#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1f62 s ARG 2 N 0.00 0.31 0.59 0.00 6.06 -1.26 -4.96 118.95 119.69 1f62 s ARG 2 Ca 0.00 0.12 -0.18 0.00 -2.50 0.00 0.00 55.73 53.17 1f62 s ARG 2 Cb 0.00 0.14 -0.04 0.00 0.06 0.00 0.00 34.95 35.12 1f62 s ARG 2 CO 0.00 -0.05 1.13 0.00 -2.50 0.00 0.00 175.30 173.88 1f62 h LYS 4 N 0.79 -0.79 0.01 0.00 3.64 -1.49 -2.88 116.57 115.85 1f62 h LYS 4 Ca -0.49 0.05 0.00 0.00 -1.27 0.00 0.00 60.65 58.95 1f62 h LYS 4 Cb 1.26 0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 33.25 1f62 h LYS 4 CO 0.56 -0.49 -0.08 0.28 -2.27 0.00 0.00 179.45 177.45 1f62 h VAL 5 N -1.14 0.00 0.00 2.00 2.07 -1.95 -3.32 116.25 113.91 1f62 h VAL 5 Ca -0.08 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.42 1f62 h VAL 5 Cb 0.67 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 30.44 1f62 h VAL 5 CO 0.14 0.00 -0.11 0.00 0.02 0.00 0.00 177.57 177.62 1f62 n ARG 7 N -4.67 0.00 -3.14 0.00 0.63 -1.09 -4.81 116.66 103.58 1f62 n ARG 7 Ca -0.07 0.00 -0.20 0.00 -0.92 0.00 0.00 57.85 56.66 1f62 n ARG 7 Cb 0.29 -4.20 -0.04 0.00 0.45 0.00 0.00 32.46 28.96 1f62 n ARG 7 CO 0.00 0.00 0.00 1.63 -2.51 0.00 0.00 177.63 176.75 1f62 n LYS 8 N -2.00 0.83 -3.67 -0.14 5.02 -1.26 -4.88 118.16 112.05 1f62 n LYS 8 Ca 0.00 -3.14 -0.09 0.00 -2.02 0.00 0.00 58.31 53.06 1f62 n LYS 8 Cb 0.00 -1.41 -0.10 0.00 -0.02 0.00 0.00 35.03 33.50 1f62 n LYS 8 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 1f62 s LYS 9 N -1.49 0.36 0.38 1.97 2.20 -1.26 -5.06 119.74 116.85 1f62 s LYS 9 Ca 0.36 0.97 0.12 0.00 -0.36 0.00 0.00 55.97 57.06 1f62 s LYS 9 Cb 0.25 0.22 0.77 0.00 -1.51 0.00 0.00 37.83 37.56 1f62 s LYS 9 CO -0.10 -0.22 1.86 0.78 -0.36 0.00 0.00 175.35 177.31 1f62 h GLY 10 N 7.81 0.05 -6.02 5.54 0.00 -2.04 -3.37 103.07 105.03 1f62 h GLY 10 Ca -0.23 -0.04 -0.69 0.00 0.00 0.00 0.00 47.33 46.38 1f62 h GLY 10 CO 0.18 0.03 2.99 1.18 0.00 0.00 0.00 176.54 180.92 1f62 n GLU 11 N -4.16 2.59 -1.45 4.80 4.71 -1.26 -4.78 120.64 121.09 1f62 n GLU 11 Ca -0.02 -2.38 -0.39 0.00 -0.01 0.00 0.00 57.16 54.36 1f62 n GLU 11 Cb 0.36 -3.15 -0.02 0.00 -1.01 0.00 0.00 31.44 27.61 1f62 n GLU 11 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 1f62 n ASP 12 N 6.19 8.54 -0.03 1.62 8.00 -1.26 -4.59 116.55 135.02 1f62 n ASP 12 Ca 0.53 -2.68 -0.02 0.00 0.71 0.00 0.00 54.79 53.33 1f62 n ASP 12 Cb 0.38 -1.53 -0.01 0.00 -0.02 0.00 0.00 41.12 39.94 1f62 n ASP 12 CO 0.00 0.00 0.00 -0.78 -0.39 0.00 0.00 177.20 176.03 1f62 h ASP 13 N 4.95 0.00 -2.59 -2.24 3.58 -1.97 -3.45 116.42 114.71 1f62 h ASP 13 Ca 0.84 0.00 -0.60 0.00 0.42 0.00 0.00 57.03 57.69 1f62 h ASP 13 Cb 0.29 0.00 -0.40 0.00 1.72 0.00 0.00 39.33 40.94 1f62 h ASP 13 CO 1.73 0.36 -0.80 0.29 -2.88 0.00 0.00 179.24 177.94 1f62 n LYS 14 N -3.43 1.06 -1.59 0.28 5.02 -1.26 -5.10 118.16 113.13 1f62 n LYS 14 Ca -0.03 -3.81 -0.30 0.00 -2.02 0.00 0.00 58.31 52.15 1f62 n LYS 14 Cb 0.12 -1.91 0.07 0.00 -0.02 0.00 0.00 35.03 33.28 1f62 n LYS 14 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1f62 s LEU 15 N -0.85 2.82 -0.29 -0.35 1.02 -1.26 -3.05 118.68 116.72 1f62 s LEU 15 Ca 0.31 1.40 -0.01 0.00 0.02 0.00 0.00 54.13 55.85 1f62 s LEU 15 Cb 0.03 -4.13 0.18 0.00 0.02 0.00 0.00 46.19 42.29 1f62 s LEU 15 CO -0.17 -1.71 0.58 -0.51 0.02 0.00 0.00 176.35 174.56 1f62 s ILE 16 N -3.14 -0.96 0.52 -0.59 2.07 0.14 -4.92 121.20 114.33 1f62 s ILE 16 Ca 0.59 -0.01 -0.19 0.00 -1.41 0.00 0.00 60.65 59.64 1f62 s ILE 16 Cb -0.14 -0.98 -0.07 0.00 0.13 0.00 0.00 42.46 41.40 1f62 s ILE 16 CO 0.54 -0.01 1.05 -0.76 -1.91 0.00 0.00 174.94 173.85 1f62 s LEU 17 N 2.83 3.74 0.31 8.50 1.43 -1.26 -1.16 118.68 133.06 1f62 s LEU 17 Ca 0.20 1.91 -0.29 0.00 -1.03 0.00 0.00 54.13 54.92 1f62 s LEU 17 Cb -0.15 -4.55 -0.10 0.00 0.03 0.00 0.00 46.19 41.42 1f62 s LEU 17 CO -0.21 -0.91 1.22 0.00 0.23 0.00 0.00 176.35 176.69 1f62 h ASP 19 N 3.53 0.27 0.00 0.00 2.03 -1.54 -2.41 116.42 118.31 1f62 h ASP 19 Ca -0.48 0.03 0.00 0.00 -0.73 0.00 0.00 57.03 55.85 1f62 h ASP 19 Cb 1.22 -0.02 0.00 0.00 -0.83 0.00 0.00 39.33 39.70 1f62 h ASP 19 CO 0.66 0.20 -0.05 -0.08 -1.03 0.00 0.00 179.24 178.94 1f62 h GLU 20 N 0.41 0.00 -0.02 4.15 4.81 -1.93 -3.41 114.58 118.59 1f62 h GLU 20 Ca 0.19 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.42 1f62 h GLU 20 Cb 0.13 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.51 1f62 h GLU 20 CO -0.15 0.00 -0.30 0.00 -0.73 0.00 0.00 179.01 177.82 1f62 n ASN 22 N 0.09 -2.69 -4.77 0.00 5.15 -0.91 -4.94 115.26 107.19 1f62 n ASN 22 Ca 0.12 -0.70 -0.36 0.00 -0.60 0.00 0.00 54.58 53.03 1f62 n ASN 22 Cb 0.45 -4.55 -0.08 0.00 -0.53 0.00 0.00 39.78 35.08 1f62 n ASN 22 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 1f62 s LYS 23 N -5.90 3.63 0.16 1.20 1.02 -1.26 -4.76 119.74 113.83 1f62 s LYS 23 Ca 0.17 -0.23 -0.28 0.00 0.02 0.00 0.00 55.97 55.65 1f62 s LYS 23 Cb -0.08 -3.19 -0.07 0.00 -0.52 0.00 0.00 37.83 33.97 1f62 s LYS 23 CO 0.77 0.57 0.89 0.00 -0.92 0.00 0.00 175.35 176.67 1f62 s ALA 24 N -0.45 3.34 0.14 5.17 0.00 -1.26 -1.56 121.76 127.14 1f62 s ALA 24 Ca 0.11 0.50 -0.01 0.00 0.00 0.00 0.00 51.96 52.57 1f62 s ALA 24 Cb -0.12 -3.15 -0.04 0.00 0.00 0.00 0.00 23.12 19.81 1f62 s ALA 24 CO 0.02 0.13 0.06 -0.06 0.00 0.00 0.00 175.76 175.91 1f62 s PHE 25 N -0.64 0.94 0.19 0.00 0.40 -0.31 -1.10 117.98 117.45 1f62 s PHE 25 Ca 0.41 -1.22 0.06 0.00 -0.60 0.00 0.00 56.93 55.58 1f62 s PHE 25 Cb -0.24 -0.52 -0.04 0.00 0.51 0.00 0.00 43.02 42.74 1f62 s PHE 25 CO 0.29 -0.49 0.11 -1.01 0.70 0.00 0.00 175.22 174.82 1f62 s HIS 26 N -4.01 3.06 0.24 0.36 3.76 -1.26 -0.68 115.29 116.76 1f62 s HIS 26 Ca 0.26 -0.06 -0.05 0.00 -0.15 0.00 0.00 55.06 55.05 1f62 s HIS 26 Cb 0.07 -1.45 0.33 0.00 1.11 0.00 0.00 32.58 32.64 1f62 s HIS 26 CO 0.03 0.52 1.86 -0.07 -0.85 0.00 0.00 174.74 176.23 1f62 h LEU 27 N 2.28 0.88 -0.78 0.89 3.38 -1.87 -1.57 115.31 118.52 1f62 h LEU 27 Ca -0.48 0.01 0.14 0.00 0.09 0.00 0.00 57.88 57.65 1f62 h LEU 27 Cb 1.21 -0.17 -0.14 0.00 0.09 0.00 0.00 40.66 41.64 1f62 h LEU 27 CO 0.62 0.57 -0.28 -0.26 0.09 0.00 0.00 178.44 179.18 1f62 h PHE 28 N 1.02 -0.69 0.03 1.13 0.04 -1.84 0.43 116.94 117.05 1f62 h PHE 28 Ca 0.38 0.08 -0.24 0.00 2.80 0.00 0.00 57.97 60.98 1f62 h PHE 28 Cb 0.14 0.42 0.01 0.00 2.20 0.00 0.00 35.95 38.72 1f62 h PHE 28 CO -0.03 -0.37 -1.01 0.00 -0.60 0.00 0.00 178.31 176.30 1f62 h LEU 30 N 0.22 -0.01 -6.23 0.00 3.38 -1.04 -3.46 115.31 108.16 1f62 h LEU 30 Ca -0.10 0.00 -0.50 0.00 0.09 0.00 0.00 57.88 57.37 1f62 h LEU 30 Cb 1.67 0.00 -0.35 0.00 0.09 0.00 0.00 40.66 42.07 1f62 h LEU 30 CO 0.18 0.03 -0.86 -0.13 0.09 0.00 0.00 178.44 177.75 1f62 s ARG 31 N -1.29 0.82 0.51 1.13 1.81 0.12 -5.03 118.95 117.01 1f62 s ARG 31 Ca -0.00 -1.67 0.17 0.00 -1.72 0.00 0.00 55.73 52.51 1f62 s ARG 31 Cb 0.00 -1.13 1.27 0.00 -0.45 0.00 0.00 34.95 34.64 1f62 s ARG 31 CO 0.01 -1.32 2.12 -1.00 -0.68 0.00 0.00 175.30 174.42 1f62 h PRO 32 N 6.00 0.00 -1.00 3.54 0.13 -1.60 -0.31 132.00 138.75 1f62 h PRO 32 Ca 0.18 0.00 0.11 0.00 -0.87 0.00 0.00 66.00 65.42 1f62 h PRO 32 Cb 0.96 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 32.01 1f62 h PRO 32 CO 0.28 0.05 0.63 0.00 -0.23 0.00 0.00 178.00 178.74 1f62 h ALA 33 N 1.95 1.49 -1.89 -0.56 0.00 -1.92 -3.39 119.26 114.94 1f62 h ALA 33 Ca -0.00 0.02 -0.57 0.00 0.00 0.00 0.00 54.91 54.36 1f62 h ALA 33 Cb 0.09 -0.22 -0.06 0.00 0.00 0.00 0.00 17.79 17.60 1f62 h ALA 33 CO 0.01 0.26 0.94 -1.17 0.00 0.00 0.00 179.25 179.29 1f62 s LEU 34 N -10.22 3.82 -0.17 0.00 2.96 -0.13 -4.90 118.68 110.04 1f62 s LEU 34 Ca -0.12 0.99 0.08 0.00 -0.22 0.00 0.00 54.13 54.86 1f62 s LEU 34 Cb 0.22 -3.54 -0.23 0.00 0.50 0.00 0.00 46.19 43.14 1f62 s LEU 34 CO 0.81 -1.10 0.18 -1.22 -1.32 0.00 0.00 176.35 173.70 1f62 n TYR 35 N 7.60 0.46 -3.67 5.38 4.01 -1.26 -4.70 117.16 124.98 1f62 n TYR 35 Ca 0.14 0.13 -0.25 0.00 -0.16 0.00 0.00 57.90 57.76 1f62 n TYR 35 Cb 0.47 -1.07 -0.02 0.00 -0.31 0.00 0.00 39.34 38.41 1f62 n TYR 35 CO 0.00 0.00 0.00 -1.21 -0.46 0.00 0.00 176.86 175.19 1f62 s GLU 36 N -2.53 3.49 0.18 -0.72 2.02 -1.26 -5.03 118.70 114.85 1f62 s GLU 36 Ca -0.18 -0.45 -0.30 0.00 0.02 0.00 0.00 54.97 54.06 1f62 s GLU 36 Cb 0.07 -2.80 -0.08 0.00 0.10 0.00 0.00 34.13 31.42 1f62 s GLU 36 CO 0.76 0.33 1.24 0.08 0.02 0.00 0.00 175.26 177.69 1f62 s VAL 37 N -2.04 3.45 -0.38 2.63 1.01 -1.26 -5.01 120.40 118.80 1f62 s VAL 37 Ca 0.38 1.20 -0.24 0.00 0.00 0.00 0.00 61.98 63.31 1f62 s VAL 37 Cb -0.10 -3.76 0.01 0.00 0.00 0.00 0.00 36.38 32.53 1f62 s VAL 37 CO 0.31 0.18 0.85 -2.16 0.00 0.00 0.00 175.10 174.28 1f62 s PRO 38 N -0.11 3.73 -1.14 2.72 0.04 -1.26 -4.97 135.00 134.01 1f62 s PRO 38 Ca 0.55 0.35 -0.16 0.00 0.04 0.00 0.00 61.00 61.78 1f62 s PRO 38 Cb -0.34 -3.83 -0.06 0.00 0.04 0.00 0.00 34.50 30.31 1f62 s PRO 38 CO 0.37 -0.94 2.18 -0.40 0.04 0.00 0.00 177.00 178.24 1f62 n ASP 39 N 6.64 4.02 -3.60 6.66 5.75 -1.26 -4.83 116.55 129.93 1f62 n ASP 39 Ca 0.05 -2.68 -0.09 0.00 -0.01 0.00 0.00 54.79 52.06 1f62 n ASP 39 Cb 0.48 -1.36 -0.02 0.00 -1.03 0.00 0.00 41.12 39.19 1f62 n ASP 39 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 1f62 s GLY 40 N 3.81 0.31 -1.19 6.12 0.00 -1.26 -5.10 107.32 110.02 1f62 s GLY 40 Ca 0.53 -0.66 -0.19 0.00 0.00 0.00 0.00 44.72 44.39 1f62 s GLY 40 CO 0.00 -0.35 1.60 -0.54 0.00 0.00 0.00 173.10 173.81 1f62 s GLU 41 N -3.46 3.85 -0.36 2.90 8.01 -1.26 -4.95 118.70 123.43 1f62 s GLU 41 Ca 0.16 -1.73 -0.29 0.00 0.01 0.00 0.00 54.97 53.13 1f62 s GLU 41 Cb -0.04 -5.43 0.01 0.00 -4.31 0.00 0.00 34.13 24.36 1f62 s GLU 41 CO 0.10 -2.20 1.31 -0.46 0.01 0.00 0.00 175.26 174.01 1f62 s TRP 42 N 4.28 2.63 -0.03 1.61 -0.11 -1.26 -4.80 118.94 121.25 1f62 s TRP 42 Ca 0.50 0.80 -0.30 0.00 1.22 0.00 0.00 56.10 58.32 1f62 s TRP 42 Cb 0.02 -4.10 -0.03 0.00 -1.50 0.00 0.00 33.47 27.86 1f62 s TRP 42 CO 0.01 -1.70 1.06 -0.65 -4.62 0.00 0.00 176.95 171.05 1f62 s GLN 43 N 4.44 4.46 0.80 5.86 -1.52 -1.26 -1.39 119.66 131.05 1f62 s GLN 43 Ca 0.56 1.50 -0.09 0.00 -1.95 0.00 0.00 55.36 55.38 1f62 s GLN 43 Cb -0.14 -3.49 0.11 0.00 -0.22 0.00 0.00 33.01 29.27 1f62 s GLN 43 CO 0.27 -0.23 1.13 0.00 -0.25 0.00 0.00 175.29 176.21 1f62 h PRO 45 N -0.96 0.00 -0.17 0.00 0.11 -1.97 0.45 132.00 129.47 1f62 h PRO 45 Ca -0.44 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.62 1f62 h PRO 45 Cb 1.29 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.40 1f62 h PRO 45 CO 0.53 0.00 -0.10 0.00 -0.21 0.00 0.00 178.00 178.22 1f62 h ALA 46 N 1.65 0.23 0.00 -0.75 0.00 -2.01 -3.38 119.26 115.00 1f62 h ALA 46 Ca 0.21 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 1f62 h ALA 46 Cb 0.98 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.72 1f62 h ALA 46 CO -0.00 0.07 -0.13 0.00 0.00 0.00 0.00 179.25 179.19 1f62 s GLN 48 N -2.17 3.67 0.92 0.00 -2.07 -0.05 -4.96 119.66 115.00 1f62 s GLN 48 Ca -0.18 1.72 -0.13 0.00 -1.82 0.00 0.00 55.36 54.95 1f62 s GLN 48 Cb -0.02 -2.31 0.15 0.00 -1.09 0.00 0.00 33.01 29.74 1f62 s GLN 48 CO 0.61 -0.61 1.16 -1.25 -1.32 0.00 0.00 175.29 173.88 1f62 s PRO 49 N -2.84 1.05 -1.31 9.60 0.04 -1.26 -4.86 135.00 135.41 1f62 s PRO 49 Ca 0.66 0.18 -0.08 0.00 0.04 0.00 0.00 61.00 61.80 1f62 s PRO 49 Cb -0.27 -1.84 -0.04 0.00 0.04 0.00 0.00 34.50 32.39 1f62 s PRO 49 CO 0.32 -2.24 2.85 0.00 0.04 0.00 0.00 177.00 177.98 1f62 n ALA 50 N -3.77 7.18 -1.34 8.56 0.00 -1.26 -5.11 120.51 124.77 1f62 n ALA 50 Ca 0.08 -3.49 0.00 0.00 0.00 0.00 0.00 53.44 50.02 1f62 n ALA 50 Cb 0.59 -3.02 0.00 0.00 0.00 0.00 0.00 19.45 17.02 1f62 n ALA 50 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13