USER MOD reduce.3.24.130724 H: found=0, std=0, add=1064, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1058 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 35 TYR OH : rot 180:sc= -3.52! USER MOD Set 1.2: A 38 HIS : no HD1:sc= -2.2 K(o=-5.7,f=-6.3!) USER MOD Set 2.1: A 22 LYS NZ :NH3+ 164:sc= 0 (180deg=0) USER MOD Set 2.2: A 24 GLN : amide:sc= -0.201 K(o=-0.2,f=-2.1!) USER MOD Single : A 1 ALA N :NH3+ -105:sc= 0.0934 (180deg=0) USER MOD Single : A 2 MET CE :methyl 144:sc= -0.707 (180deg=-3.22!) USER MOD Single : A 3 THR OG1 : rot 61:sc= -0.368! USER MOD Single : A 4 TYR OH : rot -25:sc= -2.78! USER MOD Single : A 5 HIS : no HD1:sc= -5.67! C(o=-5.7!,f=-8!) USER MOD Single : A 10 SER OG : rot 180:sc= -0.658 USER MOD Single : A 13 GLN : amide:sc= -0.198 K(o=-0.2,f=-1.2!) USER MOD Single : A 14 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 15 MET CE :methyl -179:sc= -1.76! (180deg=-1.85!) USER MOD Single : A 17 SER OG : rot 54:sc= 0.998 USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 SER OG : rot 23:sc= 0.67 USER MOD Single : A 43 THR OG1 : rot 180:sc= -0.542 USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 MET CE :methyl 147:sc= -0.819 (180deg=-1.34) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 56 HIS :FLIP no HE2:sc= -0.294 F(o=-1.3,f=-0.29) USER MOD Single : A 58 HIS : no HD1:sc= -0.482 X(o=-0.48,f=-0.24) USER MOD Single : A 63 TYR OH : rot 30:sc= -0.167 USER MOD Single : A 65 SER OG : rot 180:sc= -0.432 USER MOD Single : A 72 GLN : amide:sc= -0.566 K(o=-0.57,f=-3.4!) USER MOD Single : A 75 ASN :FLIP amide:sc= -0.0513 F(o=-0.58,f=-0.051) USER MOD Single : A 77 THR OG1 : rot 180:sc= 0 USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 GLN : amide:sc= 0 X(o=0,f=-0.054) USER MOD Single : A 95 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 106 SER OG : rot -62:sc= 0.579 USER MOD Single : A 107 SER OG : rot -54:sc= 0.242 USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 109 HIS :FLIP no HD1:sc= -0.2 F(o=-0.77,f=-0.2) USER MOD Single : A 114 TYR OH : rot 180:sc= 0 USER MOD Single : A 116 GLN : amide:sc= -0.839 K(o=-0.84,f=-4.9!) USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 GLN : amide:sc= 0 X(o=0,f=-0.0083) USER MOD Single : A 134 THR OG1 : rot 180:sc= -0.0378 USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 MET CE :methyl -179:sc= 0 (180deg=-0.000346) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -25.228 -0.633 8.951 1.00 0.00 N ATOM 2 CA ALA A 1 -24.045 -0.017 9.615 1.00 0.00 C ATOM 3 C ALA A 1 -22.810 -0.887 9.364 1.00 0.00 C ATOM 4 O ALA A 1 -22.915 -2.049 9.026 1.00 0.00 O ATOM 5 CB ALA A 1 -24.301 0.090 11.120 1.00 0.00 C ATOM 0 H1 ALA A 1 -25.463 -0.095 8.093 1.00 0.00 H new ATOM 0 H2 ALA A 1 -25.009 -1.617 8.694 1.00 0.00 H new ATOM 0 H3 ALA A 1 -26.039 -0.618 9.602 1.00 0.00 H new ATOM 0 HA ALA A 1 -23.876 0.979 9.206 1.00 0.00 H new ATOM 0 HB1 ALA A 1 -23.435 0.541 11.605 1.00 0.00 H new ATOM 0 HB2 ALA A 1 -25.180 0.710 11.296 1.00 0.00 H new ATOM 0 HB3 ALA A 1 -24.471 -0.905 11.532 1.00 0.00 H new ATOM 13 N MET A 2 -21.639 -0.331 9.526 1.00 0.00 N ATOM 14 CA MET A 2 -20.398 -1.122 9.293 1.00 0.00 C ATOM 15 C MET A 2 -20.291 -1.475 7.809 1.00 0.00 C ATOM 16 O MET A 2 -21.236 -1.331 7.060 1.00 0.00 O ATOM 17 CB MET A 2 -20.446 -2.411 10.118 1.00 0.00 C ATOM 18 CG MET A 2 -20.881 -2.092 11.550 1.00 0.00 C ATOM 19 SD MET A 2 -22.236 -3.193 12.026 1.00 0.00 S ATOM 20 CE MET A 2 -22.953 -2.135 13.308 1.00 0.00 C ATOM 0 H MET A 2 -21.489 0.637 9.810 1.00 0.00 H new ATOM 0 HA MET A 2 -19.532 -0.531 9.593 1.00 0.00 H new ATOM 0 HB2 MET A 2 -21.141 -3.118 9.666 1.00 0.00 H new ATOM 0 HB3 MET A 2 -19.466 -2.887 10.123 1.00 0.00 H new ATOM 0 HG2 MET A 2 -20.041 -2.215 12.233 1.00 0.00 H new ATOM 0 HG3 MET A 2 -21.200 -1.052 11.622 1.00 0.00 H new ATOM 0 HE1 MET A 2 -24.038 -2.235 13.297 1.00 0.00 H new ATOM 0 HE2 MET A 2 -22.570 -2.435 14.283 1.00 0.00 H new ATOM 0 HE3 MET A 2 -22.683 -1.097 13.116 1.00 0.00 H new ATOM 30 N THR A 3 -19.147 -1.946 7.387 1.00 0.00 N ATOM 31 CA THR A 3 -18.958 -2.325 5.954 1.00 0.00 C ATOM 32 C THR A 3 -19.331 -1.156 5.037 1.00 0.00 C ATOM 33 O THR A 3 -20.463 -0.721 4.985 1.00 0.00 O ATOM 34 CB THR A 3 -19.839 -3.536 5.621 1.00 0.00 C ATOM 35 OG1 THR A 3 -20.973 -3.555 6.478 1.00 0.00 O ATOM 36 CG2 THR A 3 -19.034 -4.821 5.815 1.00 0.00 C ATOM 0 H THR A 3 -18.328 -2.086 7.979 1.00 0.00 H new ATOM 0 HA THR A 3 -17.910 -2.577 5.795 1.00 0.00 H new ATOM 0 HB THR A 3 -20.171 -3.465 4.585 1.00 0.00 H new ATOM 0 HG1 THR A 3 -21.496 -2.737 6.346 1.00 0.00 H new ATOM 0 HG21 THR A 3 -19.660 -5.682 5.578 1.00 0.00 H new ATOM 0 HG22 THR A 3 -18.167 -4.810 5.155 1.00 0.00 H new ATOM 0 HG23 THR A 3 -18.701 -4.889 6.851 1.00 0.00 H new ATOM 44 N TYR A 4 -18.382 -0.659 4.294 1.00 0.00 N ATOM 45 CA TYR A 4 -18.671 0.463 3.361 1.00 0.00 C ATOM 46 C TYR A 4 -18.106 0.112 1.985 1.00 0.00 C ATOM 47 O TYR A 4 -17.984 -1.046 1.639 1.00 0.00 O ATOM 48 CB TYR A 4 -18.046 1.763 3.888 1.00 0.00 C ATOM 49 CG TYR A 4 -16.538 1.710 3.804 1.00 0.00 C ATOM 50 CD1 TYR A 4 -15.818 0.760 4.542 1.00 0.00 C ATOM 51 CD2 TYR A 4 -15.856 2.631 2.999 1.00 0.00 C ATOM 52 CE1 TYR A 4 -14.423 0.730 4.471 1.00 0.00 C ATOM 53 CE2 TYR A 4 -14.459 2.600 2.929 1.00 0.00 C ATOM 54 CZ TYR A 4 -13.744 1.649 3.664 1.00 0.00 C ATOM 55 OH TYR A 4 -12.370 1.620 3.592 1.00 0.00 O ATOM 0 H TYR A 4 -17.415 -0.984 4.294 1.00 0.00 H new ATOM 0 HA TYR A 4 -19.748 0.615 3.283 1.00 0.00 H new ATOM 0 HB2 TYR A 4 -18.417 2.610 3.310 1.00 0.00 H new ATOM 0 HB3 TYR A 4 -18.351 1.925 4.922 1.00 0.00 H new ATOM 0 HD1 TYR A 4 -16.342 0.051 5.166 1.00 0.00 H new ATOM 0 HD2 TYR A 4 -16.409 3.365 2.432 1.00 0.00 H new ATOM 0 HE1 TYR A 4 -13.869 -0.003 5.039 1.00 0.00 H new ATOM 0 HE2 TYR A 4 -13.933 3.310 2.308 1.00 0.00 H new ATOM 0 HH TYR A 4 -12.008 1.216 4.408 1.00 0.00 H new ATOM 65 N HIS A 5 -17.771 1.086 1.191 1.00 0.00 N ATOM 66 CA HIS A 5 -17.230 0.772 -0.160 1.00 0.00 C ATOM 67 C HIS A 5 -15.931 1.541 -0.390 1.00 0.00 C ATOM 68 O HIS A 5 -15.780 2.665 0.043 1.00 0.00 O ATOM 69 CB HIS A 5 -18.258 1.179 -1.220 1.00 0.00 C ATOM 70 CG HIS A 5 -17.725 0.871 -2.592 1.00 0.00 C ATOM 71 ND1 HIS A 5 -16.585 1.477 -3.099 1.00 0.00 N ATOM 72 CD2 HIS A 5 -18.167 0.024 -3.579 1.00 0.00 C ATOM 73 CE1 HIS A 5 -16.383 0.992 -4.337 1.00 0.00 C ATOM 74 NE2 HIS A 5 -17.318 0.102 -4.679 1.00 0.00 N ATOM 0 H HIS A 5 -17.847 2.078 1.414 1.00 0.00 H new ATOM 0 HA HIS A 5 -17.029 -0.297 -0.231 1.00 0.00 H new ATOM 0 HB2 HIS A 5 -19.194 0.646 -1.055 1.00 0.00 H new ATOM 0 HB3 HIS A 5 -18.479 2.243 -1.136 1.00 0.00 H new ATOM 0 HD2 HIS A 5 -19.041 -0.607 -3.512 1.00 0.00 H new ATOM 0 HE1 HIS A 5 -15.564 1.286 -4.977 1.00 0.00 H new ATOM 0 HE2 HIS A 5 -17.394 -0.411 -5.558 1.00 0.00 H new ATOM 82 N LEU A 6 -14.995 0.951 -1.080 1.00 0.00 N ATOM 83 CA LEU A 6 -13.721 1.661 -1.348 1.00 0.00 C ATOM 84 C LEU A 6 -13.302 1.402 -2.802 1.00 0.00 C ATOM 85 O LEU A 6 -13.806 0.504 -3.449 1.00 0.00 O ATOM 86 CB LEU A 6 -12.643 1.192 -0.359 1.00 0.00 C ATOM 87 CG LEU A 6 -11.873 0.021 -0.948 1.00 0.00 C ATOM 88 CD1 LEU A 6 -10.806 0.558 -1.899 1.00 0.00 C ATOM 89 CD2 LEU A 6 -11.207 -0.772 0.167 1.00 0.00 C ATOM 0 H LEU A 6 -15.060 0.010 -1.468 1.00 0.00 H new ATOM 0 HA LEU A 6 -13.851 2.734 -1.210 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -11.960 2.012 -0.136 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -13.105 0.897 0.583 1.00 0.00 H new ATOM 0 HG LEU A 6 -12.558 -0.632 -1.489 1.00 0.00 H new ATOM 0 HD11 LEU A 6 -10.248 -0.275 -2.327 1.00 0.00 H new ATOM 0 HD12 LEU A 6 -11.283 1.124 -2.699 1.00 0.00 H new ATOM 0 HD13 LEU A 6 -10.124 1.208 -1.351 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -10.657 -1.610 -0.261 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -10.518 -0.126 0.712 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -11.968 -1.149 0.850 1.00 0.00 H new ATOM 101 N ASP A 7 -12.392 2.178 -3.325 1.00 0.00 N ATOM 102 CA ASP A 7 -11.962 1.964 -4.736 1.00 0.00 C ATOM 103 C ASP A 7 -10.599 2.616 -4.971 1.00 0.00 C ATOM 104 O ASP A 7 -10.504 3.789 -5.273 1.00 0.00 O ATOM 105 CB ASP A 7 -12.993 2.585 -5.682 1.00 0.00 C ATOM 106 CG ASP A 7 -13.039 1.786 -6.985 1.00 0.00 C ATOM 107 OD1 ASP A 7 -12.079 1.085 -7.262 1.00 0.00 O ATOM 108 OD2 ASP A 7 -14.033 1.887 -7.684 1.00 0.00 O ATOM 0 H ASP A 7 -11.930 2.947 -2.839 1.00 0.00 H new ATOM 0 HA ASP A 7 -11.885 0.894 -4.928 1.00 0.00 H new ATOM 0 HB2 ASP A 7 -13.976 2.590 -5.212 1.00 0.00 H new ATOM 0 HB3 ASP A 7 -12.733 3.623 -5.889 1.00 0.00 H new ATOM 113 N VAL A 8 -9.543 1.861 -4.845 1.00 0.00 N ATOM 114 CA VAL A 8 -8.188 2.434 -5.074 1.00 0.00 C ATOM 115 C VAL A 8 -7.673 1.963 -6.434 1.00 0.00 C ATOM 116 O VAL A 8 -7.973 0.872 -6.876 1.00 0.00 O ATOM 117 CB VAL A 8 -7.236 1.958 -3.975 1.00 0.00 C ATOM 118 CG1 VAL A 8 -7.884 2.173 -2.605 1.00 0.00 C ATOM 119 CG2 VAL A 8 -6.936 0.470 -4.168 1.00 0.00 C ATOM 0 H VAL A 8 -9.560 0.873 -4.593 1.00 0.00 H new ATOM 0 HA VAL A 8 -8.241 3.523 -5.055 1.00 0.00 H new ATOM 0 HB VAL A 8 -6.308 2.527 -4.030 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -7.204 1.833 -1.824 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -8.097 3.233 -2.465 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -8.813 1.606 -2.549 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -6.258 0.131 -3.385 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -7.865 -0.098 -4.115 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -6.472 0.316 -5.142 1.00 0.00 H new ATOM 129 N VAL A 9 -6.904 2.773 -7.105 1.00 0.00 N ATOM 130 CA VAL A 9 -6.381 2.362 -8.438 1.00 0.00 C ATOM 131 C VAL A 9 -5.082 3.113 -8.734 1.00 0.00 C ATOM 132 O VAL A 9 -4.636 3.935 -7.958 1.00 0.00 O ATOM 133 CB VAL A 9 -7.419 2.688 -9.514 1.00 0.00 C ATOM 134 CG1 VAL A 9 -7.234 1.747 -10.706 1.00 0.00 C ATOM 135 CG2 VAL A 9 -8.826 2.506 -8.937 1.00 0.00 C ATOM 0 H VAL A 9 -6.615 3.699 -6.790 1.00 0.00 H new ATOM 0 HA VAL A 9 -6.184 1.290 -8.436 1.00 0.00 H new ATOM 0 HB VAL A 9 -7.289 3.719 -9.842 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -7.974 1.980 -11.472 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -6.233 1.874 -11.118 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -7.363 0.715 -10.379 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -9.566 2.738 -9.703 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -8.954 1.474 -8.609 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -8.960 3.176 -8.088 1.00 0.00 H new ATOM 145 N SER A 10 -4.469 2.837 -9.852 1.00 0.00 N ATOM 146 CA SER A 10 -3.198 3.533 -10.198 1.00 0.00 C ATOM 147 C SER A 10 -3.203 3.900 -11.683 1.00 0.00 C ATOM 148 O SER A 10 -4.239 3.947 -12.317 1.00 0.00 O ATOM 149 CB SER A 10 -2.017 2.607 -9.908 1.00 0.00 C ATOM 150 OG SER A 10 -1.632 1.948 -11.108 1.00 0.00 O ATOM 0 H SER A 10 -4.794 2.159 -10.541 1.00 0.00 H new ATOM 0 HA SER A 10 -3.107 4.440 -9.600 1.00 0.00 H new ATOM 0 HB2 SER A 10 -1.180 3.180 -9.509 1.00 0.00 H new ATOM 0 HB3 SER A 10 -2.292 1.874 -9.149 1.00 0.00 H new ATOM 0 HG SER A 10 -0.874 1.354 -10.926 1.00 0.00 H new ATOM 156 N ALA A 11 -2.053 4.160 -12.242 1.00 0.00 N ATOM 157 CA ALA A 11 -1.991 4.522 -13.685 1.00 0.00 C ATOM 158 C ALA A 11 -2.894 3.579 -14.483 1.00 0.00 C ATOM 159 O ALA A 11 -3.723 4.009 -15.261 1.00 0.00 O ATOM 160 CB ALA A 11 -0.551 4.390 -14.184 1.00 0.00 C ATOM 0 H ALA A 11 -1.154 4.137 -11.761 1.00 0.00 H new ATOM 0 HA ALA A 11 -2.328 5.550 -13.817 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -0.506 4.655 -15.240 1.00 0.00 H new ATOM 0 HB2 ALA A 11 0.094 5.059 -13.614 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -0.213 3.362 -14.053 1.00 0.00 H new ATOM 166 N GLU A 12 -2.740 2.295 -14.300 1.00 0.00 N ATOM 167 CA GLU A 12 -3.591 1.330 -15.052 1.00 0.00 C ATOM 168 C GLU A 12 -3.424 -0.072 -14.464 1.00 0.00 C ATOM 169 O GLU A 12 -2.904 -0.965 -15.104 1.00 0.00 O ATOM 170 CB GLU A 12 -3.172 1.321 -16.523 1.00 0.00 C ATOM 171 CG GLU A 12 -1.653 1.165 -16.621 1.00 0.00 C ATOM 172 CD GLU A 12 -1.318 -0.006 -17.545 1.00 0.00 C ATOM 173 OE1 GLU A 12 -1.971 -0.137 -18.566 1.00 0.00 O ATOM 174 OE2 GLU A 12 -0.412 -0.754 -17.214 1.00 0.00 O ATOM 0 H GLU A 12 -2.063 1.874 -13.664 1.00 0.00 H new ATOM 0 HA GLU A 12 -4.636 1.631 -14.972 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -3.667 0.504 -17.048 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -3.485 2.246 -17.007 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -1.207 2.083 -17.004 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -1.230 0.993 -15.631 1.00 0.00 H new ATOM 181 N GLN A 13 -3.865 -0.275 -13.253 1.00 0.00 N ATOM 182 CA GLN A 13 -3.734 -1.623 -12.629 1.00 0.00 C ATOM 183 C GLN A 13 -4.925 -1.871 -11.701 1.00 0.00 C ATOM 184 O GLN A 13 -5.359 -0.991 -10.985 1.00 0.00 O ATOM 185 CB GLN A 13 -2.437 -1.690 -11.820 1.00 0.00 C ATOM 186 CG GLN A 13 -1.237 -1.633 -12.766 1.00 0.00 C ATOM 187 CD GLN A 13 -0.101 -2.485 -12.197 1.00 0.00 C ATOM 188 OE1 GLN A 13 -0.333 -3.554 -11.669 1.00 0.00 O ATOM 189 NE2 GLN A 13 1.128 -2.054 -12.280 1.00 0.00 N ATOM 0 H GLN A 13 -4.310 0.433 -12.669 1.00 0.00 H new ATOM 0 HA GLN A 13 -3.714 -2.383 -13.410 1.00 0.00 H new ATOM 0 HB2 GLN A 13 -2.395 -0.862 -11.113 1.00 0.00 H new ATOM 0 HB3 GLN A 13 -2.408 -2.610 -11.236 1.00 0.00 H new ATOM 0 HG2 GLN A 13 -1.521 -1.998 -13.753 1.00 0.00 H new ATOM 0 HG3 GLN A 13 -0.906 -0.602 -12.890 1.00 0.00 H new ATOM 0 HE21 GLN A 13 1.325 -1.157 -12.723 1.00 0.00 H new ATOM 0 HE22 GLN A 13 1.892 -2.615 -11.902 1.00 0.00 H new ATOM 198 N GLN A 14 -5.456 -3.063 -11.706 1.00 0.00 N ATOM 199 CA GLN A 14 -6.617 -3.361 -10.821 1.00 0.00 C ATOM 200 C GLN A 14 -6.124 -3.584 -9.390 1.00 0.00 C ATOM 201 O GLN A 14 -5.186 -4.319 -9.154 1.00 0.00 O ATOM 202 CB GLN A 14 -7.329 -4.622 -11.317 1.00 0.00 C ATOM 203 CG GLN A 14 -8.088 -4.307 -12.607 1.00 0.00 C ATOM 204 CD GLN A 14 -9.514 -3.872 -12.268 1.00 0.00 C ATOM 205 OE1 GLN A 14 -10.415 -4.686 -12.215 1.00 0.00 O ATOM 206 NE2 GLN A 14 -9.759 -2.611 -12.032 1.00 0.00 N ATOM 0 H GLN A 14 -5.137 -3.841 -12.283 1.00 0.00 H new ATOM 0 HA GLN A 14 -7.311 -2.521 -10.840 1.00 0.00 H new ATOM 0 HB2 GLN A 14 -6.603 -5.416 -11.494 1.00 0.00 H new ATOM 0 HB3 GLN A 14 -8.020 -4.985 -10.556 1.00 0.00 H new ATOM 0 HG2 GLN A 14 -7.577 -3.517 -13.158 1.00 0.00 H new ATOM 0 HG3 GLN A 14 -8.108 -5.185 -13.253 1.00 0.00 H new ATOM 0 HE21 GLN A 14 -9.003 -1.928 -12.076 1.00 0.00 H new ATOM 0 HE22 GLN A 14 -10.706 -2.310 -11.803 1.00 0.00 H new ATOM 215 N MET A 15 -6.752 -2.957 -8.434 1.00 0.00 N ATOM 216 CA MET A 15 -6.322 -3.135 -7.018 1.00 0.00 C ATOM 217 C MET A 15 -7.530 -3.533 -6.167 1.00 0.00 C ATOM 218 O MET A 15 -7.662 -4.666 -5.750 1.00 0.00 O ATOM 219 CB MET A 15 -5.738 -1.821 -6.493 1.00 0.00 C ATOM 220 CG MET A 15 -4.573 -1.388 -7.386 1.00 0.00 C ATOM 221 SD MET A 15 -3.039 -1.398 -6.425 1.00 0.00 S ATOM 222 CE MET A 15 -2.426 -3.005 -6.990 1.00 0.00 C ATOM 0 H MET A 15 -7.544 -2.329 -8.572 1.00 0.00 H new ATOM 0 HA MET A 15 -5.564 -3.916 -6.963 1.00 0.00 H new ATOM 0 HB2 MET A 15 -6.507 -1.048 -6.480 1.00 0.00 H new ATOM 0 HB3 MET A 15 -5.396 -1.947 -5.466 1.00 0.00 H new ATOM 0 HG2 MET A 15 -4.485 -2.061 -8.239 1.00 0.00 H new ATOM 0 HG3 MET A 15 -4.758 -0.391 -7.785 1.00 0.00 H new ATOM 0 HE1 MET A 15 -1.478 -3.226 -6.499 1.00 0.00 H new ATOM 0 HE2 MET A 15 -3.152 -3.779 -6.742 1.00 0.00 H new ATOM 0 HE3 MET A 15 -2.278 -2.979 -8.070 1.00 0.00 H new ATOM 232 N PHE A 16 -8.415 -2.609 -5.911 1.00 0.00 N ATOM 233 CA PHE A 16 -9.617 -2.933 -5.091 1.00 0.00 C ATOM 234 C PHE A 16 -10.770 -2.018 -5.503 1.00 0.00 C ATOM 235 O PHE A 16 -10.731 -0.821 -5.292 1.00 0.00 O ATOM 236 CB PHE A 16 -9.300 -2.720 -3.609 1.00 0.00 C ATOM 237 CG PHE A 16 -10.423 -3.277 -2.765 1.00 0.00 C ATOM 238 CD1 PHE A 16 -10.394 -4.613 -2.347 1.00 0.00 C ATOM 239 CD2 PHE A 16 -11.496 -2.457 -2.399 1.00 0.00 C ATOM 240 CE1 PHE A 16 -11.435 -5.124 -1.563 1.00 0.00 C ATOM 241 CE2 PHE A 16 -12.533 -2.963 -1.619 1.00 0.00 C ATOM 242 CZ PHE A 16 -12.504 -4.299 -1.200 1.00 0.00 C ATOM 0 H PHE A 16 -8.358 -1.643 -6.234 1.00 0.00 H new ATOM 0 HA PHE A 16 -9.899 -3.973 -5.253 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -8.361 -3.211 -3.353 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -9.170 -1.657 -3.404 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -9.568 -5.249 -2.629 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -11.520 -1.427 -2.723 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -11.413 -6.154 -1.239 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -13.358 -2.326 -1.338 1.00 0.00 H new ATOM 0 HZ PHE A 16 -13.308 -4.692 -0.596 1.00 0.00 H new ATOM 252 N SER A 17 -11.796 -2.567 -6.092 1.00 0.00 N ATOM 253 CA SER A 17 -12.946 -1.723 -6.517 1.00 0.00 C ATOM 254 C SER A 17 -14.252 -2.481 -6.272 1.00 0.00 C ATOM 255 O SER A 17 -14.712 -3.237 -7.104 1.00 0.00 O ATOM 256 CB SER A 17 -12.816 -1.397 -8.005 1.00 0.00 C ATOM 257 OG SER A 17 -13.114 -2.558 -8.769 1.00 0.00 O ATOM 0 H SER A 17 -11.887 -3.562 -6.297 1.00 0.00 H new ATOM 0 HA SER A 17 -12.950 -0.797 -5.942 1.00 0.00 H new ATOM 0 HB2 SER A 17 -13.496 -0.588 -8.272 1.00 0.00 H new ATOM 0 HB3 SER A 17 -11.806 -1.052 -8.226 1.00 0.00 H new ATOM 0 HG SER A 17 -13.993 -2.905 -8.508 1.00 0.00 H new ATOM 263 N GLY A 18 -14.854 -2.281 -5.132 1.00 0.00 N ATOM 264 CA GLY A 18 -16.129 -2.987 -4.825 1.00 0.00 C ATOM 265 C GLY A 18 -16.473 -2.782 -3.351 1.00 0.00 C ATOM 266 O GLY A 18 -16.085 -1.802 -2.746 1.00 0.00 O ATOM 0 H GLY A 18 -14.517 -1.658 -4.398 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -16.932 -2.604 -5.455 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -16.032 -4.050 -5.044 1.00 0.00 H new ATOM 270 N LEU A 19 -17.193 -3.694 -2.762 1.00 0.00 N ATOM 271 CA LEU A 19 -17.548 -3.538 -1.329 1.00 0.00 C ATOM 272 C LEU A 19 -16.284 -3.650 -0.482 1.00 0.00 C ATOM 273 O LEU A 19 -15.201 -3.859 -0.992 1.00 0.00 O ATOM 274 CB LEU A 19 -18.552 -4.617 -0.930 1.00 0.00 C ATOM 275 CG LEU A 19 -19.842 -4.413 -1.727 1.00 0.00 C ATOM 276 CD1 LEU A 19 -20.956 -5.264 -1.120 1.00 0.00 C ATOM 277 CD2 LEU A 19 -20.243 -2.933 -1.681 1.00 0.00 C ATOM 0 H LEU A 19 -17.549 -4.538 -3.211 1.00 0.00 H new ATOM 0 HA LEU A 19 -18.001 -2.560 -1.165 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -18.140 -5.607 -1.127 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -18.757 -4.564 0.139 1.00 0.00 H new ATOM 0 HG LEU A 19 -19.681 -4.713 -2.763 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -21.875 -5.119 -1.688 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -20.671 -6.315 -1.154 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -21.118 -4.966 -0.084 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -21.162 -2.787 -2.249 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -20.404 -2.632 -0.646 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -19.448 -2.327 -2.116 1.00 0.00 H new ATOM 289 N VAL A 20 -16.401 -3.478 0.805 1.00 0.00 N ATOM 290 CA VAL A 20 -15.190 -3.538 1.664 1.00 0.00 C ATOM 291 C VAL A 20 -15.598 -3.235 3.107 1.00 0.00 C ATOM 292 O VAL A 20 -16.645 -2.672 3.355 1.00 0.00 O ATOM 293 CB VAL A 20 -14.181 -2.506 1.127 1.00 0.00 C ATOM 294 CG1 VAL A 20 -14.929 -1.375 0.425 1.00 0.00 C ATOM 295 CG2 VAL A 20 -13.331 -1.905 2.242 1.00 0.00 C ATOM 0 H VAL A 20 -17.278 -3.300 1.295 1.00 0.00 H new ATOM 0 HA VAL A 20 -14.727 -4.525 1.646 1.00 0.00 H new ATOM 0 HB VAL A 20 -13.522 -3.027 0.432 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -14.213 -0.646 0.046 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -15.507 -1.781 -0.405 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -15.601 -0.889 1.132 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -12.633 -1.183 1.818 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -13.978 -1.405 2.963 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -12.774 -2.697 2.742 1.00 0.00 H new ATOM 305 N GLU A 21 -14.797 -3.617 4.062 1.00 0.00 N ATOM 306 CA GLU A 21 -15.170 -3.357 5.480 1.00 0.00 C ATOM 307 C GLU A 21 -14.008 -2.690 6.217 1.00 0.00 C ATOM 308 O GLU A 21 -14.065 -1.524 6.557 1.00 0.00 O ATOM 309 CB GLU A 21 -15.511 -4.683 6.164 1.00 0.00 C ATOM 310 CG GLU A 21 -16.363 -4.414 7.406 1.00 0.00 C ATOM 311 CD GLU A 21 -15.577 -4.798 8.660 1.00 0.00 C ATOM 312 OE1 GLU A 21 -15.382 -5.983 8.875 1.00 0.00 O ATOM 313 OE2 GLU A 21 -15.182 -3.899 9.386 1.00 0.00 O ATOM 0 H GLU A 21 -13.906 -4.095 3.924 1.00 0.00 H new ATOM 0 HA GLU A 21 -16.034 -2.693 5.506 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -16.050 -5.332 5.474 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -14.596 -5.205 6.444 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -16.641 -3.361 7.447 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -17.289 -4.987 7.355 1.00 0.00 H new ATOM 320 N LYS A 22 -12.960 -3.419 6.482 1.00 0.00 N ATOM 321 CA LYS A 22 -11.808 -2.819 7.212 1.00 0.00 C ATOM 322 C LYS A 22 -10.595 -2.715 6.286 1.00 0.00 C ATOM 323 O LYS A 22 -10.032 -3.707 5.868 1.00 0.00 O ATOM 324 CB LYS A 22 -11.458 -3.697 8.416 1.00 0.00 C ATOM 325 CG LYS A 22 -11.263 -2.816 9.651 1.00 0.00 C ATOM 326 CD LYS A 22 -9.838 -2.984 10.178 1.00 0.00 C ATOM 327 CE LYS A 22 -9.299 -1.627 10.635 1.00 0.00 C ATOM 328 NZ LYS A 22 -8.061 -1.828 11.437 1.00 0.00 N ATOM 0 H LYS A 22 -12.851 -4.400 6.226 1.00 0.00 H new ATOM 0 HA LYS A 22 -12.081 -1.820 7.552 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -12.253 -4.421 8.595 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -10.550 -4.264 8.214 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -11.448 -1.772 9.399 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -11.982 -3.090 10.423 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -9.827 -3.690 11.008 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -9.197 -3.398 9.399 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -9.087 -0.998 9.770 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -10.050 -1.107 11.230 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -7.549 -0.926 11.518 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -8.314 -2.169 12.387 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -7.454 -2.530 10.968 1.00 0.00 H new ATOM 342 N ILE A 23 -10.181 -1.518 5.971 1.00 0.00 N ATOM 343 CA ILE A 23 -8.997 -1.345 5.083 1.00 0.00 C ATOM 344 C ILE A 23 -7.981 -0.447 5.799 1.00 0.00 C ATOM 345 O ILE A 23 -8.345 0.498 6.469 1.00 0.00 O ATOM 346 CB ILE A 23 -9.443 -0.730 3.735 1.00 0.00 C ATOM 347 CG1 ILE A 23 -9.341 0.803 3.751 1.00 0.00 C ATOM 348 CG2 ILE A 23 -10.899 -1.121 3.462 1.00 0.00 C ATOM 349 CD1 ILE A 23 -9.426 1.332 2.317 1.00 0.00 C ATOM 0 H ILE A 23 -10.613 -0.651 6.291 1.00 0.00 H new ATOM 0 HA ILE A 23 -8.531 -2.307 4.870 1.00 0.00 H new ATOM 0 HB ILE A 23 -8.783 -1.112 2.956 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -10.144 1.226 4.355 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -8.401 1.111 4.209 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -11.220 -0.691 2.513 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -10.981 -2.207 3.414 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -11.533 -0.744 4.264 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -9.354 2.420 2.326 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -8.608 0.919 1.728 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -10.377 1.035 1.875 1.00 0.00 H new ATOM 361 N GLN A 24 -6.714 -0.736 5.682 1.00 0.00 N ATOM 362 CA GLN A 24 -5.701 0.110 6.377 1.00 0.00 C ATOM 363 C GLN A 24 -4.432 0.203 5.530 1.00 0.00 C ATOM 364 O GLN A 24 -3.893 -0.792 5.089 1.00 0.00 O ATOM 365 CB GLN A 24 -5.364 -0.510 7.735 1.00 0.00 C ATOM 366 CG GLN A 24 -4.646 -1.845 7.523 1.00 0.00 C ATOM 367 CD GLN A 24 -5.007 -2.808 8.656 1.00 0.00 C ATOM 368 OE1 GLN A 24 -5.147 -3.995 8.438 1.00 0.00 O ATOM 369 NE2 GLN A 24 -5.165 -2.345 9.867 1.00 0.00 N ATOM 0 H GLN A 24 -6.338 -1.514 5.140 1.00 0.00 H new ATOM 0 HA GLN A 24 -6.109 1.110 6.523 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -4.732 0.168 8.309 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -6.275 -0.663 8.313 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -4.931 -2.274 6.563 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -3.568 -1.689 7.495 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -5.048 -1.349 10.051 1.00 0.00 H new ATOM 0 HE22 GLN A 24 -5.406 -2.980 10.628 1.00 0.00 H new ATOM 378 N VAL A 25 -3.947 1.395 5.305 1.00 0.00 N ATOM 379 CA VAL A 25 -2.710 1.558 4.492 1.00 0.00 C ATOM 380 C VAL A 25 -1.565 2.007 5.401 1.00 0.00 C ATOM 381 O VAL A 25 -1.685 2.965 6.140 1.00 0.00 O ATOM 382 CB VAL A 25 -2.941 2.616 3.412 1.00 0.00 C ATOM 383 CG1 VAL A 25 -1.867 2.485 2.331 1.00 0.00 C ATOM 384 CG2 VAL A 25 -4.322 2.419 2.782 1.00 0.00 C ATOM 0 H VAL A 25 -4.356 2.263 5.650 1.00 0.00 H new ATOM 0 HA VAL A 25 -2.457 0.608 4.021 1.00 0.00 H new ATOM 0 HB VAL A 25 -2.887 3.607 3.863 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -2.032 3.239 1.561 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -0.883 2.630 2.776 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -1.920 1.492 1.884 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -4.482 3.175 2.013 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -4.379 1.427 2.333 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -5.089 2.514 3.550 1.00 0.00 H new ATOM 394 N THR A 26 -0.455 1.328 5.350 1.00 0.00 N ATOM 395 CA THR A 26 0.698 1.719 6.208 1.00 0.00 C ATOM 396 C THR A 26 1.825 2.256 5.324 1.00 0.00 C ATOM 397 O THR A 26 2.374 1.546 4.503 1.00 0.00 O ATOM 398 CB THR A 26 1.194 0.499 6.985 1.00 0.00 C ATOM 399 OG1 THR A 26 0.085 -0.174 7.563 1.00 0.00 O ATOM 400 CG2 THR A 26 2.155 0.949 8.089 1.00 0.00 C ATOM 0 H THR A 26 -0.295 0.518 4.751 1.00 0.00 H new ATOM 0 HA THR A 26 0.386 2.491 6.911 1.00 0.00 H new ATOM 0 HB THR A 26 1.716 -0.176 6.307 1.00 0.00 H new ATOM 0 HG1 THR A 26 0.401 -0.957 8.060 1.00 0.00 H new ATOM 0 HG21 THR A 26 2.507 0.078 8.642 1.00 0.00 H new ATOM 0 HG22 THR A 26 3.006 1.465 7.643 1.00 0.00 H new ATOM 0 HG23 THR A 26 1.637 1.625 8.769 1.00 0.00 H new ATOM 408 N GLY A 27 2.172 3.504 5.482 1.00 0.00 N ATOM 409 CA GLY A 27 3.262 4.085 4.648 1.00 0.00 C ATOM 410 C GLY A 27 3.989 5.177 5.434 1.00 0.00 C ATOM 411 O GLY A 27 4.170 5.077 6.632 1.00 0.00 O ATOM 0 H GLY A 27 1.748 4.146 6.152 1.00 0.00 H new ATOM 0 HA2 GLY A 27 3.965 3.305 4.357 1.00 0.00 H new ATOM 0 HA3 GLY A 27 2.848 4.500 3.729 1.00 0.00 H new ATOM 415 N SER A 28 4.410 6.217 4.770 1.00 0.00 N ATOM 416 CA SER A 28 5.129 7.315 5.476 1.00 0.00 C ATOM 417 C SER A 28 4.122 8.186 6.230 1.00 0.00 C ATOM 418 O SER A 28 3.204 8.733 5.653 1.00 0.00 O ATOM 419 CB SER A 28 5.876 8.170 4.453 1.00 0.00 C ATOM 420 OG SER A 28 4.935 8.828 3.615 1.00 0.00 O ATOM 0 H SER A 28 4.287 6.355 3.767 1.00 0.00 H new ATOM 0 HA SER A 28 5.839 6.888 6.184 1.00 0.00 H new ATOM 0 HB2 SER A 28 6.502 8.903 4.962 1.00 0.00 H new ATOM 0 HB3 SER A 28 6.539 7.545 3.854 1.00 0.00 H new ATOM 0 HG SER A 28 4.073 8.890 4.077 1.00 0.00 H new ATOM 426 N GLU A 29 4.289 8.322 7.518 1.00 0.00 N ATOM 427 CA GLU A 29 3.345 9.161 8.308 1.00 0.00 C ATOM 428 C GLU A 29 1.928 8.600 8.182 1.00 0.00 C ATOM 429 O GLU A 29 1.552 8.059 7.160 1.00 0.00 O ATOM 430 CB GLU A 29 3.373 10.596 7.777 1.00 0.00 C ATOM 431 CG GLU A 29 2.806 11.545 8.834 1.00 0.00 C ATOM 432 CD GLU A 29 3.952 12.314 9.498 1.00 0.00 C ATOM 433 OE1 GLU A 29 4.766 12.864 8.776 1.00 0.00 O ATOM 434 OE2 GLU A 29 3.993 12.339 10.717 1.00 0.00 O ATOM 0 H GLU A 29 5.039 7.888 8.057 1.00 0.00 H new ATOM 0 HA GLU A 29 3.645 9.153 9.356 1.00 0.00 H new ATOM 0 HB2 GLU A 29 4.395 10.882 7.527 1.00 0.00 H new ATOM 0 HB3 GLU A 29 2.789 10.667 6.859 1.00 0.00 H new ATOM 0 HG2 GLU A 29 2.105 12.242 8.374 1.00 0.00 H new ATOM 0 HG3 GLU A 29 2.250 10.981 9.583 1.00 0.00 H new ATOM 441 N GLY A 30 1.138 8.725 9.212 1.00 0.00 N ATOM 442 CA GLY A 30 -0.254 8.200 9.153 1.00 0.00 C ATOM 443 C GLY A 30 -0.246 6.691 9.399 1.00 0.00 C ATOM 444 O GLY A 30 0.791 6.059 9.408 1.00 0.00 O ATOM 0 H GLY A 30 1.397 9.169 10.093 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -0.872 8.697 9.901 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -0.694 8.417 8.180 1.00 0.00 H new ATOM 448 N GLU A 31 -1.396 6.108 9.598 1.00 0.00 N ATOM 449 CA GLU A 31 -1.457 4.641 9.843 1.00 0.00 C ATOM 450 C GLU A 31 -2.917 4.186 9.829 1.00 0.00 C ATOM 451 O GLU A 31 -3.359 3.457 10.695 1.00 0.00 O ATOM 452 CB GLU A 31 -0.835 4.323 11.205 1.00 0.00 C ATOM 453 CG GLU A 31 -0.642 2.811 11.337 1.00 0.00 C ATOM 454 CD GLU A 31 -1.453 2.294 12.526 1.00 0.00 C ATOM 455 OE1 GLU A 31 -2.372 2.985 12.936 1.00 0.00 O ATOM 456 OE2 GLU A 31 -1.143 1.217 13.007 1.00 0.00 O ATOM 0 H GLU A 31 -2.297 6.586 9.601 1.00 0.00 H new ATOM 0 HA GLU A 31 -0.904 4.118 9.063 1.00 0.00 H new ATOM 0 HB2 GLU A 31 0.123 4.833 11.307 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -1.478 4.690 12.005 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -0.960 2.312 10.422 1.00 0.00 H new ATOM 0 HG3 GLU A 31 0.414 2.579 11.476 1.00 0.00 H new ATOM 463 N LEU A 32 -3.670 4.611 8.851 1.00 0.00 N ATOM 464 CA LEU A 32 -5.101 4.201 8.780 1.00 0.00 C ATOM 465 C LEU A 32 -5.548 4.157 7.323 1.00 0.00 C ATOM 466 O LEU A 32 -5.110 4.940 6.503 1.00 0.00 O ATOM 467 CB LEU A 32 -5.972 5.216 9.527 1.00 0.00 C ATOM 468 CG LEU A 32 -6.139 4.780 10.984 1.00 0.00 C ATOM 469 CD1 LEU A 32 -6.657 5.957 11.813 1.00 0.00 C ATOM 470 CD2 LEU A 32 -7.142 3.626 11.058 1.00 0.00 C ATOM 0 H LEU A 32 -3.356 5.224 8.099 1.00 0.00 H new ATOM 0 HA LEU A 32 -5.208 3.216 9.235 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -5.514 6.204 9.483 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -6.947 5.295 9.047 1.00 0.00 H new ATOM 0 HG LEU A 32 -5.177 4.453 11.378 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -6.776 5.646 12.851 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -5.945 6.781 11.760 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -7.620 6.284 11.419 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -7.262 3.314 12.096 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -8.104 3.954 10.664 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -6.775 2.787 10.467 1.00 0.00 H new ATOM 482 N GLY A 33 -6.433 3.260 6.997 1.00 0.00 N ATOM 483 CA GLY A 33 -6.928 3.181 5.599 1.00 0.00 C ATOM 484 C GLY A 33 -8.279 3.887 5.531 1.00 0.00 C ATOM 485 O GLY A 33 -8.355 5.098 5.479 1.00 0.00 O ATOM 0 H GLY A 33 -6.835 2.578 7.640 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -6.219 3.651 4.918 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -7.027 2.141 5.289 1.00 0.00 H new ATOM 489 N ILE A 34 -9.344 3.139 5.560 1.00 0.00 N ATOM 490 CA ILE A 34 -10.693 3.762 5.523 1.00 0.00 C ATOM 491 C ILE A 34 -11.708 2.801 6.137 1.00 0.00 C ATOM 492 O ILE A 34 -11.552 1.596 6.094 1.00 0.00 O ATOM 493 CB ILE A 34 -11.097 4.075 4.083 1.00 0.00 C ATOM 494 CG1 ILE A 34 -10.277 5.253 3.573 1.00 0.00 C ATOM 495 CG2 ILE A 34 -12.574 4.468 4.054 1.00 0.00 C ATOM 496 CD1 ILE A 34 -10.568 6.460 4.461 1.00 0.00 C ATOM 0 H ILE A 34 -9.338 2.120 5.608 1.00 0.00 H new ATOM 0 HA ILE A 34 -10.669 4.692 6.091 1.00 0.00 H new ATOM 0 HB ILE A 34 -10.924 3.199 3.458 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -9.214 5.013 3.595 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -10.533 5.474 2.537 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -12.871 4.693 3.030 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -13.177 3.643 4.434 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -12.729 5.348 4.678 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -9.990 7.316 4.113 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -11.631 6.697 4.416 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -10.291 6.230 5.490 1.00 0.00 H new ATOM 508 N TYR A 35 -12.748 3.332 6.708 1.00 0.00 N ATOM 509 CA TYR A 35 -13.788 2.468 7.331 1.00 0.00 C ATOM 510 C TYR A 35 -15.139 3.171 7.199 1.00 0.00 C ATOM 511 O TYR A 35 -15.201 4.301 6.759 1.00 0.00 O ATOM 512 CB TYR A 35 -13.467 2.240 8.818 1.00 0.00 C ATOM 513 CG TYR A 35 -12.367 3.174 9.277 1.00 0.00 C ATOM 514 CD1 TYR A 35 -11.045 2.964 8.862 1.00 0.00 C ATOM 515 CD2 TYR A 35 -12.674 4.251 10.116 1.00 0.00 C ATOM 516 CE1 TYR A 35 -10.032 3.830 9.290 1.00 0.00 C ATOM 517 CE2 TYR A 35 -11.660 5.117 10.542 1.00 0.00 C ATOM 518 CZ TYR A 35 -10.340 4.908 10.129 1.00 0.00 C ATOM 519 OH TYR A 35 -9.342 5.763 10.549 1.00 0.00 O ATOM 0 H TYR A 35 -12.925 4.334 6.771 1.00 0.00 H new ATOM 0 HA TYR A 35 -13.813 1.500 6.830 1.00 0.00 H new ATOM 0 HB2 TYR A 35 -14.363 2.402 9.418 1.00 0.00 H new ATOM 0 HB3 TYR A 35 -13.162 1.205 8.975 1.00 0.00 H new ATOM 0 HD1 TYR A 35 -10.808 2.134 8.212 1.00 0.00 H new ATOM 0 HD2 TYR A 35 -13.693 4.414 10.435 1.00 0.00 H new ATOM 0 HE1 TYR A 35 -9.013 3.667 8.973 1.00 0.00 H new ATOM 0 HE2 TYR A 35 -11.897 5.948 11.190 1.00 0.00 H new ATOM 0 HH TYR A 35 -9.726 6.457 11.125 1.00 0.00 H new ATOM 529 N PRO A 36 -16.182 2.489 7.587 1.00 0.00 N ATOM 530 CA PRO A 36 -17.542 3.044 7.521 1.00 0.00 C ATOM 531 C PRO A 36 -17.731 4.098 8.614 1.00 0.00 C ATOM 532 O PRO A 36 -18.274 3.829 9.668 1.00 0.00 O ATOM 533 CB PRO A 36 -18.443 1.827 7.746 1.00 0.00 C ATOM 534 CG PRO A 36 -17.572 0.770 8.463 1.00 0.00 C ATOM 535 CD PRO A 36 -16.109 1.116 8.131 1.00 0.00 C ATOM 0 HA PRO A 36 -17.763 3.547 6.579 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -19.310 2.092 8.351 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -18.821 1.442 6.799 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -17.742 0.792 9.539 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -17.821 -0.235 8.122 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -15.477 1.071 9.018 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -15.689 0.420 7.404 1.00 0.00 H new ATOM 543 N GLY A 37 -17.280 5.299 8.367 1.00 0.00 N ATOM 544 CA GLY A 37 -17.423 6.378 9.385 1.00 0.00 C ATOM 545 C GLY A 37 -16.211 7.314 9.318 1.00 0.00 C ATOM 546 O GLY A 37 -16.205 8.375 9.912 1.00 0.00 O ATOM 0 H GLY A 37 -16.818 5.579 7.502 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -18.340 6.940 9.207 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -17.504 5.943 10.381 1.00 0.00 H new ATOM 550 N HIS A 38 -15.184 6.935 8.602 1.00 0.00 N ATOM 551 CA HIS A 38 -13.982 7.810 8.507 1.00 0.00 C ATOM 552 C HIS A 38 -14.417 9.236 8.168 1.00 0.00 C ATOM 553 O HIS A 38 -15.532 9.473 7.748 1.00 0.00 O ATOM 554 CB HIS A 38 -13.053 7.285 7.410 1.00 0.00 C ATOM 555 CG HIS A 38 -11.725 7.984 7.500 1.00 0.00 C ATOM 556 ND1 HIS A 38 -11.156 8.630 6.413 1.00 0.00 N ATOM 557 CD2 HIS A 38 -10.842 8.147 8.538 1.00 0.00 C ATOM 558 CE1 HIS A 38 -9.982 9.147 6.819 1.00 0.00 C ATOM 559 NE2 HIS A 38 -9.741 8.881 8.106 1.00 0.00 N ATOM 0 H HIS A 38 -15.127 6.060 8.081 1.00 0.00 H new ATOM 0 HA HIS A 38 -13.454 7.807 9.461 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -12.917 6.209 7.518 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -13.499 7.453 6.430 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -10.980 7.764 9.538 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -9.315 9.709 6.182 1.00 0.00 H new ATOM 0 HE2 HIS A 38 -8.926 9.156 8.654 1.00 0.00 H new ATOM 567 N ALA A 39 -13.544 10.188 8.344 1.00 0.00 N ATOM 568 CA ALA A 39 -13.906 11.599 8.030 1.00 0.00 C ATOM 569 C ALA A 39 -13.837 11.815 6.516 1.00 0.00 C ATOM 570 O ALA A 39 -13.361 10.963 5.792 1.00 0.00 O ATOM 571 CB ALA A 39 -12.924 12.543 8.725 1.00 0.00 C ATOM 0 H ALA A 39 -12.595 10.050 8.692 1.00 0.00 H new ATOM 0 HA ALA A 39 -14.917 11.804 8.382 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -13.188 13.575 8.496 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -12.970 12.387 9.803 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -11.913 12.340 8.372 1.00 0.00 H new ATOM 577 N PRO A 40 -14.314 12.954 6.084 1.00 0.00 N ATOM 578 CA PRO A 40 -14.324 13.320 4.656 1.00 0.00 C ATOM 579 C PRO A 40 -12.927 13.757 4.207 1.00 0.00 C ATOM 580 O PRO A 40 -12.667 14.925 4.001 1.00 0.00 O ATOM 581 CB PRO A 40 -15.312 14.488 4.593 1.00 0.00 C ATOM 582 CG PRO A 40 -15.375 15.085 6.020 1.00 0.00 C ATOM 583 CD PRO A 40 -14.885 13.983 6.977 1.00 0.00 C ATOM 0 HA PRO A 40 -14.606 12.495 4.002 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -14.982 15.237 3.873 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -16.296 14.147 4.271 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -14.747 15.973 6.097 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -16.391 15.391 6.268 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -14.138 14.364 7.674 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -15.704 13.582 7.575 1.00 0.00 H new ATOM 591 N LEU A 41 -12.026 12.826 4.056 1.00 0.00 N ATOM 592 CA LEU A 41 -10.648 13.187 3.622 1.00 0.00 C ATOM 593 C LEU A 41 -10.634 13.438 2.113 1.00 0.00 C ATOM 594 O LEU A 41 -11.524 13.026 1.395 1.00 0.00 O ATOM 595 CB LEU A 41 -9.690 12.043 3.957 1.00 0.00 C ATOM 596 CG LEU A 41 -9.101 12.265 5.350 1.00 0.00 C ATOM 597 CD1 LEU A 41 -8.135 13.452 5.313 1.00 0.00 C ATOM 598 CD2 LEU A 41 -10.230 12.559 6.338 1.00 0.00 C ATOM 0 H LEU A 41 -12.185 11.831 4.214 1.00 0.00 H new ATOM 0 HA LEU A 41 -10.331 14.091 4.142 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -10.218 11.090 3.921 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -8.892 11.994 3.216 1.00 0.00 H new ATOM 0 HG LEU A 41 -8.565 11.370 5.665 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -7.715 13.610 6.306 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -7.330 13.244 4.608 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -8.671 14.348 4.999 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -9.812 12.718 7.332 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -10.765 13.454 6.023 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -10.919 11.715 6.365 1.00 0.00 H new ATOM 610 N LEU A 42 -9.626 14.109 1.629 1.00 0.00 N ATOM 611 CA LEU A 42 -9.544 14.390 0.169 1.00 0.00 C ATOM 612 C LEU A 42 -8.155 14.939 -0.154 1.00 0.00 C ATOM 613 O LEU A 42 -8.001 15.812 -0.985 1.00 0.00 O ATOM 614 CB LEU A 42 -10.604 15.425 -0.215 1.00 0.00 C ATOM 615 CG LEU A 42 -10.538 16.609 0.753 1.00 0.00 C ATOM 616 CD1 LEU A 42 -9.545 17.648 0.227 1.00 0.00 C ATOM 617 CD2 LEU A 42 -11.925 17.244 0.872 1.00 0.00 C ATOM 0 H LEU A 42 -8.853 14.476 2.184 1.00 0.00 H new ATOM 0 HA LEU A 42 -9.719 13.472 -0.393 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -10.439 15.768 -1.237 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -11.596 14.973 -0.186 1.00 0.00 H new ATOM 0 HG LEU A 42 -10.210 16.260 1.732 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -9.500 18.490 0.918 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -8.557 17.196 0.141 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -9.870 17.999 -0.752 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -11.881 18.088 1.561 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -12.251 17.592 -0.108 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -12.632 16.505 1.248 1.00 0.00 H new ATOM 629 N THR A 43 -7.145 14.437 0.499 1.00 0.00 N ATOM 630 CA THR A 43 -5.767 14.935 0.232 1.00 0.00 C ATOM 631 C THR A 43 -4.990 13.888 -0.572 1.00 0.00 C ATOM 632 O THR A 43 -5.077 13.837 -1.784 1.00 0.00 O ATOM 633 CB THR A 43 -5.056 15.210 1.562 1.00 0.00 C ATOM 634 OG1 THR A 43 -3.651 15.104 1.378 1.00 0.00 O ATOM 635 CG2 THR A 43 -5.515 14.197 2.614 1.00 0.00 C ATOM 0 H THR A 43 -7.214 13.704 1.205 1.00 0.00 H new ATOM 0 HA THR A 43 -5.818 15.859 -0.343 1.00 0.00 H new ATOM 0 HB THR A 43 -5.303 16.216 1.902 1.00 0.00 H new ATOM 0 HG1 THR A 43 -3.196 15.281 2.227 1.00 0.00 H new ATOM 0 HG21 THR A 43 -5.007 14.397 3.557 1.00 0.00 H new ATOM 0 HG22 THR A 43 -6.592 14.283 2.757 1.00 0.00 H new ATOM 0 HG23 THR A 43 -5.273 13.189 2.278 1.00 0.00 H new ATOM 643 N ALA A 44 -4.229 13.052 0.082 1.00 0.00 N ATOM 644 CA ALA A 44 -3.453 12.019 -0.662 1.00 0.00 C ATOM 645 C ALA A 44 -3.534 10.679 0.072 1.00 0.00 C ATOM 646 O ALA A 44 -3.880 10.616 1.235 1.00 0.00 O ATOM 647 CB ALA A 44 -1.989 12.455 -0.762 1.00 0.00 C ATOM 0 H ALA A 44 -4.111 13.040 1.095 1.00 0.00 H new ATOM 0 HA ALA A 44 -3.872 11.907 -1.662 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -1.421 11.700 -1.306 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -1.928 13.406 -1.291 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -1.574 12.570 0.239 1.00 0.00 H new ATOM 653 N ILE A 45 -3.218 9.607 -0.602 1.00 0.00 N ATOM 654 CA ILE A 45 -3.274 8.270 0.051 1.00 0.00 C ATOM 655 C ILE A 45 -1.860 7.837 0.448 1.00 0.00 C ATOM 656 O ILE A 45 -0.910 8.049 -0.279 1.00 0.00 O ATOM 657 CB ILE A 45 -3.883 7.256 -0.926 1.00 0.00 C ATOM 658 CG1 ILE A 45 -4.370 6.031 -0.150 1.00 0.00 C ATOM 659 CG2 ILE A 45 -2.833 6.825 -1.955 1.00 0.00 C ATOM 660 CD1 ILE A 45 -5.835 5.756 -0.499 1.00 0.00 C ATOM 0 H ILE A 45 -2.923 9.600 -1.578 1.00 0.00 H new ATOM 0 HA ILE A 45 -3.893 8.320 0.947 1.00 0.00 H new ATOM 0 HB ILE A 45 -4.722 7.719 -1.445 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -3.757 5.164 -0.396 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -4.266 6.201 0.922 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -3.274 6.105 -2.645 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -2.489 7.697 -2.511 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -1.988 6.366 -1.442 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -6.183 4.883 0.053 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -6.442 6.621 -0.231 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -5.925 5.568 -1.569 1.00 0.00 H new ATOM 672 N LYS A 46 -1.711 7.240 1.599 1.00 0.00 N ATOM 673 CA LYS A 46 -0.356 6.803 2.041 1.00 0.00 C ATOM 674 C LYS A 46 0.063 5.550 1.263 1.00 0.00 C ATOM 675 O LYS A 46 -0.740 4.666 1.039 1.00 0.00 O ATOM 676 CB LYS A 46 -0.385 6.486 3.539 1.00 0.00 C ATOM 677 CG LYS A 46 -0.897 7.703 4.312 1.00 0.00 C ATOM 678 CD LYS A 46 -0.072 8.935 3.932 1.00 0.00 C ATOM 679 CE LYS A 46 -0.575 10.149 4.716 1.00 0.00 C ATOM 680 NZ LYS A 46 -1.086 11.178 3.767 1.00 0.00 N ATOM 0 H LYS A 46 -2.468 7.036 2.252 1.00 0.00 H new ATOM 0 HA LYS A 46 0.360 7.603 1.850 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -1.029 5.626 3.727 1.00 0.00 H new ATOM 0 HB3 LYS A 46 0.614 6.218 3.883 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -1.950 7.874 4.086 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -0.826 7.522 5.384 1.00 0.00 H new ATOM 0 HD2 LYS A 46 0.982 8.761 4.148 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -0.151 9.122 2.861 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -1.366 9.849 5.404 1.00 0.00 H new ATOM 0 HE3 LYS A 46 0.232 10.565 5.320 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -1.428 12.003 4.300 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -0.320 11.472 3.128 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -1.868 10.778 3.209 1.00 0.00 H new ATOM 694 N PRO A 47 1.315 5.510 0.873 1.00 0.00 N ATOM 695 CA PRO A 47 1.878 4.377 0.116 1.00 0.00 C ATOM 696 C PRO A 47 2.208 3.218 1.059 1.00 0.00 C ATOM 697 O PRO A 47 1.728 3.156 2.174 1.00 0.00 O ATOM 698 CB PRO A 47 3.157 4.955 -0.495 1.00 0.00 C ATOM 699 CG PRO A 47 3.553 6.165 0.385 1.00 0.00 C ATOM 700 CD PRO A 47 2.284 6.590 1.147 1.00 0.00 C ATOM 0 HA PRO A 47 1.193 3.979 -0.632 1.00 0.00 H new ATOM 0 HB2 PRO A 47 3.952 4.209 -0.510 1.00 0.00 H new ATOM 0 HB3 PRO A 47 2.990 5.263 -1.527 1.00 0.00 H new ATOM 0 HG2 PRO A 47 4.349 5.895 1.079 1.00 0.00 H new ATOM 0 HG3 PRO A 47 3.929 6.984 -0.229 1.00 0.00 H new ATOM 0 HD2 PRO A 47 2.476 6.690 2.215 1.00 0.00 H new ATOM 0 HD3 PRO A 47 1.914 7.554 0.798 1.00 0.00 H new ATOM 708 N GLY A 48 3.026 2.301 0.623 1.00 0.00 N ATOM 709 CA GLY A 48 3.389 1.150 1.497 1.00 0.00 C ATOM 710 C GLY A 48 2.494 -0.045 1.170 1.00 0.00 C ATOM 711 O GLY A 48 2.175 -0.301 0.026 1.00 0.00 O ATOM 0 H GLY A 48 3.459 2.299 -0.301 1.00 0.00 H new ATOM 0 HA2 GLY A 48 4.436 0.884 1.349 1.00 0.00 H new ATOM 0 HA3 GLY A 48 3.275 1.426 2.545 1.00 0.00 H new ATOM 715 N MET A 49 2.082 -0.778 2.168 1.00 0.00 N ATOM 716 CA MET A 49 1.203 -1.955 1.914 1.00 0.00 C ATOM 717 C MET A 49 -0.207 -1.641 2.415 1.00 0.00 C ATOM 718 O MET A 49 -0.445 -0.610 3.012 1.00 0.00 O ATOM 719 CB MET A 49 1.754 -3.174 2.657 1.00 0.00 C ATOM 720 CG MET A 49 2.057 -2.797 4.108 1.00 0.00 C ATOM 721 SD MET A 49 2.307 -4.302 5.082 1.00 0.00 S ATOM 722 CE MET A 49 0.561 -4.722 5.298 1.00 0.00 C ATOM 0 H MET A 49 2.316 -0.613 3.147 1.00 0.00 H new ATOM 0 HA MET A 49 1.173 -2.170 0.846 1.00 0.00 H new ATOM 0 HB2 MET A 49 1.031 -3.989 2.626 1.00 0.00 H new ATOM 0 HB3 MET A 49 2.659 -3.532 2.167 1.00 0.00 H new ATOM 0 HG2 MET A 49 2.947 -2.169 4.154 1.00 0.00 H new ATOM 0 HG3 MET A 49 1.234 -2.215 4.523 1.00 0.00 H new ATOM 0 HE1 MET A 49 0.448 -5.806 5.325 1.00 0.00 H new ATOM 0 HE2 MET A 49 0.197 -4.296 6.233 1.00 0.00 H new ATOM 0 HE3 MET A 49 -0.016 -4.318 4.466 1.00 0.00 H new ATOM 732 N ILE A 50 -1.149 -2.512 2.179 1.00 0.00 N ATOM 733 CA ILE A 50 -2.535 -2.235 2.651 1.00 0.00 C ATOM 734 C ILE A 50 -3.300 -3.547 2.851 1.00 0.00 C ATOM 735 O ILE A 50 -3.503 -4.310 1.928 1.00 0.00 O ATOM 736 CB ILE A 50 -3.263 -1.359 1.619 1.00 0.00 C ATOM 737 CG1 ILE A 50 -4.448 -0.658 2.289 1.00 0.00 C ATOM 738 CG2 ILE A 50 -3.779 -2.222 0.463 1.00 0.00 C ATOM 739 CD1 ILE A 50 -5.454 -1.704 2.776 1.00 0.00 C ATOM 0 H ILE A 50 -1.022 -3.395 1.685 1.00 0.00 H new ATOM 0 HA ILE A 50 -2.487 -1.710 3.605 1.00 0.00 H new ATOM 0 HB ILE A 50 -2.564 -0.618 1.230 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -4.100 -0.055 3.128 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -4.927 0.022 1.585 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -4.293 -1.590 -0.262 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -2.940 -2.721 -0.021 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -4.472 -2.970 0.848 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -6.297 -1.204 3.253 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -5.811 -2.288 1.928 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -4.971 -2.366 3.495 1.00 0.00 H new ATOM 751 N ARG A 51 -3.747 -3.798 4.051 1.00 0.00 N ATOM 752 CA ARG A 51 -4.525 -5.040 4.315 1.00 0.00 C ATOM 753 C ARG A 51 -6.006 -4.667 4.321 1.00 0.00 C ATOM 754 O ARG A 51 -6.362 -3.546 4.627 1.00 0.00 O ATOM 755 CB ARG A 51 -4.132 -5.616 5.677 1.00 0.00 C ATOM 756 CG ARG A 51 -3.559 -7.022 5.492 1.00 0.00 C ATOM 757 CD ARG A 51 -4.515 -8.047 6.105 1.00 0.00 C ATOM 758 NE ARG A 51 -4.369 -8.040 7.588 1.00 0.00 N ATOM 759 CZ ARG A 51 -5.408 -8.251 8.350 1.00 0.00 C ATOM 760 NH1 ARG A 51 -5.802 -9.469 8.596 1.00 0.00 N ATOM 761 NH2 ARG A 51 -6.055 -7.241 8.867 1.00 0.00 N ATOM 0 H ARG A 51 -3.606 -3.195 4.861 1.00 0.00 H new ATOM 0 HA ARG A 51 -4.322 -5.789 3.550 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -3.395 -4.972 6.157 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -5.001 -5.650 6.334 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -3.415 -7.231 4.432 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -2.580 -7.093 5.966 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -5.543 -7.811 5.829 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -4.300 -9.041 5.713 1.00 0.00 H new ATOM 0 HE ARG A 51 -3.455 -7.870 8.009 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -5.298 -10.259 8.193 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -6.614 -9.632 9.192 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -5.749 -6.287 8.675 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -6.867 -7.406 9.462 1.00 0.00 H new ATOM 775 N ILE A 52 -6.879 -5.566 3.962 1.00 0.00 N ATOM 776 CA ILE A 52 -8.317 -5.191 3.937 1.00 0.00 C ATOM 777 C ILE A 52 -9.205 -6.356 4.378 1.00 0.00 C ATOM 778 O ILE A 52 -8.773 -7.486 4.480 1.00 0.00 O ATOM 779 CB ILE A 52 -8.672 -4.749 2.512 1.00 0.00 C ATOM 780 CG1 ILE A 52 -9.773 -3.707 2.568 1.00 0.00 C ATOM 781 CG2 ILE A 52 -9.146 -5.927 1.652 1.00 0.00 C ATOM 782 CD1 ILE A 52 -9.814 -2.980 1.230 1.00 0.00 C ATOM 0 H ILE A 52 -6.664 -6.525 3.690 1.00 0.00 H new ATOM 0 HA ILE A 52 -8.492 -4.375 4.639 1.00 0.00 H new ATOM 0 HB ILE A 52 -7.772 -4.335 2.058 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -10.733 -4.180 2.772 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -9.587 -3.001 3.378 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -9.388 -5.572 0.650 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -8.355 -6.675 1.591 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -10.033 -6.373 2.103 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -10.600 -2.225 1.250 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -8.853 -2.498 1.048 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -10.018 -3.695 0.433 1.00 0.00 H new ATOM 794 N VAL A 53 -10.454 -6.071 4.628 1.00 0.00 N ATOM 795 CA VAL A 53 -11.409 -7.126 5.051 1.00 0.00 C ATOM 796 C VAL A 53 -12.698 -6.953 4.252 1.00 0.00 C ATOM 797 O VAL A 53 -13.593 -6.231 4.650 1.00 0.00 O ATOM 798 CB VAL A 53 -11.711 -6.978 6.542 1.00 0.00 C ATOM 799 CG1 VAL A 53 -12.935 -7.821 6.904 1.00 0.00 C ATOM 800 CG2 VAL A 53 -10.506 -7.452 7.355 1.00 0.00 C ATOM 0 H VAL A 53 -10.856 -5.136 4.555 1.00 0.00 H new ATOM 0 HA VAL A 53 -10.982 -8.113 4.872 1.00 0.00 H new ATOM 0 HB VAL A 53 -11.914 -5.931 6.768 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -13.149 -7.714 7.967 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -13.794 -7.482 6.325 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -12.735 -8.868 6.677 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -10.720 -7.347 8.418 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -10.303 -8.498 7.128 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -9.635 -6.849 7.099 1.00 0.00 H new ATOM 810 N LYS A 54 -12.798 -7.596 3.125 1.00 0.00 N ATOM 811 CA LYS A 54 -14.029 -7.456 2.300 1.00 0.00 C ATOM 812 C LYS A 54 -15.254 -7.781 3.156 1.00 0.00 C ATOM 813 O LYS A 54 -15.371 -8.858 3.704 1.00 0.00 O ATOM 814 CB LYS A 54 -13.960 -8.418 1.112 1.00 0.00 C ATOM 815 CG LYS A 54 -15.032 -8.043 0.088 1.00 0.00 C ATOM 816 CD LYS A 54 -15.270 -9.220 -0.861 1.00 0.00 C ATOM 817 CE LYS A 54 -15.518 -8.693 -2.276 1.00 0.00 C ATOM 818 NZ LYS A 54 -15.707 -9.841 -3.207 1.00 0.00 N ATOM 0 H LYS A 54 -12.082 -8.212 2.739 1.00 0.00 H new ATOM 0 HA LYS A 54 -14.107 -6.433 1.931 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -12.972 -8.375 0.653 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -14.109 -9.443 1.451 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -15.959 -7.780 0.597 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -14.718 -7.165 -0.477 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -14.407 -9.886 -0.856 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -16.126 -9.805 -0.524 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -16.400 -8.052 -2.288 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -14.676 -8.082 -2.601 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -15.876 -9.484 -4.169 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -14.854 -10.435 -3.203 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -16.524 -10.406 -2.900 1.00 0.00 H new ATOM 832 N GLN A 55 -16.168 -6.855 3.277 1.00 0.00 N ATOM 833 CA GLN A 55 -17.381 -7.117 4.101 1.00 0.00 C ATOM 834 C GLN A 55 -16.961 -7.767 5.421 1.00 0.00 C ATOM 835 O GLN A 55 -15.826 -7.664 5.839 1.00 0.00 O ATOM 836 CB GLN A 55 -18.320 -8.059 3.345 1.00 0.00 C ATOM 837 CG GLN A 55 -19.672 -7.375 3.131 1.00 0.00 C ATOM 838 CD GLN A 55 -20.682 -8.394 2.600 1.00 0.00 C ATOM 839 OE1 GLN A 55 -20.665 -8.732 1.433 1.00 0.00 O ATOM 840 NE2 GLN A 55 -21.566 -8.902 3.414 1.00 0.00 N ATOM 0 H GLN A 55 -16.127 -5.933 2.843 1.00 0.00 H new ATOM 0 HA GLN A 55 -17.897 -6.178 4.302 1.00 0.00 H new ATOM 0 HB2 GLN A 55 -17.883 -8.331 2.384 1.00 0.00 H new ATOM 0 HB3 GLN A 55 -18.454 -8.983 3.907 1.00 0.00 H new ATOM 0 HG2 GLN A 55 -20.028 -6.949 4.069 1.00 0.00 H new ATOM 0 HG3 GLN A 55 -19.567 -6.550 2.426 1.00 0.00 H new ATOM 0 HE21 GLN A 55 -21.580 -8.618 4.394 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -22.243 -9.583 3.071 1.00 0.00 H new ATOM 849 N HIS A 56 -17.864 -8.443 6.077 1.00 0.00 N ATOM 850 CA HIS A 56 -17.508 -9.103 7.364 1.00 0.00 C ATOM 851 C HIS A 56 -16.733 -10.389 7.070 1.00 0.00 C ATOM 852 O HIS A 56 -17.297 -11.390 6.674 1.00 0.00 O ATOM 853 CB HIS A 56 -18.782 -9.440 8.139 1.00 0.00 C ATOM 854 CG HIS A 56 -18.426 -10.225 9.370 1.00 0.00 C ATOM 855 ND1 HIS A 56 -18.015 -11.524 9.543 1.00 0.00 N flip ATOM 856 CD2 HIS A 56 -18.473 -9.672 10.640 1.00 0.00 C flip ATOM 857 CE1 HIS A 56 -17.809 -11.774 10.896 1.00 0.00 C flip ATOM 858 NE2 HIS A 56 -18.100 -10.625 11.513 1.00 0.00 N flip ATOM 0 H HIS A 56 -18.831 -8.567 5.778 1.00 0.00 H new ATOM 0 HA HIS A 56 -16.892 -8.431 7.962 1.00 0.00 H new ATOM 0 HB2 HIS A 56 -19.304 -8.525 8.417 1.00 0.00 H new ATOM 0 HB3 HIS A 56 -19.461 -10.016 7.511 1.00 0.00 H new ATOM 0 HD1 HIS A 56 -17.881 -12.203 8.793 1.00 0.00 H new ATOM 0 HD2 HIS A 56 -18.758 -8.659 10.884 1.00 0.00 H new ATOM 0 HE1 HIS A 56 -17.484 -12.698 11.350 1.00 0.00 H new ATOM 866 N GLY A 57 -15.440 -10.369 7.253 1.00 0.00 N ATOM 867 CA GLY A 57 -14.627 -11.587 6.979 1.00 0.00 C ATOM 868 C GLY A 57 -13.895 -11.416 5.647 1.00 0.00 C ATOM 869 O GLY A 57 -14.039 -10.414 4.974 1.00 0.00 O ATOM 0 H GLY A 57 -14.912 -9.560 7.581 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -13.909 -11.748 7.784 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -15.269 -12.467 6.944 1.00 0.00 H new ATOM 873 N HIS A 58 -13.111 -12.383 5.257 1.00 0.00 N ATOM 874 CA HIS A 58 -12.375 -12.270 3.967 1.00 0.00 C ATOM 875 C HIS A 58 -11.414 -11.080 4.031 1.00 0.00 C ATOM 876 O HIS A 58 -11.795 -9.983 4.388 1.00 0.00 O ATOM 877 CB HIS A 58 -13.376 -12.055 2.829 1.00 0.00 C ATOM 878 CG HIS A 58 -12.889 -12.752 1.588 1.00 0.00 C ATOM 879 ND1 HIS A 58 -13.418 -12.481 0.335 1.00 0.00 N ATOM 880 CD2 HIS A 58 -11.926 -13.710 1.389 1.00 0.00 C ATOM 881 CE1 HIS A 58 -12.776 -13.262 -0.553 1.00 0.00 C ATOM 882 NE2 HIS A 58 -11.857 -14.031 0.036 1.00 0.00 N ATOM 0 H HIS A 58 -12.948 -13.246 5.776 1.00 0.00 H new ATOM 0 HA HIS A 58 -11.810 -13.185 3.788 1.00 0.00 H new ATOM 0 HB2 HIS A 58 -14.355 -12.441 3.114 1.00 0.00 H new ATOM 0 HB3 HIS A 58 -13.498 -10.989 2.635 1.00 0.00 H new ATOM 0 HD2 HIS A 58 -11.315 -14.148 2.164 1.00 0.00 H new ATOM 0 HE1 HIS A 58 -12.979 -13.266 -1.614 1.00 0.00 H new ATOM 0 HE2 HIS A 58 -11.238 -14.708 -0.409 1.00 0.00 H new ATOM 890 N GLU A 59 -10.172 -11.285 3.687 1.00 0.00 N ATOM 891 CA GLU A 59 -9.194 -10.162 3.730 1.00 0.00 C ATOM 892 C GLU A 59 -8.365 -10.159 2.444 1.00 0.00 C ATOM 893 O GLU A 59 -7.887 -11.185 2.001 1.00 0.00 O ATOM 894 CB GLU A 59 -8.263 -10.339 4.931 1.00 0.00 C ATOM 895 CG GLU A 59 -9.093 -10.427 6.214 1.00 0.00 C ATOM 896 CD GLU A 59 -8.867 -11.788 6.875 1.00 0.00 C ATOM 897 OE1 GLU A 59 -9.492 -12.744 6.445 1.00 0.00 O ATOM 898 OE2 GLU A 59 -8.074 -11.852 7.800 1.00 0.00 O ATOM 0 H GLU A 59 -9.793 -12.180 3.379 1.00 0.00 H new ATOM 0 HA GLU A 59 -9.731 -9.218 3.822 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -7.664 -11.242 4.810 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -7.568 -9.502 4.992 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -8.810 -9.627 6.898 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -10.150 -10.293 5.986 1.00 0.00 H new ATOM 905 N GLU A 60 -8.188 -9.014 1.840 1.00 0.00 N ATOM 906 CA GLU A 60 -7.388 -8.957 0.584 1.00 0.00 C ATOM 907 C GLU A 60 -6.012 -8.358 0.879 1.00 0.00 C ATOM 908 O GLU A 60 -5.760 -7.851 1.954 1.00 0.00 O ATOM 909 CB GLU A 60 -8.113 -8.087 -0.444 1.00 0.00 C ATOM 910 CG GLU A 60 -7.937 -8.694 -1.837 1.00 0.00 C ATOM 911 CD GLU A 60 -9.154 -8.356 -2.700 1.00 0.00 C ATOM 912 OE1 GLU A 60 -10.257 -8.660 -2.278 1.00 0.00 O ATOM 913 OE2 GLU A 60 -8.962 -7.800 -3.768 1.00 0.00 O ATOM 0 H GLU A 60 -8.561 -8.120 2.161 1.00 0.00 H new ATOM 0 HA GLU A 60 -7.267 -9.965 0.187 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -9.172 -8.018 -0.196 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -7.715 -7.073 -0.424 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -7.030 -8.307 -2.302 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -7.820 -9.775 -1.762 1.00 0.00 H new ATOM 920 N PHE A 61 -5.120 -8.412 -0.071 1.00 0.00 N ATOM 921 CA PHE A 61 -3.759 -7.847 0.145 1.00 0.00 C ATOM 922 C PHE A 61 -3.375 -6.988 -1.060 1.00 0.00 C ATOM 923 O PHE A 61 -3.362 -7.450 -2.184 1.00 0.00 O ATOM 924 CB PHE A 61 -2.752 -8.988 0.295 1.00 0.00 C ATOM 925 CG PHE A 61 -2.309 -9.089 1.734 1.00 0.00 C ATOM 926 CD1 PHE A 61 -3.053 -9.843 2.650 1.00 0.00 C ATOM 927 CD2 PHE A 61 -1.148 -8.432 2.148 1.00 0.00 C ATOM 928 CE1 PHE A 61 -2.631 -9.938 3.982 1.00 0.00 C ATOM 929 CE2 PHE A 61 -0.724 -8.527 3.478 1.00 0.00 C ATOM 930 CZ PHE A 61 -1.466 -9.279 4.396 1.00 0.00 C ATOM 0 H PHE A 61 -5.276 -8.825 -0.991 1.00 0.00 H new ATOM 0 HA PHE A 61 -3.755 -7.237 1.048 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -3.203 -9.928 -0.024 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -1.891 -8.813 -0.349 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -3.951 -10.350 2.330 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -0.577 -7.850 1.440 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -3.203 -10.519 4.690 1.00 0.00 H new ATOM 0 HE2 PHE A 61 0.175 -8.020 3.796 1.00 0.00 H new ATOM 0 HZ PHE A 61 -1.141 -9.351 5.423 1.00 0.00 H new ATOM 940 N ILE A 62 -3.062 -5.741 -0.841 1.00 0.00 N ATOM 941 CA ILE A 62 -2.682 -4.863 -1.983 1.00 0.00 C ATOM 942 C ILE A 62 -1.486 -3.993 -1.594 1.00 0.00 C ATOM 943 O ILE A 62 -1.097 -3.925 -0.445 1.00 0.00 O ATOM 944 CB ILE A 62 -3.866 -3.969 -2.355 1.00 0.00 C ATOM 945 CG1 ILE A 62 -5.165 -4.769 -2.235 1.00 0.00 C ATOM 946 CG2 ILE A 62 -3.702 -3.479 -3.795 1.00 0.00 C ATOM 947 CD1 ILE A 62 -5.798 -4.518 -0.865 1.00 0.00 C ATOM 0 H ILE A 62 -3.053 -5.293 0.075 1.00 0.00 H new ATOM 0 HA ILE A 62 -2.411 -5.483 -2.838 1.00 0.00 H new ATOM 0 HB ILE A 62 -3.901 -3.113 -1.681 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -5.857 -4.478 -3.025 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -4.962 -5.832 -2.364 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -4.545 -2.842 -4.061 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -2.776 -2.911 -3.883 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -3.667 -4.335 -4.469 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -6.723 -5.089 -0.782 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -5.107 -4.831 -0.082 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -6.016 -3.456 -0.754 1.00 0.00 H new ATOM 959 N TYR A 63 -0.899 -3.328 -2.551 1.00 0.00 N ATOM 960 CA TYR A 63 0.275 -2.458 -2.258 1.00 0.00 C ATOM 961 C TYR A 63 0.407 -1.421 -3.381 1.00 0.00 C ATOM 962 O TYR A 63 0.145 -1.706 -4.532 1.00 0.00 O ATOM 963 CB TYR A 63 1.538 -3.337 -2.177 1.00 0.00 C ATOM 964 CG TYR A 63 2.773 -2.538 -2.532 1.00 0.00 C ATOM 965 CD1 TYR A 63 3.036 -2.222 -3.870 1.00 0.00 C ATOM 966 CD2 TYR A 63 3.655 -2.117 -1.528 1.00 0.00 C ATOM 967 CE1 TYR A 63 4.177 -1.485 -4.205 1.00 0.00 C ATOM 968 CE2 TYR A 63 4.797 -1.380 -1.863 1.00 0.00 C ATOM 969 CZ TYR A 63 5.058 -1.064 -3.202 1.00 0.00 C ATOM 970 OH TYR A 63 6.183 -0.338 -3.533 1.00 0.00 O ATOM 0 H TYR A 63 -1.184 -3.350 -3.530 1.00 0.00 H new ATOM 0 HA TYR A 63 0.147 -1.939 -1.308 1.00 0.00 H new ATOM 0 HB2 TYR A 63 1.639 -3.744 -1.171 1.00 0.00 H new ATOM 0 HB3 TYR A 63 1.441 -4.185 -2.855 1.00 0.00 H new ATOM 0 HD1 TYR A 63 2.357 -2.547 -4.645 1.00 0.00 H new ATOM 0 HD2 TYR A 63 3.454 -2.361 -0.495 1.00 0.00 H new ATOM 0 HE1 TYR A 63 4.378 -1.241 -5.238 1.00 0.00 H new ATOM 0 HE2 TYR A 63 5.477 -1.055 -1.089 1.00 0.00 H new ATOM 0 HH TYR A 63 6.006 0.191 -4.339 1.00 0.00 H new ATOM 980 N LEU A 64 0.809 -0.222 -3.058 1.00 0.00 N ATOM 981 CA LEU A 64 0.950 0.820 -4.115 1.00 0.00 C ATOM 982 C LEU A 64 1.685 2.040 -3.554 1.00 0.00 C ATOM 983 O LEU A 64 2.310 1.979 -2.512 1.00 0.00 O ATOM 984 CB LEU A 64 -0.436 1.243 -4.601 1.00 0.00 C ATOM 985 CG LEU A 64 -1.176 1.962 -3.473 1.00 0.00 C ATOM 986 CD1 LEU A 64 -1.764 3.271 -4.001 1.00 0.00 C ATOM 987 CD2 LEU A 64 -2.306 1.069 -2.957 1.00 0.00 C ATOM 0 H LEU A 64 1.045 0.080 -2.113 1.00 0.00 H new ATOM 0 HA LEU A 64 1.522 0.409 -4.946 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -0.345 1.899 -5.466 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -1.002 0.369 -4.922 1.00 0.00 H new ATOM 0 HG LEU A 64 -0.481 2.177 -2.662 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -2.292 3.783 -3.197 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -0.960 3.908 -4.371 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -2.460 3.056 -4.812 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -2.835 1.580 -2.152 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -3.000 0.855 -3.769 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -1.889 0.135 -2.581 1.00 0.00 H new ATOM 999 N SER A 65 1.613 3.148 -4.241 1.00 0.00 N ATOM 1000 CA SER A 65 2.303 4.377 -3.759 1.00 0.00 C ATOM 1001 C SER A 65 1.269 5.351 -3.186 1.00 0.00 C ATOM 1002 O SER A 65 0.292 4.949 -2.585 1.00 0.00 O ATOM 1003 CB SER A 65 3.040 5.033 -4.927 1.00 0.00 C ATOM 1004 OG SER A 65 2.105 5.723 -5.744 1.00 0.00 O ATOM 0 H SER A 65 1.104 3.254 -5.118 1.00 0.00 H new ATOM 0 HA SER A 65 3.019 4.115 -2.980 1.00 0.00 H new ATOM 0 HB2 SER A 65 3.794 5.725 -4.553 1.00 0.00 H new ATOM 0 HB3 SER A 65 3.563 4.277 -5.512 1.00 0.00 H new ATOM 0 HG SER A 65 2.575 6.146 -6.493 1.00 0.00 H new ATOM 1010 N GLY A 66 1.473 6.630 -3.363 1.00 0.00 N ATOM 1011 CA GLY A 66 0.500 7.623 -2.826 1.00 0.00 C ATOM 1012 C GLY A 66 -0.487 8.028 -3.923 1.00 0.00 C ATOM 1013 O GLY A 66 -1.002 7.199 -4.646 1.00 0.00 O ATOM 0 H GLY A 66 2.272 7.029 -3.856 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -0.038 7.197 -1.979 1.00 0.00 H new ATOM 0 HA3 GLY A 66 1.029 8.502 -2.458 1.00 0.00 H new ATOM 1017 N GLY A 67 -0.756 9.299 -4.049 1.00 0.00 N ATOM 1018 CA GLY A 67 -1.712 9.758 -5.097 1.00 0.00 C ATOM 1019 C GLY A 67 -2.774 10.656 -4.456 1.00 0.00 C ATOM 1020 O GLY A 67 -2.638 11.084 -3.326 1.00 0.00 O ATOM 0 H GLY A 67 -0.356 10.039 -3.472 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -1.180 10.304 -5.876 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -2.185 8.900 -5.575 1.00 0.00 H new ATOM 1024 N ILE A 68 -3.831 10.943 -5.166 1.00 0.00 N ATOM 1025 CA ILE A 68 -4.902 11.811 -4.595 1.00 0.00 C ATOM 1026 C ILE A 68 -6.103 10.940 -4.217 1.00 0.00 C ATOM 1027 O ILE A 68 -6.622 10.202 -5.030 1.00 0.00 O ATOM 1028 CB ILE A 68 -5.326 12.845 -5.639 1.00 0.00 C ATOM 1029 CG1 ILE A 68 -6.294 13.846 -5.003 1.00 0.00 C ATOM 1030 CG2 ILE A 68 -6.017 12.138 -6.805 1.00 0.00 C ATOM 1031 CD1 ILE A 68 -6.574 14.980 -5.989 1.00 0.00 C ATOM 0 H ILE A 68 -4.000 10.614 -6.117 1.00 0.00 H new ATOM 0 HA ILE A 68 -4.530 12.325 -3.709 1.00 0.00 H new ATOM 0 HB ILE A 68 -4.446 13.374 -6.005 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -7.224 13.347 -4.732 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -5.868 14.246 -4.083 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -6.319 12.875 -7.549 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -5.328 11.426 -7.259 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -6.897 11.609 -6.440 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -7.263 15.693 -5.537 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -5.640 15.485 -6.237 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -7.018 14.572 -6.897 1.00 0.00 H new ATOM 1043 N LEU A 69 -6.544 11.010 -2.989 1.00 0.00 N ATOM 1044 CA LEU A 69 -7.703 10.170 -2.573 1.00 0.00 C ATOM 1045 C LEU A 69 -8.909 11.055 -2.248 1.00 0.00 C ATOM 1046 O LEU A 69 -8.798 12.258 -2.117 1.00 0.00 O ATOM 1047 CB LEU A 69 -7.321 9.353 -1.332 1.00 0.00 C ATOM 1048 CG LEU A 69 -7.352 10.247 -0.088 1.00 0.00 C ATOM 1049 CD1 LEU A 69 -8.782 10.320 0.456 1.00 0.00 C ATOM 1050 CD2 LEU A 69 -6.432 9.661 0.985 1.00 0.00 C ATOM 0 H LEU A 69 -6.154 11.609 -2.261 1.00 0.00 H new ATOM 0 HA LEU A 69 -7.966 9.499 -3.391 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -8.012 8.519 -1.208 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -6.326 8.926 -1.459 1.00 0.00 H new ATOM 0 HG LEU A 69 -7.012 11.248 -0.354 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -8.803 10.956 1.341 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -9.440 10.737 -0.306 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -9.122 9.319 0.721 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -6.454 10.297 1.870 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -6.773 8.660 1.249 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -5.413 9.608 0.601 1.00 0.00 H new ATOM 1062 N GLU A 70 -10.057 10.455 -2.106 1.00 0.00 N ATOM 1063 CA GLU A 70 -11.285 11.232 -1.774 1.00 0.00 C ATOM 1064 C GLU A 70 -12.337 10.265 -1.232 1.00 0.00 C ATOM 1065 O GLU A 70 -12.683 9.295 -1.872 1.00 0.00 O ATOM 1066 CB GLU A 70 -11.817 11.923 -3.030 1.00 0.00 C ATOM 1067 CG GLU A 70 -11.872 10.921 -4.184 1.00 0.00 C ATOM 1068 CD GLU A 70 -13.092 11.216 -5.056 1.00 0.00 C ATOM 1069 OE1 GLU A 70 -14.194 11.181 -4.531 1.00 0.00 O ATOM 1070 OE2 GLU A 70 -12.906 11.473 -6.234 1.00 0.00 O ATOM 0 H GLU A 70 -10.199 9.450 -2.207 1.00 0.00 H new ATOM 0 HA GLU A 70 -11.055 11.992 -1.027 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -12.811 12.329 -2.840 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -11.175 12.763 -3.295 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -10.961 10.986 -4.780 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -11.927 9.904 -3.795 1.00 0.00 H new ATOM 1077 N VAL A 71 -12.836 10.503 -0.052 1.00 0.00 N ATOM 1078 CA VAL A 71 -13.847 9.570 0.519 1.00 0.00 C ATOM 1079 C VAL A 71 -15.258 10.135 0.337 1.00 0.00 C ATOM 1080 O VAL A 71 -15.481 11.326 0.411 1.00 0.00 O ATOM 1081 CB VAL A 71 -13.567 9.369 2.009 1.00 0.00 C ATOM 1082 CG1 VAL A 71 -13.932 10.641 2.777 1.00 0.00 C ATOM 1083 CG2 VAL A 71 -14.408 8.201 2.527 1.00 0.00 C ATOM 0 H VAL A 71 -12.590 11.297 0.539 1.00 0.00 H new ATOM 0 HA VAL A 71 -13.781 8.615 -0.003 1.00 0.00 H new ATOM 0 HB VAL A 71 -12.509 9.152 2.155 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -13.732 10.495 3.838 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -13.335 11.474 2.406 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -14.990 10.861 2.634 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -14.212 8.054 3.589 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -15.465 8.421 2.381 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -14.147 7.294 1.981 1.00 0.00 H new ATOM 1093 N GLN A 72 -16.215 9.274 0.109 1.00 0.00 N ATOM 1094 CA GLN A 72 -17.619 9.736 -0.066 1.00 0.00 C ATOM 1095 C GLN A 72 -18.501 9.048 0.980 1.00 0.00 C ATOM 1096 O GLN A 72 -18.032 8.209 1.724 1.00 0.00 O ATOM 1097 CB GLN A 72 -18.108 9.374 -1.469 1.00 0.00 C ATOM 1098 CG GLN A 72 -18.382 10.656 -2.259 1.00 0.00 C ATOM 1099 CD GLN A 72 -17.357 10.791 -3.386 1.00 0.00 C ATOM 1100 OE1 GLN A 72 -16.518 9.931 -3.565 1.00 0.00 O ATOM 1101 NE2 GLN A 72 -17.387 11.843 -4.158 1.00 0.00 N ATOM 0 H GLN A 72 -16.081 8.265 0.037 1.00 0.00 H new ATOM 0 HA GLN A 72 -17.671 10.817 0.061 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -17.359 8.770 -1.982 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -19.014 8.772 -1.406 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -19.391 10.633 -2.672 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -18.328 11.521 -1.598 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -18.091 12.566 -4.008 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -16.706 11.943 -4.911 1.00 0.00 H new ATOM 1110 N PRO A 73 -19.751 9.424 1.008 1.00 0.00 N ATOM 1111 CA PRO A 73 -20.726 8.861 1.958 1.00 0.00 C ATOM 1112 C PRO A 73 -21.177 7.465 1.513 1.00 0.00 C ATOM 1113 O PRO A 73 -22.269 7.285 1.014 1.00 0.00 O ATOM 1114 CB PRO A 73 -21.887 9.858 1.912 1.00 0.00 C ATOM 1115 CG PRO A 73 -21.769 10.604 0.561 1.00 0.00 C ATOM 1116 CD PRO A 73 -20.310 10.444 0.097 1.00 0.00 C ATOM 0 HA PRO A 73 -20.320 8.733 2.961 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -22.845 9.343 1.989 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -21.833 10.556 2.747 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -22.457 10.186 -0.174 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -22.026 11.657 0.676 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -20.256 10.122 -0.943 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -19.764 11.384 0.169 1.00 0.00 H new ATOM 1124 N GLY A 74 -20.345 6.475 1.700 1.00 0.00 N ATOM 1125 CA GLY A 74 -20.728 5.090 1.297 1.00 0.00 C ATOM 1126 C GLY A 74 -19.594 4.446 0.496 1.00 0.00 C ATOM 1127 O GLY A 74 -19.351 3.260 0.595 1.00 0.00 O ATOM 0 H GLY A 74 -19.417 6.565 2.114 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -20.945 4.492 2.182 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -21.639 5.115 0.698 1.00 0.00 H new ATOM 1131 N ASN A 75 -18.899 5.212 -0.301 1.00 0.00 N ATOM 1132 CA ASN A 75 -17.788 4.627 -1.105 1.00 0.00 C ATOM 1133 C ASN A 75 -16.637 5.631 -1.209 1.00 0.00 C ATOM 1134 O ASN A 75 -16.841 6.828 -1.196 1.00 0.00 O ATOM 1135 CB ASN A 75 -18.298 4.290 -2.508 1.00 0.00 C ATOM 1136 CG ASN A 75 -18.809 5.562 -3.186 1.00 0.00 C ATOM 1137 OD1 ASN A 75 -19.946 6.077 -2.808 1.00 0.00 O flip ATOM 1138 ND2 ASN A 75 -18.166 6.093 -4.071 1.00 0.00 N flip ATOM 0 H ASN A 75 -19.051 6.212 -0.430 1.00 0.00 H new ATOM 0 HA ASN A 75 -17.430 3.720 -0.617 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -17.498 3.846 -3.100 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -19.097 3.551 -2.448 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -17.277 5.691 -4.367 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -18.516 6.941 -4.517 1.00 0.00 H new ATOM 1145 N VAL A 76 -15.427 5.150 -1.314 1.00 0.00 N ATOM 1146 CA VAL A 76 -14.264 6.069 -1.420 1.00 0.00 C ATOM 1147 C VAL A 76 -13.430 5.695 -2.649 1.00 0.00 C ATOM 1148 O VAL A 76 -13.307 4.538 -2.998 1.00 0.00 O ATOM 1149 CB VAL A 76 -13.403 5.940 -0.164 1.00 0.00 C ATOM 1150 CG1 VAL A 76 -13.003 4.477 0.032 1.00 0.00 C ATOM 1151 CG2 VAL A 76 -12.148 6.790 -0.328 1.00 0.00 C ATOM 0 H VAL A 76 -15.196 4.157 -1.331 1.00 0.00 H new ATOM 0 HA VAL A 76 -14.617 7.096 -1.518 1.00 0.00 H new ATOM 0 HB VAL A 76 -13.968 6.281 0.704 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -12.389 4.385 0.928 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -13.899 3.866 0.142 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -12.435 4.136 -0.834 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -11.530 6.702 0.565 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -11.585 6.444 -1.195 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -12.431 7.833 -0.472 1.00 0.00 H new ATOM 1161 N THR A 77 -12.856 6.665 -3.305 1.00 0.00 N ATOM 1162 CA THR A 77 -12.030 6.366 -4.508 1.00 0.00 C ATOM 1163 C THR A 77 -10.704 7.126 -4.423 1.00 0.00 C ATOM 1164 O THR A 77 -10.601 8.149 -3.775 1.00 0.00 O ATOM 1165 CB THR A 77 -12.782 6.806 -5.768 1.00 0.00 C ATOM 1166 OG1 THR A 77 -13.283 8.128 -5.594 1.00 0.00 O ATOM 1167 CG2 THR A 77 -13.944 5.848 -6.034 1.00 0.00 C ATOM 0 H THR A 77 -12.923 7.653 -3.060 1.00 0.00 H new ATOM 0 HA THR A 77 -11.835 5.294 -4.552 1.00 0.00 H new ATOM 0 HB THR A 77 -12.098 6.790 -6.617 1.00 0.00 H new ATOM 0 HG1 THR A 77 -13.762 8.405 -6.403 1.00 0.00 H new ATOM 0 HG21 THR A 77 -14.477 6.163 -6.931 1.00 0.00 H new ATOM 0 HG22 THR A 77 -13.558 4.839 -6.177 1.00 0.00 H new ATOM 0 HG23 THR A 77 -14.626 5.858 -5.184 1.00 0.00 H new ATOM 1175 N VAL A 78 -9.690 6.633 -5.079 1.00 0.00 N ATOM 1176 CA VAL A 78 -8.367 7.321 -5.049 1.00 0.00 C ATOM 1177 C VAL A 78 -7.511 6.802 -6.205 1.00 0.00 C ATOM 1178 O VAL A 78 -7.692 5.695 -6.673 1.00 0.00 O ATOM 1179 CB VAL A 78 -7.670 7.034 -3.715 1.00 0.00 C ATOM 1180 CG1 VAL A 78 -7.774 5.543 -3.393 1.00 0.00 C ATOM 1181 CG2 VAL A 78 -6.194 7.432 -3.812 1.00 0.00 C ATOM 0 H VAL A 78 -9.720 5.780 -5.637 1.00 0.00 H new ATOM 0 HA VAL A 78 -8.506 8.397 -5.152 1.00 0.00 H new ATOM 0 HB VAL A 78 -8.151 7.611 -2.925 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -7.278 5.340 -2.444 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -8.824 5.259 -3.322 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -7.295 4.966 -4.184 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -5.699 7.228 -2.863 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -5.713 6.857 -4.603 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -6.118 8.495 -4.039 1.00 0.00 H new ATOM 1191 N LEU A 79 -6.584 7.589 -6.676 1.00 0.00 N ATOM 1192 CA LEU A 79 -5.728 7.133 -7.806 1.00 0.00 C ATOM 1193 C LEU A 79 -4.253 7.353 -7.461 1.00 0.00 C ATOM 1194 O LEU A 79 -3.918 8.125 -6.584 1.00 0.00 O ATOM 1195 CB LEU A 79 -6.082 7.929 -9.064 1.00 0.00 C ATOM 1196 CG LEU A 79 -7.585 7.827 -9.328 1.00 0.00 C ATOM 1197 CD1 LEU A 79 -8.068 9.093 -10.039 1.00 0.00 C ATOM 1198 CD2 LEU A 79 -7.867 6.610 -10.214 1.00 0.00 C ATOM 0 H LEU A 79 -6.383 8.526 -6.328 1.00 0.00 H new ATOM 0 HA LEU A 79 -5.900 6.071 -7.983 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -5.794 8.973 -8.939 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -5.525 7.545 -9.919 1.00 0.00 H new ATOM 0 HG LEU A 79 -8.111 7.719 -8.380 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -9.139 9.019 -10.226 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -7.869 9.961 -9.411 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -7.541 9.202 -10.987 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -8.938 6.537 -10.402 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -7.339 6.719 -11.161 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -7.525 5.706 -9.710 1.00 0.00 H new ATOM 1210 N ALA A 80 -3.368 6.680 -8.147 1.00 0.00 N ATOM 1211 CA ALA A 80 -1.915 6.850 -7.860 1.00 0.00 C ATOM 1212 C ALA A 80 -1.114 6.619 -9.144 1.00 0.00 C ATOM 1213 O ALA A 80 -1.572 6.899 -10.233 1.00 0.00 O ATOM 1214 CB ALA A 80 -1.481 5.840 -6.797 1.00 0.00 C ATOM 0 H ALA A 80 -3.589 6.020 -8.893 1.00 0.00 H new ATOM 0 HA ALA A 80 -1.732 7.860 -7.493 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -0.419 5.965 -6.588 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -2.052 6.005 -5.884 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -1.662 4.829 -7.161 1.00 0.00 H new ATOM 1220 N ASP A 81 0.083 6.111 -9.025 1.00 0.00 N ATOM 1221 CA ASP A 81 0.910 5.864 -10.239 1.00 0.00 C ATOM 1222 C ASP A 81 1.420 4.421 -10.230 1.00 0.00 C ATOM 1223 O ASP A 81 1.573 3.800 -11.263 1.00 0.00 O ATOM 1224 CB ASP A 81 2.102 6.824 -10.244 1.00 0.00 C ATOM 1225 CG ASP A 81 1.603 8.258 -10.063 1.00 0.00 C ATOM 1226 OD1 ASP A 81 0.401 8.459 -10.121 1.00 0.00 O ATOM 1227 OD2 ASP A 81 2.432 9.133 -9.868 1.00 0.00 O ATOM 0 H ASP A 81 0.523 5.857 -8.140 1.00 0.00 H new ATOM 0 HA ASP A 81 0.303 6.027 -11.130 1.00 0.00 H new ATOM 0 HB2 ASP A 81 2.795 6.565 -9.443 1.00 0.00 H new ATOM 0 HB3 ASP A 81 2.651 6.734 -11.181 1.00 0.00 H new ATOM 1232 N THR A 82 1.687 3.882 -9.071 1.00 0.00 N ATOM 1233 CA THR A 82 2.190 2.484 -8.996 1.00 0.00 C ATOM 1234 C THR A 82 1.133 1.593 -8.339 1.00 0.00 C ATOM 1235 O THR A 82 0.207 2.072 -7.713 1.00 0.00 O ATOM 1236 CB THR A 82 3.471 2.457 -8.163 1.00 0.00 C ATOM 1237 OG1 THR A 82 4.494 3.168 -8.847 1.00 0.00 O ATOM 1238 CG2 THR A 82 3.910 1.011 -7.946 1.00 0.00 C ATOM 0 H THR A 82 1.578 4.352 -8.172 1.00 0.00 H new ATOM 0 HA THR A 82 2.397 2.114 -10.000 1.00 0.00 H new ATOM 0 HB THR A 82 3.286 2.926 -7.197 1.00 0.00 H new ATOM 0 HG1 THR A 82 5.316 3.153 -8.313 1.00 0.00 H new ATOM 0 HG21 THR A 82 4.824 0.993 -7.352 1.00 0.00 H new ATOM 0 HG22 THR A 82 3.125 0.467 -7.421 1.00 0.00 H new ATOM 0 HG23 THR A 82 4.095 0.538 -8.911 1.00 0.00 H new ATOM 1246 N ALA A 83 1.263 0.300 -8.472 1.00 0.00 N ATOM 1247 CA ALA A 83 0.264 -0.616 -7.853 1.00 0.00 C ATOM 1248 C ALA A 83 0.744 -2.064 -7.983 1.00 0.00 C ATOM 1249 O ALA A 83 0.403 -2.761 -8.918 1.00 0.00 O ATOM 1250 CB ALA A 83 -1.082 -0.460 -8.564 1.00 0.00 C ATOM 0 H ALA A 83 2.017 -0.160 -8.982 1.00 0.00 H new ATOM 0 HA ALA A 83 0.150 -0.366 -6.798 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -1.813 -1.130 -8.111 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -1.426 0.570 -8.469 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -0.967 -0.708 -9.619 1.00 0.00 H new ATOM 1256 N ILE A 84 1.533 -2.522 -7.050 1.00 0.00 N ATOM 1257 CA ILE A 84 2.037 -3.925 -7.113 1.00 0.00 C ATOM 1258 C ILE A 84 1.299 -4.777 -6.078 1.00 0.00 C ATOM 1259 O ILE A 84 1.132 -4.384 -4.941 1.00 0.00 O ATOM 1260 CB ILE A 84 3.537 -3.942 -6.814 1.00 0.00 C ATOM 1261 CG1 ILE A 84 4.302 -3.344 -7.998 1.00 0.00 C ATOM 1262 CG2 ILE A 84 3.996 -5.383 -6.590 1.00 0.00 C ATOM 1263 CD1 ILE A 84 4.577 -1.863 -7.736 1.00 0.00 C ATOM 0 H ILE A 84 1.852 -1.984 -6.244 1.00 0.00 H new ATOM 0 HA ILE A 84 1.862 -4.331 -8.109 1.00 0.00 H new ATOM 0 HB ILE A 84 3.734 -3.353 -5.918 1.00 0.00 H new ATOM 0 HG12 ILE A 84 5.241 -3.878 -8.144 1.00 0.00 H new ATOM 0 HG13 ILE A 84 3.723 -3.460 -8.914 1.00 0.00 H new ATOM 0 HG21 ILE A 84 5.065 -5.395 -6.377 1.00 0.00 H new ATOM 0 HG22 ILE A 84 3.453 -5.811 -5.747 1.00 0.00 H new ATOM 0 HG23 ILE A 84 3.798 -5.971 -7.486 1.00 0.00 H new ATOM 0 HD11 ILE A 84 5.122 -1.439 -8.580 1.00 0.00 H new ATOM 0 HD12 ILE A 84 3.632 -1.334 -7.611 1.00 0.00 H new ATOM 0 HD13 ILE A 84 5.174 -1.758 -6.830 1.00 0.00 H new ATOM 1275 N ARG A 85 0.854 -5.942 -6.465 1.00 0.00 N ATOM 1276 CA ARG A 85 0.125 -6.821 -5.506 1.00 0.00 C ATOM 1277 C ARG A 85 1.020 -7.122 -4.303 1.00 0.00 C ATOM 1278 O ARG A 85 2.231 -7.103 -4.398 1.00 0.00 O ATOM 1279 CB ARG A 85 -0.247 -8.132 -6.202 1.00 0.00 C ATOM 1280 CG ARG A 85 -1.163 -8.953 -5.292 1.00 0.00 C ATOM 1281 CD ARG A 85 -1.691 -10.165 -6.064 1.00 0.00 C ATOM 1282 NE ARG A 85 -2.364 -11.101 -5.120 1.00 0.00 N ATOM 1283 CZ ARG A 85 -3.587 -10.869 -4.732 1.00 0.00 C ATOM 1284 NH1 ARG A 85 -4.590 -11.351 -5.414 1.00 0.00 N ATOM 1285 NH2 ARG A 85 -3.808 -10.155 -3.663 1.00 0.00 N ATOM 0 H ARG A 85 0.964 -6.323 -7.405 1.00 0.00 H new ATOM 0 HA ARG A 85 -0.779 -6.316 -5.167 1.00 0.00 H new ATOM 0 HB2 ARG A 85 -0.748 -7.924 -7.148 1.00 0.00 H new ATOM 0 HB3 ARG A 85 0.654 -8.700 -6.436 1.00 0.00 H new ATOM 0 HG2 ARG A 85 -0.617 -9.281 -4.408 1.00 0.00 H new ATOM 0 HG3 ARG A 85 -1.994 -8.339 -4.944 1.00 0.00 H new ATOM 0 HD2 ARG A 85 -2.392 -9.842 -6.834 1.00 0.00 H new ATOM 0 HD3 ARG A 85 -0.870 -10.672 -6.572 1.00 0.00 H new ATOM 0 HE ARG A 85 -1.868 -11.924 -4.777 1.00 0.00 H new ATOM 0 HH11 ARG A 85 -4.417 -11.909 -6.250 1.00 0.00 H new ATOM 0 HH12 ARG A 85 -5.547 -11.170 -5.111 1.00 0.00 H new ATOM 0 HH21 ARG A 85 -3.024 -9.778 -3.130 1.00 0.00 H new ATOM 0 HH22 ARG A 85 -4.765 -9.974 -3.360 1.00 0.00 H new ATOM 1299 N GLY A 86 0.434 -7.406 -3.172 1.00 0.00 N ATOM 1300 CA GLY A 86 1.252 -7.712 -1.965 1.00 0.00 C ATOM 1301 C GLY A 86 2.278 -8.792 -2.309 1.00 0.00 C ATOM 1302 O GLY A 86 3.380 -8.803 -1.796 1.00 0.00 O ATOM 0 H GLY A 86 -0.576 -7.439 -3.032 1.00 0.00 H new ATOM 0 HA2 GLY A 86 1.758 -6.812 -1.617 1.00 0.00 H new ATOM 0 HA3 GLY A 86 0.609 -8.051 -1.152 1.00 0.00 H new ATOM 1306 N GLN A 87 1.927 -9.703 -3.176 1.00 0.00 N ATOM 1307 CA GLN A 87 2.884 -10.780 -3.552 1.00 0.00 C ATOM 1308 C GLN A 87 2.781 -11.060 -5.053 1.00 0.00 C ATOM 1309 O GLN A 87 2.755 -12.196 -5.482 1.00 0.00 O ATOM 1310 CB GLN A 87 2.547 -12.053 -2.774 1.00 0.00 C ATOM 1311 CG GLN A 87 1.027 -12.195 -2.658 1.00 0.00 C ATOM 1312 CD GLN A 87 0.632 -13.655 -2.881 1.00 0.00 C ATOM 1313 OE1 GLN A 87 -0.145 -13.958 -3.764 1.00 0.00 O ATOM 1314 NE2 GLN A 87 1.137 -14.581 -2.112 1.00 0.00 N ATOM 0 H GLN A 87 1.019 -9.747 -3.639 1.00 0.00 H new ATOM 0 HA GLN A 87 3.899 -10.462 -3.312 1.00 0.00 H new ATOM 0 HB2 GLN A 87 2.966 -12.923 -3.280 1.00 0.00 H new ATOM 0 HB3 GLN A 87 2.996 -12.015 -1.781 1.00 0.00 H new ATOM 0 HG2 GLN A 87 0.694 -11.863 -1.674 1.00 0.00 H new ATOM 0 HG3 GLN A 87 0.535 -11.558 -3.393 1.00 0.00 H new ATOM 0 HE21 GLN A 87 1.790 -14.328 -1.370 1.00 0.00 H new ATOM 0 HE22 GLN A 87 0.879 -15.558 -2.253 1.00 0.00 H new ATOM 1323 N ASP A 88 2.723 -10.033 -5.857 1.00 0.00 N ATOM 1324 CA ASP A 88 2.623 -10.246 -7.329 1.00 0.00 C ATOM 1325 C ASP A 88 3.855 -11.010 -7.822 1.00 0.00 C ATOM 1326 O ASP A 88 3.783 -11.787 -8.753 1.00 0.00 O ATOM 1327 CB ASP A 88 2.548 -8.891 -8.036 1.00 0.00 C ATOM 1328 CG ASP A 88 1.435 -8.921 -9.084 1.00 0.00 C ATOM 1329 OD1 ASP A 88 1.335 -9.914 -9.785 1.00 0.00 O ATOM 1330 OD2 ASP A 88 0.701 -7.949 -9.169 1.00 0.00 O ATOM 0 H ASP A 88 2.740 -9.058 -5.559 1.00 0.00 H new ATOM 0 HA ASP A 88 1.726 -10.824 -7.551 1.00 0.00 H new ATOM 0 HB2 ASP A 88 2.357 -8.101 -7.310 1.00 0.00 H new ATOM 0 HB3 ASP A 88 3.502 -8.664 -8.511 1.00 0.00 H new ATOM 1335 N LEU A 89 4.986 -10.794 -7.206 1.00 0.00 N ATOM 1336 CA LEU A 89 6.222 -11.506 -7.645 1.00 0.00 C ATOM 1337 C LEU A 89 6.609 -12.551 -6.595 1.00 0.00 C ATOM 1338 O LEU A 89 5.799 -12.966 -5.790 1.00 0.00 O ATOM 1339 CB LEU A 89 7.371 -10.504 -7.812 1.00 0.00 C ATOM 1340 CG LEU A 89 6.807 -9.110 -8.107 1.00 0.00 C ATOM 1341 CD1 LEU A 89 7.948 -8.092 -8.140 1.00 0.00 C ATOM 1342 CD2 LEU A 89 6.100 -9.124 -9.464 1.00 0.00 C ATOM 0 H LEU A 89 5.108 -10.157 -6.419 1.00 0.00 H new ATOM 0 HA LEU A 89 6.032 -11.997 -8.599 1.00 0.00 H new ATOM 0 HB2 LEU A 89 7.976 -10.477 -6.906 1.00 0.00 H new ATOM 0 HB3 LEU A 89 8.026 -10.820 -8.624 1.00 0.00 H new ATOM 0 HG LEU A 89 6.097 -8.834 -7.327 1.00 0.00 H new ATOM 0 HD11 LEU A 89 7.546 -7.101 -8.350 1.00 0.00 H new ATOM 0 HD12 LEU A 89 8.454 -8.081 -7.175 1.00 0.00 H new ATOM 0 HD13 LEU A 89 8.659 -8.367 -8.919 1.00 0.00 H new ATOM 0 HD21 LEU A 89 5.698 -8.133 -9.675 1.00 0.00 H new ATOM 0 HD22 LEU A 89 6.811 -9.401 -10.242 1.00 0.00 H new ATOM 0 HD23 LEU A 89 5.286 -9.849 -9.443 1.00 0.00 H new ATOM 1354 N ASP A 90 7.843 -12.981 -6.598 1.00 0.00 N ATOM 1355 CA ASP A 90 8.279 -14.000 -5.602 1.00 0.00 C ATOM 1356 C ASP A 90 8.136 -13.430 -4.188 1.00 0.00 C ATOM 1357 O ASP A 90 7.728 -12.300 -4.003 1.00 0.00 O ATOM 1358 CB ASP A 90 9.741 -14.370 -5.858 1.00 0.00 C ATOM 1359 CG ASP A 90 9.920 -14.757 -7.328 1.00 0.00 C ATOM 1360 OD1 ASP A 90 8.983 -15.291 -7.898 1.00 0.00 O ATOM 1361 OD2 ASP A 90 10.992 -14.515 -7.858 1.00 0.00 O ATOM 0 H ASP A 90 8.566 -12.670 -7.247 1.00 0.00 H new ATOM 0 HA ASP A 90 7.656 -14.890 -5.698 1.00 0.00 H new ATOM 0 HB2 ASP A 90 10.389 -13.529 -5.611 1.00 0.00 H new ATOM 0 HB3 ASP A 90 10.036 -15.199 -5.214 1.00 0.00 H new ATOM 1366 N GLU A 91 8.468 -14.203 -3.190 1.00 0.00 N ATOM 1367 CA GLU A 91 8.349 -13.705 -1.790 1.00 0.00 C ATOM 1368 C GLU A 91 9.744 -13.576 -1.172 1.00 0.00 C ATOM 1369 O GLU A 91 10.162 -12.505 -0.780 1.00 0.00 O ATOM 1370 CB GLU A 91 7.519 -14.693 -0.966 1.00 0.00 C ATOM 1371 CG GLU A 91 6.120 -14.816 -1.570 1.00 0.00 C ATOM 1372 CD GLU A 91 6.000 -16.147 -2.315 1.00 0.00 C ATOM 1373 OE1 GLU A 91 6.523 -17.131 -1.818 1.00 0.00 O ATOM 1374 OE2 GLU A 91 5.387 -16.161 -3.370 1.00 0.00 O ATOM 0 H GLU A 91 8.816 -15.157 -3.283 1.00 0.00 H new ATOM 0 HA GLU A 91 7.861 -12.731 -1.793 1.00 0.00 H new ATOM 0 HB2 GLU A 91 8.006 -15.668 -0.950 1.00 0.00 H new ATOM 0 HB3 GLU A 91 7.451 -14.353 0.068 1.00 0.00 H new ATOM 0 HG2 GLU A 91 5.367 -14.758 -0.784 1.00 0.00 H new ATOM 0 HG3 GLU A 91 5.933 -13.987 -2.253 1.00 0.00 H new ATOM 1381 N ALA A 92 10.463 -14.661 -1.077 1.00 0.00 N ATOM 1382 CA ALA A 92 11.827 -14.602 -0.480 1.00 0.00 C ATOM 1383 C ALA A 92 12.811 -14.022 -1.499 1.00 0.00 C ATOM 1384 O ALA A 92 13.926 -13.670 -1.168 1.00 0.00 O ATOM 1385 CB ALA A 92 12.271 -16.013 -0.089 1.00 0.00 C ATOM 0 H ALA A 92 10.165 -15.586 -1.387 1.00 0.00 H new ATOM 0 HA ALA A 92 11.808 -13.966 0.405 1.00 0.00 H new ATOM 0 HB1 ALA A 92 13.269 -15.972 0.348 1.00 0.00 H new ATOM 0 HB2 ALA A 92 11.572 -16.426 0.639 1.00 0.00 H new ATOM 0 HB3 ALA A 92 12.289 -16.648 -0.975 1.00 0.00 H new ATOM 1391 N ARG A 93 12.409 -13.921 -2.737 1.00 0.00 N ATOM 1392 CA ARG A 93 13.324 -13.363 -3.773 1.00 0.00 C ATOM 1393 C ARG A 93 13.220 -11.838 -3.784 1.00 0.00 C ATOM 1394 O ARG A 93 13.877 -11.168 -4.558 1.00 0.00 O ATOM 1395 CB ARG A 93 12.932 -13.910 -5.147 1.00 0.00 C ATOM 1396 CG ARG A 93 14.055 -14.800 -5.684 1.00 0.00 C ATOM 1397 CD ARG A 93 13.633 -16.267 -5.583 1.00 0.00 C ATOM 1398 NE ARG A 93 13.812 -16.738 -4.182 1.00 0.00 N ATOM 1399 CZ ARG A 93 14.888 -17.395 -3.847 1.00 0.00 C ATOM 1400 NH1 ARG A 93 16.045 -16.791 -3.834 1.00 0.00 N ATOM 1401 NH2 ARG A 93 14.808 -18.659 -3.528 1.00 0.00 N ATOM 0 H ARG A 93 11.488 -14.200 -3.075 1.00 0.00 H new ATOM 0 HA ARG A 93 14.349 -13.653 -3.543 1.00 0.00 H new ATOM 0 HB2 ARG A 93 12.006 -14.481 -5.072 1.00 0.00 H new ATOM 0 HB3 ARG A 93 12.744 -13.087 -5.837 1.00 0.00 H new ATOM 0 HG2 ARG A 93 14.273 -14.543 -6.721 1.00 0.00 H new ATOM 0 HG3 ARG A 93 14.970 -14.633 -5.115 1.00 0.00 H new ATOM 0 HD2 ARG A 93 12.592 -16.379 -5.886 1.00 0.00 H new ATOM 0 HD3 ARG A 93 14.230 -16.876 -6.262 1.00 0.00 H new ATOM 0 HE ARG A 93 13.093 -16.547 -3.484 1.00 0.00 H new ATOM 0 HH11 ARG A 93 16.108 -15.805 -4.086 1.00 0.00 H new ATOM 0 HH12 ARG A 93 16.886 -17.305 -3.572 1.00 0.00 H new ATOM 0 HH21 ARG A 93 13.904 -19.132 -3.541 1.00 0.00 H new ATOM 0 HH22 ARG A 93 15.649 -19.173 -3.266 1.00 0.00 H new ATOM 1415 N ALA A 94 12.404 -11.279 -2.934 1.00 0.00 N ATOM 1416 CA ALA A 94 12.266 -9.796 -2.900 1.00 0.00 C ATOM 1417 C ALA A 94 13.272 -9.213 -1.906 1.00 0.00 C ATOM 1418 O ALA A 94 13.361 -8.014 -1.728 1.00 0.00 O ATOM 1419 CB ALA A 94 10.847 -9.425 -2.467 1.00 0.00 C ATOM 0 H ALA A 94 11.827 -11.785 -2.262 1.00 0.00 H new ATOM 0 HA ALA A 94 12.460 -9.390 -3.893 1.00 0.00 H new ATOM 0 HB1 ALA A 94 10.746 -8.340 -2.442 1.00 0.00 H new ATOM 0 HB2 ALA A 94 10.130 -9.840 -3.176 1.00 0.00 H new ATOM 0 HB3 ALA A 94 10.652 -9.830 -1.474 1.00 0.00 H new ATOM 1425 N MET A 95 14.027 -10.053 -1.251 1.00 0.00 N ATOM 1426 CA MET A 95 15.022 -9.550 -0.264 1.00 0.00 C ATOM 1427 C MET A 95 16.361 -9.295 -0.962 1.00 0.00 C ATOM 1428 O MET A 95 17.180 -8.532 -0.493 1.00 0.00 O ATOM 1429 CB MET A 95 15.211 -10.594 0.837 1.00 0.00 C ATOM 1430 CG MET A 95 14.717 -10.029 2.169 1.00 0.00 C ATOM 1431 SD MET A 95 15.683 -10.743 3.522 1.00 0.00 S ATOM 1432 CE MET A 95 16.881 -9.396 3.683 1.00 0.00 C ATOM 0 H MET A 95 13.997 -11.067 -1.358 1.00 0.00 H new ATOM 0 HA MET A 95 14.662 -8.618 0.171 1.00 0.00 H new ATOM 0 HB2 MET A 95 14.661 -11.502 0.589 1.00 0.00 H new ATOM 0 HB3 MET A 95 16.263 -10.869 0.915 1.00 0.00 H new ATOM 0 HG2 MET A 95 14.812 -8.943 2.173 1.00 0.00 H new ATOM 0 HG3 MET A 95 13.660 -10.257 2.303 1.00 0.00 H new ATOM 0 HE1 MET A 95 17.588 -9.631 4.478 1.00 0.00 H new ATOM 0 HE2 MET A 95 17.419 -9.274 2.743 1.00 0.00 H new ATOM 0 HE3 MET A 95 16.358 -8.471 3.925 1.00 0.00 H new ATOM 1442 N GLU A 96 16.592 -9.931 -2.079 1.00 0.00 N ATOM 1443 CA GLU A 96 17.881 -9.723 -2.798 1.00 0.00 C ATOM 1444 C GLU A 96 17.811 -8.428 -3.612 1.00 0.00 C ATOM 1445 O GLU A 96 18.799 -7.967 -4.146 1.00 0.00 O ATOM 1446 CB GLU A 96 18.142 -10.898 -3.743 1.00 0.00 C ATOM 1447 CG GLU A 96 18.355 -12.176 -2.929 1.00 0.00 C ATOM 1448 CD GLU A 96 19.333 -13.093 -3.668 1.00 0.00 C ATOM 1449 OE1 GLU A 96 20.499 -12.743 -3.748 1.00 0.00 O ATOM 1450 OE2 GLU A 96 18.898 -14.130 -4.141 1.00 0.00 O ATOM 0 H GLU A 96 15.946 -10.583 -2.523 1.00 0.00 H new ATOM 0 HA GLU A 96 18.689 -9.656 -2.070 1.00 0.00 H new ATOM 0 HB2 GLU A 96 17.300 -11.024 -4.423 1.00 0.00 H new ATOM 0 HB3 GLU A 96 19.020 -10.696 -4.357 1.00 0.00 H new ATOM 0 HG2 GLU A 96 18.745 -11.930 -1.941 1.00 0.00 H new ATOM 0 HG3 GLU A 96 17.404 -12.687 -2.778 1.00 0.00 H new ATOM 1457 N ALA A 97 16.650 -7.841 -3.714 1.00 0.00 N ATOM 1458 CA ALA A 97 16.523 -6.578 -4.498 1.00 0.00 C ATOM 1459 C ALA A 97 16.954 -5.391 -3.634 1.00 0.00 C ATOM 1460 O ALA A 97 17.353 -4.359 -4.136 1.00 0.00 O ATOM 1461 CB ALA A 97 15.067 -6.392 -4.927 1.00 0.00 C ATOM 0 H ALA A 97 15.786 -8.179 -3.290 1.00 0.00 H new ATOM 0 HA ALA A 97 17.161 -6.633 -5.380 1.00 0.00 H new ATOM 0 HB1 ALA A 97 14.972 -5.470 -5.500 1.00 0.00 H new ATOM 0 HB2 ALA A 97 14.759 -7.236 -5.544 1.00 0.00 H new ATOM 0 HB3 ALA A 97 14.431 -6.337 -4.043 1.00 0.00 H new ATOM 1467 N LYS A 98 16.875 -5.528 -2.338 1.00 0.00 N ATOM 1468 CA LYS A 98 17.280 -4.405 -1.445 1.00 0.00 C ATOM 1469 C LYS A 98 18.779 -4.502 -1.148 1.00 0.00 C ATOM 1470 O LYS A 98 19.434 -3.513 -0.885 1.00 0.00 O ATOM 1471 CB LYS A 98 16.494 -4.491 -0.134 1.00 0.00 C ATOM 1472 CG LYS A 98 17.010 -5.668 0.695 1.00 0.00 C ATOM 1473 CD LYS A 98 18.020 -5.162 1.729 1.00 0.00 C ATOM 1474 CE LYS A 98 17.484 -5.425 3.138 1.00 0.00 C ATOM 1475 NZ LYS A 98 18.513 -6.153 3.933 1.00 0.00 N ATOM 0 H LYS A 98 16.548 -6.368 -1.860 1.00 0.00 H new ATOM 0 HA LYS A 98 17.069 -3.455 -1.936 1.00 0.00 H new ATOM 0 HB2 LYS A 98 16.600 -3.563 0.428 1.00 0.00 H new ATOM 0 HB3 LYS A 98 15.432 -4.617 -0.342 1.00 0.00 H new ATOM 0 HG2 LYS A 98 16.179 -6.165 1.196 1.00 0.00 H new ATOM 0 HG3 LYS A 98 17.479 -6.407 0.045 1.00 0.00 H new ATOM 0 HD2 LYS A 98 18.978 -5.664 1.593 1.00 0.00 H new ATOM 0 HD3 LYS A 98 18.197 -4.096 1.589 1.00 0.00 H new ATOM 0 HE2 LYS A 98 17.233 -4.483 3.625 1.00 0.00 H new ATOM 0 HE3 LYS A 98 16.567 -6.012 3.086 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 18.149 -6.332 4.891 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 18.732 -7.059 3.471 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 19.377 -5.577 3.993 1.00 0.00 H new ATOM 1489 N ARG A 99 19.326 -5.687 -1.185 1.00 0.00 N ATOM 1490 CA ARG A 99 20.782 -5.846 -0.904 1.00 0.00 C ATOM 1491 C ARG A 99 21.595 -5.189 -2.022 1.00 0.00 C ATOM 1492 O ARG A 99 22.579 -4.521 -1.775 1.00 0.00 O ATOM 1493 CB ARG A 99 21.128 -7.334 -0.829 1.00 0.00 C ATOM 1494 CG ARG A 99 21.879 -7.620 0.473 1.00 0.00 C ATOM 1495 CD ARG A 99 22.031 -9.131 0.654 1.00 0.00 C ATOM 1496 NE ARG A 99 20.684 -9.768 0.668 1.00 0.00 N ATOM 1497 CZ ARG A 99 20.577 -11.065 0.757 1.00 0.00 C ATOM 1498 NH1 ARG A 99 21.611 -11.784 1.101 1.00 0.00 N ATOM 1499 NH2 ARG A 99 19.435 -11.644 0.507 1.00 0.00 N ATOM 0 H ARG A 99 18.828 -6.551 -1.398 1.00 0.00 H new ATOM 0 HA ARG A 99 21.021 -5.369 0.046 1.00 0.00 H new ATOM 0 HB2 ARG A 99 20.218 -7.932 -0.875 1.00 0.00 H new ATOM 0 HB3 ARG A 99 21.740 -7.619 -1.684 1.00 0.00 H new ATOM 0 HG2 ARG A 99 22.860 -7.145 0.451 1.00 0.00 H new ATOM 0 HG3 ARG A 99 21.338 -7.195 1.318 1.00 0.00 H new ATOM 0 HD2 ARG A 99 22.633 -9.546 -0.154 1.00 0.00 H new ATOM 0 HD3 ARG A 99 22.556 -9.345 1.585 1.00 0.00 H new ATOM 0 HE ARG A 99 19.846 -9.190 0.608 1.00 0.00 H new ATOM 0 HH11 ARG A 99 22.503 -11.332 1.300 1.00 0.00 H new ATOM 0 HH12 ARG A 99 21.527 -12.798 1.170 1.00 0.00 H new ATOM 0 HH21 ARG A 99 18.626 -11.083 0.242 1.00 0.00 H new ATOM 0 HH22 ARG A 99 19.351 -12.658 0.577 1.00 0.00 H new ATOM 1513 N LYS A 100 21.194 -5.376 -3.249 1.00 0.00 N ATOM 1514 CA LYS A 100 21.948 -4.763 -4.380 1.00 0.00 C ATOM 1515 C LYS A 100 21.544 -3.295 -4.529 1.00 0.00 C ATOM 1516 O LYS A 100 22.344 -2.455 -4.891 1.00 0.00 O ATOM 1517 CB LYS A 100 21.629 -5.515 -5.674 1.00 0.00 C ATOM 1518 CG LYS A 100 22.771 -6.481 -5.998 1.00 0.00 C ATOM 1519 CD LYS A 100 22.926 -6.598 -7.516 1.00 0.00 C ATOM 1520 CE LYS A 100 23.994 -5.615 -7.998 1.00 0.00 C ATOM 1521 NZ LYS A 100 25.124 -6.370 -8.609 1.00 0.00 N ATOM 0 H LYS A 100 20.378 -5.926 -3.518 1.00 0.00 H new ATOM 0 HA LYS A 100 23.017 -4.825 -4.178 1.00 0.00 H new ATOM 0 HB2 LYS A 100 20.693 -6.064 -5.567 1.00 0.00 H new ATOM 0 HB3 LYS A 100 21.492 -4.809 -6.493 1.00 0.00 H new ATOM 0 HG2 LYS A 100 23.700 -6.124 -5.553 1.00 0.00 H new ATOM 0 HG3 LYS A 100 22.566 -7.461 -5.566 1.00 0.00 H new ATOM 0 HD2 LYS A 100 23.206 -7.616 -7.786 1.00 0.00 H new ATOM 0 HD3 LYS A 100 21.976 -6.388 -8.006 1.00 0.00 H new ATOM 0 HE2 LYS A 100 23.567 -4.926 -8.726 1.00 0.00 H new ATOM 0 HE3 LYS A 100 24.354 -5.014 -7.163 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 25.851 -5.702 -8.937 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 25.537 -7.010 -7.901 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 24.775 -6.925 -9.416 1.00 0.00 H new ATOM 1535 N ALA A 101 20.308 -2.977 -4.254 1.00 0.00 N ATOM 1536 CA ALA A 101 19.858 -1.561 -4.380 1.00 0.00 C ATOM 1537 C ALA A 101 20.342 -0.765 -3.167 1.00 0.00 C ATOM 1538 O ALA A 101 20.318 0.449 -3.158 1.00 0.00 O ATOM 1539 CB ALA A 101 18.329 -1.515 -4.441 1.00 0.00 C ATOM 0 H ALA A 101 19.591 -3.635 -3.948 1.00 0.00 H new ATOM 0 HA ALA A 101 20.272 -1.127 -5.290 1.00 0.00 H new ATOM 0 HB1 ALA A 101 18.000 -0.480 -4.533 1.00 0.00 H new ATOM 0 HB2 ALA A 101 17.982 -2.084 -5.303 1.00 0.00 H new ATOM 0 HB3 ALA A 101 17.915 -1.948 -3.530 1.00 0.00 H new ATOM 1545 N GLU A 102 20.779 -1.443 -2.142 1.00 0.00 N ATOM 1546 CA GLU A 102 21.264 -0.732 -0.926 1.00 0.00 C ATOM 1547 C GLU A 102 22.684 -0.212 -1.168 1.00 0.00 C ATOM 1548 O GLU A 102 23.133 0.717 -0.527 1.00 0.00 O ATOM 1549 CB GLU A 102 21.264 -1.706 0.257 1.00 0.00 C ATOM 1550 CG GLU A 102 22.092 -1.125 1.406 1.00 0.00 C ATOM 1551 CD GLU A 102 21.556 0.260 1.774 1.00 0.00 C ATOM 1552 OE1 GLU A 102 20.457 0.579 1.350 1.00 0.00 O ATOM 1553 OE2 GLU A 102 22.252 0.977 2.473 1.00 0.00 O ATOM 0 H GLU A 102 20.821 -2.461 -2.094 1.00 0.00 H new ATOM 0 HA GLU A 102 20.608 0.111 -0.706 1.00 0.00 H new ATOM 0 HB2 GLU A 102 20.242 -1.889 0.589 1.00 0.00 H new ATOM 0 HB3 GLU A 102 21.676 -2.667 -0.051 1.00 0.00 H new ATOM 0 HG2 GLU A 102 22.046 -1.786 2.272 1.00 0.00 H new ATOM 0 HG3 GLU A 102 23.140 -1.055 1.114 1.00 0.00 H new ATOM 1560 N GLU A 103 23.395 -0.807 -2.087 1.00 0.00 N ATOM 1561 CA GLU A 103 24.787 -0.352 -2.366 1.00 0.00 C ATOM 1562 C GLU A 103 24.788 1.150 -2.672 1.00 0.00 C ATOM 1563 O GLU A 103 25.745 1.846 -2.398 1.00 0.00 O ATOM 1564 CB GLU A 103 25.338 -1.119 -3.570 1.00 0.00 C ATOM 1565 CG GLU A 103 26.812 -1.454 -3.334 1.00 0.00 C ATOM 1566 CD GLU A 103 27.611 -0.158 -3.181 1.00 0.00 C ATOM 1567 OE1 GLU A 103 27.265 0.809 -3.840 1.00 0.00 O ATOM 1568 OE2 GLU A 103 28.553 -0.155 -2.407 1.00 0.00 O ATOM 0 H GLU A 103 23.072 -1.589 -2.657 1.00 0.00 H new ATOM 0 HA GLU A 103 25.412 -0.541 -1.494 1.00 0.00 H new ATOM 0 HB2 GLU A 103 24.767 -2.034 -3.723 1.00 0.00 H new ATOM 0 HB3 GLU A 103 25.231 -0.521 -4.475 1.00 0.00 H new ATOM 0 HG2 GLU A 103 26.918 -2.067 -2.439 1.00 0.00 H new ATOM 0 HG3 GLU A 103 27.201 -2.038 -4.168 1.00 0.00 H new ATOM 1575 N HIS A 104 23.724 1.653 -3.234 1.00 0.00 N ATOM 1576 CA HIS A 104 23.668 3.108 -3.555 1.00 0.00 C ATOM 1577 C HIS A 104 23.417 3.907 -2.273 1.00 0.00 C ATOM 1578 O HIS A 104 24.064 4.901 -2.013 1.00 0.00 O ATOM 1579 CB HIS A 104 22.534 3.369 -4.550 1.00 0.00 C ATOM 1580 CG HIS A 104 23.113 3.783 -5.875 1.00 0.00 C ATOM 1581 ND1 HIS A 104 23.569 5.070 -6.112 1.00 0.00 N ATOM 1582 CD2 HIS A 104 23.316 3.092 -7.043 1.00 0.00 C ATOM 1583 CE1 HIS A 104 24.021 5.113 -7.380 1.00 0.00 C ATOM 1584 NE2 HIS A 104 23.890 3.932 -7.992 1.00 0.00 N ATOM 0 H HIS A 104 22.891 1.120 -3.485 1.00 0.00 H new ATOM 0 HA HIS A 104 24.616 3.418 -3.995 1.00 0.00 H new ATOM 0 HB2 HIS A 104 21.928 2.471 -4.671 1.00 0.00 H new ATOM 0 HB3 HIS A 104 21.875 4.149 -4.170 1.00 0.00 H new ATOM 0 HD2 HIS A 104 23.068 2.053 -7.202 1.00 0.00 H new ATOM 0 HE1 HIS A 104 24.438 5.994 -7.845 1.00 0.00 H new ATOM 0 HE2 HIS A 104 24.154 3.697 -8.949 1.00 0.00 H new ATOM 1592 N ILE A 105 22.481 3.479 -1.471 1.00 0.00 N ATOM 1593 CA ILE A 105 22.189 4.214 -0.209 1.00 0.00 C ATOM 1594 C ILE A 105 23.483 4.415 0.582 1.00 0.00 C ATOM 1595 O ILE A 105 23.714 5.462 1.155 1.00 0.00 O ATOM 1596 CB ILE A 105 21.205 3.403 0.634 1.00 0.00 C ATOM 1597 CG1 ILE A 105 19.845 3.358 -0.068 1.00 0.00 C ATOM 1598 CG2 ILE A 105 21.050 4.060 2.005 1.00 0.00 C ATOM 1599 CD1 ILE A 105 18.826 2.659 0.835 1.00 0.00 C ATOM 0 H ILE A 105 21.906 2.652 -1.635 1.00 0.00 H new ATOM 0 HA ILE A 105 21.756 5.185 -0.450 1.00 0.00 H new ATOM 0 HB ILE A 105 21.582 2.388 0.757 1.00 0.00 H new ATOM 0 HG12 ILE A 105 19.509 4.369 -0.298 1.00 0.00 H new ATOM 0 HG13 ILE A 105 19.931 2.827 -1.016 1.00 0.00 H new ATOM 0 HG21 ILE A 105 20.349 3.483 2.608 1.00 0.00 H new ATOM 0 HG22 ILE A 105 22.018 4.091 2.505 1.00 0.00 H new ATOM 0 HG23 ILE A 105 20.673 5.075 1.881 1.00 0.00 H new ATOM 0 HD11 ILE A 105 17.858 2.627 0.335 1.00 0.00 H new ATOM 0 HD12 ILE A 105 19.161 1.643 1.043 1.00 0.00 H new ATOM 0 HD13 ILE A 105 18.733 3.209 1.772 1.00 0.00 H new ATOM 1611 N SER A 106 24.327 3.421 0.622 1.00 0.00 N ATOM 1612 CA SER A 106 25.601 3.555 1.383 1.00 0.00 C ATOM 1613 C SER A 106 26.712 4.037 0.448 1.00 0.00 C ATOM 1614 O SER A 106 27.729 3.390 0.293 1.00 0.00 O ATOM 1615 CB SER A 106 25.987 2.197 1.971 1.00 0.00 C ATOM 1616 OG SER A 106 24.894 1.298 1.833 1.00 0.00 O ATOM 0 H SER A 106 24.189 2.522 0.161 1.00 0.00 H new ATOM 0 HA SER A 106 25.466 4.278 2.187 1.00 0.00 H new ATOM 0 HB2 SER A 106 26.865 1.802 1.459 1.00 0.00 H new ATOM 0 HB3 SER A 106 26.253 2.305 3.022 1.00 0.00 H new ATOM 0 HG SER A 106 24.127 1.635 2.341 1.00 0.00 H new ATOM 1622 N SER A 107 26.532 5.171 -0.174 1.00 0.00 N ATOM 1623 CA SER A 107 27.584 5.689 -1.093 1.00 0.00 C ATOM 1624 C SER A 107 27.121 7.008 -1.714 1.00 0.00 C ATOM 1625 O SER A 107 25.940 7.278 -1.815 1.00 0.00 O ATOM 1626 CB SER A 107 27.838 4.667 -2.202 1.00 0.00 C ATOM 1627 OG SER A 107 26.914 4.881 -3.259 1.00 0.00 O ATOM 0 H SER A 107 25.704 5.759 -0.085 1.00 0.00 H new ATOM 0 HA SER A 107 28.503 5.857 -0.532 1.00 0.00 H new ATOM 0 HB2 SER A 107 28.859 4.761 -2.572 1.00 0.00 H new ATOM 0 HB3 SER A 107 27.732 3.655 -1.811 1.00 0.00 H new ATOM 0 HG SER A 107 26.001 4.876 -2.902 1.00 0.00 H new ATOM 1633 N SER A 108 28.043 7.830 -2.134 1.00 0.00 N ATOM 1634 CA SER A 108 27.660 9.131 -2.753 1.00 0.00 C ATOM 1635 C SER A 108 27.236 10.117 -1.662 1.00 0.00 C ATOM 1636 O SER A 108 27.131 9.769 -0.503 1.00 0.00 O ATOM 1637 CB SER A 108 26.497 8.911 -3.722 1.00 0.00 C ATOM 1638 OG SER A 108 26.747 9.630 -4.922 1.00 0.00 O ATOM 0 H SER A 108 29.046 7.657 -2.075 1.00 0.00 H new ATOM 0 HA SER A 108 28.514 9.538 -3.294 1.00 0.00 H new ATOM 0 HB2 SER A 108 26.383 7.849 -3.937 1.00 0.00 H new ATOM 0 HB3 SER A 108 25.563 9.246 -3.271 1.00 0.00 H new ATOM 0 HG SER A 108 26.005 9.491 -5.547 1.00 0.00 H new ATOM 1644 N HIS A 109 26.993 11.345 -2.028 1.00 0.00 N ATOM 1645 CA HIS A 109 26.576 12.358 -1.016 1.00 0.00 C ATOM 1646 C HIS A 109 25.866 13.515 -1.723 1.00 0.00 C ATOM 1647 O HIS A 109 25.575 13.449 -2.902 1.00 0.00 O ATOM 1648 CB HIS A 109 27.802 12.897 -0.265 1.00 0.00 C ATOM 1649 CG HIS A 109 29.057 12.634 -1.057 1.00 0.00 C ATOM 1650 ND1 HIS A 109 29.419 12.961 -2.342 1.00 0.00 N flip ATOM 1651 CD2 HIS A 109 30.135 11.944 -0.526 1.00 0.00 C flip ATOM 1652 CE1 HIS A 109 30.699 12.484 -2.604 1.00 0.00 C flip ATOM 1653 NE2 HIS A 109 31.084 11.879 -1.477 1.00 0.00 N flip ATOM 0 H HIS A 109 27.065 11.692 -2.985 1.00 0.00 H new ATOM 0 HA HIS A 109 25.901 11.888 -0.300 1.00 0.00 H new ATOM 0 HB2 HIS A 109 27.690 13.967 -0.093 1.00 0.00 H new ATOM 0 HB3 HIS A 109 27.875 12.423 0.714 1.00 0.00 H new ATOM 0 HD2 HIS A 109 30.201 11.533 0.471 1.00 0.00 H new ATOM 0 HE1 HIS A 109 31.261 12.582 -3.521 1.00 0.00 H new ATOM 0 HE2 HIS A 109 31.988 11.423 -1.353 1.00 0.00 H new ATOM 1661 N GLY A 110 25.582 14.572 -1.014 1.00 0.00 N ATOM 1662 CA GLY A 110 24.890 15.731 -1.647 1.00 0.00 C ATOM 1663 C GLY A 110 23.484 15.867 -1.060 1.00 0.00 C ATOM 1664 O GLY A 110 22.962 14.952 -0.456 1.00 0.00 O ATOM 0 H GLY A 110 25.799 14.684 -0.024 1.00 0.00 H new ATOM 0 HA2 GLY A 110 25.458 16.646 -1.475 1.00 0.00 H new ATOM 0 HA3 GLY A 110 24.833 15.589 -2.726 1.00 0.00 H new ATOM 1668 N ASP A 111 22.869 17.004 -1.231 1.00 0.00 N ATOM 1669 CA ASP A 111 21.499 17.200 -0.682 1.00 0.00 C ATOM 1670 C ASP A 111 20.535 16.221 -1.355 1.00 0.00 C ATOM 1671 O ASP A 111 20.599 15.995 -2.547 1.00 0.00 O ATOM 1672 CB ASP A 111 21.040 18.632 -0.957 1.00 0.00 C ATOM 1673 CG ASP A 111 20.365 19.202 0.291 1.00 0.00 C ATOM 1674 OD1 ASP A 111 21.074 19.519 1.231 1.00 0.00 O ATOM 1675 OD2 ASP A 111 19.149 19.310 0.285 1.00 0.00 O ATOM 0 H ASP A 111 23.256 17.806 -1.728 1.00 0.00 H new ATOM 0 HA ASP A 111 21.510 17.020 0.393 1.00 0.00 H new ATOM 0 HB2 ASP A 111 21.893 19.251 -1.236 1.00 0.00 H new ATOM 0 HB3 ASP A 111 20.346 18.647 -1.797 1.00 0.00 H new ATOM 1680 N VAL A 112 19.636 15.647 -0.600 1.00 0.00 N ATOM 1681 CA VAL A 112 18.655 14.686 -1.186 1.00 0.00 C ATOM 1682 C VAL A 112 19.347 13.796 -2.220 1.00 0.00 C ATOM 1683 O VAL A 112 18.757 13.397 -3.204 1.00 0.00 O ATOM 1684 CB VAL A 112 17.528 15.467 -1.862 1.00 0.00 C ATOM 1685 CG1 VAL A 112 16.922 16.454 -0.863 1.00 0.00 C ATOM 1686 CG2 VAL A 112 18.092 16.236 -3.060 1.00 0.00 C ATOM 0 H VAL A 112 19.538 15.803 0.403 1.00 0.00 H new ATOM 0 HA VAL A 112 18.248 14.060 -0.392 1.00 0.00 H new ATOM 0 HB VAL A 112 16.757 14.775 -2.202 1.00 0.00 H new ATOM 0 HG11 VAL A 112 16.118 17.011 -1.344 1.00 0.00 H new ATOM 0 HG12 VAL A 112 16.524 15.908 -0.008 1.00 0.00 H new ATOM 0 HG13 VAL A 112 17.692 17.147 -0.524 1.00 0.00 H new ATOM 0 HG21 VAL A 112 17.291 16.794 -3.544 1.00 0.00 H new ATOM 0 HG22 VAL A 112 18.861 16.929 -2.718 1.00 0.00 H new ATOM 0 HG23 VAL A 112 18.526 15.534 -3.771 1.00 0.00 H new ATOM 1696 N ASP A 113 20.592 13.481 -2.003 1.00 0.00 N ATOM 1697 CA ASP A 113 21.321 12.615 -2.969 1.00 0.00 C ATOM 1698 C ASP A 113 20.965 11.152 -2.698 1.00 0.00 C ATOM 1699 O ASP A 113 19.946 10.662 -3.142 1.00 0.00 O ATOM 1700 CB ASP A 113 22.822 12.826 -2.792 1.00 0.00 C ATOM 1701 CG ASP A 113 23.589 11.740 -3.551 1.00 0.00 C ATOM 1702 OD1 ASP A 113 23.257 11.504 -4.701 1.00 0.00 O ATOM 1703 OD2 ASP A 113 24.492 11.164 -2.969 1.00 0.00 O ATOM 0 H ASP A 113 21.137 13.786 -1.197 1.00 0.00 H new ATOM 0 HA ASP A 113 21.038 12.871 -3.990 1.00 0.00 H new ATOM 0 HB2 ASP A 113 23.107 13.811 -3.161 1.00 0.00 H new ATOM 0 HB3 ASP A 113 23.081 12.795 -1.734 1.00 0.00 H new ATOM 1708 N TYR A 114 21.782 10.451 -1.958 1.00 0.00 N ATOM 1709 CA TYR A 114 21.464 9.032 -1.650 1.00 0.00 C ATOM 1710 C TYR A 114 20.326 9.003 -0.630 1.00 0.00 C ATOM 1711 O TYR A 114 19.680 7.995 -0.427 1.00 0.00 O ATOM 1712 CB TYR A 114 22.698 8.337 -1.069 1.00 0.00 C ATOM 1713 CG TYR A 114 23.052 8.962 0.258 1.00 0.00 C ATOM 1714 CD1 TYR A 114 22.429 8.518 1.429 1.00 0.00 C ATOM 1715 CD2 TYR A 114 24.005 9.986 0.316 1.00 0.00 C ATOM 1716 CE1 TYR A 114 22.758 9.097 2.660 1.00 0.00 C ATOM 1717 CE2 TYR A 114 24.335 10.565 1.547 1.00 0.00 C ATOM 1718 CZ TYR A 114 23.711 10.121 2.719 1.00 0.00 C ATOM 1719 OH TYR A 114 24.038 10.692 3.932 1.00 0.00 O ATOM 0 H TYR A 114 22.652 10.800 -1.556 1.00 0.00 H new ATOM 0 HA TYR A 114 21.166 8.510 -2.559 1.00 0.00 H new ATOM 0 HB2 TYR A 114 22.502 7.273 -0.940 1.00 0.00 H new ATOM 0 HB3 TYR A 114 23.537 8.425 -1.760 1.00 0.00 H new ATOM 0 HD1 TYR A 114 21.694 7.728 1.383 1.00 0.00 H new ATOM 0 HD2 TYR A 114 24.485 10.329 -0.588 1.00 0.00 H new ATOM 0 HE1 TYR A 114 22.277 8.754 3.564 1.00 0.00 H new ATOM 0 HE2 TYR A 114 25.071 11.354 1.593 1.00 0.00 H new ATOM 0 HH TYR A 114 24.716 11.386 3.795 1.00 0.00 H new ATOM 1729 N ALA A 115 20.074 10.117 0.005 1.00 0.00 N ATOM 1730 CA ALA A 115 18.977 10.181 1.007 1.00 0.00 C ATOM 1731 C ALA A 115 17.640 9.987 0.290 1.00 0.00 C ATOM 1732 O ALA A 115 16.721 9.389 0.813 1.00 0.00 O ATOM 1733 CB ALA A 115 19.002 11.552 1.685 1.00 0.00 C ATOM 0 H ALA A 115 20.586 10.989 -0.130 1.00 0.00 H new ATOM 0 HA ALA A 115 19.106 9.401 1.758 1.00 0.00 H new ATOM 0 HB1 ALA A 115 18.201 11.608 2.422 1.00 0.00 H new ATOM 0 HB2 ALA A 115 19.962 11.695 2.181 1.00 0.00 H new ATOM 0 HB3 ALA A 115 18.861 12.331 0.936 1.00 0.00 H new ATOM 1739 N GLN A 116 17.531 10.488 -0.909 1.00 0.00 N ATOM 1740 CA GLN A 116 16.263 10.335 -1.674 1.00 0.00 C ATOM 1741 C GLN A 116 16.088 8.867 -2.071 1.00 0.00 C ATOM 1742 O GLN A 116 15.036 8.455 -2.519 1.00 0.00 O ATOM 1743 CB GLN A 116 16.327 11.200 -2.933 1.00 0.00 C ATOM 1744 CG GLN A 116 15.215 12.249 -2.893 1.00 0.00 C ATOM 1745 CD GLN A 116 15.292 13.122 -4.147 1.00 0.00 C ATOM 1746 OE1 GLN A 116 16.101 14.023 -4.226 1.00 0.00 O ATOM 1747 NE2 GLN A 116 14.478 12.888 -5.140 1.00 0.00 N ATOM 0 H GLN A 116 18.269 10.999 -1.393 1.00 0.00 H new ATOM 0 HA GLN A 116 15.420 10.649 -1.058 1.00 0.00 H new ATOM 0 HB2 GLN A 116 17.299 11.688 -3.002 1.00 0.00 H new ATOM 0 HB3 GLN A 116 16.220 10.576 -3.821 1.00 0.00 H new ATOM 0 HG2 GLN A 116 14.242 11.761 -2.836 1.00 0.00 H new ATOM 0 HG3 GLN A 116 15.315 12.866 -2.000 1.00 0.00 H new ATOM 0 HE21 GLN A 116 13.798 12.131 -5.074 1.00 0.00 H new ATOM 0 HE22 GLN A 116 14.522 13.462 -5.982 1.00 0.00 H new ATOM 1756 N ALA A 117 17.116 8.078 -1.914 1.00 0.00 N ATOM 1757 CA ALA A 117 17.016 6.637 -2.283 1.00 0.00 C ATOM 1758 C ALA A 117 16.237 5.882 -1.203 1.00 0.00 C ATOM 1759 O ALA A 117 15.843 4.748 -1.389 1.00 0.00 O ATOM 1760 CB ALA A 117 18.423 6.048 -2.402 1.00 0.00 C ATOM 0 H ALA A 117 18.022 8.369 -1.546 1.00 0.00 H new ATOM 0 HA ALA A 117 16.496 6.541 -3.236 1.00 0.00 H new ATOM 0 HB1 ALA A 117 18.355 4.994 -2.672 1.00 0.00 H new ATOM 0 HB2 ALA A 117 18.978 6.584 -3.172 1.00 0.00 H new ATOM 0 HB3 ALA A 117 18.940 6.145 -1.447 1.00 0.00 H new ATOM 1766 N SER A 118 16.012 6.501 -0.076 1.00 0.00 N ATOM 1767 CA SER A 118 15.261 5.815 1.013 1.00 0.00 C ATOM 1768 C SER A 118 13.758 5.909 0.740 1.00 0.00 C ATOM 1769 O SER A 118 12.975 5.144 1.267 1.00 0.00 O ATOM 1770 CB SER A 118 15.575 6.486 2.350 1.00 0.00 C ATOM 1771 OG SER A 118 15.889 5.488 3.313 1.00 0.00 O ATOM 0 H SER A 118 16.316 7.451 0.137 1.00 0.00 H new ATOM 0 HA SER A 118 15.558 4.767 1.051 1.00 0.00 H new ATOM 0 HB2 SER A 118 16.412 7.175 2.237 1.00 0.00 H new ATOM 0 HB3 SER A 118 14.721 7.075 2.684 1.00 0.00 H new ATOM 0 HG SER A 118 16.093 5.914 4.172 1.00 0.00 H new ATOM 1777 N ALA A 119 13.348 6.839 -0.078 1.00 0.00 N ATOM 1778 CA ALA A 119 11.894 6.978 -0.377 1.00 0.00 C ATOM 1779 C ALA A 119 11.468 5.897 -1.374 1.00 0.00 C ATOM 1780 O ALA A 119 10.389 5.345 -1.281 1.00 0.00 O ATOM 1781 CB ALA A 119 11.626 8.359 -0.980 1.00 0.00 C ATOM 0 H ALA A 119 13.955 7.508 -0.552 1.00 0.00 H new ATOM 0 HA ALA A 119 11.324 6.866 0.545 1.00 0.00 H new ATOM 0 HB1 ALA A 119 10.563 8.461 -1.199 1.00 0.00 H new ATOM 0 HB2 ALA A 119 11.926 9.130 -0.270 1.00 0.00 H new ATOM 0 HB3 ALA A 119 12.198 8.471 -1.901 1.00 0.00 H new ATOM 1787 N GLU A 120 12.306 5.590 -2.327 1.00 0.00 N ATOM 1788 CA GLU A 120 11.945 4.547 -3.329 1.00 0.00 C ATOM 1789 C GLU A 120 12.295 3.161 -2.779 1.00 0.00 C ATOM 1790 O GLU A 120 11.630 2.184 -3.063 1.00 0.00 O ATOM 1791 CB GLU A 120 12.726 4.795 -4.623 1.00 0.00 C ATOM 1792 CG GLU A 120 14.193 4.414 -4.419 1.00 0.00 C ATOM 1793 CD GLU A 120 15.053 5.105 -5.480 1.00 0.00 C ATOM 1794 OE1 GLU A 120 14.500 5.516 -6.487 1.00 0.00 O ATOM 1795 OE2 GLU A 120 16.250 5.211 -5.267 1.00 0.00 O ATOM 0 H GLU A 120 13.224 6.016 -2.455 1.00 0.00 H new ATOM 0 HA GLU A 120 10.875 4.594 -3.532 1.00 0.00 H new ATOM 0 HB2 GLU A 120 12.297 4.209 -5.436 1.00 0.00 H new ATOM 0 HB3 GLU A 120 12.649 5.844 -4.911 1.00 0.00 H new ATOM 0 HG2 GLU A 120 14.521 4.708 -3.422 1.00 0.00 H new ATOM 0 HG3 GLU A 120 14.312 3.333 -4.487 1.00 0.00 H new ATOM 1802 N LEU A 121 13.334 3.067 -1.995 1.00 0.00 N ATOM 1803 CA LEU A 121 13.727 1.745 -1.430 1.00 0.00 C ATOM 1804 C LEU A 121 12.640 1.250 -0.471 1.00 0.00 C ATOM 1805 O LEU A 121 11.981 0.260 -0.722 1.00 0.00 O ATOM 1806 CB LEU A 121 15.048 1.893 -0.670 1.00 0.00 C ATOM 1807 CG LEU A 121 15.529 0.519 -0.203 1.00 0.00 C ATOM 1808 CD1 LEU A 121 16.766 0.112 -1.006 1.00 0.00 C ATOM 1809 CD2 LEU A 121 15.888 0.586 1.284 1.00 0.00 C ATOM 0 H LEU A 121 13.928 3.849 -1.721 1.00 0.00 H new ATOM 0 HA LEU A 121 13.847 1.025 -2.240 1.00 0.00 H new ATOM 0 HB2 LEU A 121 15.799 2.353 -1.312 1.00 0.00 H new ATOM 0 HB3 LEU A 121 14.914 2.553 0.187 1.00 0.00 H new ATOM 0 HG LEU A 121 14.738 -0.215 -0.356 1.00 0.00 H new ATOM 0 HD11 LEU A 121 17.110 -0.868 -0.674 1.00 0.00 H new ATOM 0 HD12 LEU A 121 16.514 0.068 -2.065 1.00 0.00 H new ATOM 0 HD13 LEU A 121 17.557 0.846 -0.852 1.00 0.00 H new ATOM 0 HD21 LEU A 121 16.231 -0.392 1.620 1.00 0.00 H new ATOM 0 HD22 LEU A 121 16.680 1.320 1.434 1.00 0.00 H new ATOM 0 HD23 LEU A 121 15.009 0.879 1.858 1.00 0.00 H new ATOM 1821 N ALA A 122 12.451 1.929 0.627 1.00 0.00 N ATOM 1822 CA ALA A 122 11.411 1.495 1.602 1.00 0.00 C ATOM 1823 C ALA A 122 10.125 1.124 0.859 1.00 0.00 C ATOM 1824 O ALA A 122 9.326 0.342 1.336 1.00 0.00 O ATOM 1825 CB ALA A 122 11.124 2.636 2.581 1.00 0.00 C ATOM 0 H ALA A 122 12.972 2.765 0.891 1.00 0.00 H new ATOM 0 HA ALA A 122 11.772 0.625 2.150 1.00 0.00 H new ATOM 0 HB1 ALA A 122 10.363 2.320 3.295 1.00 0.00 H new ATOM 0 HB2 ALA A 122 12.038 2.895 3.115 1.00 0.00 H new ATOM 0 HB3 ALA A 122 10.766 3.506 2.031 1.00 0.00 H new ATOM 1831 N LYS A 123 9.915 1.678 -0.304 1.00 0.00 N ATOM 1832 CA LYS A 123 8.677 1.355 -1.071 1.00 0.00 C ATOM 1833 C LYS A 123 8.671 -0.131 -1.441 1.00 0.00 C ATOM 1834 O LYS A 123 7.723 -0.842 -1.175 1.00 0.00 O ATOM 1835 CB LYS A 123 8.633 2.197 -2.348 1.00 0.00 C ATOM 1836 CG LYS A 123 7.200 2.673 -2.595 1.00 0.00 C ATOM 1837 CD LYS A 123 7.095 3.278 -3.997 1.00 0.00 C ATOM 1838 CE LYS A 123 7.429 4.769 -3.936 1.00 0.00 C ATOM 1839 NZ LYS A 123 7.504 5.319 -5.319 1.00 0.00 N ATOM 0 H LYS A 123 10.546 2.340 -0.756 1.00 0.00 H new ATOM 0 HA LYS A 123 7.805 1.578 -0.456 1.00 0.00 H new ATOM 0 HB2 LYS A 123 9.301 3.053 -2.255 1.00 0.00 H new ATOM 0 HB3 LYS A 123 8.984 1.609 -3.196 1.00 0.00 H new ATOM 0 HG2 LYS A 123 6.506 1.838 -2.495 1.00 0.00 H new ATOM 0 HG3 LYS A 123 6.918 3.413 -1.846 1.00 0.00 H new ATOM 0 HD2 LYS A 123 7.779 2.769 -4.676 1.00 0.00 H new ATOM 0 HD3 LYS A 123 6.089 3.136 -4.392 1.00 0.00 H new ATOM 0 HE2 LYS A 123 6.669 5.300 -3.363 1.00 0.00 H new ATOM 0 HE3 LYS A 123 8.378 4.919 -3.422 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 7.731 6.333 -5.277 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 8.245 4.820 -5.851 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 6.588 5.189 -5.795 1.00 0.00 H new ATOM 1853 N ALA A 124 9.719 -0.603 -2.059 1.00 0.00 N ATOM 1854 CA ALA A 124 9.769 -2.040 -2.452 1.00 0.00 C ATOM 1855 C ALA A 124 9.861 -2.914 -1.200 1.00 0.00 C ATOM 1856 O ALA A 124 9.431 -4.051 -1.194 1.00 0.00 O ATOM 1857 CB ALA A 124 10.996 -2.285 -3.332 1.00 0.00 C ATOM 0 H ALA A 124 10.543 -0.056 -2.309 1.00 0.00 H new ATOM 0 HA ALA A 124 8.865 -2.294 -3.005 1.00 0.00 H new ATOM 0 HB1 ALA A 124 11.033 -3.336 -3.620 1.00 0.00 H new ATOM 0 HB2 ALA A 124 10.932 -1.666 -4.227 1.00 0.00 H new ATOM 0 HB3 ALA A 124 11.899 -2.028 -2.777 1.00 0.00 H new ATOM 1863 N ILE A 125 10.421 -2.399 -0.143 1.00 0.00 N ATOM 1864 CA ILE A 125 10.543 -3.208 1.102 1.00 0.00 C ATOM 1865 C ILE A 125 9.181 -3.302 1.793 1.00 0.00 C ATOM 1866 O ILE A 125 9.022 -4.003 2.773 1.00 0.00 O ATOM 1867 CB ILE A 125 11.551 -2.545 2.042 1.00 0.00 C ATOM 1868 CG1 ILE A 125 12.784 -2.114 1.243 1.00 0.00 C ATOM 1869 CG2 ILE A 125 11.970 -3.541 3.125 1.00 0.00 C ATOM 1870 CD1 ILE A 125 13.305 -3.300 0.429 1.00 0.00 C ATOM 0 H ILE A 125 10.800 -1.454 -0.086 1.00 0.00 H new ATOM 0 HA ILE A 125 10.886 -4.211 0.849 1.00 0.00 H new ATOM 0 HB ILE A 125 11.094 -1.672 2.508 1.00 0.00 H new ATOM 0 HG12 ILE A 125 12.530 -1.288 0.579 1.00 0.00 H new ATOM 0 HG13 ILE A 125 13.560 -1.754 1.918 1.00 0.00 H new ATOM 0 HG21 ILE A 125 12.688 -3.069 3.795 1.00 0.00 H new ATOM 0 HG22 ILE A 125 11.093 -3.851 3.693 1.00 0.00 H new ATOM 0 HG23 ILE A 125 12.428 -4.414 2.659 1.00 0.00 H new ATOM 0 HD11 ILE A 125 14.183 -2.993 -0.140 1.00 0.00 H new ATOM 0 HD12 ILE A 125 13.575 -4.113 1.103 1.00 0.00 H new ATOM 0 HD13 ILE A 125 12.529 -3.640 -0.257 1.00 0.00 H new ATOM 1882 N ALA A 126 8.193 -2.610 1.292 1.00 0.00 N ATOM 1883 CA ALA A 126 6.846 -2.674 1.926 1.00 0.00 C ATOM 1884 C ALA A 126 6.135 -3.952 1.475 1.00 0.00 C ATOM 1885 O ALA A 126 5.029 -4.238 1.890 1.00 0.00 O ATOM 1886 CB ALA A 126 6.024 -1.455 1.504 1.00 0.00 C ATOM 0 H ALA A 126 8.261 -2.005 0.474 1.00 0.00 H new ATOM 0 HA ALA A 126 6.953 -2.679 3.011 1.00 0.00 H new ATOM 0 HB1 ALA A 126 5.039 -1.502 1.968 1.00 0.00 H new ATOM 0 HB2 ALA A 126 6.532 -0.545 1.823 1.00 0.00 H new ATOM 0 HB3 ALA A 126 5.914 -1.448 0.420 1.00 0.00 H new ATOM 1892 N GLN A 127 6.762 -4.726 0.629 1.00 0.00 N ATOM 1893 CA GLN A 127 6.124 -5.984 0.153 1.00 0.00 C ATOM 1894 C GLN A 127 6.500 -7.133 1.095 1.00 0.00 C ATOM 1895 O GLN A 127 5.759 -8.083 1.257 1.00 0.00 O ATOM 1896 CB GLN A 127 6.618 -6.297 -1.262 1.00 0.00 C ATOM 1897 CG GLN A 127 6.245 -7.734 -1.630 1.00 0.00 C ATOM 1898 CD GLN A 127 6.152 -7.863 -3.151 1.00 0.00 C ATOM 1899 OE1 GLN A 127 5.255 -7.320 -3.765 1.00 0.00 O ATOM 1900 NE2 GLN A 127 7.049 -8.562 -3.789 1.00 0.00 N ATOM 0 H GLN A 127 7.689 -4.539 0.248 1.00 0.00 H new ATOM 0 HA GLN A 127 5.041 -5.865 0.142 1.00 0.00 H new ATOM 0 HB2 GLN A 127 6.175 -5.602 -1.975 1.00 0.00 H new ATOM 0 HB3 GLN A 127 7.699 -6.165 -1.318 1.00 0.00 H new ATOM 0 HG2 GLN A 127 6.992 -8.426 -1.241 1.00 0.00 H new ATOM 0 HG3 GLN A 127 5.293 -8.002 -1.173 1.00 0.00 H new ATOM 0 HE21 GLN A 127 7.802 -9.018 -3.273 1.00 0.00 H new ATOM 0 HE22 GLN A 127 6.998 -8.653 -4.804 1.00 0.00 H new ATOM 1909 N LEU A 128 7.645 -7.053 1.718 1.00 0.00 N ATOM 1910 CA LEU A 128 8.067 -8.139 2.648 1.00 0.00 C ATOM 1911 C LEU A 128 7.177 -8.119 3.893 1.00 0.00 C ATOM 1912 O LEU A 128 7.137 -9.064 4.656 1.00 0.00 O ATOM 1913 CB LEU A 128 9.523 -7.921 3.061 1.00 0.00 C ATOM 1914 CG LEU A 128 9.982 -9.082 3.945 1.00 0.00 C ATOM 1915 CD1 LEU A 128 11.182 -9.775 3.297 1.00 0.00 C ATOM 1916 CD2 LEU A 128 10.389 -8.545 5.319 1.00 0.00 C ATOM 0 H LEU A 128 8.306 -6.282 1.623 1.00 0.00 H new ATOM 0 HA LEU A 128 7.972 -9.102 2.147 1.00 0.00 H new ATOM 0 HB2 LEU A 128 10.156 -7.851 2.177 1.00 0.00 H new ATOM 0 HB3 LEU A 128 9.622 -6.979 3.600 1.00 0.00 H new ATOM 0 HG LEU A 128 9.166 -9.796 4.058 1.00 0.00 H new ATOM 0 HD11 LEU A 128 11.509 -10.602 3.927 1.00 0.00 H new ATOM 0 HD12 LEU A 128 10.896 -10.157 2.317 1.00 0.00 H new ATOM 0 HD13 LEU A 128 11.998 -9.061 3.184 1.00 0.00 H new ATOM 0 HD21 LEU A 128 10.716 -9.371 5.950 1.00 0.00 H new ATOM 0 HD22 LEU A 128 11.205 -7.831 5.204 1.00 0.00 H new ATOM 0 HD23 LEU A 128 9.536 -8.050 5.783 1.00 0.00 H new ATOM 1928 N ARG A 129 6.467 -7.046 4.106 1.00 0.00 N ATOM 1929 CA ARG A 129 5.584 -6.963 5.303 1.00 0.00 C ATOM 1930 C ARG A 129 4.276 -7.711 5.025 1.00 0.00 C ATOM 1931 O ARG A 129 3.629 -8.205 5.927 1.00 0.00 O ATOM 1932 CB ARG A 129 5.278 -5.495 5.609 1.00 0.00 C ATOM 1933 CG ARG A 129 6.460 -4.871 6.356 1.00 0.00 C ATOM 1934 CD ARG A 129 6.519 -5.430 7.779 1.00 0.00 C ATOM 1935 NE ARG A 129 7.651 -4.799 8.514 1.00 0.00 N ATOM 1936 CZ ARG A 129 7.550 -3.567 8.931 1.00 0.00 C ATOM 1937 NH1 ARG A 129 7.819 -2.580 8.120 1.00 0.00 N ATOM 1938 NH2 ARG A 129 7.180 -3.320 10.159 1.00 0.00 N ATOM 0 H ARG A 129 6.460 -6.223 3.503 1.00 0.00 H new ATOM 0 HA ARG A 129 6.086 -7.415 6.158 1.00 0.00 H new ATOM 0 HB2 ARG A 129 5.091 -4.951 4.683 1.00 0.00 H new ATOM 0 HB3 ARG A 129 4.373 -5.419 6.211 1.00 0.00 H new ATOM 0 HG2 ARG A 129 7.390 -5.087 5.831 1.00 0.00 H new ATOM 0 HG3 ARG A 129 6.354 -3.787 6.384 1.00 0.00 H new ATOM 0 HD2 ARG A 129 5.580 -5.234 8.297 1.00 0.00 H new ATOM 0 HD3 ARG A 129 6.648 -6.512 7.751 1.00 0.00 H new ATOM 0 HE ARG A 129 8.504 -5.330 8.691 1.00 0.00 H new ATOM 0 HH11 ARG A 129 8.108 -2.772 7.161 1.00 0.00 H new ATOM 0 HH12 ARG A 129 7.740 -1.617 8.445 1.00 0.00 H new ATOM 0 HH21 ARG A 129 6.970 -4.091 10.793 1.00 0.00 H new ATOM 0 HH22 ARG A 129 7.101 -2.356 10.484 1.00 0.00 H new ATOM 1952 N VAL A 130 3.882 -7.798 3.784 1.00 0.00 N ATOM 1953 CA VAL A 130 2.617 -8.512 3.451 1.00 0.00 C ATOM 1954 C VAL A 130 2.915 -9.992 3.200 1.00 0.00 C ATOM 1955 O VAL A 130 2.081 -10.848 3.414 1.00 0.00 O ATOM 1956 CB VAL A 130 1.999 -7.900 2.193 1.00 0.00 C ATOM 1957 CG1 VAL A 130 1.582 -6.457 2.473 1.00 0.00 C ATOM 1958 CG2 VAL A 130 3.021 -7.923 1.056 1.00 0.00 C ATOM 0 H VAL A 130 4.382 -7.405 2.986 1.00 0.00 H new ATOM 0 HA VAL A 130 1.920 -8.416 4.283 1.00 0.00 H new ATOM 0 HB VAL A 130 1.122 -8.480 1.906 1.00 0.00 H new ATOM 0 HG11 VAL A 130 1.142 -6.024 1.574 1.00 0.00 H new ATOM 0 HG12 VAL A 130 0.849 -6.440 3.280 1.00 0.00 H new ATOM 0 HG13 VAL A 130 2.457 -5.876 2.765 1.00 0.00 H new ATOM 0 HG21 VAL A 130 2.579 -7.487 0.160 1.00 0.00 H new ATOM 0 HG22 VAL A 130 3.900 -7.346 1.345 1.00 0.00 H new ATOM 0 HG23 VAL A 130 3.314 -8.953 0.851 1.00 0.00 H new ATOM 1968 N ILE A 131 4.098 -10.295 2.746 1.00 0.00 N ATOM 1969 CA ILE A 131 4.453 -11.717 2.479 1.00 0.00 C ATOM 1970 C ILE A 131 4.497 -12.490 3.799 1.00 0.00 C ATOM 1971 O ILE A 131 4.401 -13.700 3.827 1.00 0.00 O ATOM 1972 CB ILE A 131 5.825 -11.783 1.803 1.00 0.00 C ATOM 1973 CG1 ILE A 131 6.910 -11.396 2.810 1.00 0.00 C ATOM 1974 CG2 ILE A 131 5.863 -10.811 0.622 1.00 0.00 C ATOM 1975 CD1 ILE A 131 8.287 -11.717 2.224 1.00 0.00 C ATOM 0 H ILE A 131 4.836 -9.619 2.548 1.00 0.00 H new ATOM 0 HA ILE A 131 3.703 -12.161 1.824 1.00 0.00 H new ATOM 0 HB ILE A 131 6.002 -12.798 1.446 1.00 0.00 H new ATOM 0 HG12 ILE A 131 6.841 -10.334 3.045 1.00 0.00 H new ATOM 0 HG13 ILE A 131 6.765 -11.939 3.744 1.00 0.00 H new ATOM 0 HG21 ILE A 131 6.841 -10.859 0.142 1.00 0.00 H new ATOM 0 HG22 ILE A 131 5.091 -11.083 -0.098 1.00 0.00 H new ATOM 0 HG23 ILE A 131 5.684 -9.797 0.979 1.00 0.00 H new ATOM 0 HD11 ILE A 131 9.061 -11.442 2.941 1.00 0.00 H new ATOM 0 HD12 ILE A 131 8.352 -12.784 2.012 1.00 0.00 H new ATOM 0 HD13 ILE A 131 8.430 -11.154 1.302 1.00 0.00 H new ATOM 1987 N GLU A 132 4.643 -11.798 4.897 1.00 0.00 N ATOM 1988 CA GLU A 132 4.695 -12.493 6.214 1.00 0.00 C ATOM 1989 C GLU A 132 3.279 -12.877 6.647 1.00 0.00 C ATOM 1990 O GLU A 132 3.082 -13.815 7.394 1.00 0.00 O ATOM 1991 CB GLU A 132 5.317 -11.564 7.260 1.00 0.00 C ATOM 1992 CG GLU A 132 6.355 -10.661 6.591 1.00 0.00 C ATOM 1993 CD GLU A 132 7.600 -10.568 7.476 1.00 0.00 C ATOM 1994 OE1 GLU A 132 8.328 -11.546 7.544 1.00 0.00 O ATOM 1995 OE2 GLU A 132 7.805 -9.523 8.070 1.00 0.00 O ATOM 0 H GLU A 132 4.728 -10.782 4.938 1.00 0.00 H new ATOM 0 HA GLU A 132 5.302 -13.394 6.124 1.00 0.00 H new ATOM 0 HB2 GLU A 132 4.542 -10.958 7.730 1.00 0.00 H new ATOM 0 HB3 GLU A 132 5.786 -12.151 8.050 1.00 0.00 H new ATOM 0 HG2 GLU A 132 6.621 -11.059 5.612 1.00 0.00 H new ATOM 0 HG3 GLU A 132 5.937 -9.668 6.428 1.00 0.00 H new ATOM 2002 N LEU A 133 2.290 -12.161 6.186 1.00 0.00 N ATOM 2003 CA LEU A 133 0.889 -12.490 6.573 1.00 0.00 C ATOM 2004 C LEU A 133 0.322 -13.533 5.606 1.00 0.00 C ATOM 2005 O LEU A 133 -0.260 -14.518 6.014 1.00 0.00 O ATOM 2006 CB LEU A 133 0.033 -11.222 6.516 1.00 0.00 C ATOM 2007 CG LEU A 133 -0.369 -10.812 7.934 1.00 0.00 C ATOM 2008 CD1 LEU A 133 0.645 -9.805 8.481 1.00 0.00 C ATOM 2009 CD2 LEU A 133 -1.759 -10.171 7.906 1.00 0.00 C ATOM 0 H LEU A 133 2.392 -11.363 5.559 1.00 0.00 H new ATOM 0 HA LEU A 133 0.877 -12.891 7.586 1.00 0.00 H new ATOM 0 HB2 LEU A 133 0.590 -10.416 6.037 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -0.857 -11.398 5.911 1.00 0.00 H new ATOM 0 HG LEU A 133 -0.388 -11.694 8.575 1.00 0.00 H new ATOM 0 HD11 LEU A 133 0.359 -9.513 9.491 1.00 0.00 H new ATOM 0 HD12 LEU A 133 1.635 -10.260 8.502 1.00 0.00 H new ATOM 0 HD13 LEU A 133 0.664 -8.924 7.840 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -2.045 -9.879 8.916 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -1.740 -9.290 7.265 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -2.482 -10.888 7.517 1.00 0.00 H new ATOM 2021 N THR A 134 0.486 -13.324 4.328 1.00 0.00 N ATOM 2022 CA THR A 134 -0.043 -14.304 3.337 1.00 0.00 C ATOM 2023 C THR A 134 0.276 -15.727 3.803 1.00 0.00 C ATOM 2024 O THR A 134 -0.428 -16.667 3.489 1.00 0.00 O ATOM 2025 CB THR A 134 0.610 -14.054 1.974 1.00 0.00 C ATOM 2026 OG1 THR A 134 2.023 -14.001 2.129 1.00 0.00 O ATOM 2027 CG2 THR A 134 0.109 -12.727 1.399 1.00 0.00 C ATOM 0 H THR A 134 0.964 -12.517 3.927 1.00 0.00 H new ATOM 0 HA THR A 134 -1.123 -14.185 3.250 1.00 0.00 H new ATOM 0 HB THR A 134 0.348 -14.864 1.293 1.00 0.00 H new ATOM 0 HG1 THR A 134 2.442 -13.843 1.257 1.00 0.00 H new ATOM 0 HG21 THR A 134 0.575 -12.552 0.429 1.00 0.00 H new ATOM 0 HG22 THR A 134 -0.974 -12.768 1.279 1.00 0.00 H new ATOM 0 HG23 THR A 134 0.368 -11.915 2.078 1.00 0.00 H new ATOM 2035 N LYS A 135 1.334 -15.893 4.549 1.00 0.00 N ATOM 2036 CA LYS A 135 1.703 -17.254 5.034 1.00 0.00 C ATOM 2037 C LYS A 135 0.474 -17.944 5.633 1.00 0.00 C ATOM 2038 O LYS A 135 -0.015 -18.924 5.108 1.00 0.00 O ATOM 2039 CB LYS A 135 2.793 -17.133 6.100 1.00 0.00 C ATOM 2040 CG LYS A 135 4.105 -16.699 5.445 1.00 0.00 C ATOM 2041 CD LYS A 135 5.176 -17.762 5.697 1.00 0.00 C ATOM 2042 CE LYS A 135 6.346 -17.551 4.733 1.00 0.00 C ATOM 2043 NZ LYS A 135 6.277 -18.564 3.642 1.00 0.00 N ATOM 0 H LYS A 135 1.960 -15.144 4.844 1.00 0.00 H new ATOM 0 HA LYS A 135 2.073 -17.847 4.198 1.00 0.00 H new ATOM 0 HB2 LYS A 135 2.496 -16.408 6.858 1.00 0.00 H new ATOM 0 HB3 LYS A 135 2.927 -18.088 6.608 1.00 0.00 H new ATOM 0 HG2 LYS A 135 3.960 -16.560 4.374 1.00 0.00 H new ATOM 0 HG3 LYS A 135 4.427 -15.740 5.851 1.00 0.00 H new ATOM 0 HD2 LYS A 135 5.526 -17.703 6.728 1.00 0.00 H new ATOM 0 HD3 LYS A 135 4.754 -18.758 5.560 1.00 0.00 H new ATOM 0 HE2 LYS A 135 6.309 -16.546 4.314 1.00 0.00 H new ATOM 0 HE3 LYS A 135 7.292 -17.639 5.267 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 7.071 -18.422 2.986 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 6.332 -19.519 4.051 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 5.380 -18.459 3.127 1.00 0.00 H new ATOM 2057 N LYS A 136 -0.023 -17.447 6.733 1.00 0.00 N ATOM 2058 CA LYS A 136 -1.215 -18.082 7.367 1.00 0.00 C ATOM 2059 C LYS A 136 -2.461 -17.238 7.088 1.00 0.00 C ATOM 2060 O LYS A 136 -3.411 -17.250 7.845 1.00 0.00 O ATOM 2061 CB LYS A 136 -0.997 -18.181 8.878 1.00 0.00 C ATOM 2062 CG LYS A 136 -1.281 -19.611 9.345 1.00 0.00 C ATOM 2063 CD LYS A 136 -1.646 -19.601 10.831 1.00 0.00 C ATOM 2064 CE LYS A 136 -3.141 -19.880 10.993 1.00 0.00 C ATOM 2065 NZ LYS A 136 -3.582 -19.468 12.356 1.00 0.00 N ATOM 0 H LYS A 136 0.344 -16.629 7.220 1.00 0.00 H new ATOM 0 HA LYS A 136 -1.354 -19.080 6.951 1.00 0.00 H new ATOM 0 HB2 LYS A 136 0.027 -17.903 9.127 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -1.652 -17.481 9.397 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -2.096 -20.040 8.762 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -0.406 -20.239 9.179 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -1.065 -20.354 11.364 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -1.396 -18.636 11.271 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -3.707 -19.336 10.237 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -3.342 -20.940 10.840 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -4.599 -19.658 12.464 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -3.051 -20.006 13.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -3.404 -18.452 12.486 1.00 0.00 H new ATOM 2079 N ALA A 137 -2.467 -16.507 6.008 1.00 0.00 N ATOM 2080 CA ALA A 137 -3.653 -15.666 5.685 1.00 0.00 C ATOM 2081 C ALA A 137 -4.507 -16.374 4.631 1.00 0.00 C ATOM 2082 O ALA A 137 -5.721 -16.311 4.655 1.00 0.00 O ATOM 2083 CB ALA A 137 -3.188 -14.316 5.140 1.00 0.00 C ATOM 0 H ALA A 137 -1.702 -16.456 5.335 1.00 0.00 H new ATOM 0 HA ALA A 137 -4.244 -15.509 6.587 1.00 0.00 H new ATOM 0 HB1 ALA A 137 -4.056 -13.701 4.904 1.00 0.00 H new ATOM 0 HB2 ALA A 137 -2.579 -13.811 5.890 1.00 0.00 H new ATOM 0 HB3 ALA A 137 -2.597 -14.472 4.237 1.00 0.00 H new ATOM 2089 N MET A 138 -3.881 -17.047 3.706 1.00 0.00 N ATOM 2090 CA MET A 138 -4.654 -17.759 2.650 1.00 0.00 C ATOM 2091 C MET A 138 -5.402 -18.939 3.271 1.00 0.00 C ATOM 2092 O MET A 138 -5.417 -19.995 2.659 1.00 0.00 O ATOM 2093 CB MET A 138 -3.693 -18.269 1.576 1.00 0.00 C ATOM 2094 CG MET A 138 -3.243 -17.099 0.700 1.00 0.00 C ATOM 2095 SD MET A 138 -4.145 -17.139 -0.868 1.00 0.00 S ATOM 2096 CE MET A 138 -3.123 -18.389 -1.682 1.00 0.00 C ATOM 2097 OXT MET A 138 -5.946 -18.768 4.349 1.00 0.00 O ATOM 0 H MET A 138 -2.867 -17.135 3.636 1.00 0.00 H new ATOM 0 HA MET A 138 -5.373 -17.074 2.200 1.00 0.00 H new ATOM 0 HB2 MET A 138 -2.829 -18.743 2.041 1.00 0.00 H new ATOM 0 HB3 MET A 138 -4.182 -19.028 0.965 1.00 0.00 H new ATOM 0 HG2 MET A 138 -3.426 -16.155 1.213 1.00 0.00 H new ATOM 0 HG3 MET A 138 -2.170 -17.159 0.517 1.00 0.00 H new ATOM 0 HE1 MET A 138 -3.495 -18.562 -2.692 1.00 0.00 H new ATOM 0 HE2 MET A 138 -2.091 -18.040 -1.730 1.00 0.00 H new ATOM 0 HE3 MET A 138 -3.166 -19.319 -1.115 1.00 0.00 H new TER 2107 MET A 138