#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 5.75 -0.04 -1.12 1.04 -1.26 -4.91 113.70 113.16 1e0g s SER 2 Ca 0.00 0.17 -0.17 0.00 0.48 0.00 0.00 55.95 56.42 1e0g s SER 2 Cb 0.00 -1.92 -0.05 0.00 0.10 0.00 0.00 66.02 64.14 1e0g s SER 2 CO 0.00 0.24 0.48 -0.63 0.98 0.00 0.00 173.24 174.31 1e0g s ILE 3 N -0.03 5.04 -0.20 -1.02 1.01 -1.26 -4.94 121.20 119.81 1e0g s ILE 3 Ca 0.07 0.99 0.01 0.00 0.00 0.00 0.00 60.65 61.71 1e0g s ILE 3 Cb -0.12 -3.81 0.04 0.00 0.01 0.00 0.00 42.46 38.58 1e0g s ILE 3 CO 0.01 0.45 -0.11 -0.89 0.00 0.00 0.00 174.94 174.40 1e0g s THR 4 N -0.25 1.68 -0.04 2.92 2.01 -1.26 0.25 115.64 120.95 1e0g s THR 4 Ca 0.26 -1.04 0.06 0.00 0.31 0.00 0.00 61.69 61.29 1e0g s THR 4 Cb -0.17 -1.75 -0.02 0.00 0.01 0.00 0.00 72.50 70.58 1e0g s THR 4 CO 0.13 0.17 -0.23 -0.72 -0.69 0.00 0.00 174.62 173.28 1e0g s TYR 5 N 1.38 2.45 -0.24 4.92 -0.85 -0.49 -4.79 117.35 119.73 1e0g s TYR 5 Ca -0.01 -0.44 -0.20 0.00 -0.52 0.00 0.00 57.07 55.90 1e0g s TYR 5 Cb -0.16 -1.56 -0.02 0.00 0.38 0.00 0.00 41.96 40.59 1e0g s TYR 5 CO -0.08 -0.03 0.59 1.03 -1.52 0.00 0.00 175.55 175.53 1e0g s ARG 6 N -0.51 4.13 -0.40 -3.49 0.52 -1.26 0.61 118.95 118.56 1e0g s ARG 6 Ca 0.07 0.48 -0.29 0.00 -0.52 0.00 0.00 55.73 55.47 1e0g s ARG 6 Cb -0.11 -3.63 0.01 0.00 0.52 0.00 0.00 34.95 31.74 1e0g s ARG 6 CO 0.01 -0.33 1.34 0.08 0.02 0.00 0.00 175.30 176.42 1e0g s VAL 7 N 2.24 4.00 0.27 3.52 1.01 0.51 -4.85 120.40 127.11 1e0g s VAL 7 Ca 0.25 1.05 0.05 0.00 0.00 0.00 0.00 61.98 63.33 1e0g s VAL 7 Cb -0.16 -4.26 -0.03 0.00 0.00 0.00 0.00 36.38 31.94 1e0g s VAL 7 CO 0.09 -0.73 0.41 -0.13 0.00 0.00 0.00 175.10 174.74 1e0g s ARG 8 N 4.69 3.38 0.31 2.72 3.00 -1.26 0.69 118.95 132.48 1e0g s ARG 8 Ca 0.58 -0.74 -0.29 0.00 0.00 0.00 0.00 55.73 55.29 1e0g s ARG 8 Cb -0.13 -2.84 -0.13 0.00 0.00 0.00 0.00 34.95 31.85 1e0g s ARG 8 CO 0.30 0.31 1.27 0.36 0.00 0.00 0.00 175.30 177.54 1e0g n LYS 9 N -1.51 1.98 -0.12 3.54 -0.00 -1.26 -0.24 118.16 120.54 1e0g n LYS 9 Ca -0.07 0.70 0.00 0.00 -0.00 0.00 0.00 58.31 58.94 1e0g n LYS 9 Cb 0.57 -2.26 0.00 0.00 -0.00 0.00 0.00 35.03 33.34 1e0g n LYS 9 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1e0g n GLY 10 N 1.10 2.02 3.81 2.58 0.00 -1.26 -5.01 105.19 108.43 1e0g n GLY 10 Ca 0.07 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.72 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 -3.42 7.11 -0.04 1.61 1.11 0.67 -5.07 116.67 118.65 1e0g s ASP 11 Ca 0.00 1.42 0.05 0.00 0.18 0.00 0.00 52.55 54.20 1e0g s ASP 11 Cb 0.00 -2.42 -0.02 0.00 1.07 0.00 0.00 42.92 41.55 1e0g s ASP 11 CO 0.00 0.11 -0.18 -0.55 1.18 0.00 0.00 175.17 175.73 1e0g s SER 12 N -1.47 3.74 0.13 0.27 0.15 -1.26 -4.83 113.70 110.43 1e0g s SER 12 Ca 0.39 -0.28 -0.28 0.00 0.70 0.00 0.00 55.95 56.49 1e0g s SER 12 Cb -0.18 -0.70 -0.04 0.00 -1.71 0.00 0.00 66.02 63.39 1e0g s SER 12 CO 0.22 0.34 1.59 -0.07 1.20 0.00 0.00 173.24 176.52 1e0g h LEU 13 N 5.37 -1.21 -0.46 3.45 -0.00 -1.99 0.49 115.31 120.96 1e0g h LEU 13 Ca -0.46 0.17 -0.00 0.00 -0.00 0.00 0.00 57.88 57.59 1e0g h LEU 13 Cb 1.14 0.50 -0.02 0.00 -0.00 0.00 0.00 40.66 42.28 1e0g h LEU 13 CO 0.49 -0.40 0.28 0.28 -0.00 0.00 0.00 178.44 179.09 1e0g h SER 14 N -0.45 0.55 -0.82 -0.43 0.02 -1.96 -1.62 113.55 108.84 1e0g h SER 14 Ca 0.09 -0.05 0.04 0.00 -0.84 0.00 0.00 61.79 61.02 1e0g h SER 14 Cb 0.60 -0.14 -0.05 0.00 0.14 0.00 0.00 62.40 62.95 1e0g h SER 14 CO -0.39 0.44 0.54 0.77 -1.14 0.00 0.00 176.83 177.05 1e0g h SER 15 N 0.61 0.87 -0.28 3.07 4.64 -1.68 -1.12 113.55 119.67 1e0g h SER 15 Ca 0.17 -0.01 -0.02 0.00 -0.47 0.00 0.00 61.79 61.45 1e0g h SER 15 Cb -0.01 -0.20 -0.01 0.00 -0.31 0.00 0.00 62.40 61.87 1e0g h SER 15 CO -0.03 0.60 0.08 0.40 -0.87 0.00 0.00 176.83 177.00 1e0g h ILE 16 N 1.01 1.20 -0.75 0.95 5.03 0.46 -2.32 117.51 123.10 1e0g h ILE 16 Ca 0.33 -0.66 0.13 0.00 -0.12 0.00 0.00 64.86 64.54 1e0g h ILE 16 Cb 0.04 1.12 -0.09 0.00 -3.03 0.00 0.00 36.82 34.86 1e0g h ILE 16 CO -0.10 0.22 0.31 0.00 -0.68 0.00 0.00 178.15 177.90 1e0g h ALA 17 N 0.91 1.05 -1.00 1.87 0.00 -0.30 0.48 119.26 122.26 1e0g h ALA 17 Ca 0.09 0.11 0.21 0.00 0.00 0.00 0.00 54.91 55.31 1e0g h ALA 17 Cb 0.26 0.07 -0.11 0.00 0.00 0.00 0.00 17.79 18.01 1e0g h ALA 17 CO -0.00 -0.19 0.61 0.87 0.00 0.00 0.00 179.25 180.54 1e0g h LYS 18 N 0.47 0.66 -0.41 0.00 1.79 -0.72 0.54 116.57 118.89 1e0g h LYS 18 Ca 0.40 -0.04 0.10 0.00 -2.18 0.00 0.00 60.65 58.93 1e0g h LYS 18 Cb 0.59 -0.15 -0.02 0.00 -1.58 0.00 0.00 32.23 31.07 1e0g h LYS 18 CO -0.38 0.44 0.29 0.00 -1.08 0.00 0.00 179.45 178.71 1e0g h ARG 19 N 0.68 0.10 -0.16 3.15 3.08 -0.79 -1.47 114.38 118.98 1e0g h ARG 19 Ca 0.59 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.63 1e0g h ARG 19 Cb 1.03 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 31.05 1e0g h ARG 19 CO -0.39 0.07 0.00 0.72 -1.07 0.00 0.00 179.97 179.30 1e0g n HIS 20 N -4.44 0.28 -3.80 3.04 -0.00 0.13 -4.98 115.22 105.45 1e0g n HIS 20 Ca 0.06 -0.61 -0.26 0.00 -0.00 0.00 0.00 57.72 56.91 1e0g n HIS 20 Cb 0.41 -0.09 0.01 0.00 -0.00 0.00 0.00 29.99 30.33 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 -0.27 -0.48 3.68 -1.41 0.00 0.14 -4.96 105.19 101.89 1e0g n GLY 21 Ca 0.09 0.24 -0.30 0.00 0.00 0.00 0.00 46.02 46.05 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 1.68 -0.57 1.61 -7.23 -0.69 -4.83 120.40 106.64 1e0g s VAL 22 Ca 0.15 -1.98 -0.09 0.00 -1.81 0.00 0.00 61.98 58.25 1e0g s VAL 22 Cb -0.05 -2.66 0.15 0.00 0.56 0.00 0.00 36.38 34.37 1e0g s VAL 22 CO 0.86 0.00 0.45 0.20 -0.31 0.00 0.00 175.10 176.30 1e0g s ASN 23 N -3.79 5.84 0.60 4.85 0.02 -1.26 -4.58 114.94 116.62 1e0g s ASN 23 Ca 0.24 -2.24 0.29 0.00 -1.02 0.00 0.00 52.86 50.12 1e0g s ASN 23 Cb 0.06 -2.03 1.53 0.00 0.02 0.00 0.00 41.25 40.83 1e0g s ASN 23 CO 0.12 -0.62 1.93 0.40 0.02 0.00 0.00 177.10 178.95 1e0g h ILE 24 N 5.69 0.30 -0.70 0.60 1.08 -1.91 0.98 117.51 123.55 1e0g h ILE 24 Ca -0.12 0.00 -0.04 0.00 -0.39 0.00 0.00 64.86 64.32 1e0g h ILE 24 Cb 1.04 0.66 -0.03 0.00 -3.07 0.00 0.00 36.82 35.42 1e0g h ILE 24 CO 0.82 0.00 0.29 0.07 -0.69 0.00 0.00 178.15 178.64 1e0g h LYS 25 N 0.00 1.03 -0.78 2.37 2.10 -1.97 0.26 116.57 119.57 1e0g h LYS 25 Ca 0.15 -0.17 -0.05 0.00 -2.00 0.00 0.00 60.65 58.59 1e0g h LYS 25 Cb 0.98 -0.18 -0.03 0.00 -0.90 0.00 0.00 32.23 32.09 1e0g h LYS 25 CO -0.00 0.83 0.31 -0.44 -2.00 0.00 0.00 179.45 178.15 1e0g h ASP 26 N 1.01 1.08 -0.65 7.07 3.32 0.57 0.54 116.42 129.35 1e0g h ASP 26 Ca 0.24 -0.18 0.06 0.00 0.02 0.00 0.00 57.03 57.17 1e0g h ASP 26 Cb 0.18 -0.28 -0.05 0.00 0.22 0.00 0.00 39.33 39.40 1e0g h ASP 26 CO -0.02 0.96 0.36 0.58 -1.72 0.00 0.00 179.24 179.40 1e0g h VAL 27 N 1.13 0.97 0.00 -1.35 2.07 -0.39 0.66 116.25 119.34 1e0g h VAL 27 Ca 0.26 -0.23 0.00 0.00 0.82 0.00 0.00 66.70 67.55 1e0g h VAL 27 Cb 0.22 0.24 0.00 0.00 -1.52 0.00 0.00 31.29 30.23 1e0g h VAL 27 CO -0.02 0.12 0.00 0.23 0.02 0.00 0.00 177.57 177.92 1e0g n MET 28 N -4.79 0.21 -0.01 1.57 2.81 0.70 -1.53 117.12 116.06 1e0g n MET 28 Ca 0.08 0.35 -0.17 0.00 -1.81 0.00 0.00 57.70 56.15 1e0g n MET 28 Cb 0.17 -1.84 -0.09 0.00 -0.71 0.00 0.00 33.22 30.75 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 0.56 0.22 0.03 2.43 0.54 -3.32 114.38 114.84 1e0g h ARG 29 Ca 0.00 -0.50 -0.35 0.00 -0.81 0.00 0.00 59.98 58.33 1e0g h ARG 29 Cb 0.48 0.12 0.02 0.00 -0.42 0.00 0.00 29.97 30.16 1e0g h ARG 29 CO 0.00 1.13 -1.63 -1.49 -1.51 0.00 0.00 179.97 176.47 1e0g h TRP 30 N 0.17 0.83 -3.07 2.20 6.55 -1.08 -3.45 115.95 118.12 1e0g h TRP 30 Ca -0.05 -0.61 -0.61 0.00 0.95 0.00 0.00 58.89 58.57 1e0g h TRP 30 Cb 1.28 -0.03 -0.08 0.00 -0.86 0.00 0.00 29.16 29.47 1e0g h TRP 30 CO 0.11 1.62 -0.30 -0.80 -1.05 0.00 0.00 178.44 178.03 1e0g s ASN 31 N -7.42 6.58 0.00 -3.49 0.01 -0.59 -5.02 114.94 105.01 1e0g s ASN 31 Ca -0.13 0.69 0.00 0.00 -0.71 0.00 0.00 52.86 52.71 1e0g s ASN 31 Cb 0.05 -2.19 0.00 0.00 0.41 0.00 0.00 41.25 39.52 1e0g s ASN 31 CO 0.90 0.24 0.00 -1.20 -1.51 0.00 0.00 177.10 175.52 1e0g n SER 32 N 2.62 0.00 -4.58 -1.22 7.64 -1.26 -4.46 113.62 112.37 1e0g n SER 32 Ca -0.14 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.33 1e0g n SER 32 Cb 0.53 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.70 1e0g n SER 32 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 1e0g s ASP 33 N -1.00 6.11 -0.25 6.43 1.11 -1.26 -4.86 116.67 122.95 1e0g s ASP 33 Ca 0.00 0.35 -0.01 0.00 0.18 0.00 0.00 52.55 53.07 1e0g s ASP 33 Cb 0.00 -2.54 0.13 0.00 1.07 0.00 0.00 42.92 41.57 1e0g s ASP 33 CO 0.00 -1.71 2.19 0.35 1.18 0.00 0.00 175.17 177.17 1e0g n THR 34 N 6.90 2.69 0.44 -1.27 -2.24 -1.26 -4.41 114.28 115.12 1e0g n THR 34 Ca 0.13 -1.55 0.05 0.00 -2.27 0.00 0.00 64.05 60.42 1e0g n THR 34 Cb 0.49 -1.44 0.26 0.00 -2.10 0.00 0.00 70.33 67.54 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 0.77 1.57 1.84 6.98 0.00 -1.26 -1.60 120.51 128.80 1e0g n ALA 35 Ca 0.26 -0.04 0.14 0.00 0.00 0.00 0.00 53.44 53.80 1e0g n ALA 35 Cb 0.58 -1.18 0.76 0.00 0.00 0.00 0.00 19.45 19.60 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 -1.43 0.44 -3.95 0.00 3.02 -1.26 -4.43 115.26 107.65 1e0g n ASN 36 Ca 0.04 -1.22 -0.42 0.00 -0.03 0.00 0.00 54.58 52.94 1e0g n ASN 36 Cb 0.12 -0.01 0.00 0.00 -0.61 0.00 0.00 39.78 39.28 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 -0.62 6.41 -4.79 3.41 4.32 -0.63 -4.54 117.00 120.56 1e0g n LEU 37 Ca 0.21 -4.31 -0.22 0.00 -0.02 0.00 0.00 56.01 51.67 1e0g n LEU 37 Cb 0.17 -1.61 -0.05 0.00 -1.62 0.00 0.00 43.42 40.31 1e0g n LEU 37 CO 0.16 1.04 -0.16 -1.10 -1.22 0.00 0.00 177.39 176.12 1e0g s GLN 38 N 2.26 2.58 -1.01 3.23 -1.52 -1.26 -4.99 119.66 118.95 1e0g s GLN 38 Ca 0.45 -1.37 -0.24 0.00 -1.95 0.00 0.00 55.36 52.26 1e0g s GLN 38 Cb 0.10 -2.35 -0.06 0.00 -0.22 0.00 0.00 33.01 30.48 1e0g s GLN 38 CO -0.03 0.16 1.94 -1.25 -0.25 0.00 0.00 175.29 175.86 1e0g s PRO 39 N -3.89 2.55 0.00 2.91 0.04 -1.23 -1.45 135.00 133.92 1e0g s PRO 39 Ca 0.38 -0.63 0.00 0.00 0.04 0.00 0.00 61.00 60.79 1e0g s PRO 39 Cb -0.05 -5.13 0.00 0.00 0.04 0.00 0.00 34.50 29.36 1e0g s PRO 39 CO 0.24 -3.59 0.00 0.41 0.04 0.00 0.00 177.00 174.10 1e0g n GLY 40 N 6.46 1.15 3.62 0.56 0.00 0.22 -4.76 105.19 112.44 1e0g n GLY 40 Ca 0.42 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 46.16 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 -1.40 4.55 0.53 1.61 1.11 -0.53 -4.87 116.67 117.67 1e0g s ASP 41 Ca 0.00 -0.42 -0.10 0.00 0.18 0.00 0.00 52.55 52.21 1e0g s ASP 41 Cb 0.00 -0.90 -0.05 0.00 1.07 0.00 0.00 42.92 43.04 1e0g s ASP 41 CO 0.00 0.13 0.91 -0.54 1.18 0.00 0.00 175.17 176.85 1e0g s LYS 42 N -2.64 3.66 -0.02 8.23 1.02 -1.26 -0.37 119.74 128.36 1e0g s LYS 42 Ca 0.25 0.57 -0.01 0.00 0.02 0.00 0.00 55.97 56.79 1e0g s LYS 42 Cb -0.10 -2.22 0.01 0.00 -0.52 0.00 0.00 37.83 35.00 1e0g s LYS 42 CO 0.16 -0.34 0.05 -0.51 -0.92 0.00 0.00 175.35 173.79 1e0g s LEU 43 N -4.70 1.53 0.01 3.17 1.43 0.20 -4.81 118.68 115.51 1e0g s LEU 43 Ca 0.53 0.09 -0.30 0.00 -1.03 0.00 0.00 54.13 53.42 1e0g s LEU 43 Cb -0.11 0.11 -0.05 0.00 0.03 0.00 0.00 46.19 46.17 1e0g s LEU 43 CO 0.45 -0.06 1.31 -0.89 0.23 0.00 0.00 176.35 177.39 1e0g s THR 44 N 0.42 3.87 -0.55 5.49 2.01 -1.26 -1.40 115.64 124.22 1e0g s THR 44 Ca -0.03 1.27 0.04 0.00 0.31 0.00 0.00 61.69 63.28 1e0g s THR 44 Cb -0.05 -3.81 0.38 0.00 0.01 0.00 0.00 72.50 69.03 1e0g s THR 44 CO -0.01 0.03 1.14 0.18 -0.69 0.00 0.00 174.62 175.26 1e0g n LEU 45 N 4.93 4.94 0.19 4.42 4.77 0.14 -4.78 117.00 131.61 1e0g n LEU 45 Ca 0.12 -5.39 0.18 0.00 -0.03 0.00 0.00 56.01 50.88 1e0g n LEU 45 Cb 0.45 -0.57 0.78 0.00 -2.33 0.00 0.00 43.42 41.74 1e0g n LEU 45 CO 0.57 2.25 1.16 -0.26 -1.33 0.00 0.00 177.39 179.78 1e0g h PHE 46 N 2.85 0.00 -0.92 -1.77 0.04 -1.91 -3.35 116.94 111.88 1e0g h PHE 46 Ca 0.26 0.00 -0.65 0.00 2.80 0.00 0.00 57.97 60.39 1e0g h PHE 46 Cb 0.67 0.00 0.09 0.00 2.20 0.00 0.00 35.95 38.90 1e0g h PHE 46 CO 0.88 0.00 -0.34 1.33 -0.60 0.00 0.00 178.31 179.58 1e0g n VAL 47 N -3.41 1.34 0.93 -0.55 0.24 -1.26 -4.92 118.33 110.70 1e0g n VAL 47 Ca 0.03 -0.34 0.11 0.00 -2.04 0.00 0.00 64.34 62.11 1e0g n VAL 47 Cb 0.50 0.00 0.09 0.00 -1.47 0.00 0.00 33.84 32.96 1e0g n VAL 47 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98