#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kl6 h LEU 0 N 0.00 0.45 -1.01 -0.35 3.38 -1.97 -1.85 115.31 113.96 3kl6 h LEU 0 Ca 0.00 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.96 3kl6 h LEU 0 Cb 0.00 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.64 3kl6 h LEU 0 CO 0.00 0.32 -0.17 0.00 0.09 0.00 0.00 178.44 178.68 3kl6 h SER 2 N 2.45 0.00 -3.11 0.00 0.02 -1.72 -3.27 113.55 107.92 3kl6 h SER 2 Ca 0.00 0.00 -0.63 0.00 -0.84 0.00 0.00 61.79 60.32 3kl6 h SER 2 Cb 0.65 0.00 -0.35 0.00 0.14 0.00 0.00 62.40 62.83 3kl6 h SER 2 CO 0.00 0.00 -0.85 -0.76 -1.14 0.00 0.00 176.83 174.08 3kl6 s LEU 3 N -5.73 1.87 -1.72 5.07 1.02 -1.26 -4.74 118.68 113.19 3kl6 s LEU 3 Ca 0.05 -0.55 0.00 0.00 0.02 0.00 0.00 54.13 53.65 3kl6 s LEU 3 Cb 0.08 -1.30 0.00 0.00 0.02 0.00 0.00 46.19 44.99 3kl6 s LEU 3 CO 0.57 -0.02 0.00 0.47 0.02 0.00 0.00 176.35 177.38 3kl6 n ASP 4 N 4.65 -5.19 -2.35 2.29 10.43 -1.26 -2.37 116.55 122.76 3kl6 n ASP 4 Ca -0.19 0.19 -0.16 0.00 2.57 0.00 0.00 54.79 57.21 3kl6 n ASP 4 Cb 0.50 -4.44 -0.01 0.00 1.84 0.00 0.00 41.12 39.01 3kl6 n ASP 4 CO 0.00 0.00 0.00 -3.20 -1.07 0.00 0.00 177.20 172.93 3kl6 n ASN 5 N -1.65 -4.64 -1.46 -2.24 5.15 -1.23 -0.44 115.26 108.75 3kl6 n ASN 5 Ca -0.21 0.14 -0.19 0.00 -0.60 0.00 0.00 54.58 53.72 3kl6 n ASN 5 Cb 0.65 -3.93 -0.08 0.00 -0.53 0.00 0.00 39.78 35.89 3kl6 n ASN 5 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3kl6 n GLY 6 N -0.84 1.69 2.61 8.20 0.00 -1.00 -1.46 105.19 114.39 3kl6 n GLY 6 Ca -0.18 -0.13 -0.06 0.00 0.00 0.00 0.00 46.02 45.64 3kl6 n GLY 6 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3kl6 n ASP 7 N -1.02 -5.03 -4.77 1.61 10.43 0.42 -5.00 116.55 113.18 3kl6 n ASP 7 Ca -0.19 0.16 -0.38 0.00 2.57 0.00 0.00 54.79 56.95 3kl6 n ASP 7 Cb 0.61 -3.09 -0.06 0.00 1.84 0.00 0.00 41.12 40.42 3kl6 n ASP 7 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 3kl6 h ASP 9 N 3.35 0.85 0.00 0.00 5.19 -1.63 -3.46 116.42 120.72 3kl6 h ASP 9 Ca -0.46 -0.29 0.00 0.00 -0.62 0.00 0.00 57.03 55.65 3kl6 h ASP 9 Cb 1.20 -0.23 0.00 0.00 0.18 0.00 0.00 39.33 40.47 3kl6 h ASP 9 CO 0.65 1.02 0.00 0.00 -3.12 0.00 0.00 179.24 177.79 3kl6 n GLN 10 N -4.13 0.00 -2.91 3.56 6.02 -1.26 -4.99 117.38 113.68 3kl6 n GLN 10 Ca 0.01 0.00 -0.39 0.00 -0.01 0.00 0.00 57.00 56.60 3kl6 n GLN 10 Cb 0.42 0.00 -0.06 0.00 1.02 0.00 0.00 30.24 31.62 3kl6 n GLN 10 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 3kl6 s PHE 11 N 1.60 3.90 -0.04 1.08 0.08 -0.52 -4.94 117.98 119.14 3kl6 s PHE 11 Ca 0.00 1.71 0.05 0.00 0.12 0.00 0.00 56.93 58.81 3kl6 s PHE 11 Cb 0.00 -2.83 -0.01 0.00 -0.57 0.00 0.00 43.02 39.61 3kl6 s PHE 11 CO 0.00 0.47 -0.18 0.00 -0.10 0.00 0.00 175.22 175.41 3kl6 s HIS 13 N -0.03 0.93 -0.15 0.00 3.76 -0.30 -5.01 115.29 114.48 3kl6 s HIS 13 Ca -0.03 -1.26 0.02 0.00 -0.15 0.00 0.00 55.06 53.64 3kl6 s HIS 13 Cb -0.11 -0.50 0.02 0.00 1.11 0.00 0.00 32.58 33.09 3kl6 s HIS 13 CO 0.02 -0.53 -0.20 -1.21 -0.85 0.00 0.00 174.74 171.97 3kl6 s GLU 14 N -4.07 2.90 -0.04 1.40 2.02 -1.26 -0.76 118.70 118.88 3kl6 s GLU 14 Ca 0.27 -0.80 0.00 0.00 0.02 0.00 0.00 54.97 54.46 3kl6 s GLU 14 Cb 0.07 -2.42 0.02 0.00 0.10 0.00 0.00 34.13 31.90 3kl6 s GLU 14 CO 0.04 -0.11 -0.02 -2.00 0.02 0.00 0.00 175.26 173.18 3kl6 s GLU 15 N 1.07 0.60 -1.53 1.61 2.56 -0.46 -4.84 118.70 117.71 3kl6 s GLU 15 Ca -0.01 -0.01 -0.06 0.00 0.00 0.00 0.00 54.97 54.90 3kl6 s GLU 15 Cb -0.14 -0.73 0.05 0.00 2.00 0.00 0.00 34.13 35.31 3kl6 s GLU 15 CO -0.07 -0.13 0.44 0.94 -0.56 0.00 0.00 175.26 175.87 3kl6 n GLN 16 N 4.25 -2.73 -2.72 4.30 0.00 -1.26 -1.64 117.38 117.58 3kl6 n GLN 16 Ca -0.23 0.33 -0.20 0.00 -0.00 0.00 0.00 57.00 56.90 3kl6 n GLN 16 Cb 0.51 -4.50 0.02 0.00 0.00 0.00 0.00 30.24 26.26 3kl6 n GLN 16 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.06 175.35 3kl6 n ASN 17 N -2.87 -5.61 -3.98 1.69 5.15 -1.26 -5.01 115.26 103.36 3kl6 n ASN 17 Ca -0.20 -0.17 -0.09 0.00 -0.60 0.00 0.00 54.58 53.52 3kl6 n ASN 17 Cb 0.63 -4.53 -0.10 0.00 -0.53 0.00 0.00 39.78 35.25 3kl6 n ASN 17 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 3kl6 s SER 18 N -2.51 0.27 0.14 1.20 1.04 -0.65 -5.14 113.70 108.04 3kl6 s SER 18 Ca 0.17 -0.60 -0.30 0.00 0.48 0.00 0.00 55.95 55.70 3kl6 s SER 18 Cb -0.07 0.16 -0.07 0.00 0.10 0.00 0.00 66.02 66.14 3kl6 s SER 18 CO 0.21 -0.42 1.15 -0.69 0.98 0.00 0.00 173.24 174.47 3kl6 s VAL 19 N -2.28 3.87 -0.15 5.02 1.01 -1.26 -1.35 120.40 125.25 3kl6 s VAL 19 Ca -0.08 1.51 0.00 0.00 0.00 0.00 0.00 61.98 63.41 3kl6 s VAL 19 Cb -0.04 -3.96 0.02 0.00 0.00 0.00 0.00 36.38 32.40 3kl6 s VAL 19 CO -0.04 0.21 -0.14 -0.69 0.00 0.00 0.00 175.10 174.44 3kl6 s VAL 20 N 0.24 1.60 0.23 2.92 1.01 0.06 -4.92 120.40 121.54 3kl6 s VAL 20 Ca 0.53 -0.66 -0.02 0.00 0.00 0.00 0.00 61.98 61.83 3kl6 s VAL 20 Cb -0.30 -1.50 -0.04 0.00 0.00 0.00 0.00 36.38 34.53 3kl6 s VAL 20 CO 0.33 0.45 0.44 0.00 0.00 0.00 0.00 175.10 176.32 3kl6 s SER 22 N -3.22 0.35 0.12 0.00 1.04 -0.64 -4.98 113.70 106.37 3kl6 s SER 22 Ca 0.40 -1.20 -0.00 0.00 0.48 0.00 0.00 55.95 55.62 3kl6 s SER 22 Cb -0.11 0.69 -0.04 0.00 0.10 0.00 0.00 66.02 66.66 3kl6 s SER 22 CO 0.30 -1.34 0.02 0.00 0.98 0.00 0.00 173.24 173.19 3kl6 s ALA 24 N -3.90 1.93 0.33 0.00 0.00 -1.26 -4.91 121.76 113.94 3kl6 s ALA 24 Ca 0.19 0.03 -0.28 0.00 0.00 0.00 0.00 51.96 51.90 3kl6 s ALA 24 Cb 0.07 -3.21 -0.13 0.00 0.00 0.00 0.00 23.12 19.86 3kl6 s ALA 24 CO -0.01 -2.02 1.28 0.54 0.00 0.00 0.00 175.76 175.55 3kl6 n ARG 25 N -3.67 2.07 -0.57 0.00 1.74 -1.26 -1.92 116.66 113.05 3kl6 n ARG 25 Ca 0.08 0.73 0.00 0.00 -0.77 0.00 0.00 57.85 57.88 3kl6 n ARG 25 Cb 0.55 -2.30 0.00 0.00 -1.02 0.00 0.00 32.46 29.69 3kl6 n ARG 25 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3kl6 n GLY 26 N 0.93 0.76 3.28 -0.13 0.00 -1.26 -4.70 105.19 104.07 3kl6 n GLY 26 Ca 0.06 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.86 3kl6 n GLY 26 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3kl6 s TYR 27 N -2.73 1.70 0.09 1.61 2.02 -0.81 -0.73 117.35 118.50 3kl6 s TYR 27 Ca 0.00 -0.45 0.07 0.00 -0.37 0.00 0.00 57.07 56.32 3kl6 s TYR 27 Cb 0.00 -0.90 -0.03 0.00 -0.40 0.00 0.00 41.96 40.62 3kl6 s TYR 27 CO 0.00 0.22 -0.19 -0.08 -1.57 0.00 0.00 175.55 173.93 3kl6 s THR 28 N -1.53 1.50 0.16 -0.71 -1.32 0.70 -4.78 115.64 109.66 3kl6 s THR 28 Ca 0.09 -1.42 -0.30 0.00 -1.21 0.00 0.00 61.69 58.84 3kl6 s THR 28 Cb -0.08 -1.38 -0.08 0.00 -1.51 0.00 0.00 72.50 69.45 3kl6 s THR 28 CO 0.05 -0.08 1.27 -0.22 -2.21 0.00 0.00 174.62 173.42 3kl6 s LEU 29 N -1.76 4.41 1.01 9.08 2.96 -1.26 -0.55 118.68 132.57 3kl6 s LEU 29 Ca 0.04 2.28 -0.12 0.00 -0.22 0.00 0.00 54.13 56.11 3kl6 s LEU 29 Cb -0.10 -3.60 0.19 0.00 0.50 0.00 0.00 46.19 43.18 3kl6 s LEU 29 CO 0.03 -0.49 1.09 0.00 -1.32 0.00 0.00 176.35 175.66 3kl6 s ALA 30 N 0.36 0.87 0.41 5.97 0.00 -0.05 -4.88 121.76 124.45 3kl6 s ALA 30 Ca 0.57 -0.29 0.19 0.00 0.00 0.00 0.00 51.96 52.43 3kl6 s ALA 30 Cb -0.34 -3.14 1.13 0.00 0.00 0.00 0.00 23.12 20.76 3kl6 s ALA 30 CO 0.35 -2.89 1.78 -0.44 0.00 0.00 0.00 175.76 174.55 3kl6 h ASP 31 N -1.94 0.42 0.34 0.00 3.32 -1.95 -0.82 116.42 115.78 3kl6 h ASP 31 Ca -0.55 0.08 0.00 0.00 0.02 0.00 0.00 57.03 56.58 3kl6 h ASP 31 Cb 1.32 0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.88 3kl6 h ASP 31 CO 0.56 0.08 0.00 -0.46 -1.72 0.00 0.00 179.24 177.71 3kl6 n ASN 32 N -4.60 0.00 -0.34 6.45 0.23 -1.26 -4.89 115.26 110.85 3kl6 n ASN 32 Ca 0.25 -0.34 -0.04 0.00 -0.53 0.00 0.00 54.58 53.92 3kl6 n ASN 32 Cb 0.89 -0.19 -0.02 0.00 -2.08 0.00 0.00 39.78 38.38 3kl6 n ASN 32 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3kl6 n GLY 33 N 0.87 0.65 1.08 4.83 0.00 -0.31 -4.82 105.19 107.49 3kl6 n GLY 33 Ca 0.15 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 45.91 3kl6 n GLY 33 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3kl6 n LYS 34 N -1.83 0.00 -2.49 1.61 4.76 -1.26 -4.21 118.16 114.74 3kl6 n LYS 34 Ca -0.04 0.00 -0.33 0.00 -2.87 0.00 0.00 58.31 55.07 3kl6 n LYS 34 Cb 0.27 -0.45 -0.04 0.00 -1.84 0.00 0.00 35.03 32.98 3kl6 n LYS 34 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3kl6 s ALA 35 N -1.98 2.96 -0.20 7.82 0.00 -1.26 -1.61 121.76 127.48 3kl6 s ALA 35 Ca 0.00 0.38 -0.02 0.00 0.00 0.00 0.00 51.96 52.31 3kl6 s ALA 35 Cb 0.00 -3.18 -0.00 0.00 0.00 0.00 0.00 23.12 19.94 3kl6 s ALA 35 CO 0.00 -0.25 -0.09 0.00 0.00 0.00 0.00 175.76 175.42 3kl6 s ILE 37 N 1.33 4.03 0.39 0.00 -1.09 0.29 -4.89 121.20 121.26 3kl6 s ILE 37 Ca 0.04 -0.30 -0.27 0.00 -2.23 0.00 0.00 60.65 57.90 3kl6 s ILE 37 Cb -0.14 -2.81 -0.11 0.00 -1.58 0.00 0.00 42.46 37.83 3kl6 s ILE 37 CO -0.05 0.45 1.38 -2.65 -1.23 0.00 0.00 174.94 172.84 3kl6 n PRO 38 N 4.01 2.31 0.00 2.79 -0.02 -1.26 -0.21 135.00 142.62 3kl6 n PRO 38 Ca -0.17 0.81 0.12 0.00 -2.02 0.00 0.00 63.50 62.25 3kl6 n PRO 38 Cb 0.52 -2.51 0.19 0.00 -0.02 0.00 0.00 33.50 31.68 3kl6 n PRO 38 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 3kl6 n THR 39 N 0.18 0.00 -3.89 3.45 -2.24 0.09 -4.81 114.28 107.07 3kl6 n THR 39 Ca 0.04 -0.28 -0.03 0.00 -2.27 0.00 0.00 64.05 61.51 3kl6 n THR 39 Cb 0.39 0.98 0.02 0.00 -2.10 0.00 0.00 70.33 69.61 3kl6 n THR 39 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 3kl6 s GLY 40 N -2.31 0.09 0.68 3.38 0.00 -1.26 -5.07 107.32 102.83 3kl6 s GLY 40 Ca 0.25 -0.30 -0.15 0.00 0.00 0.00 0.00 44.72 44.52 3kl6 s GLY 40 CO 0.47 2.60 1.14 -4.14 0.00 0.00 0.00 173.10 173.16 3kl6 s PRO 41 N -2.18 2.61 -1.22 2.90 0.02 -1.26 -4.02 135.00 131.85 3kl6 s PRO 41 Ca 0.22 1.50 -0.12 0.00 0.02 0.00 0.00 61.00 62.62 3kl6 s PRO 41 Cb -0.02 -1.92 -0.01 0.00 0.02 0.00 0.00 34.50 32.57 3kl6 s PRO 41 CO 0.05 -1.42 0.70 0.66 -0.33 0.00 0.00 177.00 176.66 3kl6 n TYR 42 N -2.49 -1.87 -1.73 6.54 4.01 -1.26 -4.94 117.16 115.40 3kl6 n TYR 42 Ca 0.11 0.61 -0.34 0.00 -0.16 0.00 0.00 57.90 58.11 3kl6 n TYR 42 Cb 0.51 -3.71 0.06 0.00 -0.31 0.00 0.00 39.34 35.89 3kl6 n TYR 42 CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 3kl6 s PRO 43 N -6.03 2.63 0.55 -0.72 0.04 -1.26 -4.93 135.00 125.29 3kl6 s PRO 43 Ca 0.28 1.65 -0.21 0.00 0.04 0.00 0.00 61.00 62.76 3kl6 s PRO 43 Cb -0.10 -1.91 -0.04 0.00 0.04 0.00 0.00 34.50 32.49 3kl6 s PRO 43 CO 0.85 -1.43 1.29 0.00 0.04 0.00 0.00 177.00 177.76 3kl6 n GLY 45 N 0.67 0.39 3.53 0.00 0.00 -1.26 -5.01 105.19 103.51 3kl6 n GLY 45 Ca 0.11 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.80 3kl6 n GLY 45 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3kl6 s LYS 46 N -0.45 3.06 0.68 1.61 -0.14 -1.21 -5.11 119.74 118.18 3kl6 s LYS 46 Ca 0.00 -0.56 -0.16 0.00 -1.36 0.00 0.00 55.97 53.89 3kl6 s LYS 46 Cb 0.00 -2.67 0.01 0.00 -1.68 0.00 0.00 37.83 33.49 3kl6 s LYS 46 CO 0.00 0.50 1.21 -0.65 -0.76 0.00 0.00 175.35 175.65 3kl6 s GLN 47 N -0.37 2.46 0.00 1.68 -0.21 -1.26 -4.93 119.66 117.02 3kl6 s GLN 47 Ca 0.05 1.77 0.27 0.00 0.02 0.00 0.00 55.36 57.47 3kl6 s GLN 47 Cb -0.12 -1.87 0.93 0.00 1.00 0.00 0.00 33.01 32.94 3kl6 s GLN 47 CO 0.02 -1.59 1.68 0.25 -2.12 0.00 0.00 175.29 173.52