00 0.00 C ATOM 297 CG1 VAL A 22 -13.580 0.628 -0.728 1.00 0.00 C ATOM 298 CG2 VAL A 22 -13.365 2.168 -2.707 1.00 0.00 C ATOM 0 H VAL A 22 -12.075 4.602 -0.785 1.00 0.00 H new ATOM 0 HA VAL A 22 -14.689 3.201 -0.407 1.00 0.00 H new ATOM 0 HB VAL A 22 -11.935 1.980 -1.090 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -13.161 -0.178 -1.330 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -13.311 0.478 0.318 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -14.665 0.628 -0.827 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -12.953 1.340 -3.284 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -14.448 2.192 -2.829 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -12.939 3.106 -3.064 1.00 0.00 H new ATOM 308 N GLY A 23 -14.140 2.785 1.974 1.00 0.00 N ATOM 309 CA GLY A 23 -13.809 2.459 3.405 1.00 0.00 C ATOM 310 C GLY A 23 -13.372 0.979 3.402 1.00 0.00 C ATOM 311 O GLY A 23 -14.151 0.087 3.633 1.00 0.00 O ATOM 0 H GLY A 23 -15.137 2.869 1.773 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -13.013 3.102 3.780 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -14.673 2.612 4.052 1.00 0.00 H new ATOM 315 N TYR A 24 -12.127 0.760 3.070 1.00 0.00 N ATOM 316 CA TYR A 24 -11.515 -0.613 2.932 1.00 0.00 C ATOM 317 C TYR A 24 -11.150 -1.246 4.325 1.00 0.00 C ATOM 318 O TYR A 24 -10.235 -2.061 4.405 1.00 0.00 O ATOM 319 CB TYR A 24 -10.228 -0.400 2.071 1.00 0.00 C ATOM 320 CG TYR A 24 -9.048 -0.053 2.988 1.00 0.00 C ATOM 321 CD1 TYR A 24 -9.066 1.110 3.762 1.00 0.00 C ATOM 322 CD2 TYR A 24 -7.982 -0.924 3.081 1.00 0.00 C ATOM 323 CE1 TYR A 24 -7.997 1.390 4.623 1.00 0.00 C ATOM 324 CE2 TYR A 24 -6.912 -0.649 3.935 1.00 0.00 C ATOM 325 CZ TYR A 24 -6.920 0.509 4.705 1.00 0.00 C ATOM 326 OH TYR A 24 -5.867 0.781 5.554 1.00 0.00 O ATOM 0 H TYR A 24 -11.468 1.515 2.877 1.00 0.00 H new ATOM 0 HA TYR A 24 -12.217 -1.308 2.472 1.00 0.00 H new ATOM 0 HB2 TYR A 24 -10.006 -1.302 1.501 1.00 0.00 H new ATOM 0 HB3 TYR A 24 -10.389 0.401 1.350 1.00 0.00 H new ATOM 0 HD1 TYR A 24 -9.902 1.791 3.697 1.00 0.00 H new ATOM 0 HD2 TYR A 24 -7.975 -1.827 2.488 1.00 0.00 H new ATOM 0 HE1 TYR A 24 -8.007 2.288 5.223 1.00 0.00 H new ATOM 0 HE2 TYR A 24 -6.080 -1.334 3.997 1.00 0.00 H new ATOM 0 HH TYR A 24 -6.019 1.641 5.999 1.00 0.00 H new ATOM 336 N LYS A 25 -11.834 -0.869 5.392 1.00 0.00 N ATOM 337 CA LYS A 25 -11.522 -1.416 6.738 1.00 0.00 C ATOM 338 C LYS A 25 -11.777 -2.925 6.723 1.00 0.00 C ATOM 339 O LYS A 25 -11.800 -3.542 5.664 1.00 0.00 O ATOM 340 CB LYS A 25 -12.406 -0.720 7.766 1.00 0.00 C ATOM 341 CG LYS A 25 -11.883 0.699 8.014 1.00 0.00 C ATOM 342 CD LYS A 25 -12.302 1.584 6.873 1.00 0.00 C ATOM 343 CE LYS A 25 -12.399 3.025 7.360 1.00 0.00 C ATOM 344 NZ LYS A 25 -13.451 3.136 8.412 1.00 0.00 N ATOM 0 H LYS A 25 -12.601 -0.197 5.373 1.00 0.00 H new ATOM 0 HA LYS A 25 -10.479 -1.240 7.001 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -13.435 -0.682 7.410 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -12.412 -1.285 8.698 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -12.276 1.086 8.954 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -10.797 0.689 8.103 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -11.581 1.511 6.058 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -13.264 1.256 6.478 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -11.438 3.349 7.759 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -12.636 3.685 6.525 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -14.008 4.001 8.256 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -14.078 2.307 8.365 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -13.002 3.177 9.349 1.00 0.00 H new ATOM 358 N ASP A 26 -11.984 -3.523 7.881 1.00 0.00 N ATOM 359 CA ASP A 26 -12.273 -5.027 7.964 1.00 0.00 C ATOM 360 C ASP A 26 -13.334 -5.377 6.929 1.00 0.00 C ATOM 361 O ASP A 26 -13.121 -6.196 6.043 1.00 0.00 O ATOM 362 CB ASP A 26 -12.800 -5.418 9.356 1.00 0.00 C ATOM 363 CG ASP A 26 -13.619 -4.280 9.998 1.00 0.00 C ATOM 364 OD1 ASP A 26 -13.016 -3.409 10.603 1.00 0.00 O ATOM 365 OD2 ASP A 26 -14.833 -4.315 9.886 1.00 0.00 O ATOM 0 H ASP A 26 -11.968 -3.045 8.782 1.00 0.00 H new ATOM 0 HA ASP A 26 -11.346 -5.569 7.778 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -13.421 -6.310 9.272 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -11.961 -5.673 10.004 1.00 0.00 H new ATOM 370 N SER A 27 -14.450 -4.703 7.019 1.00 0.00 N ATOM 371 CA SER A 27 -15.544 -4.876 6.064 1.00 0.00 C ATOM 372 C SER A 27 -15.461 -3.675 5.120 1.00 0.00 C ATOM 373 O SER A 27 -15.684 -2.555 5.554 1.00 0.00 O ATOM 374 CB SER A 27 -16.868 -4.877 6.811 1.00 0.00 C ATOM 375 OG SER A 27 -16.858 -3.866 7.817 1.00 0.00 O ATOM 0 H SER A 27 -14.639 -4.017 7.750 1.00 0.00 H new ATOM 0 HA SER A 27 -15.473 -5.815 5.515 1.00 0.00 H new ATOM 0 HB2 SER A 27 -17.688 -4.702 6.115 1.00 0.00 H new ATOM 0 HB3 SER A 27 -17.038 -5.853 7.265 1.00 0.00 H new ATOM 0 HG SER A 27 -16.464 -3.046 7.453 1.00 0.00 H new ATOM 381 N PRO A 28 -15.079 -3.917 3.857 1.00 0.00 N ATOM 382 CA PRO A 28 -14.897 -2.849 2.899 1.00 0.00 C ATOM 383 C PRO A 28 -16.219 -2.323 2.412 1.00 0.00 C ATOM 384 O PRO A 28 -17.239 -3.003 2.475 1.00 0.00 O ATOM 385 CB PRO A 28 -14.088 -3.481 1.776 1.00 0.00 C ATOM 386 CG PRO A 28 -14.307 -5.000 1.901 1.00 0.00 C ATOM 387 CD PRO A 28 -14.830 -5.259 3.302 1.00 0.00 C ATOM 0 HA PRO A 28 -14.389 -1.985 3.328 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -14.420 -3.117 0.803 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -13.031 -3.230 1.867 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -15.018 -5.350 1.153 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -13.375 -5.539 1.731 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -15.742 -5.855 3.281 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -14.104 -5.808 3.902 1.00 0.00 H new ATOM 395 N SER A 29 -16.204 -1.106 1.931 1.00 0.00 N ATOM 396 CA SER A 29 -17.423 -0.470 1.427 1.00 0.00 C ATOM 397 C SER A 29 -17.032 0.711 0.582 1.00 0.00 C ATOM 398 O SER A 29 -15.891 1.145 0.595 1.00 0.00 O ATOM 399 CB SER A 29 -18.289 -0.012 2.593 1.00 0.00 C ATOM 400 OG SER A 29 -17.493 0.742 3.498 1.00 0.00 O ATOM 0 H SER A 29 -15.368 -0.525 1.872 1.00 0.00 H new ATOM 0 HA SER A 29 -17.994 -1.181 0.830 1.00 0.00 H new ATOM 0 HB2 SER A 29 -19.119 0.593 2.229 1.00 0.00 H new ATOM 0 HB3 SER A 29 -18.721 -0.874 3.101 1.00 0.00 H new ATOM 0 HG SER A 29 -18.046 1.041 4.250 1.00 0.00 H new ATOM 406 N VAL A 30 -17.955 1.218 -0.165 1.00 0.00 N ATOM 407 CA VAL A 30 -17.677 2.350 -1.041 1.00 0.00 C ATOM 408 C VAL A 30 -18.144 3.637 -0.358 1.00 0.00 C ATOM 409 O VAL A 30 -19.328 3.941 -0.312 1.00 0.00 O ATOM 410 CB VAL A 30 -18.397 2.080 -2.353 1.00 0.00 C ATOM 411 CG1 VAL A 30 -18.400 3.326 -3.228 1.00 0.00 C ATOM 412 CG2 VAL A 30 -17.657 0.927 -3.069 1.00 0.00 C ATOM 0 H VAL A 30 -18.916 0.879 -0.200 1.00 0.00 H new ATOM 0 HA VAL A 30 -16.613 2.474 -1.243 1.00 0.00 H new ATOM 0 HB VAL A 30 -19.435 1.807 -2.162 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -18.920 3.113 -4.162 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -18.909 4.136 -2.706 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -17.373 3.622 -3.443 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -18.151 0.710 -4.016 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -16.624 1.219 -3.258 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -17.673 0.038 -2.439 1.00 0.00 H new ATOM 422 N TRP A 31 -17.197 4.386 0.175 1.00 0.00 N ATOM 423 CA TRP A 31 -17.515 5.656 0.873 1.00 0.00 C ATOM 424 C TRP A 31 -17.994 6.692 -0.138 1.00 0.00 C ATOM 425 O TRP A 31 -18.696 7.629 0.217 1.00 0.00 O ATOM 426 CB TRP A 31 -16.250 6.137 1.613 1.00 0.00 C ATOM 427 CG TRP A 31 -16.159 5.437 2.955 1.00 0.00 C ATOM 428 CD1 TRP A 31 -16.932 4.383 3.341 1.00 0.00 C ATOM 429 CD2 TRP A 31 -15.279 5.714 4.085 1.00 0.00 C ATOM 430 NE1 TRP A 31 -16.602 4.023 4.608 1.00 0.00 N ATOM 431 CE2 TRP A 31 -15.591 4.807 5.122 1.00 0.00 C ATOM 432 CE3 TRP A 31 -14.256 6.657 4.318 1.00 0.00 C ATOM 433 CZ2 TRP A 31 -14.928 4.831 6.338 1.00 0.00 C ATOM 434 CZ3 TRP A 31 -13.584 6.681 5.551 1.00 0.00 C ATOM 435 CH2 TRP A 31 -13.924 5.774 6.558 1.00 0.00 C ATOM 0 H TRP A 31 -16.204 4.155 0.148 1.00 0.00 H new ATOM 0 HA TRP A 31 -18.314 5.506 1.599 1.00 0.00 H new ATOM 0 HB2 TRP A 31 -15.363 5.923 1.017 1.00 0.00 H new ATOM 0 HB3 TRP A 31 -16.286 7.217 1.755 1.00 0.00 H new ATOM 0 HD1 TRP A 31 -17.689 3.908 2.734 1.00 0.00 H new ATOM 0 HE1 TRP A 31 -17.049 3.262 5.119 1.00 0.00 H new ATOM 0 HE3 TRP A 31 -13.989 7.363 3.546 1.00 0.00 H new ATOM 0 HZ2 TRP A 31 -15.187 4.123 7.112 1.00 0.00 H new ATOM 0 HZ3 TRP A 31 -12.800 7.404 5.722 1.00 0.00 H new ATOM 0 HH2 TRP A 31 -13.409 5.803 7.507 1.00 0.00 H new ATOM 446 N ALA A 32 -17.648 6.514 -1.408 1.00 0.00 N ATOM 447 CA ALA A 32 -18.117 7.475 -2.475 1.00 0.00 C ATOM 448 C ALA A 32 -17.489 7.127 -3.836 1.00 0.00 C ATOM 449 O ALA A 32 -16.471 7.685 -4.226 1.00 0.00 O ATOM 450 CB ALA A 32 -17.740 8.912 -2.089 1.00 0.00 C ATOM 0 H ALA A 32 -17.065 5.748 -1.746 1.00 0.00 H new ATOM 0 HA ALA A 32 -19.201 7.392 -2.557 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -18.082 9.598 -2.864 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -18.213 9.170 -1.141 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -16.657 8.989 -1.988 1.00 0.00 H new ATOM 456 N ALA A 33 -18.118 6.227 -4.578 1.00 0.00 N ATOM 457 CA ALA A 33 -17.605 5.852 -5.922 1.00 0.00 C ATOM 458 C ALA A 33 -18.652 6.213 -6.939 1.00 0.00 C ATOM 459 O ALA A 33 -19.827 5.950 -6.733 1.00 0.00 O ATOM 460 CB ALA A 33 -17.356 4.343 -6.004 1.00 0.00 C ATOM 0 H ALA A 33 -18.969 5.741 -4.295 1.00 0.00 H new ATOM 0 HA ALA A 33 -16.668 6.377 -6.108 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -16.981 4.089 -6.996 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -16.621 4.054 -5.253 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -18.289 3.810 -5.822 1.00 0.00 H new ATOM 466 N VAL A 34 -18.243 6.793 -8.053 1.00 0.00 N ATOM 467 CA VAL A 34 -19.232 7.162 -9.147 1.00 0.00 C ATOM 468 C VAL A 34 -20.116 5.893 -9.426 1.00 0.00 C ATOM 469 O VAL A 34 -19.629 4.934 -9.996 1.00 0.00 O ATOM 470 CB VAL A 34 -18.460 7.594 -10.419 1.00 0.00 C ATOM 471 CG1 VAL A 34 -19.450 8.056 -11.486 1.00 0.00 C ATOM 472 CG2 VAL A 34 -17.531 8.768 -10.074 1.00 0.00 C ATOM 0 H VAL A 34 -17.272 7.028 -8.257 1.00 0.00 H new ATOM 0 HA VAL A 34 -19.866 7.996 -8.846 1.00 0.00 H new ATOM 0 HB VAL A 34 -17.879 6.750 -10.791 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -18.906 8.360 -12.380 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -20.127 7.238 -11.733 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -20.025 8.901 -11.107 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -16.986 9.075 -10.967 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -18.124 9.605 -9.705 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -16.823 8.458 -9.305 1.00 0.00 H new ATOM 482 N PRO A 35 -21.381 5.902 -8.927 1.00 0.00 N ATOM 483 CA PRO A 35 -22.280 4.730 -9.038 1.00 0.00 C ATOM 484 C PRO A 35 -22.746 4.477 -10.465 1.00 0.00 C ATOM 485 O PRO A 35 -22.861 5.388 -11.272 1.00 0.00 O ATOM 486 CB PRO A 35 -23.460 5.075 -8.116 1.00 0.00 C ATOM 487 CG PRO A 35 -23.454 6.617 -7.963 1.00 0.00 C ATOM 488 CD PRO A 35 -22.009 7.071 -8.257 1.00 0.00 C ATOM 0 HA PRO A 35 -21.773 3.808 -8.753 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -24.402 4.730 -8.543 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -23.352 4.587 -7.147 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -24.156 7.080 -8.656 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -23.758 6.910 -6.958 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -21.992 7.952 -8.898 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -21.481 7.334 -7.340 1.00 0.00 H new ATOM 496 N GLY A 36 -23.013 3.211 -10.768 1.00 0.00 N ATOM 497 CA GLY A 36 -23.470 2.819 -12.132 1.00 0.00 C ATOM 498 C GLY A 36 -22.271 2.346 -12.967 1.00 0.00 C ATOM 499 O GLY A 36 -22.445 1.716 -14.001 1.00 0.00 O ATOM 0 H GLY A 36 -22.928 2.436 -10.111 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -24.212 2.024 -12.062 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -23.954 3.665 -12.620 1.00 0.00 H new ATOM 503 N LYS A 37 -21.046 2.680 -12.542 1.00 0.00 N ATOM 504 CA LYS A 37 -19.831 2.290 -13.325 1.00 0.00 C ATOM 505 C LYS A 37 -19.309 0.890 -12.938 1.00 0.00 C ATOM 506 O LYS A 37 -19.573 -0.075 -13.648 1.00 0.00 O ATOM 507 CB LYS A 37 -18.740 3.345 -13.108 1.00 0.00 C ATOM 508 CG LYS A 37 -19.283 4.743 -13.493 1.00 0.00 C ATOM 509 CD LYS A 37 -19.789 4.732 -14.947 1.00 0.00 C ATOM 510 CE LYS A 37 -20.212 6.141 -15.355 1.00 0.00 C ATOM 511 NZ LYS A 37 -19.012 7.022 -15.408 1.00 0.00 N ATOM 0 H LYS A 37 -20.855 3.204 -11.688 1.00 0.00 H new ATOM 0 HA LYS A 37 -20.105 2.242 -14.379 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -18.420 3.343 -12.066 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -17.864 3.106 -13.711 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -20.093 5.025 -12.820 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -18.498 5.491 -13.378 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -19.005 4.370 -15.612 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -20.631 4.047 -15.044 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -20.703 6.118 -16.328 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -20.936 6.536 -14.642 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -19.208 7.840 -16.020 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -18.782 7.354 -14.449 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -18.206 6.488 -15.792 1.00 0.00 H new ATOM 525 N THR A 38 -18.531 0.762 -11.850 1.00 0.00 N ATOM 526 CA THR A 38 -17.966 -0.597 -11.490 1.00 0.00 C ATOM 527 C THR A 38 -17.326 -0.590 -10.072 1.00 0.00 C ATOM 528 O THR A 38 -17.449 -1.553 -9.329 1.00 0.00 O ATOM 529 CB THR A 38 -16.906 -0.951 -12.586 1.00 0.00 C ATOM 530 OG1 THR A 38 -17.566 -1.542 -13.694 1.00 0.00 O ATOM 531 CG2 THR A 38 -15.817 -1.928 -12.070 1.00 0.00 C ATOM 0 H THR A 38 -18.276 1.523 -11.220 1.00 0.00 H new ATOM 0 HA THR A 38 -18.759 -1.345 -11.461 1.00 0.00 H new ATOM 0 HB THR A 38 -16.408 -0.024 -12.871 1.00 0.00 H new ATOM 0 HG1 THR A 38 -18.512 -1.286 -13.686 1.00 0.00 H new ATOM 0 HG21 THR A 38 -15.109 -2.139 -12.871 1.00 0.00 H new ATOM 0 HG22 THR A 38 -15.291 -1.475 -11.230 1.00 0.00 H new ATOM 0 HG23 THR A 38 -16.286 -2.857 -11.746 1.00 0.00 H new ATOM 539 N PHE A 39 -16.616 0.459 -9.736 1.00 0.00 N ATOM 540 CA PHE A 39 -15.902 0.540 -8.405 1.00 0.00 C ATOM 541 C PHE A 39 -16.841 0.446 -7.232 1.00 0.00 C ATOM 542 O PHE A 39 -16.534 -0.185 -6.251 1.00 0.00 O ATOM 543 CB PHE A 39 -15.204 1.864 -8.311 1.00 0.00 C ATOM 544 CG PHE A 39 -13.947 1.911 -9.184 1.00 0.00 C ATOM 545 CD1 PHE A 39 -13.644 0.872 -10.083 1.00 0.00 C ATOM 546 CD2 PHE A 39 -13.068 3.000 -9.067 1.00 0.00 C ATOM 547 CE1 PHE A 39 -12.503 0.925 -10.837 1.00 0.00 C ATOM 548 CE2 PHE A 39 -11.912 3.042 -9.828 1.00 0.00 C ATOM 549 CZ PHE A 39 -11.633 2.000 -10.714 1.00 0.00 C ATOM 0 H PHE A 39 -16.494 1.279 -10.331 1.00 0.00 H new ATOM 0 HA PHE A 39 -15.210 -0.301 -8.363 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -15.887 2.657 -8.616 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -14.933 2.058 -7.273 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -14.314 0.030 -10.178 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -13.294 3.805 -8.383 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -12.279 0.128 -11.530 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -11.231 3.875 -9.737 1.00 0.00 H new ATOM 0 HZ PHE A 39 -10.732 2.030 -11.309 1.00 0.00 H new ATOM 559 N VAL A 40 -17.959 1.108 -7.320 1.00 0.00 N ATOM 560 CA VAL A 40 -18.964 1.124 -6.204 1.00 0.00 C ATOM 561 C VAL A 40 -19.358 -0.322 -5.846 1.00 0.00 C ATOM 562 O VAL A 40 -19.819 -0.591 -4.739 1.00 0.00 O ATOM 563 CB VAL A 40 -20.191 1.957 -6.634 1.00 0.00 C ATOM 564 CG1 VAL A 40 -20.620 1.555 -8.042 1.00 0.00 C ATOM 565 CG2 VAL A 40 -21.342 1.744 -5.641 1.00 0.00 C ATOM 0 H VAL A 40 -18.231 1.655 -8.137 1.00 0.00 H new ATOM 0 HA VAL A 40 -18.535 1.586 -5.315 1.00 0.00 H new ATOM 0 HB VAL A 40 -19.926 3.014 -6.637 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -21.486 2.145 -8.341 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -19.800 1.735 -8.738 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -20.881 0.497 -8.055 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -22.204 2.335 -5.951 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -21.614 0.689 -5.620 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -21.027 2.057 -4.646 1.00 0.00 H new ATOM 575 N ASN A 41 -19.146 -1.253 -6.757 1.00 0.00 N ATOM 576 CA ASN A 41 -19.452 -2.656 -6.484 1.00 0.00 C ATOM 577 C ASN A 41 -18.177 -3.319 -5.915 1.00 0.00 C ATOM 578 O ASN A 41 -17.958 -4.515 -6.085 1.00 0.00 O ATOM 579 CB ASN A 41 -19.858 -3.315 -7.793 1.00 0.00 C ATOM 580 CG ASN A 41 -21.208 -2.756 -8.246 1.00 0.00 C ATOM 581 OD1 ASN A 41 -21.356 -2.333 -9.376 1.00 0.00 O ATOM 582 ND2 ASN A 41 -22.205 -2.734 -7.406 1.00 0.00 N ATOM 0 H ASN A 41 -18.767 -1.072 -7.686 1.00 0.00 H new ATOM 0 HA ASN A 41 -20.264 -2.759 -5.765 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -19.101 -3.131 -8.556 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -19.924 -4.395 -7.664 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -23.109 -2.362 -7.697 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -22.081 -3.089 -6.458 1.00 0.00 H new ATOM 589 N ILE A 42 -17.319 -2.527 -5.235 1.00 0.00 N ATOM 590 CA ILE A 42 -16.071 -3.063 -4.662 1.00 0.00 C ATOM 591 C ILE A 42 -16.407 -3.938 -3.428 1.00 0.00 C ATOM 592 O ILE A 42 -17.396 -3.747 -2.738 1.00 0.00 O ATOM 593 CB ILE A 42 -15.105 -1.873 -4.324 1.00 0.00 C ATOM 594 CG1 ILE A 42 -14.225 -1.603 -5.563 1.00 0.00 C ATOM 595 CG2 ILE A 42 -14.191 -2.192 -3.117 1.00 0.00 C ATOM 596 CD1 ILE A 42 -13.729 -0.149 -5.567 1.00 0.00 C ATOM 0 H ILE A 42 -17.466 -1.531 -5.073 1.00 0.00 H new ATOM 0 HA ILE A 42 -15.556 -3.703 -5.378 1.00 0.00 H new ATOM 0 HB ILE A 42 -15.706 -1.003 -4.062 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -13.373 -2.283 -5.566 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -14.795 -1.801 -6.471 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -13.540 -1.341 -2.919 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -14.805 -2.391 -2.239 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -13.584 -3.069 -3.342 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -13.110 0.022 -6.448 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -14.584 0.527 -5.587 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -13.140 0.037 -4.669 1.00 0.00 H new ATOM 608 N THR A 43 -15.577 -4.895 -3.219 1.00 0.00 N ATOM 609 CA THR A 43 -15.706 -5.899 -2.116 1.00 0.00 C ATOM 610 C THR A 43 -14.294 -6.134 -1.510 1.00 0.00 C ATOM 611 O THR A 43 -13.346 -5.580 -2.015 1.00 0.00 O ATOM 612 CB THR A 43 -16.217 -7.184 -2.792 1.00 0.00 C ATOM 613 OG1 THR A 43 -15.479 -7.420 -3.984 1.00 0.00 O ATOM 614 CG2 THR A 43 -17.694 -7.011 -3.146 1.00 0.00 C ATOM 0 H THR A 43 -14.753 -5.044 -3.801 1.00 0.00 H new ATOM 0 HA THR A 43 -16.378 -5.579 -1.319 1.00 0.00 H new ATOM 0 HB THR A 43 -16.093 -8.027 -2.112 1.00 0.00 H new ATOM 0 HG1 THR A 43 -16.091 -7.444 -4.749 1.00 0.00 H new ATOM 0 HG21 THR A 43 -18.062 -7.918 -3.625 1.00 0.00 H new ATOM 0 HG22 THR A 43 -18.266 -6.823 -2.238 1.00 0.00 H new ATOM 0 HG23 THR A 43 -17.808 -6.168 -3.828 1.00 0.00 H new ATOM 622 N PRO A 44 -14.166 -6.986 -0.457 1.00 0.00 N ATOM 623 CA PRO A 44 -12.835 -7.283 0.142 1.00 0.00 C ATOM 624 C PRO A 44 -11.938 -8.118 -0.789 1.00 0.00 C ATOM 625 O PRO A 44 -10.812 -8.449 -0.441 1.00 0.00 O ATOM 626 CB PRO A 44 -13.150 -8.020 1.416 1.00 0.00 C ATOM 627 CG PRO A 44 -14.589 -8.587 1.265 1.00 0.00 C ATOM 628 CD PRO A 44 -15.290 -7.705 0.207 1.00 0.00 C ATOM 0 HA PRO A 44 -12.265 -6.371 0.318 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -12.434 -8.824 1.584 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -13.086 -7.352 2.275 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -14.565 -9.630 0.949 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -15.122 -8.554 2.215 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -15.856 -8.307 -0.504 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -15.993 -7.011 0.667 1.00 0.00 H new ATOM 636 N ALA A 45 -12.421 -8.418 -1.960 1.00 0.00 N ATOM 637 CA ALA A 45 -11.628 -9.183 -2.964 1.00 0.00 C ATOM 638 C ALA A 45 -10.809 -8.182 -3.758 1.00 0.00 C ATOM 639 O ALA A 45 -9.570 -8.122 -3.669 1.00 0.00 O ATOM 640 CB ALA A 45 -12.592 -9.908 -3.896 1.00 0.00 C ATOM 0 H ALA A 45 -13.357 -8.159 -2.272 1.00 0.00 H new ATOM 0 HA ALA A 45 -10.975 -9.911 -2.482 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -12.026 -10.473 -4.637 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -13.214 -10.591 -3.317 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -13.226 -9.180 -4.402 1.00 0.00 H new ATOM 646 N GLU A 46 -11.507 -7.364 -4.507 1.00 0.00 N ATOM 647 CA GLU A 46 -10.821 -6.278 -5.330 1.00 0.00 C ATOM 648 C GLU A 46 -9.992 -5.406 -4.385 1.00 0.00 C ATOM 649 O GLU A 46 -8.874 -4.999 -4.701 1.00 0.00 O ATOM 650 CB GLU A 46 -11.846 -5.405 -6.127 1.00 0.00 C ATOM 651 CG GLU A 46 -13.183 -5.321 -5.420 1.00 0.00 C ATOM 652 CD GLU A 46 -14.179 -6.279 -6.088 1.00 0.00 C ATOM 653 OE1 GLU A 46 -13.845 -7.443 -6.240 1.00 0.00 O ATOM 654 OE2 GLU A 46 -15.257 -5.830 -6.435 1.00 0.00 O ATOM 0 H GLU A 46 -12.523 -7.389 -4.594 1.00 0.00 H new ATOM 0 HA GLU A 46 -10.178 -6.754 -6.070 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -11.442 -4.402 -6.261 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -11.987 -5.827 -7.122 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -13.066 -5.578 -4.367 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -13.563 -4.300 -5.459 1.00 0.00 H new ATOM 661 N VAL A 47 -10.515 -5.189 -3.206 1.00 0.00 N ATOM 662 CA VAL A 47 -9.804 -4.432 -2.160 1.00 0.00 C ATOM 663 C VAL A 47 -8.776 -5.343 -1.478 1.00 0.00 C ATOM 664 O VAL A 47 -7.752 -4.886 -1.038 1.00 0.00 O ATOM 665 CB VAL A 47 -10.877 -3.817 -1.209 1.00 0.00 C ATOM 666 CG1 VAL A 47 -10.451 -3.747 0.224 1.00 0.00 C ATOM 667 CG2 VAL A 47 -11.077 -2.359 -1.611 1.00 0.00 C ATOM 0 H VAL A 47 -11.438 -5.521 -2.927 1.00 0.00 H new ATOM 0 HA VAL A 47 -9.222 -3.602 -2.561 1.00 0.00 H new ATOM 0 HB VAL A 47 -11.757 -4.454 -1.297 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -11.251 -3.308 0.820 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -10.235 -4.751 0.589 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -9.556 -3.131 0.308 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -11.824 -1.902 -0.962 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -10.134 -1.822 -1.513 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -11.417 -2.310 -2.646 1.00 0.00 H new ATOM 677 N GLY A 48 -9.042 -6.630 -1.418 1.00 0.00 N ATOM 678 CA GLY A 48 -8.074 -7.600 -0.778 1.00 0.00 C ATOM 679 C GLY A 48 -6.669 -7.425 -1.358 1.00 0.00 C ATOM 680 O GLY A 48 -5.681 -7.646 -0.678 1.00 0.00 O ATOM 0 H GLY A 48 -9.892 -7.058 -1.786 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -8.050 -7.440 0.300 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -8.415 -8.622 -0.941 1.00 0.00 H new ATOM 684 N VAL A 49 -6.586 -7.042 -2.610 1.00 0.00 N ATOM 685 CA VAL A 49 -5.228 -6.846 -3.278 1.00 0.00 C ATOM 686 C VAL A 49 -4.849 -5.367 -3.289 1.00 0.00 C ATOM 687 O VAL A 49 -3.683 -5.015 -3.138 1.00 0.00 O ATOM 688 CB VAL A 49 -5.234 -7.407 -4.715 1.00 0.00 C ATOM 689 CG1 VAL A 49 -6.193 -6.610 -5.598 1.00 0.00 C ATOM 690 CG2 VAL A 49 -3.816 -7.312 -5.299 1.00 0.00 C ATOM 0 H VAL A 49 -7.389 -6.853 -3.209 1.00 0.00 H new ATOM 0 HA VAL A 49 -4.484 -7.395 -2.701 1.00 0.00 H new ATOM 0 HB VAL A 49 -5.562 -8.446 -4.686 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -6.184 -7.020 -6.608 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -7.202 -6.674 -5.190 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -5.879 -5.567 -5.627 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -3.814 -7.707 -6.315 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -3.498 -6.270 -5.314 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -3.129 -7.892 -4.683 1.00 0.00 H new ATOM 700 N LEU A 50 -5.828 -4.509 -3.419 1.00 0.00 N ATOM 701 CA LEU A 50 -5.581 -3.044 -3.390 1.00 0.00 C ATOM 702 C LEU A 50 -5.086 -2.623 -2.006 1.00 0.00 C ATOM 703 O LEU A 50 -4.647 -1.494 -1.819 1.00 0.00 O ATOM 704 CB LEU A 50 -6.907 -2.340 -3.630 1.00 0.00 C ATOM 705 CG LEU A 50 -7.181 -2.022 -5.082 1.00 0.00 C ATOM 706 CD1 LEU A 50 -8.696 -1.775 -5.236 1.00 0.00 C ATOM 707 CD2 LEU A 50 -6.444 -0.738 -5.454 1.00 0.00 C ATOM 0 H LEU A 50 -6.805 -4.772 -3.546 1.00 0.00 H new ATOM 0 HA LEU A 50 -4.839 -2.787 -4.146 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -7.713 -2.966 -3.248 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -6.923 -1.413 -3.056 1.00 0.00 H new ATOM 0 HG LEU A 50 -6.852 -2.841 -5.721 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -8.923 -1.543 -6.277 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -9.243 -2.669 -4.936 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -8.994 -0.938 -4.604 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -6.635 -0.499 -6.500 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -6.797 0.079 -4.825 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -5.373 -0.876 -5.303 1.00 0.00 H new ATOM 719 N VAL A 51 -5.245 -3.490 -1.018 1.00 0.00 N ATOM 720 CA VAL A 51 -4.890 -3.109 0.391 1.00 0.00 C ATOM 721 C VAL A 51 -4.310 -4.298 1.215 1.00 0.00 C ATOM 722 O VAL A 51 -3.808 -4.097 2.309 1.00 0.00 O ATOM 723 CB VAL A 51 -6.213 -2.601 1.048 1.00 0.00 C ATOM 724 CG1 VAL A 51 -6.914 -1.608 0.112 1.00 0.00 C ATOM 725 CG2 VAL A 51 -7.165 -3.798 1.334 1.00 0.00 C ATOM 0 H VAL A 51 -5.604 -4.438 -1.131 1.00 0.00 H new ATOM 0 HA VAL A 51 -4.108 -2.349 0.379 1.00 0.00 H new ATOM 0 HB VAL A 51 -5.967 -2.105 1.987 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -7.836 -1.258 0.577 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -6.257 -0.759 -0.075 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -7.148 -2.101 -0.832 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -8.084 -3.431 1.792 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -7.403 -4.305 0.399 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -6.676 -4.498 2.012 1.00 0.00 H new ATOM 735 N GLY A 52 -4.437 -5.516 0.720 1.00 0.00 N ATOM 736 CA GLY A 52 -3.954 -6.734 1.495 1.00 0.00 C ATOM 737 C GLY A 52 -2.449 -6.666 1.839 1.00 0.00 C ATOM 738 O GLY A 52 -1.940 -5.678 2.338 1.00 0.00 O ATOM 0 H GLY A 52 -4.854 -5.726 -0.187 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -4.529 -6.824 2.417 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -4.148 -7.632 0.909 1.00 0.00 H new ATOM 822 N PHE A 58 1.214 -8.588 -6.734 1.00 0.00 N ATOM 823 CA PHE A 58 0.380 -7.894 -7.808 1.00 0.00 C ATOM 824 C PHE A 58 1.105 -6.802 -8.622 1.00 0.00 C ATOM 825 O PHE A 58 0.618 -6.452 -9.685 1.00 0.00 O ATOM 826 CB PHE A 58 -0.935 -7.328 -7.204 1.00 0.00 C ATOM 827 CG PHE A 58 -0.695 -6.128 -6.312 1.00 0.00 C ATOM 828 CD1 PHE A 58 -0.247 -4.915 -6.853 1.00 0.00 C ATOM 829 CD2 PHE A 58 -0.971 -6.213 -4.947 1.00 0.00 C ATOM 830 CE1 PHE A 58 -0.066 -3.822 -6.041 1.00 0.00 C ATOM 831 CE2 PHE A 58 -0.798 -5.096 -4.140 1.00 0.00 C ATOM 832 CZ PHE A 58 -0.336 -3.901 -4.698 1.00 0.00 C ATOM 0 HA PHE A 58 0.163 -8.682 -8.529 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -1.610 -7.047 -8.012 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -1.433 -8.109 -6.630 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -0.044 -4.840 -7.911 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -1.317 -7.143 -4.520 1.00 0.00 H new ATOM 0 HE1 PHE A 58 0.291 -2.894 -6.463 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -1.020 -5.151 -3.084 1.00 0.00 H new ATOM 0 HZ PHE A 58 -0.191 -3.035 -4.069 1.00 0.00 H new ATOM 842 N TYR A 59 2.238 -6.223 -8.177 1.00 0.00 N ATOM 843 CA TYR A 59 2.877 -5.146 -9.026 1.00 0.00 C ATOM 844 C TYR A 59 3.158 -5.658 -10.435 1.00 0.00 C ATOM 845 O TYR A 59 3.375 -4.878 -11.359 1.00 0.00 O ATOM 846 CB TYR A 59 4.178 -4.612 -8.422 1.00 0.00 C ATOM 847 CG TYR A 59 4.061 -4.299 -6.954 1.00 0.00 C ATOM 848 CD1 TYR A 59 2.928 -3.676 -6.475 1.00 0.00 C ATOM 849 CD2 TYR A 59 5.131 -4.580 -6.089 1.00 0.00 C ATOM 850 CE1 TYR A 59 2.841 -3.320 -5.124 1.00 0.00 C ATOM 851 CE2 TYR A 59 5.047 -4.236 -4.748 1.00 0.00 C ATOM 852 CZ TYR A 59 3.911 -3.604 -4.257 1.00 0.00 C ATOM 853 OH TYR A 59 3.849 -3.250 -2.928 1.00 0.00 O ATOM 0 H TYR A 59 2.716 -6.446 -7.304 1.00 0.00 H new ATOM 0 HA TYR A 59 2.159 -4.327 -9.064 1.00 0.00 H new ATOM 0 HB2 TYR A 59 4.969 -5.348 -8.569 1.00 0.00 H new ATOM 0 HB3 TYR A 59 4.477 -3.711 -8.957 1.00 0.00 H new ATOM 0 HD1 TYR A 59 2.107 -3.462 -7.143 1.00 0.00 H new ATOM 0 HD2 TYR A 59 6.019 -5.064 -6.468 1.00 0.00 H new ATOM 0 HE1 TYR A 59 1.955 -2.829 -4.749 1.00 0.00 H new ATOM 0 HE2 TYR A 59 5.868 -4.460 -4.083 1.00 0.00 H new ATOM 0 HH TYR A 59 3.601 -2.305 -2.852 1.00 0.00 H new ATOM 863 N VAL A 60 3.160 -6.943 -10.590 1.00 0.00 N ATOM 864 CA VAL A 60 3.421 -7.574 -11.884 1.00 0.00 C ATOM 865 C VAL A 60 2.106 -7.857 -12.629 1.00 0.00 C ATOM 866 O VAL A 60 2.018 -7.640 -13.836 1.00 0.00 O ATOM 867 CB VAL A 60 4.160 -8.875 -11.627 1.00 0.00 C ATOM 868 CG1 VAL A 60 5.465 -8.569 -10.892 1.00 0.00 C ATOM 869 CG2 VAL A 60 3.304 -9.839 -10.774 1.00 0.00 C ATOM 0 H VAL A 60 2.982 -7.603 -9.833 1.00 0.00 H new ATOM 0 HA VAL A 60 4.019 -6.908 -12.506 1.00 0.00 H new ATOM 0 HB VAL A 60 4.367 -9.355 -12.583 1.00 0.00 H new ATOM 0 HG11 VAL A 60 6.003 -9.498 -10.703 1.00 0.00 H new ATOM 0 HG12 VAL A 60 6.082 -7.911 -11.504 1.00 0.00 H new ATOM 0 HG13 VAL A 60 5.242 -8.079 -9.944 1.00 0.00 H new ATOM 0 HG21 VAL A 60 3.857 -10.763 -10.605 1.00 0.00 H new ATOM 0 HG22 VAL A 60 3.076 -9.372 -9.816 1.00 0.00 H new ATOM 0 HG23 VAL A 60 2.375 -10.063 -11.299 1.00 0.00 H new ATOM 879 N ASN A 61 1.088 -8.364 -11.925 1.00 0.00 N ATOM 880 CA ASN A 61 -0.196 -8.682 -12.591 1.00 0.00 C ATOM 881 C ASN A 61 -1.127 -7.456 -12.620 1.00 0.00 C ATOM 882 O ASN A 61 -1.538 -7.030 -13.690 1.00 0.00 O ATOM 883 CB ASN A 61 -0.886 -9.886 -11.917 1.00 0.00 C ATOM 884 CG ASN A 61 -0.838 -9.838 -10.406 1.00 0.00 C ATOM 885 OD1 ASN A 61 -1.631 -9.169 -9.777 1.00 0.00 O ATOM 886 ND2 ASN A 61 0.043 -10.580 -9.780 1.00 0.00 N ATOM 0 H ASN A 61 1.116 -8.561 -10.925 1.00 0.00 H new ATOM 0 HA ASN A 61 0.024 -8.956 -13.623 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -1.927 -9.926 -12.239 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -0.411 -10.806 -12.259 1.00 0.00 H new ATOM 0 HD21 ASN A 61 0.064 -10.596 -8.760 1.00 0.00 H new ATOM 0 HD22 ASN A 61 0.708 -11.141 -10.313 1.00 0.00 H new ATOM 893 N GLY A 62 -1.467 -6.887 -11.467 1.00 0.00 N ATOM 894 CA GLY A 62 -2.367 -5.702 -11.436 1.00 0.00 C ATOM 895 C GLY A 62 -3.430 -5.918 -10.359 1.00 0.00 C ATOM 896 O GLY A 62 -3.772 -7.049 -10.036 1.00 0.00 O ATOM 0 H GLY A 62 -1.149 -7.207 -10.552 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -1.794 -4.799 -11.225 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -2.838 -5.561 -12.409 1.00 0.00 H new ATOM 900 N LEU A 63 -3.955 -4.839 -9.799 1.00 0.00 N ATOM 901 CA LEU A 63 -5.012 -4.960 -8.728 1.00 0.00 C ATOM 902 C LEU A 63 -6.354 -5.230 -9.396 1.00 0.00 C ATOM 903 O LEU A 63 -6.400 -5.726 -10.517 1.00 0.00 O ATOM 904 CB LEU A 63 -5.110 -3.659 -7.883 1.00 0.00 C ATOM 905 CG LEU A 63 -3.738 -3.142 -7.483 1.00 0.00 C ATOM 906 CD1 LEU A 63 -3.853 -1.640 -7.195 1.00 0.00 C ATOM 907 CD2 LEU A 63 -3.282 -3.874 -6.221 1.00 0.00 C ATOM 0 H LEU A 63 -3.696 -3.882 -10.039 1.00 0.00 H new ATOM 0 HA LEU A 63 -4.742 -5.778 -8.060 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -5.635 -2.893 -8.454 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -5.702 -3.851 -6.988 1.00 0.00 H new ATOM 0 HG LEU A 63 -3.015 -3.312 -8.281 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -2.877 -1.249 -6.906 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -4.200 -1.123 -8.090 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -4.563 -1.478 -6.384 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -2.298 -3.510 -5.925 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -3.994 -3.690 -5.416 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -3.229 -4.944 -6.420 1.00 0.00 H new ATOM 919 N THR A 64 -7.448 -4.891 -8.720 1.00 0.00 N ATOM 920 CA THR A 64 -8.784 -5.101 -9.263 1.00 0.00 C ATOM 921 C THR A 64 -9.711 -4.223 -8.493 1.00 0.00 C ATOM 922 O THR A 64 -9.670 -4.202 -7.277 1.00 0.00 O ATOM 923 CB THR A 64 -9.220 -6.550 -9.080 1.00 0.00 C ATOM 924 OG1 THR A 64 -8.962 -6.953 -7.755 1.00 0.00 O ATOM 925 CG2 THR A 64 -8.448 -7.442 -10.022 1.00 0.00 C ATOM 0 H THR A 64 -7.434 -4.468 -7.792 1.00 0.00 H new ATOM 0 HA THR A 64 -8.793 -4.871 -10.328 1.00 0.00 H new ATOM 0 HB THR A 64 -10.286 -6.630 -9.294 1.00 0.00 H new ATOM 0 HG1 THR A 64 -9.244 -7.884 -7.636 1.00 0.00 H new ATOM 0 HG21 THR A 64 -8.765 -8.476 -9.886 1.00 0.00 H new ATOM 0 HG22 THR A 64 -8.639 -7.137 -11.051 1.00 0.00 H new ATOM 0 HG23 THR A 64 -7.382 -7.358 -9.811 1.00 0.00 H new ATOM 933 N LEU A 65 -10.509 -3.499 -9.181 1.00 0.00 N ATOM 934 CA LEU A 65 -11.478 -2.584 -8.535 1.00 0.00 C ATOM 935 C LEU A 65 -12.852 -2.639 -9.211 1.00 0.00 C ATOM 936 O LEU A 65 -13.063 -2.180 -10.320 1.00 0.00 O ATOM 937 CB LEU A 65 -10.895 -1.176 -8.385 1.00 0.00 C ATOM 938 CG LEU A 65 -9.805 -0.813 -9.449 1.00 0.00 C ATOM 939 CD1 LEU A 65 -10.246 -1.081 -10.889 1.00 0.00 C ATOM 940 CD2 LEU A 65 -9.442 0.667 -9.275 1.00 0.00 C ATOM 0 H LEU A 65 -10.540 -3.495 -10.201 1.00 0.00 H new ATOM 0 HA LEU A 65 -11.659 -2.931 -7.518 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -11.706 -0.451 -8.451 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -10.461 -1.079 -7.390 1.00 0.00 H new ATOM 0 HG LEU A 65 -8.942 -1.457 -9.278 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -9.442 -0.807 -11.573 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -10.478 -2.139 -11.007 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -11.132 -0.488 -11.114 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -8.683 0.944 -10.007 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -10.331 1.280 -9.425 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -9.054 0.831 -8.270 1.00 0.00 H new ATOM 952 N GLY A 66 -13.789 -3.281 -8.519 1.00 0.00 N ATOM 953 CA GLY A 66 -15.158 -3.474 -9.057 1.00 0.00 C ATOM 954 C GLY A 66 -15.109 -4.623 -10.068 1.00 0.00 C ATOM 955 O GLY A 66 -15.960 -4.728 -10.942 1.00 0.00 O ATOM 0 H GLY A 66 -13.641 -3.678 -7.591 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -15.855 -3.704 -8.252 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -15.513 -2.561 -9.535 1.00 0.00 H new ATOM 959 N GLY A 67 -14.089 -5.491 -9.958 1.00 0.00 N ATOM 960 CA GLY A 67 -13.943 -6.616 -10.903 1.00 0.00 C ATOM 961 C GLY A 67 -13.159 -6.145 -12.133 1.00 0.00 C ATOM 962 O GLY A 67 -13.114 -6.843 -13.138 1.00 0.00 O ATOM 0 H GLY A 67 -13.366 -5.440 -9.240 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -13.424 -7.445 -10.422 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -14.924 -6.985 -11.202 1.00 0.00 H new ATOM 966 N GLN A 68 -12.523 -4.950 -12.070 1.00 0.00 N ATOM 967 CA GLN A 68 -11.738 -4.460 -13.264 1.00 0.00 C ATOM 968 C GLN A 68 -10.250 -4.490 -12.954 1.00 0.00 C ATOM 969 O GLN A 68 -9.740 -3.663 -12.222 1.00 0.00 O ATOM 970 CB GLN A 68 -12.167 -3.049 -13.630 1.00 0.00 C ATOM 971 CG GLN A 68 -11.282 -2.455 -14.778 1.00 0.00 C ATOM 972 CD GLN A 68 -11.173 -3.446 -15.959 1.00 0.00 C ATOM 973 OE1 GLN A 68 -9.997 -3.687 -16.497 1.00 0.00 O flip ATOM 974 NE2 GLN A 68 -12.164 -4.000 -16.393 1.00 0.00 N flip ATOM 0 H GLN A 68 -12.525 -4.328 -11.262 1.00 0.00 H new ATOM 0 HA GLN A 68 -11.937 -5.117 -14.111 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -13.211 -3.055 -13.942 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -12.101 -2.409 -12.751 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -11.712 -1.515 -15.125 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -10.287 -2.228 -14.395 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -13.076 -3.814 -15.976 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -12.083 -4.651 -17.174 1.00 0.00 H new ATOM 983 N LYS A 69 -9.559 -5.447 -13.515 1.00 0.00 N ATOM 984 CA LYS A 69 -8.102 -5.587 -13.295 1.00 0.00 C ATOM 985 C LYS A 69 -7.344 -4.370 -13.808 1.00 0.00 C ATOM 986 O LYS A 69 -7.288 -4.131 -15.009 1.00 0.00 O ATOM 987 CB LYS A 69 -7.633 -6.814 -14.062 1.00 0.00 C ATOM 988 CG LYS A 69 -6.617 -7.583 -13.248 1.00 0.00 C ATOM 989 CD LYS A 69 -6.652 -9.029 -13.697 1.00 0.00 C ATOM 990 CE LYS A 69 -5.538 -9.827 -12.998 1.00 0.00 C ATOM 991 NZ LYS A 69 -4.761 -10.592 -14.014 1.00 0.00 N ATOM 0 H LYS A 69 -9.961 -6.153 -14.132 1.00 0.00 H new ATOM 0 HA LYS A 69 -7.910 -5.681 -12.226 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -8.484 -7.454 -14.293 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -7.194 -6.512 -15.013 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -5.621 -7.165 -13.389 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -6.846 -7.509 -12.185 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -7.623 -9.466 -13.466 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -6.527 -9.085 -14.778 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -4.878 -9.151 -12.454 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -5.970 -10.509 -12.266 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -4.008 -11.131 -13.541 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -5.395 -11.248 -14.514 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -4.337 -9.932 -14.697 1.00 0.00 H new ATOM 1005 N CYS A 70 -6.685 -3.650 -12.912 1.00 0.00 N ATOM 1006 CA CYS A 70 -5.844 -2.517 -13.325 1.00 0.00 C ATOM 1007 C CYS A 70 -4.411 -2.984 -13.053 1.00 0.00 C ATOM 1008 O CYS A 70 -4.193 -3.850 -12.213 1.00 0.00 O ATOM 1009 CB CYS A 70 -6.170 -1.273 -12.514 1.00 0.00 C ATOM 1010 SG CYS A 70 -6.177 -1.650 -10.741 1.00 0.00 S ATOM 0 H CYS A 70 -6.710 -3.820 -11.907 1.00 0.00 H new ATOM 0 HA CYS A 70 -6.001 -2.246 -14.369 1.00 0.00 H new ATOM 0 HB2 CYS A 70 -5.437 -0.494 -12.723 1.00 0.00 H new ATOM 0 HB3 CYS A 70 -7.143 -0.883 -12.812 1.00 0.00 H new ATOM 0 HG CYS A 70 -5.006 -2.091 -10.386 1.00 0.00 H new ATOM 1016 N SER A 71 -3.460 -2.465 -13.746 1.00 0.00 N ATOM 1017 CA SER A 71 -2.034 -2.916 -13.546 1.00 0.00 C ATOM 1018 C SER A 71 -1.175 -1.773 -13.045 1.00 0.00 C ATOM 1019 O SER A 71 -1.071 -0.733 -13.655 1.00 0.00 O ATOM 1020 CB SER A 71 -1.496 -3.515 -14.833 1.00 0.00 C ATOM 1021 OG SER A 71 -0.909 -2.516 -15.645 1.00 0.00 O ATOM 0 H SER A 71 -3.588 -1.741 -14.453 1.00 0.00 H new ATOM 0 HA SER A 71 -2.006 -3.692 -12.781 1.00 0.00 H new ATOM 0 HB2 SER A 71 -0.757 -4.282 -14.601 1.00 0.00 H new ATOM 0 HB3 SER A 71 -2.304 -4.004 -15.377 1.00 0.00 H new ATOM 0 HG SER A 71 -1.173 -1.631 -15.317 1.00 0.00 H new ATOM 1027 N VAL A 72 -0.603 -1.983 -11.913 1.00 0.00 N ATOM 1028 CA VAL A 72 0.236 -0.949 -11.233 1.00 0.00 C ATOM 1029 C VAL A 72 1.307 -0.349 -12.110 1.00 0.00 C ATOM 1030 O VAL A 72 2.289 -0.989 -12.469 1.00 0.00 O ATOM 1031 CB VAL A 72 0.939 -1.509 -10.016 1.00 0.00 C ATOM 1032 CG1 VAL A 72 1.350 -0.350 -9.101 1.00 0.00 C ATOM 1033 CG2 VAL A 72 0.033 -2.454 -9.252 1.00 0.00 C ATOM 0 H VAL A 72 -0.677 -2.861 -11.399 1.00 0.00 H new ATOM 0 HA VAL A 72 -0.480 -0.173 -10.962 1.00 0.00 H new ATOM 0 HB VAL A 72 1.817 -2.065 -10.344 1.00 0.00 H new ATOM 0 HG11 VAL A 72 1.858 -0.744 -8.221 1.00 0.00 H new ATOM 0 HG12 VAL A 72 2.023 0.318 -9.639 1.00 0.00 H new ATOM 0 HG13 VAL A 72 0.462 0.202 -8.791 1.00 0.00 H new ATOM 0 HG21 VAL A 72 0.563 -2.842 -8.382 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -0.858 -1.919 -8.925 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -0.258 -3.282 -9.899 1.00 0.00 H new ATOM 1043 N ILE A 73 1.153 0.920 -12.351 1.00 0.00 N ATOM 1044 CA ILE A 73 2.110 1.701 -13.062 1.00 0.00 C ATOM 1045 C ILE A 73 2.700 2.701 -11.955 1.00 0.00 C ATOM 1046 O ILE A 73 2.494 3.886 -11.950 1.00 0.00 O ATOM 1047 CB ILE A 73 1.388 2.397 -14.228 1.00 0.00 C ATOM 1048 CG1 ILE A 73 1.325 1.430 -15.471 1.00 0.00 C ATOM 1049 CG2 ILE A 73 2.107 3.694 -14.635 1.00 0.00 C ATOM 1050 CD1 ILE A 73 -0.107 0.825 -15.656 1.00 0.00 C ATOM 0 H ILE A 73 0.336 1.450 -12.049 1.00 0.00 H new ATOM 0 HA ILE A 73 2.928 1.143 -13.518 1.00 0.00 H new ATOM 0 HB ILE A 73 0.380 2.647 -13.896 1.00 0.00 H new ATOM 0 HG12 ILE A 73 1.610 1.974 -16.371 1.00 0.00 H new ATOM 0 HG13 ILE A 73 2.048 0.624 -15.343 1.00 0.00 H new ATOM 0 HG21 ILE A 73 1.572 4.162 -15.461 1.00 0.00 H new ATOM 0 HG22 ILE A 73 2.133 4.377 -13.786 1.00 0.00 H new ATOM 0 HG23 ILE A 73 3.126 3.463 -14.946 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -0.113 0.163 -16.522 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -0.381 0.259 -14.765 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -0.825 1.630 -15.809 1.00 0.00 H new ATOM 1062 N ARG A 74 3.357 2.102 -10.991 1.00 0.00 N ATOM 1063 CA ARG A 74 4.004 2.783 -9.768 1.00 0.00 C ATOM 1064 C ARG A 74 3.232 2.394 -8.532 1.00 0.00 C ATOM 1065 O ARG A 74 2.007 2.362 -8.553 1.00 0.00 O ATOM 1066 CB ARG A 74 4.028 4.309 -9.847 1.00 0.00 C ATOM 1067 CG ARG A 74 5.021 4.764 -10.921 1.00 0.00 C ATOM 1068 CD ARG A 74 5.309 6.256 -10.752 1.00 0.00 C ATOM 1069 NE ARG A 74 6.637 6.571 -11.344 1.00 0.00 N ATOM 1070 CZ ARG A 74 7.727 6.353 -10.656 1.00 0.00 C ATOM 1071 NH1 ARG A 74 8.005 7.094 -9.620 1.00 0.00 N ATOM 1072 NH2 ARG A 74 8.537 5.389 -11.002 1.00 0.00 N ATOM 0 H ARG A 74 3.492 1.091 -10.985 1.00 0.00 H new ATOM 0 HA ARG A 74 5.040 2.445 -9.739 1.00 0.00 H new ATOM 0 HB2 ARG A 74 3.032 4.685 -10.079 1.00 0.00 H new ATOM 0 HB3 ARG A 74 4.309 4.727 -8.880 1.00 0.00 H new ATOM 0 HG2 ARG A 74 5.946 4.193 -10.841 1.00 0.00 H new ATOM 0 HG3 ARG A 74 4.613 4.572 -11.913 1.00 0.00 H new ATOM 0 HD2 ARG A 74 4.532 6.845 -11.239 1.00 0.00 H new ATOM 0 HD3 ARG A 74 5.297 6.523 -9.695 1.00 0.00 H new ATOM 0 HE ARG A 74 6.697 6.957 -12.286 1.00 0.00 H new ATOM 0 HH11 ARG A 74 7.372 7.845 -9.345 1.00 0.00 H new ATOM 0 HH12 ARG A 74 8.856 6.923 -9.084 1.00 0.00 H new ATOM 0 HH21 ARG A 74 8.319 4.805 -11.810 1.00 0.00 H new ATOM 0 HH22 ARG A 74 9.387 5.220 -10.465 1.00 0.00 H new ATOM 1086 N ASP A 75 3.925 2.097 -7.435 1.00 0.00 N ATOM 1087 CA ASP A 75 3.201 1.718 -6.198 1.00 0.00 C ATOM 1088 C ASP A 75 3.864 2.281 -4.951 1.00 0.00 C ATOM 1089 O ASP A 75 4.699 1.646 -4.319 1.00 0.00 O ATOM 1090 CB ASP A 75 3.048 0.188 -6.109 1.00 0.00 C ATOM 1091 CG ASP A 75 2.439 -0.224 -4.751 1.00 0.00 C ATOM 1092 OD1 ASP A 75 1.295 0.118 -4.506 1.00 0.00 O ATOM 1093 OD2 ASP A 75 3.140 -0.860 -3.982 1.00 0.00 O ATOM 0 H ASP A 75 4.942 2.106 -7.363 1.00 0.00 H new ATOM 0 HA ASP A 75 2.206 2.161 -6.251 1.00 0.00 H new ATOM 0 HB2 ASP A 75 2.412 -0.166 -6.920 1.00 0.00 H new ATOM 0 HB3 ASP A 75 4.021 -0.287 -6.236 1.00 0.00 H new ATOM 1098 N SER A 76 3.404 3.443 -4.559 1.00 0.00 N ATOM 1099 CA SER A 76 3.858 4.082 -3.309 1.00 0.00 C ATOM 1100 C SER A 76 2.568 4.245 -2.476 1.00 0.00 C ATOM 1101 O SER A 76 2.334 5.239 -1.901 1.00 0.00 O ATOM 1102 CB SER A 76 4.531 5.463 -3.605 1.00 0.00 C ATOM 1103 OG SER A 76 5.900 5.256 -3.925 1.00 0.00 O ATOM 0 H SER A 76 2.711 3.983 -5.078 1.00 0.00 H new ATOM 0 HA SER A 76 4.612 3.495 -2.784 1.00 0.00 H new ATOM 0 HB2 SER A 76 4.023 5.959 -4.432 1.00 0.00 H new ATOM 0 HB3 SER A 76 4.443 6.118 -2.738 1.00 0.00 H new ATOM 0 HG SER A 76 6.326 6.118 -4.113 1.00 0.00 H new ATOM 1109 N LEU A 77 1.721 3.208 -2.500 1.00 0.00 N ATOM 1110 CA LEU A 77 0.357 3.204 -1.795 1.00 0.00 C ATOM 1111 C LEU A 77 0.447 3.227 -0.242 1.00 0.00 C ATOM 1112 O LEU A 77 0.017 4.190 0.377 1.00 0.00 O ATOM 1113 CB LEU A 77 -0.358 1.931 -2.241 1.00 0.00 C ATOM 1114 CG LEU A 77 -1.842 2.010 -1.924 1.00 0.00 C ATOM 1115 CD1 LEU A 77 -2.479 3.126 -2.747 1.00 0.00 C ATOM 1116 CD2 LEU A 77 -2.500 0.674 -2.284 1.00 0.00 C ATOM 0 H LEU A 77 1.924 2.339 -2.993 1.00 0.00 H new ATOM 0 HA LEU A 77 -0.176 4.114 -2.070 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -0.217 1.785 -3.312 1.00 0.00 H new ATOM 0 HB3 LEU A 77 0.080 1.067 -1.741 1.00 0.00 H new ATOM 0 HG LEU A 77 -1.982 2.218 -0.863 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -3.544 3.183 -2.520 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -2.004 4.076 -2.501 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -2.345 2.917 -3.808 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -3.566 0.721 -2.060 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -2.361 0.475 -3.347 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -2.042 -0.126 -1.702 1.00 0.00 H new ATOM 1128 N LEU A 78 0.941 2.194 0.407 1.00 0.00 N ATOM 1129 CA LEU A 78 0.998 2.254 1.919 1.00 0.00 C ATOM 1130 C LEU A 78 2.463 2.348 2.378 1.00 0.00 C ATOM 1131 O LEU A 78 2.926 1.554 3.204 1.00 0.00 O ATOM 1132 CB LEU A 78 0.277 1.037 2.562 1.00 0.00 C ATOM 1133 CG LEU A 78 0.519 -0.247 1.741 1.00 0.00 C ATOM 1134 CD1 LEU A 78 0.301 -1.497 2.630 1.00 0.00 C ATOM 1135 CD2 LEU A 78 -0.465 -0.282 0.557 1.00 0.00 C ATOM 0 H LEU A 78 1.297 1.339 -0.020 1.00 0.00 H new ATOM 0 HA LEU A 78 0.470 3.147 2.254 1.00 0.00 H new ATOM 0 HB2 LEU A 78 0.636 0.894 3.581 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -0.793 1.236 2.626 1.00 0.00 H new ATOM 0 HG LEU A 78 1.545 -0.250 1.372 1.00 0.00 H new ATOM 0 HD11 LEU A 78 0.474 -2.397 2.041 1.00 0.00 H new ATOM 0 HD12 LEU A 78 0.997 -1.473 3.469 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -0.722 -1.501 3.007 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -0.299 -1.187 -0.027 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -1.488 -0.276 0.934 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -0.305 0.592 -0.075 1.00 0.00 H new ATOM 1183 N GLU A 82 3.343 9.006 0.733 1.00 0.00 N ATOM 1184 CA GLU A 82 2.934 9.189 -0.690 1.00 0.00 C ATOM 1185 C GLU A 82 1.552 8.601 -0.912 1.00 0.00 C ATOM 1186 O GLU A 82 0.619 9.268 -1.333 1.00 0.00 O ATOM 1187 CB GLU A 82 3.895 8.392 -1.612 1.00 0.00 C ATOM 1188 CG GLU A 82 5.108 9.199 -2.077 1.00 0.00 C ATOM 1189 CD GLU A 82 4.669 10.538 -2.683 1.00 0.00 C ATOM 1190 OE1 GLU A 82 4.544 11.490 -1.933 1.00 0.00 O ATOM 1191 OE2 GLU A 82 4.465 10.584 -3.885 1.00 0.00 O ATOM 0 HA GLU A 82 2.952 10.256 -0.913 1.00 0.00 H new ATOM 0 HB2 GLU A 82 4.241 7.505 -1.082 1.00 0.00 H new ATOM 0 HB3 GLU A 82 3.343 8.046 -2.486 1.00 0.00 H new ATOM 0 HG2 GLU A 82 5.777 9.377 -1.235 1.00 0.00 H new ATOM 0 HG3 GLU A 82 5.670 8.627 -2.815 1.00 0.00 H new ATOM 1198 N PHE A 83 1.480 7.317 -0.725 1.00 0.00 N ATOM 1199 CA PHE A 83 0.231 6.511 -1.005 1.00 0.00 C ATOM 1200 C PHE A 83 -0.191 6.597 -2.493 1.00 0.00 C ATOM 1201 O PHE A 83 -1.168 5.964 -2.868 1.00 0.00 O ATOM 1202 CB PHE A 83 -0.986 6.871 -0.178 1.00 0.00 C ATOM 1203 CG PHE A 83 -0.690 7.836 0.928 1.00 0.00 C ATOM 1204 CD1 PHE A 83 0.119 7.443 1.992 1.00 0.00 C ATOM 1205 CD2 PHE A 83 -1.266 9.108 0.908 1.00 0.00 C ATOM 1206 CE1 PHE A 83 0.352 8.325 3.044 1.00 0.00 C ATOM 1207 CE2 PHE A 83 -1.026 9.998 1.957 1.00 0.00 C ATOM 1208 CZ PHE A 83 -0.217 9.609 3.026 1.00 0.00 C ATOM 0 H PHE A 83 2.259 6.759 -0.376 1.00 0.00 H new ATOM 0 HA PHE A 83 0.536 5.503 -0.725 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -1.746 7.300 -0.831 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -1.409 5.961 0.247 1.00 0.00 H new ATOM 0 HD1 PHE A 83 0.563 6.459 2.001 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -1.896 9.403 0.082 1.00 0.00 H new ATOM 0 HE1 PHE A 83 0.971 8.021 3.875 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -1.465 10.985 1.941 1.00 0.00 H new ATOM 0 HZ PHE A 83 -0.029 10.295 3.839 1.00 0.00 H new ATOM 1218 N SER A 84 0.504 7.362 -3.345 1.00 0.00 N ATOM 1219 CA SER A 84 0.080 7.447 -4.764 1.00 0.00 C ATOM 1220 C SER A 84 0.635 6.262 -5.513 1.00 0.00 C ATOM 1221 O SER A 84 1.828 5.982 -5.487 1.00 0.00 O ATOM 1222 CB SER A 84 0.538 8.755 -5.377 1.00 0.00 C ATOM 1223 OG SER A 84 1.861 9.051 -4.948 1.00 0.00 O ATOM 0 H SER A 84 1.328 7.912 -3.100 1.00 0.00 H new ATOM 0 HA SER A 84 -1.008 7.424 -4.827 1.00 0.00 H new ATOM 0 HB2 SER A 84 0.505 8.689 -6.464 1.00 0.00 H new ATOM 0 HB3 SER A 84 -0.137 9.560 -5.086 1.00 0.00 H new ATOM 0 HG SER A 84 2.384 8.223 -4.906 1.00 0.00 H new ATOM 1229 N MET A 85 -0.243 5.543 -6.144 1.00 0.00 N ATOM 1230 CA MET A 85 0.128 4.314 -6.895 1.00 0.00 C ATOM 1231 C MET A 85 -0.690 4.314 -8.130 1.00 0.00 C ATOM 1232 O MET A 85 -1.911 4.403 -8.037 1.00 0.00 O ATOM 1233 CB MET A 85 -0.285 3.135 -6.029 1.00 0.00 C ATOM 1234 CG MET A 85 -0.161 1.783 -6.749 1.00 0.00 C ATOM 1235 SD MET A 85 -1.612 0.803 -6.346 1.00 0.00 S ATOM 1236 CE MET A 85 -0.800 -0.788 -6.283 1.00 0.00 C ATOM 0 H MET A 85 -1.238 5.763 -6.172 1.00 0.00 H new ATOM 0 HA MET A 85 1.190 4.264 -7.133 1.00 0.00 H new ATOM 0 HB2 MET A 85 0.332 3.119 -5.130 1.00 0.00 H new ATOM 0 HB3 MET A 85 -1.317 3.274 -5.705 1.00 0.00 H new ATOM 0 HG2 MET A 85 -0.088 1.931 -7.827 1.00 0.00 H new ATOM 0 HG3 MET A 85 0.746 1.267 -6.436 1.00 0.00 H new ATOM 0 HE1 MET A 85 -1.279 -1.469 -6.986 1.00 0.00 H new ATOM 0 HE2 MET A 85 0.250 -0.671 -6.550 1.00 0.00 H new ATOM 0 HE3 MET A 85 -0.875 -1.195 -5.275 1.00 0.00 H new ATOM 1246 N ASP A 86 -0.094 4.186 -9.296 1.00 0.00 N ATOM 1247 CA ASP A 86 -0.933 4.163 -10.482 1.00 0.00 C ATOM 1248 C ASP A 86 -1.235 2.767 -10.814 1.00 0.00 C ATOM 1249 O ASP A 86 -0.451 1.898 -10.564 1.00 0.00 O ATOM 1250 CB ASP A 86 -0.227 4.747 -11.658 1.00 0.00 C ATOM 1251 CG ASP A 86 0.112 6.214 -11.403 1.00 0.00 C ATOM 1252 OD1 ASP A 86 0.830 6.479 -10.451 1.00 0.00 O ATOM 1253 OD2 ASP A 86 -0.348 7.048 -12.163 1.00 0.00 O ATOM 0 H ASP A 86 0.911 4.100 -9.450 1.00 0.00 H new ATOM 0 HA ASP A 86 -1.832 4.742 -10.270 1.00 0.00 H new ATOM 0 HB2 ASP A 86 0.686 4.186 -11.857 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -0.854 4.661 -12.546 1.00 0.00 H new ATOM 1258 N LEU A 87 -2.364 2.556 -11.393 1.00 0.00 N ATOM 1259 CA LEU A 87 -2.770 1.240 -11.858 1.00 0.00 C ATOM 1260 C LEU A 87 -3.791 1.478 -12.955 1.00 0.00 C ATOM 1261 O LEU A 87 -4.675 2.284 -12.786 1.00 0.00 O ATOM 1262 CB LEU A 87 -3.251 0.296 -10.742 1.00 0.00 C ATOM 1263 CG LEU A 87 -4.018 0.936 -9.547 1.00 0.00 C ATOM 1264 CD1 LEU A 87 -3.174 1.945 -8.810 1.00 0.00 C ATOM 1265 CD2 LEU A 87 -5.310 1.575 -10.002 1.00 0.00 C ATOM 0 H LEU A 87 -3.052 3.288 -11.568 1.00 0.00 H new ATOM 0 HA LEU A 87 -1.911 0.694 -12.250 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -3.897 -0.458 -11.193 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -2.381 -0.226 -10.344 1.00 0.00 H new ATOM 0 HG LEU A 87 -4.253 0.125 -8.857 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -3.748 2.366 -7.985 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -2.281 1.457 -8.419 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -2.881 2.743 -9.493 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -5.821 2.012 -9.144 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -5.093 2.355 -10.732 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -5.949 0.819 -10.458 1.00 0.00 H new ATOM 1277 N ARG A 88 -3.629 0.862 -14.140 1.00 0.00 N ATOM 1278 CA ARG A 88 -4.597 1.196 -15.263 1.00 0.00 C ATOM 1279 C ARG A 88 -5.268 -0.016 -15.827 1.00 0.00 C ATOM 1280 O ARG A 88 -4.746 -1.095 -15.823 1.00 0.00 O ATOM 1281 CB ARG A 88 -3.883 2.032 -16.377 1.00 0.00 C ATOM 1282 CG ARG A 88 -3.237 1.197 -17.508 1.00 0.00 C ATOM 1283 CD ARG A 88 -2.717 2.190 -18.567 1.00 0.00 C ATOM 1284 NE ARG A 88 -1.355 1.795 -19.031 1.00 0.00 N ATOM 1285 CZ ARG A 88 -1.138 1.553 -20.293 1.00 0.00 C ATOM 1286 NH1 ARG A 88 -1.932 0.756 -20.956 1.00 0.00 N ATOM 1287 NH2 ARG A 88 -0.124 2.114 -20.893 1.00 0.00 N ATOM 0 H ARG A 88 -2.905 0.179 -14.362 1.00 0.00 H new ATOM 0 HA ARG A 88 -5.391 1.807 -14.832 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -4.609 2.715 -16.819 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -3.111 2.645 -15.912 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -2.421 0.588 -17.119 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -3.965 0.514 -17.946 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -3.402 2.219 -19.414 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -2.687 3.196 -18.147 1.00 0.00 H new ATOM 0 HE ARG A 88 -0.592 1.714 -18.359 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -2.726 0.320 -20.486 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -1.759 0.569 -21.944 1.00 0.00 H new ATOM 0 HH21 ARG A 88 0.494 2.738 -20.374 1.00 0.00 H new ATOM 0 HH22 ARG A 88 0.051 1.928 -21.881 1.00 0.00 H new ATOM 1301 N THR A 89 -6.443 0.192 -16.331 1.00 0.00 N ATOM 1302 CA THR A 89 -7.216 -0.925 -16.927 1.00 0.00 C ATOM 1303 C THR A 89 -6.562 -1.151 -18.268 1.00 0.00 C ATOM 1304 O THR A 89 -6.913 -0.514 -19.262 1.00 0.00 O ATOM 1305 CB THR A 89 -8.749 -0.568 -17.076 1.00 0.00 C ATOM 1306 OG1 THR A 89 -9.057 -0.013 -18.348 1.00 0.00 O ATOM 1307 CG2 THR A 89 -9.118 0.469 -16.063 1.00 0.00 C ATOM 0 H THR A 89 -6.909 1.099 -16.357 1.00 0.00 H new ATOM 0 HA THR A 89 -7.200 -1.817 -16.301 1.00 0.00 H new ATOM 0 HB THR A 89 -9.299 -1.500 -16.942 1.00 0.00 H new ATOM 0 HG1 THR A 89 -8.248 0.380 -18.738 1.00 0.00 H new ATOM 0 HG21 THR A 89 -10.175 0.717 -16.164 1.00 0.00 H new ATOM 0 HG22 THR A 89 -8.930 0.082 -15.061 1.00 0.00 H new ATOM 0 HG23 THR A 89 -8.518 1.365 -16.224 1.00 0.00 H new ATOM 1315 N LYS A 90 -5.569 -2.003 -18.289 1.00 0.00 N ATOM 1316 CA LYS A 90 -4.830 -2.263 -19.509 1.00 0.00 C ATOM 1317 C LYS A 90 -5.656 -3.270 -20.306 1.00 0.00 C ATOM 1318 O LYS A 90 -6.083 -4.299 -19.798 1.00 0.00 O ATOM 1319 CB LYS A 90 -3.387 -2.744 -19.188 1.00 0.00 C ATOM 1320 CG LYS A 90 -2.873 -2.136 -17.869 1.00 0.00 C ATOM 1321 CD LYS A 90 -1.453 -1.583 -18.098 1.00 0.00 C ATOM 1322 CE LYS A 90 -0.473 -2.749 -18.319 1.00 0.00 C ATOM 1323 NZ LYS A 90 0.843 -2.450 -17.659 1.00 0.00 N ATOM 0 H LYS A 90 -5.249 -2.531 -17.477 1.00 0.00 H new ATOM 0 HA LYS A 90 -4.691 -1.363 -20.108 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -3.371 -3.832 -19.120 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -2.719 -2.466 -20.003 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -3.539 -1.340 -17.535 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -2.862 -2.892 -17.084 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -1.445 -0.920 -18.963 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -1.140 -0.990 -17.239 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -0.892 -3.669 -17.911 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -0.325 -2.912 -19.386 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 1.503 -3.236 -17.829 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 1.239 -1.574 -18.055 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 0.700 -2.333 -16.636 1.00 0.00 H new ATOM 1434 N ASN A 99 -7.008 4.777 -17.096 1.00 0.00 N ATOM 1435 CA ASN A 99 -5.883 4.953 -16.148 1.00 0.00 C ATOM 1436 C ASN A 99 -6.361 5.460 -14.872 1.00 0.00 C ATOM 1437 O ASN A 99 -7.217 6.288 -14.791 1.00 0.00 O ATOM 1438 CB ASN A 99 -4.754 5.836 -16.711 1.00 0.00 C ATOM 1439 CG ASN A 99 -4.270 5.311 -18.051 1.00 0.00 C ATOM 1440 OD1 ASN A 99 -4.573 4.199 -18.430 1.00 0.00 O ATOM 1441 ND2 ASN A 99 -3.486 6.072 -18.773 1.00 0.00 N ATOM 0 HA ASN A 99 -5.447 3.966 -15.991 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -5.110 6.860 -16.825 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -3.923 5.864 -16.006 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -3.124 5.731 -19.664 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -3.238 7.005 -18.445 1.00 0.00 H new ATOM 1448 N VAL A 100 -5.810 4.925 -13.875 1.00 0.00 N ATOM 1449 CA VAL A 100 -6.200 5.244 -12.516 1.00 0.00 C ATOM 1450 C VAL A 100 -5.001 5.606 -11.707 1.00 0.00 C ATOM 1451 O VAL A 100 -3.896 5.164 -11.967 1.00 0.00 O ATOM 1452 CB VAL A 100 -6.792 3.950 -11.839 1.00 0.00 C ATOM 1453 CG1 VAL A 100 -7.629 4.289 -10.607 1.00 0.00 C ATOM 1454 CG2 VAL A 100 -7.663 3.155 -12.838 1.00 0.00 C ATOM 0 H VAL A 100 -5.060 4.238 -13.944 1.00 0.00 H new ATOM 0 HA VAL A 100 -6.917 6.064 -12.552 1.00 0.00 H new ATOM 0 HB VAL A 100 -5.944 3.340 -11.528 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -8.020 3.371 -10.169 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -7.007 4.805 -9.875 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -8.458 4.934 -10.897 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -8.060 2.266 -12.347 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -8.488 3.780 -13.179 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -7.056 2.857 -13.693 1.00 0.00 H new ATOM 1464 N THR A 101 -5.252 6.292 -10.672 1.00 0.00 N ATOM 1465 CA THR A 101 -4.246 6.605 -9.684 1.00 0.00 C ATOM 1466 C THR A 101 -4.885 6.100 -8.379 1.00 0.00 C ATOM 1467 O THR A 101 -6.094 5.884 -8.325 1.00 0.00 O ATOM 1468 CB THR A 101 -3.974 8.119 -9.617 1.00 0.00 C ATOM 1469 OG1 THR A 101 -3.189 8.506 -10.736 1.00 0.00 O ATOM 1470 CG2 THR A 101 -3.224 8.449 -8.314 1.00 0.00 C ATOM 0 H THR A 101 -6.174 6.672 -10.459 1.00 0.00 H new ATOM 0 HA THR A 101 -3.278 6.152 -9.899 1.00 0.00 H new ATOM 0 HB THR A 101 -4.919 8.662 -9.634 1.00 0.00 H new ATOM 0 HG1 THR A 101 -2.238 8.437 -10.508 1.00 0.00 H new ATOM 0 HG21 THR A 101 -3.031 9.521 -8.267 1.00 0.00 H new ATOM 0 HG22 THR A 101 -3.831 8.151 -7.459 1.00 0.00 H new ATOM 0 HG23 THR A 101 -2.277 7.909 -8.292 1.00 0.00 H new ATOM 1478 N VAL A 102 -4.129 5.888 -7.362 1.00 0.00 N ATOM 1479 CA VAL A 102 -4.727 5.374 -6.118 1.00 0.00 C ATOM 1480 C VAL A 102 -3.959 5.911 -4.926 1.00 0.00 C ATOM 1481 O VAL A 102 -2.806 5.602 -4.702 1.00 0.00 O ATOM 1482 CB VAL A 102 -4.755 3.844 -6.248 1.00 0.00 C ATOM 1483 CG1 VAL A 102 -4.844 3.135 -4.876 1.00 0.00 C ATOM 1484 CG2 VAL A 102 -5.967 3.489 -7.072 1.00 0.00 C ATOM 0 H VAL A 102 -3.122 6.047 -7.334 1.00 0.00 H new ATOM 0 HA VAL A 102 -5.751 5.710 -5.954 1.00 0.00 H new ATOM 0 HB VAL A 102 -3.828 3.511 -6.715 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -4.861 2.055 -5.025 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -3.979 3.404 -4.270 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -5.755 3.445 -4.365 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -6.024 2.407 -7.188 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -6.866 3.848 -6.570 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -5.889 3.956 -8.054 1.00 0.00 H new ATOM 1494 N THR A 103 -4.634 6.741 -4.171 1.00 0.00 N ATOM 1495 CA THR A 103 -4.024 7.388 -2.973 1.00 0.00 C ATOM 1496 C THR A 103 -4.605 6.728 -1.705 1.00 0.00 C ATOM 1497 O THR A 103 -5.745 6.970 -1.337 1.00 0.00 O ATOM 1498 CB THR A 103 -4.358 8.886 -3.009 1.00 0.00 C ATOM 1499 OG1 THR A 103 -5.714 9.060 -3.326 1.00 0.00 O ATOM 1500 CG2 THR A 103 -3.510 9.585 -4.083 1.00 0.00 C ATOM 0 H THR A 103 -5.605 7.002 -4.341 1.00 0.00 H new ATOM 0 HA THR A 103 -2.941 7.264 -2.968 1.00 0.00 H new ATOM 0 HB THR A 103 -4.144 9.317 -2.031 1.00 0.00 H new ATOM 0 HG1 THR A 103 -5.833 9.003 -4.297 1.00 0.00 H new ATOM 0 HG21 THR A 103 -3.752 10.648 -4.103 1.00 0.00 H new ATOM 0 HG22 THR A 103 -2.453 9.458 -3.851 1.00 0.00 H new ATOM 0 HG23 THR A 103 -3.723 9.146 -5.058 1.00 0.00 H new ATOM 1508 N LYS A 104 -3.829 5.866 -1.055 1.00 0.00 N ATOM 1509 CA LYS A 104 -4.325 5.143 0.177 1.00 0.00 C ATOM 1510 C LYS A 104 -4.005 5.949 1.442 1.00 0.00 C ATOM 1511 O LYS A 104 -2.852 6.079 1.830 1.00 0.00 O ATOM 1512 CB LYS A 104 -3.637 3.769 0.265 1.00 0.00 C ATOM 1513 CG LYS A 104 -4.195 2.979 1.459 1.00 0.00 C ATOM 1514 CD LYS A 104 -5.254 1.986 0.975 1.00 0.00 C ATOM 1515 CE LYS A 104 -5.248 0.750 1.874 1.00 0.00 C ATOM 1516 NZ LYS A 104 -4.091 -0.121 1.520 1.00 0.00 N ATOM 0 H LYS A 104 -2.874 5.635 -1.328 1.00 0.00 H new ATOM 0 HA LYS A 104 -5.406 5.021 0.103 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -3.799 3.212 -0.658 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -2.560 3.898 0.375 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -3.388 2.447 1.964 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -4.631 3.663 2.187 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -6.239 2.453 0.989 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -5.053 1.698 -0.057 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -5.184 1.049 2.920 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -6.181 0.198 1.757 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -4.190 -1.040 1.996 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -4.067 -0.265 0.490 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -3.207 0.334 1.827 1.00 0.00 H new ATOM 1530 N THR A 105 -5.029 6.459 2.109 1.00 0.00 N ATOM 1531 CA THR A 105 -4.792 7.235 3.383 1.00 0.00 C ATOM 1532 C THR A 105 -4.494 6.217 4.512 1.00 0.00 C ATOM 1533 O THR A 105 -3.898 5.176 4.256 1.00 0.00 O ATOM 1534 CB THR A 105 -6.027 8.096 3.736 1.00 0.00 C ATOM 1535 OG1 THR A 105 -7.086 7.253 4.148 1.00 0.00 O ATOM 1536 CG2 THR A 105 -6.463 8.929 2.523 1.00 0.00 C ATOM 0 H THR A 105 -6.006 6.372 1.830 1.00 0.00 H new ATOM 0 HA THR A 105 -3.948 7.914 3.257 1.00 0.00 H new ATOM 0 HB THR A 105 -5.766 8.776 4.547 1.00 0.00 H new ATOM 0 HG1 THR A 105 -7.752 7.190 3.432 1.00 0.00 H new ATOM 0 HG21 THR A 105 -7.333 9.529 2.788 1.00 0.00 H new ATOM 0 HG22 THR A 105 -5.647 9.586 2.221 1.00 0.00 H new ATOM 0 HG23 THR A 105 -6.718 8.264 1.698 1.00 0.00 H new ATOM 1544 N ASP A 106 -4.900 6.501 5.756 1.00 0.00 N ATOM 1545 CA ASP A 106 -4.635 5.546 6.879 1.00 0.00 C ATOM 1546 C ASP A 106 -5.822 4.590 7.047 1.00 0.00 C ATOM 1547 O ASP A 106 -5.635 3.409 7.300 1.00 0.00 O ATOM 1548 CB ASP A 106 -4.422 6.323 8.167 1.00 0.00 C ATOM 1549 CG ASP A 106 -3.849 5.388 9.231 1.00 0.00 C ATOM 1550 OD1 ASP A 106 -2.639 5.245 9.275 1.00 0.00 O ATOM 1551 OD2 ASP A 106 -4.630 4.829 9.980 1.00 0.00 O ATOM 0 H ASP A 106 -5.398 7.350 6.022 1.00 0.00 H new ATOM 0 HA ASP A 106 -3.741 4.966 6.650 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -3.741 7.157 7.994 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -5.366 6.748 8.509 1.00 0.00 H new ATOM 1556 N LYS A 107 -7.051 5.095 6.913 1.00 0.00 N ATOM 1557 CA LYS A 107 -8.269 4.208 7.072 1.00 0.00 C ATOM 1558 C LYS A 107 -9.197 4.329 5.851 1.00 0.00 C ATOM 1559 O LYS A 107 -10.332 3.895 5.898 1.00 0.00 O ATOM 1560 CB LYS A 107 -9.063 4.614 8.323 1.00 0.00 C ATOM 1561 CG LYS A 107 -8.132 4.832 9.507 1.00 0.00 C ATOM 1562 CD LYS A 107 -8.972 4.919 10.785 1.00 0.00 C ATOM 1563 CE LYS A 107 -8.062 5.177 11.988 1.00 0.00 C ATOM 1564 NZ LYS A 107 -7.011 4.115 12.068 1.00 0.00 N ATOM 0 H LYS A 107 -7.255 6.072 6.703 1.00 0.00 H new ATOM 0 HA LYS A 107 -7.919 3.180 7.165 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -9.624 5.527 8.123 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -9.791 3.839 8.565 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -7.417 4.013 9.580 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -7.556 5.747 9.371 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -9.706 5.720 10.695 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -9.527 3.992 10.930 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -7.595 6.158 11.898 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -8.651 5.188 12.905 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -6.633 4.073 13.036 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -7.427 3.195 11.819 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -6.241 4.338 11.405 1.00 0.00 H new ATOM 1578 N THR A 108 -8.722 4.896 4.755 1.00 0.00 N ATOM 1579 CA THR A 108 -9.574 5.027 3.538 1.00 0.00 C ATOM 1580 C THR A 108 -8.730 4.617 2.328 1.00 0.00 C ATOM 1581 O THR A 108 -7.504 4.614 2.377 1.00 0.00 O ATOM 1582 CB THR A 108 -10.111 6.473 3.402 1.00 0.00 C ATOM 1583 OG1 THR A 108 -9.113 7.328 2.867 1.00 0.00 O ATOM 1584 CG2 THR A 108 -10.543 6.979 4.785 1.00 0.00 C ATOM 0 H THR A 108 -7.778 5.271 4.661 1.00 0.00 H new ATOM 0 HA THR A 108 -10.446 4.377 3.608 1.00 0.00 H new ATOM 0 HB THR A 108 -10.964 6.475 2.723 1.00 0.00 H new ATOM 0 HG1 THR A 108 -9.049 7.191 1.899 1.00 0.00 H new ATOM 0 HG21 THR A 108 -10.922 7.997 4.698 1.00 0.00 H new ATOM 0 HG22 THR A 108 -11.326 6.332 5.181 1.00 0.00 H new ATOM 0 HG23 THR A 108 -9.687 6.967 5.460 1.00 0.00 H new ATOM 1592 N LEU A 109 -9.384 4.241 1.279 1.00 0.00 N ATOM 1593 CA LEU A 109 -8.701 3.770 0.040 1.00 0.00 C ATOM 1594 C LEU A 109 -9.255 4.634 -1.116 1.00 0.00 C ATOM 1595 O LEU A 109 -10.280 4.298 -1.686 1.00 0.00 O ATOM 1596 CB LEU A 109 -9.125 2.289 -0.141 1.00 0.00 C ATOM 1597 CG LEU A 109 -8.054 1.419 -0.796 1.00 0.00 C ATOM 1598 CD1 LEU A 109 -8.739 0.213 -1.393 1.00 0.00 C ATOM 1599 CD2 LEU A 109 -7.347 2.149 -1.888 1.00 0.00 C ATOM 0 H LEU A 109 -10.402 4.238 1.220 1.00 0.00 H new ATOM 0 HA LEU A 109 -7.614 3.850 0.073 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -9.375 1.870 0.834 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -10.031 2.251 -0.746 1.00 0.00 H new ATOM 0 HG LEU A 109 -7.319 1.138 -0.042 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -7.997 -0.428 -1.869 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -9.248 -0.343 -0.606 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -9.467 0.539 -2.136 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -6.592 1.499 -2.331 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -8.065 2.444 -2.653 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -6.866 3.038 -1.479 1.00 0.00 H new ATOM 1611 N VAL A 110 -8.614 5.766 -1.464 1.00 0.00 N ATOM 1612 CA VAL A 110 -9.184 6.623 -2.535 1.00 0.00 C ATOM 1613 C VAL A 110 -8.675 6.139 -3.881 1.00 0.00 C ATOM 1614 O VAL A 110 -7.494 5.848 -4.047 1.00 0.00 O ATOM 1615 CB VAL A 110 -8.789 8.126 -2.274 1.00 0.00 C ATOM 1616 CG1 VAL A 110 -8.713 8.921 -3.594 1.00 0.00 C ATOM 1617 CG2 VAL A 110 -9.852 8.789 -1.369 1.00 0.00 C ATOM 0 H VAL A 110 -7.745 6.101 -1.048 1.00 0.00 H new ATOM 0 HA VAL A 110 -10.272 6.558 -2.535 1.00 0.00 H new ATOM 0 HB VAL A 110 -7.810 8.136 -1.794 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -8.438 9.954 -3.381 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -7.963 8.473 -4.246 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -9.684 8.898 -4.089 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -9.579 9.829 -1.188 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -10.824 8.749 -1.860 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -9.904 8.257 -0.419 1.00 0.00 H new ATOM 1627 N LEU A 111 -9.560 6.095 -4.843 1.00 0.00 N ATOM 1628 CA LEU A 111 -9.187 5.691 -6.199 1.00 0.00 C ATOM 1629 C LEU A 111 -9.640 6.787 -7.132 1.00 0.00 C ATOM 1630 O LEU A 111 -10.656 7.428 -6.917 1.00 0.00 O ATOM 1631 CB LEU A 111 -9.872 4.364 -6.621 1.00 0.00 C ATOM 1632 CG LEU A 111 -9.819 3.345 -5.488 1.00 0.00 C ATOM 1633 CD1 LEU A 111 -10.999 2.393 -5.605 1.00 0.00 C ATOM 1634 CD2 LEU A 111 -8.527 2.532 -5.562 1.00 0.00 C ATOM 0 H LEU A 111 -10.545 6.331 -4.726 1.00 0.00 H new ATOM 0 HA LEU A 111 -8.109 5.532 -6.238 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -10.909 4.556 -6.896 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -9.378 3.959 -7.504 1.00 0.00 H new ATOM 0 HG LEU A 111 -9.857 3.880 -4.539 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -10.961 1.665 -4.795 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -11.929 2.957 -5.542 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -10.954 1.874 -6.562 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -8.505 1.809 -4.746 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -8.483 2.005 -6.515 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -7.671 3.201 -5.477 1.00 0.00 H new ATOM 1646 N LEU A 112 -8.898 6.997 -8.141 1.00 0.00 N ATOM 1647 CA LEU A 112 -9.218 8.010 -9.154 1.00 0.00 C ATOM 1648 C LEU A 112 -9.037 7.288 -10.452 1.00 0.00 C ATOM 1649 O LEU A 112 -7.941 7.185 -10.949 1.00 0.00 O ATOM 1650 CB LEU A 112 -8.209 9.132 -9.024 1.00 0.00 C ATOM 1651 CG LEU A 112 -8.436 10.353 -9.989 1.00 0.00 C ATOM 1652 CD1 LEU A 112 -9.661 10.215 -10.924 1.00 0.00 C ATOM 1653 CD2 LEU A 112 -8.572 11.603 -9.141 1.00 0.00 C ATOM 0 H LEU A 112 -8.035 6.485 -8.323 1.00 0.00 H new ATOM 0 HA LEU A 112 -10.216 8.439 -9.063 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -8.223 9.494 -7.996 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -7.214 8.727 -9.205 1.00 0.00 H new ATOM 0 HG LEU A 112 -7.574 10.401 -10.654 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -9.740 11.102 -11.553 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -9.541 9.333 -11.553 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -10.566 10.113 -10.325 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -8.731 12.466 -9.788 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -9.421 11.494 -8.466 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -7.662 11.748 -8.559 1.00 0.00 H new ATOM 1665 N MET A 113 -10.071 6.745 -10.986 1.00 0.00 N ATOM 1666 CA MET A 113 -9.889 5.927 -12.246 1.00 0.00 C ATOM 1667 C MET A 113 -10.228 6.721 -13.422 1.00 0.00 C ATOM 1668 O MET A 113 -10.983 7.658 -13.343 1.00 0.00 O ATOM 1669 CB MET A 113 -10.789 4.595 -12.204 1.00 0.00 C ATOM 1670 CG MET A 113 -11.236 4.147 -13.668 1.00 0.00 C ATOM 1671 SD MET A 113 -12.176 2.600 -13.673 1.00 0.00 S ATOM 1672 CE MET A 113 -12.850 2.765 -15.346 1.00 0.00 C ATOM 0 H MET A 113 -11.026 6.814 -10.634 1.00 0.00 H new ATOM 0 HA MET A 113 -8.841 5.632 -12.306 1.00 0.00 H new ATOM 0 HB2 MET A 113 -10.227 3.789 -11.731 1.00 0.00 H new ATOM 0 HB3 MET A 113 -11.672 4.770 -11.590 1.00 0.00 H new ATOM 0 HG2 MET A 113 -11.841 4.936 -14.115 1.00 0.00 H new ATOM 0 HG3 MET A 113 -10.351 4.031 -14.293 1.00 0.00 H new ATOM 0 HE1 MET A 113 -13.906 3.027 -15.288 1.00 0.00 H new ATOM 0 HE2 MET A 113 -12.310 3.547 -15.880 1.00 0.00 H new ATOM 0 HE3 MET A 113 -12.739 1.820 -15.878 1.00 0.00 H new ATOM 1682 N GLY A 114 -9.724 6.274 -14.556 1.00 0.00 N ATOM 1683 CA GLY A 114 -10.108 6.909 -15.807 1.00 0.00 C ATOM 1684 C GLY A 114 -9.072 7.030 -16.945 1.00 0.00 C ATOM 1685 O GLY A 114 -7.922 7.391 -16.775 1.00 0.00 O ATOM 0 H GLY A 114 -9.068 5.498 -14.641 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -10.965 6.363 -16.201 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -10.453 7.916 -15.570 1.00 0.00 H new ATOM 1773 N GLY A 121 -0.826 10.964 -15.054 1.00 0.00 N ATOM 1774 CA GLY A 121 0.049 11.936 -14.309 1.00 0.00 C ATOM 1775 C GLY A 121 -0.838 13.068 -13.803 1.00 0.00 C ATOM 1776 O GLY A 121 -0.659 13.576 -12.704 1.00 0.00 O ATOM 0 HA2 GLY A 121 0.548 11.440 -13.476 1.00 0.00 H new ATOM 0 HA3 GLY A 121 0.830 12.325 -14.962 1.00 0.00 H new ATOM 1780 N LEU A 122 -1.833 13.428 -14.598 1.00 0.00 N ATOM 1781 CA LEU A 122 -2.814 14.496 -14.196 1.00 0.00 C ATOM 1782 C LEU A 122 -3.757 13.848 -13.249 1.00 0.00 C ATOM 1783 O LEU A 122 -4.130 14.423 -12.272 1.00 0.00 O ATOM 1784 CB LEU A 122 -3.621 15.014 -15.398 1.00 0.00 C ATOM 1785 CG LEU A 122 -2.748 15.118 -16.661 1.00 0.00 C ATOM 1786 CD1 LEU A 122 -3.516 14.534 -17.846 1.00 0.00 C ATOM 1787 CD2 LEU A 122 -2.414 16.586 -16.925 1.00 0.00 C ATOM 0 H LEU A 122 -2.005 13.020 -15.517 1.00 0.00 H new ATOM 0 HA LEU A 122 -2.282 15.344 -13.765 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -4.461 14.346 -15.589 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -4.039 15.992 -15.162 1.00 0.00 H new ATOM 0 HG LEU A 122 -1.821 14.562 -16.522 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -2.905 14.604 -18.746 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -3.752 13.488 -17.647 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -4.440 15.093 -17.991 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -1.796 16.663 -17.819 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -3.336 17.148 -17.072 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -1.872 16.995 -16.072 1.00 0.00 H new ATOM 1799 N ILE A 123 -4.112 12.599 -13.531 1.00 0.00 N ATOM 1800 CA ILE A 123 -4.999 11.826 -12.624 1.00 0.00 C ATOM 1801 C ILE A 123 -4.222 11.627 -11.332 1.00 0.00 C ATOM 1802 O ILE A 123 -4.780 11.672 -10.260 1.00 0.00 O ATOM 1803 CB ILE A 123 -5.285 10.480 -13.267 1.00 0.00 C ATOM 1804 CG1 ILE A 123 -6.119 10.684 -14.556 1.00 0.00 C ATOM 1805 CG2 ILE A 123 -6.056 9.541 -12.300 1.00 0.00 C ATOM 1806 CD1 ILE A 123 -6.281 9.342 -15.258 1.00 0.00 C ATOM 0 H ILE A 123 -3.812 12.093 -14.364 1.00 0.00 H new ATOM 0 HA ILE A 123 -5.944 12.336 -12.435 1.00 0.00 H new ATOM 0 HB ILE A 123 -4.330 10.014 -13.508 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -7.096 11.101 -14.311 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -5.625 11.397 -15.216 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -6.244 8.587 -12.792 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -5.461 9.375 -11.402 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -7.005 10.001 -12.026 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -6.867 9.475 -16.167 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -5.299 8.945 -15.514 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -6.793 8.644 -14.595 1.00 0.00 H new ATOM 1818 N ASN A 124 -2.907 11.425 -11.451 1.00 0.00 N ATOM 1819 CA ASN A 124 -2.050 11.259 -10.244 1.00 0.00 C ATOM 1820 C ASN A 124 -2.096 12.559 -9.441 1.00 0.00 C ATOM 1821 O ASN A 124 -1.951 12.563 -8.228 1.00 0.00 O ATOM 1822 CB ASN A 124 -0.605 10.972 -10.660 1.00 0.00 C ATOM 1823 CG ASN A 124 0.213 10.623 -9.417 1.00 0.00 C ATOM 1824 OD1 ASN A 124 0.097 9.536 -8.887 1.00 0.00 O ATOM 1825 ND2 ASN A 124 1.039 11.503 -8.922 1.00 0.00 N ATOM 0 H ASN A 124 -2.410 11.371 -12.340 1.00 0.00 H new ATOM 0 HA ASN A 124 -2.415 10.425 -9.644 1.00 0.00 H new ATOM 0 HB2 ASN A 124 -0.576 10.148 -11.373 1.00 0.00 H new ATOM 0 HB3 ASN A 124 -0.178 11.841 -11.160 1.00 0.00 H new ATOM 0 HD21 ASN A 124 1.586 11.278 -8.091 1.00 0.00 H new ATOM 0 HD22 ASN A 124 1.138 12.416 -9.366 1.00 0.00 H new ATOM 1832 N LYS A 125 -2.307 13.669 -10.135 1.00 0.00 N ATOM 1833 CA LYS A 125 -2.377 15.022 -9.453 1.00 0.00 C ATOM 1834 C LYS A 125 -3.786 15.223 -8.845 1.00 0.00 C ATOM 1835 O LYS A 125 -3.940 15.847 -7.795 1.00 0.00 O ATOM 1836 CB LYS A 125 -2.116 16.122 -10.506 1.00 0.00 C ATOM 1837 CG LYS A 125 -0.625 16.155 -10.879 1.00 0.00 C ATOM 1838 CD LYS A 125 0.137 17.048 -9.888 1.00 0.00 C ATOM 1839 CE LYS A 125 1.283 17.767 -10.609 1.00 0.00 C ATOM 1840 NZ LYS A 125 0.724 18.762 -11.567 1.00 0.00 N ATOM 0 H LYS A 125 -2.434 13.696 -11.147 1.00 0.00 H new ATOM 0 HA LYS A 125 -1.631 15.076 -8.660 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -2.717 15.934 -11.396 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -2.422 17.092 -10.113 1.00 0.00 H new ATOM 0 HG2 LYS A 125 -0.214 15.146 -10.864 1.00 0.00 H new ATOM 0 HG3 LYS A 125 -0.502 16.534 -11.894 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -0.542 17.778 -9.447 1.00 0.00 H new ATOM 0 HD3 LYS A 125 0.532 16.445 -9.070 1.00 0.00 H new ATOM 0 HE2 LYS A 125 1.926 18.266 -9.884 1.00 0.00 H new ATOM 0 HE3 LYS A 125 1.903 17.044 -11.140 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 1.379 19.565 -11.656 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 0.597 18.315 -12.497 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 -0.195 19.102 -11.218 1.00 0.00 H new ATOM 1854 N LYS A 126 -4.811 14.689 -9.502 1.00 0.00 N ATOM 1855 CA LYS A 126 -6.216 14.832 -8.999 1.00 0.00 C ATOM 1856 C LYS A 126 -6.504 13.773 -7.928 1.00 0.00 C ATOM 1857 O LYS A 126 -7.458 13.897 -7.185 1.00 0.00 O ATOM 1858 CB LYS A 126 -7.196 14.652 -10.160 1.00 0.00 C ATOM 1859 CG LYS A 126 -7.475 16.005 -10.821 1.00 0.00 C ATOM 1860 CD LYS A 126 -6.543 16.196 -12.021 1.00 0.00 C ATOM 1861 CE LYS A 126 -6.913 15.204 -13.136 1.00 0.00 C ATOM 1862 NZ LYS A 126 -6.840 15.900 -14.456 1.00 0.00 N ATOM 0 H LYS A 126 -4.722 14.159 -10.369 1.00 0.00 H new ATOM 0 HA LYS A 126 -6.336 15.824 -8.564 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -6.783 13.958 -10.892 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -8.127 14.216 -9.797 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -8.515 16.055 -11.144 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -7.326 16.810 -10.101 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -6.619 17.218 -12.392 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -5.508 16.044 -11.716 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -6.233 14.352 -13.122 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -7.917 14.813 -12.973 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -6.566 15.219 -15.193 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -7.770 16.305 -14.687 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -6.133 16.661 -14.408 1.00 0.00 H new ATOM 1876 N CYS A 127 -5.664 12.741 -7.830 1.00 0.00 N ATOM 1877 CA CYS A 127 -5.851 11.672 -6.780 1.00 0.00 C ATOM 1878 C CYS A 127 -5.093 12.117 -5.558 1.00 0.00 C ATOM 1879 O CYS A 127 -5.474 11.841 -4.448 1.00 0.00 O ATOM 1880 CB CYS A 127 -5.280 10.346 -7.255 1.00 0.00 C ATOM 1881 SG CYS A 127 -6.144 8.986 -6.421 1.00 0.00 S ATOM 0 H CYS A 127 -4.857 12.601 -8.438 1.00 0.00 H new ATOM 0 HA CYS A 127 -6.912 11.533 -6.573 1.00 0.00 H new ATOM 0 HB2 CYS A 127 -5.392 10.255 -8.335 1.00 0.00 H new ATOM 0 HB3 CYS A 127 -4.212 10.299 -7.041 1.00 0.00 H new ATOM 0 HG CYS A 127 -6.389 8.038 -7.276 1.00 0.00 H new ATOM 1887 N TYR A 128 -4.016 12.834 -5.784 1.00 0.00 N ATOM 1888 CA TYR A 128 -3.199 13.379 -4.694 1.00 0.00 C ATOM 1889 C TYR A 128 -4.041 14.483 -4.014 1.00 0.00 C ATOM 1890 O TYR A 128 -3.937 14.714 -2.819 1.00 0.00 O ATOM 1891 CB TYR A 128 -1.926 13.947 -5.343 1.00 0.00 C ATOM 1892 CG TYR A 128 -0.941 14.468 -4.334 1.00 0.00 C ATOM 1893 CD1 TYR A 128 -0.793 13.868 -3.073 1.00 0.00 C ATOM 1894 CD2 TYR A 128 -0.153 15.557 -4.690 1.00 0.00 C ATOM 1895 CE1 TYR A 128 0.148 14.368 -2.170 1.00 0.00 C ATOM 1896 CE2 TYR A 128 0.790 16.064 -3.789 1.00 0.00 C ATOM 1897 CZ TYR A 128 0.940 15.470 -2.525 1.00 0.00 C ATOM 1898 OH TYR A 128 1.870 15.968 -1.636 1.00 0.00 O ATOM 0 H TYR A 128 -3.673 13.062 -6.717 1.00 0.00 H new ATOM 0 HA TYR A 128 -2.916 12.642 -3.943 1.00 0.00 H new ATOM 0 HB2 TYR A 128 -1.450 13.169 -5.941 1.00 0.00 H new ATOM 0 HB3 TYR A 128 -2.200 14.751 -6.026 1.00 0.00 H new ATOM 0 HD1 TYR A 128 -1.406 13.021 -2.802 1.00 0.00 H new ATOM 0 HD2 TYR A 128 -0.269 16.012 -5.663 1.00 0.00 H new ATOM 0 HE1 TYR A 128 0.266 13.907 -1.200 1.00 0.00 H new ATOM 0 HE2 TYR A 128 1.401 16.910 -4.065 1.00 0.00 H new ATOM 0 HH TYR A 128 2.333 16.731 -2.041 1.00 0.00 H new ATOM 1908 N GLU A 129 -4.916 15.144 -4.795 1.00 0.00 N ATOM 1909 CA GLU A 129 -5.819 16.213 -4.232 1.00 0.00 C ATOM 1910 C GLU A 129 -7.072 15.540 -3.621 1.00 0.00 C ATOM 1911 O GLU A 129 -7.591 15.960 -2.585 1.00 0.00 O ATOM 1912 CB GLU A 129 -6.240 17.161 -5.359 1.00 0.00 C ATOM 1913 CG GLU A 129 -5.106 18.151 -5.645 1.00 0.00 C ATOM 1914 CD GLU A 129 -5.229 19.356 -4.709 1.00 0.00 C ATOM 1915 OE1 GLU A 129 -6.043 20.220 -4.992 1.00 0.00 O ATOM 1916 OE2 GLU A 129 -4.509 19.394 -3.725 1.00 0.00 O ATOM 0 H GLU A 129 -5.030 14.976 -5.795 1.00 0.00 H new ATOM 0 HA GLU A 129 -5.295 16.779 -3.462 1.00 0.00 H new ATOM 0 HB2 GLU A 129 -6.476 16.592 -6.258 1.00 0.00 H new ATOM 0 HB3 GLU A 129 -7.145 17.700 -5.077 1.00 0.00 H new ATOM 0 HG2 GLU A 129 -4.141 17.665 -5.504 1.00 0.00 H new ATOM 0 HG3 GLU A 129 -5.149 18.479 -6.684 1.00 0.00 H new ATOM 1923 N MET A 130 -7.537 14.473 -4.250 1.00 0.00 N ATOM 1924 CA MET A 130 -8.738 13.714 -3.738 1.00 0.00 C ATOM 1925 C MET A 130 -8.378 13.221 -2.297 1.00 0.00 C ATOM 1926 O MET A 130 -9.141 13.373 -1.328 1.00 0.00 O ATOM 1927 CB MET A 130 -8.976 12.506 -4.704 1.00 0.00 C ATOM 1928 CG MET A 130 -10.477 12.134 -4.808 1.00 0.00 C ATOM 1929 SD MET A 130 -10.644 10.497 -5.552 1.00 0.00 S ATOM 1930 CE MET A 130 -12.389 10.236 -5.149 1.00 0.00 C ATOM 0 H MET A 130 -7.131 14.093 -5.105 1.00 0.00 H new ATOM 0 HA MET A 130 -9.643 14.320 -3.701 1.00 0.00 H new ATOM 0 HB2 MET A 130 -8.594 12.753 -5.695 1.00 0.00 H new ATOM 0 HB3 MET A 130 -8.412 11.643 -4.351 1.00 0.00 H new ATOM 0 HG2 MET A 130 -10.934 12.143 -3.818 1.00 0.00 H new ATOM 0 HG3 MET A 130 -11.005 12.874 -5.410 1.00 0.00 H new ATOM 0 HE1 MET A 130 -12.555 9.185 -4.913 1.00 0.00 H new ATOM 0 HE2 MET A 130 -12.659 10.848 -4.288 1.00 0.00 H new ATOM 0 HE3 MET A 130 -13.006 10.518 -6.003 1.00 0.00 H new ATOM 1940 N ALA A 131 -7.179 12.685 -2.163 1.00 0.00 N ATOM 1941 CA ALA A 131 -6.671 12.203 -0.839 1.00 0.00 C ATOM 1942 C ALA A 131 -6.170 13.380 -0.027 1.00 0.00 C ATOM 1943 O ALA A 131 -6.028 13.267 1.173 1.00 0.00 O ATOM 1944 CB ALA A 131 -5.528 11.216 -1.056 1.00 0.00 C ATOM 0 H ALA A 131 -6.523 12.562 -2.934 1.00 0.00 H new ATOM 0 HA ALA A 131 -7.481 11.709 -0.303 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -5.160 10.867 -0.091 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -5.887 10.366 -1.637 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -4.719 11.709 -1.596 1.00 0.00 H new ATOM 1950 N SER A 132 -5.912 14.536 -0.665 1.00 0.00 N ATOM 1951 CA SER A 132 -5.453 15.727 0.112 1.00 0.00 C ATOM 1952 C SER A 132 -6.571 16.074 1.098 1.00 0.00 C ATOM 1953 O SER A 132 -6.307 16.530 2.203 1.00 0.00 O ATOM 1954 CB SER A 132 -5.133 16.913 -0.822 1.00 0.00 C ATOM 1955 OG SER A 132 -6.334 17.562 -1.241 1.00 0.00 O ATOM 0 H SER A 132 -6.004 14.681 -1.670 1.00 0.00 H new ATOM 0 HA SER A 132 -4.529 15.506 0.647 1.00 0.00 H new ATOM 0 HB2 SER A 132 -4.489 17.626 -0.306 1.00 0.00 H new ATOM 0 HB3 SER A 132 -4.582 16.558 -1.693 1.00 0.00 H new ATOM 0 HG SER A 132 -7.050 16.899 -1.331 1.00 0.00 H new ATOM 1961 N HIS A 133 -7.843 15.799 0.715 1.00 0.00 N ATOM 1962 CA HIS A 133 -8.969 16.055 1.671 1.00 0.00 C ATOM 1963 C HIS A 133 -9.031 14.900 2.632 1.00 0.00 C ATOM 1964 O HIS A 133 -9.235 15.101 3.813 1.00 0.00 O ATOM 1965 CB HIS A 133 -10.325 16.205 0.999 1.00 0.00 C ATOM 1966 CG HIS A 133 -11.229 16.866 1.998 1.00 0.00 C ATOM 1967 ND1 HIS A 133 -11.164 18.226 2.272 1.00 0.00 N ATOM 1968 CD2 HIS A 133 -12.206 16.365 2.821 1.00 0.00 C ATOM 1969 CE1 HIS A 133 -12.077 18.490 3.229 1.00 0.00 C ATOM 1970 NE2 HIS A 133 -12.737 17.389 3.598 1.00 0.00 N ATOM 0 H HIS A 133 -8.114 15.422 -0.193 1.00 0.00 H new ATOM 0 HA HIS A 133 -8.764 17.003 2.168 1.00 0.00 H new ATOM 0 HB2 HIS A 133 -10.244 16.806 0.093 1.00 0.00 H new ATOM 0 HB3 HIS A 133 -10.720 15.233 0.703 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -12.516 15.331 2.860 1.00 0.00 H new ATOM 0 HE1 HIS A 133 -12.253 19.471 3.646 1.00 0.00 H new ATOM 0 HE2 HIS A 133 -13.473 17.315 4.300 1.00 0.00 H new ATOM 1978 N LEU A 134 -8.830 13.658 2.144 1.00 0.00 N ATOM 1979 CA LEU A 134 -8.848 12.473 3.089 1.00 0.00 C ATOM 1980 C LEU A 134 -7.618 12.495 4.005 1.00 0.00 C ATOM 1981 O LEU A 134 -7.547 11.749 4.975 1.00 0.00 O ATOM 1982 CB LEU A 134 -8.906 11.181 2.298 1.00 0.00 C ATOM 1983 CG LEU A 134 -10.311 11.043 1.705 1.00 0.00 C ATOM 1984 CD1 LEU A 134 -10.308 11.454 0.241 1.00 0.00 C ATOM 1985 CD2 LEU A 134 -10.789 9.600 1.828 1.00 0.00 C ATOM 0 H LEU A 134 -8.661 13.434 1.163 1.00 0.00 H new ATOM 0 HA LEU A 134 -9.737 12.537 3.717 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -8.158 11.187 1.505 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -8.680 10.331 2.942 1.00 0.00 H new ATOM 0 HG LEU A 134 -10.987 11.696 2.257 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -11.313 11.351 -0.168 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -9.986 12.492 0.155 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -9.623 10.814 -0.315 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -11.789 9.511 1.404 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -10.106 8.943 1.289 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -10.814 9.313 2.879 1.00 0.00 H new ATOM 1997 N ARG A 135 -6.691 13.388 3.741 1.00 0.00 N ATOM 1998 CA ARG A 135 -5.494 13.552 4.608 1.00 0.00 C ATOM 1999 C ARG A 135 -5.856 14.646 5.596 1.00 0.00 C ATOM 2000 O ARG A 135 -5.558 14.559 6.779 1.00 0.00 O ATOM 2001 CB ARG A 135 -4.294 13.961 3.755 1.00 0.00 C ATOM 2002 CG ARG A 135 -3.563 12.712 3.276 1.00 0.00 C ATOM 2003 CD ARG A 135 -2.665 12.189 4.394 1.00 0.00 C ATOM 2004 NE ARG A 135 -1.348 12.871 4.323 1.00 0.00 N ATOM 2005 CZ ARG A 135 -0.701 13.160 5.419 1.00 0.00 C ATOM 2006 NH1 ARG A 135 0.121 12.293 5.936 1.00 0.00 N ATOM 2007 NH2 ARG A 135 -0.884 14.314 6.002 1.00 0.00 N ATOM 0 H ARG A 135 -6.721 14.021 2.941 1.00 0.00 H new ATOM 0 HA ARG A 135 -5.223 12.630 5.123 1.00 0.00 H new ATOM 0 HB2 ARG A 135 -4.626 14.552 2.901 1.00 0.00 H new ATOM 0 HB3 ARG A 135 -3.619 14.590 4.335 1.00 0.00 H new ATOM 0 HG2 ARG A 135 -4.282 11.946 2.984 1.00 0.00 H new ATOM 0 HG3 ARG A 135 -2.966 12.943 2.393 1.00 0.00 H new ATOM 0 HD2 ARG A 135 -3.129 12.369 5.364 1.00 0.00 H new ATOM 0 HD3 ARG A 135 -2.535 11.111 4.298 1.00 0.00 H new ATOM 0 HE ARG A 135 -0.948 13.114 3.417 1.00 0.00 H new ATOM 0 HH11 ARG A 135 0.259 11.389 5.485 1.00 0.00 H new ATOM 0 HH12 ARG A 135 0.627 12.518 6.793 1.00 0.00 H new ATOM 0 HH21 ARG A 135 -1.533 14.991 5.601 1.00 0.00 H new ATOM 0 HH22 ARG A 135 -0.378 14.539 6.859 1.00 0.00 H new ATOM 2021 N ARG A 136 -6.589 15.651 5.111 1.00 0.00 N ATOM 2022 CA ARG A 136 -7.089 16.732 5.991 1.00 0.00 C ATOM 2023 C ARG A 136 -8.368 16.223 6.699 1.00 0.00 C ATOM 2024 O ARG A 136 -8.934 16.902 7.545 1.00 0.00 O ATOM 2025 CB ARG A 136 -7.427 17.959 5.146 1.00 0.00 C ATOM 2026 CG ARG A 136 -6.133 18.634 4.660 1.00 0.00 C ATOM 2027 CD ARG A 136 -5.833 19.868 5.516 1.00 0.00 C ATOM 2028 NE ARG A 136 -7.035 20.753 5.565 1.00 0.00 N ATOM 2029 CZ ARG A 136 -7.212 21.554 6.579 1.00 0.00 C ATOM 2030 NH1 ARG A 136 -6.232 22.314 6.987 1.00 0.00 N ATOM 2031 NH2 ARG A 136 -8.367 21.596 7.184 1.00 0.00 N ATOM 0 H ARG A 136 -6.851 15.747 4.130 1.00 0.00 H new ATOM 0 HA ARG A 136 -6.332 17.005 6.727 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -8.037 17.666 4.292 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -8.017 18.664 5.732 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -5.302 17.931 4.718 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -6.234 18.923 3.614 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -5.553 19.563 6.524 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -4.985 20.413 5.101 1.00 0.00 H new ATOM 0 HE ARG A 136 -7.717 20.731 4.806 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -5.329 22.281 6.513 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -6.369 22.941 7.780 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -9.132 21.002 6.864 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -8.505 22.223 7.977 1.00 0.00 H new ATOM 2045 N SER A 137 -8.809 15.006 6.354 1.00 0.00 N ATOM 2046 CA SER A 137 -10.010 14.404 6.972 1.00 0.00 C ATOM 2047 C SER A 137 -9.608 13.789 8.330 1.00 0.00 C ATOM 2048 O SER A 137 -10.447 13.581 9.195 1.00 0.00 O ATOM 2049 CB SER A 137 -10.561 13.318 6.014 1.00 0.00 C ATOM 2050 OG SER A 137 -9.740 12.158 6.070 1.00 0.00 O ATOM 0 H SER A 137 -8.358 14.417 5.654 1.00 0.00 H new ATOM 0 HA SER A 137 -10.785 15.152 7.141 1.00 0.00 H new ATOM 0 HB2 SER A 137 -11.584 13.063 6.290 1.00 0.00 H new ATOM 0 HB3 SER A 137 -10.592 13.703 4.995 1.00 0.00 H new ATOM 0 HG SER A 137 -8.797 12.424 6.071 1.00 0.00 H new ATOM 2056 N GLN A 138 -8.305 13.497 8.517 1.00 0.00 N ATOM 2057 CA GLN A 138 -7.812 12.897 9.813 1.00 0.00 C ATOM 2058 C GLN A 138 -8.214 11.418 9.878 1.00 0.00 C ATOM 2059 O GLN A 138 -8.410 10.859 10.957 1.00 0.00 O ATOM 2060 CB GLN A 138 -8.407 13.671 11.021 1.00 0.00 C ATOM 2061 CG GLN A 138 -7.266 14.210 11.907 1.00 0.00 C ATOM 2062 CD GLN A 138 -7.827 14.789 13.227 1.00 0.00 C ATOM 2063 OE1 GLN A 138 -8.971 14.557 13.588 1.00 0.00 O ATOM 2064 NE2 GLN A 138 -7.056 15.534 13.970 1.00 0.00 N ATOM 0 H GLN A 138 -7.578 13.655 7.819 1.00 0.00 H new ATOM 0 HA GLN A 138 -6.726 12.974 9.855 1.00 0.00 H new ATOM 0 HB2 GLN A 138 -9.026 14.495 10.667 1.00 0.00 H new ATOM 0 HB3 GLN A 138 -9.053 13.014 11.603 1.00 0.00 H new ATOM 0 HG2 GLN A 138 -6.560 13.409 12.126 1.00 0.00 H new ATOM 0 HG3 GLN A 138 -6.716 14.982 11.370 1.00 0.00 H new ATOM 0 HE21 GLN A 138 -6.100 15.732 13.675 1.00 0.00 H new ATOM 0 HE22 GLN A 138 -7.409 15.919 14.846 1.00 0.00 H new ATOM 2073 N TYR A 139 -8.321 10.776 8.724 1.00 0.00 N ATOM 2074 CA TYR A 139 -8.690 9.326 8.684 1.00 0.00 C ATOM 2075 C TYR A 139 -7.422 8.493 8.504 1.00 0.00 C ATOM 2076 O TYR A 139 -6.997 7.887 9.473 1.00 0.00 O ATOM 2077 CB TYR A 139 -9.656 9.064 7.522 1.00 0.00 C ATOM 2078 CG TYR A 139 -11.073 9.086 8.044 1.00 0.00 C ATOM 2079 CD1 TYR A 139 -11.455 8.195 9.055 1.00 0.00 C ATOM 2080 CD2 TYR A 139 -11.999 9.996 7.527 1.00 0.00 C ATOM 2081 CE1 TYR A 139 -12.764 8.211 9.545 1.00 0.00 C ATOM 2082 CE2 TYR A 139 -13.311 10.015 8.019 1.00 0.00 C ATOM 2083 CZ TYR A 139 -13.692 9.123 9.028 1.00 0.00 C ATOM 2084 OH TYR A 139 -14.984 9.139 9.512 1.00 0.00 O ATOM 2085 OXT TYR A 139 -6.888 8.483 7.406 1.00 0.00 O ATOM 0 H TYR A 139 -8.166 11.203 7.811 1.00 0.00 H new ATOM 0 HA TYR A 139 -9.181 9.048 9.617 1.00 0.00 H new ATOM 0 HB2 TYR A 139 -9.528 9.821 6.749 1.00 0.00 H new ATOM 0 HB3 TYR A 139 -9.439 8.100 7.063 1.00 0.00 H new ATOM 0 HD1 TYR A 139 -10.737 7.495 9.456 1.00 0.00 H new ATOM 0 HD2 TYR A 139 -11.704 10.684 6.749 1.00 0.00 H new ATOM 0 HE1 TYR A 139 -13.059 7.521 10.321 1.00 0.00 H new ATOM 0 HE2 TYR A 139 -14.028 10.717 7.620 1.00 0.00 H new ATOM 0 HH TYR A 139 -15.499 9.832 9.048 1.00 0.00 H new