#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 2.50 0.03 -2.24 1.04 -1.26 -4.97 113.70 108.80 1e0g s SER 2 Ca 0.00 -0.44 -0.16 0.00 0.48 0.00 0.00 55.95 55.83 1e0g s SER 2 Cb 0.00 -0.25 -0.06 0.00 0.10 0.00 0.00 66.02 65.81 1e0g s SER 2 CO 0.00 0.22 0.47 -0.63 0.98 0.00 0.00 173.24 174.28 1e0g s ILE 3 N -0.61 4.92 -0.16 -1.02 1.01 -1.26 -4.94 121.20 119.14 1e0g s ILE 3 Ca 0.08 0.97 -0.01 0.00 0.00 0.00 0.00 60.65 61.69 1e0g s ILE 3 Cb -0.08 -3.78 0.04 0.00 0.01 0.00 0.00 42.46 38.65 1e0g s ILE 3 CO 0.00 0.57 -0.02 -0.89 0.00 0.00 0.00 174.94 174.59 1e0g s THR 4 N -1.10 0.89 -0.03 2.92 2.01 -1.25 0.02 115.64 119.10 1e0g s THR 4 Ca 0.26 -0.54 0.06 0.00 0.31 0.00 0.00 61.69 61.78 1e0g s THR 4 Cb -0.18 -1.15 -0.02 0.00 0.01 0.00 0.00 72.50 71.16 1e0g s THR 4 CO 0.16 0.06 -0.20 -0.72 -0.69 0.00 0.00 174.62 173.22 1e0g s TYR 5 N 1.72 2.52 -0.22 4.92 -0.85 -0.35 -4.75 117.35 120.34 1e0g s TYR 5 Ca 0.01 -0.30 -0.21 0.00 -0.52 0.00 0.00 57.07 56.05 1e0g s TYR 5 Cb -0.15 -1.56 -0.02 0.00 0.38 0.00 0.00 41.96 40.60 1e0g s TYR 5 CO -0.07 0.08 0.65 1.03 -1.52 0.00 0.00 175.55 175.71 1e0g s ARG 6 N -0.68 4.18 -0.45 -3.49 3.00 -1.26 0.76 118.95 121.01 1e0g s ARG 6 Ca 0.11 0.63 -0.29 0.00 0.00 0.00 0.00 55.73 56.18 1e0g s ARG 6 Cb -0.10 -3.60 0.02 0.00 0.00 0.00 0.00 34.95 31.27 1e0g s ARG 6 CO -0.00 -0.31 1.23 0.08 0.00 0.00 0.00 175.30 176.30 1e0g s VAL 7 N 2.14 4.12 0.28 3.52 1.01 0.11 -4.85 120.40 126.72 1e0g s VAL 7 Ca 0.29 1.15 0.06 0.00 0.00 0.00 0.00 61.98 63.47 1e0g s VAL 7 Cb -0.16 -4.47 -0.03 0.00 0.00 0.00 0.00 36.38 31.73 1e0g s VAL 7 CO 0.10 -0.91 0.34 -0.13 0.00 0.00 0.00 175.10 174.50 1e0g s ARG 8 N 4.58 3.15 0.27 2.72 3.00 -1.26 0.65 118.95 132.05 1e0g s ARG 8 Ca 0.52 -0.96 -0.30 0.00 0.00 0.00 0.00 55.73 54.99 1e0g s ARG 8 Cb -0.09 -2.74 -0.13 0.00 0.00 0.00 0.00 34.95 31.98 1e0g s ARG 8 CO 0.31 0.29 1.30 1.63 0.00 0.00 0.00 175.30 178.84 1e0g n LYS 9 N -1.40 1.90 0.00 3.54 5.02 -1.26 -0.04 118.16 125.91 1e0g n LYS 9 Ca -0.06 0.67 0.00 0.00 -2.02 0.00 0.00 58.31 56.90 1e0g n LYS 9 Cb 0.58 -2.26 0.00 0.00 -0.02 0.00 0.00 35.03 33.33 1e0g n LYS 9 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1e0g n GLY 10 N 1.63 2.66 3.70 0.72 0.00 -1.26 -5.00 105.19 107.65 1e0g n GLY 10 Ca 0.10 -0.15 -0.42 0.00 0.00 0.00 0.00 46.02 45.55 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 0.44 6.86 0.05 1.61 1.11 0.94 -5.01 116.67 122.67 1e0g s ASP 11 Ca 0.00 2.19 0.03 0.00 0.18 0.00 0.00 52.55 54.95 1e0g s ASP 11 Cb 0.00 -2.57 -0.04 0.00 1.07 0.00 0.00 42.92 41.38 1e0g s ASP 11 CO 0.00 -0.67 0.02 -0.44 1.18 0.00 0.00 175.17 175.26 1e0g s SER 12 N 1.49 5.20 0.13 0.27 0.01 -1.26 -4.67 113.70 114.87 1e0g s SER 12 Ca 0.64 -0.07 -0.29 0.00 1.31 0.00 0.00 55.95 57.54 1e0g s SER 12 Cb -0.33 -1.33 -0.06 0.00 0.21 0.00 0.00 66.02 64.51 1e0g s SER 12 CO 0.28 0.22 1.58 -0.07 0.41 0.00 0.00 173.24 175.66 1e0g h LEU 13 N 3.76 -1.29 -0.58 2.44 -0.00 -1.99 0.51 115.31 118.17 1e0g h LEU 13 Ca -0.48 0.17 -0.01 0.00 -0.00 0.00 0.00 57.88 57.56 1e0g h LEU 13 Cb 1.17 0.52 -0.03 0.00 -0.00 0.00 0.00 40.66 42.32 1e0g h LEU 13 CO 0.60 -0.43 0.34 0.77 -0.00 0.00 0.00 178.44 179.73 1e0g h SER 14 N -0.50 0.70 -0.35 -0.43 4.64 -1.96 -1.75 113.55 113.91 1e0g h SER 14 Ca 0.07 -0.07 0.04 0.00 -0.47 0.00 0.00 61.79 61.36 1e0g h SER 14 Cb 0.62 -0.18 -0.04 0.00 -0.31 0.00 0.00 62.40 62.50 1e0g h SER 14 CO -0.38 0.57 0.11 -1.28 -0.87 0.00 0.00 176.83 174.98 1e0g h SER 15 N 0.78 0.11 -0.57 4.97 0.87 -1.62 -1.25 113.55 116.84 1e0g h SER 15 Ca 0.21 0.04 0.03 0.00 -1.23 0.00 0.00 61.79 60.84 1e0g h SER 15 Cb 0.00 0.03 -0.04 0.00 -0.44 0.00 0.00 62.40 61.96 1e0g h SER 15 CO -0.04 0.10 0.34 0.40 -0.53 0.00 0.00 176.83 177.10 1e0g h ILE 16 N 0.26 1.04 -0.57 2.23 5.03 0.26 -1.32 117.51 124.44 1e0g h ILE 16 Ca 0.16 -0.23 0.11 0.00 -0.12 0.00 0.00 64.86 64.78 1e0g h ILE 16 Cb 0.14 0.32 -0.09 0.00 -3.03 0.00 0.00 36.82 34.17 1e0g h ILE 16 CO -0.17 0.12 0.06 0.00 -0.68 0.00 0.00 178.15 177.48 1e0g h ALA 17 N 1.26 0.62 -0.98 1.87 0.00 -0.36 0.16 119.26 121.83 1e0g h ALA 17 Ca 0.23 0.15 0.22 0.00 0.00 0.00 0.00 54.91 55.51 1e0g h ALA 17 Cb 0.05 0.23 -0.09 0.00 0.00 0.00 0.00 17.79 17.98 1e0g h ALA 17 CO -0.11 -0.35 0.63 0.87 0.00 0.00 0.00 179.25 180.28 1e0g h LYS 18 N 0.19 0.50 -0.44 0.00 1.79 -0.27 0.54 116.57 118.88 1e0g h LYS 18 Ca 0.30 -0.03 0.10 0.00 -2.18 0.00 0.00 60.65 58.83 1e0g h LYS 18 Cb 0.45 -0.11 -0.02 0.00 -1.58 0.00 0.00 32.23 30.97 1e0g h LYS 18 CO -0.43 0.33 0.30 -0.09 -1.08 0.00 0.00 179.45 178.49 1e0g h ARG 19 N 0.52 0.15 -0.15 3.15 2.43 -0.49 -1.42 114.38 118.58 1e0g h ARG 19 Ca 0.55 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.71 1e0g h ARG 19 Cb 1.20 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.71 1e0g h ARG 19 CO -0.28 0.10 0.00 0.72 -1.51 0.00 0.00 179.97 179.00 1e0g n HIS 20 N -4.45 0.26 -3.77 2.20 -0.00 0.15 -4.98 115.22 104.62 1e0g n HIS 20 Ca 0.07 -0.61 -0.25 0.00 -0.00 0.00 0.00 57.72 56.94 1e0g n HIS 20 Cb 0.40 -0.08 0.02 0.00 -0.00 0.00 0.00 29.99 30.32 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 -0.28 -0.44 3.70 -1.41 0.00 0.12 -4.96 105.19 101.92 1e0g n GLY 21 Ca 0.08 0.22 -0.29 0.00 0.00 0.00 0.00 46.02 46.03 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 -3.72 1.78 -0.57 1.61 -7.23 -0.68 -4.81 120.40 106.77 1e0g s VAL 22 Ca 0.12 -1.91 -0.09 0.00 -1.81 0.00 0.00 61.98 58.28 1e0g s VAL 22 Cb -0.04 -2.69 0.15 0.00 0.56 0.00 0.00 36.38 34.36 1e0g s VAL 22 CO 0.85 0.00 0.45 0.20 -0.31 0.00 0.00 175.10 176.29 1e0g s ASN 23 N -3.83 5.83 0.63 4.85 0.02 -1.26 -4.57 114.94 116.60 1e0g s ASN 23 Ca 0.27 -2.24 0.30 0.00 -1.02 0.00 0.00 52.86 50.17 1e0g s ASN 23 Cb 0.06 -2.02 1.61 0.00 0.02 0.00 0.00 41.25 40.91 1e0g s ASN 23 CO 0.14 -0.61 1.95 0.40 0.02 0.00 0.00 177.10 179.00 1e0g h ILE 24 N 5.71 0.20 -0.61 0.60 1.08 -1.91 1.04 117.51 123.62 1e0g h ILE 24 Ca -0.12 0.00 -0.04 0.00 -0.39 0.00 0.00 64.86 64.31 1e0g h ILE 24 Cb 1.04 0.69 -0.03 0.00 -3.07 0.00 0.00 36.82 35.45 1e0g h ILE 24 CO 0.82 0.00 0.21 0.07 -0.69 0.00 0.00 178.15 178.56 1e0g h LYS 25 N 0.00 0.91 -0.69 2.37 2.10 -1.97 0.35 116.57 119.65 1e0g h LYS 25 Ca 0.08 -0.16 -0.07 0.00 -2.00 0.00 0.00 60.65 58.50 1e0g h LYS 25 Cb 0.79 -0.15 -0.03 0.00 -0.90 0.00 0.00 32.23 31.94 1e0g h LYS 25 CO -0.00 0.77 0.16 -0.44 -2.00 0.00 0.00 179.45 177.95 1e0g h ASP 26 N 0.89 1.04 -0.83 7.07 3.32 0.71 0.60 116.42 129.23 1e0g h ASP 26 Ca 0.20 -0.24 0.06 0.00 0.02 0.00 0.00 57.03 57.08 1e0g h ASP 26 Cb 0.23 -0.27 -0.06 0.00 0.22 0.00 0.00 39.33 39.45 1e0g h ASP 26 CO -0.01 1.01 0.50 0.58 -1.72 0.00 0.00 179.24 179.60 1e0g h VAL 27 N 1.03 1.02 0.00 -1.35 2.07 -0.43 0.68 116.25 119.27 1e0g h VAL 27 Ca 0.21 -0.31 0.00 0.00 0.82 0.00 0.00 66.70 67.42 1e0g h VAL 27 Cb 0.37 0.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.17 1e0g h VAL 27 CO 0.00 0.17 0.00 0.23 0.02 0.00 0.00 177.57 177.99 1e0g n MET 28 N -4.65 0.21 -0.01 1.57 2.81 0.10 -1.49 117.12 115.66 1e0g n MET 28 Ca 0.12 0.30 -0.17 0.00 -1.81 0.00 0.00 57.70 56.13 1e0g n MET 28 Cb 0.18 -1.80 -0.09 0.00 -0.71 0.00 0.00 33.22 30.80 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 0.63 0.22 0.03 2.43 0.59 -3.31 114.38 114.96 1e0g h ARG 29 Ca 0.00 -0.57 -0.34 0.00 -0.81 0.00 0.00 59.98 58.26 1e0g h ARG 29 Cb 0.54 0.13 0.02 0.00 -0.42 0.00 0.00 29.97 30.24 1e0g h ARG 29 CO 0.00 1.18 -1.62 -1.49 -1.51 0.00 0.00 179.97 176.53 1e0g h TRP 30 N 0.28 0.84 -3.07 2.20 6.55 -1.09 -3.44 115.95 118.21 1e0g h TRP 30 Ca -0.06 -0.61 -0.62 0.00 0.95 0.00 0.00 58.89 58.54 1e0g h TRP 30 Cb 1.36 -0.03 -0.11 0.00 -0.86 0.00 0.00 29.16 29.52 1e0g h TRP 30 CO 0.11 1.62 -0.49 -0.80 -1.05 0.00 0.00 178.44 177.82 1e0g s ASN 31 N -7.42 6.23 -0.09 -3.49 0.01 -0.56 -4.96 114.94 104.66 1e0g s ASN 31 Ca -0.12 0.30 0.14 0.00 -0.71 0.00 0.00 52.86 52.46 1e0g s ASN 31 Cb 0.05 -2.07 -0.20 0.00 0.41 0.00 0.00 41.25 39.44 1e0g s ASN 31 CO 0.90 0.26 0.16 -1.54 -1.51 0.00 0.00 177.10 175.36 1e0g n SER 32 N 3.01 1.53 -3.10 -1.22 3.41 -1.26 -4.37 113.62 111.63 1e0g n SER 32 Ca -0.17 0.00 -0.18 0.00 -0.26 0.00 0.00 58.87 58.26 1e0g n SER 32 Cb 0.53 1.17 -0.02 0.00 -0.26 0.00 0.00 64.21 65.63 1e0g n SER 32 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1e0g n ASP 33 N -2.33 1.29 -3.40 4.04 -0.08 -1.26 -4.98 116.55 109.83 1e0g n ASP 33 Ca -0.15 -3.05 -0.39 0.00 -1.51 0.00 0.00 54.79 49.69 1e0g n ASP 33 Cb 0.74 -0.60 -0.02 0.00 2.34 0.00 0.00 41.12 43.57 1e0g n ASP 33 CO 0.00 0.00 0.00 1.07 0.12 0.00 0.00 177.20 178.39 1e0g n THR 34 N 0.18 4.01 0.26 5.18 5.66 -1.26 -4.61 114.28 123.71 1e0g n THR 34 Ca 0.24 -2.61 0.02 0.00 -3.05 0.00 0.00 64.05 58.65 1e0g n THR 34 Cb 0.65 -2.59 0.13 0.00 -1.55 0.00 0.00 70.33 66.97 1e0g n THR 34 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1e0g n ALA 35 N 4.23 1.52 1.09 1.79 0.00 -1.26 -1.93 120.51 125.95 1e0g n ALA 35 Ca 0.71 -0.03 0.09 0.00 0.00 0.00 0.00 53.44 54.21 1e0g n ALA 35 Cb 0.26 -1.08 0.52 0.00 0.00 0.00 0.00 19.45 19.16 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 -1.18 0.00 -3.58 0.00 3.02 -1.26 -4.30 115.26 107.95 1e0g n ASN 36 Ca 0.03 -0.49 -0.41 0.00 -0.03 0.00 0.00 54.58 53.68 1e0g n ASN 36 Cb 0.03 -0.04 -0.04 0.00 -0.61 0.00 0.00 39.78 39.12 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 -1.04 4.76 -4.76 3.41 4.32 -0.81 -4.47 117.00 118.41 1e0g n LEU 37 Ca 0.13 -3.13 -0.23 0.00 -0.02 0.00 0.00 56.01 52.76 1e0g n LEU 37 Cb 0.07 -1.21 -0.06 0.00 -1.62 0.00 0.00 43.42 40.60 1e0g n LEU 37 CO 0.11 0.05 -0.18 -1.10 -1.22 0.00 0.00 177.39 175.05 1e0g s GLN 38 N 4.45 2.49 -0.99 3.23 -0.21 -1.26 -5.00 119.66 122.36 1e0g s GLN 38 Ca 0.54 -1.45 -0.24 0.00 0.02 0.00 0.00 55.36 54.23 1e0g s GLN 38 Cb 0.14 -2.27 -0.07 0.00 1.00 0.00 0.00 33.01 31.81 1e0g s GLN 38 CO 0.06 0.14 1.96 -1.25 -2.12 0.00 0.00 175.29 174.09 1e0g s PRO 39 N -3.87 2.47 0.00 2.91 0.04 -1.22 -1.56 135.00 133.77 1e0g s PRO 39 Ca 0.38 -0.55 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 0.24 -3.66 0.00 0.41 0.04 0.00 0.00 177.00 174.02 1e0g n GLY 40 N 6.49 0.87 3.57 0.56 0.00 0.21 -4.81 105.19 112.09 1e0g n GLY 40 Ca 0.42 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.15 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 -1.24 4.34 0.60 1.61 1.11 -0.60 -4.86 116.67 117.63 1e0g s ASP 41 Ca 0.00 -0.44 -0.08 0.00 0.18 0.00 0.00 52.55 52.20 1e0g s ASP 41 Cb 0.00 -0.79 -0.01 0.00 1.07 0.00 0.00 42.92 43.18 1e0g s ASP 41 CO 0.00 0.16 0.96 -1.59 1.18 0.00 0.00 175.17 175.87 1e0g s LYS 42 N -2.37 3.23 -0.05 8.23 -2.85 -1.26 0.05 119.74 124.72 1e0g s LYS 42 Ca 0.22 0.36 -0.04 0.00 -1.00 0.00 0.00 55.97 55.51 1e0g s LYS 42 Cb -0.10 -2.18 0.02 0.00 -2.06 0.00 0.00 37.83 33.50 1e0g s LYS 42 CO 0.14 -0.63 0.13 -0.51 0.10 0.00 0.00 175.35 174.58 1e0g s LEU 43 N -5.07 1.30 0.08 2.77 1.43 0.23 -4.80 118.68 114.62 1e0g s LEU 43 Ca 0.54 0.27 -0.31 0.00 -1.03 0.00 0.00 54.13 53.60 1e0g s LEU 43 Cb -0.11 0.41 -0.07 0.00 0.03 0.00 0.00 46.19 46.46 1e0g s LEU 43 CO 0.49 -0.07 1.31 -0.89 0.23 0.00 0.00 176.35 177.42 1e0g s THR 44 N 0.37 3.65 -0.51 5.49 2.01 -1.26 -1.22 115.64 124.18 1e0g s THR 44 Ca -0.03 1.17 0.06 0.00 0.31 0.00 0.00 61.69 63.20 1e0g s THR 44 Cb -0.04 -3.75 0.38 0.00 0.01 0.00 0.00 72.50 69.10 1e0g s THR 44 CO -0.02 0.08 1.00 0.18 -0.69 0.00 0.00 174.62 175.17 1e0g n LEU 45 N 4.12 4.25 0.27 4.42 4.77 0.10 -4.81 117.00 130.12 1e0g n LEU 45 Ca 0.11 -5.40 0.18 0.00 -0.03 0.00 0.00 56.01 50.87 1e0g n LEU 45 Cb 0.44 -0.41 0.87 0.00 -2.33 0.00 0.00 43.42 41.99 1e0g n LEU 45 CO 0.57 2.28 1.15 -0.26 -1.33 0.00 0.00 177.39 179.80 1e0g h PHE 46 N 2.83 0.00 -0.98 -1.77 0.04 -1.92 -3.36 116.94 111.79 1e0g h PHE 46 Ca 0.18 0.00 -0.58 0.00 2.80 0.00 0.00 57.97 60.37 1e0g h PHE 46 Cb 0.71 0.00 0.10 0.00 2.20 0.00 0.00 35.95 38.97 1e0g h PHE 46 CO 0.80 0.00 -0.53 1.33 -0.60 0.00 0.00 178.31 179.31 1e0g n VAL 47 N -3.24 1.57 0.90 -0.55 0.24 -1.26 -4.95 118.33 111.04 1e0g n VAL 47 Ca 0.00 -0.44 0.11 0.00 -2.04 0.00 0.00 64.34 61.97 1e0g n VAL 47 Cb 0.37 0.00 0.09 0.00 -1.47 0.00 0.00 33.84 32.83 1e0g n VAL 47 CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86