#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fzy h ARG 3 N 0.00 0.10 -0.56 -1.46 2.43 -1.82 -2.11 114.38 110.94 1fzy h ARG 3 Ca 0.00 -0.01 -0.05 0.00 -0.81 0.00 0.00 59.98 59.11 1fzy h ARG 3 Cb 0.00 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.50 1fzy h ARG 3 CO 0.00 0.06 0.16 0.00 -1.51 0.00 0.00 179.97 178.68 1fzy h ALA 4 N 1.46 0.74 -0.60 2.80 0.00 -1.94 -0.75 119.26 120.96 1fzy h ALA 4 Ca 0.25 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 1fzy h ALA 4 Cb 0.38 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 1fzy h ALA 4 CO -0.43 0.43 0.27 1.57 0.00 0.00 0.00 179.25 181.08 1fzy h LYS 5 N 0.80 0.88 0.21 0.00 -0.00 -1.98 -1.94 116.57 114.54 1fzy h LYS 5 Ca 0.18 -0.14 -0.00 0.00 -0.00 0.00 0.00 60.65 60.68 1fzy h LYS 5 Cb 0.32 -0.15 -0.01 0.00 -0.00 0.00 0.00 32.23 32.39 1fzy h LYS 5 CO -0.00 0.73 -0.14 -0.09 -0.00 0.00 0.00 179.45 179.95 1fzy h ARG 6 N 0.83 -0.33 -0.37 0.07 1.12 -1.03 -2.67 114.38 111.99 1fzy h ARG 6 Ca 0.20 0.02 0.02 0.00 -1.11 0.00 0.00 59.98 59.11 1fzy h ARG 6 Cb 0.16 0.08 -0.03 0.00 -0.01 0.00 0.00 29.97 30.17 1fzy h ARG 6 CO -0.02 -0.22 0.21 0.82 -3.11 0.00 0.00 179.97 177.65 1fzy h ILE 7 N -0.34 1.03 -0.43 1.20 1.08 -1.04 -0.67 117.51 118.34 1fzy h ILE 7 Ca -0.02 -0.15 -0.05 0.00 -0.39 0.00 0.00 64.86 64.26 1fzy h ILE 7 Cb 0.30 0.56 -0.02 0.00 -3.07 0.00 0.00 36.82 34.59 1fzy h ILE 7 CO 0.01 0.08 0.06 0.24 -0.69 0.00 0.00 178.15 177.85 1fzy h MET 8 N 0.43 0.66 -0.47 2.37 2.86 -1.34 0.13 114.93 119.57 1fzy h MET 8 Ca 0.15 -0.14 -0.01 0.00 -2.06 0.00 0.00 59.70 57.64 1fzy h MET 8 Cb 0.01 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 31.55 1fzy h MET 8 CO -0.07 0.64 0.27 0.87 1.06 0.00 0.00 176.91 179.67 1fzy h LYS 9 N 0.64 0.65 -0.41 1.72 1.57 -1.10 -2.47 116.57 117.17 1fzy h LYS 9 Ca 0.14 -0.07 -0.03 0.00 -1.87 0.00 0.00 60.65 58.82 1fzy h LYS 9 Cb 0.31 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.47 1fzy h LYS 9 CO 0.00 0.50 0.14 0.93 -0.57 0.00 0.00 179.45 180.45 1fzy h GLU 10 N 0.63 0.63 -0.89 3.15 5.08 -0.51 -1.31 114.58 121.36 1fzy h GLU 10 Ca 0.17 -0.13 0.16 0.00 -1.00 0.00 0.00 59.36 58.56 1fzy h GLU 10 Cb 0.03 -0.09 -0.10 0.00 0.50 0.00 0.00 28.75 29.08 1fzy h GLU 10 CO -0.03 0.61 0.47 0.82 -1.00 0.00 0.00 179.01 179.89 1fzy h ILE 11 N 0.52 0.70 -0.20 3.13 1.08 -0.67 -1.73 117.51 120.34 1fzy h ILE 11 Ca 0.13 -0.22 -0.16 0.00 -0.39 0.00 0.00 64.86 64.22 1fzy h ILE 11 Cb 0.24 0.01 0.00 0.00 -3.07 0.00 0.00 36.82 34.00 1fzy h ILE 11 CO -0.01 0.12 -0.50 -0.61 -0.69 0.00 0.00 178.15 176.45 1fzy h GLN 12 N 0.64 0.69 -0.94 2.37 5.75 -1.06 -1.03 115.11 121.52 1fzy h GLN 12 Ca 0.50 -0.48 0.08 0.00 -0.15 0.00 0.00 58.65 58.60 1fzy h GLN 12 Cb 0.75 0.07 -0.07 0.00 1.07 0.00 0.00 27.48 29.30 1fzy h GLN 12 CO -0.38 1.10 0.60 0.00 -2.65 0.00 0.00 178.83 177.50 1fzy h ALA 13 N 0.59 1.53 0.03 3.38 0.00 -0.75 -0.68 119.26 123.35 1fzy h ALA 13 Ca -0.01 -0.01 -0.15 0.00 0.00 0.00 0.00 54.91 54.74 1fzy h ALA 13 Cb 1.12 -0.25 0.01 0.00 0.00 0.00 0.00 17.79 18.67 1fzy h ALA 13 CO 0.11 0.30 -0.62 0.28 0.00 0.00 0.00 179.25 179.33 1fzy h VAL 14 N 1.01 1.46 -0.40 0.00 2.07 -1.24 -3.28 116.25 115.86 1fzy h VAL 14 Ca 0.42 -2.16 -0.01 0.00 0.82 0.00 0.00 66.70 65.76 1fzy h VAL 14 Cb 0.30 2.74 -0.02 0.00 -1.52 0.00 0.00 31.29 32.78 1fzy h VAL 14 CO -0.18 0.62 0.19 0.11 0.02 0.00 0.00 177.57 178.34 1fzy h LYS 15 N -0.19 0.55 0.00 1.57 6.56 -0.89 -2.31 116.57 121.86 1fzy h LYS 15 Ca -0.08 -0.06 0.00 0.00 -1.06 0.00 0.00 60.65 59.45 1fzy h LYS 15 Cb 1.36 -0.11 0.00 0.00 -0.57 0.00 0.00 32.23 32.91 1fzy h LYS 15 CO 0.12 0.43 0.00 -0.25 -2.06 0.00 0.00 179.45 177.69 1fzy n ASP 16 N -4.41 0.00 -3.00 0.86 8.00 -0.29 -4.12 116.55 113.59 1fzy n ASP 16 Ca 0.03 -0.29 -0.22 0.00 0.71 0.00 0.00 54.79 55.02 1fzy n ASP 16 Cb 0.12 -0.23 -0.03 0.00 -0.02 0.00 0.00 41.12 40.95 1fzy n ASP 16 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1fzy n ASP 17 N -1.23 2.74 0.02 -2.24 2.03 -0.87 -4.94 116.55 112.05 1fzy n ASP 17 Ca 0.16 -3.34 0.16 0.00 0.52 0.00 0.00 54.79 52.30 1fzy n ASP 17 Cb 0.22 -0.58 0.64 0.00 -0.72 0.00 0.00 41.12 40.67 1fzy n ASP 17 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 1fzy h PRO 18 N 2.96 0.10 0.00 -0.67 0.11 -1.72 -2.40 132.00 130.39 1fzy h PRO 18 Ca 0.11 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.22 1fzy h PRO 18 Cb 0.77 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 31.86 1fzy h PRO 18 CO 0.66 0.07 0.00 0.00 -0.21 0.00 0.00 178.00 178.52 1fzy h ALA 19 N 1.76 1.00 0.00 -0.75 0.00 -1.93 -0.14 119.26 119.21 1fzy h ALA 19 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.13 1fzy h ALA 19 Cb 0.76 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.55 1fzy h ALA 19 CO -0.02 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.23 1fzy n ALA 20 N -1.80 1.95 -1.94 0.00 0.00 -0.90 -4.90 120.51 112.93 1fzy n ALA 20 Ca 0.02 0.03 -0.12 0.00 0.00 0.00 0.00 53.44 53.37 1fzy n ALA 20 Cb 0.23 -1.42 -0.02 0.00 0.00 0.00 0.00 19.45 18.24 1fzy n ALA 20 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1fzy n HIS 21 N -2.20 -0.38 -4.45 0.00 8.25 -0.06 -4.92 115.22 111.46 1fzy n HIS 21 Ca 0.04 0.00 -0.34 0.00 -0.26 0.00 0.00 57.72 57.16 1fzy n HIS 21 Cb 0.32 -2.55 -0.10 0.00 1.12 0.00 0.00 29.99 28.78 1fzy n HIS 21 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1fzy s ILE 22 N -2.55 4.03 0.12 1.59 -1.09 -1.26 -3.36 121.20 118.68 1fzy s ILE 22 Ca 0.00 -0.43 0.07 0.00 -2.23 0.00 0.00 60.65 58.06 1fzy s ILE 22 Cb 0.00 -2.71 -0.04 0.00 -1.58 0.00 0.00 42.46 38.14 1fzy s ILE 22 CO 0.00 0.54 -0.17 0.42 -1.23 0.00 0.00 174.94 174.50 1fzy s THR 23 N -0.91 1.53 -0.11 2.92 -4.23 -0.57 -4.86 115.64 109.42 1fzy s THR 23 Ca 0.15 -1.63 -0.04 0.00 -1.18 0.00 0.00 61.69 58.99 1fzy s THR 23 Cb -0.11 -1.52 0.06 0.00 1.34 0.00 0.00 72.50 72.26 1fzy s THR 23 CO 0.04 -0.24 0.21 -0.22 -0.54 0.00 0.00 174.62 173.87 1fzy s LEU 24 N -2.19 -0.16 -0.01 4.79 0.20 -1.26 -1.75 118.68 118.30 1fzy s LEU 24 Ca 0.08 0.46 -0.05 0.00 0.69 0.00 0.00 54.13 55.31 1fzy s LEU 24 Cb -0.08 0.49 0.00 0.00 -0.43 0.00 0.00 46.19 46.17 1fzy s LEU 24 CO 0.04 -0.24 0.11 -1.61 -0.29 0.00 0.00 176.35 174.36 1fzy s GLU 25 N 2.31 0.33 0.43 1.98 0.41 -0.70 -4.94 118.70 118.52 1fzy s GLU 25 Ca 0.02 -0.20 -0.23 0.00 -0.41 0.00 0.00 54.97 54.14 1fzy s GLU 25 Cb -0.12 0.14 -0.08 0.00 -1.78 0.00 0.00 34.13 32.29 1fzy s GLU 25 CO -0.07 -0.07 1.12 -0.06 -0.49 0.00 0.00 175.26 175.69 1fzy s PHE 26 N -0.82 3.04 0.03 1.61 0.40 -1.26 -0.00 117.98 120.97 1fzy s PHE 26 Ca -0.09 1.58 -0.22 0.00 -0.60 0.00 0.00 56.93 57.60 1fzy s PHE 26 Cb -0.05 -3.28 -0.15 0.00 0.51 0.00 0.00 43.02 40.05 1fzy s PHE 26 CO 0.01 -1.15 1.38 0.28 0.70 0.00 0.00 175.22 176.44 1fzy h VAL 27 N 2.02 1.32 -4.90 -0.44 2.07 -1.51 -3.44 116.25 111.38 1fzy h VAL 27 Ca -0.49 -1.10 -0.51 0.00 0.82 0.00 0.00 66.70 65.42 1fzy h VAL 27 Cb 1.23 1.81 -0.13 0.00 -1.52 0.00 0.00 31.29 32.69 1fzy h VAL 27 CO 0.61 0.31 -0.47 -1.54 0.02 0.00 0.00 177.57 176.50 1fzy n SER 28 N -4.70 0.04 -0.89 0.57 3.41 -1.26 -5.03 113.62 105.77 1fzy n SER 28 Ca -0.06 -3.20 0.11 0.00 -0.26 0.00 0.00 58.87 55.45 1fzy n SER 28 Cb 0.28 1.44 0.28 0.00 -0.26 0.00 0.00 64.21 65.95 1fzy n SER 28 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1fzy n GLU 29 N -0.75 2.16 0.05 4.33 1.02 -1.26 -4.08 120.64 122.11 1fzy n GLU 29 Ca 0.02 -1.75 0.11 0.00 -0.02 0.00 0.00 57.16 55.53 1fzy n GLU 29 Cb 0.61 -1.45 -0.02 0.00 -0.02 0.00 0.00 31.44 30.56 1fzy n GLU 29 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1fzy n SER 30 N 0.97 0.59 -3.61 1.62 2.88 -1.26 -4.97 113.62 109.83 1fzy n SER 30 Ca 0.18 0.06 -0.08 0.00 -1.33 0.00 0.00 58.87 57.70 1fzy n SER 30 Cb 0.48 0.87 -0.01 0.00 -0.75 0.00 0.00 64.21 64.80 1fzy n SER 30 CO 0.00 0.00 0.00 1.51 -1.23 0.00 0.00 175.04 175.32 1fzy s ASP 31 N -4.64 -0.13 -0.05 -3.46 -4.77 -1.26 -5.06 116.67 97.31 1fzy s ASP 31 Ca -0.00 -0.82 0.08 0.00 -3.30 0.00 0.00 52.55 48.50 1fzy s ASP 31 Cb 0.12 0.74 0.13 0.00 -1.09 0.00 0.00 42.92 42.83 1fzy s ASP 31 CO 0.82 -1.41 1.08 2.30 0.70 0.00 0.00 175.17 178.65 1fzy n ILE 32 N -0.47 1.35 0.70 2.11 -6.64 -1.26 -4.66 119.36 110.49 1fzy n ILE 32 Ca -0.05 -1.47 0.07 0.00 -1.77 0.00 0.00 62.75 59.53 1fzy n ILE 32 Cb 0.60 0.22 -0.05 0.00 -1.44 0.00 0.00 39.64 38.96 1fzy n ILE 32 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 1fzy n HIS 33 N -0.79 0.00 -3.71 4.28 1.44 -1.26 -4.87 115.22 110.31 1fzy n HIS 33 Ca 0.07 0.00 -0.37 0.00 -2.01 0.00 0.00 57.72 55.41 1fzy n HIS 33 Cb 0.41 0.00 -0.11 0.00 0.12 0.00 0.00 29.99 30.41 1fzy n HIS 33 CO 0.00 0.00 0.00 -1.01 -2.81 0.00 0.00 176.34 172.52 1fzy s HIS 34 N -2.20 3.21 0.11 -1.40 3.76 -1.26 -1.08 115.29 116.43 1fzy s HIS 34 Ca 0.08 -0.01 0.00 0.00 -0.15 0.00 0.00 55.06 54.98 1fzy s HIS 34 Cb 0.12 -2.28 -0.04 0.00 1.11 0.00 0.00 32.58 31.49 1fzy s HIS 34 CO 0.53 -0.12 -0.01 -0.51 -0.85 0.00 0.00 174.74 173.78 1fzy s LEU 35 N 1.38 2.20 -0.15 0.89 1.02 -0.18 -1.31 118.68 122.53 1fzy s LEU 35 Ca 0.06 -1.10 -0.02 0.00 0.02 0.00 0.00 54.13 53.09 1fzy s LEU 35 Cb -0.15 0.11 -0.02 0.00 0.02 0.00 0.00 46.19 46.15 1fzy s LEU 35 CO 0.06 -0.60 -0.08 -0.54 0.02 0.00 0.00 176.35 175.21 1fzy s LYS 36 N -3.94 3.51 0.07 1.70 -0.14 1.00 -0.54 119.74 121.40 1fzy s LYS 36 Ca 0.17 -0.61 0.03 0.00 -1.36 0.00 0.00 55.97 54.21 1fzy s LYS 36 Cb 0.07 -2.79 -0.04 0.00 -1.68 0.00 0.00 37.83 33.39 1fzy s LYS 36 CO -0.02 0.19 0.03 0.20 -0.76 0.00 0.00 175.35 174.99 1fzy s GLY 37 N 0.45 1.95 0.06 -3.33 0.00 0.13 -1.72 107.32 104.87 1fzy s GLY 37 Ca -0.07 -1.04 0.02 0.00 0.00 0.00 0.00 44.72 43.63 1fzy s GLY 37 CO 0.04 -1.00 -0.07 -0.51 0.00 0.00 0.00 173.10 171.57 1fzy s THR 38 N -1.29 0.54 0.08 0.90 -4.23 -0.72 0.01 115.64 110.92 1fzy s THR 38 Ca 0.26 -1.45 -0.07 0.00 -1.18 0.00 0.00 61.69 59.25 1fzy s THR 38 Cb -0.12 -1.07 -0.01 0.00 1.34 0.00 0.00 72.50 72.65 1fzy s THR 38 CO 0.18 -0.63 0.14 0.72 -0.54 0.00 0.00 174.62 174.48 1fzy s PHE 39 N -2.46 0.24 0.20 3.99 -0.71 -0.66 -1.51 117.98 117.07 1fzy s PHE 39 Ca -0.01 -0.69 -0.10 0.00 -1.04 0.00 0.00 56.93 55.10 1fzy s PHE 39 Cb -0.03 -0.14 -0.07 0.00 -1.21 0.00 0.00 43.02 41.58 1fzy s PHE 39 CO -0.03 -0.50 0.52 -0.51 -1.34 0.00 0.00 175.22 173.37 1fzy s LEU 40 N -2.84 4.22 0.51 -1.99 1.43 -1.21 -0.83 118.68 117.97 1fzy s LEU 40 Ca 0.05 0.90 -0.23 0.00 -1.03 0.00 0.00 54.13 53.82 1fzy s LEU 40 Cb 0.05 -3.53 -0.06 0.00 0.03 0.00 0.00 46.19 42.68 1fzy s LEU 40 CO -0.10 -0.01 1.40 -0.83 0.23 0.00 0.00 176.35 177.03 1fzy s GLY 41 N -2.22 2.90 0.23 -3.19 0.00 0.73 -4.92 107.32 100.85 1fzy s GLY 41 Ca 0.44 1.41 -0.30 0.00 0.00 0.00 0.00 44.72 46.27 1fzy s GLY 41 CO 0.21 1.97 1.43 -4.14 0.00 0.00 0.00 173.10 172.57 1fzy s PRO 42 N -2.74 4.28 0.61 2.90 0.02 -1.26 -4.43 135.00 134.38 1fzy s PRO 42 Ca 0.68 2.27 -0.17 0.00 0.02 0.00 0.00 61.00 63.80 1fzy s PRO 42 Cb -0.42 -3.13 -0.02 0.00 0.02 0.00 0.00 34.50 30.94 1fzy s PRO 42 CO 0.52 -0.42 1.11 -1.25 -0.33 0.00 0.00 177.00 176.63 1fzy s PRO 43 N -0.13 3.04 -0.13 5.54 0.04 -1.26 -3.17 135.00 138.92 1fzy s PRO 43 Ca 0.60 1.45 0.00 0.00 0.04 0.00 0.00 61.00 63.09 1fzy s PRO 43 Cb -0.41 -1.98 0.00 0.00 0.04 0.00 0.00 34.50 32.15 1fzy s PRO 43 CO 0.41 -1.07 0.00 0.41 0.04 0.00 0.00 177.00 176.79 1fzy n GLY 44 N -0.32 0.50 3.19 0.56 0.00 -1.26 -4.98 105.19 102.88 1fzy n GLY 44 Ca 0.11 -0.75 -0.14 0.00 0.00 0.00 0.00 46.02 45.23 1fzy n GLY 44 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1fzy s THR 45 N -2.03 0.98 0.01 2.61 2.01 -1.19 -5.01 115.64 113.03 1fzy s THR 45 Ca 0.00 -1.75 0.24 0.00 0.31 0.00 0.00 61.69 60.49 1fzy s THR 45 Cb 0.00 -1.49 0.24 0.00 0.01 0.00 0.00 72.50 71.27 1fzy s THR 45 CO 0.00 -0.61 1.73 -0.65 -0.69 0.00 0.00 174.62 174.39 1fzy h PRO 46 N 3.36 0.00 -0.58 4.92 0.11 -1.88 -1.45 132.00 136.48 1fzy h PRO 46 Ca -0.37 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.74 1fzy h PRO 46 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1fzy h PRO 46 CO 0.56 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 179.01 1fzy n TYR 47 N -2.38 0.76 -2.06 0.65 4.02 -1.26 -3.54 117.16 113.35 1fzy n TYR 47 Ca -0.02 -0.38 -0.41 0.00 -0.01 0.00 0.00 57.90 57.08 1fzy n TYR 47 Cb 0.10 0.00 -0.02 0.00 -0.02 0.00 0.00 39.34 39.40 1fzy n TYR 47 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 176.86 173.85 1fzy s GLU 48 N -1.24 4.30 0.00 -0.72 2.12 -0.55 -2.06 118.70 120.55 1fzy s GLU 48 Ca 0.43 2.24 0.00 0.00 0.36 0.00 0.00 54.97 58.00 1fzy s GLU 48 Cb 0.23 -3.13 0.00 0.00 0.26 0.00 0.00 34.13 31.49 1fzy s GLU 48 CO 0.31 -0.38 0.00 0.41 -0.54 0.00 0.00 175.26 175.06 1fzy n GLY 49 N 2.20 0.68 3.87 -1.50 0.00 -1.26 -4.98 105.19 104.19 1fzy n GLY 49 Ca 0.06 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.76 1fzy n GLY 49 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1fzy s GLY 50 N -1.97 2.30 -0.18 -0.02 0.00 -0.88 -4.84 107.32 101.74 1fzy s GLY 50 Ca 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 44.72 44.56 1fzy s GLY 50 CO 0.00 -0.00 -0.16 1.25 0.00 0.00 0.00 173.10 174.18 1fzy s LYS 51 N -2.87 3.10 -0.17 2.90 2.20 -0.37 -0.19 119.74 124.32 1fzy s LYS 51 Ca 0.50 -0.78 -0.05 0.00 -0.36 0.00 0.00 55.97 55.28 1fzy s LYS 51 Cb -0.11 -2.66 -0.03 0.00 -1.51 0.00 0.00 37.83 33.53 1fzy s LYS 51 CO 0.20 -0.17 -0.01 -0.06 -0.36 0.00 0.00 175.35 174.95 1fzy s PHE 52 N 1.24 3.07 -0.13 4.03 0.08 -0.01 -4.69 117.98 121.57 1fzy s PHE 52 Ca 0.03 -0.26 -0.02 0.00 0.12 0.00 0.00 56.93 56.81 1fzy s PHE 52 Cb -0.14 -2.01 -0.02 0.00 -0.57 0.00 0.00 43.02 40.28 1fzy s PHE 52 CO -0.09 -0.04 -0.07 0.08 -0.10 0.00 0.00 175.22 175.00 1fzy s VAL 53 N 0.49 3.58 -0.11 -0.44 1.01 -1.26 -1.65 120.40 122.02 1fzy s VAL 53 Ca -0.02 -0.48 0.01 0.00 0.00 0.00 0.00 61.98 61.49 1fzy s VAL 53 Cb -0.14 -2.53 0.02 0.00 0.00 0.00 0.00 36.38 33.73 1fzy s VAL 53 CO 0.02 0.52 -0.12 -0.69 0.00 0.00 0.00 175.10 174.83 1fzy s VAL 54 N 0.14 1.33 0.10 2.92 1.01 0.10 -0.17 120.40 125.83 1fzy s VAL 54 Ca -0.03 -0.51 -0.31 0.00 0.00 0.00 0.00 61.98 61.13 1fzy s VAL 54 Cb -0.14 -1.26 -0.06 0.00 0.00 0.00 0.00 36.38 34.92 1fzy s VAL 54 CO 0.04 0.41 1.23 -0.62 0.00 0.00 0.00 175.10 176.15 1fzy s ASP 55 N 1.27 7.04 -0.06 3.32 2.15 -0.15 -0.69 116.67 129.55 1fzy s ASP 55 Ca -0.01 2.11 0.03 0.00 0.43 0.00 0.00 52.55 55.11 1fzy s ASP 55 Cb -0.14 -2.59 0.00 0.00 -0.30 0.00 0.00 42.92 39.90 1fzy s ASP 55 CO -0.05 -0.47 -0.17 -0.63 -0.17 0.00 0.00 175.17 173.68 1fzy s ILE 56 N 0.82 1.45 -0.16 4.11 1.01 0.30 -2.02 121.20 126.71 1fzy s ILE 56 Ca 0.58 -0.69 0.00 0.00 0.00 0.00 0.00 60.65 60.55 1fzy s ILE 56 Cb -0.31 -1.27 0.03 0.00 0.01 0.00 0.00 42.46 40.92 1fzy s ILE 56 CO 0.31 0.42 -0.12 -0.70 0.00 0.00 0.00 174.94 174.84 1fzy s GLU 57 N 0.34 2.16 -0.15 2.79 2.56 -0.30 -1.01 118.70 125.08 1fzy s GLU 57 Ca -0.11 -0.62 -0.14 0.00 0.00 0.00 0.00 54.97 54.10 1fzy s GLU 57 Cb -0.14 -2.16 -0.05 0.00 2.00 0.00 0.00 34.13 33.78 1fzy s GLU 57 CO 0.04 -0.30 0.31 0.14 -0.56 0.00 0.00 175.26 174.89 1fzy s VAL 58 N 1.48 5.29 0.66 3.70 -7.23 -0.24 0.11 120.40 124.17 1fzy s VAL 58 Ca 0.03 0.58 -0.12 0.00 -1.81 0.00 0.00 61.98 60.67 1fzy s VAL 58 Cb -0.14 -3.64 -0.01 0.00 0.56 0.00 0.00 36.38 33.15 1fzy s VAL 58 CO -0.10 0.40 1.05 -2.16 -0.31 0.00 0.00 175.10 173.98 1fzy s PRO 59 N 0.36 3.18 0.30 4.82 0.05 -1.26 -4.87 135.00 137.59 1fzy s PRO 59 Ca 0.18 0.93 0.06 0.00 0.05 0.00 0.00 61.00 62.22 1fzy s PRO 59 Cb -0.13 -2.02 0.81 0.00 0.05 0.00 0.00 34.50 33.20 1fzy s PRO 59 CO 0.05 -0.91 1.70 0.52 0.05 0.00 0.00 177.00 178.41 1fzy h MET 60 N -0.43 0.40 0.00 4.56 2.86 -1.97 -0.24 114.93 120.11 1fzy h MET 60 Ca -0.44 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.17 1fzy h MET 60 Cb 1.21 -0.09 0.00 0.00 0.06 0.00 0.00 31.60 32.77 1fzy h MET 60 CO 0.58 0.27 0.00 0.39 1.06 0.00 0.00 176.91 179.21 1fzy n GLU 61 N -5.02 0.38 -1.61 1.72 1.02 -1.26 -4.64 120.64 111.23 1fzy n GLU 61 Ca 0.24 0.04 -0.44 0.00 -0.02 0.00 0.00 57.16 56.99 1fzy n GLU 61 Cb 0.72 -1.50 -0.01 0.00 -0.02 0.00 0.00 31.44 30.63 1fzy n GLU 61 CO 0.00 0.00 0.00 0.98 1.18 0.00 0.00 177.13 179.29 1fzy n TYR 62 N -1.28 1.38 1.50 -0.32 9.36 -0.10 -0.51 117.16 127.19 1fzy n TYR 62 Ca 0.12 0.67 0.03 0.00 3.32 0.00 0.00 57.90 62.03 1fzy n TYR 62 Cb 0.20 -2.27 0.07 0.00 -0.63 0.00 0.00 39.34 36.71 1fzy n TYR 62 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 1fzy n PRO 63 N 0.64 1.37 0.00 2.98 -0.04 -1.26 -3.98 135.00 134.70 1fzy n PRO 63 Ca 0.09 -0.57 0.13 0.00 -0.04 0.00 0.00 63.50 63.11 1fzy n PRO 63 Cb 0.33 -1.12 0.36 0.00 -0.04 0.00 0.00 33.50 33.03 1fzy n PRO 63 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1fzy n PHE 64 N -0.04 0.00 -4.61 0.54 3.01 0.33 -3.61 117.46 113.09 1fzy n PHE 64 Ca 0.05 0.00 -0.26 0.00 1.01 0.00 0.00 57.45 58.26 1fzy n PHE 64 Cb 0.13 -0.17 -0.14 0.00 -0.01 0.00 0.00 39.48 39.29 1fzy n PHE 64 CO 0.00 0.00 0.00 0.15 1.01 0.00 0.00 176.76 177.92 1fzy s LYS 65 N -2.66 1.38 0.62 -1.08 -0.14 -1.19 -4.88 119.74 111.79 1fzy s LYS 65 Ca 0.21 -0.99 -0.17 0.00 -1.36 0.00 0.00 55.97 53.66 1fzy s LYS 65 Cb 0.19 -1.52 -0.02 0.00 -1.68 0.00 0.00 37.83 34.79 1fzy s LYS 65 CO 0.57 0.38 1.17 -1.25 -0.76 0.00 0.00 175.35 175.46 1fzy s PRO 66 N -1.29 2.87 0.64 -1.68 0.04 -1.26 -4.16 135.00 130.16 1fzy s PRO 66 Ca 0.08 1.67 -0.12 0.00 0.04 0.00 0.00 61.00 62.67 1fzy s PRO 66 Cb -0.09 -1.93 -0.02 0.00 0.04 0.00 0.00 34.50 32.49 1fzy s PRO 66 CO 0.02 -1.25 1.04 -1.25 0.04 0.00 0.00 177.00 175.60 1fzy s PRO 67 N -3.59 3.34 -0.30 0.56 0.04 -1.26 -4.55 135.00 129.23 1fzy s PRO 67 Ca 0.74 0.91 -0.16 0.00 0.04 0.00 0.00 61.00 62.52 1fzy s PRO 67 Cb -0.27 -2.04 -0.02 0.00 0.04 0.00 0.00 34.50 32.21 1fzy s PRO 67 CO 0.36 -0.78 0.44 -1.59 0.04 0.00 0.00 177.00 175.46 1fzy s LYS 68 N -4.88 3.86 -0.04 4.56 0.00 0.12 -4.94 119.74 118.41 1fzy s LYS 68 Ca 0.58 -0.02 0.06 0.00 0.00 0.00 0.00 55.97 56.58 1fzy s LYS 68 Cb -0.13 -3.72 -0.01 0.00 0.00 0.00 0.00 37.83 33.98 1fzy s LYS 68 CO 0.50 -0.42 -0.22 -1.64 0.00 0.00 0.00 175.35 173.56 1fzy s MET 69 N 2.19 2.14 -0.13 1.78 -1.94 -1.26 -1.15 119.30 120.93 1fzy s MET 69 Ca 0.17 -0.79 -0.11 0.00 -1.71 0.00 0.00 55.69 53.24 1fzy s MET 69 Cb -0.16 -1.88 0.04 0.00 2.01 0.00 0.00 34.83 34.84 1fzy s MET 69 CO 0.11 0.37 0.34 1.14 -0.01 0.00 0.00 175.02 176.97 1fzy s GLN 70 N -0.21 0.38 0.25 2.03 -2.07 -0.86 -4.45 119.66 114.74 1fzy s GLN 70 Ca -0.00 0.49 -0.31 0.00 -1.82 0.00 0.00 55.36 53.73 1fzy s GLN 70 Cb -0.12 0.16 -0.11 0.00 -1.09 0.00 0.00 33.01 31.85 1fzy s GLN 70 CO 0.02 -0.06 1.58 -0.06 -1.32 0.00 0.00 175.29 175.45 1fzy s PHE 71 N 0.32 2.88 -0.01 9.60 0.08 0.66 -0.98 117.98 130.53 1fzy s PHE 71 Ca -0.01 0.73 -0.08 0.00 0.12 0.00 0.00 56.93 57.69 1fzy s PHE 71 Cb -0.03 -4.01 -0.30 0.00 -0.57 0.00 0.00 43.02 38.11 1fzy s PHE 71 CO -0.01 -3.51 0.81 -0.44 -0.10 0.00 0.00 175.22 171.97 1fzy h ASP 72 N 5.51 0.55 -3.64 1.36 3.32 -0.90 -3.37 116.42 119.26 1fzy h ASP 72 Ca -0.45 -0.75 -0.52 0.00 0.02 0.00 0.00 57.03 55.32 1fzy h ASP 72 Cb 1.21 -0.18 0.05 0.00 0.22 0.00 0.00 39.33 40.63 1fzy h ASP 72 CO 0.84 1.63 0.64 -0.89 -1.72 0.00 0.00 179.24 179.74 1fzy s THR 73 N -2.60 2.94 -0.29 0.35 2.01 -1.08 -4.97 115.64 112.01 1fzy s THR 73 Ca -0.12 0.86 -0.29 0.00 0.31 0.00 0.00 61.69 62.46 1fzy s THR 73 Cb 0.06 -3.55 0.01 0.00 0.01 0.00 0.00 72.50 69.03 1fzy s THR 73 CO 0.87 0.17 1.16 -0.75 -0.69 0.00 0.00 174.62 175.38 1fzy s LYS 74 N -1.01 4.06 0.02 4.92 2.20 -1.26 -4.93 119.74 123.74 1fzy s LYS 74 Ca 0.52 1.21 0.07 0.00 -0.36 0.00 0.00 55.97 57.41 1fzy s LYS 74 Cb -0.38 -3.77 -0.02 0.00 -1.51 0.00 0.00 37.83 32.14 1fzy s LYS 74 CO 0.46 -0.92 -0.21 0.08 -0.36 0.00 0.00 175.35 174.39 1fzy s VAL 75 N 3.80 1.70 -0.50 4.02 1.01 -1.26 -4.71 120.40 124.47 1fzy s VAL 75 Ca 0.49 -1.10 -0.16 0.00 0.00 0.00 0.00 61.98 61.21 1fzy s VAL 75 Cb -0.15 -1.45 0.09 0.00 0.00 0.00 0.00 36.38 34.87 1fzy s VAL 75 CO 0.17 0.32 0.45 -0.47 0.00 0.00 0.00 175.10 175.57 1fzy s TYR 76 N -0.68 3.23 -0.23 5.22 5.04 -1.26 -4.19 117.35 124.48 1fzy s TYR 76 Ca 0.08 -1.04 -0.26 0.00 -2.44 0.00 0.00 57.07 53.41 1fzy s TYR 76 Cb -0.09 -3.43 0.08 0.00 0.35 0.00 0.00 41.96 38.88 1fzy s TYR 76 CO 0.01 -0.90 0.79 -1.58 -1.34 0.00 0.00 175.55 172.53 1fzy s HIS 77 N 1.70 -0.68 0.50 4.97 2.46 -1.26 -4.66 115.29 118.32 1fzy s HIS 77 Ca 0.04 1.56 0.24 0.00 0.47 0.00 0.00 55.06 57.37 1fzy s HIS 77 Cb -0.26 0.32 1.32 0.00 -0.13 0.00 0.00 32.58 33.83 1fzy s HIS 77 CO 0.06 -0.39 1.95 -1.35 -2.47 0.00 0.00 174.74 172.54 1fzy h PRO 78 N 4.35 0.12 -0.35 2.88 0.11 -1.87 -2.83 132.00 134.40 1fzy h PRO 78 Ca -0.28 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.82 1fzy h PRO 78 Cb 1.16 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.24 1fzy h PRO 78 CO 0.14 0.08 0.00 0.09 -0.21 0.00 0.00 178.00 178.09 1fzy n ASN 79 N -4.39 2.95 -4.02 -2.05 4.13 -1.26 -0.60 115.26 110.02 1fzy n ASN 79 Ca 0.13 -1.92 -0.24 0.00 1.68 0.00 0.00 54.58 54.23 1fzy n ASN 79 Cb 0.67 -0.23 -0.16 0.00 -1.54 0.00 0.00 39.78 38.51 1fzy n ASN 79 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1fzy s ILE 80 N -1.02 1.10 -0.11 2.41 1.01 -1.07 -0.41 121.20 123.11 1fzy s ILE 80 Ca 0.26 -0.47 -0.30 0.00 0.00 0.00 0.00 60.65 60.15 1fzy s ILE 80 Cb 0.14 -1.01 -0.02 0.00 0.01 0.00 0.00 42.46 41.59 1fzy s ILE 80 CO 0.19 0.35 1.11 -0.55 0.00 0.00 0.00 174.94 176.03 1fzy s SER 81 N 0.64 7.13 0.00 3.58 0.15 0.04 -4.39 113.70 120.84 1fzy s SER 81 Ca -0.14 1.63 0.24 0.00 0.70 0.00 0.00 55.95 58.38 1fzy s SER 81 Cb -0.15 -2.55 1.22 0.00 -1.71 0.00 0.00 66.02 62.83 1fzy s SER 81 CO 0.03 -0.56 1.78 -1.54 1.20 0.00 0.00 173.24 174.16 1fzy n SER 82 N 5.42 0.00 -0.11 5.45 3.41 -1.26 -0.33 113.62 126.20 1fzy n SER 82 Ca 0.10 -0.14 -0.23 0.00 -0.26 0.00 0.00 58.87 58.35 1fzy n SER 82 Cb 0.47 -0.25 -0.08 0.00 -0.26 0.00 0.00 64.21 64.09 1fzy n SER 82 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1fzy n VAL 83 N -1.25 1.21 0.44 -3.33 0.31 -1.26 -4.73 118.33 109.72 1fzy n VAL 83 Ca 0.12 -0.33 0.10 0.00 -0.01 0.00 0.00 64.34 64.22 1fzy n VAL 83 Cb 0.18 -1.73 -0.13 0.00 -0.91 0.00 0.00 33.84 31.25 1fzy n VAL 83 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 1fzy n THR 84 N -3.87 0.00 -0.97 2.52 -2.24 -1.23 -4.96 114.28 103.52 1fzy n THR 84 Ca -0.43 -0.26 0.00 0.00 -2.27 0.00 0.00 64.05 61.10 1fzy n THR 84 Cb 0.82 0.51 0.00 0.00 -2.10 0.00 0.00 70.33 69.56 1fzy n THR 84 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1fzy n GLY 85 N 1.41 0.65 3.76 3.38 0.00 0.55 -4.70 105.19 110.24 1fzy n GLY 85 Ca -0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 1fzy n GLY 85 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fzy s ALA 86 N -2.71 2.86 -0.03 4.61 0.00 -1.26 -0.24 121.76 124.99 1fzy s ALA 86 Ca 0.00 1.17 0.06 0.00 0.00 0.00 0.00 51.96 53.19 1fzy s ALA 86 Cb 0.00 -3.49 -0.02 0.00 0.00 0.00 0.00 23.12 19.61 1fzy s ALA 86 CO 0.00 -1.10 -0.22 0.42 0.00 0.00 0.00 175.76 174.87 1fzy s ILE 87 N -1.41 2.41 -0.41 0.00 1.01 -1.26 -0.78 121.20 120.77 1fzy s ILE 87 Ca 0.69 -0.97 -0.04 0.00 0.00 0.00 0.00 60.65 60.33 1fzy s ILE 87 Cb -0.35 -1.88 0.10 0.00 0.01 0.00 0.00 42.46 40.34 1fzy s ILE 87 CO 0.42 0.58 0.21 0.00 0.00 0.00 0.00 174.94 176.15 1fzy s LEU 89 N 1.21 -0.66 0.23 0.00 2.96 -1.26 -4.86 118.68 116.30 1fzy s LEU 89 Ca 0.06 1.23 -0.06 0.00 -0.22 0.00 0.00 54.13 55.14 1fzy s LEU 89 Cb -0.23 1.84 0.33 0.00 0.50 0.00 0.00 46.19 48.63 1fzy s LEU 89 CO -0.03 -0.22 1.83 -2.24 -1.32 0.00 0.00 176.35 174.37 1fzy h ASP 90 N 7.45 0.73 0.50 3.68 -0.00 -1.98 -1.91 116.42 124.89 1fzy h ASP 90 Ca -0.27 0.03 0.00 0.00 -0.00 0.00 0.00 57.03 56.79 1fzy h ASP 90 Cb 1.17 -0.12 0.00 0.00 -0.00 0.00 0.00 39.33 40.38 1fzy h ASP 90 CO 0.18 0.45 0.00 0.16 -0.00 0.00 0.00 179.24 180.04 1fzy h ILE 91 N 0.85 0.00 0.00 4.15 3.07 -1.95 0.14 117.51 123.78 1fzy h ILE 91 Ca 0.36 -0.25 0.00 0.00 1.55 0.00 0.00 64.86 66.52 1fzy h ILE 91 Cb 0.23 1.23 0.00 0.00 -0.27 0.00 0.00 36.82 38.01 1fzy h ILE 91 CO -0.19 0.00 -0.47 -0.07 -1.05 0.00 0.00 178.15 176.37 1fzy h LEU 92 N 0.00 0.00 0.00 0.16 4.07 -1.68 -3.09 115.31 114.76 1fzy h LEU 92 Ca 0.00 -0.13 0.00 0.00 0.08 0.00 0.00 57.88 57.83 1fzy h LEU 92 Cb 0.25 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.99 1fzy h LEU 92 CO 0.00 0.06 0.00 0.29 -1.08 0.00 0.00 178.44 177.71 1fzy n LYS 93 N -2.27 0.00 0.01 1.13 4.01 0.25 -4.88 118.16 116.41 1fzy n LYS 93 Ca 0.04 0.00 0.12 0.00 -0.51 0.00 0.00 58.31 57.95 1fzy n LYS 93 Cb 0.45 0.00 0.13 0.00 -0.51 0.00 0.00 35.03 35.11 1fzy n LYS 93 CO 0.00 0.00 0.00 0.09 -1.11 0.00 0.00 177.40 176.38 1fzy n ASN 94 N 0.00 0.62 -1.45 4.39 5.03 -0.52 -4.14 115.26 119.19 1fzy n ASN 94 Ca 0.00 -0.31 -0.04 0.00 0.87 0.00 0.00 54.58 55.10 1fzy n ASN 94 Cb 0.00 0.48 0.24 0.00 -1.02 0.00 0.00 39.78 39.48 1fzy n ASN 94 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1fzy n ALA 95 N -1.61 4.20 -1.77 5.41 0.00 0.15 -4.99 120.51 121.88 1fzy n ALA 95 Ca 0.04 -2.68 -0.36 0.00 0.00 0.00 0.00 53.44 50.44 1fzy n ALA 95 Cb 0.37 -0.96 -0.01 0.00 0.00 0.00 0.00 19.45 18.85 1fzy n ALA 95 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 177.50 177.04 1fzy s TRP 96 N -3.08 2.85 -0.02 0.00 -0.11 -1.17 -4.55 118.94 112.86 1fzy s TRP 96 Ca 0.48 1.55 -0.01 0.00 1.22 0.00 0.00 56.10 59.34 1fzy s TRP 96 Cb 0.41 -3.30 0.01 0.00 -1.50 0.00 0.00 33.47 29.08 1fzy s TRP 96 CO 0.07 -1.40 0.04 0.45 -4.62 0.00 0.00 176.95 171.49 1fzy s SER 97 N -1.56 -0.03 0.53 5.86 0.15 -1.26 -5.03 113.70 112.36 1fzy s SER 97 Ca 0.66 0.08 0.27 0.00 0.70 0.00 0.00 55.95 57.66 1fzy s SER 97 Cb -0.25 0.06 1.45 0.00 -1.71 0.00 0.00 66.02 65.56 1fzy s SER 97 CO 0.30 -0.03 1.79 -0.65 1.20 0.00 0.00 173.24 175.85 1fzy h PRO 98 N 6.30 0.00 0.00 5.44 0.11 -1.90 0.04 132.00 141.99 1fzy h PRO 98 Ca -0.28 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.79 1fzy h PRO 98 Cb 1.19 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.30 1fzy h PRO 98 CO 0.48 0.00 -0.28 -0.39 -0.21 0.00 0.00 178.00 177.61 1fzy h VAL 99 N 0.00 0.33 -3.74 3.15 -1.51 -1.96 -3.46 116.25 109.07 1fzy h VAL 99 Ca 0.00 -1.48 -0.52 0.00 -1.23 0.00 0.00 66.70 63.48 1fzy h VAL 99 Cb 0.46 2.13 0.04 0.00 -2.13 0.00 0.00 31.29 31.79 1fzy h VAL 99 CO 0.00 0.19 0.57 -0.63 -1.23 0.00 0.00 177.57 176.47 1fzy s ILE 100 N -3.12 3.16 0.46 7.19 1.01 -0.00 -5.04 121.20 124.86 1fzy s ILE 100 Ca 0.05 1.11 0.07 0.00 0.00 0.00 0.00 60.65 61.88 1fzy s ILE 100 Cb 0.06 -3.71 -0.01 0.00 0.01 0.00 0.00 42.46 38.82 1fzy s ILE 100 CO 0.71 0.24 0.36 0.42 0.00 0.00 0.00 174.94 176.67 1fzy s THR 101 N -0.85 2.24 0.23 2.92 -4.23 -1.26 -4.96 115.64 109.73 1fzy s THR 101 Ca 0.49 -1.46 0.01 0.00 -1.18 0.00 0.00 61.69 59.55 1fzy s THR 101 Cb -0.36 -2.70 -0.02 0.00 1.34 0.00 0.00 72.50 70.76 1fzy s THR 101 CO 0.45 0.00 1.57 -0.07 -0.54 0.00 0.00 174.62 176.03 1fzy h LEU 102 N 1.00 0.45 -0.15 4.79 3.38 -1.97 -1.13 115.31 121.68 1fzy h LEU 102 Ca -0.40 -0.23 -0.01 0.00 0.09 0.00 0.00 57.88 57.34 1fzy h LEU 102 Cb 1.28 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.89 1fzy h LEU 102 CO 0.60 0.88 0.06 0.50 0.09 0.00 0.00 178.44 180.56 1fzy h LYS 103 N 0.32 0.22 -0.40 1.13 3.64 -1.96 -0.00 116.57 119.52 1fzy h LYS 103 Ca 0.01 -0.04 0.05 0.00 -1.27 0.00 0.00 60.65 59.40 1fzy h LYS 103 Cb 1.01 -0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 32.75 1fzy h LYS 103 CO 0.09 0.32 0.13 1.03 -2.27 0.00 0.00 179.45 178.75 1fzy h SER 104 N 0.08 0.12 -0.46 4.20 0.87 -1.93 0.40 113.55 116.83 1fzy h SER 104 Ca 0.05 0.05 0.02 0.00 -1.23 0.00 0.00 61.79 60.68 1fzy h SER 104 Cb 0.18 0.04 -0.03 0.00 -0.44 0.00 0.00 62.40 62.15 1fzy h SER 104 CO -0.00 0.10 0.27 0.00 -0.53 0.00 0.00 176.83 176.68 1fzy h ALA 105 N 1.27 0.59 -1.00 6.23 0.00 -0.94 0.49 119.26 125.90 1fzy h ALA 105 Ca 0.19 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.10 1fzy h ALA 105 Cb 0.19 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 17.79 1fzy h ALA 105 CO -0.20 -0.04 0.66 -0.07 0.00 0.00 0.00 179.25 179.60 1fzy h LEU 106 N 0.55 1.14 -0.83 0.00 4.07 -0.56 0.19 115.31 119.88 1fzy h LEU 106 Ca 0.18 -0.03 -0.10 0.00 0.08 0.00 0.00 57.88 58.02 1fzy h LEU 106 Cb 0.01 -0.28 -0.02 0.00 1.08 0.00 0.00 40.66 41.45 1fzy h LEU 106 CO -0.08 0.81 -0.18 0.40 -1.08 0.00 0.00 178.44 178.32 1fzy h ILE 107 N 1.34 1.26 -0.20 1.22 2.04 -0.37 -1.58 117.51 121.22 1fzy h ILE 107 Ca 0.37 -1.23 -0.07 0.00 1.00 0.00 0.00 64.86 64.93 1fzy h ILE 107 Cb -0.12 1.17 -0.01 0.00 -0.74 0.00 0.00 36.82 37.11 1fzy h ILE 107 CO -0.09 0.41 -0.20 0.28 0.00 0.00 0.00 178.15 178.55 1fzy h SER 108 N 0.61 0.35 0.12 1.72 0.02 0.30 -0.46 113.55 116.21 1fzy h SER 108 Ca 0.10 -0.10 -0.13 0.00 -0.84 0.00 0.00 61.79 60.82 1fzy h SER 108 Cb 0.64 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 63.08 1fzy h SER 108 CO 0.05 0.56 -0.46 -0.07 -1.14 0.00 0.00 176.83 175.76 1fzy h LEU 109 N 0.32 0.44 -0.59 5.07 3.38 -0.62 -0.26 115.31 123.06 1fzy h LEU 109 Ca 0.06 -0.21 -0.13 0.00 0.09 0.00 0.00 57.88 57.69 1fzy h LEU 109 Cb 0.54 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 1fzy h LEU 109 CO 0.04 0.84 -0.26 -0.61 0.09 0.00 0.00 178.44 178.54 1fzy h GLN 110 N 0.33 0.85 0.00 1.13 4.15 -0.93 -2.61 115.11 118.02 1fzy h GLN 110 Ca 0.02 -0.37 -0.05 0.00 0.77 0.00 0.00 58.65 59.02 1fzy h GLN 110 Cb 0.94 -0.03 -0.01 0.00 0.21 0.00 0.00 27.48 28.60 1fzy h GLN 110 CO 0.08 1.01 -0.25 0.00 -1.93 0.00 0.00 178.83 177.74 1fzy h ALA 111 N 0.98 1.18 -0.13 3.38 0.00 -0.82 -2.69 119.26 121.15 1fzy h ALA 111 Ca 0.09 -0.23 -0.15 0.00 0.00 0.00 0.00 54.91 54.62 1fzy h ALA 111 Cb 0.80 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 1fzy h ALA 111 CO 0.07 0.31 -0.58 1.25 0.00 0.00 0.00 179.25 180.30 1fzy h LEU 112 N 0.00 0.46 -0.79 0.00 5.85 -0.71 -0.78 115.31 119.34 1fzy h LEU 112 Ca -0.00 -0.25 -0.08 0.00 0.84 0.00 0.00 57.88 58.38 1fzy h LEU 112 Cb 0.62 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.49 1fzy h LEU 112 CO 0.03 0.94 0.02 -0.07 -0.34 0.00 0.00 178.44 179.02 1fzy h LEU 113 N 0.31 0.90 -0.60 2.25 3.38 -1.17 -2.64 115.31 117.74 1fzy h LEU 113 Ca -0.00 -0.23 -0.14 0.00 0.09 0.00 0.00 57.88 57.60 1fzy h LEU 113 Cb 1.11 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.60 1fzy h LEU 113 CO 0.10 0.95 -0.67 -0.61 0.09 0.00 0.00 178.44 178.30 1fzy h GLN 114 N 0.87 0.00 -2.35 1.13 4.15 -1.30 -3.39 115.11 114.22 1fzy h GLN 114 Ca 0.16 0.00 -0.59 0.00 0.77 0.00 0.00 58.65 59.00 1fzy h GLN 114 Cb 0.48 0.00 -0.39 0.00 0.21 0.00 0.00 27.48 27.78 1fzy h GLN 114 CO 0.02 0.67 -0.96 0.43 -1.93 0.00 0.00 178.83 177.06 1fzy n SER 115 N -3.66 0.01 -4.56 -0.69 7.64 -0.31 -5.10 113.62 106.94 1fzy n SER 115 Ca -0.01 -2.52 -0.39 0.00 1.01 0.00 0.00 58.87 56.96 1fzy n SER 115 Cb 0.68 -0.59 0.04 0.00 -1.01 0.00 0.00 64.21 63.33 1fzy n SER 115 CO 0.00 0.00 0.00 -2.65 -3.01 0.00 0.00 175.04 169.38 1fzy n PRO 116 N 2.47 0.85 -3.73 1.43 -0.02 -1.00 -4.62 135.00 130.38 1fzy n PRO 116 Ca 0.28 0.32 -0.30 0.00 -2.02 0.00 0.00 63.50 61.78 1fzy n PRO 116 Cb 0.48 -1.96 -0.10 0.00 -0.02 0.00 0.00 33.50 31.90 1fzy n PRO 116 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1fzy n GLU 117 N -0.37 2.23 0.23 -0.52 1.02 -1.26 -4.92 120.64 117.05 1fzy n GLU 117 Ca 0.12 -4.53 0.16 0.00 -0.02 0.00 0.00 57.16 52.89 1fzy n GLU 117 Cb 0.45 -2.32 0.75 0.00 -0.02 0.00 0.00 31.44 30.31 1fzy n GLU 117 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 1fzy h PRO 118 N 5.28 0.00 0.00 3.49 0.13 -1.92 -2.83 132.00 136.15 1fzy h PRO 118 Ca 0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 1fzy h PRO 118 Cb 0.74 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.87 1fzy h PRO 118 CO 0.79 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.65 1fzy n ASN 119 N -2.66 0.08 -3.25 1.44 3.02 -1.26 -3.57 115.26 109.05 1fzy n ASN 119 Ca -0.00 0.51 -0.24 0.00 -0.03 0.00 0.00 54.58 54.82 1fzy n ASN 119 Cb 0.16 -0.53 -0.08 0.00 -0.61 0.00 0.00 39.78 38.72 1fzy n ASN 119 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1fzy n ASP 120 N -1.58 -0.61 -4.80 6.41 2.03 -1.07 -5.14 116.55 111.80 1fzy n ASP 120 Ca 0.05 -2.55 -0.34 0.00 0.52 0.00 0.00 54.79 52.47 1fzy n ASP 120 Cb 0.27 -0.31 -0.04 0.00 -0.72 0.00 0.00 41.12 40.33 1fzy n ASP 120 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 1fzy s PRO 121 N -0.25 3.85 -0.13 -0.67 0.04 -1.23 -4.82 135.00 131.78 1fzy s PRO 121 Ca 0.33 1.35 -0.16 0.00 0.04 0.00 0.00 61.00 62.57 1fzy s PRO 121 Cb 0.09 -2.12 -0.25 0.00 0.04 0.00 0.00 34.50 32.25 1fzy s PRO 121 CO -0.16 -0.39 0.47 0.37 0.04 0.00 0.00 177.00 177.33 1fzy h GLN 122 N 1.63 0.19 -4.61 4.56 5.75 -1.09 -3.44 115.11 118.10 1fzy h GLN 122 Ca -0.49 -0.33 -0.69 0.00 -0.15 0.00 0.00 58.65 56.99 1fzy h GLN 122 Cb 1.22 0.12 -0.34 0.00 1.07 0.00 0.00 27.48 29.55 1fzy h GLN 122 CO 0.59 1.16 -0.62 0.34 -2.65 0.00 0.00 178.83 177.65 1fzy s ASP 123 N -6.97 5.11 0.32 -0.69 -1.08 -0.98 -4.92 116.67 107.45 1fzy s ASP 123 Ca -0.22 -1.70 0.01 0.00 -0.52 0.00 0.00 52.55 50.12 1fzy s ASP 123 Cb 0.05 -1.78 0.55 0.00 -1.46 0.00 0.00 42.92 40.28 1fzy s ASP 123 CO 0.73 -0.42 1.96 0.00 0.52 0.00 0.00 175.17 177.96 1fzy h ALA 124 N 8.02 1.51 -0.32 3.66 0.00 -1.85 -1.64 119.26 128.63 1fzy h ALA 124 Ca -0.16 -0.04 -0.12 0.00 0.00 0.00 0.00 54.91 54.59 1fzy h ALA 124 Cb 1.05 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 1fzy h ALA 124 CO 0.62 0.41 -0.27 0.93 0.00 0.00 0.00 179.25 180.95 1fzy h GLU 125 N 0.99 0.75 -0.38 0.00 5.08 -1.96 -0.98 114.58 118.08 1fzy h GLU 125 Ca 0.31 -0.38 -0.08 0.00 -1.00 0.00 0.00 59.36 58.22 1fzy h GLU 125 Cb 0.03 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.26 1fzy h GLU 125 CO -0.09 1.00 -0.08 0.28 -1.00 0.00 0.00 179.01 179.12 1fzy h VAL 126 N 0.52 1.24 -0.42 3.13 2.07 -1.83 0.16 116.25 121.12 1fzy h VAL 126 Ca 0.06 -1.04 -0.09 0.00 0.82 0.00 0.00 66.70 66.45 1fzy h VAL 126 Cb 0.83 1.04 -0.02 0.00 -1.52 0.00 0.00 31.29 31.62 1fzy h VAL 126 CO 0.07 0.35 -0.09 0.00 0.02 0.00 0.00 177.57 177.92 1fzy h ALA 127 N 1.32 1.05 -0.30 1.67 0.00 -1.16 -0.57 119.26 121.26 1fzy h ALA 127 Ca 0.11 -0.30 -0.07 0.00 0.00 0.00 0.00 54.91 54.65 1fzy h ALA 127 Cb 0.50 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 1fzy h ALA 127 CO 0.03 0.58 -0.10 0.37 0.00 0.00 0.00 179.25 180.13 1fzy h GLN 128 N 0.68 0.60 -0.11 0.00 -0.00 -0.57 -2.38 115.11 113.33 1fzy h GLN 128 Ca 0.12 -0.24 0.01 0.00 -0.00 0.00 0.00 58.65 58.54 1fzy h GLN 128 Cb 0.55 -0.03 -0.01 0.00 0.00 0.00 0.00 27.48 27.99 1fzy h GLN 128 CO 0.03 0.80 0.02 1.25 0.00 0.00 0.00 178.83 180.94 1fzy h HIS 129 N 0.36 0.04 -0.64 3.99 2.76 -0.49 0.15 115.15 121.33 1fzy h HIS 129 Ca 0.07 0.01 0.12 0.00 -2.20 0.00 0.00 60.37 58.37 1fzy h HIS 129 Cb 0.59 -0.00 -0.09 0.00 1.55 0.00 0.00 27.41 29.47 1fzy h HIS 129 CO 0.05 0.02 0.16 -0.92 -1.30 0.00 0.00 177.93 175.94 1fzy h TYR 130 N 0.07 0.26 -0.03 5.26 3.20 -1.03 -0.74 116.97 123.96 1fzy h TYR 130 Ca 0.05 0.04 -0.09 0.00 3.14 0.00 0.00 58.73 61.87 1fzy h TYR 130 Cb 0.04 -0.02 0.01 0.00 1.54 0.00 0.00 36.73 38.29 1fzy h TYR 130 CO -0.11 -0.02 -0.32 -0.07 -1.64 0.00 0.00 178.16 176.01 1fzy h LEU 131 N 0.30 0.33 -0.48 2.82 3.38 -1.11 -3.25 115.31 117.30 1fzy h LEU 131 Ca 0.34 -0.71 -0.10 0.00 0.09 0.00 0.00 57.88 57.51 1fzy h LEU 131 Cb 0.51 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.14 1fzy h LEU 131 CO -0.41 0.99 -0.07 -0.09 0.09 0.00 0.00 178.44 178.95 1fzy h ARG 132 N -0.30 0.90 -1.83 1.13 2.43 -0.49 -3.40 114.38 112.83 1fzy h ARG 132 Ca -0.03 -0.33 -0.41 0.00 -0.81 0.00 0.00 59.98 58.40 1fzy h ARG 132 Cb 1.01 -0.06 -0.29 0.00 -0.42 0.00 0.00 29.97 30.20 1fzy h ARG 132 CO 0.06 0.97 -0.77 0.34 -1.51 0.00 0.00 179.97 179.06 1fzy s ASP 133 N -6.48 0.35 0.16 -3.80 -1.08 -0.30 -5.02 116.67 100.50 1fzy s ASP 133 Ca -0.12 -2.44 -0.15 0.00 -0.52 0.00 0.00 52.55 49.32 1fzy s ASP 133 Cb 0.12 0.51 0.10 0.00 -1.46 0.00 0.00 42.92 42.18 1fzy s ASP 133 CO 0.84 -0.14 1.73 -0.09 0.52 0.00 0.00 175.17 178.03 1fzy h ARG 134 N 5.56 0.21 -0.48 4.34 9.65 -1.71 -0.38 114.38 131.57 1fzy h ARG 134 Ca 0.17 -0.01 0.06 0.00 -1.10 0.00 0.00 59.98 59.10 1fzy h ARG 134 Cb 1.00 -0.05 -0.05 0.00 -1.39 0.00 0.00 29.97 29.47 1fzy h ARG 134 CO 0.22 0.14 0.17 0.93 2.80 0.00 0.00 179.97 184.23 1fzy h GLU 135 N 0.22 0.34 -0.41 0.20 3.07 -1.93 0.18 114.58 116.24 1fzy h GLU 135 Ca 0.19 -0.02 -0.11 0.00 -0.50 0.00 0.00 59.36 58.92 1fzy h GLU 135 Cb 0.21 -0.08 -0.01 0.00 -0.84 0.00 0.00 28.75 28.04 1fzy h GLU 135 CO -0.24 0.22 -0.16 1.03 -1.40 0.00 0.00 179.01 178.47 1fzy h SER 136 N 0.35 0.86 -0.13 1.42 0.87 -1.85 -2.56 113.55 112.50 1fzy h SER 136 Ca 0.23 -0.39 0.05 0.00 -1.23 0.00 0.00 61.79 60.45 1fzy h SER 136 Cb 0.23 -0.24 -0.06 0.00 -0.44 0.00 0.00 62.40 61.90 1fzy h SER 136 CO -0.23 1.05 -0.31 0.15 -0.53 0.00 0.00 176.83 176.96 1fzy h PHE 137 N 0.66 -0.85 -0.78 2.24 3.57 0.19 -2.62 116.94 119.35 1fzy h PHE 137 Ca 0.10 0.04 0.07 0.00 3.53 0.00 0.00 57.97 61.71 1fzy h PHE 137 Cb 0.71 0.39 -0.06 0.00 2.79 0.00 0.00 35.95 39.78 1fzy h PHE 137 CO 0.05 -0.39 0.45 -0.91 -2.23 0.00 0.00 178.31 175.29 1fzy h ASN 138 N -0.38 0.67 -0.64 0.41 2.35 -0.59 -0.59 115.58 116.82 1fzy h ASN 138 Ca 0.10 0.03 0.03 0.00 -0.55 0.00 0.00 56.30 55.91 1fzy h ASN 138 Cb 0.53 -0.10 -0.03 0.00 0.05 0.00 0.00 38.32 38.77 1fzy h ASN 138 CO -0.35 0.41 0.42 0.11 -1.65 0.00 0.00 177.43 176.37 1fzy h LYS 139 N 0.80 0.76 -0.03 0.81 1.57 -1.31 -0.26 116.57 118.91 1fzy h LYS 139 Ca 0.36 -0.05 -0.04 0.00 -1.87 0.00 0.00 60.65 59.05 1fzy h LYS 139 Cb 0.26 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.40 1fzy h LYS 139 CO -0.21 0.50 -0.14 1.15 -0.57 0.00 0.00 179.45 180.19 1fzy h THR 140 N 0.78 1.47 -0.54 -0.16 2.02 -0.79 -1.50 112.91 114.19 1fzy h THR 140 Ca 0.25 -1.60 0.07 0.00 0.77 0.00 0.00 66.41 65.90 1fzy h THR 140 Cb 0.04 2.44 -0.06 0.00 -1.74 0.00 0.00 68.15 68.82 1fzy h THR 140 CO -0.07 0.44 0.22 0.00 0.37 0.00 0.00 175.52 176.48 1fzy h ALA 141 N 0.39 0.68 -0.55 6.16 0.00 -0.98 0.30 119.26 125.27 1fzy h ALA 141 Ca -0.01 0.06 -0.09 0.00 0.00 0.00 0.00 54.91 54.87 1fzy h ALA 141 Cb 0.78 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.56 1fzy h ALA 141 CO 0.03 -0.16 -0.00 0.00 0.00 0.00 0.00 179.25 179.12 1fzy h ALA 142 N 1.34 0.74 -0.21 0.00 0.00 -1.06 -0.56 119.26 119.50 1fzy h ALA 142 Ca 0.26 -0.30 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 1fzy h ALA 142 Cb 0.25 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1fzy h ALA 142 CO -0.23 0.56 0.13 1.25 0.00 0.00 0.00 179.25 180.96 1fzy h LEU 143 N 0.85 0.26 -1.86 0.00 5.85 -0.81 -1.94 115.31 117.66 1fzy h LEU 143 Ca 0.16 -0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.82 1fzy h LEU 143 Cb 0.54 -0.06 -0.00 0.00 0.37 0.00 0.00 40.66 41.50 1fzy h LEU 143 CO 0.03 0.22 -0.06 -0.50 -0.34 0.00 0.00 178.44 177.79 1fzy h TRP 144 N 0.27 0.01 -0.45 1.25 4.06 -0.81 0.23 115.95 120.50 1fzy h TRP 144 Ca 0.08 -0.00 -0.10 0.00 2.06 0.00 0.00 58.89 60.93 1fzy h TRP 144 Cb 0.01 -0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.16 1fzy h TRP 144 CO -0.05 0.07 -0.09 1.15 -3.56 0.00 0.00 178.44 175.96 1fzy h THR 145 N 0.01 1.27 -0.62 1.49 2.02 -0.75 0.99 112.91 117.32 1fzy h THR 145 Ca 0.00 -1.20 -0.07 0.00 0.77 0.00 0.00 66.41 65.92 1fzy h THR 145 Cb 0.12 1.12 -0.03 0.00 -1.74 0.00 0.00 68.15 67.63 1fzy h THR 145 CO 0.01 0.41 0.13 0.03 0.37 0.00 0.00 175.52 176.47 1fzy h ARG 146 N 0.69 1.01 -0.04 6.66 2.47 -0.53 -1.94 114.38 122.71 1fzy h ARG 146 Ca 0.12 -0.25 -0.11 0.00 -1.26 0.00 0.00 59.98 58.47 1fzy h ARG 146 Cb 0.63 -0.13 0.01 0.00 -1.65 0.00 0.00 29.97 28.83 1fzy h ARG 146 CO 0.04 0.93 -0.42 -0.07 0.56 0.00 0.00 179.97 181.01 1fzy h LEU 147 N 0.93 0.44 0.00 3.04 3.38 -0.47 -3.38 115.31 119.24 1fzy h LEU 147 Ca 0.19 -0.70 0.00 0.00 0.09 0.00 0.00 57.88 57.46 1fzy h LEU 147 Cb 0.39 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.00 1fzy h LEU 147 CO 0.01 1.08 -0.61 -1.22 0.09 0.00 0.00 178.44 177.79 1fzy n TYR 148 N -4.35 0.00 -1.42 1.13 0.53 0.33 -4.56 117.16 108.81 1fzy n TYR 148 Ca -0.09 0.00 0.07 0.00 -1.02 0.00 0.00 57.90 56.86 1fzy n TYR 148 Cb 0.57 -0.05 0.19 0.00 -1.03 0.00 0.00 39.34 39.02 1fzy n TYR 148 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 1fzy n ALA 149 N -1.33 3.19 1.71 -0.72 0.00 -0.73 -4.50 120.51 118.13 1fzy n ALA 149 Ca 0.00 -3.08 0.15 0.00 0.00 0.00 0.00 53.44 50.51 1fzy n ALA 149 Cb 0.12 -0.36 0.71 0.00 0.00 0.00 0.00 19.45 19.92 1fzy n ALA 149 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93