#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bic s ASP 2 N 0.00 4.28 -0.34 4.31 1.01 -1.26 -5.08 116.67 119.58 2bic s ASP 2 Ca 0.00 -2.52 -0.27 0.00 0.71 0.00 0.00 52.55 50.47 2bic s ASP 2 Cb 0.00 -1.42 0.01 0.00 1.01 0.00 0.00 42.92 42.52 2bic s ASP 2 CO 0.00 -0.30 0.97 -2.16 0.21 0.00 0.00 175.17 173.89 2bic s PRO 3 N 0.41 3.94 0.00 8.23 0.04 -1.26 -4.81 135.00 141.56 2bic s PRO 3 Ca 0.14 0.77 0.00 0.00 0.04 0.00 0.00 61.00 61.95 2bic s PRO 3 Cb -0.23 -3.77 0.00 0.00 0.04 0.00 0.00 34.50 30.54 2bic s PRO 3 CO -0.05 -0.91 0.00 -0.11 0.04 0.00 0.00 177.00 175.97 2bic n LEU 4 N 6.77 0.00 -4.52 -3.56 7.94 -1.26 -4.70 117.00 117.67 2bic n LEU 4 Ca 0.09 0.00 -0.43 0.00 -1.11 0.00 0.00 56.01 54.56 2bic n LEU 4 Cb 0.48 0.00 -0.02 0.00 0.53 0.00 0.00 43.42 44.41 2bic n LEU 4 CO 0.58 0.00 1.46 -0.31 -1.11 0.00 0.00 177.39 178.00 2bic s TYR 5 N 0.00 2.92 -0.14 1.96 2.02 -1.26 -4.78 117.35 118.07 2bic s TYR 5 Ca 0.00 -1.40 -0.14 0.00 -0.37 0.00 0.00 57.07 55.16 2bic s TYR 5 Cb 0.00 -4.54 -0.06 0.00 -0.40 0.00 0.00 41.96 36.96 2bic s TYR 5 CO 0.00 -1.70 0.47 0.00 -1.57 0.00 0.00 175.55 172.76 2bic n GLN 7 N 1.14 3.39 -4.41 0.00 7.27 -1.26 -4.96 117.38 118.55 2bic n GLN 7 Ca 0.09 -3.80 -0.26 0.00 0.07 0.00 0.00 57.00 53.10 2bic n GLN 7 Cb -0.01 -3.04 -0.12 0.00 2.41 0.00 0.00 30.24 29.48 2bic n GLN 7 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2bic s ALA 8 N 1.51 2.45 -0.73 1.69 0.00 -1.26 -4.96 121.76 120.46 2bic s ALA 8 Ca 0.43 -1.62 -0.26 0.00 0.00 0.00 0.00 51.96 50.50 2bic s ALA 8 Cb -0.01 -0.30 0.04 0.00 0.00 0.00 0.00 23.12 22.84 2bic s ALA 8 CO 0.00 0.39 1.24 0.42 0.00 0.00 0.00 175.76 177.82 2bic s ILE 9 N -1.75 3.80 0.00 0.00 -1.09 -1.26 -4.21 121.20 116.69 2bic s ILE 9 Ca 0.20 0.30 0.00 0.00 -2.23 0.00 0.00 60.65 58.92 2bic s ILE 9 Cb -0.08 -4.89 0.00 0.00 -1.58 0.00 0.00 42.46 35.91 2bic s ILE 9 CO 0.09 -1.81 0.00 0.61 -1.23 0.00 0.00 174.94 172.60 2bic n GLY 10 N 5.39 -0.88 2.45 6.18 0.00 -1.26 -4.88 105.19 112.20 2bic n GLY 10 Ca 0.03 0.31 -0.29 0.00 0.00 0.00 0.00 46.02 46.06 2bic n GLY 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bic n PRO 12 N 1.20 -1.95 -1.55 0.00 -0.02 -1.26 -4.88 135.00 126.54 2bic n PRO 12 Ca 0.06 -0.39 -0.40 0.00 -2.02 0.00 0.00 63.50 60.75 2bic n PRO 12 Cb 0.36 -0.57 0.02 0.00 -0.02 0.00 0.00 33.50 33.29 2bic n PRO 12 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 2bic n THR 13 N -3.62 2.46 0.03 3.45 -1.04 -1.26 -4.80 114.28 109.50 2bic n THR 13 Ca 0.04 -0.50 -0.10 0.00 -2.04 0.00 0.00 64.05 61.44 2bic n THR 13 Cb 0.16 -0.92 -0.04 0.00 -1.82 0.00 0.00 70.33 67.71 2bic n THR 13 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 2bic h LEU 14 N 0.94 -0.42 -7.61 -4.42 5.85 -1.97 -3.19 115.31 104.50 2bic h LEU 14 Ca -0.44 0.07 -0.80 0.00 0.84 0.00 0.00 57.88 57.55 2bic h LEU 14 Cb 1.37 0.19 -0.28 0.00 0.37 0.00 0.00 40.66 42.31 2bic h LEU 14 CO 0.53 -0.19 0.39 -0.31 -0.34 0.00 0.00 178.44 178.51 2bic s TYR 15 N -6.14 4.19 0.23 1.25 2.02 -1.26 -4.65 117.35 112.99 2bic s TYR 15 Ca -0.14 -2.58 -0.04 0.00 -0.37 0.00 0.00 57.07 53.94 2bic s TYR 15 Cb 0.09 -3.83 -0.03 0.00 -0.40 0.00 0.00 41.96 37.79 2bic s TYR 15 CO 0.67 -0.96 0.26 -1.54 -1.57 0.00 0.00 175.55 172.41 2bic s SER 16 N 1.45 0.25 0.12 2.29 1.04 -1.20 -5.05 113.70 112.59 2bic s SER 16 Ca 0.29 -1.30 -0.14 0.00 0.48 0.00 0.00 55.95 55.27 2bic s SER 16 Cb -0.10 0.47 -0.04 0.00 0.10 0.00 0.00 66.02 66.45 2bic s SER 16 CO -0.08 -0.97 1.52 -0.08 0.98 0.00 0.00 173.24 174.61 2bic h GLU 17 N 2.45 0.72 -0.28 4.02 4.81 -1.94 -1.04 114.58 123.33 2bic h GLU 17 Ca -0.32 -0.28 -0.05 0.00 -0.13 0.00 0.00 59.36 58.58 2bic h GLU 17 Cb 1.25 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.58 2bic h GLU 17 CO 0.46 0.88 -0.02 0.00 -0.73 0.00 0.00 179.01 179.60 2bic h ALA 18 N 0.82 0.39 -0.10 2.92 0.00 -1.97 -2.65 119.26 118.66 2bic h ALA 18 Ca 0.09 -0.24 -0.06 0.00 0.00 0.00 0.00 54.91 54.69 2bic h ALA 18 Cb 0.62 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 2bic h ALA 18 CO 0.04 0.15 -0.23 -0.97 0.00 0.00 0.00 179.25 178.24 2bic h ASN 19 N 0.29 0.16 -0.61 0.00 -0.73 -1.77 -2.88 115.58 110.05 2bic h ASN 19 Ca 0.08 -0.04 -0.05 0.00 1.87 0.00 0.00 56.30 58.15 2bic h ASN 19 Cb 0.46 -0.04 -0.03 0.00 0.27 0.00 0.00 38.32 38.98 2bic h ASN 19 CO 0.02 0.41 0.17 0.25 -0.37 0.00 0.00 177.43 177.91 2bic h LEU 20 N 0.16 0.91 -0.13 0.34 5.85 -1.06 -2.07 115.31 119.31 2bic h LEU 20 Ca 0.03 -0.22 -0.01 0.00 0.84 0.00 0.00 57.88 58.51 2bic h LEU 20 Cb 0.50 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.29 2bic h LEU 20 CO 0.03 0.89 0.04 0.00 -0.34 0.00 0.00 178.44 179.06 2bic h ALA 21 N 1.05 0.17 -0.72 1.25 0.00 -1.27 -1.27 119.26 118.48 2bic h ALA 21 Ca 0.19 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 2bic h ALA 21 Cb 0.32 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 2bic h ALA 21 CO -0.00 -0.20 0.32 -0.24 0.00 0.00 0.00 179.25 179.13 2bic h VAL 22 N 0.02 1.24 0.00 0.00 3.04 -1.53 -2.56 116.25 116.46 2bic h VAL 22 Ca 0.04 -0.71 -0.07 0.00 -1.01 0.00 0.00 66.70 64.96 2bic h VAL 22 Cb 0.24 0.38 -0.01 0.00 -2.01 0.00 0.00 31.29 29.88 2bic h VAL 22 CO -0.00 0.29 -0.32 0.77 -1.01 0.00 0.00 177.57 177.30 2bic h SER 23 N 1.01 0.00 0.40 3.17 4.64 -1.32 0.72 113.55 122.18 2bic h SER 23 Ca 0.24 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.50 2bic h SER 23 Cb 0.16 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.24 2bic h SER 23 CO -0.03 0.32 -0.30 0.50 -0.87 0.00 0.00 176.83 176.45 2bic h LYS 24 N 0.00 0.00 0.00 4.77 1.63 -0.81 -2.48 116.57 119.68 2bic h LYS 24 Ca -0.00 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 2bic h LYS 24 Cb 0.57 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.20 2bic h LYS 24 CO 0.04 0.30 -0.23 0.93 -3.45 0.00 0.00 179.45 177.05 2bic h GLU 25 N 0.00 0.00 -0.86 1.90 5.08 -1.33 -3.43 114.58 115.94 2bic h GLU 25 Ca -0.00 0.00 0.21 0.00 -1.00 0.00 0.00 59.36 58.57 2bic h GLU 25 Cb 0.59 0.00 -0.16 0.00 0.50 0.00 0.00 28.75 29.67 2bic h GLU 25 CO 0.04 0.00 -0.07 0.00 -1.00 0.00 0.00 179.01 177.98 2bic h ARG 27 N 0.00 0.00 -0.25 0.00 2.43 -1.68 -1.30 114.38 113.58 2bic h ARG 27 Ca 0.48 0.00 0.07 0.00 -0.81 0.00 0.00 59.98 59.73 2bic h ARG 27 Cb 0.91 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.45 2bic h ARG 27 CO -0.84 0.00 0.19 -0.44 -1.51 0.00 0.00 179.97 177.37 2bic h ASP 28 N 0.00 0.00 -3.66 -3.80 5.19 -1.01 -3.43 116.42 109.70 2bic h ASP 28 Ca 0.36 0.00 -0.43 0.00 -0.62 0.00 0.00 57.03 56.34 2bic h ASP 28 Cb 1.51 0.00 0.18 0.00 0.18 0.00 0.00 39.33 41.20 2bic h ASP 28 CO -0.00 0.00 0.19 -1.10 -3.12 0.00 0.00 179.24 175.20 2bic s GLN 29 N -4.98 -0.63 -0.02 3.56 1.11 -0.49 -4.91 119.66 113.30 2bic s GLN 29 Ca -0.05 -0.01 -0.30 0.00 0.01 0.00 0.00 55.36 55.02 2bic s GLN 29 Cb 0.18 -1.66 -0.07 0.00 -1.01 0.00 0.00 33.01 30.45 2bic s GLN 29 CO 0.68 -3.33 1.77 0.20 0.01 0.00 0.00 175.29 174.62 2bic s GLY 30 N -3.96 1.51 -0.82 3.09 0.00 -1.26 -4.92 107.32 100.96 2bic s GLY 30 Ca 0.70 1.09 -0.23 0.00 0.00 0.00 0.00 44.72 46.28 2bic s GLY 30 CO 0.56 3.20 1.19 1.25 0.00 0.00 0.00 173.10 179.30 2bic s LYS 31 N 4.19 3.34 -0.09 2.90 2.20 -1.26 -4.72 119.74 126.29 2bic s LYS 31 Ca 0.79 -0.94 -0.02 0.00 -0.36 0.00 0.00 55.97 55.44 2bic s LYS 31 Cb -0.37 -4.61 -0.05 0.00 -1.51 0.00 0.00 37.83 31.29 2bic s LYS 31 CO 0.34 -1.98 -0.10 1.28 -0.36 0.00 0.00 175.35 174.53 2bic n LEU 32 N 8.16 1.77 0.00 5.43 4.77 -1.26 -5.09 117.00 130.78 2bic n LEU 32 Ca 0.12 0.04 0.00 0.00 -0.03 0.00 0.00 56.01 56.14 2bic n LEU 32 Cb 0.48 -0.30 0.00 0.00 -2.33 0.00 0.00 43.42 41.28 2bic n LEU 32 CO 0.63 0.41 0.00 0.61 -1.33 0.00 0.00 177.39 177.72 2bic n GLY 33 N 2.72 -1.91 2.59 -0.72 0.00 -1.26 -4.93 105.19 101.67 2bic n GLY 33 Ca -0.18 0.70 -0.37 0.00 0.00 0.00 0.00 46.02 46.18 2bic n GLY 33 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2bic n ASP 34 N 0.00 7.46 -0.91 1.61 2.03 -1.26 -4.55 116.55 120.93 2bic n ASP 34 Ca 0.00 -3.81 0.12 0.00 0.52 0.00 0.00 54.79 51.62 2bic n ASP 34 Cb 0.00 -0.98 0.26 0.00 -0.72 0.00 0.00 41.12 39.68 2bic n ASP 34 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 2bic n ASP 35 N -0.73 2.76 -0.79 1.67 -0.08 -1.26 -3.69 116.55 114.42 2bic n ASP 35 Ca 0.58 -1.88 0.12 0.00 -1.51 0.00 0.00 54.79 52.09 2bic n ASP 35 Cb 0.48 -0.15 0.08 0.00 2.34 0.00 0.00 41.12 43.87 2bic n ASP 35 CO 0.00 0.00 0.00 0.49 0.12 0.00 0.00 177.20 177.81 2bic n PHE 36 N 1.06 0.00 -0.27 -0.67 3.72 -1.26 -4.79 117.46 115.24 2bic n PHE 36 Ca 0.18 0.00 -0.01 0.00 -0.05 0.00 0.00 57.45 57.57 2bic n PHE 36 Cb 0.51 -0.00 0.03 0.00 -0.94 0.00 0.00 39.48 39.08 2bic n PHE 36 CO 0.00 0.00 0.00 1.58 -0.05 0.00 0.00 176.76 178.29 2bic n HIS 37 N 0.85 0.01 0.22 1.38 -0.00 -1.24 -1.12 115.22 115.32 2bic n HIS 37 Ca 0.12 0.87 -0.12 0.00 0.46 0.00 0.00 57.72 59.05 2bic n HIS 37 Cb 0.55 -0.76 -0.07 0.00 -0.12 0.00 0.00 29.99 29.59 2bic n HIS 37 CO 0.00 0.00 0.00 -0.09 0.46 0.00 0.00 176.34 176.71 2bic h ARG 38 N 0.00 -0.58 -1.15 1.57 2.43 -1.90 -2.86 114.38 111.88 2bic h ARG 38 Ca 0.24 0.04 0.44 0.00 -0.81 0.00 0.00 59.98 59.89 2bic h ARG 38 Cb 0.42 0.13 -0.16 0.00 -0.42 0.00 0.00 29.97 29.93 2bic h ARG 38 CO -0.70 -0.28 0.68 0.00 -1.51 0.00 0.00 179.97 178.16 2bic h GLU 41 N 0.00 0.00 0.01 0.00 5.08 0.05 -0.91 114.58 118.81 2bic h GLU 41 Ca -0.13 0.00 -0.39 0.00 -1.00 0.00 0.00 59.36 57.84 2bic h GLU 41 Cb 1.47 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.66 2bic h GLU 41 CO 0.04 0.39 -2.18 -1.91 -1.00 0.00 0.00 179.01 174.35 2bic n GLU 42 N -3.02 0.62 -2.98 2.33 0.00 0.15 -4.09 120.64 113.64 2bic n GLU 42 Ca -0.05 0.31 -0.43 0.00 0.00 0.00 0.00 57.16 56.99 2bic n GLU 42 Cb 0.81 -1.58 0.01 0.00 0.00 0.00 0.00 31.44 30.68 2bic n GLU 42 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.13 178.07 2bic n GLN 43 N -4.01 4.34 0.00 5.31 -0.06 -1.16 -4.70 117.38 117.11 2bic n GLN 43 Ca -0.45 -4.47 0.00 0.00 -2.00 0.00 0.00 57.00 50.07 2bic n GLN 43 Cb 0.88 -2.55 0.00 0.00 -4.06 0.00 0.00 30.24 24.51 2bic n GLN 43 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 2bic n GLY 45 N 0.00 3.56 2.90 0.00 0.00 -0.35 -4.85 105.19 106.46 2bic n GLY 45 Ca 0.00 -2.07 -0.13 0.00 0.00 0.00 0.00 46.02 43.82 2bic n GLY 45 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2bic s SER 46 N 2.51 0.61 0.00 1.61 1.04 -1.26 -4.59 113.70 113.62 2bic s SER 46 Ca 0.42 0.20 0.00 0.00 0.48 0.00 0.00 55.95 57.04 2bic s SER 46 Cb -0.02 0.81 0.00 0.00 0.10 0.00 0.00 66.02 66.91 2bic s SER 46 CO -0.00 -0.29 0.00 0.35 0.98 0.00 0.00 173.24 174.27 2bic n THR 47 N 5.35 0.00 -3.45 2.02 -2.24 -1.26 -4.94 114.28 109.75 2bic n THR 47 Ca -0.05 0.00 -0.23 0.00 -2.27 0.00 0.00 64.05 61.50 2bic n THR 47 Cb 0.50 0.00 -0.12 0.00 -2.10 0.00 0.00 70.33 68.61 2bic n THR 47 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 2bic s THR 48 N 0.00 -0.18 -0.63 4.28 2.01 -1.26 -5.10 115.64 114.75 2bic s THR 48 Ca 0.00 -0.88 -0.26 0.00 0.31 0.00 0.00 61.69 60.86 2bic s THR 48 Cb 0.00 -0.96 0.04 0.00 0.01 0.00 0.00 72.50 71.59 2bic s THR 48 CO 0.00 -0.67 1.11 -2.16 -0.69 0.00 0.00 174.62 172.21 2bic s PRO 49 N 1.90 3.31 -0.60 4.92 0.04 -1.26 -4.97 135.00 138.33 2bic s PRO 49 Ca 0.12 -0.21 -0.25 0.00 0.04 0.00 0.00 61.00 60.70 2bic s PRO 49 Cb -0.16 -4.11 0.04 0.00 0.04 0.00 0.00 34.50 30.31 2bic s PRO 49 CO -0.24 -1.78 1.06 0.00 0.04 0.00 0.00 177.00 176.08 2bic s ALA 50 N 4.74 3.06 -0.15 8.56 0.00 -1.26 -4.88 121.76 131.83 2bic s ALA 50 Ca 0.34 -1.21 -0.11 0.00 0.00 0.00 0.00 51.96 50.97 2bic s ALA 50 Cb -0.11 -3.90 -0.06 0.00 0.00 0.00 0.00 23.12 19.05 2bic s ALA 50 CO 0.18 -2.63 -0.10 0.66 0.00 0.00 0.00 175.76 173.87 2bic h SER 51 N 9.50 0.00 0.00 0.00 4.64 -2.08 -3.58 113.55 122.03 2bic h SER 51 Ca -0.26 -0.09 0.00 0.00 -0.47 0.00 0.00 61.79 60.97 2bic h SER 51 Cb 1.07 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.16 2bic h SER 51 CO 1.15 0.88 0.00 0.00 -0.87 0.00 0.00 176.83 177.99