#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1e0g s SER 2 N 0.00 1.02 0.08 -1.12 1.04 -1.26 -5.04 113.70 108.42 1e0g s SER 2 Ca 0.00 -1.13 -0.14 0.00 0.48 0.00 0.00 55.95 55.16 1e0g s SER 2 Cb 0.00 0.14 -0.06 0.00 0.10 0.00 0.00 66.02 66.20 1e0g s SER 2 CO 0.00 -0.57 0.48 -0.63 0.98 0.00 0.00 173.24 173.50 1e0g s ILE 3 N -3.72 4.94 -0.16 -1.02 1.01 -1.25 -4.94 121.20 116.05 1e0g s ILE 3 Ca 0.20 0.80 -0.01 0.00 0.00 0.00 0.00 60.65 61.64 1e0g s ILE 3 Cb 0.06 -3.73 0.05 0.00 0.01 0.00 0.00 42.46 38.85 1e0g s ILE 3 CO 0.01 0.38 -0.01 -0.89 0.00 0.00 0.00 174.94 174.43 1e0g s THR 4 N -1.30 0.81 -0.08 2.92 2.01 -1.26 0.03 115.64 118.76 1e0g s THR 4 Ca 0.32 -0.50 0.03 0.00 0.31 0.00 0.00 61.69 61.85 1e0g s THR 4 Cb -0.16 -1.09 -0.02 0.00 0.01 0.00 0.00 72.50 71.24 1e0g s THR 4 CO 0.17 0.04 -0.18 -0.72 -0.69 0.00 0.00 174.62 173.24 1e0g s TYR 5 N 1.75 2.65 -0.27 4.92 -0.85 -0.53 -4.77 117.35 120.27 1e0g s TYR 5 Ca 0.01 -0.56 -0.24 0.00 -0.52 0.00 0.00 57.07 55.75 1e0g s TYR 5 Cb -0.15 -1.70 -0.00 0.00 0.38 0.00 0.00 41.96 40.48 1e0g s TYR 5 CO -0.07 -0.12 0.82 0.50 -1.52 0.00 0.00 175.55 175.16 1e0g s ARG 6 N -0.10 4.11 -0.38 -3.49 3.52 -1.26 0.49 118.95 121.83 1e0g s ARG 6 Ca -0.03 0.82 -0.29 0.00 -0.13 0.00 0.00 55.73 56.10 1e0g s ARG 6 Cb -0.14 -3.67 0.01 0.00 -1.56 0.00 0.00 34.95 29.59 1e0g s ARG 6 CO 0.04 -0.58 1.32 0.08 -0.81 0.00 0.00 175.30 175.35 1e0g s VAL 7 N 2.90 4.05 0.26 7.11 1.01 0.12 -4.85 120.40 131.00 1e0g s VAL 7 Ca 0.34 1.12 0.04 0.00 0.00 0.00 0.00 61.98 63.48 1e0g s VAL 7 Cb -0.15 -4.26 -0.03 0.00 0.00 0.00 0.00 36.38 31.94 1e0g s VAL 7 CO 0.09 -0.70 0.40 -0.13 0.00 0.00 0.00 175.10 174.77 1e0g s ARG 8 N 4.56 3.45 0.30 2.72 0.52 -1.26 0.65 118.95 129.89 1e0g s ARG 8 Ca 0.57 -0.66 -0.29 0.00 -0.52 0.00 0.00 55.73 54.83 1e0g s ARG 8 Cb -0.13 -2.84 -0.13 0.00 0.52 0.00 0.00 34.95 32.37 1e0g s ARG 8 CO 0.29 0.37 1.31 0.36 0.02 0.00 0.00 175.30 177.65 1e0g n LYS 9 N -1.47 2.04 -0.18 3.54 2.85 -1.26 -0.42 118.16 123.26 1e0g n LYS 9 Ca -0.08 0.72 0.00 0.00 -1.05 0.00 0.00 58.31 57.90 1e0g n LYS 9 Cb 0.57 -2.31 0.00 0.00 -0.65 0.00 0.00 35.03 32.64 1e0g n LYS 9 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1e0g n GLY 10 N 1.27 1.59 3.84 2.58 0.00 -1.26 -5.03 105.19 108.19 1e0g n GLY 10 Ca 0.07 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.76 1e0g n GLY 10 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1e0g s ASP 11 N -3.19 6.84 -0.07 1.61 1.11 0.44 -5.07 116.67 118.35 1e0g s ASP 11 Ca 0.00 1.39 0.05 0.00 0.18 0.00 0.00 52.55 54.17 1e0g s ASP 11 Cb 0.00 -2.42 -0.01 0.00 1.07 0.00 0.00 42.92 41.56 1e0g s ASP 11 CO 0.00 -0.21 -0.24 -0.44 1.18 0.00 0.00 175.17 175.46 1e0g s SER 12 N -2.19 3.16 0.13 0.27 0.01 -1.26 -4.89 113.70 108.93 1e0g s SER 12 Ca 0.55 -0.50 -0.29 0.00 1.31 0.00 0.00 55.95 57.02 1e0g s SER 12 Cb -0.11 -0.95 -0.06 0.00 0.21 0.00 0.00 66.02 65.11 1e0g s SER 12 CO 0.17 0.23 1.58 -0.07 0.41 0.00 0.00 173.24 175.57 1e0g h LEU 13 N 6.15 -1.32 -0.67 2.44 -0.00 -1.99 0.50 115.31 120.42 1e0g h LEU 13 Ca -0.30 0.17 0.01 0.00 -0.00 0.00 0.00 57.88 57.75 1e0g h LEU 13 Cb 1.19 0.53 -0.03 0.00 -0.00 0.00 0.00 40.66 42.34 1e0g h LEU 13 CO 0.48 -0.43 0.44 0.77 -0.00 0.00 0.00 178.44 179.70 1e0g h SER 14 N -0.51 0.77 -0.46 -0.43 4.64 -1.96 -1.60 113.55 113.99 1e0g h SER 14 Ca 0.07 -0.02 0.04 0.00 -0.47 0.00 0.00 61.79 61.41 1e0g h SER 14 Cb 0.63 -0.19 -0.04 0.00 -0.31 0.00 0.00 62.40 62.49 1e0g h SER 14 CO -0.38 0.55 0.23 0.28 -0.87 0.00 0.00 176.83 176.65 1e0g h SER 15 N 0.91 0.34 -0.50 4.97 0.02 -1.62 -1.28 113.55 116.39 1e0g h SER 15 Ca 0.25 0.02 0.04 0.00 -0.84 0.00 0.00 61.79 61.26 1e0g h SER 15 Cb -0.10 -0.04 -0.04 0.00 0.14 0.00 0.00 62.40 62.35 1e0g h SER 15 CO -0.05 0.24 0.27 0.40 -1.14 0.00 0.00 176.83 176.54 1e0g h ILE 16 N 0.47 0.99 -0.54 3.27 2.04 0.40 -1.30 117.51 122.84 1e0g h ILE 16 Ca 0.20 -0.18 0.10 0.00 1.00 0.00 0.00 64.86 65.98 1e0g h ILE 16 Cb 0.10 0.42 -0.08 0.00 -0.74 0.00 0.00 36.82 36.52 1e0g h ILE 16 CO -0.14 0.10 0.07 0.00 0.00 0.00 0.00 178.15 178.18 1e0g h ALA 17 N 1.25 0.58 -1.00 1.87 0.00 -0.30 0.10 119.26 121.78 1e0g h ALA 17 Ca 0.21 0.13 0.23 0.00 0.00 0.00 0.00 54.91 55.49 1e0g h ALA 17 Cb 0.10 0.20 -0.09 0.00 0.00 0.00 0.00 17.79 18.00 1e0g h ALA 17 CO -0.13 -0.34 0.63 0.87 0.00 0.00 0.00 179.25 180.28 1e0g h LYS 18 N 0.19 0.49 -0.49 0.00 1.57 -0.26 0.57 116.57 118.65 1e0g h LYS 18 Ca 0.28 -0.03 0.10 0.00 -1.87 0.00 0.00 60.65 59.12 1e0g h LYS 18 Cb 0.41 -0.11 -0.03 0.00 0.08 0.00 0.00 32.23 32.58 1e0g h LYS 18 CO -0.40 0.32 0.34 -0.09 -0.57 0.00 0.00 179.45 179.05 1e0g h ARG 19 N 0.50 0.24 -0.16 3.15 2.43 -0.55 -1.45 114.38 118.55 1e0g h ARG 19 Ca 0.56 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.72 1e0g h ARG 19 Cb 1.25 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.75 1e0g h ARG 19 CO -0.30 0.16 0.00 0.72 -1.51 0.00 0.00 179.97 179.04 1e0g n HIS 20 N -4.46 0.31 -3.79 2.20 -0.00 0.16 -4.98 115.22 104.66 1e0g n HIS 20 Ca 0.08 -0.64 -0.26 0.00 -0.00 0.00 0.00 57.72 56.90 1e0g n HIS 20 Cb 0.38 -0.10 0.01 0.00 -0.00 0.00 0.00 29.99 30.28 1e0g n HIS 20 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1e0g n GLY 21 N -0.32 -0.47 3.67 -1.41 0.00 0.13 -4.96 105.19 101.83 1e0g n GLY 21 Ca 0.10 0.23 -0.30 0.00 0.00 0.00 0.00 46.02 46.06 1e0g n GLY 21 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1e0g s VAL 22 N -3.73 1.72 -0.58 1.61 -7.23 -0.67 -4.79 120.40 106.73 1e0g s VAL 22 Ca 0.14 -1.99 -0.09 0.00 -1.81 0.00 0.00 61.98 58.23 1e0g s VAL 22 Cb -0.05 -2.71 0.15 0.00 0.56 0.00 0.00 36.38 34.33 1e0g s VAL 22 CO 0.86 0.00 0.46 0.20 -0.31 0.00 0.00 175.10 176.31 1e0g s ASN 23 N -3.77 5.83 0.58 4.85 0.01 -1.26 -4.54 114.94 116.63 1e0g s ASN 23 Ca 0.25 -2.30 0.29 0.00 -0.71 0.00 0.00 52.86 50.40 1e0g s ASN 23 Cb 0.07 -2.02 1.44 0.00 0.41 0.00 0.00 41.25 41.15 1e0g s ASN 23 CO 0.13 -0.60 1.85 0.40 -1.51 0.00 0.00 177.10 177.37 1e0g h ILE 24 N 5.64 0.38 -0.82 0.60 1.08 -1.91 0.99 117.51 123.47 1e0g h ILE 24 Ca -0.10 0.00 0.01 0.00 -0.39 0.00 0.00 64.86 64.37 1e0g h ILE 24 Cb 1.04 0.55 -0.04 0.00 -3.07 0.00 0.00 36.82 35.30 1e0g h ILE 24 CO 0.81 0.00 0.54 0.07 -0.69 0.00 0.00 178.15 178.88 1e0g h LYS 25 N 0.00 1.09 -0.91 2.37 2.10 -1.97 0.23 116.57 119.47 1e0g h LYS 25 Ca 0.29 -0.07 -0.01 0.00 -2.00 0.00 0.00 60.65 58.86 1e0g h LYS 25 Cb 1.45 -0.24 -0.04 0.00 -0.90 0.00 0.00 32.23 32.49 1e0g h LYS 25 CO -0.00 0.73 0.53 -0.44 -2.00 0.00 0.00 179.45 178.27 1e0g h ASP 26 N 1.12 1.12 -0.62 7.07 3.32 0.59 0.49 116.42 129.51 1e0g h ASP 26 Ca 0.30 -0.08 0.06 0.00 0.02 0.00 0.00 57.03 57.33 1e0g h ASP 26 Cb -0.11 -0.28 -0.05 0.00 0.22 0.00 0.00 39.33 39.10 1e0g h ASP 26 CO -0.06 0.87 0.33 0.58 -1.72 0.00 0.00 179.24 179.24 1e0g h VAL 27 N 1.27 0.96 0.00 -1.35 2.07 -0.30 0.67 116.25 119.57 1e0g h VAL 27 Ca 0.33 -0.21 0.00 0.00 0.82 0.00 0.00 66.70 67.63 1e0g h VAL 27 Cb -0.02 0.28 0.00 0.00 -1.52 0.00 0.00 31.29 30.03 1e0g h VAL 27 CO -0.06 0.11 0.00 0.23 0.02 0.00 0.00 177.57 177.88 1e0g n MET 28 N -4.82 0.20 -0.02 1.57 2.81 0.54 -1.56 117.12 115.84 1e0g n MET 28 Ca 0.07 0.37 -0.16 0.00 -1.81 0.00 0.00 57.70 56.18 1e0g n MET 28 Cb 0.16 -1.85 -0.09 0.00 -0.71 0.00 0.00 33.22 30.73 1e0g n MET 28 CO 0.00 0.00 0.00 -0.09 1.51 0.00 0.00 175.97 177.39 1e0g h ARG 29 N 0.00 0.46 0.09 0.03 2.43 0.51 -3.31 114.38 114.60 1e0g h ARG 29 Ca 0.00 -0.40 -0.28 0.00 -0.81 0.00 0.00 59.98 58.50 1e0g h ARG 29 Cb 0.44 0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 30.07 1e0g h ARG 29 CO 0.00 1.03 -1.37 -1.49 -1.51 0.00 0.00 179.97 176.64 1e0g h TRP 30 N 0.02 0.36 -3.18 2.20 6.55 -1.10 -3.44 115.95 117.37 1e0g h TRP 30 Ca -0.04 -0.27 -0.59 0.00 0.95 0.00 0.00 58.89 58.95 1e0g h TRP 30 Cb 1.14 -0.01 -0.06 0.00 -0.86 0.00 0.00 29.16 29.37 1e0g h TRP 30 CO 0.12 1.26 -0.13 -0.80 -1.05 0.00 0.00 178.44 177.84 1e0g s ASN 31 N -6.93 6.85 -0.19 -3.49 0.01 -0.60 -4.97 114.94 105.62 1e0g s ASN 31 Ca -0.05 1.00 0.02 0.00 -0.71 0.00 0.00 52.86 53.12 1e0g s ASN 31 Cb 0.07 -2.29 -0.21 0.00 0.41 0.00 0.00 41.25 39.23 1e0g s ASN 31 CO 0.86 0.20 0.07 -1.54 -1.51 0.00 0.00 177.10 175.18 1e0g n SER 32 N 2.39 1.68 -4.00 -1.22 3.41 -1.26 -4.60 113.62 110.02 1e0g n SER 32 Ca -0.11 0.03 -0.31 0.00 -0.26 0.00 0.00 58.87 58.23 1e0g n SER 32 Cb 0.52 -0.34 -0.15 0.00 -0.26 0.00 0.00 64.21 63.98 1e0g n SER 32 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1e0g s ASP 33 N -6.51 4.62 -0.18 4.04 1.01 -1.26 -4.96 116.67 113.43 1e0g s ASP 33 Ca -0.25 -1.97 0.01 0.00 0.71 0.00 0.00 52.55 51.04 1e0g s ASP 33 Cb 0.08 -1.53 0.21 0.00 1.01 0.00 0.00 42.92 42.69 1e0g s ASP 33 CO 0.70 -0.35 1.50 0.35 0.21 0.00 0.00 175.17 177.58 1e0g n THR 34 N 4.35 1.98 0.47 -1.27 -2.24 -1.26 -4.26 114.28 112.05 1e0g n THR 34 Ca 0.00 -0.85 0.06 0.00 -2.27 0.00 0.00 64.05 61.00 1e0g n THR 34 Cb 0.42 -0.96 0.27 0.00 -2.10 0.00 0.00 70.33 67.96 1e0g n THR 34 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1e0g n ALA 35 N 0.12 1.61 1.83 6.98 0.00 -1.26 -1.55 120.51 128.23 1e0g n ALA 35 Ca 0.21 -0.05 0.12 0.00 0.00 0.00 0.00 53.44 53.72 1e0g n ALA 35 Cb 0.82 -1.19 0.64 0.00 0.00 0.00 0.00 19.45 19.71 1e0g n ALA 35 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1e0g n ASN 36 N -1.41 0.40 -3.79 0.00 3.02 -1.26 -4.43 115.26 107.80 1e0g n ASN 36 Ca 0.04 -1.35 -0.42 0.00 -0.03 0.00 0.00 54.58 52.82 1e0g n ASN 36 Cb 0.12 -0.02 0.00 0.00 -0.61 0.00 0.00 39.78 39.27 1e0g n ASN 36 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1e0g n LEU 37 N -0.58 6.76 -4.79 3.41 4.32 -0.60 -4.53 117.00 120.98 1e0g n LEU 37 Ca 0.18 -4.23 -0.22 0.00 -0.02 0.00 0.00 56.01 51.72 1e0g n LEU 37 Cb 0.15 -1.63 -0.05 0.00 -1.62 0.00 0.00 43.42 40.27 1e0g n LEU 37 CO 0.14 1.13 -0.14 -1.10 -1.22 0.00 0.00 177.39 176.19 1e0g s GLN 38 N 2.70 2.57 -1.01 3.23 -0.21 -1.26 -4.99 119.66 120.69 1e0g s GLN 38 Ca 0.46 -1.39 -0.24 0.00 0.02 0.00 0.00 55.36 54.20 1e0g s GLN 38 Cb 0.13 -2.34 -0.08 0.00 1.00 0.00 0.00 33.01 31.72 1e0g s GLN 38 CO -0.07 0.12 1.98 -1.25 -2.12 0.00 0.00 175.29 173.96 1e0g s PRO 39 N -3.92 2.40 0.00 2.91 0.04 -1.21 -1.50 135.00 133.72 1e0g s PRO 39 Ca 0.39 -0.57 0.00 0.00 0.04 0.00 0.00 61.00 60.86 1e0g s PRO 39 Cb -0.04 -5.11 0.00 0.00 0.04 0.00 0.00 34.50 29.39 1e0g s PRO 39 CO 0.25 -3.78 0.00 0.41 0.04 0.00 0.00 177.00 173.92 1e0g n GLY 40 N 6.44 0.36 3.56 0.56 0.00 0.21 -4.71 105.19 111.60 1e0g n GLY 40 Ca 0.42 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.14 1e0g n GLY 40 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1e0g s ASP 41 N -0.95 4.30 0.53 1.61 1.11 -0.56 -4.87 116.67 117.84 1e0g s ASP 41 Ca 0.00 -0.37 -0.09 0.00 0.18 0.00 0.00 52.55 52.28 1e0g s ASP 41 Cb 0.00 -0.82 -0.04 0.00 1.07 0.00 0.00 42.92 43.13 1e0g s ASP 41 CO 0.00 0.20 0.89 -1.59 1.18 0.00 0.00 175.17 175.85 1e0g s LYS 42 N -1.97 3.61 -0.01 8.23 0.00 -1.26 0.11 119.74 128.44 1e0g s LYS 42 Ca 0.19 0.48 0.01 0.00 0.00 0.00 0.00 55.97 56.65 1e0g s LYS 42 Cb -0.11 -2.25 0.01 0.00 0.00 0.00 0.00 37.83 35.47 1e0g s LYS 42 CO 0.11 -0.33 -0.04 -1.17 0.00 0.00 0.00 175.35 173.92 1e0g s LEU 43 N -4.78 1.76 -0.16 2.77 0.20 0.18 -4.84 118.68 113.81 1e0g s LEU 43 Ca 0.51 -0.08 -0.29 0.00 0.69 0.00 0.00 54.13 54.96 1e0g s LEU 43 Cb -0.11 -0.27 -0.03 0.00 -0.43 0.00 0.00 46.19 45.36 1e0g s LEU 43 CO 0.46 0.01 1.44 -0.89 -0.29 0.00 0.00 176.35 177.09 1e0g s THR 44 N 0.24 3.96 -0.75 3.68 2.01 -1.26 -1.45 115.64 122.07 1e0g s THR 44 Ca -0.02 1.14 0.01 0.00 0.31 0.00 0.00 61.69 63.13 1e0g s THR 44 Cb -0.06 -3.80 0.35 0.00 0.01 0.00 0.00 72.50 69.00 1e0g s THR 44 CO -0.00 -0.17 1.51 0.18 -0.69 0.00 0.00 174.62 175.45 1e0g n LEU 45 N 7.18 6.16 0.24 4.42 4.77 0.10 -4.73 117.00 135.14 1e0g n LEU 45 Ca 0.16 -5.30 0.18 0.00 -0.03 0.00 0.00 56.01 51.02 1e0g n LEU 45 Cb 0.44 -0.85 0.82 0.00 -2.33 0.00 0.00 43.42 41.50 1e0g n LEU 45 CO 0.60 2.09 1.15 -0.26 -1.33 0.00 0.00 177.39 179.65 1e0g h PHE 46 N 3.28 0.00 -1.15 -1.77 0.04 -1.91 -3.34 116.94 112.08 1e0g h PHE 46 Ca 0.40 0.00 -0.58 0.00 2.80 0.00 0.00 57.97 60.58 1e0g h PHE 46 Cb 0.41 0.00 0.12 0.00 2.20 0.00 0.00 35.95 38.68 1e0g h PHE 46 CO 1.07 0.00 -0.64 1.33 -0.60 0.00 0.00 178.31 179.48 1e0g n VAL 47 N -3.31 1.28 0.78 -0.55 0.24 -1.26 -4.92 118.33 110.59 1e0g n VAL 47 Ca 0.02 -0.45 0.06 0.00 -2.04 0.00 0.00 64.34 61.93 1e0g n VAL 47 Cb 0.44 0.00 0.37 0.00 -1.47 0.00 0.00 33.84 33.18 1e0g n VAL 47 CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86