#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jf5 s GLN 2 N 0.00 2.52 0.19 2.12 0.74 -1.26 -0.43 119.66 123.54 2jf5 s GLN 2 Ca 0.00 -0.69 0.05 0.00 0.05 0.00 0.00 55.36 54.78 2jf5 s GLN 2 Cb 0.00 -2.40 -0.05 0.00 1.10 0.00 0.00 33.01 31.66 2jf5 s GLN 2 CO 0.00 0.63 -0.10 0.96 -0.55 0.00 0.00 175.29 176.23 2jf5 s ILE 3 N -0.75 1.36 -0.01 -2.34 -4.36 -0.38 0.12 121.20 114.84 2jf5 s ILE 3 Ca 0.12 -2.11 0.00 0.00 -0.26 0.00 0.00 60.65 58.40 2jf5 s ILE 3 Cb -0.11 -2.03 -0.04 0.00 1.25 0.00 0.00 42.46 41.54 2jf5 s ILE 3 CO 0.01 -0.60 0.03 -0.36 0.24 0.00 0.00 174.94 174.26 2jf5 s PHE 4 N -3.21 3.16 -0.18 1.37 0.08 -0.57 -0.97 117.98 117.66 2jf5 s PHE 4 Ca 0.21 0.14 0.01 0.00 0.12 0.00 0.00 56.93 57.41 2jf5 s PHE 4 Cb 0.02 -1.71 0.03 0.00 -0.57 0.00 0.00 43.02 40.80 2jf5 s PHE 4 CO 0.05 0.50 -0.13 0.08 -0.10 0.00 0.00 175.22 175.61 2jf5 s VAL 5 N -1.11 1.72 -0.15 -0.44 1.01 0.12 -0.63 120.40 120.92 2jf5 s VAL 5 Ca 0.20 -0.91 -0.08 0.00 0.00 0.00 0.00 61.98 61.19 2jf5 s VAL 5 Cb -0.12 -1.69 -0.04 0.00 0.00 0.00 0.00 36.38 34.53 2jf5 s VAL 5 CO 0.11 0.31 0.13 -0.54 0.00 0.00 0.00 175.10 175.11 2jf5 s LYS 6 N 1.39 3.69 0.41 2.72 1.02 0.78 -0.58 119.74 129.17 2jf5 s LYS 6 Ca 0.01 -0.18 0.06 0.00 0.02 0.00 0.00 55.97 55.89 2jf5 s LYS 6 Cb -0.15 -3.25 0.01 0.00 -0.52 0.00 0.00 37.83 33.92 2jf5 s LYS 6 CO -0.10 0.60 0.57 0.95 -0.92 0.00 0.00 175.35 176.45 2jf5 s THR 7 N -0.51 3.32 0.32 2.17 -4.23 -0.46 -1.01 115.64 115.24 2jf5 s THR 7 Ca 0.12 -0.93 0.09 0.00 -1.18 0.00 0.00 61.69 59.78 2jf5 s THR 7 Cb -0.12 -3.14 0.33 0.00 1.34 0.00 0.00 72.50 70.92 2jf5 s THR 7 CO 0.02 -0.06 1.63 0.25 -0.54 0.00 0.00 174.62 175.92 2jf5 h LEU 8 N 0.63 0.16 -0.47 4.79 5.85 -1.90 0.87 115.31 125.24 2jf5 h LEU 8 Ca -0.42 0.21 0.00 0.00 0.84 0.00 0.00 57.88 58.51 2jf5 h LEU 8 Cb 1.27 0.25 0.00 0.00 0.37 0.00 0.00 40.66 42.55 2jf5 h LEU 8 CO 0.49 -0.21 0.00 0.35 -0.34 0.00 0.00 178.44 178.73 2jf5 n THR 9 N -5.20 0.08 -0.88 1.05 -2.24 -1.26 -4.89 114.28 100.93 2jf5 n THR 9 Ca 0.27 -0.14 0.00 0.00 -2.27 0.00 0.00 64.05 61.91 2jf5 n THR 9 Cb 0.87 -0.01 0.00 0.00 -2.10 0.00 0.00 70.33 69.09 2jf5 n THR 9 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2jf5 n GLY 10 N 0.96 0.54 3.77 3.38 0.00 0.30 -5.05 105.19 109.09 2jf5 n GLY 10 Ca 0.16 -0.18 -0.38 0.00 0.00 0.00 0.00 46.02 45.62 2jf5 n GLY 10 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2jf5 s LYS 11 N -0.43 3.93 -0.16 1.61 2.20 -1.26 -4.79 119.74 120.85 2jf5 s LYS 11 Ca 0.00 1.93 0.02 0.00 -0.36 0.00 0.00 55.97 57.56 2jf5 s LYS 11 Cb 0.00 -2.63 0.02 0.00 -1.51 0.00 0.00 37.83 33.71 2jf5 s LYS 11 CO 0.00 -0.45 -0.21 0.99 -0.36 0.00 0.00 175.35 175.32 2jf5 s THR 12 N -1.39 2.07 -0.09 3.43 2.01 -1.26 -1.36 115.64 119.05 2jf5 s THR 12 Ca 0.59 -0.95 -0.01 0.00 0.31 0.00 0.00 61.69 61.62 2jf5 s THR 12 Cb -0.33 -1.85 -0.03 0.00 0.01 0.00 0.00 72.50 70.30 2jf5 s THR 12 CO 0.41 0.54 -0.02 -0.51 -0.69 0.00 0.00 174.62 174.36 2jf5 s ILE 13 N 1.11 4.14 -0.16 1.82 2.07 0.25 -4.95 121.20 125.48 2jf5 s ILE 13 Ca 0.00 -0.31 -0.08 0.00 -1.41 0.00 0.00 60.65 58.86 2jf5 s ILE 13 Cb -0.14 -2.74 -0.04 0.00 0.13 0.00 0.00 42.46 39.67 2jf5 s ILE 13 CO -0.09 0.59 0.11 -0.89 -1.91 0.00 0.00 174.94 172.75 2jf5 s THR 14 N -0.71 5.20 -0.03 4.00 2.01 -1.26 0.12 115.64 124.96 2jf5 s THR 14 Ca 0.11 0.10 0.07 0.00 0.31 0.00 0.00 61.69 62.29 2jf5 s THR 14 Cb -0.12 -3.31 -0.02 0.00 0.01 0.00 0.00 72.50 69.06 2jf5 s THR 14 CO 0.02 0.52 -0.25 -0.76 -0.69 0.00 0.00 174.62 173.46 2jf5 s LEU 15 N -0.20 2.05 -0.26 4.42 1.43 -0.15 -5.00 118.68 120.97 2jf5 s LEU 15 Ca 0.10 -0.46 -0.20 0.00 -1.03 0.00 0.00 54.13 52.54 2jf5 s LEU 15 Cb -0.12 -1.29 -0.02 0.00 0.03 0.00 0.00 46.19 44.80 2jf5 s LEU 15 CO 0.01 0.29 0.62 -0.70 0.23 0.00 0.00 176.35 176.80 2jf5 s GLU 16 N -0.50 4.07 0.29 1.70 2.56 -1.26 -1.25 118.70 124.30 2jf5 s GLU 16 Ca 0.07 0.49 0.04 0.00 0.00 0.00 0.00 54.97 55.58 2jf5 s GLU 16 Cb -0.10 -3.66 -0.02 0.00 2.00 0.00 0.00 34.13 32.35 2jf5 s GLU 16 CO -0.00 -0.44 0.15 1.33 -0.56 0.00 0.00 175.26 175.74 2jf5 n VAL 17 N 5.23 0.00 -4.20 3.70 0.24 0.43 -5.01 118.33 118.71 2jf5 n VAL 17 Ca -0.01 -1.82 -0.17 0.00 -2.04 0.00 0.00 64.34 60.30 2jf5 n VAL 17 Cb 0.49 0.76 -0.11 0.00 -1.47 0.00 0.00 33.84 33.51 2jf5 n VAL 17 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 2jf5 s GLU 18 N -3.12 0.92 0.37 7.34 2.02 -1.26 -3.68 118.70 121.29 2jf5 s GLU 18 Ca 0.22 -1.13 0.10 0.00 0.02 0.00 0.00 54.97 54.18 2jf5 s GLU 18 Cb 0.01 -0.80 0.86 0.00 0.10 0.00 0.00 34.13 34.30 2jf5 s GLU 18 CO 0.15 0.16 1.88 -1.35 0.02 0.00 0.00 175.26 176.12 2jf5 h PRO 19 N 3.79 0.62 -0.27 0.39 0.11 -1.96 -1.45 132.00 133.23 2jf5 h PRO 19 Ca -0.40 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.68 2jf5 h PRO 19 Cb 1.19 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.16 2jf5 h PRO 19 CO 0.47 0.41 0.00 0.43 -0.21 0.00 0.00 178.00 179.11 2jf5 n SER 20 N -4.55 2.06 -4.68 -2.05 7.64 -1.26 -1.66 113.62 109.12 2jf5 n SER 20 Ca 0.17 -1.83 -0.45 0.00 1.01 0.00 0.00 58.87 57.77 2jf5 n SER 20 Cb 0.48 -0.17 -0.03 0.00 -1.01 0.00 0.00 64.21 63.48 2jf5 n SER 20 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2jf5 n ASP 21 N 0.59 3.14 -4.75 6.43 8.00 -0.55 -4.71 116.55 124.69 2jf5 n ASP 21 Ca 0.16 1.11 -0.31 0.00 0.71 0.00 0.00 54.79 56.46 2jf5 n ASP 21 Cb 0.37 -1.46 0.11 0.00 -0.02 0.00 0.00 41.12 40.12 2jf5 n ASP 21 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 2jf5 s THR 22 N 0.49 3.09 0.31 -3.53 -4.23 -1.26 -1.18 115.64 109.32 2jf5 s THR 22 Ca 0.73 0.35 -0.00 0.00 -1.18 0.00 0.00 61.69 61.59 2jf5 s THR 22 Cb -0.63 -2.83 0.21 0.00 1.34 0.00 0.00 72.50 70.58 2jf5 s THR 22 CO 0.43 -0.46 1.91 0.40 -0.54 0.00 0.00 174.62 176.35 2jf5 h ILE 23 N -1.28 1.20 -1.00 2.99 1.08 -1.43 -1.99 117.51 117.08 2jf5 h ILE 23 Ca -0.45 -0.57 0.02 0.00 -0.39 0.00 0.00 64.86 63.47 2jf5 h ILE 23 Cb 1.25 0.40 -0.05 0.00 -3.07 0.00 0.00 36.82 35.35 2jf5 h ILE 23 CO 0.52 0.24 0.66 -0.33 -0.69 0.00 0.00 178.15 178.55 2jf5 h GLU 24 N 0.88 1.28 -0.66 2.37 3.07 -1.88 -0.85 114.58 118.79 2jf5 h GLU 24 Ca 0.22 -0.08 -0.06 0.00 -0.50 0.00 0.00 59.36 58.94 2jf5 h GLU 24 Cb 0.09 -0.29 -0.03 0.00 -0.84 0.00 0.00 28.75 27.68 2jf5 h GLU 24 CO -0.03 0.84 0.18 -0.91 -1.40 0.00 0.00 179.01 177.69 2jf5 h ASN 25 N 1.31 0.97 -0.42 1.42 2.35 -1.75 -1.21 115.58 118.26 2jf5 h ASN 25 Ca 0.38 -0.19 -0.08 0.00 -0.55 0.00 0.00 56.30 55.87 2jf5 h ASN 25 Cb -0.08 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.03 2jf5 h ASN 25 CO -0.10 0.92 -0.03 0.58 -1.65 0.00 0.00 177.43 177.15 2jf5 h VAL 26 N 0.99 1.27 -0.83 2.81 2.07 -0.62 -1.89 116.25 120.05 2jf5 h VAL 26 Ca 0.21 -1.09 0.01 0.00 0.82 0.00 0.00 66.70 66.65 2jf5 h VAL 26 Cb 0.32 1.13 -0.04 0.00 -1.52 0.00 0.00 31.29 31.18 2jf5 h VAL 26 CO -0.00 0.37 0.55 0.11 0.02 0.00 0.00 177.57 178.62 2jf5 h LYS 27 N 0.59 1.09 -0.63 1.57 1.57 -0.89 -1.17 116.57 118.71 2jf5 h LYS 27 Ca 0.11 -0.07 -0.09 0.00 -1.87 0.00 0.00 60.65 58.74 2jf5 h LYS 27 Cb 0.54 -0.25 -0.02 0.00 0.08 0.00 0.00 32.23 32.57 2jf5 h LYS 27 CO 0.03 0.72 0.06 0.00 -0.57 0.00 0.00 179.45 179.69 2jf5 h ALA 28 N 1.48 0.90 -0.24 3.86 0.00 -1.01 0.16 119.26 124.41 2jf5 h ALA 28 Ca 0.30 -0.29 -0.07 0.00 0.00 0.00 0.00 54.91 54.86 2jf5 h ALA 28 Cb -0.13 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.41 2jf5 h ALA 28 CO -0.07 0.66 -0.15 0.87 0.00 0.00 0.00 179.25 180.57 2jf5 h LYS 29 N 0.99 0.41 -0.32 0.00 1.57 -0.83 -2.27 116.57 116.12 2jf5 h LYS 29 Ca 0.19 -0.12 -0.16 0.00 -1.87 0.00 0.00 60.65 58.69 2jf5 h LYS 29 Cb 0.49 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.75 2jf5 h LYS 29 CO 0.02 0.56 -0.42 0.82 -0.57 0.00 0.00 179.45 179.85 2jf5 h ILE 30 N 0.38 1.28 -0.85 1.86 2.04 -0.81 -2.77 117.51 118.64 2jf5 h ILE 30 Ca 0.07 -1.61 0.08 0.00 1.00 0.00 0.00 64.86 64.41 2jf5 h ILE 30 Cb 0.49 1.48 -0.07 0.00 -0.74 0.00 0.00 36.82 37.98 2jf5 h ILE 30 CO 0.03 0.53 0.51 -0.61 0.00 0.00 0.00 178.15 178.60 2jf5 h GLN 31 N 0.66 0.85 -0.76 2.37 4.15 -0.81 0.21 115.11 121.77 2jf5 h GLN 31 Ca 0.05 -0.05 -0.04 0.00 0.77 0.00 0.00 58.65 59.37 2jf5 h GLN 31 Cb 1.00 -0.19 -0.03 0.00 0.21 0.00 0.00 27.48 28.46 2jf5 h GLN 31 CO 0.10 0.56 0.32 -0.44 -1.93 0.00 0.00 178.83 177.43 2jf5 h ASP 32 N 0.87 1.04 0.28 -0.69 3.32 -1.32 0.19 116.42 120.11 2jf5 h ASP 32 Ca 0.40 -0.17 -0.34 0.00 0.02 0.00 0.00 57.03 56.94 2jf5 h ASP 32 Cb 0.30 -0.27 0.01 0.00 0.22 0.00 0.00 39.33 39.60 2jf5 h ASP 32 CO -0.22 0.92 -1.61 0.11 -1.72 0.00 0.00 179.24 176.72 2jf5 h LYS 33 N 1.09 0.41 0.00 3.56 1.57 -1.18 -3.41 116.57 118.61 2jf5 h LYS 33 Ca 0.25 -0.69 0.00 0.00 -1.87 0.00 0.00 60.65 58.34 2jf5 h LYS 33 Cb 0.20 0.26 0.00 0.00 0.08 0.00 0.00 32.23 32.76 2jf5 h LYS 33 CO -0.02 1.31 -0.72 0.39 -0.57 0.00 0.00 179.45 179.84 2jf5 n GLU 34 N -3.60 2.74 -1.30 3.15 -0.58 0.69 -5.03 120.64 116.72 2jf5 n GLU 34 Ca -0.20 -0.02 -0.02 0.00 -0.42 0.00 0.00 57.16 56.50 2jf5 n GLU 34 Cb 1.08 -0.90 -0.01 0.00 -0.57 0.00 0.00 31.44 31.04 2jf5 n GLU 34 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2jf5 n GLY 35 N 1.72 0.48 3.67 0.62 0.00 0.66 -5.01 105.19 107.32 2jf5 n GLY 35 Ca -0.00 -0.94 -0.37 0.00 0.00 0.00 0.00 46.02 44.70 2jf5 n GLY 35 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2jf5 s ILE 36 N -2.08 5.29 0.35 -0.61 1.01 -1.26 -5.01 121.20 118.89 2jf5 s ILE 36 Ca 0.00 0.43 -0.28 0.00 0.00 0.00 0.00 60.65 60.80 2jf5 s ILE 36 Cb 0.00 -3.61 -0.12 0.00 0.01 0.00 0.00 42.46 38.74 2jf5 s ILE 36 CO 0.00 0.31 1.35 -2.65 0.00 0.00 0.00 174.94 173.95 2jf5 n PRO 37 N 4.33 2.29 0.11 2.79 -0.02 -1.26 -4.02 135.00 139.22 2jf5 n PRO 37 Ca -0.12 0.80 0.13 0.00 -2.02 0.00 0.00 63.50 62.30 2jf5 n PRO 37 Cb 0.52 -2.43 0.64 0.00 -0.02 0.00 0.00 33.50 32.21 2jf5 n PRO 37 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 2jf5 h PRO 38 N 2.72 0.05 0.00 0.52 0.11 -1.97 -1.65 132.00 131.79 2jf5 h PRO 38 Ca -0.47 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2jf5 h PRO 38 Cb 1.27 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.37 2jf5 h PRO 38 CO 0.63 0.04 0.00 0.38 -0.21 0.00 0.00 178.00 178.84 2jf5 h ASP 39 N 0.06 0.00 0.04 -2.05 2.03 -1.98 -1.92 116.42 112.60 2jf5 h ASP 39 Ca 0.14 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.44 2jf5 h ASP 39 Cb 0.47 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.97 2jf5 h ASP 39 CO -0.01 0.00 -0.10 0.00 -1.03 0.00 0.00 179.24 178.11 2jf5 n GLN 40 N -2.83 1.56 -3.73 4.15 6.02 -0.62 -4.91 117.38 117.02 2jf5 n GLN 40 Ca -0.00 -1.03 -0.36 0.00 -0.01 0.00 0.00 57.00 55.60 2jf5 n GLN 40 Cb 0.21 -1.48 -0.07 0.00 1.02 0.00 0.00 30.24 29.92 2jf5 n GLN 40 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 2jf5 s GLN 41 N -2.15 3.89 -0.06 -1.09 -0.21 -0.72 -0.44 119.66 118.87 2jf5 s GLN 41 Ca 0.32 -0.06 0.05 0.00 0.02 0.00 0.00 55.36 55.69 2jf5 s GLN 41 Cb 0.20 -3.31 -0.01 0.00 1.00 0.00 0.00 33.01 30.89 2jf5 s GLN 41 CO 0.39 0.51 -0.22 1.03 -2.12 0.00 0.00 175.29 174.88 2jf5 s ARG 42 N -0.30 2.33 -0.11 2.91 1.81 0.63 -4.91 118.95 121.31 2jf5 s ARG 42 Ca 0.14 -0.79 0.02 0.00 -1.72 0.00 0.00 55.73 53.37 2jf5 s ARG 42 Cb -0.12 -1.96 -0.01 0.00 -0.45 0.00 0.00 34.95 32.40 2jf5 s ARG 42 CO 0.03 0.31 -0.16 -0.51 -0.68 0.00 0.00 175.30 174.29 2jf5 s LEU 43 N -0.03 2.59 -0.05 2.53 1.43 -1.26 -0.30 118.68 123.58 2jf5 s LEU 43 Ca -0.06 -0.35 0.06 0.00 -1.03 0.00 0.00 54.13 52.75 2jf5 s LEU 43 Cb -0.14 -1.56 -0.01 0.00 0.03 0.00 0.00 46.19 44.52 2jf5 s LEU 43 CO 0.04 0.20 -0.23 -0.63 0.23 0.00 0.00 176.35 175.96 2jf5 s ILE 44 N 0.12 1.91 -0.08 -0.59 1.09 -0.28 -0.07 121.20 123.30 2jf5 s ILE 44 Ca -0.08 -0.99 0.01 0.00 -1.10 0.00 0.00 60.65 58.50 2jf5 s ILE 44 Cb -0.15 -1.62 0.02 0.00 -1.06 0.00 0.00 42.46 39.65 2jf5 s ILE 44 CO 0.05 0.53 -0.08 0.12 -0.10 0.00 0.00 174.94 175.46 2jf5 s PHE 45 N -0.12 1.27 -1.43 3.97 5.36 0.15 -0.78 117.98 126.40 2jf5 s PHE 45 Ca -0.03 -0.51 -0.01 0.00 -0.96 0.00 0.00 56.93 55.42 2jf5 s PHE 45 Cb -0.13 -1.02 0.01 0.00 -0.34 0.00 0.00 43.02 41.53 2jf5 s PHE 45 CO 0.03 -0.34 0.41 0.00 -1.46 0.00 0.00 175.22 173.87 2jf5 n ALA 46 N 4.32 -1.98 0.00 11.12 0.00 -1.26 -1.38 120.51 131.32 2jf5 n ALA 46 Ca -0.19 -0.26 0.00 0.00 0.00 0.00 0.00 53.44 52.99 2jf5 n ALA 46 Cb 0.51 -1.54 0.00 0.00 0.00 0.00 0.00 19.45 18.42 2jf5 n ALA 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jf5 n GLY 47 N -1.99 2.81 3.63 0.00 0.00 -1.26 -5.02 105.19 103.36 2jf5 n GLY 47 Ca -0.30 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.38 2jf5 n GLY 47 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2jf5 s LYS 48 N -0.08 3.97 0.03 1.61 2.20 -0.48 -5.06 119.74 121.92 2jf5 s LYS 48 Ca 0.00 -0.35 -0.30 0.00 -0.36 0.00 0.00 55.97 54.96 2jf5 s LYS 48 Cb 0.00 -3.24 -0.06 0.00 -1.51 0.00 0.00 37.83 33.02 2jf5 s LYS 48 CO 0.00 0.24 1.44 -1.14 -0.36 0.00 0.00 175.35 175.53 2jf5 s GLN 49 N 0.47 4.27 0.24 4.03 0.74 -1.26 -0.67 119.66 127.48 2jf5 s GLN 49 Ca 0.03 2.04 -0.28 0.00 0.05 0.00 0.00 55.36 57.20 2jf5 s GLN 49 Cb -0.13 -3.53 -0.09 0.00 1.10 0.00 0.00 33.01 30.36 2jf5 s GLN 49 CO 0.01 -0.58 0.90 -0.51 -0.55 0.00 0.00 175.29 174.55 2jf5 s LEU 50 N 2.26 4.57 -0.11 3.68 1.43 0.90 -4.97 118.68 126.45 2jf5 s LEU 50 Ca 0.65 1.85 -0.01 0.00 -1.03 0.00 0.00 54.13 55.59 2jf5 s LEU 50 Cb -0.33 -3.63 -0.03 0.00 0.03 0.00 0.00 46.19 42.23 2jf5 s LEU 50 CO 0.28 0.12 -0.06 -1.61 0.23 0.00 0.00 176.35 175.31 2jf5 s GLU 51 N -1.38 3.15 -0.06 1.70 2.02 -1.26 -4.69 118.70 118.18 2jf5 s GLU 51 Ca 0.42 -0.55 -0.39 0.00 0.02 0.00 0.00 54.97 54.47 2jf5 s GLU 51 Cb -0.24 -2.71 -0.18 0.00 0.10 0.00 0.00 34.13 31.10 2jf5 s GLU 51 CO 0.29 0.47 1.36 -0.25 0.02 0.00 0.00 175.26 177.15 2jf5 n ASP 52 N 2.81 1.28 0.00 -0.19 9.92 -1.26 -1.86 116.55 127.25 2jf5 n ASP 52 Ca -0.18 1.13 0.00 0.00 -0.53 0.00 0.00 54.79 55.21 2jf5 n ASP 52 Cb 0.53 -1.08 0.00 0.00 -0.64 0.00 0.00 41.12 39.93 2jf5 n ASP 52 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2jf5 n GLY 53 N 2.67 2.23 3.96 0.44 0.00 -1.26 -5.01 105.19 108.22 2jf5 n GLY 53 Ca 0.21 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.01 2jf5 n GLY 53 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2jf5 s ARG 54 N -0.24 2.86 0.31 1.61 1.81 -0.78 -4.93 118.95 119.59 2jf5 s ARG 54 Ca 0.00 -0.59 0.08 0.00 -1.72 0.00 0.00 55.73 53.51 2jf5 s ARG 54 Cb 0.00 -2.52 -0.04 0.00 -0.45 0.00 0.00 34.95 31.94 2jf5 s ARG 54 CO 0.00 -0.45 0.12 0.95 -0.68 0.00 0.00 175.30 175.24 2jf5 s THR 55 N -2.65 3.31 0.21 0.02 -4.23 -1.26 -1.29 115.64 109.76 2jf5 s THR 55 Ca 0.52 -1.70 -0.10 0.00 -1.18 0.00 0.00 61.69 59.23 2jf5 s THR 55 Cb -0.10 -3.00 0.18 0.00 1.34 0.00 0.00 72.50 70.92 2jf5 s THR 55 CO 0.38 -0.25 1.68 -0.07 -0.54 0.00 0.00 174.62 175.83 2jf5 h LEU 56 N 1.60 -0.13 -1.72 4.79 3.38 -1.20 -2.41 115.31 119.61 2jf5 h LEU 56 Ca -0.44 0.13 -0.03 0.00 0.09 0.00 0.00 57.88 57.63 2jf5 h LEU 56 Cb 1.25 0.21 -0.00 0.00 0.09 0.00 0.00 40.66 42.21 2jf5 h LEU 56 CO 0.62 -0.06 -0.16 0.77 0.09 0.00 0.00 178.44 179.70 2jf5 h SER 57 N 0.18 0.00 -0.30 -0.43 4.64 -1.54 -1.76 113.55 114.35 2jf5 h SER 57 Ca 0.33 0.00 0.06 0.00 -0.47 0.00 0.00 61.79 61.70 2jf5 h SER 57 Cb 0.52 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.59 2jf5 h SER 57 CO -0.47 0.16 0.20 0.44 -0.87 0.00 0.00 176.83 176.29 2jf5 h ASP 58 N 0.00 0.13 -0.48 4.97 3.32 -1.74 -1.21 116.42 121.41 2jf5 h ASP 58 Ca -0.00 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2jf5 h ASP 58 Cb 0.30 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 39.82 2jf5 h ASP 58 CO 0.02 0.09 0.00 -1.22 -1.72 0.00 0.00 179.24 176.41 2jf5 n TYR 59 N -4.48 0.63 -3.28 4.55 4.01 -0.74 -4.97 117.16 112.87 2jf5 n TYR 59 Ca 0.03 -0.31 -0.24 0.00 -0.16 0.00 0.00 57.90 57.22 2jf5 n TYR 59 Cb 0.26 0.00 0.04 0.00 -0.31 0.00 0.00 39.34 39.33 2jf5 n TYR 59 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 2jf5 n ASN 60 N 1.56 -5.80 -4.66 7.72 5.15 -0.46 -4.96 115.26 113.81 2jf5 n ASN 60 Ca 0.21 -0.40 -0.42 0.00 -0.60 0.00 0.00 54.58 53.36 2jf5 n ASN 60 Cb 0.62 -4.65 -0.03 0.00 -0.53 0.00 0.00 39.78 35.18 2jf5 n ASN 60 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2jf5 s ILE 61 N -3.20 4.76 0.52 -1.44 1.01 -0.74 -5.01 121.20 117.11 2jf5 s ILE 61 Ca 0.42 1.84 0.01 0.00 0.00 0.00 0.00 60.65 62.92 2jf5 s ILE 61 Cb -0.19 -4.23 -0.00 0.00 0.01 0.00 0.00 42.46 38.05 2jf5 s ILE 61 CO 0.52 -0.10 0.05 -1.10 0.00 0.00 0.00 174.94 174.31 2jf5 s GLN 62 N 2.83 2.22 0.25 2.79 -0.21 -1.26 -4.49 119.66 121.79 2jf5 s GLN 62 Ca 0.41 -2.39 -0.30 0.00 0.02 0.00 0.00 55.36 53.10 2jf5 s GLN 62 Cb -0.16 -1.59 -0.14 0.00 1.00 0.00 0.00 33.01 32.12 2jf5 s GLN 62 CO 0.08 -0.42 1.19 0.36 -2.12 0.00 0.00 175.29 174.38 2jf5 n LYS 63 N -1.35 1.57 -0.92 2.91 2.85 -1.26 -1.93 118.16 120.03 2jf5 n LYS 63 Ca -0.18 0.56 0.00 0.00 -1.05 0.00 0.00 58.31 57.63 2jf5 n LYS 63 Cb 0.67 -2.06 0.00 0.00 -0.65 0.00 0.00 35.03 32.98 2jf5 n LYS 63 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 2jf5 n GLU 64 N 1.35 -0.15 -1.67 -1.58 1.02 0.12 -5.00 120.64 114.74 2jf5 n GLU 64 Ca 0.11 0.04 -0.37 0.00 -0.02 0.00 0.00 57.16 56.92 2jf5 n GLU 64 Cb 0.30 -3.12 0.08 0.00 -0.02 0.00 0.00 31.44 28.68 2jf5 n GLU 64 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 2jf5 s SER 65 N -2.52 4.47 -0.13 1.62 0.01 -0.81 -4.75 113.70 111.60 2jf5 s SER 65 Ca 0.00 2.60 -0.00 0.00 1.31 0.00 0.00 55.95 59.86 2jf5 s SER 65 Cb 0.00 -2.62 -0.01 0.00 0.21 0.00 0.00 66.02 63.60 2jf5 s SER 65 CO 0.00 -2.09 -0.13 -0.89 0.41 0.00 0.00 173.24 170.54 2jf5 s THR 66 N -1.48 3.02 0.10 1.44 2.01 -1.26 -1.51 115.64 117.96 2jf5 s THR 66 Ca 0.82 -0.67 0.05 0.00 0.31 0.00 0.00 61.69 62.19 2jf5 s THR 66 Cb -0.37 -2.27 -0.04 0.00 0.01 0.00 0.00 72.50 69.84 2jf5 s THR 66 CO 0.41 0.52 0.02 -0.76 -0.69 0.00 0.00 174.62 174.13 2jf5 s LEU 67 N 0.38 3.54 -0.18 4.42 1.02 0.20 -4.64 118.68 123.41 2jf5 s LEU 67 Ca -0.11 -0.17 -0.02 0.00 0.02 0.00 0.00 54.13 53.85 2jf5 s LEU 67 Cb -0.16 -2.24 -0.01 0.00 0.02 0.00 0.00 46.19 43.80 2jf5 s LEU 67 CO 0.05 0.16 -0.08 -1.00 0.02 0.00 0.00 176.35 175.50 2jf5 s HIS 68 N -1.40 2.91 -0.28 0.29 3.76 0.04 -0.16 115.29 120.45 2jf5 s HIS 68 Ca 0.27 -0.82 -0.21 0.00 -0.15 0.00 0.00 55.06 54.15 2jf5 s HIS 68 Cb -0.11 -2.00 -0.01 0.00 1.11 0.00 0.00 32.58 31.57 2jf5 s HIS 68 CO 0.19 -0.40 0.66 -1.17 -0.85 0.00 0.00 174.74 173.17 2jf5 s LEU 69 N 0.99 4.09 -0.16 0.89 2.96 -0.18 -1.13 118.68 126.14 2jf5 s LEU 69 Ca -0.01 0.62 -0.02 0.00 -0.22 0.00 0.00 54.13 54.51 2jf5 s LEU 69 Cb -0.15 -2.89 -0.01 0.00 0.50 0.00 0.00 46.19 43.64 2jf5 s LEU 69 CO -0.00 -0.45 -0.09 -0.69 -1.32 0.00 0.00 176.35 173.80 2jf5 s VAL 70 N 2.62 3.30 -0.10 1.68 1.01 0.58 -4.06 120.40 125.43 2jf5 s VAL 70 Ca 0.27 -0.55 -0.15 0.00 0.00 0.00 0.00 61.98 61.54 2jf5 s VAL 70 Cb -0.15 -2.44 -0.05 0.00 0.00 0.00 0.00 36.38 33.75 2jf5 s VAL 70 CO 0.10 0.49 0.39 -0.76 0.00 0.00 0.00 175.10 175.31 2jf5 s LEU 71 N 0.72 4.32 -0.09 3.92 1.43 -1.26 -0.27 118.68 127.45 2jf5 s LEU 71 Ca -0.04 0.74 -0.29 0.00 -1.03 0.00 0.00 54.13 53.51 2jf5 s LEU 71 Cb -0.15 -2.54 -0.07 0.00 0.03 0.00 0.00 46.19 43.46 2jf5 s LEU 71 CO 0.02 0.13 2.10 -0.60 0.23 0.00 0.00 176.35 178.23 2jf5 s ARG 72 N 0.08 3.64 -0.02 1.70 3.52 0.41 -4.94 118.95 123.34 2jf5 s ARG 72 Ca 0.22 2.33 -0.37 0.00 -0.13 0.00 0.00 55.73 57.78 2jf5 s ARG 72 Cb -0.15 -4.27 -0.16 0.00 -1.56 0.00 0.00 34.95 28.81 2jf5 s ARG 72 CO 0.09 -1.53 1.52 1.47 -0.81 0.00 0.00 175.30 176.04 2jf5 n LEU 73 N 9.62 2.15 -4.57 -0.88 -0.00 -1.26 -4.71 117.00 117.35 2jf5 n LEU 73 Ca 0.25 1.09 -0.40 0.00 -0.00 0.00 0.00 56.01 56.95 2jf5 n LEU 73 Cb 0.43 -1.22 -0.03 0.00 -0.00 0.00 0.00 43.42 42.61 2jf5 n LEU 73 CO 0.67 -0.71 1.79 -0.60 -0.00 0.00 0.00 177.39 178.54 2jf5 s ARG 74 N 1.68 2.73 3.44 1.47 3.52 -1.26 -3.85 118.95 126.69 2jf5 s ARG 74 Ca 0.88 1.41 0.00 0.00 -0.13 0.00 0.00 55.73 57.89 2jf5 s ARG 74 Cb -0.94 -4.41 0.00 0.00 -1.56 0.00 0.00 34.95 28.04 2jf5 s ARG 74 CO 0.52 -2.56 0.00 0.41 -0.81 0.00 0.00 175.30 172.85 2jf5 n GLY 75 N 5.75 2.01 0.00 8.12 0.00 -1.26 -5.28 105.19 114.53 2jf5 n GLY 75 Ca 0.29 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.28 2jf5 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93