USER MOD reduce.3.24.130724 H: found=0, std=0, add=1267, rem=0, adj=52 USER MOD reduce.3.24.130724 removed 1268 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 66 MET CE :methyl -109:sc= -4.16 (180deg=-9.63!) USER MOD Set 1.2: B 67 THR OG1 : rot 180:sc= -0.0568 USER MOD Set 2.1: B 62 THR OG1 : rot -65:sc= -0.188 USER MOD Set 2.2: B 76 GLN : amide:sc= -2.37 X(o=-2.6,f=-2.5) USER MOD Set 3.1: B 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.2: B 61 TYR OH : rot 15:sc= -0.65 USER MOD Set 4.1: B 21 GLN : amide:sc= -0.936 K(o=-1.2,f=-0.039) USER MOD Set 4.2: B 22 GLN : amide:sc= -0.226 K(o=-1.2,f=-0.039) USER MOD Set 5.1: A 62 THR OG1 : rot -68:sc= 0.737 USER MOD Set 5.2: A 76 GLN : amide:sc= -2.06 K(o=-1.3,f=-7.5!) USER MOD Set 6.1: A 66 MET CE :methyl -112:sc= -3.83 (180deg=-8.95!) USER MOD Set 6.2: A 67 THR OG1 : rot 180:sc=-0.00667 USER MOD Set 7.1: A 60 LYS NZ :NH3+ 162:sc= 0.546 (180deg=0) USER MOD Set 7.2: A 61 TYR OH : rot 15:sc= -0.0101 USER MOD Set 8.1: A 51 ASN : amide:sc= -0.752 K(o=-3,f=-9.5!) USER MOD Set 8.2: A 54 GLN : amide:sc= -2.28 K(o=-3,f=-2.1) USER MOD Set 9.1: A 19 SER OG : rot 180:sc= 0.0519 USER MOD Set 9.2: A 22 GLN : amide:sc= -0.0289 X(o=0.023,f=0.052) USER MOD Single : A 4 THR OG1 : rot 22:sc= 0.153 USER MOD Single : A 6 SER OG : rot 92:sc= 0.563 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 MET CE :methyl -150:sc= -0.819 (180deg=-3.26!) USER MOD Single : A 14 LYS NZ :NH3+ 155:sc= -0.402 (180deg=-0.621) USER MOD Single : A 15 SER OG : rot -35:sc= -0.285 USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 GLN : amide:sc= -0.0665 X(o=-0.067,f=0) USER MOD Single : A 27 THR OG1 : rot 5:sc= 0.813! USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 42 SER OG : rot -23:sc= 0.736 USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 THR OG1 : rot 55:sc= 0.132 USER MOD Single : A 49 MET CE :methyl 151:sc= -2.2 (180deg=-5.06!) USER MOD Single : A 50 MET CE :methyl -164:sc= -0.28 (180deg=-0.9) USER MOD Single : A 55 THR OG1 : rot -91:sc= 0.487 USER MOD Single : A 57 GLN : amide:sc= -4.5! C(o=-4.5!,f=-7.1!) USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 ASN : amide:sc= 0 X(o=0,f=-0.073) USER MOD Single : A 69 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 74 SER OG : rot -170:sc= 0 USER MOD Single : A 83 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 4 THR OG1 : rot 180:sc= 0.204 USER MOD Single : B 6 SER OG : rot 101:sc= 1.09 USER MOD Single : B 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 12 MET CE :methyl -152:sc= -0.333 (180deg=-1.92) USER MOD Single : B 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 15 SER OG : rot -40:sc= -0.344 USER MOD Single : B 17 TYR OH : rot 180:sc= 0 USER MOD Single : B 19 SER OG : rot 180:sc= 0 USER MOD Single : B 27 THR OG1 : rot -62:sc= 0.152 USER MOD Single : B 31 TYR OH : rot 180:sc= 0 USER MOD Single : B 33 THR OG1 : rot 180:sc= 0 USER MOD Single : B 35 SER OG : rot 180:sc= 0 USER MOD Single : B 36 TYR OH : rot 180:sc= 0 USER MOD Single : B 37 TYR OH : rot 180:sc= 0 USER MOD Single : B 39 SER OG : rot 107:sc= 1.15 USER MOD Single : B 42 SER OG : rot 180:sc= 0 USER MOD Single : B 43 THR OG1 : rot 180:sc= 0.132 USER MOD Single : B 46 THR OG1 : rot -140:sc= -0.0588 USER MOD Single : B 49 MET CE :methyl 157:sc= -2.11 (180deg=-4.05!) USER MOD Single : B 50 MET CE :methyl -162:sc= -0.353 (180deg=-1.38) USER MOD Single : B 51 ASN : amide:sc= -0.511 X(o=-0.51,f=-0.031) USER MOD Single : B 54 GLN : amide:sc= -1.69 K(o=-1.7,f=-1.1) USER MOD Single : B 55 THR OG1 : rot -77:sc= 0.436 USER MOD Single : B 57 GLN : amide:sc= -2.02 K(o=-2,f=-5.3!) USER MOD Single : B 59 THR OG1 : rot 180:sc= 0 USER MOD Single : B 68 ASN : amide:sc=-0.00323 X(o=-0.0032,f=-0.15) USER MOD Single : B 69 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 74 SER OG : rot -130:sc= -1.16 USER MOD ----------------------------------------------------------------- ATOM 43 N THR A 4 4.018 5.798 -6.944 1.00 55.11 N ATOM 44 CA THR A 4 5.297 6.493 -7.016 1.00 61.02 C ATOM 45 C THR A 4 5.099 8.003 -7.090 1.00 34.12 C ATOM 46 O THR A 4 3.976 8.498 -6.979 1.00 24.32 O ATOM 47 CB THR A 4 6.118 6.034 -8.236 1.00 65.03 C ATOM 48 OG1 THR A 4 7.500 6.358 -8.047 1.00 41.45 O ATOM 49 CG2 THR A 4 5.607 6.689 -9.510 1.00 24.23 C ATOM 0 HA THR A 4 5.843 6.245 -6.106 1.00 61.02 H new ATOM 0 HB THR A 4 6.009 4.954 -8.334 1.00 65.03 H new ATOM 0 HG1 THR A 4 7.682 6.469 -7.090 1.00 41.45 H new ATOM 0 HG21 THR A 4 6.202 6.350 -10.358 1.00 24.23 H new ATOM 0 HG22 THR A 4 4.564 6.415 -9.667 1.00 24.23 H new ATOM 0 HG23 THR A 4 5.688 7.772 -9.420 1.00 24.23 H new ATOM 57 N ILE A 5 6.194 8.730 -7.281 1.00 21.33 N ATOM 58 CA ILE A 5 6.139 10.184 -7.373 1.00 1.35 C ATOM 59 C ILE A 5 5.079 10.632 -8.372 1.00 62.20 C ATOM 60 O ILE A 5 4.158 11.373 -8.026 1.00 53.40 O ATOM 61 CB ILE A 5 7.501 10.774 -7.786 1.00 73.54 C ATOM 62 CG1 ILE A 5 8.607 10.258 -6.862 1.00 25.20 C ATOM 63 CG2 ILE A 5 7.449 12.294 -7.762 1.00 34.15 C ATOM 64 CD1 ILE A 5 9.968 10.846 -7.163 1.00 64.05 C ATOM 0 H ILE A 5 7.130 8.336 -7.375 1.00 21.33 H new ATOM 0 HA ILE A 5 5.878 10.553 -6.381 1.00 1.35 H new ATOM 0 HB ILE A 5 7.725 10.454 -8.803 1.00 73.54 H new ATOM 0 HG12 ILE A 5 8.342 10.485 -5.829 1.00 25.20 H new ATOM 0 HG13 ILE A 5 8.662 9.173 -6.946 1.00 25.20 H new ATOM 0 HG21 ILE A 5 8.419 12.696 -8.056 1.00 34.15 H new ATOM 0 HG22 ILE A 5 6.686 12.643 -8.457 1.00 34.15 H new ATOM 0 HG23 ILE A 5 7.206 12.634 -6.755 1.00 34.15 H new ATOM 0 HD11 ILE A 5 10.703 10.436 -6.470 1.00 64.05 H new ATOM 0 HD12 ILE A 5 10.254 10.597 -8.185 1.00 64.05 H new ATOM 0 HD13 ILE A 5 9.929 11.930 -7.051 1.00 64.05 H new ATOM 76 N SER A 6 5.213 10.177 -9.613 1.00 63.44 N ATOM 77 CA SER A 6 4.267 10.533 -10.665 1.00 34.41 C ATOM 78 C SER A 6 2.834 10.272 -10.216 1.00 2.22 C ATOM 79 O SER A 6 1.926 11.042 -10.525 1.00 53.23 O ATOM 80 CB SER A 6 4.568 9.741 -11.938 1.00 71.40 C ATOM 81 OG SER A 6 3.610 8.715 -12.139 1.00 42.32 O ATOM 0 H SER A 6 5.968 9.561 -9.915 1.00 63.44 H new ATOM 0 HA SER A 6 4.375 11.597 -10.874 1.00 34.41 H new ATOM 0 HB2 SER A 6 4.571 10.413 -12.796 1.00 71.40 H new ATOM 0 HB3 SER A 6 5.565 9.304 -11.871 1.00 71.40 H new ATOM 0 HG SER A 6 2.880 9.054 -12.697 1.00 42.32 H new ATOM 87 N GLU A 7 2.638 9.179 -9.484 1.00 61.11 N ATOM 88 CA GLU A 7 1.314 8.815 -8.994 1.00 23.42 C ATOM 89 C GLU A 7 0.792 9.858 -8.010 1.00 40.04 C ATOM 90 O GLU A 7 -0.407 10.129 -7.951 1.00 33.31 O ATOM 91 CB GLU A 7 1.355 7.440 -8.323 1.00 72.32 C ATOM 92 CG GLU A 7 0.889 6.309 -9.223 1.00 53.22 C ATOM 93 CD GLU A 7 -0.583 5.989 -9.045 1.00 62.25 C ATOM 94 OE1 GLU A 7 -1.396 6.936 -9.018 1.00 50.32 O ATOM 95 OE2 GLU A 7 -0.921 4.792 -8.932 1.00 43.33 O ATOM 0 H GLU A 7 3.379 8.531 -9.218 1.00 61.11 H new ATOM 0 HA GLU A 7 0.637 8.775 -9.847 1.00 23.42 H new ATOM 0 HB2 GLU A 7 2.374 7.236 -7.995 1.00 72.32 H new ATOM 0 HB3 GLU A 7 0.731 7.462 -7.429 1.00 72.32 H new ATOM 0 HG2 GLU A 7 1.075 6.577 -10.263 1.00 53.22 H new ATOM 0 HG3 GLU A 7 1.479 5.417 -9.013 1.00 53.22 H new ATOM 102 N LYS A 8 1.704 10.442 -7.238 1.00 33.13 N ATOM 103 CA LYS A 8 1.339 11.456 -6.256 1.00 4.14 C ATOM 104 C LYS A 8 0.783 12.701 -6.941 1.00 74.14 C ATOM 105 O LYS A 8 0.180 13.558 -6.295 1.00 64.53 O ATOM 106 CB LYS A 8 2.553 11.829 -5.403 1.00 75.53 C ATOM 107 CG LYS A 8 3.354 10.630 -4.927 1.00 22.34 C ATOM 108 CD LYS A 8 4.126 10.943 -3.657 1.00 11.10 C ATOM 109 CE LYS A 8 3.779 9.970 -2.540 1.00 11.21 C ATOM 110 NZ LYS A 8 4.998 9.459 -1.852 1.00 5.33 N ATOM 0 H LYS A 8 2.701 10.230 -7.274 1.00 33.13 H new ATOM 0 HA LYS A 8 0.564 11.041 -5.612 1.00 4.14 H new ATOM 0 HB2 LYS A 8 3.205 12.484 -5.981 1.00 75.53 H new ATOM 0 HB3 LYS A 8 2.216 12.398 -4.536 1.00 75.53 H new ATOM 0 HG2 LYS A 8 2.682 9.791 -4.748 1.00 22.34 H new ATOM 0 HG3 LYS A 8 4.048 10.321 -5.709 1.00 22.34 H new ATOM 0 HD2 LYS A 8 5.196 10.899 -3.860 1.00 11.10 H new ATOM 0 HD3 LYS A 8 3.904 11.961 -3.336 1.00 11.10 H new ATOM 0 HE2 LYS A 8 3.133 10.465 -1.815 1.00 11.21 H new ATOM 0 HE3 LYS A 8 3.215 9.132 -2.950 1.00 11.21 H new ATOM 0 HZ1 LYS A 8 4.720 8.799 -1.098 1.00 5.33 H new ATOM 0 HZ2 LYS A 8 5.603 8.965 -2.539 1.00 5.33 H new ATOM 0 HZ3 LYS A 8 5.523 10.256 -1.439 1.00 5.33 H new ATOM 124 N ILE A 9 0.989 12.792 -8.250 1.00 15.20 N ATOM 125 CA ILE A 9 0.507 13.930 -9.022 1.00 41.10 C ATOM 126 C ILE A 9 -0.619 13.518 -9.965 1.00 71.21 C ATOM 127 O ILE A 9 -1.164 14.344 -10.696 1.00 5.21 O ATOM 128 CB ILE A 9 1.639 14.575 -9.842 1.00 42.44 C ATOM 129 CG1 ILE A 9 2.908 14.694 -8.997 1.00 3.22 C ATOM 130 CG2 ILE A 9 1.208 15.940 -10.358 1.00 73.14 C ATOM 131 CD1 ILE A 9 4.074 15.306 -9.740 1.00 55.24 C ATOM 0 H ILE A 9 1.487 12.091 -8.799 1.00 15.20 H new ATOM 0 HA ILE A 9 0.129 14.659 -8.306 1.00 41.10 H new ATOM 0 HB ILE A 9 1.856 13.937 -10.699 1.00 42.44 H new ATOM 0 HG12 ILE A 9 2.692 15.298 -8.115 1.00 3.22 H new ATOM 0 HG13 ILE A 9 3.193 13.703 -8.643 1.00 3.22 H new ATOM 0 HG21 ILE A 9 2.019 16.383 -10.936 1.00 73.14 H new ATOM 0 HG22 ILE A 9 0.329 15.828 -10.993 1.00 73.14 H new ATOM 0 HG23 ILE A 9 0.967 16.588 -9.515 1.00 73.14 H new ATOM 0 HD11 ILE A 9 4.939 15.359 -9.079 1.00 55.24 H new ATOM 0 HD12 ILE A 9 4.317 14.691 -10.607 1.00 55.24 H new ATOM 0 HD13 ILE A 9 3.808 16.310 -10.071 1.00 55.24 H new ATOM 143 N VAL A 10 -0.963 12.235 -9.941 1.00 4.30 N ATOM 144 CA VAL A 10 -2.026 11.712 -10.790 1.00 43.34 C ATOM 145 C VAL A 10 -3.321 11.533 -10.005 1.00 34.04 C ATOM 146 O VAL A 10 -4.392 11.950 -10.449 1.00 71.51 O ATOM 147 CB VAL A 10 -1.630 10.363 -11.420 1.00 22.34 C ATOM 148 CG1 VAL A 10 -2.761 9.823 -12.282 1.00 23.30 C ATOM 149 CG2 VAL A 10 -0.353 10.510 -12.234 1.00 51.14 C ATOM 0 H VAL A 10 -0.520 11.538 -9.342 1.00 4.30 H new ATOM 0 HA VAL A 10 -2.184 12.443 -11.583 1.00 43.34 H new ATOM 0 HB VAL A 10 -1.443 9.649 -10.618 1.00 22.34 H new ATOM 0 HG11 VAL A 10 -2.463 8.870 -12.718 1.00 23.30 H new ATOM 0 HG12 VAL A 10 -3.650 9.678 -11.668 1.00 23.30 H new ATOM 0 HG13 VAL A 10 -2.982 10.533 -13.079 1.00 23.30 H new ATOM 0 HG21 VAL A 10 -0.088 9.548 -12.672 1.00 51.14 H new ATOM 0 HG22 VAL A 10 -0.510 11.239 -13.029 1.00 51.14 H new ATOM 0 HG23 VAL A 10 0.455 10.848 -11.585 1.00 51.14 H new ATOM 159 N LEU A 11 -3.215 10.911 -8.836 1.00 33.50 N ATOM 160 CA LEU A 11 -4.378 10.676 -7.987 1.00 22.11 C ATOM 161 C LEU A 11 -5.074 11.989 -7.641 1.00 23.40 C ATOM 162 O LEU A 11 -6.278 12.136 -7.845 1.00 73.14 O ATOM 163 CB LEU A 11 -3.960 9.955 -6.704 1.00 73.11 C ATOM 164 CG LEU A 11 -2.753 10.539 -5.969 1.00 24.02 C ATOM 165 CD1 LEU A 11 -3.203 11.366 -4.775 1.00 11.31 C ATOM 166 CD2 LEU A 11 -1.810 9.428 -5.526 1.00 62.13 C ATOM 0 H LEU A 11 -2.336 10.560 -8.454 1.00 33.50 H new ATOM 0 HA LEU A 11 -5.078 10.048 -8.538 1.00 22.11 H new ATOM 0 HB2 LEU A 11 -4.809 9.950 -6.020 1.00 73.11 H new ATOM 0 HB3 LEU A 11 -3.743 8.915 -6.949 1.00 73.11 H new ATOM 0 HG LEU A 11 -2.216 11.193 -6.655 1.00 24.02 H new ATOM 0 HD11 LEU A 11 -2.330 11.773 -4.265 1.00 11.31 H new ATOM 0 HD12 LEU A 11 -3.838 12.184 -5.117 1.00 11.31 H new ATOM 0 HD13 LEU A 11 -3.764 10.735 -4.086 1.00 11.31 H new ATOM 0 HD21 LEU A 11 -0.957 9.861 -5.005 1.00 62.13 H new ATOM 0 HD22 LEU A 11 -2.337 8.749 -4.856 1.00 62.13 H new ATOM 0 HD23 LEU A 11 -1.460 8.878 -6.400 1.00 62.13 H new ATOM 178 N MET A 12 -4.306 12.940 -7.120 1.00 51.31 N ATOM 179 CA MET A 12 -4.848 14.242 -6.750 1.00 35.35 C ATOM 180 C MET A 12 -5.439 14.951 -7.965 1.00 14.33 C ATOM 181 O MET A 12 -6.496 15.575 -7.878 1.00 15.55 O ATOM 182 CB MET A 12 -3.759 15.112 -6.118 1.00 43.44 C ATOM 183 CG MET A 12 -2.424 15.032 -6.840 1.00 42.04 C ATOM 184 SD MET A 12 -1.290 16.345 -6.349 1.00 23.34 S ATOM 185 CE MET A 12 -1.046 17.186 -7.912 1.00 1.34 C ATOM 0 H MET A 12 -3.307 12.834 -6.945 1.00 51.31 H new ATOM 0 HA MET A 12 -5.643 14.082 -6.022 1.00 35.35 H new ATOM 0 HB2 MET A 12 -4.095 16.149 -6.106 1.00 43.44 H new ATOM 0 HB3 MET A 12 -3.620 14.810 -5.080 1.00 43.44 H new ATOM 0 HG2 MET A 12 -1.963 14.065 -6.638 1.00 42.04 H new ATOM 0 HG3 MET A 12 -2.593 15.086 -7.915 1.00 42.04 H new ATOM 0 HE1 MET A 12 -0.051 17.629 -7.935 1.00 1.34 H new ATOM 0 HE2 MET A 12 -1.144 16.471 -8.729 1.00 1.34 H new ATOM 0 HE3 MET A 12 -1.795 17.970 -8.024 1.00 1.34 H new ATOM 195 N ARG A 13 -4.751 14.848 -9.097 1.00 72.22 N ATOM 196 CA ARG A 13 -5.207 15.479 -10.329 1.00 43.34 C ATOM 197 C ARG A 13 -6.619 15.020 -10.685 1.00 25.20 C ATOM 198 O ARG A 13 -7.473 15.828 -11.049 1.00 32.00 O ATOM 199 CB ARG A 13 -4.250 15.157 -11.478 1.00 43.40 C ATOM 200 CG ARG A 13 -4.766 15.589 -12.841 1.00 23.54 C ATOM 201 CD ARG A 13 -3.626 15.841 -13.815 1.00 1.24 C ATOM 202 NE ARG A 13 -3.225 14.623 -14.513 1.00 13.15 N ATOM 203 CZ ARG A 13 -3.987 14.002 -15.407 1.00 62.43 C ATOM 204 NH1 ARG A 13 -5.185 14.484 -15.709 1.00 34.04 N ATOM 205 NH2 ARG A 13 -3.552 12.898 -16.001 1.00 3.12 N ATOM 0 H ARG A 13 -3.875 14.333 -9.186 1.00 72.22 H new ATOM 0 HA ARG A 13 -5.223 16.557 -10.170 1.00 43.34 H new ATOM 0 HB2 ARG A 13 -3.293 15.645 -11.290 1.00 43.40 H new ATOM 0 HB3 ARG A 13 -4.063 14.083 -11.494 1.00 43.40 H new ATOM 0 HG2 ARG A 13 -5.425 14.819 -13.242 1.00 23.54 H new ATOM 0 HG3 ARG A 13 -5.362 16.495 -12.735 1.00 23.54 H new ATOM 0 HD2 ARG A 13 -3.931 16.593 -14.543 1.00 1.24 H new ATOM 0 HD3 ARG A 13 -2.771 16.248 -13.275 1.00 1.24 H new ATOM 0 HE ARG A 13 -2.309 14.227 -14.303 1.00 13.15 H new ATOM 0 HH11 ARG A 13 -5.523 15.333 -15.255 1.00 34.04 H new ATOM 0 HH12 ARG A 13 -5.769 14.006 -16.396 1.00 34.04 H new ATOM 0 HH21 ARG A 13 -2.631 12.524 -15.772 1.00 3.12 H new ATOM 0 HH22 ARG A 13 -4.139 12.423 -16.687 1.00 3.12 H new ATOM 219 N LYS A 14 -6.855 13.716 -10.578 1.00 43.14 N ATOM 220 CA LYS A 14 -8.161 13.149 -10.888 1.00 24.33 C ATOM 221 C LYS A 14 -9.205 13.596 -9.869 1.00 14.43 C ATOM 222 O LYS A 14 -10.401 13.623 -10.162 1.00 20.12 O ATOM 223 CB LYS A 14 -8.083 11.621 -10.915 1.00 73.54 C ATOM 224 CG LYS A 14 -8.015 11.039 -12.316 1.00 21.53 C ATOM 225 CD LYS A 14 -6.584 10.736 -12.725 1.00 2.42 C ATOM 226 CE LYS A 14 -5.999 9.596 -11.906 1.00 1.21 C ATOM 227 NZ LYS A 14 -5.521 8.481 -12.770 1.00 3.32 N ATOM 0 H LYS A 14 -6.159 13.033 -10.279 1.00 43.14 H new ATOM 0 HA LYS A 14 -8.461 13.510 -11.872 1.00 24.33 H new ATOM 0 HB2 LYS A 14 -7.205 11.301 -10.355 1.00 73.54 H new ATOM 0 HB3 LYS A 14 -8.954 11.212 -10.403 1.00 73.54 H new ATOM 0 HG2 LYS A 14 -8.608 10.126 -12.361 1.00 21.53 H new ATOM 0 HG3 LYS A 14 -8.456 11.741 -13.024 1.00 21.53 H new ATOM 0 HD2 LYS A 14 -6.554 10.477 -13.783 1.00 2.42 H new ATOM 0 HD3 LYS A 14 -5.971 11.629 -12.597 1.00 2.42 H new ATOM 0 HE2 LYS A 14 -5.171 9.969 -11.303 1.00 1.21 H new ATOM 0 HE3 LYS A 14 -6.753 9.222 -11.214 1.00 1.21 H new ATOM 0 HZ1 LYS A 14 -4.782 7.947 -12.270 1.00 3.32 H new ATOM 0 HZ2 LYS A 14 -6.316 7.848 -12.991 1.00 3.32 H new ATOM 0 HZ3 LYS A 14 -5.131 8.869 -13.653 1.00 3.32 H new ATOM 241 N SER A 15 -8.745 13.948 -8.673 1.00 0.52 N ATOM 242 CA SER A 15 -9.640 14.392 -7.611 1.00 34.52 C ATOM 243 C SER A 15 -10.359 15.677 -8.008 1.00 4.13 C ATOM 244 O SER A 15 -11.488 15.925 -7.585 1.00 42.32 O ATOM 245 CB SER A 15 -8.855 14.613 -6.315 1.00 23.33 C ATOM 246 OG SER A 15 -9.711 14.563 -5.187 1.00 1.04 O ATOM 0 H SER A 15 -7.758 13.934 -8.415 1.00 0.52 H new ATOM 0 HA SER A 15 -10.386 13.614 -7.449 1.00 34.52 H new ATOM 0 HB2 SER A 15 -8.080 13.853 -6.221 1.00 23.33 H new ATOM 0 HB3 SER A 15 -8.351 15.579 -6.351 1.00 23.33 H new ATOM 0 HG SER A 15 -10.584 14.942 -5.422 1.00 1.04 H new ATOM 252 N GLU A 16 -9.696 16.491 -8.824 1.00 24.43 N ATOM 253 CA GLU A 16 -10.273 17.751 -9.279 1.00 22.34 C ATOM 254 C GLU A 16 -11.081 17.549 -10.557 1.00 32.11 C ATOM 255 O GLU A 16 -11.726 18.476 -11.049 1.00 43.32 O ATOM 256 CB GLU A 16 -9.170 18.786 -9.517 1.00 13.35 C ATOM 257 CG GLU A 16 -9.680 20.216 -9.572 1.00 62.31 C ATOM 258 CD GLU A 16 -9.668 20.891 -8.215 1.00 2.34 C ATOM 259 OE1 GLU A 16 -8.728 20.636 -7.433 1.00 72.53 O ATOM 260 OE2 GLU A 16 -10.599 21.675 -7.934 1.00 14.23 O ATOM 0 H GLU A 16 -8.760 16.301 -9.183 1.00 24.43 H new ATOM 0 HA GLU A 16 -10.943 18.117 -8.501 1.00 22.34 H new ATOM 0 HB2 GLU A 16 -8.428 18.704 -8.722 1.00 13.35 H new ATOM 0 HB3 GLU A 16 -8.661 18.554 -10.453 1.00 13.35 H new ATOM 0 HG2 GLU A 16 -9.066 20.791 -10.265 1.00 62.31 H new ATOM 0 HG3 GLU A 16 -10.696 20.221 -9.967 1.00 62.31 H new ATOM 267 N TYR A 17 -11.041 16.334 -11.090 1.00 34.24 N ATOM 268 CA TYR A 17 -11.768 16.010 -12.313 1.00 3.21 C ATOM 269 C TYR A 17 -11.253 16.837 -13.486 1.00 63.52 C ATOM 270 O TYR A 17 -12.033 17.346 -14.293 1.00 30.34 O ATOM 271 CB TYR A 17 -13.265 16.253 -12.120 1.00 21.42 C ATOM 272 CG TYR A 17 -13.834 15.585 -10.889 1.00 23.24 C ATOM 273 CD1 TYR A 17 -13.797 16.216 -9.652 1.00 22.22 C ATOM 274 CD2 TYR A 17 -14.409 14.322 -10.963 1.00 54.02 C ATOM 275 CE1 TYR A 17 -14.315 15.610 -8.524 1.00 21.13 C ATOM 276 CE2 TYR A 17 -14.931 13.708 -9.841 1.00 50.43 C ATOM 277 CZ TYR A 17 -14.880 14.356 -8.624 1.00 22.22 C ATOM 278 OH TYR A 17 -15.399 13.748 -7.503 1.00 41.24 O ATOM 0 H TYR A 17 -10.513 15.556 -10.695 1.00 34.24 H new ATOM 0 HA TYR A 17 -11.604 14.956 -12.536 1.00 3.21 H new ATOM 0 HB2 TYR A 17 -13.445 17.326 -12.056 1.00 21.42 H new ATOM 0 HB3 TYR A 17 -13.799 15.892 -12.999 1.00 21.42 H new ATOM 0 HD1 TYR A 17 -13.355 17.198 -9.571 1.00 22.22 H new ATOM 0 HD2 TYR A 17 -14.448 13.812 -11.914 1.00 54.02 H new ATOM 0 HE1 TYR A 17 -14.278 16.115 -7.570 1.00 21.13 H new ATOM 0 HE2 TYR A 17 -15.376 12.727 -9.916 1.00 50.43 H new ATOM 0 HH TYR A 17 -15.760 12.870 -7.745 1.00 41.24 H new ATOM 288 N LEU A 18 -9.934 16.969 -13.576 1.00 50.01 N ATOM 289 CA LEU A 18 -9.312 17.735 -14.652 1.00 55.21 C ATOM 290 C LEU A 18 -8.277 16.893 -15.390 1.00 11.42 C ATOM 291 O LEU A 18 -7.635 16.023 -14.802 1.00 23.51 O ATOM 292 CB LEU A 18 -8.655 18.997 -14.091 1.00 71.45 C ATOM 293 CG LEU A 18 -7.458 18.776 -13.166 1.00 20.12 C ATOM 294 CD1 LEU A 18 -6.180 18.618 -13.976 1.00 2.31 C ATOM 295 CD2 LEU A 18 -7.327 19.927 -12.180 1.00 52.43 C ATOM 0 H LEU A 18 -9.274 16.556 -12.917 1.00 50.01 H new ATOM 0 HA LEU A 18 -10.090 18.022 -15.359 1.00 55.21 H new ATOM 0 HB2 LEU A 18 -8.333 19.617 -14.927 1.00 71.45 H new ATOM 0 HB3 LEU A 18 -9.410 19.564 -13.546 1.00 71.45 H new ATOM 0 HG LEU A 18 -7.623 17.858 -12.602 1.00 20.12 H new ATOM 0 HD11 LEU A 18 -5.338 18.462 -13.301 1.00 2.31 H new ATOM 0 HD12 LEU A 18 -6.275 17.761 -14.642 1.00 2.31 H new ATOM 0 HD13 LEU A 18 -6.009 19.519 -14.566 1.00 2.31 H new ATOM 0 HD21 LEU A 18 -6.470 19.753 -11.529 1.00 52.43 H new ATOM 0 HD22 LEU A 18 -7.185 20.860 -12.726 1.00 52.43 H new ATOM 0 HD23 LEU A 18 -8.232 19.994 -11.577 1.00 52.43 H new ATOM 307 N SER A 19 -8.119 17.160 -16.683 1.00 75.14 N ATOM 308 CA SER A 19 -7.162 16.426 -17.503 1.00 42.32 C ATOM 309 C SER A 19 -5.799 17.112 -17.493 1.00 72.22 C ATOM 310 O SER A 19 -5.579 18.069 -16.750 1.00 2.13 O ATOM 311 CB SER A 19 -7.675 16.307 -18.939 1.00 3.34 C ATOM 312 OG SER A 19 -8.940 16.930 -19.082 1.00 61.02 O ATOM 0 H SER A 19 -8.641 17.879 -17.185 1.00 75.14 H new ATOM 0 HA SER A 19 -7.050 15.427 -17.081 1.00 42.32 H new ATOM 0 HB2 SER A 19 -6.961 16.766 -19.623 1.00 3.34 H new ATOM 0 HB3 SER A 19 -7.751 15.255 -19.215 1.00 3.34 H new ATOM 0 HG SER A 19 -9.245 16.842 -20.009 1.00 61.02 H new ATOM 318 N ARG A 20 -4.888 16.616 -18.324 1.00 71.01 N ATOM 319 CA ARG A 20 -3.546 17.179 -18.411 1.00 24.20 C ATOM 320 C ARG A 20 -3.557 18.492 -19.189 1.00 73.30 C ATOM 321 O ARG A 20 -2.580 19.239 -19.176 1.00 23.14 O ATOM 322 CB ARG A 20 -2.594 16.185 -19.078 1.00 14.35 C ATOM 323 CG ARG A 20 -1.968 15.196 -18.109 1.00 64.12 C ATOM 324 CD ARG A 20 -1.068 14.204 -18.829 1.00 52.12 C ATOM 325 NE ARG A 20 -1.067 12.895 -18.181 1.00 31.03 N ATOM 326 CZ ARG A 20 -0.707 11.773 -18.792 1.00 33.21 C ATOM 327 NH1 ARG A 20 -0.320 11.798 -20.060 1.00 13.10 N ATOM 328 NH2 ARG A 20 -0.733 10.620 -18.134 1.00 51.12 N ATOM 0 H ARG A 20 -5.055 15.825 -18.947 1.00 71.01 H new ATOM 0 HA ARG A 20 -3.197 17.380 -17.398 1.00 24.20 H new ATOM 0 HB2 ARG A 20 -3.137 15.634 -19.846 1.00 14.35 H new ATOM 0 HB3 ARG A 20 -1.801 16.737 -19.583 1.00 14.35 H new ATOM 0 HG2 ARG A 20 -1.390 15.736 -17.359 1.00 64.12 H new ATOM 0 HG3 ARG A 20 -2.754 14.658 -17.579 1.00 64.12 H new ATOM 0 HD2 ARG A 20 -1.400 14.097 -19.862 1.00 52.12 H new ATOM 0 HD3 ARG A 20 -0.051 14.594 -18.860 1.00 52.12 H new ATOM 0 HE ARG A 20 -1.359 12.840 -17.205 1.00 31.03 H new ATOM 0 HH11 ARG A 20 -0.298 12.682 -20.569 1.00 13.10 H new ATOM 0 HH12 ARG A 20 -0.044 10.934 -20.526 1.00 13.10 H new ATOM 0 HH21 ARG A 20 -1.030 10.596 -17.158 1.00 51.12 H new ATOM 0 HH22 ARG A 20 -0.456 9.758 -18.604 1.00 51.12 H new ATOM 342 N GLN A 21 -4.668 18.763 -19.866 1.00 33.24 N ATOM 343 CA GLN A 21 -4.804 19.984 -20.651 1.00 62.13 C ATOM 344 C GLN A 21 -5.242 21.151 -19.772 1.00 32.54 C ATOM 345 O GLN A 21 -5.047 22.313 -20.125 1.00 15.25 O ATOM 346 CB GLN A 21 -5.811 19.777 -21.784 1.00 31.45 C ATOM 347 CG GLN A 21 -5.720 20.829 -22.879 1.00 12.41 C ATOM 348 CD GLN A 21 -6.896 20.781 -23.833 1.00 73.14 C ATOM 349 OE1 GLN A 21 -6.727 20.574 -25.035 1.00 3.42 O ATOM 350 NE2 GLN A 21 -8.098 20.971 -23.302 1.00 2.12 N ATOM 0 H GLN A 21 -5.486 18.154 -19.887 1.00 33.24 H new ATOM 0 HA GLN A 21 -3.830 20.221 -21.079 1.00 62.13 H new ATOM 0 HB2 GLN A 21 -5.653 18.792 -22.224 1.00 31.45 H new ATOM 0 HB3 GLN A 21 -6.819 19.783 -21.369 1.00 31.45 H new ATOM 0 HG2 GLN A 21 -5.666 21.818 -22.424 1.00 12.41 H new ATOM 0 HG3 GLN A 21 -4.796 20.686 -23.440 1.00 12.41 H new ATOM 0 HE21 GLN A 21 -8.192 21.139 -22.300 1.00 2.12 H new ATOM 0 HE22 GLN A 21 -8.927 20.949 -23.896 1.00 2.12 H new ATOM 359 N GLN A 22 -5.836 20.831 -18.626 1.00 51.23 N ATOM 360 CA GLN A 22 -6.304 21.853 -17.698 1.00 0.45 C ATOM 361 C GLN A 22 -5.148 22.404 -16.867 1.00 51.31 C ATOM 362 O GLN A 22 -4.757 23.561 -17.019 1.00 43.21 O ATOM 363 CB GLN A 22 -7.383 21.281 -16.777 1.00 11.44 C ATOM 364 CG GLN A 22 -8.358 20.356 -17.485 1.00 2.14 C ATOM 365 CD GLN A 22 -9.079 21.035 -18.633 1.00 62.24 C ATOM 366 OE1 GLN A 22 -9.066 20.550 -19.764 1.00 71.22 O ATOM 367 NE2 GLN A 22 -9.715 22.165 -18.346 1.00 62.52 N ATOM 0 H GLN A 22 -6.004 19.873 -18.319 1.00 51.23 H new ATOM 0 HA GLN A 22 -6.730 22.669 -18.281 1.00 0.45 H new ATOM 0 HB2 GLN A 22 -6.903 20.736 -15.964 1.00 11.44 H new ATOM 0 HB3 GLN A 22 -7.938 22.104 -16.326 1.00 11.44 H new ATOM 0 HG2 GLN A 22 -7.819 19.487 -17.863 1.00 2.14 H new ATOM 0 HG3 GLN A 22 -9.091 19.989 -16.767 1.00 2.14 H new ATOM 0 HE21 GLN A 22 -9.700 22.531 -17.394 1.00 62.52 H new ATOM 0 HE22 GLN A 22 -10.219 22.667 -19.077 1.00 62.52 H new ATOM 376 N LEU A 23 -4.606 21.566 -15.991 1.00 1.25 N ATOM 377 CA LEU A 23 -3.495 21.968 -15.135 1.00 22.42 C ATOM 378 C LEU A 23 -2.364 22.575 -15.959 1.00 63.10 C ATOM 379 O LEU A 23 -1.740 23.553 -15.549 1.00 73.44 O ATOM 380 CB LEU A 23 -2.975 20.767 -14.343 1.00 64.12 C ATOM 381 CG LEU A 23 -1.658 20.976 -13.594 1.00 63.23 C ATOM 382 CD1 LEU A 23 -1.632 20.147 -12.320 1.00 72.12 C ATOM 383 CD2 LEU A 23 -0.476 20.624 -14.486 1.00 24.14 C ATOM 0 H LEU A 23 -4.917 20.604 -15.854 1.00 1.25 H new ATOM 0 HA LEU A 23 -3.860 22.724 -14.440 1.00 22.42 H new ATOM 0 HB2 LEU A 23 -3.738 20.475 -13.621 1.00 64.12 H new ATOM 0 HB3 LEU A 23 -2.850 19.930 -15.030 1.00 64.12 H new ATOM 0 HG LEU A 23 -1.580 22.028 -13.320 1.00 63.23 H new ATOM 0 HD11 LEU A 23 -0.688 20.308 -11.800 1.00 72.12 H new ATOM 0 HD12 LEU A 23 -2.457 20.446 -11.674 1.00 72.12 H new ATOM 0 HD13 LEU A 23 -1.732 19.091 -12.571 1.00 72.12 H new ATOM 0 HD21 LEU A 23 0.453 20.779 -13.937 1.00 24.14 H new ATOM 0 HD22 LEU A 23 -0.548 19.580 -14.790 1.00 24.14 H new ATOM 0 HD23 LEU A 23 -0.485 21.261 -15.370 1.00 24.14 H new ATOM 395 N ALA A 24 -2.109 21.990 -17.125 1.00 40.14 N ATOM 396 CA ALA A 24 -1.057 22.476 -18.009 1.00 33.11 C ATOM 397 C ALA A 24 -1.209 23.970 -18.275 1.00 23.23 C ATOM 398 O ALA A 24 -0.229 24.667 -18.535 1.00 34.43 O ATOM 399 CB ALA A 24 -1.069 21.702 -19.319 1.00 43.12 C ATOM 0 H ALA A 24 -2.617 21.179 -17.479 1.00 40.14 H new ATOM 0 HA ALA A 24 -0.099 22.317 -17.514 1.00 33.11 H new ATOM 0 HB1 ALA A 24 -0.278 22.076 -19.970 1.00 43.12 H new ATOM 0 HB2 ALA A 24 -0.904 20.644 -19.118 1.00 43.12 H new ATOM 0 HB3 ALA A 24 -2.034 21.832 -19.809 1.00 43.12 H new ATOM 405 N ASP A 25 -2.444 24.454 -18.209 1.00 0.02 N ATOM 406 CA ASP A 25 -2.725 25.867 -18.441 1.00 72.22 C ATOM 407 C ASP A 25 -2.711 26.647 -17.130 1.00 62.10 C ATOM 408 O ASP A 25 -2.468 27.854 -17.116 1.00 11.21 O ATOM 409 CB ASP A 25 -4.079 26.032 -19.134 1.00 75.11 C ATOM 410 CG ASP A 25 -3.985 26.861 -20.399 1.00 52.02 C ATOM 411 OD1 ASP A 25 -4.013 28.105 -20.296 1.00 32.35 O ATOM 412 OD2 ASP A 25 -3.882 26.265 -21.492 1.00 73.30 O ATOM 0 H ASP A 25 -3.267 23.890 -17.997 1.00 0.02 H new ATOM 0 HA ASP A 25 -1.944 26.266 -19.088 1.00 72.22 H new ATOM 0 HB2 ASP A 25 -4.482 25.049 -19.377 1.00 75.11 H new ATOM 0 HB3 ASP A 25 -4.781 26.503 -18.446 1.00 75.11 H new ATOM 417 N LEU A 26 -2.976 25.949 -16.030 1.00 11.45 N ATOM 418 CA LEU A 26 -2.995 26.576 -14.714 1.00 42.33 C ATOM 419 C LEU A 26 -1.579 26.882 -14.236 1.00 31.40 C ATOM 420 O LEU A 26 -1.359 27.823 -13.471 1.00 63.25 O ATOM 421 CB LEU A 26 -3.701 25.669 -13.705 1.00 5.25 C ATOM 422 CG LEU A 26 -5.139 26.050 -13.351 1.00 72.31 C ATOM 423 CD1 LEU A 26 -6.113 25.006 -13.877 1.00 51.25 C ATOM 424 CD2 LEU A 26 -5.292 26.215 -11.846 1.00 64.15 C ATOM 0 H LEU A 26 -3.180 24.950 -16.024 1.00 11.45 H new ATOM 0 HA LEU A 26 -3.543 27.515 -14.794 1.00 42.33 H new ATOM 0 HB2 LEU A 26 -3.702 24.653 -14.099 1.00 5.25 H new ATOM 0 HB3 LEU A 26 -3.114 25.654 -12.787 1.00 5.25 H new ATOM 0 HG LEU A 26 -5.369 27.004 -13.826 1.00 72.31 H new ATOM 0 HD11 LEU A 26 -7.131 25.294 -13.616 1.00 51.25 H new ATOM 0 HD12 LEU A 26 -6.022 24.937 -14.961 1.00 51.25 H new ATOM 0 HD13 LEU A 26 -5.884 24.038 -13.432 1.00 51.25 H new ATOM 0 HD21 LEU A 26 -6.322 26.486 -11.613 1.00 64.15 H new ATOM 0 HD22 LEU A 26 -5.042 25.277 -11.350 1.00 64.15 H new ATOM 0 HD23 LEU A 26 -4.622 27.000 -11.496 1.00 64.15 H new ATOM 436 N THR A 27 -0.620 26.083 -14.692 1.00 4.14 N ATOM 437 CA THR A 27 0.775 26.269 -14.313 1.00 54.35 C ATOM 438 C THR A 27 1.627 26.653 -15.518 1.00 0.33 C ATOM 439 O THR A 27 2.797 27.004 -15.375 1.00 41.53 O ATOM 440 CB THR A 27 1.357 24.995 -13.671 1.00 71.31 C ATOM 441 OG1 THR A 27 2.787 25.069 -13.646 1.00 70.12 O ATOM 442 CG2 THR A 27 0.922 23.756 -14.440 1.00 31.12 C ATOM 0 H THR A 27 -0.784 25.300 -15.325 1.00 4.14 H new ATOM 0 HA THR A 27 0.799 27.078 -13.583 1.00 54.35 H new ATOM 0 HB THR A 27 0.979 24.922 -12.651 1.00 71.31 H new ATOM 0 HG1 THR A 27 3.075 25.948 -13.970 1.00 70.12 H new ATOM 0 HG21 THR A 27 1.345 22.868 -13.969 1.00 31.12 H new ATOM 0 HG22 THR A 27 -0.166 23.687 -14.434 1.00 31.12 H new ATOM 0 HG23 THR A 27 1.275 23.824 -15.469 1.00 31.12 H new ATOM 450 N GLY A 28 1.030 26.583 -16.704 1.00 71.14 N ATOM 451 CA GLY A 28 1.749 26.928 -17.916 1.00 55.42 C ATOM 452 C GLY A 28 2.642 25.801 -18.400 1.00 63.01 C ATOM 453 O GLY A 28 3.355 25.947 -19.394 1.00 24.43 O ATOM 0 H GLY A 28 0.062 26.294 -16.847 1.00 71.14 H new ATOM 0 HA2 GLY A 28 1.035 27.183 -18.699 1.00 55.42 H new ATOM 0 HA3 GLY A 28 2.355 27.816 -17.735 1.00 55.42 H new ATOM 457 N VAL A 29 2.604 24.674 -17.696 1.00 50.12 N ATOM 458 CA VAL A 29 3.416 23.519 -18.059 1.00 54.03 C ATOM 459 C VAL A 29 3.058 23.011 -19.452 1.00 24.12 C ATOM 460 O VAL A 29 1.888 22.931 -19.828 1.00 11.23 O ATOM 461 CB VAL A 29 3.245 22.372 -17.046 1.00 3.24 C ATOM 462 CG1 VAL A 29 3.367 21.023 -17.739 1.00 14.34 C ATOM 463 CG2 VAL A 29 4.263 22.497 -15.923 1.00 50.23 C ATOM 0 H VAL A 29 2.020 24.537 -16.871 1.00 50.12 H new ATOM 0 HA VAL A 29 4.455 23.848 -18.052 1.00 54.03 H new ATOM 0 HB VAL A 29 2.248 22.441 -16.611 1.00 3.24 H new ATOM 0 HG11 VAL A 29 3.243 20.225 -17.007 1.00 14.34 H new ATOM 0 HG12 VAL A 29 2.596 20.936 -18.504 1.00 14.34 H new ATOM 0 HG13 VAL A 29 4.350 20.940 -18.203 1.00 14.34 H new ATOM 0 HG21 VAL A 29 4.128 21.678 -15.216 1.00 50.23 H new ATOM 0 HG22 VAL A 29 5.270 22.455 -16.338 1.00 50.23 H new ATOM 0 HG23 VAL A 29 4.122 23.447 -15.408 1.00 50.23 H new ATOM 473 N PRO A 30 4.086 22.658 -20.236 1.00 5.34 N ATOM 474 CA PRO A 30 3.905 22.150 -21.599 1.00 54.13 C ATOM 475 C PRO A 30 3.283 20.757 -21.621 1.00 3.43 C ATOM 476 O PRO A 30 3.906 19.783 -21.198 1.00 5.21 O ATOM 477 CB PRO A 30 5.330 22.108 -22.155 1.00 44.23 C ATOM 478 CG PRO A 30 6.202 21.976 -20.954 1.00 71.13 C ATOM 479 CD PRO A 30 5.507 22.728 -19.852 1.00 14.15 C ATOM 0 HA PRO A 30 3.225 22.774 -22.179 1.00 54.13 H new ATOM 0 HB2 PRO A 30 5.465 21.268 -22.836 1.00 44.23 H new ATOM 0 HB3 PRO A 30 5.563 23.013 -22.716 1.00 44.23 H new ATOM 0 HG2 PRO A 30 6.340 20.929 -20.685 1.00 71.13 H new ATOM 0 HG3 PRO A 30 7.193 22.389 -21.144 1.00 71.13 H new ATOM 0 HD2 PRO A 30 5.684 22.270 -18.879 1.00 14.15 H new ATOM 0 HD3 PRO A 30 5.856 23.759 -19.787 1.00 14.15 H new ATOM 487 N TYR A 31 2.054 20.671 -22.116 1.00 25.44 N ATOM 488 CA TYR A 31 1.349 19.397 -22.191 1.00 32.30 C ATOM 489 C TYR A 31 2.198 18.345 -22.896 1.00 14.22 C ATOM 490 O TYR A 31 2.098 17.153 -22.606 1.00 34.33 O ATOM 491 CB TYR A 31 0.018 19.571 -22.924 1.00 63.02 C ATOM 492 CG TYR A 31 -0.789 18.295 -23.025 1.00 1.51 C ATOM 493 CD1 TYR A 31 -0.524 17.359 -24.016 1.00 12.33 C ATOM 494 CD2 TYR A 31 -1.817 18.027 -22.129 1.00 32.10 C ATOM 495 CE1 TYR A 31 -1.257 16.192 -24.112 1.00 62.12 C ATOM 496 CE2 TYR A 31 -2.555 16.863 -22.217 1.00 35.12 C ATOM 497 CZ TYR A 31 -2.272 15.949 -23.210 1.00 32.41 C ATOM 498 OH TYR A 31 -3.006 14.788 -23.302 1.00 11.03 O ATOM 0 H TYR A 31 1.525 21.468 -22.471 1.00 25.44 H new ATOM 0 HA TYR A 31 1.155 19.057 -21.174 1.00 32.30 H new ATOM 0 HB2 TYR A 31 -0.575 20.326 -22.408 1.00 63.02 H new ATOM 0 HB3 TYR A 31 0.212 19.949 -23.928 1.00 63.02 H new ATOM 0 HD1 TYR A 31 0.269 17.547 -24.724 1.00 12.33 H new ATOM 0 HD2 TYR A 31 -2.043 18.741 -21.351 1.00 32.10 H new ATOM 0 HE1 TYR A 31 -1.037 15.474 -24.888 1.00 62.12 H new ATOM 0 HE2 TYR A 31 -3.350 16.670 -21.512 1.00 35.12 H new ATOM 0 HH TYR A 31 -3.681 14.770 -22.592 1.00 11.03 H new ATOM 508 N GLY A 32 3.034 18.795 -23.828 1.00 2.44 N ATOM 509 CA GLY A 32 3.889 17.880 -24.561 1.00 73.33 C ATOM 510 C GLY A 32 4.791 17.072 -23.649 1.00 15.40 C ATOM 511 O GLY A 32 4.994 15.876 -23.865 1.00 5.33 O ATOM 0 H GLY A 32 3.134 19.776 -24.088 1.00 2.44 H new ATOM 0 HA2 GLY A 32 3.270 17.202 -25.149 1.00 73.33 H new ATOM 0 HA3 GLY A 32 4.501 18.444 -25.265 1.00 73.33 H new ATOM 515 N THR A 33 5.334 17.724 -22.627 1.00 2.10 N ATOM 516 CA THR A 33 6.221 17.059 -21.680 1.00 33.22 C ATOM 517 C THR A 33 5.466 16.629 -20.429 1.00 41.20 C ATOM 518 O THR A 33 5.877 15.700 -19.731 1.00 25.30 O ATOM 519 CB THR A 33 7.394 17.971 -21.271 1.00 51.23 C ATOM 520 OG1 THR A 33 7.933 18.624 -22.427 1.00 63.51 O ATOM 521 CG2 THR A 33 8.485 17.171 -20.578 1.00 43.02 C ATOM 0 H THR A 33 5.175 18.713 -22.433 1.00 2.10 H new ATOM 0 HA THR A 33 6.616 16.177 -22.184 1.00 33.22 H new ATOM 0 HB THR A 33 7.018 18.720 -20.574 1.00 51.23 H new ATOM 0 HG1 THR A 33 8.677 19.203 -22.159 1.00 63.51 H new ATOM 0 HG21 THR A 33 9.302 17.836 -20.299 1.00 43.02 H new ATOM 0 HG22 THR A 33 8.078 16.700 -19.683 1.00 43.02 H new ATOM 0 HG23 THR A 33 8.858 16.402 -21.255 1.00 43.02 H new ATOM 529 N LEU A 34 4.359 17.308 -20.148 1.00 24.43 N ATOM 530 CA LEU A 34 3.545 16.996 -18.979 1.00 43.23 C ATOM 531 C LEU A 34 3.195 15.512 -18.940 1.00 50.10 C ATOM 532 O LEU A 34 3.224 14.884 -17.881 1.00 64.13 O ATOM 533 CB LEU A 34 2.265 17.833 -18.986 1.00 34.41 C ATOM 534 CG LEU A 34 1.274 17.554 -17.855 1.00 14.43 C ATOM 535 CD1 LEU A 34 1.804 18.094 -16.536 1.00 3.32 C ATOM 536 CD2 LEU A 34 -0.084 18.160 -18.175 1.00 12.32 C ATOM 0 H LEU A 34 4.005 18.079 -20.714 1.00 24.43 H new ATOM 0 HA LEU A 34 4.125 17.238 -18.088 1.00 43.23 H new ATOM 0 HB2 LEU A 34 2.543 18.886 -18.947 1.00 34.41 H new ATOM 0 HB3 LEU A 34 1.755 17.673 -19.936 1.00 34.41 H new ATOM 0 HG LEU A 34 1.154 16.475 -17.760 1.00 14.43 H new ATOM 0 HD11 LEU A 34 1.086 17.886 -15.743 1.00 3.32 H new ATOM 0 HD12 LEU A 34 2.753 17.613 -16.301 1.00 3.32 H new ATOM 0 HD13 LEU A 34 1.953 19.171 -16.617 1.00 3.32 H new ATOM 0 HD21 LEU A 34 -0.777 17.952 -17.360 1.00 12.32 H new ATOM 0 HD22 LEU A 34 0.019 19.238 -18.298 1.00 12.32 H new ATOM 0 HD23 LEU A 34 -0.468 17.725 -19.098 1.00 12.32 H new ATOM 548 N SER A 35 2.867 14.956 -20.102 1.00 63.13 N ATOM 549 CA SER A 35 2.510 13.545 -20.200 1.00 73.31 C ATOM 550 C SER A 35 3.559 12.670 -19.520 1.00 51.22 C ATOM 551 O SER A 35 3.242 11.612 -18.976 1.00 50.40 O ATOM 552 CB SER A 35 2.362 13.136 -21.667 1.00 42.24 C ATOM 553 OG SER A 35 2.463 11.731 -21.817 1.00 24.01 O ATOM 0 H SER A 35 2.841 15.460 -20.988 1.00 63.13 H new ATOM 0 HA SER A 35 1.557 13.401 -19.691 1.00 73.31 H new ATOM 0 HB2 SER A 35 1.399 13.477 -22.048 1.00 42.24 H new ATOM 0 HB3 SER A 35 3.132 13.625 -22.264 1.00 42.24 H new ATOM 0 HG SER A 35 2.364 11.495 -22.763 1.00 24.01 H new ATOM 559 N TYR A 36 4.808 13.121 -19.555 1.00 24.31 N ATOM 560 CA TYR A 36 5.905 12.379 -18.944 1.00 24.32 C ATOM 561 C TYR A 36 6.108 12.803 -17.492 1.00 10.31 C ATOM 562 O TYR A 36 6.578 12.022 -16.665 1.00 72.52 O ATOM 563 CB TYR A 36 7.195 12.593 -19.735 1.00 60.32 C ATOM 564 CG TYR A 36 7.214 11.882 -21.069 1.00 21.33 C ATOM 565 CD1 TYR A 36 6.774 10.568 -21.184 1.00 21.51 C ATOM 566 CD2 TYR A 36 7.671 12.522 -22.214 1.00 33.34 C ATOM 567 CE1 TYR A 36 6.789 9.914 -22.401 1.00 11.33 C ATOM 568 CE2 TYR A 36 7.689 11.876 -23.436 1.00 14.13 C ATOM 569 CZ TYR A 36 7.248 10.572 -23.523 1.00 3.04 C ATOM 570 OH TYR A 36 7.263 9.924 -24.737 1.00 45.51 O ATOM 0 H TYR A 36 5.086 13.996 -20.000 1.00 24.31 H new ATOM 0 HA TYR A 36 5.648 11.320 -18.961 1.00 24.32 H new ATOM 0 HB2 TYR A 36 7.337 13.661 -19.900 1.00 60.32 H new ATOM 0 HB3 TYR A 36 8.039 12.248 -19.137 1.00 60.32 H new ATOM 0 HD1 TYR A 36 6.414 10.050 -20.307 1.00 21.51 H new ATOM 0 HD2 TYR A 36 8.018 13.542 -22.148 1.00 33.34 H new ATOM 0 HE1 TYR A 36 6.443 8.893 -22.473 1.00 11.33 H new ATOM 0 HE2 TYR A 36 8.046 12.389 -24.317 1.00 14.13 H new ATOM 0 HH TYR A 36 7.614 10.527 -25.425 1.00 45.51 H new ATOM 580 N TYR A 37 5.750 14.046 -17.192 1.00 54.21 N ATOM 581 CA TYR A 37 5.893 14.577 -15.841 1.00 5.01 C ATOM 582 C TYR A 37 5.050 13.780 -14.850 1.00 44.23 C ATOM 583 O TYR A 37 5.577 13.179 -13.914 1.00 51.30 O ATOM 584 CB TYR A 37 5.487 16.051 -15.804 1.00 11.33 C ATOM 585 CG TYR A 37 6.600 16.996 -16.197 1.00 63.44 C ATOM 586 CD1 TYR A 37 7.623 16.584 -17.041 1.00 74.01 C ATOM 587 CD2 TYR A 37 6.628 18.303 -15.724 1.00 44.14 C ATOM 588 CE1 TYR A 37 8.642 17.443 -17.402 1.00 44.51 C ATOM 589 CE2 TYR A 37 7.641 19.170 -16.081 1.00 1.34 C ATOM 590 CZ TYR A 37 8.647 18.736 -16.920 1.00 71.32 C ATOM 591 OH TYR A 37 9.659 19.595 -17.279 1.00 40.12 O ATOM 0 H TYR A 37 5.359 14.705 -17.865 1.00 54.21 H new ATOM 0 HA TYR A 37 6.940 14.488 -15.552 1.00 5.01 H new ATOM 0 HB2 TYR A 37 4.640 16.203 -16.473 1.00 11.33 H new ATOM 0 HB3 TYR A 37 5.148 16.301 -14.799 1.00 11.33 H new ATOM 0 HD1 TYR A 37 7.622 15.573 -17.422 1.00 74.01 H new ATOM 0 HD2 TYR A 37 5.843 18.646 -15.066 1.00 44.14 H new ATOM 0 HE1 TYR A 37 9.431 17.105 -18.058 1.00 44.51 H new ATOM 0 HE2 TYR A 37 7.646 20.183 -15.706 1.00 1.34 H new ATOM 0 HH TYR A 37 9.514 20.467 -16.855 1.00 40.12 H new ATOM 601 N GLU A 38 3.739 13.782 -15.063 1.00 3.11 N ATOM 602 CA GLU A 38 2.822 13.060 -14.190 1.00 5.14 C ATOM 603 C GLU A 38 2.979 11.552 -14.364 1.00 64.14 C ATOM 604 O GLU A 38 2.427 10.767 -13.592 1.00 41.42 O ATOM 605 CB GLU A 38 1.376 13.470 -14.479 1.00 45.31 C ATOM 606 CG GLU A 38 1.184 14.971 -14.609 1.00 24.31 C ATOM 607 CD GLU A 38 -0.195 15.423 -14.171 1.00 34.22 C ATOM 608 OE1 GLU A 38 -0.758 14.800 -13.247 1.00 25.54 O ATOM 609 OE2 GLU A 38 -0.711 16.400 -14.753 1.00 33.41 O ATOM 0 H GLU A 38 3.288 14.276 -15.833 1.00 3.11 H new ATOM 0 HA GLU A 38 3.065 13.317 -13.159 1.00 5.14 H new ATOM 0 HB2 GLU A 38 1.048 12.989 -15.401 1.00 45.31 H new ATOM 0 HB3 GLU A 38 0.735 13.098 -13.680 1.00 45.31 H new ATOM 0 HG2 GLU A 38 1.937 15.483 -14.010 1.00 24.31 H new ATOM 0 HG3 GLU A 38 1.347 15.266 -15.646 1.00 24.31 H new ATOM 616 N SER A 39 3.734 11.155 -15.382 1.00 60.13 N ATOM 617 CA SER A 39 3.961 9.741 -15.661 1.00 34.13 C ATOM 618 C SER A 39 5.223 9.245 -14.963 1.00 11.41 C ATOM 619 O SER A 39 5.381 8.050 -14.718 1.00 14.05 O ATOM 620 CB SER A 39 4.074 9.509 -17.169 1.00 51.23 C ATOM 621 OG SER A 39 4.400 8.159 -17.453 1.00 13.01 O ATOM 0 H SER A 39 4.200 11.792 -16.028 1.00 60.13 H new ATOM 0 HA SER A 39 3.110 9.179 -15.277 1.00 34.13 H new ATOM 0 HB2 SER A 39 3.132 9.769 -17.652 1.00 51.23 H new ATOM 0 HB3 SER A 39 4.837 10.166 -17.585 1.00 51.23 H new ATOM 0 HG SER A 39 4.465 8.035 -18.423 1.00 13.01 H new ATOM 627 N GLY A 40 6.120 10.174 -14.643 1.00 14.52 N ATOM 628 CA GLY A 40 7.356 9.813 -13.975 1.00 24.23 C ATOM 629 C GLY A 40 8.418 9.331 -14.943 1.00 45.11 C ATOM 630 O GLY A 40 9.399 8.707 -14.539 1.00 74.53 O ATOM 0 H GLY A 40 6.012 11.170 -14.835 1.00 14.52 H new ATOM 0 HA2 GLY A 40 7.734 10.675 -13.426 1.00 24.23 H new ATOM 0 HA3 GLY A 40 7.155 9.031 -13.242 1.00 24.23 H new ATOM 634 N ARG A 41 8.222 9.619 -16.227 1.00 4.24 N ATOM 635 CA ARG A 41 9.169 9.207 -17.255 1.00 13.35 C ATOM 636 C ARG A 41 10.589 9.630 -16.887 1.00 52.13 C ATOM 637 O ARG A 41 11.516 8.820 -16.920 1.00 61.34 O ATOM 638 CB ARG A 41 8.780 9.810 -18.607 1.00 40.30 C ATOM 639 CG ARG A 41 9.142 8.931 -19.793 1.00 52.51 C ATOM 640 CD ARG A 41 8.173 7.767 -19.939 1.00 42.11 C ATOM 641 NE ARG A 41 8.696 6.728 -20.823 1.00 62.55 N ATOM 642 CZ ARG A 41 7.973 5.702 -21.257 1.00 34.51 C ATOM 643 NH1 ARG A 41 6.704 5.578 -20.892 1.00 62.54 N ATOM 644 NH2 ARG A 41 8.519 4.797 -22.059 1.00 43.33 N ATOM 0 H ARG A 41 7.416 10.136 -16.579 1.00 4.24 H new ATOM 0 HA ARG A 41 9.139 8.120 -17.327 1.00 13.35 H new ATOM 0 HB2 ARG A 41 7.706 9.995 -18.617 1.00 40.30 H new ATOM 0 HB3 ARG A 41 9.271 10.777 -18.719 1.00 40.30 H new ATOM 0 HG2 ARG A 41 9.136 9.528 -20.705 1.00 52.51 H new ATOM 0 HG3 ARG A 41 10.155 8.549 -19.669 1.00 52.51 H new ATOM 0 HD2 ARG A 41 7.969 7.339 -18.957 1.00 42.11 H new ATOM 0 HD3 ARG A 41 7.224 8.132 -20.331 1.00 42.11 H new ATOM 0 HE ARG A 41 9.669 6.794 -21.123 1.00 62.55 H new ATOM 0 HH11 ARG A 41 6.280 6.272 -20.276 1.00 62.54 H new ATOM 0 HH12 ARG A 41 6.152 4.789 -21.227 1.00 62.54 H new ATOM 0 HH21 ARG A 41 9.494 4.889 -22.342 1.00 43.33 H new ATOM 0 HH22 ARG A 41 7.963 4.009 -22.392 1.00 43.33 H new ATOM 658 N SER A 42 10.751 10.902 -16.539 1.00 70.41 N ATOM 659 CA SER A 42 12.058 11.434 -16.170 1.00 61.23 C ATOM 660 C SER A 42 11.967 12.255 -14.888 1.00 5.23 C ATOM 661 O SER A 42 12.961 12.815 -14.423 1.00 13.14 O ATOM 662 CB SER A 42 12.621 12.294 -17.302 1.00 24.10 C ATOM 663 OG SER A 42 13.854 12.884 -16.929 1.00 12.30 O ATOM 0 H SER A 42 9.993 11.584 -16.505 1.00 70.41 H new ATOM 0 HA SER A 42 12.729 10.593 -15.996 1.00 61.23 H new ATOM 0 HB2 SER A 42 12.762 11.682 -18.193 1.00 24.10 H new ATOM 0 HB3 SER A 42 11.905 13.074 -17.561 1.00 24.10 H new ATOM 0 HG SER A 42 13.912 12.931 -15.952 1.00 12.30 H new ATOM 669 N THR A 43 10.767 12.325 -14.320 1.00 12.02 N ATOM 670 CA THR A 43 10.544 13.080 -13.093 1.00 14.23 C ATOM 671 C THR A 43 10.759 14.571 -13.318 1.00 53.01 C ATOM 672 O THR A 43 11.791 15.005 -13.831 1.00 0.33 O ATOM 673 CB THR A 43 11.477 12.603 -11.964 1.00 21.52 C ATOM 674 OG1 THR A 43 11.525 11.172 -11.939 1.00 2.04 O ATOM 675 CG2 THR A 43 11.003 13.123 -10.615 1.00 51.25 C ATOM 0 H THR A 43 9.934 11.868 -14.691 1.00 12.02 H new ATOM 0 HA THR A 43 9.509 12.906 -12.798 1.00 14.23 H new ATOM 0 HB THR A 43 12.475 12.996 -12.157 1.00 21.52 H new ATOM 0 HG1 THR A 43 12.122 10.877 -11.220 1.00 2.04 H new ATOM 0 HG21 THR A 43 11.677 12.773 -9.833 1.00 51.25 H new ATOM 0 HG22 THR A 43 10.996 14.213 -10.627 1.00 51.25 H new ATOM 0 HG23 THR A 43 9.996 12.756 -10.417 1.00 51.25 H new ATOM 683 N PRO A 44 9.763 15.380 -12.926 1.00 21.02 N ATOM 684 CA PRO A 44 9.821 16.837 -13.073 1.00 52.42 C ATOM 685 C PRO A 44 10.840 17.475 -12.136 1.00 70.25 C ATOM 686 O PRO A 44 11.213 16.909 -11.108 1.00 3.54 O ATOM 687 CB PRO A 44 8.403 17.287 -12.709 1.00 71.00 C ATOM 688 CG PRO A 44 7.881 16.212 -11.818 1.00 72.24 C ATOM 689 CD PRO A 44 8.504 14.933 -12.306 1.00 61.30 C ATOM 0 HA PRO A 44 10.133 17.133 -14.074 1.00 52.42 H new ATOM 0 HB2 PRO A 44 8.412 18.252 -12.202 1.00 71.00 H new ATOM 0 HB3 PRO A 44 7.783 17.400 -13.598 1.00 71.00 H new ATOM 0 HG2 PRO A 44 8.146 16.404 -10.778 1.00 72.24 H new ATOM 0 HG3 PRO A 44 6.793 16.159 -11.865 1.00 72.24 H new ATOM 0 HD2 PRO A 44 8.685 14.236 -11.487 1.00 61.30 H new ATOM 0 HD3 PRO A 44 7.862 14.422 -13.024 1.00 61.30 H new ATOM 697 N PRO A 45 11.301 18.682 -12.495 1.00 71.15 N ATOM 698 CA PRO A 45 12.283 19.423 -11.698 1.00 45.31 C ATOM 699 C PRO A 45 11.699 19.930 -10.384 1.00 45.42 C ATOM 700 O PRO A 45 10.592 19.553 -9.997 1.00 14.40 O ATOM 701 CB PRO A 45 12.661 20.598 -12.603 1.00 13.01 C ATOM 702 CG PRO A 45 11.480 20.787 -13.492 1.00 51.14 C ATOM 703 CD PRO A 45 10.901 19.415 -13.708 1.00 25.43 C ATOM 0 HA PRO A 45 13.129 18.799 -11.411 1.00 45.31 H new ATOM 0 HB2 PRO A 45 12.866 21.496 -12.021 1.00 13.01 H new ATOM 0 HB3 PRO A 45 13.560 20.380 -13.180 1.00 13.01 H new ATOM 0 HG2 PRO A 45 10.748 21.452 -13.033 1.00 51.14 H new ATOM 0 HG3 PRO A 45 11.773 21.241 -14.439 1.00 51.14 H new ATOM 0 HD2 PRO A 45 9.817 19.449 -13.818 1.00 25.43 H new ATOM 0 HD3 PRO A 45 11.299 18.948 -14.609 1.00 25.43 H new ATOM 711 N THR A 46 12.450 20.788 -9.699 1.00 13.11 N ATOM 712 CA THR A 46 12.006 21.346 -8.428 1.00 31.11 C ATOM 713 C THR A 46 11.280 22.671 -8.632 1.00 24.32 C ATOM 714 O THR A 46 10.455 23.071 -7.810 1.00 10.01 O ATOM 715 CB THR A 46 13.190 21.566 -7.467 1.00 23.32 C ATOM 716 OG1 THR A 46 13.965 20.367 -7.363 1.00 51.14 O ATOM 717 CG2 THR A 46 12.699 21.981 -6.089 1.00 20.13 C ATOM 0 H THR A 46 13.368 21.111 -10.004 1.00 13.11 H new ATOM 0 HA THR A 46 11.319 20.623 -7.988 1.00 31.11 H new ATOM 0 HB THR A 46 13.812 22.366 -7.869 1.00 23.32 H new ATOM 0 HG1 THR A 46 14.240 20.077 -8.258 1.00 51.14 H new ATOM 0 HG21 THR A 46 13.553 22.130 -5.428 1.00 20.13 H new ATOM 0 HG22 THR A 46 12.135 22.910 -6.168 1.00 20.13 H new ATOM 0 HG23 THR A 46 12.057 21.200 -5.681 1.00 20.13 H new ATOM 725 N ASP A 47 11.590 23.347 -9.733 1.00 42.22 N ATOM 726 CA ASP A 47 10.966 24.627 -10.046 1.00 11.00 C ATOM 727 C ASP A 47 9.564 24.422 -10.614 1.00 64.31 C ATOM 728 O ASP A 47 8.650 25.197 -10.331 1.00 65.11 O ATOM 729 CB ASP A 47 11.823 25.407 -11.043 1.00 53.22 C ATOM 730 CG ASP A 47 11.758 26.905 -10.816 1.00 65.03 C ATOM 731 OD1 ASP A 47 10.677 27.399 -10.434 1.00 61.13 O ATOM 732 OD2 ASP A 47 12.787 27.582 -11.021 1.00 21.44 O ATOM 0 H ASP A 47 12.270 23.030 -10.424 1.00 42.22 H new ATOM 0 HA ASP A 47 10.886 25.200 -9.122 1.00 11.00 H new ATOM 0 HB2 ASP A 47 12.858 25.075 -10.965 1.00 53.22 H new ATOM 0 HB3 ASP A 47 11.492 25.181 -12.057 1.00 53.22 H new ATOM 737 N VAL A 48 9.403 23.375 -11.416 1.00 60.11 N ATOM 738 CA VAL A 48 8.113 23.069 -12.024 1.00 45.24 C ATOM 739 C VAL A 48 7.221 22.295 -11.059 1.00 11.34 C ATOM 740 O VAL A 48 6.043 22.610 -10.899 1.00 1.53 O ATOM 741 CB VAL A 48 8.281 22.252 -13.318 1.00 14.52 C ATOM 742 CG1 VAL A 48 6.925 21.924 -13.924 1.00 74.34 C ATOM 743 CG2 VAL A 48 9.152 23.004 -14.314 1.00 62.30 C ATOM 0 H VAL A 48 10.149 22.724 -11.660 1.00 60.11 H new ATOM 0 HA VAL A 48 7.643 24.022 -12.265 1.00 45.24 H new ATOM 0 HB VAL A 48 8.778 21.314 -13.072 1.00 14.52 H new ATOM 0 HG11 VAL A 48 7.065 21.346 -14.838 1.00 74.34 H new ATOM 0 HG12 VAL A 48 6.340 21.341 -13.212 1.00 74.34 H new ATOM 0 HG13 VAL A 48 6.397 22.849 -14.157 1.00 74.34 H new ATOM 0 HG21 VAL A 48 9.260 22.412 -15.223 1.00 62.30 H new ATOM 0 HG22 VAL A 48 8.686 23.959 -14.557 1.00 62.30 H new ATOM 0 HG23 VAL A 48 10.135 23.181 -13.877 1.00 62.30 H new ATOM 753 N MET A 49 7.793 21.281 -10.419 1.00 23.51 N ATOM 754 CA MET A 49 7.050 20.462 -9.468 1.00 32.02 C ATOM 755 C MET A 49 6.282 21.335 -8.481 1.00 43.12 C ATOM 756 O MET A 49 5.085 21.143 -8.269 1.00 54.11 O ATOM 757 CB MET A 49 8.000 19.532 -8.711 1.00 51.33 C ATOM 758 CG MET A 49 7.313 18.704 -7.637 1.00 21.11 C ATOM 759 SD MET A 49 8.072 18.906 -6.014 1.00 71.53 S ATOM 760 CE MET A 49 7.303 20.427 -5.466 1.00 52.32 C ATOM 0 H MET A 49 8.768 21.007 -10.541 1.00 23.51 H new ATOM 0 HA MET A 49 6.334 19.861 -10.028 1.00 32.02 H new ATOM 0 HB2 MET A 49 8.482 18.861 -9.422 1.00 51.33 H new ATOM 0 HB3 MET A 49 8.788 20.128 -8.250 1.00 51.33 H new ATOM 0 HG2 MET A 49 6.262 18.989 -7.581 1.00 21.11 H new ATOM 0 HG3 MET A 49 7.343 17.652 -7.920 1.00 21.11 H new ATOM 0 HE1 MET A 49 7.236 20.429 -4.378 1.00 52.32 H new ATOM 0 HE2 MET A 49 7.902 21.276 -5.795 1.00 52.32 H new ATOM 0 HE3 MET A 49 6.302 20.502 -5.891 1.00 52.32 H new ATOM 770 N MET A 50 6.978 22.296 -7.882 1.00 13.33 N ATOM 771 CA MET A 50 6.360 23.200 -6.919 1.00 63.34 C ATOM 772 C MET A 50 5.328 24.094 -7.598 1.00 13.15 C ATOM 773 O MET A 50 4.354 24.516 -6.976 1.00 31.51 O ATOM 774 CB MET A 50 7.427 24.058 -6.236 1.00 63.11 C ATOM 775 CG MET A 50 7.977 25.163 -7.125 1.00 51.43 C ATOM 776 SD MET A 50 9.581 25.768 -6.567 1.00 41.12 S ATOM 777 CE MET A 50 9.349 25.754 -4.791 1.00 52.14 C ATOM 0 H MET A 50 7.970 22.469 -8.046 1.00 13.33 H new ATOM 0 HA MET A 50 5.852 22.598 -6.166 1.00 63.34 H new ATOM 0 HB2 MET A 50 7.003 24.504 -5.336 1.00 63.11 H new ATOM 0 HB3 MET A 50 8.248 23.416 -5.917 1.00 63.11 H new ATOM 0 HG2 MET A 50 8.068 24.792 -8.146 1.00 51.43 H new ATOM 0 HG3 MET A 50 7.269 25.991 -7.149 1.00 51.43 H new ATOM 0 HE1 MET A 50 10.125 26.356 -4.318 1.00 52.14 H new ATOM 0 HE2 MET A 50 8.370 26.168 -4.549 1.00 52.14 H new ATOM 0 HE3 MET A 50 9.411 24.729 -4.424 1.00 52.14 H new ATOM 787 N ASN A 51 5.549 24.380 -8.876 1.00 65.21 N ATOM 788 CA ASN A 51 4.637 25.226 -9.639 1.00 34.45 C ATOM 789 C ASN A 51 3.299 24.525 -9.858 1.00 20.22 C ATOM 790 O ASN A 51 2.308 25.159 -10.222 1.00 30.14 O ATOM 791 CB ASN A 51 5.258 25.595 -10.988 1.00 31.11 C ATOM 792 CG ASN A 51 5.875 26.981 -10.980 1.00 2.32 C ATOM 793 OD1 ASN A 51 5.317 27.918 -10.410 1.00 22.00 O ATOM 794 ND2 ASN A 51 7.033 27.116 -11.615 1.00 22.11 N ATOM 0 H ASN A 51 6.351 24.039 -9.406 1.00 65.21 H new ATOM 0 HA ASN A 51 4.461 26.136 -9.066 1.00 34.45 H new ATOM 0 HB2 ASN A 51 6.022 24.862 -11.246 1.00 31.11 H new ATOM 0 HB3 ASN A 51 4.493 25.545 -11.763 1.00 31.11 H new ATOM 0 HD21 ASN A 51 7.496 28.024 -11.644 1.00 22.11 H new ATOM 0 HD22 ASN A 51 7.460 26.311 -12.074 1.00 22.11 H new ATOM 801 N ILE A 52 3.280 23.216 -9.632 1.00 3.55 N ATOM 802 CA ILE A 52 2.064 22.431 -9.803 1.00 73.42 C ATOM 803 C ILE A 52 1.279 22.343 -8.499 1.00 71.13 C ATOM 804 O ILE A 52 0.046 22.321 -8.504 1.00 32.44 O ATOM 805 CB ILE A 52 2.380 21.005 -10.295 1.00 62.11 C ATOM 806 CG1 ILE A 52 3.320 21.055 -11.500 1.00 74.14 C ATOM 807 CG2 ILE A 52 1.094 20.271 -10.649 1.00 33.12 C ATOM 808 CD1 ILE A 52 3.012 22.181 -12.462 1.00 62.23 C ATOM 0 H ILE A 52 4.092 22.677 -9.330 1.00 3.55 H new ATOM 0 HA ILE A 52 1.461 22.942 -10.554 1.00 73.42 H new ATOM 0 HB ILE A 52 2.878 20.461 -9.493 1.00 62.11 H new ATOM 0 HG12 ILE A 52 4.345 21.161 -11.146 1.00 74.14 H new ATOM 0 HG13 ILE A 52 3.263 20.106 -12.034 1.00 74.14 H new ATOM 0 HG21 ILE A 52 1.333 19.265 -10.995 1.00 33.12 H new ATOM 0 HG22 ILE A 52 0.456 20.210 -9.768 1.00 33.12 H new ATOM 0 HG23 ILE A 52 0.572 20.812 -11.438 1.00 33.12 H new ATOM 0 HD11 ILE A 52 3.719 22.154 -13.292 1.00 62.23 H new ATOM 0 HD12 ILE A 52 1.998 22.065 -12.845 1.00 62.23 H new ATOM 0 HD13 ILE A 52 3.097 23.136 -11.944 1.00 62.23 H new ATOM 820 N LEU A 53 1.997 22.298 -7.383 1.00 51.45 N ATOM 821 CA LEU A 53 1.368 22.215 -6.069 1.00 74.54 C ATOM 822 C LEU A 53 1.035 23.605 -5.538 1.00 34.01 C ATOM 823 O LEU A 53 0.091 23.774 -4.766 1.00 42.22 O ATOM 824 CB LEU A 53 2.286 21.487 -5.087 1.00 74.22 C ATOM 825 CG LEU A 53 1.862 20.070 -4.695 1.00 41.43 C ATOM 826 CD1 LEU A 53 1.499 19.261 -5.931 1.00 53.22 C ATOM 827 CD2 LEU A 53 2.967 19.381 -3.908 1.00 13.23 C ATOM 0 H LEU A 53 3.017 22.318 -7.361 1.00 51.45 H new ATOM 0 HA LEU A 53 0.440 21.653 -6.172 1.00 74.54 H new ATOM 0 HB2 LEU A 53 3.284 21.439 -5.522 1.00 74.22 H new ATOM 0 HB3 LEU A 53 2.362 22.086 -4.180 1.00 74.22 H new ATOM 0 HG LEU A 53 0.980 20.138 -4.059 1.00 41.43 H new ATOM 0 HD11 LEU A 53 1.200 18.256 -5.633 1.00 53.22 H new ATOM 0 HD12 LEU A 53 0.674 19.745 -6.453 1.00 53.22 H new ATOM 0 HD13 LEU A 53 2.363 19.201 -6.593 1.00 53.22 H new ATOM 0 HD21 LEU A 53 2.648 18.374 -3.638 1.00 13.23 H new ATOM 0 HD22 LEU A 53 3.868 19.324 -4.519 1.00 13.23 H new ATOM 0 HD23 LEU A 53 3.178 19.950 -3.003 1.00 13.23 H new ATOM 839 N GLN A 54 1.815 24.596 -5.957 1.00 35.22 N ATOM 840 CA GLN A 54 1.601 25.972 -5.523 1.00 5.24 C ATOM 841 C GLN A 54 0.219 26.465 -5.938 1.00 40.02 C ATOM 842 O GLN A 54 -0.309 27.418 -5.365 1.00 11.30 O ATOM 843 CB GLN A 54 2.679 26.887 -6.108 1.00 13.40 C ATOM 844 CG GLN A 54 2.519 27.137 -7.600 1.00 75.21 C ATOM 845 CD GLN A 54 3.469 28.200 -8.117 1.00 20.35 C ATOM 846 OE1 GLN A 54 3.078 29.075 -8.889 1.00 45.45 O ATOM 847 NE2 GLN A 54 4.726 28.128 -7.694 1.00 73.44 N ATOM 0 H GLN A 54 2.600 24.472 -6.596 1.00 35.22 H new ATOM 0 HA GLN A 54 1.664 25.997 -4.435 1.00 5.24 H new ATOM 0 HB2 GLN A 54 2.657 27.842 -5.583 1.00 13.40 H new ATOM 0 HB3 GLN A 54 3.658 26.445 -5.925 1.00 13.40 H new ATOM 0 HG2 GLN A 54 2.691 26.207 -8.141 1.00 75.21 H new ATOM 0 HG3 GLN A 54 1.493 27.441 -7.806 1.00 75.21 H new ATOM 0 HE21 GLN A 54 5.007 27.385 -7.054 1.00 73.44 H new ATOM 0 HE22 GLN A 54 5.410 28.815 -8.009 1.00 73.44 H new ATOM 856 N THR A 55 -0.362 25.809 -6.938 1.00 23.53 N ATOM 857 CA THR A 55 -1.683 26.182 -7.429 1.00 24.25 C ATOM 858 C THR A 55 -2.707 26.195 -6.301 1.00 71.25 C ATOM 859 O THR A 55 -2.560 25.508 -5.289 1.00 30.33 O ATOM 860 CB THR A 55 -2.163 25.219 -8.532 1.00 54.30 C ATOM 861 OG1 THR A 55 -2.035 23.864 -8.088 1.00 42.52 O ATOM 862 CG2 THR A 55 -1.363 25.418 -9.811 1.00 51.14 C ATOM 0 H THR A 55 0.061 25.018 -7.423 1.00 23.53 H new ATOM 0 HA THR A 55 -1.594 27.186 -7.845 1.00 24.25 H new ATOM 0 HB THR A 55 -3.211 25.435 -8.742 1.00 54.30 H new ATOM 0 HG1 THR A 55 -1.154 23.518 -8.342 1.00 42.52 H new ATOM 0 HG21 THR A 55 -1.720 24.727 -10.575 1.00 51.14 H new ATOM 0 HG22 THR A 55 -1.487 26.443 -10.162 1.00 51.14 H new ATOM 0 HG23 THR A 55 -0.308 25.227 -9.614 1.00 51.14 H new ATOM 870 N PRO A 56 -3.770 26.994 -6.475 1.00 53.52 N ATOM 871 CA PRO A 56 -4.841 27.114 -5.480 1.00 12.33 C ATOM 872 C PRO A 56 -5.685 25.848 -5.381 1.00 31.34 C ATOM 873 O PRO A 56 -6.243 25.546 -4.327 1.00 43.31 O ATOM 874 CB PRO A 56 -5.684 28.279 -6.006 1.00 41.51 C ATOM 875 CG PRO A 56 -5.431 28.296 -7.474 1.00 31.12 C ATOM 876 CD PRO A 56 -4.010 27.840 -7.656 1.00 2.04 C ATOM 0 HA PRO A 56 -4.449 27.273 -4.476 1.00 12.33 H new ATOM 0 HB2 PRO A 56 -6.742 28.132 -5.788 1.00 41.51 H new ATOM 0 HB3 PRO A 56 -5.391 29.221 -5.543 1.00 41.51 H new ATOM 0 HG2 PRO A 56 -6.123 27.635 -7.997 1.00 31.12 H new ATOM 0 HG3 PRO A 56 -5.575 29.296 -7.883 1.00 31.12 H new ATOM 0 HD2 PRO A 56 -3.883 27.281 -8.583 1.00 2.04 H new ATOM 0 HD3 PRO A 56 -3.319 28.682 -7.694 1.00 2.04 H new ATOM 884 N GLN A 57 -5.772 25.112 -6.484 1.00 54.13 N ATOM 885 CA GLN A 57 -6.549 23.879 -6.520 1.00 35.45 C ATOM 886 C GLN A 57 -5.787 22.737 -5.855 1.00 15.23 C ATOM 887 O GLN A 57 -6.384 21.862 -5.227 1.00 55.15 O ATOM 888 CB GLN A 57 -6.891 23.508 -7.964 1.00 31.22 C ATOM 889 CG GLN A 57 -5.710 22.950 -8.744 1.00 70.00 C ATOM 890 CD GLN A 57 -5.891 23.077 -10.245 1.00 22.24 C ATOM 891 OE1 GLN A 57 -4.972 23.475 -10.960 1.00 74.05 O ATOM 892 NE2 GLN A 57 -7.080 22.738 -10.729 1.00 50.03 N ATOM 0 H GLN A 57 -5.314 25.348 -7.364 1.00 54.13 H new ATOM 0 HA GLN A 57 -7.474 24.045 -5.967 1.00 35.45 H new ATOM 0 HB2 GLN A 57 -7.695 22.771 -7.961 1.00 31.22 H new ATOM 0 HB3 GLN A 57 -7.270 24.391 -8.477 1.00 31.22 H new ATOM 0 HG2 GLN A 57 -4.802 23.474 -8.445 1.00 70.00 H new ATOM 0 HG3 GLN A 57 -5.572 21.900 -8.486 1.00 70.00 H new ATOM 0 HE21 GLN A 57 -7.813 22.413 -10.099 1.00 50.03 H new ATOM 0 HE22 GLN A 57 -7.260 22.803 -11.731 1.00 50.03 H new ATOM 901 N PHE A 58 -4.466 22.750 -5.999 1.00 44.33 N ATOM 902 CA PHE A 58 -3.623 21.715 -5.414 1.00 12.11 C ATOM 903 C PHE A 58 -2.826 22.265 -4.234 1.00 32.20 C ATOM 904 O PHE A 58 -1.642 21.967 -4.076 1.00 14.11 O ATOM 905 CB PHE A 58 -2.670 21.147 -6.468 1.00 65.32 C ATOM 906 CG PHE A 58 -3.374 20.519 -7.637 1.00 64.12 C ATOM 907 CD1 PHE A 58 -4.211 19.429 -7.454 1.00 54.23 C ATOM 908 CD2 PHE A 58 -3.200 21.018 -8.917 1.00 14.53 C ATOM 909 CE1 PHE A 58 -4.861 18.850 -8.527 1.00 13.32 C ATOM 910 CE2 PHE A 58 -3.848 20.443 -9.993 1.00 51.05 C ATOM 911 CZ PHE A 58 -4.677 19.356 -9.799 1.00 14.14 C ATOM 0 H PHE A 58 -3.956 23.466 -6.516 1.00 44.33 H new ATOM 0 HA PHE A 58 -4.270 20.916 -5.052 1.00 12.11 H new ATOM 0 HB2 PHE A 58 -2.024 21.946 -6.830 1.00 65.32 H new ATOM 0 HB3 PHE A 58 -2.025 20.403 -6.000 1.00 65.32 H new ATOM 0 HD1 PHE A 58 -4.357 19.028 -6.462 1.00 54.23 H new ATOM 0 HD2 PHE A 58 -2.550 21.866 -9.076 1.00 14.53 H new ATOM 0 HE1 PHE A 58 -5.512 18.003 -8.371 1.00 13.32 H new ATOM 0 HE2 PHE A 58 -3.706 20.844 -10.986 1.00 51.05 H new ATOM 0 HZ PHE A 58 -5.180 18.902 -10.640 1.00 14.14 H new ATOM 921 N THR A 59 -3.484 23.073 -3.408 1.00 4.20 N ATOM 922 CA THR A 59 -2.838 23.666 -2.244 1.00 22.31 C ATOM 923 C THR A 59 -2.916 22.737 -1.038 1.00 21.11 C ATOM 924 O THR A 59 -1.975 22.644 -0.251 1.00 21.14 O ATOM 925 CB THR A 59 -3.475 25.020 -1.878 1.00 62.34 C ATOM 926 OG1 THR A 59 -2.791 25.595 -0.759 1.00 4.22 O ATOM 927 CG2 THR A 59 -4.950 24.853 -1.548 1.00 32.12 C ATOM 0 H THR A 59 -4.464 23.331 -3.524 1.00 4.20 H new ATOM 0 HA THR A 59 -1.793 23.824 -2.509 1.00 22.31 H new ATOM 0 HB THR A 59 -3.386 25.684 -2.738 1.00 62.34 H new ATOM 0 HG1 THR A 59 -3.200 26.456 -0.533 1.00 4.22 H new ATOM 0 HG21 THR A 59 -5.378 25.823 -1.293 1.00 32.12 H new ATOM 0 HG22 THR A 59 -5.472 24.442 -2.412 1.00 32.12 H new ATOM 0 HG23 THR A 59 -5.059 24.174 -0.702 1.00 32.12 H new ATOM 935 N LYS A 60 -4.046 22.052 -0.897 1.00 35.52 N ATOM 936 CA LYS A 60 -4.248 21.128 0.212 1.00 52.53 C ATOM 937 C LYS A 60 -3.404 19.870 0.034 1.00 41.24 C ATOM 938 O LYS A 60 -3.174 19.126 0.986 1.00 22.22 O ATOM 939 CB LYS A 60 -5.727 20.752 0.326 1.00 75.42 C ATOM 940 CG LYS A 60 -6.312 20.191 -0.959 1.00 41.34 C ATOM 941 CD LYS A 60 -7.779 19.829 -0.792 1.00 60.34 C ATOM 942 CE LYS A 60 -8.606 20.294 -1.981 1.00 4.52 C ATOM 943 NZ LYS A 60 -9.953 19.656 -2.002 1.00 64.02 N ATOM 0 H LYS A 60 -4.837 22.120 -1.538 1.00 35.52 H new ATOM 0 HA LYS A 60 -3.934 21.627 1.129 1.00 52.53 H new ATOM 0 HB2 LYS A 60 -5.846 20.016 1.121 1.00 75.42 H new ATOM 0 HB3 LYS A 60 -6.296 21.634 0.620 1.00 75.42 H new ATOM 0 HG2 LYS A 60 -6.206 20.924 -1.759 1.00 41.34 H new ATOM 0 HG3 LYS A 60 -5.750 19.307 -1.260 1.00 41.34 H new ATOM 0 HD2 LYS A 60 -7.878 18.749 -0.678 1.00 60.34 H new ATOM 0 HD3 LYS A 60 -8.165 20.282 0.121 1.00 60.34 H new ATOM 0 HE2 LYS A 60 -8.718 21.378 -1.944 1.00 4.52 H new ATOM 0 HE3 LYS A 60 -8.078 20.059 -2.905 1.00 4.52 H new ATOM 0 HZ1 LYS A 60 -10.586 20.202 -2.621 1.00 64.02 H new ATOM 0 HZ2 LYS A 60 -9.871 18.684 -2.362 1.00 64.02 H new ATOM 0 HZ3 LYS A 60 -10.343 19.636 -1.038 1.00 64.02 H new ATOM 957 N TYR A 61 -2.945 19.641 -1.192 1.00 14.05 N ATOM 958 CA TYR A 61 -2.127 18.473 -1.494 1.00 71.14 C ATOM 959 C TYR A 61 -0.672 18.871 -1.721 1.00 30.13 C ATOM 960 O TYR A 61 -0.118 18.658 -2.800 1.00 60.54 O ATOM 961 CB TYR A 61 -2.669 17.751 -2.730 1.00 71.25 C ATOM 962 CG TYR A 61 -4.178 17.706 -2.791 1.00 2.03 C ATOM 963 CD1 TYR A 61 -4.905 16.915 -1.910 1.00 2.40 C ATOM 964 CD2 TYR A 61 -4.878 18.453 -3.730 1.00 71.04 C ATOM 965 CE1 TYR A 61 -6.285 16.869 -1.962 1.00 73.23 C ATOM 966 CE2 TYR A 61 -6.258 18.414 -3.788 1.00 44.31 C ATOM 967 CZ TYR A 61 -6.957 17.621 -2.903 1.00 4.15 C ATOM 968 OH TYR A 61 -8.331 17.579 -2.959 1.00 1.43 O ATOM 0 H TYR A 61 -3.126 20.248 -1.991 1.00 14.05 H new ATOM 0 HA TYR A 61 -2.171 17.799 -0.639 1.00 71.14 H new ATOM 0 HB2 TYR A 61 -2.292 18.247 -3.625 1.00 71.25 H new ATOM 0 HB3 TYR A 61 -2.283 16.732 -2.744 1.00 71.25 H new ATOM 0 HD1 TYR A 61 -4.382 16.326 -1.171 1.00 2.40 H new ATOM 0 HD2 TYR A 61 -4.335 19.075 -4.426 1.00 71.04 H new ATOM 0 HE1 TYR A 61 -6.834 16.248 -1.270 1.00 73.23 H new ATOM 0 HE2 TYR A 61 -6.787 19.002 -4.523 1.00 44.31 H new ATOM 0 HH TYR A 61 -8.680 17.174 -2.138 1.00 1.43 H new ATOM 978 N THR A 62 -0.056 19.449 -0.695 1.00 71.44 N ATOM 979 CA THR A 62 1.334 19.879 -0.780 1.00 10.10 C ATOM 980 C THR A 62 2.271 18.825 -0.199 1.00 71.52 C ATOM 981 O THR A 62 3.037 18.192 -0.927 1.00 70.23 O ATOM 982 CB THR A 62 1.558 21.211 -0.042 1.00 54.41 C ATOM 983 OG1 THR A 62 0.319 21.684 0.500 1.00 54.14 O ATOM 984 CG2 THR A 62 2.140 22.259 -0.979 1.00 32.11 C ATOM 0 H THR A 62 -0.499 19.630 0.206 1.00 71.44 H new ATOM 0 HA THR A 62 1.557 20.018 -1.838 1.00 10.10 H new ATOM 0 HB THR A 62 2.267 21.038 0.768 1.00 54.41 H new ATOM 0 HG1 THR A 62 -0.280 21.944 -0.231 1.00 54.14 H new ATOM 0 HG21 THR A 62 2.289 23.191 -0.434 1.00 32.11 H new ATOM 0 HG22 THR A 62 3.096 21.909 -1.368 1.00 32.11 H new ATOM 0 HG23 THR A 62 1.452 22.429 -1.807 1.00 32.11 H new ATOM 992 N LEU A 63 2.205 18.642 1.115 1.00 70.40 N ATOM 993 CA LEU A 63 3.047 17.664 1.794 1.00 22.45 C ATOM 994 C LEU A 63 2.235 16.444 2.214 1.00 21.32 C ATOM 995 O LEU A 63 2.769 15.500 2.797 1.00 24.35 O ATOM 996 CB LEU A 63 3.710 18.296 3.020 1.00 14.53 C ATOM 997 CG LEU A 63 2.937 18.182 4.334 1.00 33.33 C ATOM 998 CD1 LEU A 63 3.464 17.022 5.165 1.00 44.54 C ATOM 999 CD2 LEU A 63 3.024 19.484 5.118 1.00 34.14 C ATOM 0 H LEU A 63 1.577 19.158 1.731 1.00 70.40 H new ATOM 0 HA LEU A 63 3.820 17.340 1.097 1.00 22.45 H new ATOM 0 HB2 LEU A 63 4.689 17.836 3.156 1.00 14.53 H new ATOM 0 HB3 LEU A 63 3.880 19.352 2.812 1.00 14.53 H new ATOM 0 HG LEU A 63 1.890 17.989 4.102 1.00 33.33 H new ATOM 0 HD11 LEU A 63 2.902 16.957 6.096 1.00 44.54 H new ATOM 0 HD12 LEU A 63 3.350 16.093 4.606 1.00 44.54 H new ATOM 0 HD13 LEU A 63 4.518 17.184 5.388 1.00 44.54 H new ATOM 0 HD21 LEU A 63 2.468 19.385 6.050 1.00 34.14 H new ATOM 0 HD22 LEU A 63 4.068 19.706 5.340 1.00 34.14 H new ATOM 0 HD23 LEU A 63 2.598 20.294 4.526 1.00 34.14 H new ATOM 1011 N TRP A 64 0.942 16.469 1.914 1.00 4.53 N ATOM 1012 CA TRP A 64 0.056 15.362 2.257 1.00 50.12 C ATOM 1013 C TRP A 64 0.625 14.035 1.768 1.00 52.11 C ATOM 1014 O TRP A 64 0.324 12.978 2.321 1.00 52.14 O ATOM 1015 CB TRP A 64 -1.333 15.588 1.656 1.00 45.11 C ATOM 1016 CG TRP A 64 -1.557 14.834 0.381 1.00 5.32 C ATOM 1017 CD1 TRP A 64 -2.426 13.798 0.183 1.00 25.31 C ATOM 1018 CD2 TRP A 64 -0.902 15.056 -0.872 1.00 40.31 C ATOM 1019 NE1 TRP A 64 -2.349 13.363 -1.118 1.00 23.33 N ATOM 1020 CE2 TRP A 64 -1.423 14.118 -1.786 1.00 24.22 C ATOM 1021 CE3 TRP A 64 0.072 15.956 -1.312 1.00 53.41 C ATOM 1022 CZ2 TRP A 64 -1.000 14.057 -3.111 1.00 70.32 C ATOM 1023 CZ3 TRP A 64 0.491 15.893 -2.628 1.00 55.11 C ATOM 1024 CH2 TRP A 64 -0.044 14.949 -3.515 1.00 13.15 C ATOM 0 H TRP A 64 0.483 17.243 1.434 1.00 4.53 H new ATOM 0 HA TRP A 64 -0.027 15.321 3.343 1.00 50.12 H new ATOM 0 HB2 TRP A 64 -2.089 15.291 2.383 1.00 45.11 H new ATOM 0 HB3 TRP A 64 -1.472 16.653 1.469 1.00 45.11 H new ATOM 0 HD1 TRP A 64 -3.077 13.383 0.938 1.00 25.31 H new ATOM 0 HE1 TRP A 64 -2.894 12.601 -1.521 1.00 23.33 H new ATOM 0 HE3 TRP A 64 0.490 16.688 -0.636 1.00 53.41 H new ATOM 0 HZ2 TRP A 64 -1.412 13.331 -3.796 1.00 70.32 H new ATOM 0 HZ3 TRP A 64 1.244 16.583 -2.979 1.00 55.11 H new ATOM 0 HH2 TRP A 64 0.305 14.925 -4.537 1.00 13.15 H new ATOM 1035 N PHE A 65 1.450 14.098 0.728 1.00 21.42 N ATOM 1036 CA PHE A 65 2.062 12.901 0.164 1.00 54.41 C ATOM 1037 C PHE A 65 3.584 13.006 0.185 1.00 55.14 C ATOM 1038 O PHE A 65 4.285 12.002 0.303 1.00 43.01 O ATOM 1039 CB PHE A 65 1.574 12.680 -1.269 1.00 0.51 C ATOM 1040 CG PHE A 65 0.616 11.532 -1.405 1.00 35.13 C ATOM 1041 CD1 PHE A 65 -0.335 11.286 -0.428 1.00 1.23 C ATOM 1042 CD2 PHE A 65 0.666 10.697 -2.510 1.00 72.04 C ATOM 1043 CE1 PHE A 65 -1.219 10.229 -0.550 1.00 74.41 C ATOM 1044 CE2 PHE A 65 -0.215 9.640 -2.638 1.00 63.43 C ATOM 1045 CZ PHE A 65 -1.158 9.406 -1.657 1.00 12.20 C ATOM 0 H PHE A 65 1.710 14.966 0.259 1.00 21.42 H new ATOM 0 HA PHE A 65 1.766 12.049 0.777 1.00 54.41 H new ATOM 0 HB2 PHE A 65 1.091 13.590 -1.624 1.00 0.51 H new ATOM 0 HB3 PHE A 65 2.435 12.503 -1.914 1.00 0.51 H new ATOM 0 HD1 PHE A 65 -0.387 11.927 0.439 1.00 1.23 H new ATOM 0 HD2 PHE A 65 1.402 10.874 -3.280 1.00 72.04 H new ATOM 0 HE1 PHE A 65 -1.955 10.048 0.219 1.00 74.41 H new ATOM 0 HE2 PHE A 65 -0.166 8.997 -3.505 1.00 63.43 H new ATOM 0 HZ PHE A 65 -1.847 8.580 -1.755 1.00 12.20 H new ATOM 1055 N MET A 66 4.088 14.230 0.068 1.00 21.31 N ATOM 1056 CA MET A 66 5.527 14.468 0.074 1.00 54.24 C ATOM 1057 C MET A 66 6.185 13.795 1.274 1.00 62.12 C ATOM 1058 O MET A 66 7.331 13.352 1.200 1.00 43.23 O ATOM 1059 CB MET A 66 5.817 15.970 0.095 1.00 0.42 C ATOM 1060 CG MET A 66 7.027 16.366 -0.737 1.00 60.21 C ATOM 1061 SD MET A 66 8.162 17.445 0.159 1.00 74.33 S ATOM 1062 CE MET A 66 8.885 16.286 1.318 1.00 12.21 C ATOM 0 H MET A 66 3.522 15.072 -0.032 1.00 21.31 H new ATOM 0 HA MET A 66 5.945 14.037 -0.836 1.00 54.24 H new ATOM 0 HB2 MET A 66 4.942 16.506 -0.273 1.00 0.42 H new ATOM 0 HB3 MET A 66 5.975 16.287 1.126 1.00 0.42 H new ATOM 0 HG2 MET A 66 7.558 15.467 -1.051 1.00 60.21 H new ATOM 0 HG3 MET A 66 6.691 16.870 -1.643 1.00 60.21 H new ATOM 0 HE1 MET A 66 8.562 16.533 2.329 1.00 12.21 H new ATOM 0 HE2 MET A 66 8.562 15.275 1.071 1.00 12.21 H new ATOM 0 HE3 MET A 66 9.972 16.344 1.260 1.00 12.21 H new ATOM 1072 N THR A 67 5.451 13.721 2.381 1.00 35.53 N ATOM 1073 CA THR A 67 5.964 13.103 3.597 1.00 25.30 C ATOM 1074 C THR A 67 4.911 12.212 4.248 1.00 54.02 C ATOM 1075 O THR A 67 5.022 11.859 5.421 1.00 4.44 O ATOM 1076 CB THR A 67 6.422 14.163 4.616 1.00 34.44 C ATOM 1077 OG1 THR A 67 7.080 15.240 3.939 1.00 54.41 O ATOM 1078 CG2 THR A 67 7.364 13.555 5.644 1.00 3.14 C ATOM 0 H THR A 67 4.500 14.081 2.460 1.00 35.53 H new ATOM 0 HA THR A 67 6.821 12.496 3.305 1.00 25.30 H new ATOM 0 HB THR A 67 5.541 14.542 5.133 1.00 34.44 H new ATOM 0 HG1 THR A 67 7.367 15.911 4.593 1.00 54.41 H new ATOM 0 HG21 THR A 67 7.674 14.323 6.353 1.00 3.14 H new ATOM 0 HG22 THR A 67 6.852 12.754 6.178 1.00 3.14 H new ATOM 0 HG23 THR A 67 8.242 13.152 5.139 1.00 3.14 H new ATOM 1086 N ASN A 68 3.890 11.851 3.477 1.00 30.33 N ATOM 1087 CA ASN A 68 2.817 11.001 3.978 1.00 74.32 C ATOM 1088 C ASN A 68 2.245 11.558 5.278 1.00 52.13 C ATOM 1089 O ASN A 68 2.015 10.817 6.234 1.00 64.53 O ATOM 1090 CB ASN A 68 3.329 9.577 4.202 1.00 33.53 C ATOM 1091 CG ASN A 68 4.335 9.153 3.150 1.00 60.54 C ATOM 1092 OD1 ASN A 68 5.545 9.230 3.364 1.00 41.20 O ATOM 1093 ND2 ASN A 68 3.838 8.701 2.004 1.00 22.32 N ATOM 0 H ASN A 68 3.784 12.134 2.503 1.00 30.33 H new ATOM 0 HA ASN A 68 2.023 10.981 3.231 1.00 74.32 H new ATOM 0 HB2 ASN A 68 3.788 9.510 5.188 1.00 33.53 H new ATOM 0 HB3 ASN A 68 2.487 8.885 4.195 1.00 33.53 H new ATOM 0 HD21 ASN A 68 4.466 8.401 1.259 1.00 22.32 H new ATOM 0 HD22 ASN A 68 2.828 8.654 1.869 1.00 22.32 H new ATOM 1100 N GLN A 69 2.017 12.867 5.306 1.00 44.34 N ATOM 1101 CA GLN A 69 1.471 13.523 6.488 1.00 22.34 C ATOM 1102 C GLN A 69 0.402 14.539 6.103 1.00 11.24 C ATOM 1103 O GLN A 69 0.700 15.570 5.501 1.00 12.43 O ATOM 1104 CB GLN A 69 2.587 14.213 7.275 1.00 24.40 C ATOM 1105 CG GLN A 69 2.102 14.904 8.539 1.00 53.41 C ATOM 1106 CD GLN A 69 1.967 13.952 9.711 1.00 3.24 C ATOM 1107 OE1 GLN A 69 2.961 13.448 10.235 1.00 30.13 O ATOM 1108 NE2 GLN A 69 0.731 13.700 10.129 1.00 3.22 N ATOM 0 H GLN A 69 2.202 13.494 4.523 1.00 44.34 H new ATOM 0 HA GLN A 69 1.011 12.760 7.116 1.00 22.34 H new ATOM 0 HB2 GLN A 69 3.343 13.474 7.542 1.00 24.40 H new ATOM 0 HB3 GLN A 69 3.073 14.948 6.633 1.00 24.40 H new ATOM 0 HG2 GLN A 69 2.797 15.701 8.802 1.00 53.41 H new ATOM 0 HG3 GLN A 69 1.138 15.373 8.344 1.00 53.41 H new ATOM 0 HE21 GLN A 69 -0.064 14.140 9.665 1.00 3.22 H new ATOM 0 HE22 GLN A 69 0.577 13.067 10.914 1.00 3.22 H new ATOM 1117 N ILE A 70 -0.844 14.241 6.455 1.00 53.02 N ATOM 1118 CA ILE A 70 -1.959 15.129 6.146 1.00 1.12 C ATOM 1119 C ILE A 70 -2.094 16.225 7.197 1.00 5.32 C ATOM 1120 O ILE A 70 -2.176 15.946 8.392 1.00 35.42 O ATOM 1121 CB ILE A 70 -3.286 14.355 6.052 1.00 22.12 C ATOM 1122 CG1 ILE A 70 -3.529 13.557 7.335 1.00 23.30 C ATOM 1123 CG2 ILE A 70 -3.277 13.432 4.843 1.00 74.23 C ATOM 1124 CD1 ILE A 70 -4.727 14.034 8.125 1.00 41.24 C ATOM 0 H ILE A 70 -1.107 13.392 6.954 1.00 53.02 H new ATOM 0 HA ILE A 70 -1.744 15.582 5.178 1.00 1.12 H new ATOM 0 HB ILE A 70 -4.099 15.071 5.932 1.00 22.12 H new ATOM 0 HG12 ILE A 70 -3.667 12.507 7.079 1.00 23.30 H new ATOM 0 HG13 ILE A 70 -2.641 13.617 7.965 1.00 23.30 H new ATOM 0 HG21 ILE A 70 -4.222 12.892 4.791 1.00 74.23 H new ATOM 0 HG22 ILE A 70 -3.145 14.022 3.936 1.00 74.23 H new ATOM 0 HG23 ILE A 70 -2.457 12.720 4.935 1.00 74.23 H new ATOM 0 HD11 ILE A 70 -4.839 13.423 9.021 1.00 41.24 H new ATOM 0 HD12 ILE A 70 -4.582 15.076 8.412 1.00 41.24 H new ATOM 0 HD13 ILE A 70 -5.625 13.947 7.513 1.00 41.24 H new ATOM 1136 N ALA A 71 -2.121 17.474 6.742 1.00 53.21 N ATOM 1137 CA ALA A 71 -2.251 18.612 7.642 1.00 71.32 C ATOM 1138 C ALA A 71 -3.592 19.313 7.450 1.00 23.44 C ATOM 1139 O ALA A 71 -3.679 20.381 6.843 1.00 55.01 O ATOM 1140 CB ALA A 71 -1.106 19.590 7.426 1.00 72.44 C ATOM 0 H ALA A 71 -2.054 17.722 5.755 1.00 53.21 H new ATOM 0 HA ALA A 71 -2.208 18.241 8.666 1.00 71.32 H new ATOM 0 HB1 ALA A 71 -1.216 20.435 8.105 1.00 72.44 H new ATOM 0 HB2 ALA A 71 -0.158 19.089 7.621 1.00 72.44 H new ATOM 0 HB3 ALA A 71 -1.122 19.948 6.396 1.00 72.44 H new ATOM 1146 N PRO A 72 -4.663 18.700 7.976 1.00 32.32 N ATOM 1147 CA PRO A 72 -6.018 19.248 7.874 1.00 40.23 C ATOM 1148 C PRO A 72 -6.200 20.505 8.718 1.00 33.14 C ATOM 1149 O PRO A 72 -7.166 21.247 8.542 1.00 11.03 O ATOM 1150 CB PRO A 72 -6.900 18.115 8.405 1.00 14.40 C ATOM 1151 CG PRO A 72 -6.009 17.334 9.308 1.00 21.53 C ATOM 1152 CD PRO A 72 -4.632 17.425 8.712 1.00 55.43 C ATOM 0 HA PRO A 72 -6.259 19.552 6.855 1.00 40.23 H new ATOM 0 HB2 PRO A 72 -7.765 18.505 8.942 1.00 14.40 H new ATOM 0 HB3 PRO A 72 -7.281 17.496 7.593 1.00 14.40 H new ATOM 0 HG2 PRO A 72 -6.024 17.741 10.319 1.00 21.53 H new ATOM 0 HG3 PRO A 72 -6.336 16.297 9.377 1.00 21.53 H new ATOM 0 HD2 PRO A 72 -3.860 17.424 9.482 1.00 55.43 H new ATOM 0 HD3 PRO A 72 -4.424 16.584 8.051 1.00 55.43 H new ATOM 1160 N GLU A 73 -5.265 20.738 9.634 1.00 23.32 N ATOM 1161 CA GLU A 73 -5.324 21.906 10.506 1.00 5.13 C ATOM 1162 C GLU A 73 -5.504 23.183 9.691 1.00 20.24 C ATOM 1163 O GLU A 73 -6.102 24.152 10.159 1.00 42.23 O ATOM 1164 CB GLU A 73 -4.053 22.002 11.353 1.00 31.42 C ATOM 1165 CG GLU A 73 -3.865 20.831 12.302 1.00 1.34 C ATOM 1166 CD GLU A 73 -4.835 20.862 13.466 1.00 12.40 C ATOM 1167 OE1 GLU A 73 -5.283 21.967 13.837 1.00 62.13 O ATOM 1168 OE2 GLU A 73 -5.148 19.780 14.008 1.00 50.44 O ATOM 0 H GLU A 73 -4.458 20.134 9.792 1.00 23.32 H new ATOM 0 HA GLU A 73 -6.184 21.793 11.167 1.00 5.13 H new ATOM 0 HB2 GLU A 73 -3.189 22.065 10.691 1.00 31.42 H new ATOM 0 HB3 GLU A 73 -4.080 22.926 11.930 1.00 31.42 H new ATOM 0 HG2 GLU A 73 -3.993 19.899 11.752 1.00 1.34 H new ATOM 0 HG3 GLU A 73 -2.844 20.838 12.684 1.00 1.34 H new ATOM 1175 N SER A 74 -4.979 23.178 8.470 1.00 3.44 N ATOM 1176 CA SER A 74 -5.077 24.338 7.590 1.00 51.31 C ATOM 1177 C SER A 74 -5.940 24.024 6.371 1.00 0.10 C ATOM 1178 O SER A 74 -6.374 24.926 5.656 1.00 72.23 O ATOM 1179 CB SER A 74 -3.684 24.784 7.142 1.00 74.54 C ATOM 1180 OG SER A 74 -2.965 25.366 8.216 1.00 24.41 O ATOM 0 H SER A 74 -4.481 22.384 8.067 1.00 3.44 H new ATOM 0 HA SER A 74 -5.548 25.148 8.148 1.00 51.31 H new ATOM 0 HB2 SER A 74 -3.133 23.928 6.752 1.00 74.54 H new ATOM 0 HB3 SER A 74 -3.773 25.503 6.328 1.00 74.54 H new ATOM 0 HG SER A 74 -2.147 25.783 7.874 1.00 24.41 H new ATOM 1186 N GLY A 75 -6.185 22.738 6.142 1.00 44.22 N ATOM 1187 CA GLY A 75 -6.995 22.327 5.010 1.00 41.33 C ATOM 1188 C GLY A 75 -6.274 21.343 4.109 1.00 61.32 C ATOM 1189 O GLY A 75 -6.755 21.020 3.023 1.00 21.02 O ATOM 0 H GLY A 75 -5.837 21.973 6.720 1.00 44.22 H new ATOM 0 HA2 GLY A 75 -7.918 21.874 5.373 1.00 41.33 H new ATOM 0 HA3 GLY A 75 -7.277 23.206 4.431 1.00 41.33 H new ATOM 1193 N GLN A 76 -5.118 20.866 4.561 1.00 43.44 N ATOM 1194 CA GLN A 76 -4.330 19.915 3.787 1.00 71.34 C ATOM 1195 C GLN A 76 -4.753 18.482 4.090 1.00 22.20 C ATOM 1196 O GLN A 76 -4.553 17.987 5.200 1.00 15.14 O ATOM 1197 CB GLN A 76 -2.840 20.093 4.085 1.00 1.44 C ATOM 1198 CG GLN A 76 -2.445 21.532 4.376 1.00 0.22 C ATOM 1199 CD GLN A 76 -2.791 22.474 3.239 1.00 70.30 C ATOM 1200 OE1 GLN A 76 -3.950 22.845 3.056 1.00 4.14 O ATOM 1201 NE2 GLN A 76 -1.783 22.866 2.467 1.00 55.24 N ATOM 0 H GLN A 76 -4.707 21.123 5.459 1.00 43.44 H new ATOM 0 HA GLN A 76 -4.508 20.111 2.730 1.00 71.34 H new ATOM 0 HB2 GLN A 76 -2.572 19.472 4.940 1.00 1.44 H new ATOM 0 HB3 GLN A 76 -2.262 19.731 3.234 1.00 1.44 H new ATOM 0 HG2 GLN A 76 -2.946 21.866 5.284 1.00 0.22 H new ATOM 0 HG3 GLN A 76 -1.373 21.579 4.568 1.00 0.22 H new ATOM 0 HE21 GLN A 76 -0.837 22.533 2.655 1.00 55.24 H new ATOM 0 HE22 GLN A 76 -1.955 23.499 1.686 1.00 55.24 H new ATOM 1210 N ILE A 77 -5.340 17.820 3.098 1.00 35.21 N ATOM 1211 CA ILE A 77 -5.791 16.444 3.260 1.00 50.55 C ATOM 1212 C ILE A 77 -5.599 15.648 1.973 1.00 25.22 C ATOM 1213 O ILE A 77 -5.209 16.197 0.944 1.00 5.00 O ATOM 1214 CB ILE A 77 -7.274 16.382 3.672 1.00 45.42 C ATOM 1215 CG1 ILE A 77 -8.174 16.608 2.455 1.00 11.52 C ATOM 1216 CG2 ILE A 77 -7.567 17.413 4.753 1.00 62.31 C ATOM 1217 CD1 ILE A 77 -7.937 17.933 1.766 1.00 65.21 C ATOM 0 H ILE A 77 -5.514 18.215 2.174 1.00 35.21 H new ATOM 0 HA ILE A 77 -5.184 16.004 4.051 1.00 50.55 H new ATOM 0 HB ILE A 77 -7.483 15.391 4.076 1.00 45.42 H new ATOM 0 HG12 ILE A 77 -8.013 15.802 1.739 1.00 11.52 H new ATOM 0 HG13 ILE A 77 -9.216 16.552 2.769 1.00 11.52 H new ATOM 0 HG21 ILE A 77 -8.619 17.357 5.034 1.00 62.31 H new ATOM 0 HG22 ILE A 77 -6.947 17.211 5.626 1.00 62.31 H new ATOM 0 HG23 ILE A 77 -7.345 18.411 4.374 1.00 62.31 H new ATOM 0 HD11 ILE A 77 -8.609 18.025 0.913 1.00 65.21 H new ATOM 0 HD12 ILE A 77 -8.126 18.746 2.467 1.00 65.21 H new ATOM 0 HD13 ILE A 77 -6.904 17.984 1.421 1.00 65.21 H new ATOM 1229 N ALA A 78 -5.877 14.350 2.040 1.00 44.32 N ATOM 1230 CA ALA A 78 -5.739 13.479 0.880 1.00 35.42 C ATOM 1231 C ALA A 78 -7.058 13.354 0.126 1.00 61.12 C ATOM 1232 O ALA A 78 -8.137 13.304 0.718 1.00 40.31 O ATOM 1233 CB ALA A 78 -5.242 12.106 1.307 1.00 72.54 C ATOM 0 H ALA A 78 -6.199 13.879 2.885 1.00 44.32 H new ATOM 0 HA ALA A 78 -5.007 13.926 0.207 1.00 35.42 H new ATOM 0 HB1 ALA A 78 -5.144 11.466 0.430 1.00 72.54 H new ATOM 0 HB2 ALA A 78 -4.272 12.205 1.794 1.00 72.54 H new ATOM 0 HB3 ALA A 78 -5.954 11.662 2.003 1.00 72.54 H new ATOM 1239 N PRO A 79 -6.974 13.306 -1.212 1.00 45.11 N ATOM 1240 CA PRO A 79 -8.153 13.187 -2.076 1.00 73.10 C ATOM 1241 C PRO A 79 -8.815 11.817 -1.969 1.00 74.34 C ATOM 1242 O PRO A 79 -8.488 11.027 -1.084 1.00 72.43 O ATOM 1243 CB PRO A 79 -7.585 13.399 -3.481 1.00 3.43 C ATOM 1244 CG PRO A 79 -6.155 12.995 -3.377 1.00 4.55 C ATOM 1245 CD PRO A 79 -5.722 13.361 -1.984 1.00 54.14 C ATOM 0 HA PRO A 79 -8.932 13.900 -1.804 1.00 73.10 H new ATOM 0 HB2 PRO A 79 -8.115 12.794 -4.217 1.00 3.43 H new ATOM 0 HB3 PRO A 79 -7.681 14.439 -3.794 1.00 3.43 H new ATOM 0 HG2 PRO A 79 -6.038 11.926 -3.554 1.00 4.55 H new ATOM 0 HG3 PRO A 79 -5.549 13.510 -4.122 1.00 4.55 H new ATOM 0 HD2 PRO A 79 -4.980 12.662 -1.597 1.00 54.14 H new ATOM 0 HD3 PRO A 79 -5.273 14.353 -1.951 1.00 54.14 H new ATOM 1253 N ALA A 80 -9.746 11.544 -2.876 1.00 1.11 N ATOM 1254 CA ALA A 80 -10.452 10.268 -2.885 1.00 34.34 C ATOM 1255 C ALA A 80 -9.635 9.193 -3.596 1.00 51.31 C ATOM 1256 O ALA A 80 -9.633 8.031 -3.190 1.00 70.35 O ATOM 1257 CB ALA A 80 -11.813 10.422 -3.546 1.00 63.50 C ATOM 0 H ALA A 80 -10.029 12.188 -3.614 1.00 1.11 H new ATOM 0 HA ALA A 80 -10.596 9.954 -1.851 1.00 34.34 H new ATOM 0 HB1 ALA A 80 -12.328 9.462 -3.546 1.00 63.50 H new ATOM 0 HB2 ALA A 80 -12.405 11.152 -2.994 1.00 63.50 H new ATOM 0 HB3 ALA A 80 -11.682 10.763 -4.573 1.00 63.50 H new ATOM 1263 N LEU A 81 -8.943 9.589 -4.658 1.00 5.22 N ATOM 1264 CA LEU A 81 -8.123 8.660 -5.427 1.00 2.43 C ATOM 1265 C LEU A 81 -6.865 8.276 -4.653 1.00 54.42 C ATOM 1266 O LEU A 81 -6.354 7.166 -4.792 1.00 41.41 O ATOM 1267 CB LEU A 81 -7.739 9.279 -6.771 1.00 34.21 C ATOM 1268 CG LEU A 81 -8.888 9.531 -7.747 1.00 32.21 C ATOM 1269 CD1 LEU A 81 -9.220 11.014 -7.810 1.00 11.43 C ATOM 1270 CD2 LEU A 81 -8.539 9.001 -9.131 1.00 41.44 C ATOM 0 H LEU A 81 -8.933 10.548 -5.006 1.00 5.22 H new ATOM 0 HA LEU A 81 -8.709 7.758 -5.604 1.00 2.43 H new ATOM 0 HB2 LEU A 81 -7.236 10.227 -6.581 1.00 34.21 H new ATOM 0 HB3 LEU A 81 -7.014 8.625 -7.256 1.00 34.21 H new ATOM 0 HG LEU A 81 -9.768 8.998 -7.387 1.00 32.21 H new ATOM 0 HD11 LEU A 81 -10.040 11.174 -8.510 1.00 11.43 H new ATOM 0 HD12 LEU A 81 -9.514 11.363 -6.820 1.00 11.43 H new ATOM 0 HD13 LEU A 81 -8.344 11.569 -8.145 1.00 11.43 H new ATOM 0 HD21 LEU A 81 -9.369 9.189 -9.813 1.00 41.44 H new ATOM 0 HD22 LEU A 81 -7.645 9.505 -9.499 1.00 41.44 H new ATOM 0 HD23 LEU A 81 -8.353 7.929 -9.074 1.00 41.44 H new ATOM 1282 N ALA A 82 -6.374 9.201 -3.836 1.00 61.40 N ATOM 1283 CA ALA A 82 -5.180 8.959 -3.036 1.00 42.42 C ATOM 1284 C ALA A 82 -5.289 7.644 -2.271 1.00 41.25 C ATOM 1285 O ALA A 82 -4.416 6.782 -2.371 1.00 1.31 O ATOM 1286 CB ALA A 82 -4.944 10.114 -2.075 1.00 60.33 C ATOM 0 H ALA A 82 -6.785 10.126 -3.710 1.00 61.40 H new ATOM 0 HA ALA A 82 -4.329 8.886 -3.713 1.00 42.42 H new ATOM 0 HB1 ALA A 82 -4.049 9.919 -1.484 1.00 60.33 H new ATOM 0 HB2 ALA A 82 -4.812 11.036 -2.640 1.00 60.33 H new ATOM 0 HB3 ALA A 82 -5.802 10.216 -1.411 1.00 60.33 H new ATOM 1292 N HIS A 83 -6.366 7.498 -1.506 1.00 52.44 N ATOM 1293 CA HIS A 83 -6.589 6.289 -0.724 1.00 62.14 C ATOM 1294 C HIS A 83 -5.505 6.119 0.336 1.00 43.04 C ATOM 1295 O HIS A 83 -5.305 5.025 0.866 1.00 74.24 O ATOM 1296 CB HIS A 83 -6.624 5.063 -1.637 1.00 52.01 C ATOM 1297 CG HIS A 83 -8.005 4.544 -1.893 1.00 71.45 C ATOM 1298 ND1 HIS A 83 -8.560 3.499 -1.184 1.00 72.31 N ATOM 1299 CD2 HIS A 83 -8.945 4.934 -2.785 1.00 33.10 C ATOM 1300 CE1 HIS A 83 -9.781 3.267 -1.630 1.00 41.15 C ATOM 1301 NE2 HIS A 83 -10.039 4.124 -2.602 1.00 35.44 N ATOM 0 H HIS A 83 -7.098 8.202 -1.411 1.00 52.44 H new ATOM 0 HA HIS A 83 -7.551 6.385 -0.221 1.00 62.14 H new ATOM 0 HB2 HIS A 83 -6.158 5.316 -2.589 1.00 52.01 H new ATOM 0 HB3 HIS A 83 -6.024 4.270 -1.190 1.00 52.01 H new ATOM 0 HD2 HIS A 83 -8.852 5.733 -3.506 1.00 33.10 H new ATOM 0 HE1 HIS A 83 -10.454 2.506 -1.263 1.00 41.15 H new ATOM 0 HE2 HIS A 83 -10.910 4.176 -3.131 1.00 35.44 H new ATOM 1309 N PHE A 84 -4.805 7.207 0.639 1.00 61.54 N ATOM 1310 CA PHE A 84 -3.738 7.178 1.633 1.00 21.02 C ATOM 1311 C PHE A 84 -4.079 8.071 2.822 1.00 45.34 C ATOM 1312 O PHE A 84 -5.188 8.595 2.923 1.00 11.55 O ATOM 1313 CB PHE A 84 -2.416 7.625 1.007 1.00 72.42 C ATOM 1314 CG PHE A 84 -1.378 6.542 0.958 1.00 14.02 C ATOM 1315 CD1 PHE A 84 -0.527 6.330 2.031 1.00 20.34 C ATOM 1316 CD2 PHE A 84 -1.253 5.734 -0.160 1.00 43.32 C ATOM 1317 CE1 PHE A 84 0.430 5.333 1.989 1.00 14.32 C ATOM 1318 CE2 PHE A 84 -0.299 4.734 -0.207 1.00 15.34 C ATOM 1319 CZ PHE A 84 0.543 4.534 0.868 1.00 4.42 C ATOM 0 H PHE A 84 -4.957 8.120 0.211 1.00 61.54 H new ATOM 0 HA PHE A 84 -3.634 6.153 1.989 1.00 21.02 H new ATOM 0 HB2 PHE A 84 -2.605 7.981 -0.006 1.00 72.42 H new ATOM 0 HB3 PHE A 84 -2.022 8.469 1.574 1.00 72.42 H new ATOM 0 HD1 PHE A 84 -0.612 6.951 2.910 1.00 20.34 H new ATOM 0 HD2 PHE A 84 -1.908 5.887 -1.005 1.00 43.32 H new ATOM 0 HE1 PHE A 84 1.088 5.179 2.831 1.00 14.32 H new ATOM 0 HE2 PHE A 84 -0.213 4.110 -1.084 1.00 15.34 H new ATOM 0 HZ PHE A 84 1.289 3.754 0.833 1.00 4.42 H new ATOM 1573 N THR B 4 16.157 31.646 -4.327 1.00 72.34 N ATOM 1574 CA THR B 4 15.750 30.668 -5.329 1.00 42.42 C ATOM 1575 C THR B 4 15.483 29.309 -4.694 1.00 52.45 C ATOM 1576 O THR B 4 15.491 29.173 -3.470 1.00 62.33 O ATOM 1577 CB THR B 4 16.821 30.509 -6.425 1.00 14.31 C ATOM 1578 OG1 THR B 4 16.241 29.919 -7.594 1.00 24.44 O ATOM 1579 CG2 THR B 4 17.974 29.646 -5.933 1.00 44.11 C ATOM 0 HA THR B 4 14.831 31.041 -5.781 1.00 42.42 H new ATOM 0 HB THR B 4 17.208 31.498 -6.672 1.00 14.31 H new ATOM 0 HG1 THR B 4 16.927 29.823 -8.287 1.00 24.44 H new ATOM 0 HG21 THR B 4 18.718 29.548 -6.724 1.00 44.11 H new ATOM 0 HG22 THR B 4 18.431 30.113 -5.060 1.00 44.11 H new ATOM 0 HG23 THR B 4 17.600 28.659 -5.662 1.00 44.11 H new ATOM 1587 N ILE B 5 15.246 28.306 -5.533 1.00 72.43 N ATOM 1588 CA ILE B 5 14.978 26.957 -5.051 1.00 60.40 C ATOM 1589 C ILE B 5 16.043 26.505 -4.058 1.00 73.52 C ATOM 1590 O ILE B 5 15.737 26.175 -2.912 1.00 14.01 O ATOM 1591 CB ILE B 5 14.916 25.947 -6.213 1.00 41.35 C ATOM 1592 CG1 ILE B 5 13.917 26.416 -7.273 1.00 41.00 C ATOM 1593 CG2 ILE B 5 14.539 24.567 -5.696 1.00 64.43 C ATOM 1594 CD1 ILE B 5 13.759 25.449 -8.425 1.00 71.13 C ATOM 0 H ILE B 5 15.234 28.402 -6.548 1.00 72.43 H new ATOM 0 HA ILE B 5 14.009 26.987 -4.552 1.00 60.40 H new ATOM 0 HB ILE B 5 15.902 25.884 -6.673 1.00 41.35 H new ATOM 0 HG12 ILE B 5 12.946 26.570 -6.802 1.00 41.00 H new ATOM 0 HG13 ILE B 5 14.239 27.382 -7.662 1.00 41.00 H new ATOM 0 HG21 ILE B 5 14.499 23.865 -6.529 1.00 64.43 H new ATOM 0 HG22 ILE B 5 15.284 24.233 -4.975 1.00 64.43 H new ATOM 0 HG23 ILE B 5 13.563 24.613 -5.214 1.00 64.43 H new ATOM 0 HD11 ILE B 5 13.036 25.847 -9.137 1.00 71.13 H new ATOM 0 HD12 ILE B 5 14.720 25.314 -8.921 1.00 71.13 H new ATOM 0 HD13 ILE B 5 13.407 24.489 -8.048 1.00 71.13 H new ATOM 1606 N SER B 6 17.295 26.495 -4.503 1.00 1.32 N ATOM 1607 CA SER B 6 18.406 26.083 -3.654 1.00 35.53 C ATOM 1608 C SER B 6 18.375 26.825 -2.321 1.00 22.31 C ATOM 1609 O SER B 6 18.600 26.235 -1.265 1.00 0.21 O ATOM 1610 CB SER B 6 19.739 26.337 -4.361 1.00 41.32 C ATOM 1611 OG SER B 6 20.402 27.462 -3.809 1.00 21.35 O ATOM 0 H SER B 6 17.566 26.768 -5.448 1.00 1.32 H new ATOM 0 HA SER B 6 18.305 25.015 -3.459 1.00 35.53 H new ATOM 0 HB2 SER B 6 20.375 25.456 -4.272 1.00 41.32 H new ATOM 0 HB3 SER B 6 19.565 26.499 -5.425 1.00 41.32 H new ATOM 0 HG SER B 6 21.103 27.160 -3.195 1.00 21.35 H new ATOM 1617 N GLU B 7 18.093 28.123 -2.379 1.00 32.11 N ATOM 1618 CA GLU B 7 18.034 28.946 -1.178 1.00 62.35 C ATOM 1619 C GLU B 7 16.998 28.402 -0.197 1.00 42.41 C ATOM 1620 O GLU B 7 17.171 28.492 1.019 1.00 11.21 O ATOM 1621 CB GLU B 7 17.698 30.394 -1.540 1.00 23.21 C ATOM 1622 CG GLU B 7 18.921 31.277 -1.714 1.00 1.43 C ATOM 1623 CD GLU B 7 19.227 32.102 -0.478 1.00 1.34 C ATOM 1624 OE1 GLU B 7 19.426 31.502 0.599 1.00 2.32 O ATOM 1625 OE2 GLU B 7 19.266 33.344 -0.588 1.00 64.22 O ATOM 0 H GLU B 7 17.902 28.627 -3.245 1.00 32.11 H new ATOM 0 HA GLU B 7 19.013 28.917 -0.700 1.00 62.35 H new ATOM 0 HB2 GLU B 7 17.119 30.404 -2.463 1.00 23.21 H new ATOM 0 HB3 GLU B 7 17.063 30.816 -0.761 1.00 23.21 H new ATOM 0 HG2 GLU B 7 19.783 30.654 -1.953 1.00 1.43 H new ATOM 0 HG3 GLU B 7 18.765 31.944 -2.562 1.00 1.43 H new ATOM 1632 N LYS B 8 15.922 27.838 -0.734 1.00 33.03 N ATOM 1633 CA LYS B 8 14.858 27.278 0.091 1.00 74.20 C ATOM 1634 C LYS B 8 15.345 26.043 0.842 1.00 72.42 C ATOM 1635 O LYS B 8 14.682 25.563 1.762 1.00 55.43 O ATOM 1636 CB LYS B 8 13.649 26.919 -0.775 1.00 61.22 C ATOM 1637 CG LYS B 8 13.334 27.954 -1.841 1.00 10.12 C ATOM 1638 CD LYS B 8 11.862 27.937 -2.217 1.00 72.53 C ATOM 1639 CE LYS B 8 11.225 29.307 -2.040 1.00 74.45 C ATOM 1640 NZ LYS B 8 10.992 29.982 -3.347 1.00 44.13 N ATOM 0 H LYS B 8 15.763 27.756 -1.738 1.00 33.03 H new ATOM 0 HA LYS B 8 14.563 28.032 0.821 1.00 74.20 H new ATOM 0 HB2 LYS B 8 13.830 25.958 -1.256 1.00 61.22 H new ATOM 0 HB3 LYS B 8 12.777 26.794 -0.133 1.00 61.22 H new ATOM 0 HG2 LYS B 8 13.606 28.945 -1.479 1.00 10.12 H new ATOM 0 HG3 LYS B 8 13.939 27.761 -2.727 1.00 10.12 H new ATOM 0 HD2 LYS B 8 11.754 27.615 -3.253 1.00 72.53 H new ATOM 0 HD3 LYS B 8 11.336 27.208 -1.600 1.00 72.53 H new ATOM 0 HE2 LYS B 8 10.278 29.202 -1.511 1.00 74.45 H new ATOM 0 HE3 LYS B 8 11.869 29.930 -1.419 1.00 74.45 H new ATOM 0 HZ1 LYS B 8 10.557 30.913 -3.184 1.00 44.13 H new ATOM 0 HZ2 LYS B 8 11.899 30.105 -3.841 1.00 44.13 H new ATOM 0 HZ3 LYS B 8 10.357 29.400 -3.930 1.00 44.13 H new ATOM 1654 N ILE B 9 16.507 25.534 0.445 1.00 12.54 N ATOM 1655 CA ILE B 9 17.082 24.357 1.083 1.00 14.12 C ATOM 1656 C ILE B 9 18.365 24.707 1.828 1.00 2.44 C ATOM 1657 O ILE B 9 19.040 23.832 2.370 1.00 32.42 O ATOM 1658 CB ILE B 9 17.384 23.251 0.055 1.00 61.41 C ATOM 1659 CG1 ILE B 9 16.236 23.128 -0.948 1.00 2.42 C ATOM 1660 CG2 ILE B 9 17.624 21.924 0.760 1.00 21.54 C ATOM 1661 CD1 ILE B 9 16.477 22.088 -2.019 1.00 4.43 C ATOM 0 H ILE B 9 17.068 25.919 -0.315 1.00 12.54 H new ATOM 0 HA ILE B 9 16.341 23.989 1.793 1.00 14.12 H new ATOM 0 HB ILE B 9 18.289 23.520 -0.490 1.00 61.41 H new ATOM 0 HG12 ILE B 9 15.321 22.879 -0.411 1.00 2.42 H new ATOM 0 HG13 ILE B 9 16.074 24.096 -1.423 1.00 2.42 H new ATOM 0 HG21 ILE B 9 17.836 21.152 0.020 1.00 21.54 H new ATOM 0 HG22 ILE B 9 18.472 22.020 1.438 1.00 21.54 H new ATOM 0 HG23 ILE B 9 16.736 21.648 1.328 1.00 21.54 H new ATOM 0 HD11 ILE B 9 15.622 22.056 -2.694 1.00 4.43 H new ATOM 0 HD12 ILE B 9 17.374 22.346 -2.582 1.00 4.43 H new ATOM 0 HD13 ILE B 9 16.609 21.111 -1.554 1.00 4.43 H new ATOM 1673 N VAL B 10 18.695 25.995 1.854 1.00 31.43 N ATOM 1674 CA VAL B 10 19.896 26.463 2.536 1.00 4.14 C ATOM 1675 C VAL B 10 19.545 27.209 3.818 1.00 20.24 C ATOM 1676 O VAL B 10 20.114 26.947 4.878 1.00 25.00 O ATOM 1677 CB VAL B 10 20.732 27.386 1.631 1.00 14.00 C ATOM 1678 CG1 VAL B 10 22.037 27.766 2.313 1.00 0.51 C ATOM 1679 CG2 VAL B 10 20.998 26.718 0.290 1.00 13.31 C ATOM 0 H VAL B 10 18.147 26.733 1.411 1.00 31.43 H new ATOM 0 HA VAL B 10 20.484 25.579 2.783 1.00 4.14 H new ATOM 0 HB VAL B 10 20.165 28.299 1.451 1.00 14.00 H new ATOM 0 HG11 VAL B 10 22.614 28.419 1.657 1.00 0.51 H new ATOM 0 HG12 VAL B 10 21.822 28.287 3.246 1.00 0.51 H new ATOM 0 HG13 VAL B 10 22.612 26.865 2.525 1.00 0.51 H new ATOM 0 HG21 VAL B 10 21.590 27.384 -0.337 1.00 13.31 H new ATOM 0 HG22 VAL B 10 21.544 25.788 0.449 1.00 13.31 H new ATOM 0 HG23 VAL B 10 20.050 26.502 -0.203 1.00 13.31 H new ATOM 1689 N LEU B 11 18.603 28.140 3.715 1.00 4.44 N ATOM 1690 CA LEU B 11 18.174 28.925 4.866 1.00 2.34 C ATOM 1691 C LEU B 11 17.715 28.019 6.004 1.00 45.43 C ATOM 1692 O LEU B 11 18.120 28.194 7.152 1.00 75.44 O ATOM 1693 CB LEU B 11 17.043 29.875 4.468 1.00 4.21 C ATOM 1694 CG LEU B 11 15.919 29.266 3.629 1.00 62.10 C ATOM 1695 CD1 LEU B 11 14.750 28.864 4.516 1.00 1.11 C ATOM 1696 CD2 LEU B 11 15.464 30.244 2.556 1.00 42.24 C ATOM 0 H LEU B 11 18.122 28.369 2.845 1.00 4.44 H new ATOM 0 HA LEU B 11 19.026 29.509 5.213 1.00 2.34 H new ATOM 0 HB2 LEU B 11 16.607 30.290 5.377 1.00 4.21 H new ATOM 0 HB3 LEU B 11 17.474 30.708 3.912 1.00 4.21 H new ATOM 0 HG LEU B 11 16.302 28.371 3.138 1.00 62.10 H new ATOM 0 HD11 LEU B 11 13.959 28.432 3.902 1.00 1.11 H new ATOM 0 HD12 LEU B 11 15.084 28.128 5.247 1.00 1.11 H new ATOM 0 HD13 LEU B 11 14.368 29.743 5.035 1.00 1.11 H new ATOM 0 HD21 LEU B 11 14.664 29.793 1.969 1.00 42.24 H new ATOM 0 HD22 LEU B 11 15.099 31.157 3.027 1.00 42.24 H new ATOM 0 HD23 LEU B 11 16.303 30.483 1.903 1.00 42.24 H new ATOM 1708 N MET B 12 16.869 27.048 5.674 1.00 15.32 N ATOM 1709 CA MET B 12 16.358 26.111 6.669 1.00 4.44 C ATOM 1710 C MET B 12 17.466 25.187 7.164 1.00 75.53 C ATOM 1711 O MET B 12 17.496 24.813 8.337 1.00 31.24 O ATOM 1712 CB MET B 12 15.214 25.283 6.080 1.00 24.25 C ATOM 1713 CG MET B 12 15.522 24.709 4.707 1.00 13.14 C ATOM 1714 SD MET B 12 14.730 23.114 4.427 1.00 25.25 S ATOM 1715 CE MET B 12 16.149 22.096 4.025 1.00 64.33 C ATOM 0 H MET B 12 16.523 26.889 4.728 1.00 15.32 H new ATOM 0 HA MET B 12 15.983 26.686 7.515 1.00 4.44 H new ATOM 0 HB2 MET B 12 14.980 24.466 6.762 1.00 24.25 H new ATOM 0 HB3 MET B 12 14.323 25.907 6.012 1.00 24.25 H new ATOM 0 HG2 MET B 12 15.194 25.412 3.942 1.00 13.14 H new ATOM 0 HG3 MET B 12 16.601 24.599 4.597 1.00 13.14 H new ATOM 0 HE1 MET B 12 15.838 21.280 3.372 1.00 64.33 H new ATOM 0 HE2 MET B 12 16.899 22.702 3.517 1.00 64.33 H new ATOM 0 HE3 MET B 12 16.574 21.686 4.941 1.00 64.33 H new ATOM 1725 N ARG B 13 18.373 24.822 6.265 1.00 31.24 N ATOM 1726 CA ARG B 13 19.481 23.940 6.612 1.00 74.51 C ATOM 1727 C ARG B 13 20.408 24.606 7.625 1.00 20.12 C ATOM 1728 O ARG B 13 20.725 24.029 8.665 1.00 41.34 O ATOM 1729 CB ARG B 13 20.269 23.559 5.358 1.00 32.34 C ATOM 1730 CG ARG B 13 21.090 22.289 5.515 1.00 45.45 C ATOM 1731 CD ARG B 13 22.563 22.600 5.721 1.00 63.05 C ATOM 1732 NE ARG B 13 23.120 23.374 4.615 1.00 42.01 N ATOM 1733 CZ ARG B 13 24.233 24.094 4.708 1.00 41.31 C ATOM 1734 NH1 ARG B 13 24.905 24.136 5.849 1.00 23.35 N ATOM 1735 NH2 ARG B 13 24.675 24.772 3.656 1.00 12.23 N ATOM 0 H ARG B 13 18.363 25.123 5.291 1.00 31.24 H new ATOM 0 HA ARG B 13 19.067 23.037 7.061 1.00 74.51 H new ATOM 0 HB2 ARG B 13 19.574 23.432 4.528 1.00 32.34 H new ATOM 0 HB3 ARG B 13 20.934 24.381 5.094 1.00 32.34 H new ATOM 0 HG2 ARG B 13 20.716 21.715 6.363 1.00 45.45 H new ATOM 0 HG3 ARG B 13 20.969 21.665 4.630 1.00 45.45 H new ATOM 0 HD2 ARG B 13 22.690 23.154 6.651 1.00 63.05 H new ATOM 0 HD3 ARG B 13 23.119 21.668 5.827 1.00 63.05 H new ATOM 0 HE ARG B 13 22.628 23.361 3.722 1.00 42.01 H new ATOM 0 HH11 ARG B 13 24.568 23.615 6.659 1.00 23.35 H new ATOM 0 HH12 ARG B 13 25.759 24.689 5.918 1.00 23.35 H new ATOM 0 HH21 ARG B 13 24.160 24.740 2.776 1.00 12.23 H new ATOM 0 HH22 ARG B 13 25.529 25.325 3.728 1.00 12.23 H new ATOM 1749 N LYS B 14 20.842 25.822 7.313 1.00 12.22 N ATOM 1750 CA LYS B 14 21.732 26.567 8.195 1.00 65.30 C ATOM 1751 C LYS B 14 21.044 26.888 9.518 1.00 55.42 C ATOM 1752 O LYS B 14 21.701 27.195 10.512 1.00 72.04 O ATOM 1753 CB LYS B 14 22.189 27.861 7.517 1.00 13.55 C ATOM 1754 CG LYS B 14 23.237 27.647 6.440 1.00 13.50 C ATOM 1755 CD LYS B 14 23.752 28.968 5.892 1.00 31.23 C ATOM 1756 CE LYS B 14 22.661 29.726 5.151 1.00 22.12 C ATOM 1757 NZ LYS B 14 23.224 30.635 4.115 1.00 72.34 N ATOM 0 H LYS B 14 20.591 26.313 6.455 1.00 12.22 H new ATOM 0 HA LYS B 14 22.603 25.945 8.401 1.00 65.30 H new ATOM 0 HB2 LYS B 14 21.323 28.355 7.076 1.00 13.55 H new ATOM 0 HB3 LYS B 14 22.590 28.535 8.274 1.00 13.55 H new ATOM 0 HG2 LYS B 14 24.068 27.073 6.849 1.00 13.50 H new ATOM 0 HG3 LYS B 14 22.811 27.057 5.629 1.00 13.50 H new ATOM 0 HD2 LYS B 14 24.130 29.580 6.711 1.00 31.23 H new ATOM 0 HD3 LYS B 14 24.589 28.783 5.219 1.00 31.23 H new ATOM 0 HE2 LYS B 14 21.981 29.016 4.680 1.00 22.12 H new ATOM 0 HE3 LYS B 14 22.074 30.306 5.863 1.00 22.12 H new ATOM 0 HZ1 LYS B 14 22.449 31.133 3.632 1.00 72.34 H new ATOM 0 HZ2 LYS B 14 23.853 31.329 4.567 1.00 72.34 H new ATOM 0 HZ3 LYS B 14 23.763 30.079 3.421 1.00 72.34 H new ATOM 1771 N SER B 15 19.717 26.814 9.522 1.00 70.12 N ATOM 1772 CA SER B 15 18.940 27.100 10.723 1.00 60.13 C ATOM 1773 C SER B 15 19.100 25.985 11.752 1.00 64.13 C ATOM 1774 O SER B 15 18.986 26.215 12.955 1.00 73.31 O ATOM 1775 CB SER B 15 17.461 27.273 10.370 1.00 63.31 C ATOM 1776 OG SER B 15 16.835 28.200 11.239 1.00 42.11 O ATOM 0 H SER B 15 19.158 26.559 8.708 1.00 70.12 H new ATOM 0 HA SER B 15 19.315 28.028 11.156 1.00 60.13 H new ATOM 0 HB2 SER B 15 17.367 27.615 9.339 1.00 63.31 H new ATOM 0 HB3 SER B 15 16.954 26.310 10.433 1.00 63.31 H new ATOM 0 HG SER B 15 17.161 28.063 12.153 1.00 42.11 H new ATOM 1782 N GLU B 16 19.366 24.775 11.268 1.00 40.41 N ATOM 1783 CA GLU B 16 19.542 23.623 12.145 1.00 13.44 C ATOM 1784 C GLU B 16 20.980 23.536 12.647 1.00 32.01 C ATOM 1785 O GLU B 16 21.306 22.697 13.486 1.00 23.44 O ATOM 1786 CB GLU B 16 19.166 22.334 11.412 1.00 54.12 C ATOM 1787 CG GLU B 16 18.918 21.157 12.340 1.00 50.43 C ATOM 1788 CD GLU B 16 17.644 21.311 13.148 1.00 43.22 C ATOM 1789 OE1 GLU B 16 16.720 22.007 12.676 1.00 51.44 O ATOM 1790 OE2 GLU B 16 17.571 20.736 14.256 1.00 35.53 O ATOM 0 H GLU B 16 19.464 24.568 10.274 1.00 40.41 H new ATOM 0 HA GLU B 16 18.883 23.749 13.004 1.00 13.44 H new ATOM 0 HB2 GLU B 16 18.270 22.512 10.817 1.00 54.12 H new ATOM 0 HB3 GLU B 16 19.964 22.075 10.716 1.00 54.12 H new ATOM 0 HG2 GLU B 16 18.863 20.241 11.752 1.00 50.43 H new ATOM 0 HG3 GLU B 16 19.764 21.050 13.019 1.00 50.43 H new ATOM 1797 N TYR B 17 21.835 24.410 12.127 1.00 34.32 N ATOM 1798 CA TYR B 17 23.239 24.430 12.520 1.00 12.14 C ATOM 1799 C TYR B 17 23.938 23.136 12.115 1.00 53.41 C ATOM 1800 O TYR B 17 24.810 22.638 12.828 1.00 71.22 O ATOM 1801 CB TYR B 17 23.366 24.640 14.030 1.00 12.25 C ATOM 1802 CG TYR B 17 22.490 25.752 14.563 1.00 11.31 C ATOM 1803 CD1 TYR B 17 22.492 27.009 13.968 1.00 4.33 C ATOM 1804 CD2 TYR B 17 21.664 25.548 15.660 1.00 24.11 C ATOM 1805 CE1 TYR B 17 21.694 28.028 14.451 1.00 21.33 C ATOM 1806 CE2 TYR B 17 20.862 26.561 16.149 1.00 12.34 C ATOM 1807 CZ TYR B 17 20.881 27.799 15.541 1.00 21.44 C ATOM 1808 OH TYR B 17 20.085 28.812 16.026 1.00 40.42 O ATOM 0 H TYR B 17 21.581 25.113 11.433 1.00 34.32 H new ATOM 0 HA TYR B 17 23.722 25.259 12.003 1.00 12.14 H new ATOM 0 HB2 TYR B 17 23.110 23.711 14.540 1.00 12.25 H new ATOM 0 HB3 TYR B 17 24.406 24.861 14.271 1.00 12.25 H new ATOM 0 HD1 TYR B 17 23.128 27.192 13.114 1.00 4.33 H new ATOM 0 HD2 TYR B 17 21.648 24.580 16.140 1.00 24.11 H new ATOM 0 HE1 TYR B 17 21.707 28.999 13.978 1.00 21.33 H new ATOM 0 HE2 TYR B 17 20.224 26.385 17.002 1.00 12.34 H new ATOM 0 HH TYR B 17 19.573 28.486 16.796 1.00 40.42 H new ATOM 1818 N LEU B 18 23.547 22.596 10.966 1.00 12.20 N ATOM 1819 CA LEU B 18 24.135 21.359 10.463 1.00 24.40 C ATOM 1820 C LEU B 18 24.779 21.578 9.097 1.00 52.21 C ATOM 1821 O LEU B 18 24.310 22.392 8.302 1.00 53.11 O ATOM 1822 CB LEU B 18 23.069 20.266 10.368 1.00 20.43 C ATOM 1823 CG LEU B 18 22.007 20.458 9.285 1.00 13.14 C ATOM 1824 CD1 LEU B 18 22.485 19.884 7.960 1.00 73.11 C ATOM 1825 CD2 LEU B 18 20.695 19.812 9.704 1.00 4.13 C ATOM 0 H LEU B 18 22.826 22.995 10.365 1.00 12.20 H new ATOM 0 HA LEU B 18 24.909 21.043 11.162 1.00 24.40 H new ATOM 0 HB2 LEU B 18 23.569 19.313 10.194 1.00 20.43 H new ATOM 0 HB3 LEU B 18 22.567 20.191 11.332 1.00 20.43 H new ATOM 0 HG LEU B 18 21.838 21.527 9.155 1.00 13.14 H new ATOM 0 HD11 LEU B 18 21.716 20.030 7.202 1.00 73.11 H new ATOM 0 HD12 LEU B 18 23.399 20.392 7.652 1.00 73.11 H new ATOM 0 HD13 LEU B 18 22.683 18.818 8.075 1.00 73.11 H new ATOM 0 HD21 LEU B 18 19.951 19.959 8.921 1.00 4.13 H new ATOM 0 HD22 LEU B 18 20.849 18.745 9.863 1.00 4.13 H new ATOM 0 HD23 LEU B 18 20.343 20.269 10.629 1.00 4.13 H new ATOM 1837 N SER B 19 25.854 20.843 8.832 1.00 12.41 N ATOM 1838 CA SER B 19 26.564 20.958 7.563 1.00 64.34 C ATOM 1839 C SER B 19 25.951 20.036 6.513 1.00 33.32 C ATOM 1840 O SER B 19 25.210 19.109 6.841 1.00 1.23 O ATOM 1841 CB SER B 19 28.044 20.624 7.751 1.00 15.24 C ATOM 1842 OG SER B 19 28.714 21.652 8.460 1.00 63.44 O ATOM 0 H SER B 19 26.252 20.162 9.478 1.00 12.41 H new ATOM 0 HA SER B 19 26.473 21.987 7.215 1.00 64.34 H new ATOM 0 HB2 SER B 19 28.141 19.682 8.291 1.00 15.24 H new ATOM 0 HB3 SER B 19 28.514 20.483 6.778 1.00 15.24 H new ATOM 0 HG SER B 19 29.658 21.413 8.568 1.00 63.44 H new ATOM 1848 N ARG B 20 26.267 20.296 5.249 1.00 0.34 N ATOM 1849 CA ARG B 20 25.748 19.491 4.150 1.00 13.34 C ATOM 1850 C ARG B 20 26.012 18.008 4.390 1.00 61.45 C ATOM 1851 O ARG B 20 25.238 17.153 3.960 1.00 32.35 O ATOM 1852 CB ARG B 20 26.384 19.924 2.827 1.00 32.01 C ATOM 1853 CG ARG B 20 25.566 20.957 2.068 1.00 12.30 C ATOM 1854 CD ARG B 20 26.142 21.216 0.685 1.00 43.42 C ATOM 1855 NE ARG B 20 26.491 22.621 0.492 1.00 33.34 N ATOM 1856 CZ ARG B 20 27.620 23.165 0.933 1.00 13.22 C ATOM 1857 NH1 ARG B 20 28.505 22.426 1.588 1.00 45.34 N ATOM 1858 NH2 ARG B 20 27.866 24.451 0.718 1.00 44.43 N ATOM 0 H ARG B 20 26.880 21.058 4.960 1.00 0.34 H new ATOM 0 HA ARG B 20 24.671 19.647 4.097 1.00 13.34 H new ATOM 0 HB2 ARG B 20 27.375 20.332 3.026 1.00 32.01 H new ATOM 0 HB3 ARG B 20 26.522 19.046 2.195 1.00 32.01 H new ATOM 0 HG2 ARG B 20 24.536 20.611 1.976 1.00 12.30 H new ATOM 0 HG3 ARG B 20 25.540 21.889 2.633 1.00 12.30 H new ATOM 0 HD2 ARG B 20 27.029 20.599 0.540 1.00 43.42 H new ATOM 0 HD3 ARG B 20 25.417 20.915 -0.072 1.00 43.42 H new ATOM 0 HE ARG B 20 25.832 23.217 -0.009 1.00 33.34 H new ATOM 0 HH11 ARG B 20 28.320 21.437 1.755 1.00 45.34 H new ATOM 0 HH12 ARG B 20 29.371 22.847 1.925 1.00 45.34 H new ATOM 0 HH21 ARG B 20 27.188 25.023 0.214 1.00 44.43 H new ATOM 0 HH22 ARG B 20 28.733 24.868 1.057 1.00 44.43 H new ATOM 1872 N GLN B 21 27.107 17.711 5.081 1.00 14.43 N ATOM 1873 CA GLN B 21 27.472 16.331 5.378 1.00 43.34 C ATOM 1874 C GLN B 21 26.469 15.696 6.335 1.00 62.14 C ATOM 1875 O GLN B 21 26.171 14.506 6.236 1.00 41.54 O ATOM 1876 CB GLN B 21 28.878 16.271 5.981 1.00 2.32 C ATOM 1877 CG GLN B 21 29.079 17.221 7.150 1.00 23.52 C ATOM 1878 CD GLN B 21 29.487 16.503 8.422 1.00 53.34 C ATOM 1879 OE1 GLN B 21 30.486 16.850 9.052 1.00 14.14 O ATOM 1880 NE2 GLN B 21 28.711 15.496 8.807 1.00 71.20 N ATOM 0 H GLN B 21 27.757 18.407 5.446 1.00 14.43 H new ATOM 0 HA GLN B 21 27.460 15.770 4.443 1.00 43.34 H new ATOM 0 HB2 GLN B 21 29.079 15.252 6.313 1.00 2.32 H new ATOM 0 HB3 GLN B 21 29.607 16.503 5.205 1.00 2.32 H new ATOM 0 HG2 GLN B 21 29.843 17.954 6.890 1.00 23.52 H new ATOM 0 HG3 GLN B 21 28.156 17.772 7.328 1.00 23.52 H new ATOM 0 HE21 GLN B 21 27.892 15.243 8.254 1.00 71.20 H new ATOM 0 HE22 GLN B 21 28.934 14.976 9.656 1.00 71.20 H new ATOM 1889 N GLN B 22 25.953 16.498 7.261 1.00 33.40 N ATOM 1890 CA GLN B 22 24.983 16.013 8.236 1.00 53.02 C ATOM 1891 C GLN B 22 23.708 15.538 7.546 1.00 53.44 C ATOM 1892 O GLN B 22 23.301 14.385 7.694 1.00 72.23 O ATOM 1893 CB GLN B 22 24.651 17.112 9.247 1.00 4.03 C ATOM 1894 CG GLN B 22 24.946 16.723 10.687 1.00 5.22 C ATOM 1895 CD GLN B 22 26.425 16.520 10.946 1.00 40.14 C ATOM 1896 OE1 GLN B 22 27.194 17.481 11.007 1.00 24.31 O ATOM 1897 NE2 GLN B 22 26.834 15.267 11.100 1.00 70.34 N ATOM 0 H GLN B 22 26.190 17.485 7.357 1.00 33.40 H new ATOM 0 HA GLN B 22 25.426 15.167 8.762 1.00 53.02 H new ATOM 0 HB2 GLN B 22 25.220 18.008 8.997 1.00 4.03 H new ATOM 0 HB3 GLN B 22 23.596 17.370 9.158 1.00 4.03 H new ATOM 0 HG2 GLN B 22 24.568 17.498 11.353 1.00 5.22 H new ATOM 0 HG3 GLN B 22 24.410 15.805 10.928 1.00 5.22 H new ATOM 0 HE21 GLN B 22 26.163 14.501 11.042 1.00 70.34 H new ATOM 0 HE22 GLN B 22 27.819 15.070 11.277 1.00 70.34 H new ATOM 1906 N LEU B 23 23.081 16.435 6.793 1.00 15.24 N ATOM 1907 CA LEU B 23 21.850 16.108 6.080 1.00 60.42 C ATOM 1908 C LEU B 23 22.100 15.033 5.026 1.00 74.31 C ATOM 1909 O LEU B 23 21.313 14.100 4.879 1.00 34.01 O ATOM 1910 CB LEU B 23 21.272 17.361 5.419 1.00 62.13 C ATOM 1911 CG LEU B 23 19.926 17.188 4.715 1.00 44.52 C ATOM 1912 CD1 LEU B 23 19.161 18.502 4.695 1.00 33.53 C ATOM 1913 CD2 LEU B 23 20.130 16.666 3.299 1.00 12.23 C ATOM 0 H LEU B 23 23.404 17.393 6.660 1.00 15.24 H new ATOM 0 HA LEU B 23 21.132 15.722 6.803 1.00 60.42 H new ATOM 0 HB2 LEU B 23 21.164 18.133 6.181 1.00 62.13 H new ATOM 0 HB3 LEU B 23 21.995 17.730 4.692 1.00 62.13 H new ATOM 0 HG LEU B 23 19.338 16.458 5.270 1.00 44.52 H new ATOM 0 HD11 LEU B 23 18.206 18.359 4.190 1.00 33.53 H new ATOM 0 HD12 LEU B 23 18.985 18.836 5.717 1.00 33.53 H new ATOM 0 HD13 LEU B 23 19.744 19.254 4.163 1.00 33.53 H new ATOM 0 HD21 LEU B 23 19.162 16.548 2.812 1.00 12.23 H new ATOM 0 HD22 LEU B 23 20.737 17.374 2.734 1.00 12.23 H new ATOM 0 HD23 LEU B 23 20.637 15.702 3.336 1.00 12.23 H new ATOM 1925 N ALA B 24 23.203 15.172 4.297 1.00 31.24 N ATOM 1926 CA ALA B 24 23.560 14.211 3.261 1.00 75.43 C ATOM 1927 C ALA B 24 23.539 12.786 3.803 1.00 63.14 C ATOM 1928 O ALA B 24 23.275 11.836 3.066 1.00 31.23 O ATOM 1929 CB ALA B 24 24.929 14.539 2.685 1.00 65.45 C ATOM 0 H ALA B 24 23.864 15.941 4.405 1.00 31.24 H new ATOM 0 HA ALA B 24 22.818 14.280 2.466 1.00 75.43 H new ATOM 0 HB1 ALA B 24 25.182 13.813 1.913 1.00 65.45 H new ATOM 0 HB2 ALA B 24 24.911 15.539 2.251 1.00 65.45 H new ATOM 0 HB3 ALA B 24 25.676 14.501 3.478 1.00 65.45 H new ATOM 1935 N ASP B 25 23.819 12.645 5.094 1.00 53.33 N ATOM 1936 CA ASP B 25 23.833 11.335 5.734 1.00 63.20 C ATOM 1937 C ASP B 25 22.474 11.018 6.351 1.00 41.34 C ATOM 1938 O ASP B 25 22.117 9.853 6.527 1.00 55.50 O ATOM 1939 CB ASP B 25 24.920 11.281 6.809 1.00 35.03 C ATOM 1940 CG ASP B 25 26.100 10.422 6.397 1.00 31.34 C ATOM 1941 OD1 ASP B 25 27.017 10.953 5.738 1.00 43.25 O ATOM 1942 OD2 ASP B 25 26.103 9.218 6.731 1.00 75.51 O ATOM 0 H ASP B 25 24.039 13.422 5.718 1.00 53.33 H new ATOM 0 HA ASP B 25 24.050 10.587 4.971 1.00 63.20 H new ATOM 0 HB2 ASP B 25 25.267 12.292 7.022 1.00 35.03 H new ATOM 0 HB3 ASP B 25 24.494 10.889 7.733 1.00 35.03 H new ATOM 1947 N LEU B 26 21.721 12.062 6.679 1.00 71.41 N ATOM 1948 CA LEU B 26 20.401 11.895 7.278 1.00 64.24 C ATOM 1949 C LEU B 26 19.369 11.511 6.223 1.00 43.13 C ATOM 1950 O LEU B 26 18.336 10.918 6.535 1.00 10.22 O ATOM 1951 CB LEU B 26 19.972 13.184 7.982 1.00 4.31 C ATOM 1952 CG LEU B 26 20.121 13.200 9.503 1.00 10.30 C ATOM 1953 CD1 LEU B 26 21.229 14.154 9.921 1.00 61.54 C ATOM 1954 CD2 LEU B 26 18.806 13.585 10.164 1.00 62.25 C ATOM 0 H LEU B 26 22.001 13.033 6.540 1.00 71.41 H new ATOM 0 HA LEU B 26 20.461 11.090 8.011 1.00 64.24 H new ATOM 0 HB2 LEU B 26 20.554 14.009 7.571 1.00 4.31 H new ATOM 0 HB3 LEU B 26 18.928 13.377 7.737 1.00 4.31 H new ATOM 0 HG LEU B 26 20.390 12.197 9.833 1.00 10.30 H new ATOM 0 HD11 LEU B 26 21.320 14.152 11.007 1.00 61.54 H new ATOM 0 HD12 LEU B 26 22.172 13.834 9.477 1.00 61.54 H new ATOM 0 HD13 LEU B 26 20.990 15.161 9.579 1.00 61.54 H new ATOM 0 HD21 LEU B 26 18.931 13.591 11.247 1.00 62.25 H new ATOM 0 HD22 LEU B 26 18.507 14.578 9.828 1.00 62.25 H new ATOM 0 HD23 LEU B 26 18.037 12.862 9.892 1.00 62.25 H new ATOM 1966 N THR B 27 19.656 11.851 4.970 1.00 72.41 N ATOM 1967 CA THR B 27 18.754 11.540 3.868 1.00 53.05 C ATOM 1968 C THR B 27 19.384 10.537 2.908 1.00 51.22 C ATOM 1969 O THR B 27 18.711 9.994 2.033 1.00 32.24 O ATOM 1970 CB THR B 27 18.365 12.808 3.086 1.00 52.21 C ATOM 1971 OG1 THR B 27 19.512 13.339 2.412 1.00 2.43 O ATOM 1972 CG2 THR B 27 17.786 13.863 4.017 1.00 64.34 C ATOM 0 H THR B 27 20.506 12.342 4.693 1.00 72.41 H new ATOM 0 HA THR B 27 17.857 11.104 4.307 1.00 53.05 H new ATOM 0 HB THR B 27 17.605 12.536 2.353 1.00 52.21 H new ATOM 0 HG1 THR B 27 20.189 13.597 3.072 1.00 2.43 H new ATOM 0 HG21 THR B 27 17.519 14.749 3.441 1.00 64.34 H new ATOM 0 HG22 THR B 27 16.897 13.467 4.507 1.00 64.34 H new ATOM 0 HG23 THR B 27 18.527 14.130 4.770 1.00 64.34 H new ATOM 1980 N GLY B 28 20.681 10.297 3.077 1.00 31.12 N ATOM 1981 CA GLY B 28 21.380 9.359 2.218 1.00 0.51 C ATOM 1982 C GLY B 28 21.967 10.026 0.989 1.00 21.43 C ATOM 1983 O GLY B 28 22.747 9.417 0.256 1.00 31.15 O ATOM 0 H GLY B 28 21.260 10.735 3.793 1.00 31.12 H new ATOM 0 HA2 GLY B 28 22.179 8.879 2.783 1.00 0.51 H new ATOM 0 HA3 GLY B 28 20.692 8.573 1.907 1.00 0.51 H new ATOM 1987 N VAL B 29 21.592 11.280 0.762 1.00 41.33 N ATOM 1988 CA VAL B 29 22.086 12.030 -0.387 1.00 64.40 C ATOM 1989 C VAL B 29 23.603 12.174 -0.338 1.00 1.32 C ATOM 1990 O VAL B 29 24.192 12.436 0.711 1.00 12.41 O ATOM 1991 CB VAL B 29 21.450 13.431 -0.458 1.00 61.44 C ATOM 1992 CG1 VAL B 29 22.430 14.432 -1.050 1.00 50.43 C ATOM 1993 CG2 VAL B 29 20.162 13.390 -1.267 1.00 55.14 C ATOM 0 H VAL B 29 20.947 11.799 1.359 1.00 41.33 H new ATOM 0 HA VAL B 29 21.806 11.467 -1.277 1.00 64.40 H new ATOM 0 HB VAL B 29 21.206 13.753 0.554 1.00 61.44 H new ATOM 0 HG11 VAL B 29 21.964 15.416 -1.093 1.00 50.43 H new ATOM 0 HG12 VAL B 29 23.322 14.480 -0.426 1.00 50.43 H new ATOM 0 HG13 VAL B 29 22.707 14.118 -2.056 1.00 50.43 H new ATOM 0 HG21 VAL B 29 19.726 14.388 -1.307 1.00 55.14 H new ATOM 0 HG22 VAL B 29 20.379 13.048 -2.279 1.00 55.14 H new ATOM 0 HG23 VAL B 29 19.458 12.705 -0.795 1.00 55.14 H new ATOM 2003 N PRO B 30 24.252 12.000 -1.499 1.00 64.31 N ATOM 2004 CA PRO B 30 25.709 12.107 -1.614 1.00 44.21 C ATOM 2005 C PRO B 30 26.200 13.541 -1.441 1.00 55.44 C ATOM 2006 O PRO B 30 25.630 14.475 -2.005 1.00 52.10 O ATOM 2007 CB PRO B 30 25.989 11.614 -3.037 1.00 72.05 C ATOM 2008 CG PRO B 30 24.725 11.871 -3.782 1.00 25.14 C ATOM 2009 CD PRO B 30 23.613 11.686 -2.787 1.00 2.43 C ATOM 0 HA PRO B 30 26.222 11.535 -0.841 1.00 44.21 H new ATOM 0 HB2 PRO B 30 26.827 12.149 -3.483 1.00 72.05 H new ATOM 0 HB3 PRO B 30 26.245 10.555 -3.046 1.00 72.05 H new ATOM 0 HG2 PRO B 30 24.714 12.879 -4.196 1.00 25.14 H new ATOM 0 HG3 PRO B 30 24.618 11.181 -4.619 1.00 25.14 H new ATOM 0 HD2 PRO B 30 22.775 12.352 -2.993 1.00 2.43 H new ATOM 0 HD3 PRO B 30 23.223 10.668 -2.805 1.00 2.43 H new ATOM 2017 N TYR B 31 27.262 13.706 -0.660 1.00 55.04 N ATOM 2018 CA TYR B 31 27.829 15.027 -0.412 1.00 73.24 C ATOM 2019 C TYR B 31 28.562 15.545 -1.645 1.00 50.10 C ATOM 2020 O TYR B 31 28.670 16.753 -1.855 1.00 14.12 O ATOM 2021 CB TYR B 31 28.785 14.978 0.781 1.00 71.51 C ATOM 2022 CG TYR B 31 29.338 16.330 1.169 1.00 71.30 C ATOM 2023 CD1 TYR B 31 30.475 16.841 0.556 1.00 4.21 C ATOM 2024 CD2 TYR B 31 28.723 17.099 2.151 1.00 11.35 C ATOM 2025 CE1 TYR B 31 30.985 18.076 0.909 1.00 23.24 C ATOM 2026 CE2 TYR B 31 29.224 18.335 2.509 1.00 75.30 C ATOM 2027 CZ TYR B 31 30.355 18.819 1.885 1.00 13.24 C ATOM 2028 OH TYR B 31 30.858 20.050 2.240 1.00 2.20 O ATOM 0 H TYR B 31 27.747 12.943 -0.188 1.00 55.04 H new ATOM 0 HA TYR B 31 27.010 15.710 -0.185 1.00 73.24 H new ATOM 0 HB2 TYR B 31 28.263 14.549 1.637 1.00 71.51 H new ATOM 0 HB3 TYR B 31 29.613 14.310 0.545 1.00 71.51 H new ATOM 0 HD1 TYR B 31 30.969 16.263 -0.210 1.00 4.21 H new ATOM 0 HD2 TYR B 31 27.838 16.723 2.642 1.00 11.35 H new ATOM 0 HE1 TYR B 31 31.871 18.457 0.424 1.00 23.24 H new ATOM 0 HE2 TYR B 31 28.733 18.919 3.273 1.00 75.30 H new ATOM 0 HH TYR B 31 30.297 20.443 2.941 1.00 2.20 H new ATOM 2038 N GLY B 32 29.063 14.622 -2.460 1.00 45.13 N ATOM 2039 CA GLY B 32 29.779 15.004 -3.664 1.00 74.01 C ATOM 2040 C GLY B 32 28.896 15.732 -4.657 1.00 73.43 C ATOM 2041 O GLY B 32 29.380 16.528 -5.462 1.00 1.33 O ATOM 0 H GLY B 32 28.986 13.616 -2.308 1.00 45.13 H new ATOM 0 HA2 GLY B 32 30.621 15.642 -3.395 1.00 74.01 H new ATOM 0 HA3 GLY B 32 30.192 14.112 -4.136 1.00 74.01 H new ATOM 2045 N THR B 33 27.596 15.460 -4.602 1.00 10.04 N ATOM 2046 CA THR B 33 26.643 16.092 -5.505 1.00 11.04 C ATOM 2047 C THR B 33 25.764 17.093 -4.764 1.00 2.51 C ATOM 2048 O THR B 33 25.249 18.042 -5.358 1.00 23.25 O ATOM 2049 CB THR B 33 25.745 15.049 -6.196 1.00 3.23 C ATOM 2050 OG1 THR B 33 26.538 13.953 -6.664 1.00 14.15 O ATOM 2051 CG2 THR B 33 24.992 15.670 -7.362 1.00 42.22 C ATOM 0 H THR B 33 27.179 14.805 -3.940 1.00 10.04 H new ATOM 0 HA THR B 33 27.226 16.616 -6.263 1.00 11.04 H new ATOM 0 HB THR B 33 25.020 14.687 -5.467 1.00 3.23 H new ATOM 0 HG1 THR B 33 25.959 13.293 -7.101 1.00 14.15 H new ATOM 0 HG21 THR B 33 24.365 14.914 -7.834 1.00 42.22 H new ATOM 0 HG22 THR B 33 24.366 16.485 -6.998 1.00 42.22 H new ATOM 0 HG23 THR B 33 25.704 16.057 -8.091 1.00 42.22 H new ATOM 2059 N LEU B 34 25.595 16.876 -3.465 1.00 5.42 N ATOM 2060 CA LEU B 34 24.777 17.760 -2.641 1.00 11.23 C ATOM 2061 C LEU B 34 25.313 19.187 -2.677 1.00 53.41 C ATOM 2062 O LEU B 34 24.546 20.149 -2.640 1.00 25.43 O ATOM 2063 CB LEU B 34 24.738 17.254 -1.199 1.00 44.11 C ATOM 2064 CG LEU B 34 24.092 18.190 -0.176 1.00 20.43 C ATOM 2065 CD1 LEU B 34 22.581 18.213 -0.353 1.00 30.33 C ATOM 2066 CD2 LEU B 34 24.458 17.768 1.239 1.00 54.42 C ATOM 0 H LEU B 34 26.013 16.096 -2.959 1.00 5.42 H new ATOM 0 HA LEU B 34 23.765 17.761 -3.046 1.00 11.23 H new ATOM 0 HB2 LEU B 34 24.202 16.305 -1.183 1.00 44.11 H new ATOM 0 HB3 LEU B 34 25.760 17.049 -0.879 1.00 44.11 H new ATOM 0 HG LEU B 34 24.473 19.198 -0.343 1.00 20.43 H new ATOM 0 HD11 LEU B 34 22.139 18.884 0.383 1.00 30.33 H new ATOM 0 HD12 LEU B 34 22.337 18.563 -1.356 1.00 30.33 H new ATOM 0 HD13 LEU B 34 22.183 17.208 -0.213 1.00 30.33 H new ATOM 0 HD21 LEU B 34 23.990 18.445 1.953 1.00 54.42 H new ATOM 0 HD22 LEU B 34 24.106 16.752 1.418 1.00 54.42 H new ATOM 0 HD23 LEU B 34 25.541 17.804 1.361 1.00 54.42 H new ATOM 2078 N SER B 35 26.633 19.317 -2.751 1.00 61.31 N ATOM 2079 CA SER B 35 27.272 20.627 -2.791 1.00 34.14 C ATOM 2080 C SER B 35 26.652 21.501 -3.876 1.00 4.52 C ATOM 2081 O SER B 35 26.473 22.705 -3.691 1.00 30.41 O ATOM 2082 CB SER B 35 28.775 20.478 -3.036 1.00 14.21 C ATOM 2083 OG SER B 35 29.285 21.582 -3.764 1.00 62.41 O ATOM 0 H SER B 35 27.282 18.531 -2.785 1.00 61.31 H new ATOM 0 HA SER B 35 27.115 21.110 -1.827 1.00 34.14 H new ATOM 0 HB2 SER B 35 29.296 20.396 -2.082 1.00 14.21 H new ATOM 0 HB3 SER B 35 28.968 19.556 -3.585 1.00 14.21 H new ATOM 0 HG SER B 35 30.247 21.464 -3.906 1.00 62.41 H new ATOM 2089 N TYR B 36 26.328 20.887 -5.008 1.00 41.34 N ATOM 2090 CA TYR B 36 25.730 21.609 -6.125 1.00 34.30 C ATOM 2091 C TYR B 36 24.220 21.732 -5.948 1.00 45.21 C ATOM 2092 O TYR B 36 23.598 22.667 -6.454 1.00 45.01 O ATOM 2093 CB TYR B 36 26.044 20.899 -7.444 1.00 40.31 C ATOM 2094 CG TYR B 36 27.494 21.007 -7.859 1.00 34.30 C ATOM 2095 CD1 TYR B 36 28.176 22.213 -7.763 1.00 45.14 C ATOM 2096 CD2 TYR B 36 28.181 19.902 -8.346 1.00 32.43 C ATOM 2097 CE1 TYR B 36 29.501 22.316 -8.142 1.00 64.54 C ATOM 2098 CE2 TYR B 36 29.505 19.995 -8.726 1.00 62.53 C ATOM 2099 CZ TYR B 36 30.161 21.205 -8.623 1.00 62.20 C ATOM 2100 OH TYR B 36 31.480 21.302 -9.000 1.00 51.03 O ATOM 0 H TYR B 36 26.469 19.891 -5.177 1.00 41.34 H new ATOM 0 HA TYR B 36 26.158 22.611 -6.148 1.00 34.30 H new ATOM 0 HB2 TYR B 36 25.778 19.846 -7.352 1.00 40.31 H new ATOM 0 HB3 TYR B 36 25.417 21.318 -8.231 1.00 40.31 H new ATOM 0 HD1 TYR B 36 27.662 23.085 -7.386 1.00 45.14 H new ATOM 0 HD2 TYR B 36 27.670 18.954 -8.429 1.00 32.43 H new ATOM 0 HE1 TYR B 36 30.017 23.262 -8.062 1.00 64.54 H new ATOM 0 HE2 TYR B 36 30.024 19.126 -9.102 1.00 62.53 H new ATOM 0 HH TYR B 36 31.795 20.429 -9.315 1.00 51.03 H new ATOM 2110 N TYR B 37 23.636 20.782 -5.226 1.00 23.03 N ATOM 2111 CA TYR B 37 22.198 20.782 -4.983 1.00 71.53 C ATOM 2112 C TYR B 37 21.771 22.046 -4.244 1.00 1.34 C ATOM 2113 O TYR B 37 21.095 22.908 -4.805 1.00 12.02 O ATOM 2114 CB TYR B 37 21.796 19.546 -4.177 1.00 44.25 C ATOM 2115 CG TYR B 37 21.522 18.329 -5.030 1.00 22.43 C ATOM 2116 CD1 TYR B 37 22.230 18.105 -6.204 1.00 52.14 C ATOM 2117 CD2 TYR B 37 20.554 17.402 -4.662 1.00 15.42 C ATOM 2118 CE1 TYR B 37 21.983 16.995 -6.987 1.00 2.53 C ATOM 2119 CE2 TYR B 37 20.300 16.288 -5.439 1.00 0.41 C ATOM 2120 CZ TYR B 37 21.017 16.089 -6.600 1.00 71.12 C ATOM 2121 OH TYR B 37 20.768 14.981 -7.378 1.00 2.50 O ATOM 0 H TYR B 37 24.136 20.002 -4.799 1.00 23.03 H new ATOM 0 HA TYR B 37 21.692 20.758 -5.948 1.00 71.53 H new ATOM 0 HB2 TYR B 37 22.590 19.311 -3.468 1.00 44.25 H new ATOM 0 HB3 TYR B 37 20.905 19.778 -3.593 1.00 44.25 H new ATOM 0 HD1 TYR B 37 22.987 18.812 -6.510 1.00 52.14 H new ATOM 0 HD2 TYR B 37 19.991 17.555 -3.753 1.00 15.42 H new ATOM 0 HE1 TYR B 37 22.543 16.837 -7.897 1.00 2.53 H new ATOM 0 HE2 TYR B 37 19.544 15.577 -5.139 1.00 0.41 H new ATOM 0 HH TYR B 37 20.060 14.444 -6.965 1.00 2.50 H new ATOM 2131 N GLU B 38 22.171 22.150 -2.980 1.00 43.22 N ATOM 2132 CA GLU B 38 21.830 23.308 -2.164 1.00 44.31 C ATOM 2133 C GLU B 38 22.360 24.593 -2.794 1.00 24.45 C ATOM 2134 O GLU B 38 21.869 25.685 -2.508 1.00 42.22 O ATOM 2135 CB GLU B 38 22.396 23.149 -0.751 1.00 11.21 C ATOM 2136 CG GLU B 38 22.121 21.788 -0.136 1.00 54.50 C ATOM 2137 CD GLU B 38 21.840 21.866 1.353 1.00 35.11 C ATOM 2138 OE1 GLU B 38 22.408 22.759 2.017 1.00 63.32 O ATOM 2139 OE2 GLU B 38 21.052 21.037 1.853 1.00 70.20 O ATOM 0 H GLU B 38 22.731 21.446 -2.500 1.00 43.22 H new ATOM 0 HA GLU B 38 20.743 23.373 -2.107 1.00 44.31 H new ATOM 0 HB2 GLU B 38 23.473 23.315 -0.779 1.00 11.21 H new ATOM 0 HB3 GLU B 38 21.971 23.921 -0.109 1.00 11.21 H new ATOM 0 HG2 GLU B 38 21.269 21.332 -0.639 1.00 54.50 H new ATOM 0 HG3 GLU B 38 22.978 21.137 -0.307 1.00 54.50 H new ATOM 2146 N SER B 39 23.363 24.453 -3.653 1.00 53.34 N ATOM 2147 CA SER B 39 23.964 25.603 -4.321 1.00 70.11 C ATOM 2148 C SER B 39 23.094 26.070 -5.485 1.00 24.54 C ATOM 2149 O SER B 39 23.229 27.195 -5.963 1.00 41.42 O ATOM 2150 CB SER B 39 25.365 25.252 -4.825 1.00 1.22 C ATOM 2151 OG SER B 39 26.326 25.384 -3.793 1.00 11.15 O ATOM 0 H SER B 39 23.778 23.555 -3.904 1.00 53.34 H new ATOM 0 HA SER B 39 24.039 26.415 -3.597 1.00 70.11 H new ATOM 0 HB2 SER B 39 25.373 24.230 -5.205 1.00 1.22 H new ATOM 0 HB3 SER B 39 25.629 25.904 -5.658 1.00 1.22 H new ATOM 0 HG SER B 39 26.615 24.495 -3.499 1.00 11.15 H new ATOM 2157 N GLY B 40 22.200 25.195 -5.936 1.00 41.23 N ATOM 2158 CA GLY B 40 21.322 25.535 -7.040 1.00 73.32 C ATOM 2159 C GLY B 40 22.002 25.397 -8.387 1.00 71.50 C ATOM 2160 O GLY B 40 21.528 25.934 -9.387 1.00 64.32 O ATOM 0 H GLY B 40 22.068 24.257 -5.557 1.00 41.23 H new ATOM 0 HA2 GLY B 40 20.443 24.891 -7.013 1.00 73.32 H new ATOM 0 HA3 GLY B 40 20.970 26.559 -6.918 1.00 73.32 H new ATOM 2164 N ARG B 41 23.119 24.676 -8.412 1.00 73.33 N ATOM 2165 CA ARG B 41 23.867 24.471 -9.646 1.00 73.31 C ATOM 2166 C ARG B 41 23.009 23.769 -10.694 1.00 30.24 C ATOM 2167 O ARG B 41 23.238 23.909 -11.895 1.00 23.15 O ATOM 2168 CB ARG B 41 25.129 23.651 -9.372 1.00 2.45 C ATOM 2169 CG ARG B 41 26.351 24.141 -10.133 1.00 71.20 C ATOM 2170 CD ARG B 41 26.826 25.489 -9.613 1.00 3.45 C ATOM 2171 NE ARG B 41 28.128 25.859 -10.162 1.00 73.34 N ATOM 2172 CZ ARG B 41 28.887 26.830 -9.666 1.00 44.45 C ATOM 2173 NH1 ARG B 41 28.476 27.525 -8.614 1.00 73.10 N ATOM 2174 NH2 ARG B 41 30.060 27.107 -10.220 1.00 72.43 N ATOM 0 H ARG B 41 23.525 24.225 -7.592 1.00 73.33 H new ATOM 0 HA ARG B 41 24.153 25.449 -10.033 1.00 73.31 H new ATOM 0 HB2 ARG B 41 25.343 23.675 -8.303 1.00 2.45 H new ATOM 0 HB3 ARG B 41 24.940 22.610 -9.636 1.00 2.45 H new ATOM 0 HG2 ARG B 41 27.155 23.411 -10.042 1.00 71.20 H new ATOM 0 HG3 ARG B 41 26.113 24.222 -11.193 1.00 71.20 H new ATOM 0 HD2 ARG B 41 26.094 26.255 -9.869 1.00 3.45 H new ATOM 0 HD3 ARG B 41 26.887 25.457 -8.525 1.00 3.45 H new ATOM 0 HE ARG B 41 28.474 25.343 -10.971 1.00 73.34 H new ATOM 0 HH11 ARG B 41 27.575 27.314 -8.184 1.00 73.10 H new ATOM 0 HH12 ARG B 41 29.061 28.270 -8.235 1.00 73.10 H new ATOM 0 HH21 ARG B 41 30.381 26.574 -11.028 1.00 72.43 H new ATOM 0 HH22 ARG B 41 30.641 27.853 -9.838 1.00 72.43 H new ATOM 2188 N SER B 42 22.019 23.011 -10.229 1.00 53.33 N ATOM 2189 CA SER B 42 21.129 22.283 -11.125 1.00 23.23 C ATOM 2190 C SER B 42 19.901 21.774 -10.376 1.00 3.44 C ATOM 2191 O SER B 42 20.017 21.136 -9.330 1.00 55.33 O ATOM 2192 CB SER B 42 21.869 21.109 -11.770 1.00 33.02 C ATOM 2193 OG SER B 42 21.763 21.154 -13.183 1.00 14.24 O ATOM 0 H SER B 42 21.814 22.886 -9.238 1.00 53.33 H new ATOM 0 HA SER B 42 20.799 22.969 -11.905 1.00 23.23 H new ATOM 0 HB2 SER B 42 22.919 21.134 -11.480 1.00 33.02 H new ATOM 0 HB3 SER B 42 21.458 20.169 -11.401 1.00 33.02 H new ATOM 0 HG SER B 42 22.245 20.395 -13.572 1.00 14.24 H new ATOM 2199 N THR B 43 18.722 22.063 -10.920 1.00 54.02 N ATOM 2200 CA THR B 43 17.472 21.638 -10.303 1.00 44.13 C ATOM 2201 C THR B 43 17.436 20.125 -10.120 1.00 62.42 C ATOM 2202 O THR B 43 17.367 19.360 -11.084 1.00 42.45 O ATOM 2203 CB THR B 43 16.256 22.071 -11.144 1.00 15.34 C ATOM 2204 OG1 THR B 43 16.672 22.961 -12.185 1.00 15.25 O ATOM 2205 CG2 THR B 43 15.213 22.755 -10.273 1.00 51.13 C ATOM 0 H THR B 43 18.607 22.589 -11.786 1.00 54.02 H new ATOM 0 HA THR B 43 17.420 22.120 -9.327 1.00 44.13 H new ATOM 0 HB THR B 43 15.811 21.179 -11.585 1.00 15.34 H new ATOM 0 HG1 THR B 43 15.893 23.230 -12.716 1.00 15.25 H new ATOM 0 HG21 THR B 43 14.364 23.052 -10.888 1.00 51.13 H new ATOM 0 HG22 THR B 43 14.877 22.066 -9.499 1.00 51.13 H new ATOM 0 HG23 THR B 43 15.650 23.638 -9.807 1.00 51.13 H new ATOM 2213 N PRO B 44 17.483 19.679 -8.857 1.00 34.10 N ATOM 2214 CA PRO B 44 17.456 18.253 -8.518 1.00 64.22 C ATOM 2215 C PRO B 44 16.098 17.617 -8.796 1.00 65.12 C ATOM 2216 O PRO B 44 15.098 18.302 -9.014 1.00 43.23 O ATOM 2217 CB PRO B 44 17.757 18.238 -7.018 1.00 42.35 C ATOM 2218 CG PRO B 44 17.314 19.574 -6.530 1.00 43.14 C ATOM 2219 CD PRO B 44 17.567 20.533 -7.661 1.00 4.14 C ATOM 0 HA PRO B 44 18.166 17.679 -9.114 1.00 64.22 H new ATOM 0 HB2 PRO B 44 17.220 17.434 -6.514 1.00 42.35 H new ATOM 0 HB3 PRO B 44 18.819 18.079 -6.829 1.00 42.35 H new ATOM 0 HG2 PRO B 44 16.258 19.560 -6.259 1.00 43.14 H new ATOM 0 HG3 PRO B 44 17.868 19.867 -5.638 1.00 43.14 H new ATOM 0 HD2 PRO B 44 16.825 21.331 -7.684 1.00 4.14 H new ATOM 0 HD3 PRO B 44 18.544 21.008 -7.574 1.00 4.14 H new ATOM 2227 N PRO B 45 16.058 16.277 -8.787 1.00 22.42 N ATOM 2228 CA PRO B 45 14.827 15.519 -9.034 1.00 43.51 C ATOM 2229 C PRO B 45 13.824 15.655 -7.894 1.00 62.05 C ATOM 2230 O PRO B 45 14.110 16.280 -6.872 1.00 14.40 O ATOM 2231 CB PRO B 45 15.317 14.073 -9.148 1.00 65.34 C ATOM 2232 CG PRO B 45 16.584 14.040 -8.364 1.00 42.52 C ATOM 2233 CD PRO B 45 17.211 15.396 -8.534 1.00 44.51 C ATOM 0 HA PRO B 45 14.300 15.875 -9.919 1.00 43.51 H new ATOM 0 HB2 PRO B 45 14.584 13.374 -8.746 1.00 65.34 H new ATOM 0 HB3 PRO B 45 15.487 13.793 -10.188 1.00 65.34 H new ATOM 0 HG2 PRO B 45 16.387 13.830 -7.313 1.00 42.52 H new ATOM 0 HG3 PRO B 45 17.247 13.255 -8.727 1.00 42.52 H new ATOM 0 HD2 PRO B 45 17.760 15.699 -7.643 1.00 44.51 H new ATOM 0 HD3 PRO B 45 17.917 15.411 -9.364 1.00 44.51 H new ATOM 2241 N THR B 46 12.647 15.064 -8.074 1.00 11.44 N ATOM 2242 CA THR B 46 11.602 15.118 -7.060 1.00 63.42 C ATOM 2243 C THR B 46 11.771 14.004 -6.034 1.00 5.13 C ATOM 2244 O THR B 46 11.337 14.130 -4.889 1.00 4.01 O ATOM 2245 CB THR B 46 10.200 15.009 -7.692 1.00 52.33 C ATOM 2246 OG1 THR B 46 10.119 15.848 -8.850 1.00 33.31 O ATOM 2247 CG2 THR B 46 9.125 15.409 -6.694 1.00 3.02 C ATOM 0 H THR B 46 12.394 14.542 -8.913 1.00 11.44 H new ATOM 0 HA THR B 46 11.696 16.083 -6.562 1.00 63.42 H new ATOM 0 HB THR B 46 10.036 13.971 -7.983 1.00 52.33 H new ATOM 0 HG1 THR B 46 9.242 16.284 -8.877 1.00 33.31 H new ATOM 0 HG21 THR B 46 8.144 15.324 -7.162 1.00 3.02 H new ATOM 0 HG22 THR B 46 9.171 14.751 -5.826 1.00 3.02 H new ATOM 0 HG23 THR B 46 9.288 16.439 -6.377 1.00 3.02 H new ATOM 2255 N ASP B 47 12.406 12.914 -6.450 1.00 1.43 N ATOM 2256 CA ASP B 47 12.636 11.778 -5.566 1.00 54.30 C ATOM 2257 C ASP B 47 13.645 12.132 -4.476 1.00 63.03 C ATOM 2258 O ASP B 47 13.639 11.542 -3.396 1.00 32.00 O ATOM 2259 CB ASP B 47 13.132 10.573 -6.366 1.00 61.00 C ATOM 2260 CG ASP B 47 14.630 10.611 -6.599 1.00 74.43 C ATOM 2261 OD1 ASP B 47 15.075 11.379 -7.478 1.00 53.32 O ATOM 2262 OD2 ASP B 47 15.358 9.871 -5.904 1.00 4.34 O ATOM 0 H ASP B 47 12.771 12.793 -7.395 1.00 1.43 H new ATOM 0 HA ASP B 47 11.689 11.523 -5.090 1.00 54.30 H new ATOM 0 HB2 ASP B 47 12.873 9.657 -5.836 1.00 61.00 H new ATOM 0 HB3 ASP B 47 12.618 10.542 -7.327 1.00 61.00 H new ATOM 2267 N VAL B 48 14.509 13.098 -4.769 1.00 74.22 N ATOM 2268 CA VAL B 48 15.523 13.532 -3.815 1.00 22.51 C ATOM 2269 C VAL B 48 15.043 14.734 -3.010 1.00 4.50 C ATOM 2270 O VAL B 48 15.146 14.754 -1.785 1.00 11.21 O ATOM 2271 CB VAL B 48 16.841 13.894 -4.525 1.00 0.11 C ATOM 2272 CG1 VAL B 48 17.850 14.445 -3.528 1.00 24.23 C ATOM 2273 CG2 VAL B 48 17.406 12.683 -5.252 1.00 54.21 C ATOM 0 H VAL B 48 14.527 13.595 -5.659 1.00 74.22 H new ATOM 0 HA VAL B 48 15.701 12.696 -3.139 1.00 22.51 H new ATOM 0 HB VAL B 48 16.634 14.668 -5.264 1.00 0.11 H new ATOM 0 HG11 VAL B 48 18.775 14.695 -4.047 1.00 24.23 H new ATOM 0 HG12 VAL B 48 17.444 15.340 -3.057 1.00 24.23 H new ATOM 0 HG13 VAL B 48 18.054 13.694 -2.764 1.00 24.23 H new ATOM 0 HG21 VAL B 48 18.337 12.958 -5.748 1.00 54.21 H new ATOM 0 HG22 VAL B 48 17.599 11.885 -4.535 1.00 54.21 H new ATOM 0 HG23 VAL B 48 16.688 12.337 -5.995 1.00 54.21 H new ATOM 2283 N MET B 49 14.519 15.736 -3.710 1.00 33.43 N ATOM 2284 CA MET B 49 14.022 16.943 -3.060 1.00 40.22 C ATOM 2285 C MET B 49 13.116 16.593 -1.883 1.00 4.22 C ATOM 2286 O MET B 49 13.298 17.099 -0.777 1.00 1.31 O ATOM 2287 CB MET B 49 13.262 17.812 -4.063 1.00 44.14 C ATOM 2288 CG MET B 49 12.638 19.051 -3.443 1.00 51.34 C ATOM 2289 SD MET B 49 10.876 19.194 -3.798 1.00 51.12 S ATOM 2290 CE MET B 49 10.200 18.009 -2.637 1.00 51.15 C ATOM 0 H MET B 49 14.428 15.736 -4.726 1.00 33.43 H new ATOM 0 HA MET B 49 14.879 17.501 -2.683 1.00 40.22 H new ATOM 0 HB2 MET B 49 13.944 18.117 -4.857 1.00 44.14 H new ATOM 0 HB3 MET B 49 12.478 17.214 -4.528 1.00 44.14 H new ATOM 0 HG2 MET B 49 12.786 19.026 -2.363 1.00 51.34 H new ATOM 0 HG3 MET B 49 13.153 19.937 -3.815 1.00 51.34 H new ATOM 0 HE1 MET B 49 9.158 18.254 -2.432 1.00 51.15 H new ATOM 0 HE2 MET B 49 10.260 17.007 -3.063 1.00 51.15 H new ATOM 0 HE3 MET B 49 10.770 18.043 -1.709 1.00 51.15 H new ATOM 2300 N MET B 50 12.142 15.723 -2.130 1.00 73.41 N ATOM 2301 CA MET B 50 11.209 15.305 -1.091 1.00 53.21 C ATOM 2302 C MET B 50 11.920 14.481 -0.022 1.00 3.12 C ATOM 2303 O MET B 50 11.523 14.483 1.142 1.00 20.05 O ATOM 2304 CB MET B 50 10.064 14.494 -1.700 1.00 34.20 C ATOM 2305 CG MET B 50 10.457 13.074 -2.073 1.00 34.23 C ATOM 2306 SD MET B 50 9.281 12.301 -3.201 1.00 14.43 S ATOM 2307 CE MET B 50 7.728 12.861 -2.507 1.00 65.11 C ATOM 0 H MET B 50 11.979 15.294 -3.041 1.00 73.41 H new ATOM 0 HA MET B 50 10.800 16.200 -0.622 1.00 53.21 H new ATOM 0 HB2 MET B 50 9.237 14.459 -0.991 1.00 34.20 H new ATOM 0 HB3 MET B 50 9.699 15.007 -2.590 1.00 34.20 H new ATOM 0 HG2 MET B 50 11.444 13.084 -2.535 1.00 34.23 H new ATOM 0 HG3 MET B 50 10.535 12.473 -1.167 1.00 34.23 H new ATOM 0 HE1 MET B 50 6.917 12.232 -2.875 1.00 65.11 H new ATOM 0 HE2 MET B 50 7.771 12.798 -1.420 1.00 65.11 H new ATOM 0 HE3 MET B 50 7.549 13.895 -2.803 1.00 65.11 H new ATOM 2317 N ASN B 51 12.972 13.777 -0.426 1.00 10.42 N ATOM 2318 CA ASN B 51 13.738 12.948 0.498 1.00 73.03 C ATOM 2319 C ASN B 51 14.467 13.808 1.525 1.00 51.31 C ATOM 2320 O ASN B 51 14.949 13.306 2.540 1.00 61.22 O ATOM 2321 CB ASN B 51 14.744 12.087 -0.270 1.00 41.34 C ATOM 2322 CG ASN B 51 14.241 10.675 -0.498 1.00 53.40 C ATOM 2323 OD1 ASN B 51 14.973 9.705 -0.301 1.00 40.12 O ATOM 2324 ND2 ASN B 51 12.986 10.554 -0.916 1.00 25.24 N ATOM 0 H ASN B 51 13.314 13.764 -1.387 1.00 10.42 H new ATOM 0 HA ASN B 51 13.041 12.297 1.026 1.00 73.03 H new ATOM 0 HB2 ASN B 51 14.958 12.553 -1.232 1.00 41.34 H new ATOM 0 HB3 ASN B 51 15.683 12.051 0.282 1.00 41.34 H new ATOM 0 HD21 ASN B 51 12.592 9.629 -1.087 1.00 25.24 H new ATOM 0 HD22 ASN B 51 12.416 11.386 -1.066 1.00 25.24 H new ATOM 2331 N ILE B 52 14.543 15.107 1.253 1.00 15.14 N ATOM 2332 CA ILE B 52 15.211 16.037 2.155 1.00 71.33 C ATOM 2333 C ILE B 52 14.217 16.687 3.112 1.00 63.34 C ATOM 2334 O ILE B 52 14.529 16.933 4.277 1.00 22.32 O ATOM 2335 CB ILE B 52 15.953 17.140 1.377 1.00 0.12 C ATOM 2336 CG1 ILE B 52 16.825 16.523 0.282 1.00 22.15 C ATOM 2337 CG2 ILE B 52 16.798 17.980 2.324 1.00 64.33 C ATOM 2338 CD1 ILE B 52 17.502 15.237 0.701 1.00 3.43 C ATOM 0 H ILE B 52 14.151 15.538 0.416 1.00 15.14 H new ATOM 0 HA ILE B 52 15.935 15.456 2.727 1.00 71.33 H new ATOM 0 HB ILE B 52 15.216 17.790 0.906 1.00 0.12 H new ATOM 0 HG12 ILE B 52 16.209 16.330 -0.596 1.00 22.15 H new ATOM 0 HG13 ILE B 52 17.586 17.245 -0.015 1.00 22.15 H new ATOM 0 HG21 ILE B 52 17.316 18.755 1.759 1.00 64.33 H new ATOM 0 HG22 ILE B 52 16.154 18.444 3.071 1.00 64.33 H new ATOM 0 HG23 ILE B 52 17.530 17.343 2.821 1.00 64.33 H new ATOM 0 HD11 ILE B 52 18.103 14.857 -0.125 1.00 3.43 H new ATOM 0 HD12 ILE B 52 18.145 15.428 1.560 1.00 3.43 H new ATOM 0 HD13 ILE B 52 16.746 14.499 0.970 1.00 3.43 H new ATOM 2350 N LEU B 53 13.017 16.961 2.612 1.00 63.51 N ATOM 2351 CA LEU B 53 11.973 17.580 3.422 1.00 30.02 C ATOM 2352 C LEU B 53 11.220 16.532 4.235 1.00 3.01 C ATOM 2353 O LEU B 53 10.647 16.839 5.280 1.00 32.54 O ATOM 2354 CB LEU B 53 10.996 18.349 2.530 1.00 71.32 C ATOM 2355 CG LEU B 53 11.102 19.874 2.578 1.00 24.34 C ATOM 2356 CD1 LEU B 53 12.554 20.313 2.463 1.00 64.42 C ATOM 2357 CD2 LEU B 53 10.265 20.501 1.473 1.00 70.41 C ATOM 0 H LEU B 53 12.743 16.764 1.649 1.00 63.51 H new ATOM 0 HA LEU B 53 12.449 18.276 4.113 1.00 30.02 H new ATOM 0 HB2 LEU B 53 11.145 18.027 1.500 1.00 71.32 H new ATOM 0 HB3 LEU B 53 9.981 18.066 2.809 1.00 71.32 H new ATOM 0 HG LEU B 53 10.716 20.216 3.538 1.00 24.34 H new ATOM 0 HD11 LEU B 53 12.609 21.401 2.499 1.00 64.42 H new ATOM 0 HD12 LEU B 53 13.128 19.893 3.289 1.00 64.42 H new ATOM 0 HD13 LEU B 53 12.967 19.960 1.518 1.00 64.42 H new ATOM 0 HD21 LEU B 53 10.352 21.586 1.522 1.00 70.41 H new ATOM 0 HD22 LEU B 53 10.621 20.152 0.504 1.00 70.41 H new ATOM 0 HD23 LEU B 53 9.221 20.215 1.600 1.00 70.41 H new ATOM 2369 N GLN B 54 11.230 15.295 3.750 1.00 45.30 N ATOM 2370 CA GLN B 54 10.550 14.202 4.433 1.00 4.44 C ATOM 2371 C GLN B 54 11.165 13.951 5.805 1.00 73.55 C ATOM 2372 O GLN B 54 10.564 13.293 6.657 1.00 22.03 O ATOM 2373 CB GLN B 54 10.616 12.927 3.590 1.00 31.43 C ATOM 2374 CG GLN B 54 11.999 12.298 3.544 1.00 54.24 C ATOM 2375 CD GLN B 54 11.997 10.929 2.892 1.00 53.44 C ATOM 2376 OE1 GLN B 54 12.632 9.995 3.382 1.00 62.11 O ATOM 2377 NE2 GLN B 54 11.280 10.804 1.781 1.00 32.34 N ATOM 0 H GLN B 54 11.701 15.025 2.887 1.00 45.30 H new ATOM 0 HA GLN B 54 9.506 14.485 4.570 1.00 4.44 H new ATOM 0 HB2 GLN B 54 9.909 12.200 3.990 1.00 31.43 H new ATOM 0 HB3 GLN B 54 10.297 13.157 2.573 1.00 31.43 H new ATOM 0 HG2 GLN B 54 12.675 12.956 2.997 1.00 54.24 H new ATOM 0 HG3 GLN B 54 12.389 12.212 4.558 1.00 54.24 H new ATOM 0 HE21 GLN B 54 10.769 11.606 1.411 1.00 32.34 H new ATOM 0 HE22 GLN B 54 11.240 9.906 1.298 1.00 32.34 H new ATOM 2386 N THR B 55 12.368 14.476 6.015 1.00 55.12 N ATOM 2387 CA THR B 55 13.065 14.308 7.284 1.00 13.51 C ATOM 2388 C THR B 55 12.253 14.885 8.438 1.00 42.11 C ATOM 2389 O THR B 55 11.438 15.791 8.264 1.00 72.25 O ATOM 2390 CB THR B 55 14.450 14.984 7.258 1.00 53.41 C ATOM 2391 OG1 THR B 55 14.325 16.342 6.823 1.00 50.54 O ATOM 2392 CG2 THR B 55 15.399 14.236 6.333 1.00 63.21 C ATOM 0 H THR B 55 12.880 15.022 5.322 1.00 55.12 H new ATOM 0 HA THR B 55 13.194 13.236 7.434 1.00 13.51 H new ATOM 0 HB THR B 55 14.859 14.963 8.268 1.00 53.41 H new ATOM 0 HG1 THR B 55 14.203 16.364 5.851 1.00 50.54 H new ATOM 0 HG21 THR B 55 16.370 14.731 6.330 1.00 63.21 H new ATOM 0 HG22 THR B 55 15.515 13.210 6.683 1.00 63.21 H new ATOM 0 HG23 THR B 55 14.992 14.230 5.322 1.00 63.21 H new ATOM 2400 N PRO B 56 12.480 14.350 9.647 1.00 31.25 N ATOM 2401 CA PRO B 56 11.781 14.797 10.854 1.00 41.22 C ATOM 2402 C PRO B 56 12.205 16.197 11.286 1.00 3.50 C ATOM 2403 O PRO B 56 11.420 16.938 11.877 1.00 61.54 O ATOM 2404 CB PRO B 56 12.193 13.765 11.907 1.00 43.23 C ATOM 2405 CG PRO B 56 13.504 13.242 11.431 1.00 22.11 C ATOM 2406 CD PRO B 56 13.438 13.267 9.928 1.00 60.25 C ATOM 0 HA PRO B 56 10.704 14.862 10.699 1.00 41.22 H new ATOM 0 HB2 PRO B 56 12.283 14.220 12.893 1.00 43.23 H new ATOM 0 HB3 PRO B 56 11.455 12.967 11.990 1.00 43.23 H new ATOM 0 HG2 PRO B 56 14.326 13.858 11.796 1.00 22.11 H new ATOM 0 HG3 PRO B 56 13.677 12.230 11.797 1.00 22.11 H new ATOM 0 HD2 PRO B 56 14.414 13.469 9.486 1.00 60.25 H new ATOM 0 HD3 PRO B 56 13.097 12.314 9.525 1.00 60.25 H new ATOM 2414 N GLN B 57 13.451 16.551 10.987 1.00 42.31 N ATOM 2415 CA GLN B 57 13.978 17.862 11.345 1.00 55.32 C ATOM 2416 C GLN B 57 13.435 18.940 10.414 1.00 1.51 C ATOM 2417 O GLN B 57 13.197 20.074 10.831 1.00 23.51 O ATOM 2418 CB GLN B 57 15.507 17.851 11.294 1.00 61.00 C ATOM 2419 CG GLN B 57 16.068 17.733 9.886 1.00 72.54 C ATOM 2420 CD GLN B 57 17.317 16.876 9.827 1.00 74.05 C ATOM 2421 OE1 GLN B 57 17.849 16.461 10.857 1.00 63.42 O ATOM 2422 NE2 GLN B 57 17.793 16.606 8.616 1.00 41.13 N ATOM 0 H GLN B 57 14.113 15.949 10.498 1.00 42.31 H new ATOM 0 HA GLN B 57 13.656 18.090 12.361 1.00 55.32 H new ATOM 0 HB2 GLN B 57 15.884 18.766 11.751 1.00 61.00 H new ATOM 0 HB3 GLN B 57 15.876 17.019 11.894 1.00 61.00 H new ATOM 0 HG2 GLN B 57 15.308 17.307 9.230 1.00 72.54 H new ATOM 0 HG3 GLN B 57 16.296 18.728 9.505 1.00 72.54 H new ATOM 0 HE21 GLN B 57 17.320 16.971 7.789 1.00 41.13 H new ATOM 0 HE22 GLN B 57 18.631 16.034 8.513 1.00 41.13 H new ATOM 2431 N PHE B 58 13.240 18.580 9.150 1.00 72.25 N ATOM 2432 CA PHE B 58 12.724 19.518 8.158 1.00 73.52 C ATOM 2433 C PHE B 58 11.282 19.181 7.790 1.00 1.21 C ATOM 2434 O PHE B 58 10.909 19.194 6.616 1.00 54.13 O ATOM 2435 CB PHE B 58 13.601 19.499 6.904 1.00 21.34 C ATOM 2436 CG PHE B 58 15.017 19.933 7.156 1.00 1.42 C ATOM 2437 CD1 PHE B 58 15.296 21.225 7.568 1.00 54.32 C ATOM 2438 CD2 PHE B 58 16.068 19.046 6.980 1.00 51.33 C ATOM 2439 CE1 PHE B 58 16.599 21.627 7.799 1.00 23.24 C ATOM 2440 CE2 PHE B 58 17.372 19.442 7.210 1.00 4.43 C ATOM 2441 CZ PHE B 58 17.638 20.734 7.621 1.00 13.33 C ATOM 0 H PHE B 58 13.431 17.646 8.788 1.00 72.25 H new ATOM 0 HA PHE B 58 12.745 20.517 8.593 1.00 73.52 H new ATOM 0 HB2 PHE B 58 13.607 18.491 6.490 1.00 21.34 H new ATOM 0 HB3 PHE B 58 13.158 20.151 6.151 1.00 21.34 H new ATOM 0 HD1 PHE B 58 14.487 21.927 7.711 1.00 54.32 H new ATOM 0 HD2 PHE B 58 15.865 18.035 6.660 1.00 51.33 H new ATOM 0 HE1 PHE B 58 16.804 22.638 8.118 1.00 23.24 H new ATOM 0 HE2 PHE B 58 18.182 18.742 7.069 1.00 4.43 H new ATOM 0 HZ PHE B 58 18.656 21.045 7.803 1.00 13.33 H new ATOM 2451 N THR B 59 10.474 18.880 8.801 1.00 3.42 N ATOM 2452 CA THR B 59 9.074 18.539 8.586 1.00 32.14 C ATOM 2453 C THR B 59 8.199 19.788 8.574 1.00 21.44 C ATOM 2454 O THR B 59 7.213 19.861 7.842 1.00 24.22 O ATOM 2455 CB THR B 59 8.557 17.574 9.669 1.00 53.35 C ATOM 2456 OG1 THR B 59 7.201 17.207 9.391 1.00 50.44 O ATOM 2457 CG2 THR B 59 8.644 18.211 11.047 1.00 63.52 C ATOM 0 H THR B 59 10.766 18.865 9.778 1.00 3.42 H new ATOM 0 HA THR B 59 9.015 18.048 7.615 1.00 32.14 H new ATOM 0 HB THR B 59 9.183 16.682 9.659 1.00 53.35 H new ATOM 0 HG1 THR B 59 6.880 16.592 10.083 1.00 50.44 H new ATOM 0 HG21 THR B 59 8.273 17.511 11.796 1.00 63.52 H new ATOM 0 HG22 THR B 59 9.682 18.462 11.267 1.00 63.52 H new ATOM 0 HG23 THR B 59 8.039 19.118 11.068 1.00 63.52 H new ATOM 2465 N LYS B 60 8.567 20.770 9.391 1.00 13.34 N ATOM 2466 CA LYS B 60 7.817 22.017 9.474 1.00 2.41 C ATOM 2467 C LYS B 60 8.092 22.899 8.261 1.00 33.42 C ATOM 2468 O LYS B 60 7.349 23.842 7.987 1.00 21.23 O ATOM 2469 CB LYS B 60 8.180 22.769 10.757 1.00 14.22 C ATOM 2470 CG LYS B 60 9.667 23.049 10.898 1.00 61.42 C ATOM 2471 CD LYS B 60 9.970 23.819 12.172 1.00 54.34 C ATOM 2472 CE LYS B 60 11.143 23.211 12.926 1.00 31.41 C ATOM 2473 NZ LYS B 60 11.443 23.956 14.180 1.00 31.11 N ATOM 0 H LYS B 60 9.380 20.726 10.005 1.00 13.34 H new ATOM 0 HA LYS B 60 6.755 21.773 9.490 1.00 2.41 H new ATOM 0 HB2 LYS B 60 7.637 23.714 10.780 1.00 14.22 H new ATOM 0 HB3 LYS B 60 7.845 22.188 11.616 1.00 14.22 H new ATOM 0 HG2 LYS B 60 10.217 22.108 10.901 1.00 61.42 H new ATOM 0 HG3 LYS B 60 10.014 23.619 10.036 1.00 61.42 H new ATOM 0 HD2 LYS B 60 10.193 24.857 11.926 1.00 54.34 H new ATOM 0 HD3 LYS B 60 9.088 23.825 12.813 1.00 54.34 H new ATOM 0 HE2 LYS B 60 10.921 22.171 13.166 1.00 31.41 H new ATOM 0 HE3 LYS B 60 12.025 23.209 12.285 1.00 31.41 H new ATOM 0 HZ1 LYS B 60 12.248 23.510 14.664 1.00 31.11 H new ATOM 0 HZ2 LYS B 60 11.680 24.942 13.950 1.00 31.11 H new ATOM 0 HZ3 LYS B 60 10.610 23.937 14.803 1.00 31.11 H new ATOM 2487 N TYR B 61 9.160 22.585 7.537 1.00 63.31 N ATOM 2488 CA TYR B 61 9.532 23.350 6.353 1.00 12.35 C ATOM 2489 C TYR B 61 9.266 22.550 5.082 1.00 43.03 C ATOM 2490 O TYR B 61 10.184 22.252 4.317 1.00 15.42 O ATOM 2491 CB TYR B 61 11.008 23.747 6.419 1.00 51.41 C ATOM 2492 CG TYR B 61 11.461 24.164 7.800 1.00 52.31 C ATOM 2493 CD1 TYR B 61 11.069 25.381 8.344 1.00 43.25 C ATOM 2494 CD2 TYR B 61 12.282 23.342 8.562 1.00 24.22 C ATOM 2495 CE1 TYR B 61 11.481 25.767 9.604 1.00 20.34 C ATOM 2496 CE2 TYR B 61 12.699 23.718 9.824 1.00 72.43 C ATOM 2497 CZ TYR B 61 12.295 24.932 10.341 1.00 62.03 C ATOM 2498 OH TYR B 61 12.708 25.312 11.598 1.00 73.32 O ATOM 0 H TYR B 61 9.783 21.806 7.749 1.00 63.31 H new ATOM 0 HA TYR B 61 8.921 24.252 6.328 1.00 12.35 H new ATOM 0 HB2 TYR B 61 11.617 22.907 6.084 1.00 51.41 H new ATOM 0 HB3 TYR B 61 11.186 24.567 5.724 1.00 51.41 H new ATOM 0 HD1 TYR B 61 10.430 26.037 7.771 1.00 43.25 H new ATOM 0 HD2 TYR B 61 12.600 22.391 8.160 1.00 24.22 H new ATOM 0 HE1 TYR B 61 11.168 26.717 10.010 1.00 20.34 H new ATOM 0 HE2 TYR B 61 13.337 23.066 10.402 1.00 72.43 H new ATOM 0 HH TYR B 61 12.160 26.063 11.909 1.00 73.32 H new ATOM 2508 N THR B 62 8.001 22.206 4.861 1.00 34.42 N ATOM 2509 CA THR B 62 7.612 21.440 3.684 1.00 72.42 C ATOM 2510 C THR B 62 7.074 22.352 2.587 1.00 31.24 C ATOM 2511 O THR B 62 7.677 22.481 1.521 1.00 31.52 O ATOM 2512 CB THR B 62 6.543 20.385 4.028 1.00 33.53 C ATOM 2513 OG1 THR B 62 6.353 20.324 5.446 1.00 23.01 O ATOM 2514 CG2 THR B 62 6.946 19.015 3.505 1.00 4.41 C ATOM 0 H THR B 62 7.228 22.446 5.482 1.00 34.42 H new ATOM 0 HA THR B 62 8.509 20.935 3.326 1.00 72.42 H new ATOM 0 HB THR B 62 5.608 20.678 3.549 1.00 33.53 H new ATOM 0 HG1 THR B 62 7.175 20.003 5.873 1.00 23.01 H new ATOM 0 HG21 THR B 62 6.176 18.287 3.760 1.00 4.41 H new ATOM 0 HG22 THR B 62 7.060 19.058 2.422 1.00 4.41 H new ATOM 0 HG23 THR B 62 7.891 18.716 3.958 1.00 4.41 H new ATOM 2522 N LEU B 63 5.938 22.986 2.855 1.00 12.13 N ATOM 2523 CA LEU B 63 5.320 23.889 1.891 1.00 1.11 C ATOM 2524 C LEU B 63 5.476 25.342 2.326 1.00 22.24 C ATOM 2525 O LEU B 63 5.052 26.260 1.624 1.00 42.13 O ATOM 2526 CB LEU B 63 3.836 23.551 1.725 1.00 73.21 C ATOM 2527 CG LEU B 63 2.870 24.308 2.637 1.00 75.31 C ATOM 2528 CD1 LEU B 63 2.279 25.507 1.913 1.00 21.21 C ATOM 2529 CD2 LEU B 63 1.766 23.382 3.129 1.00 54.43 C ATOM 0 H LEU B 63 5.426 22.891 3.732 1.00 12.13 H new ATOM 0 HA LEU B 63 5.826 23.760 0.934 1.00 1.11 H new ATOM 0 HB2 LEU B 63 3.553 23.744 0.690 1.00 73.21 H new ATOM 0 HB3 LEU B 63 3.706 22.483 1.898 1.00 73.21 H new ATOM 0 HG LEU B 63 3.426 24.671 3.502 1.00 75.31 H new ATOM 0 HD11 LEU B 63 1.594 26.033 2.579 1.00 21.21 H new ATOM 0 HD12 LEU B 63 3.081 26.181 1.611 1.00 21.21 H new ATOM 0 HD13 LEU B 63 1.738 25.168 1.030 1.00 21.21 H new ATOM 0 HD21 LEU B 63 1.087 23.937 3.777 1.00 54.43 H new ATOM 0 HD22 LEU B 63 1.213 22.989 2.276 1.00 54.43 H new ATOM 0 HD23 LEU B 63 2.206 22.556 3.687 1.00 54.43 H new ATOM 2541 N TRP B 64 6.090 25.543 3.486 1.00 1.21 N ATOM 2542 CA TRP B 64 6.305 26.885 4.015 1.00 43.23 C ATOM 2543 C TRP B 64 6.946 27.787 2.965 1.00 72.02 C ATOM 2544 O TRP B 64 6.794 29.008 3.006 1.00 64.33 O ATOM 2545 CB TRP B 64 7.186 26.829 5.264 1.00 62.22 C ATOM 2546 CG TRP B 64 8.629 27.133 4.987 1.00 4.30 C ATOM 2547 CD1 TRP B 64 9.336 28.216 5.426 1.00 74.40 C ATOM 2548 CD2 TRP B 64 9.537 26.345 4.210 1.00 4.15 C ATOM 2549 NE1 TRP B 64 10.630 28.149 4.966 1.00 54.00 N ATOM 2550 CE2 TRP B 64 10.778 27.011 4.219 1.00 33.35 C ATOM 2551 CE3 TRP B 64 9.422 25.142 3.508 1.00 30.31 C ATOM 2552 CZ2 TRP B 64 11.894 26.512 3.553 1.00 50.25 C ATOM 2553 CZ3 TRP B 64 10.531 24.649 2.846 1.00 42.23 C ATOM 2554 CH2 TRP B 64 11.754 25.332 2.874 1.00 30.42 C ATOM 0 H TRP B 64 6.448 24.794 4.079 1.00 1.21 H new ATOM 0 HA TRP B 64 5.335 27.303 4.283 1.00 43.23 H new ATOM 0 HB2 TRP B 64 6.807 27.539 5.999 1.00 62.22 H new ATOM 0 HB3 TRP B 64 7.110 25.837 5.710 1.00 62.22 H new ATOM 0 HD1 TRP B 64 8.938 29.008 6.043 1.00 74.40 H new ATOM 0 HE1 TRP B 64 11.361 28.836 5.151 1.00 54.00 H new ATOM 0 HE3 TRP B 64 8.484 24.607 3.483 1.00 30.31 H new ATOM 0 HZ2 TRP B 64 12.837 27.038 3.571 1.00 50.25 H new ATOM 0 HZ3 TRP B 64 10.453 23.722 2.298 1.00 42.23 H new ATOM 0 HH2 TRP B 64 12.603 24.919 2.349 1.00 30.42 H new ATOM 2565 N PHE B 65 7.664 27.179 2.027 1.00 3.22 N ATOM 2566 CA PHE B 65 8.328 27.927 0.967 1.00 51.24 C ATOM 2567 C PHE B 65 7.863 27.455 -0.407 1.00 44.13 C ATOM 2568 O PHE B 65 7.815 28.233 -1.359 1.00 61.53 O ATOM 2569 CB PHE B 65 9.847 27.777 1.083 1.00 33.14 C ATOM 2570 CG PHE B 65 10.534 29.009 1.599 1.00 11.11 C ATOM 2571 CD1 PHE B 65 9.946 29.783 2.587 1.00 22.30 C ATOM 2572 CD2 PHE B 65 11.767 29.392 1.097 1.00 2.15 C ATOM 2573 CE1 PHE B 65 10.575 30.918 3.065 1.00 2.32 C ATOM 2574 CE2 PHE B 65 12.401 30.525 1.572 1.00 4.54 C ATOM 2575 CZ PHE B 65 11.804 31.289 2.556 1.00 1.24 C ATOM 0 H PHE B 65 7.801 26.169 1.980 1.00 3.22 H new ATOM 0 HA PHE B 65 8.063 28.978 1.079 1.00 51.24 H new ATOM 0 HB2 PHE B 65 10.072 26.941 1.745 1.00 33.14 H new ATOM 0 HB3 PHE B 65 10.255 27.526 0.104 1.00 33.14 H new ATOM 0 HD1 PHE B 65 8.985 29.496 2.988 1.00 22.30 H new ATOM 0 HD2 PHE B 65 12.238 28.799 0.327 1.00 2.15 H new ATOM 0 HE1 PHE B 65 10.106 31.513 3.835 1.00 2.32 H new ATOM 0 HE2 PHE B 65 13.363 30.813 1.174 1.00 4.54 H new ATOM 0 HZ PHE B 65 12.298 32.175 2.927 1.00 1.24 H new ATOM 2585 N MET B 66 7.521 26.174 -0.501 1.00 55.55 N ATOM 2586 CA MET B 66 7.058 25.598 -1.758 1.00 63.34 C ATOM 2587 C MET B 66 5.949 26.447 -2.370 1.00 2.10 C ATOM 2588 O MET B 66 5.830 26.546 -3.593 1.00 23.20 O ATOM 2589 CB MET B 66 6.557 24.169 -1.535 1.00 52.14 C ATOM 2590 CG MET B 66 6.866 23.230 -2.689 1.00 45.22 C ATOM 2591 SD MET B 66 5.424 22.289 -3.224 1.00 33.32 S ATOM 2592 CE MET B 66 4.480 23.561 -4.060 1.00 54.53 C ATOM 0 H MET B 66 7.556 25.516 0.278 1.00 55.55 H new ATOM 0 HA MET B 66 7.900 25.577 -2.450 1.00 63.34 H new ATOM 0 HB2 MET B 66 7.007 23.773 -0.625 1.00 52.14 H new ATOM 0 HB3 MET B 66 5.479 24.192 -1.374 1.00 52.14 H new ATOM 0 HG2 MET B 66 7.250 23.808 -3.530 1.00 45.22 H new ATOM 0 HG3 MET B 66 7.655 22.540 -2.390 1.00 45.22 H new ATOM 0 HE1 MET B 66 3.600 23.810 -3.467 1.00 54.53 H new ATOM 0 HE2 MET B 66 5.098 24.450 -4.184 1.00 54.53 H new ATOM 0 HE3 MET B 66 4.166 23.197 -5.039 1.00 54.53 H new ATOM 2602 N THR B 67 5.138 27.061 -1.513 1.00 4.01 N ATOM 2603 CA THR B 67 4.037 27.901 -1.970 1.00 64.01 C ATOM 2604 C THR B 67 3.998 29.219 -1.205 1.00 4.11 C ATOM 2605 O THR B 67 2.999 29.935 -1.237 1.00 25.32 O ATOM 2606 CB THR B 67 2.682 27.187 -1.811 1.00 50.32 C ATOM 2607 OG1 THR B 67 2.805 25.811 -2.188 1.00 43.04 O ATOM 2608 CG2 THR B 67 1.614 27.858 -2.662 1.00 73.01 C ATOM 0 H THR B 67 5.223 26.992 -0.499 1.00 4.01 H new ATOM 0 HA THR B 67 4.210 28.103 -3.027 1.00 64.01 H new ATOM 0 HB THR B 67 2.384 27.251 -0.765 1.00 50.32 H new ATOM 0 HG1 THR B 67 1.939 25.364 -2.082 1.00 43.04 H new ATOM 0 HG21 THR B 67 0.666 27.336 -2.533 1.00 73.01 H new ATOM 0 HG22 THR B 67 1.502 28.897 -2.352 1.00 73.01 H new ATOM 0 HG23 THR B 67 1.909 27.822 -3.711 1.00 73.01 H new ATOM 2616 N ASN B 68 5.092 29.532 -0.519 1.00 11.41 N ATOM 2617 CA ASN B 68 5.183 30.766 0.254 1.00 74.22 C ATOM 2618 C ASN B 68 4.007 30.890 1.218 1.00 14.40 C ATOM 2619 O ASN B 68 3.434 31.967 1.377 1.00 0.14 O ATOM 2620 CB ASN B 68 5.221 31.976 -0.680 1.00 72.14 C ATOM 2621 CG ASN B 68 6.593 32.195 -1.288 1.00 24.42 C ATOM 2622 OD1 ASN B 68 7.596 32.259 -0.577 1.00 31.00 O ATOM 2623 ND2 ASN B 68 6.643 32.311 -2.609 1.00 25.24 N ATOM 0 H ASN B 68 5.928 28.949 -0.482 1.00 11.41 H new ATOM 0 HA ASN B 68 6.105 30.735 0.834 1.00 74.22 H new ATOM 0 HB2 ASN B 68 4.491 31.839 -1.478 1.00 72.14 H new ATOM 0 HB3 ASN B 68 4.925 32.868 -0.127 1.00 72.14 H new ATOM 0 HD21 ASN B 68 7.538 32.460 -3.074 1.00 25.24 H new ATOM 0 HD22 ASN B 68 5.786 32.252 -3.159 1.00 25.24 H new ATOM 2630 N GLN B 69 3.655 29.780 1.859 1.00 42.21 N ATOM 2631 CA GLN B 69 2.547 29.765 2.808 1.00 70.13 C ATOM 2632 C GLN B 69 2.911 28.970 4.057 1.00 10.34 C ATOM 2633 O GLN B 69 3.110 27.756 3.995 1.00 41.40 O ATOM 2634 CB GLN B 69 1.297 29.171 2.156 1.00 35.41 C ATOM 2635 CG GLN B 69 0.003 29.575 2.843 1.00 60.42 C ATOM 2636 CD GLN B 69 -0.512 30.921 2.373 1.00 22.34 C ATOM 2637 OE1 GLN B 69 -0.996 31.056 1.249 1.00 42.13 O ATOM 2638 NE2 GLN B 69 -0.411 31.928 3.233 1.00 14.11 N ATOM 0 H GLN B 69 4.120 28.880 1.739 1.00 42.21 H new ATOM 0 HA GLN B 69 2.340 30.794 3.102 1.00 70.13 H new ATOM 0 HB2 GLN B 69 1.258 29.484 1.113 1.00 35.41 H new ATOM 0 HB3 GLN B 69 1.377 28.084 2.160 1.00 35.41 H new ATOM 0 HG2 GLN B 69 -0.756 28.815 2.656 1.00 60.42 H new ATOM 0 HG3 GLN B 69 0.163 29.608 3.921 1.00 60.42 H new ATOM 0 HE21 GLN B 69 -0.003 31.772 4.155 1.00 14.11 H new ATOM 0 HE22 GLN B 69 -0.741 32.857 2.972 1.00 14.11 H new ATOM 2647 N ILE B 70 2.997 29.660 5.189 1.00 24.34 N ATOM 2648 CA ILE B 70 3.336 29.017 6.452 1.00 24.43 C ATOM 2649 C ILE B 70 2.096 28.435 7.123 1.00 41.10 C ATOM 2650 O ILE B 70 1.102 29.132 7.323 1.00 43.13 O ATOM 2651 CB ILE B 70 4.016 30.002 7.421 1.00 12.12 C ATOM 2652 CG1 ILE B 70 3.138 31.239 7.624 1.00 1.24 C ATOM 2653 CG2 ILE B 70 5.387 30.399 6.896 1.00 40.03 C ATOM 2654 CD1 ILE B 70 2.621 31.388 9.037 1.00 23.21 C ATOM 0 H ILE B 70 2.836 30.665 5.257 1.00 24.34 H new ATOM 0 HA ILE B 70 4.032 28.211 6.219 1.00 24.43 H new ATOM 0 HB ILE B 70 4.146 29.510 8.385 1.00 12.12 H new ATOM 0 HG12 ILE B 70 3.710 32.128 7.360 1.00 1.24 H new ATOM 0 HG13 ILE B 70 2.291 31.190 6.939 1.00 1.24 H new ATOM 0 HG21 ILE B 70 5.855 31.095 7.592 1.00 40.03 H new ATOM 0 HG22 ILE B 70 6.010 29.510 6.798 1.00 40.03 H new ATOM 0 HG23 ILE B 70 5.279 30.876 5.922 1.00 40.03 H new ATOM 0 HD11 ILE B 70 2.007 32.286 9.107 1.00 23.21 H new ATOM 0 HD12 ILE B 70 2.021 30.516 9.299 1.00 23.21 H new ATOM 0 HD13 ILE B 70 3.462 31.469 9.725 1.00 23.21 H new ATOM 2666 N ALA B 71 2.163 27.154 7.470 1.00 31.41 N ATOM 2667 CA ALA B 71 1.048 26.479 8.122 1.00 42.14 C ATOM 2668 C ALA B 71 1.396 26.108 9.560 1.00 13.21 C ATOM 2669 O ALA B 71 1.655 24.949 9.882 1.00 44.11 O ATOM 2670 CB ALA B 71 0.649 25.239 7.337 1.00 21.42 C ATOM 0 H ALA B 71 2.979 26.563 7.310 1.00 31.41 H new ATOM 0 HA ALA B 71 0.203 27.167 8.146 1.00 42.14 H new ATOM 0 HB1 ALA B 71 -0.185 24.745 7.836 1.00 21.42 H new ATOM 0 HB2 ALA B 71 0.350 25.527 6.329 1.00 21.42 H new ATOM 0 HB3 ALA B 71 1.496 24.555 7.282 1.00 21.42 H new ATOM 2676 N PRO B 72 1.403 27.115 10.446 1.00 64.10 N ATOM 2677 CA PRO B 72 1.719 26.919 11.864 1.00 11.04 C ATOM 2678 C PRO B 72 0.626 26.149 12.599 1.00 33.42 C ATOM 2679 O PRO B 72 0.798 25.762 13.755 1.00 25.43 O ATOM 2680 CB PRO B 72 1.823 28.347 12.406 1.00 2.43 C ATOM 2681 CG PRO B 72 0.979 29.162 11.487 1.00 51.11 C ATOM 2682 CD PRO B 72 1.104 28.522 10.133 1.00 31.23 C ATOM 0 HA PRO B 72 2.625 26.330 12.002 1.00 11.04 H new ATOM 0 HB2 PRO B 72 1.463 28.408 13.433 1.00 2.43 H new ATOM 0 HB3 PRO B 72 2.856 28.695 12.409 1.00 2.43 H new ATOM 0 HG2 PRO B 72 -0.059 29.174 11.819 1.00 51.11 H new ATOM 0 HG3 PRO B 72 1.318 30.198 11.462 1.00 51.11 H new ATOM 0 HD2 PRO B 72 0.184 28.618 9.557 1.00 31.23 H new ATOM 0 HD3 PRO B 72 1.899 28.980 9.544 1.00 31.23 H new ATOM 2690 N GLU B 73 -0.496 25.931 11.922 1.00 4.23 N ATOM 2691 CA GLU B 73 -1.616 25.207 12.512 1.00 61.34 C ATOM 2692 C GLU B 73 -1.294 23.722 12.645 1.00 54.44 C ATOM 2693 O GLU B 73 -1.873 23.022 13.477 1.00 31.22 O ATOM 2694 CB GLU B 73 -2.876 25.393 11.665 1.00 60.13 C ATOM 2695 CG GLU B 73 -4.139 25.586 12.487 1.00 64.33 C ATOM 2696 CD GLU B 73 -4.387 27.040 12.842 1.00 11.13 C ATOM 2697 OE1 GLU B 73 -3.880 27.488 13.891 1.00 33.02 O ATOM 2698 OE2 GLU B 73 -5.089 27.726 12.071 1.00 41.10 O ATOM 0 H GLU B 73 -0.654 26.245 10.965 1.00 4.23 H new ATOM 0 HA GLU B 73 -1.794 25.613 13.508 1.00 61.34 H new ATOM 0 HB2 GLU B 73 -2.741 26.256 11.013 1.00 60.13 H new ATOM 0 HB3 GLU B 73 -3.002 24.523 11.020 1.00 60.13 H new ATOM 0 HG2 GLU B 73 -4.993 25.201 11.930 1.00 64.33 H new ATOM 0 HG3 GLU B 73 -4.065 25.000 13.403 1.00 64.33 H new ATOM 2705 N SER B 74 -0.367 23.247 11.820 1.00 3.13 N ATOM 2706 CA SER B 74 0.029 21.844 11.842 1.00 54.43 C ATOM 2707 C SER B 74 1.525 21.705 12.116 1.00 41.34 C ATOM 2708 O SER B 74 2.086 20.615 12.024 1.00 62.25 O ATOM 2709 CB SER B 74 -0.321 21.171 10.513 1.00 12.33 C ATOM 2710 OG SER B 74 -1.541 20.458 10.608 1.00 21.43 O ATOM 0 H SER B 74 0.124 23.813 11.128 1.00 3.13 H new ATOM 0 HA SER B 74 -0.518 21.351 12.646 1.00 54.43 H new ATOM 0 HB2 SER B 74 -0.397 21.925 9.729 1.00 12.33 H new ATOM 0 HB3 SER B 74 0.480 20.490 10.224 1.00 12.33 H new ATOM 0 HG SER B 74 -1.417 19.550 10.260 1.00 21.43 H new ATOM 2716 N GLY B 75 2.163 22.821 12.452 1.00 32.12 N ATOM 2717 CA GLY B 75 3.586 22.805 12.734 1.00 40.12 C ATOM 2718 C GLY B 75 4.423 23.126 11.512 1.00 61.53 C ATOM 2719 O GLY B 75 5.343 22.383 11.170 1.00 74.03 O ATOM 0 H GLY B 75 1.720 23.736 12.534 1.00 32.12 H new ATOM 0 HA2 GLY B 75 3.805 23.527 13.521 1.00 40.12 H new ATOM 0 HA3 GLY B 75 3.867 21.823 13.115 1.00 40.12 H new ATOM 2723 N GLN B 76 4.104 24.234 10.852 1.00 5.14 N ATOM 2724 CA GLN B 76 4.832 24.650 9.659 1.00 30.43 C ATOM 2725 C GLN B 76 5.109 26.149 9.685 1.00 1.04 C ATOM 2726 O GLN B 76 4.191 26.961 9.567 1.00 20.13 O ATOM 2727 CB GLN B 76 4.042 24.286 8.401 1.00 34.10 C ATOM 2728 CG GLN B 76 3.424 22.897 8.450 1.00 32.22 C ATOM 2729 CD GLN B 76 4.465 21.796 8.425 1.00 51.40 C ATOM 2730 OE1 GLN B 76 4.437 20.879 9.248 1.00 11.02 O ATOM 2731 NE2 GLN B 76 5.391 21.877 7.477 1.00 72.22 N ATOM 0 H GLN B 76 3.346 24.860 11.123 1.00 5.14 H new ATOM 0 HA GLN B 76 5.786 24.124 9.645 1.00 30.43 H new ATOM 0 HB2 GLN B 76 3.251 25.021 8.253 1.00 34.10 H new ATOM 0 HB3 GLN B 76 4.702 24.350 7.536 1.00 34.10 H new ATOM 0 HG2 GLN B 76 2.822 22.803 9.354 1.00 32.22 H new ATOM 0 HG3 GLN B 76 2.749 22.773 7.603 1.00 32.22 H new ATOM 0 HE21 GLN B 76 5.377 22.653 6.816 1.00 72.22 H new ATOM 0 HE22 GLN B 76 6.116 21.163 7.410 1.00 72.22 H new ATOM 2740 N ILE B 77 6.378 26.509 9.840 1.00 41.52 N ATOM 2741 CA ILE B 77 6.775 27.911 9.881 1.00 50.31 C ATOM 2742 C ILE B 77 8.151 28.111 9.256 1.00 5.22 C ATOM 2743 O ILE B 77 8.876 27.148 9.003 1.00 61.33 O ATOM 2744 CB ILE B 77 6.795 28.450 11.324 1.00 44.11 C ATOM 2745 CG1 ILE B 77 8.049 27.966 12.054 1.00 70.24 C ATOM 2746 CG2 ILE B 77 5.542 28.015 12.067 1.00 64.41 C ATOM 2747 CD1 ILE B 77 8.161 26.459 12.130 1.00 2.32 C ATOM 0 H ILE B 77 7.149 25.849 9.939 1.00 41.52 H new ATOM 0 HA ILE B 77 6.033 28.465 9.306 1.00 50.31 H new ATOM 0 HB ILE B 77 6.815 29.539 11.291 1.00 44.11 H new ATOM 0 HG12 ILE B 77 8.930 28.363 11.548 1.00 70.24 H new ATOM 0 HG13 ILE B 77 8.051 28.374 13.065 1.00 70.24 H new ATOM 0 HG21 ILE B 77 5.570 28.403 13.085 1.00 64.41 H new ATOM 0 HG22 ILE B 77 4.662 28.403 11.555 1.00 64.41 H new ATOM 0 HG23 ILE B 77 5.495 26.926 12.095 1.00 64.41 H new ATOM 0 HD11 ILE B 77 9.074 26.188 12.661 1.00 2.32 H new ATOM 0 HD12 ILE B 77 7.299 26.056 12.662 1.00 2.32 H new ATOM 0 HD13 ILE B 77 8.191 26.045 11.122 1.00 2.32 H new ATOM 2759 N ALA B 78 8.507 29.368 9.010 1.00 60.23 N ATOM 2760 CA ALA B 78 9.798 29.696 8.419 1.00 30.33 C ATOM 2761 C ALA B 78 10.866 29.870 9.494 1.00 42.43 C ATOM 2762 O ALA B 78 10.615 30.412 10.570 1.00 1.45 O ATOM 2763 CB ALA B 78 9.688 30.955 7.573 1.00 22.31 C ATOM 0 H ALA B 78 7.918 30.176 9.211 1.00 60.23 H new ATOM 0 HA ALA B 78 10.097 28.867 7.778 1.00 30.33 H new ATOM 0 HB1 ALA B 78 10.660 31.187 7.138 1.00 22.31 H new ATOM 0 HB2 ALA B 78 8.963 30.795 6.775 1.00 22.31 H new ATOM 0 HB3 ALA B 78 9.362 31.786 8.198 1.00 22.31 H new ATOM 2769 N PRO B 79 12.086 29.398 9.199 1.00 54.52 N ATOM 2770 CA PRO B 79 13.217 29.490 10.127 1.00 53.33 C ATOM 2771 C PRO B 79 13.706 30.924 10.304 1.00 52.42 C ATOM 2772 O PRO B 79 13.060 31.870 9.854 1.00 11.10 O ATOM 2773 CB PRO B 79 14.297 28.636 9.459 1.00 0.21 C ATOM 2774 CG PRO B 79 13.957 28.664 8.008 1.00 1.12 C ATOM 2775 CD PRO B 79 12.457 28.739 7.935 1.00 63.55 C ATOM 0 HA PRO B 79 12.949 29.155 11.129 1.00 53.33 H new ATOM 0 HB2 PRO B 79 15.292 29.042 9.641 1.00 0.21 H new ATOM 0 HB3 PRO B 79 14.293 27.617 9.847 1.00 0.21 H new ATOM 0 HG2 PRO B 79 14.415 29.522 7.516 1.00 1.12 H new ATOM 0 HG3 PRO B 79 14.328 27.772 7.503 1.00 1.12 H new ATOM 0 HD2 PRO B 79 12.125 29.313 7.070 1.00 63.55 H new ATOM 0 HD3 PRO B 79 12.009 27.749 7.851 1.00 63.55 H new ATOM 2783 N ALA B 80 14.851 31.077 10.963 1.00 25.42 N ATOM 2784 CA ALA B 80 15.427 32.395 11.196 1.00 0.54 C ATOM 2785 C ALA B 80 16.021 32.970 9.915 1.00 35.22 C ATOM 2786 O ALA B 80 15.612 34.035 9.451 1.00 62.14 O ATOM 2787 CB ALA B 80 16.488 32.321 12.285 1.00 73.13 C ATOM 0 H ALA B 80 15.397 30.304 11.344 1.00 25.42 H new ATOM 0 HA ALA B 80 14.629 33.060 11.525 1.00 0.54 H new ATOM 0 HB1 ALA B 80 16.910 33.312 12.449 1.00 73.13 H new ATOM 0 HB2 ALA B 80 16.036 31.961 13.209 1.00 73.13 H new ATOM 0 HB3 ALA B 80 17.278 31.636 11.977 1.00 73.13 H new ATOM 2793 N LEU B 81 16.988 32.258 9.345 1.00 30.02 N ATOM 2794 CA LEU B 81 17.639 32.698 8.116 1.00 34.04 C ATOM 2795 C LEU B 81 16.608 33.024 7.040 1.00 42.43 C ATOM 2796 O LEU B 81 16.785 33.958 6.259 1.00 23.42 O ATOM 2797 CB LEU B 81 18.599 31.619 7.610 1.00 64.45 C ATOM 2798 CG LEU B 81 19.941 31.521 8.336 1.00 64.45 C ATOM 2799 CD1 LEU B 81 20.231 30.081 8.728 1.00 35.40 C ATOM 2800 CD2 LEU B 81 21.060 32.074 7.465 1.00 62.22 C ATOM 0 H LEU B 81 17.338 31.374 9.714 1.00 30.02 H new ATOM 0 HA LEU B 81 18.204 33.604 8.337 1.00 34.04 H new ATOM 0 HB2 LEU B 81 18.099 30.653 7.681 1.00 64.45 H new ATOM 0 HB3 LEU B 81 18.793 31.800 6.553 1.00 64.45 H new ATOM 0 HG LEU B 81 19.885 32.120 9.245 1.00 64.45 H new ATOM 0 HD11 LEU B 81 21.190 30.030 9.244 1.00 35.40 H new ATOM 0 HD12 LEU B 81 19.444 29.718 9.389 1.00 35.40 H new ATOM 0 HD13 LEU B 81 20.267 29.460 7.833 1.00 35.40 H new ATOM 0 HD21 LEU B 81 22.008 31.996 7.998 1.00 62.22 H new ATOM 0 HD22 LEU B 81 21.116 31.502 6.539 1.00 62.22 H new ATOM 0 HD23 LEU B 81 20.858 33.120 7.234 1.00 62.22 H new ATOM 2812 N ALA B 82 15.530 32.247 7.007 1.00 60.51 N ATOM 2813 CA ALA B 82 14.469 32.455 6.030 1.00 44.45 C ATOM 2814 C ALA B 82 14.018 33.912 6.010 1.00 20.32 C ATOM 2815 O ALA B 82 13.722 34.495 7.053 1.00 2.23 O ATOM 2816 CB ALA B 82 13.290 31.540 6.328 1.00 40.20 C ATOM 0 H ALA B 82 15.369 31.468 7.646 1.00 60.51 H new ATOM 0 HA ALA B 82 14.865 32.211 5.044 1.00 44.45 H new ATOM 0 HB1 ALA B 82 12.505 31.706 5.590 1.00 40.20 H new ATOM 0 HB2 ALA B 82 13.616 30.501 6.284 1.00 40.20 H new ATOM 0 HB3 ALA B 82 12.904 31.757 7.324 1.00 40.20 H new