#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 5.86 -0.05 1.67 1.04 -1.26 -4.98 113.70 115.98 1e0g s SER 2 Ca 0.00 0.19 -0.17 0.00 0.48 0.00 0.00 55.95 56.45 1e0g s SER 2 Cb 0.00 -1.72 -0.05 0.00 0.10 0.00 0.00 66.02 64.35 1e0g s SER 2 CO 0.00 0.26 0.47 -0.63 0.98 0.00 0.00 173.24 174.33 1e0g s ILE 3 N -1.24 5.06 -0.20 -1.02 1.01 -1.26 -4.94 121.20 118.62 1e0g s ILE 3 Ca 0.24 0.97 0.01 0.00 0.00 0.00 0.00 60.65 61.87 1e0g s ILE 3 Cb -0.12 -3.80 0.04 0.00 0.01 0.00 0.00 42.46 38.59 1e0g s ILE 3 CO 0.16 0.44 -0.10 -0.89 0.00 0.00 0.00 174.94 174.55 1e0g s THR 4 N -0.20 1.62 -0.04 2.92 2.01 -1.26 0.26 115.64 120.96 1e0g s THR 4 Ca 0.26 -1.01 0.06 0.00 0.31 0.00 0.00 61.69 61.31 1e0g s THR 4 Cb -0.16 -1.71 -0.02 0.00 0.01 0.00 0.00 72.50 70.62 1e0g s THR 4 CO 0.13 0.15 -0.21 -0.72 -0.69 0.00 0.00 174.62 173.29 1e0g s TYR 5 N 1.40 2.51 -0.22 4.92 -0.85 -0.41 -4.79 117.35 119.91 1e0g s TYR 5 Ca -0.01 -0.33 -0.19 0.00 -0.52 0.00 0.00 57.07 56.01 1e0g s TYR 5 Cb -0.16 -1.57 -0.03 0.00 0.38 0.00 0.00 41.96 40.58 1e0g s TYR 5 CO -0.08 0.05 0.55 1.03 -1.52 0.00 0.00 175.55 175.58 1e0g s ARG 6 N -0.62 4.16 -0.44 -3.49 0.52 -1.26 0.40 118.95 118.23 1e0g s ARG 6 Ca 0.09 0.45 -0.29 0.00 -0.52 0.00 0.00 55.73 55.47 1e0g s ARG 6 Cb -0.11 -3.59 0.02 0.00 0.52 0.00 0.00 34.95 31.79 1e0g s ARG 6 CO 0.00 -0.24 1.22 0.08 0.02 0.00 0.00 175.30 176.38 1e0g s VAL 7 N 1.92 4.14 0.27 3.52 1.01 0.02 -4.84 120.40 126.44 1e0g s VAL 7 Ca 0.25 1.17 0.05 0.00 0.00 0.00 0.00 61.98 63.45 1e0g s VAL 7 Cb -0.16 -4.47 -0.02 0.00 0.00 0.00 0.00 36.38 31.73 1e0g s VAL 7 CO 0.10 -0.89 0.40 -0.13 0.00 0.00 0.00 175.10 174.57 1e0g s ARG 8 N 4.53 3.36 0.29 2.72 0.52 -1.26 0.65 118.95 129.76 1e0g s ARG 8 Ca 0.52 -0.80 -0.30 0.00 -0.52 0.00 0.00 55.73 54.63 1e0g s ARG 8 Cb -0.10 -2.86 -0.13 0.00 0.52 0.00 0.00 34.95 32.38 1e0g s ARG 8 CO 0.31 0.33 1.30 1.63 0.02 0.00 0.00 175.30 178.88 1e0g n LYS 9 N -1.49 1.95 0.00 3.54 5.02 -1.26 -0.20 118.16 125.72 1e0g n LYS 9 Ca -0.07 0.69 0.00 0.00 -2.02 0.00 0.00 58.31 56.91 1e0g n LYS 9 Cb 0.57 -2.27 0.00 0.00 -0.02 0.00 0.00 35.03 33.31 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 1.46 2.59 3.75 0.72 0.00 -1.26 -5.01 105.19 107.44 1e0g n GLY 10 Ca 0.09 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.70 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 -1.85 7.37 -0.01 1.61 1.11 0.72 -5.05 116.67 120.57 1e0g s ASP 11 Ca 0.00 1.63 0.03 0.00 0.18 0.00 0.00 52.55 54.39 1e0g s ASP 11 Cb 0.00 -2.52 -0.03 0.00 1.07 0.00 0.00 42.92 41.44 1e0g s ASP 11 CO 0.00 0.05 -0.08 -0.55 1.18 0.00 0.00 175.17 175.76 1e0g s SER 12 N -0.38 4.50 0.12 0.27 0.15 -1.26 -4.78 113.70 112.32 1e0g s SER 12 Ca 0.40 -0.16 -0.30 0.00 0.70 0.00 0.00 55.95 56.60 1e0g s SER 12 Cb -0.22 -1.03 -0.08 0.00 -1.71 0.00 0.00 66.02 62.98 1e0g s SER 12 CO 0.26 0.30 1.58 -0.07 1.20 0.00 0.00 173.24 176.51 1e0g h LEU 13 N 4.70 -1.34 -0.67 3.45 -0.00 -1.99 0.50 115.31 119.97 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 0.53 -0.03 0.00 -0.00 0.00 0.00 40.66 42.32 1e0g h LEU 13 CO 0.53 -0.45 0.38 -1.28 -0.00 0.00 0.00 178.44 177.62 1e0g h SER 14 N -0.55 0.82 -0.47 -0.43 0.87 -1.96 -1.72 113.55 110.10 1e0g h SER 14 Ca 0.06 -0.08 0.04 0.00 -1.23 0.00 0.00 61.79 60.58 1e0g h SER 14 Cb 0.65 -0.21 -0.04 0.00 -0.44 0.00 0.00 62.40 62.36 1e0g h SER 14 CO -0.36 0.66 0.24 -1.28 -0.53 0.00 0.00 176.83 175.56 1e0g h SER 15 N 0.91 0.34 -0.53 6.23 0.87 -1.66 -1.25 113.55 118.46 1e0g h SER 15 Ca 0.24 0.03 0.02 0.00 -1.23 0.00 0.00 61.79 60.84 1e0g h SER 15 Cb 0.01 -0.04 -0.03 0.00 -0.44 0.00 0.00 62.40 61.90 1e0g h SER 15 CO -0.04 0.24 0.32 0.40 -0.53 0.00 0.00 176.83 177.22 1e0g h ILE 16 N 0.47 1.07 -0.56 2.23 5.03 0.32 -1.49 117.51 124.59 1e0g h ILE 16 Ca 0.21 -0.22 0.11 0.00 -0.12 0.00 0.00 64.86 64.83 1e0g h ILE 16 Cb 0.11 0.37 -0.08 0.00 -3.03 0.00 0.00 36.82 34.19 1e0g h ILE 16 CO -0.15 0.12 0.09 0.00 -0.68 0.00 0.00 178.15 177.53 1e0g h ALA 17 N 1.22 0.63 -0.96 1.87 0.00 -0.36 0.16 119.26 121.83 1e0g h ALA 17 Ca 0.21 0.13 0.22 0.00 0.00 0.00 0.00 54.91 55.47 1e0g h ALA 17 Cb -0.00 0.20 -0.08 0.00 0.00 0.00 0.00 17.79 17.91 1e0g h ALA 17 CO -0.08 -0.33 0.62 0.87 0.00 0.00 0.00 179.25 180.33 1e0g h LYS 18 N 0.21 0.46 -0.45 0.00 6.56 -0.27 0.59 116.57 123.67 1e0g h LYS 18 Ca 0.29 -0.03 0.09 0.00 -1.06 0.00 0.00 60.65 59.95 1e0g h LYS 18 Cb 0.43 -0.10 -0.02 0.00 -0.57 0.00 0.00 32.23 31.96 1e0g h LYS 18 CO -0.40 0.30 0.31 -0.09 -2.06 0.00 0.00 179.45 177.52 1e0g h ARG 19 N 0.47 0.19 -0.15 3.15 9.65 -0.44 -1.36 114.38 125.88 1e0g h ARG 19 Ca 0.52 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 59.39 1e0g h ARG 19 Cb 1.20 -0.04 0.00 0.00 -1.39 0.00 0.00 29.97 29.74 1e0g h ARG 19 CO -0.24 0.13 0.00 0.72 2.80 0.00 0.00 179.97 183.38 1e0g n HIS 20 N -4.45 0.27 -3.74 2.20 -0.00 0.16 -4.98 115.22 104.67 1e0g n HIS 20 Ca 0.07 -0.60 -0.24 0.00 -0.00 0.00 0.00 57.72 56.94 1e0g n HIS 20 Cb 0.39 -0.08 0.02 0.00 -0.00 0.00 0.00 29.99 30.31 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 -0.26 -0.47 3.68 -1.41 0.00 0.13 -4.88 105.19 101.98 1e0g n GLY 21 Ca 0.08 0.23 -0.30 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 -3.69 1.70 -0.57 1.61 -7.23 -0.64 -4.91 120.40 106.67 1e0g s VAL 22 Ca 0.13 -1.98 -0.09 0.00 -1.81 0.00 0.00 61.98 58.23 1e0g s VAL 22 Cb -0.04 -2.68 0.15 0.00 0.56 0.00 0.00 36.38 34.36 1e0g s VAL 22 CO 0.84 0.00 0.44 0.20 -0.31 0.00 0.00 175.10 176.27 1e0g s ASN 23 N -3.79 5.78 0.61 4.85 -0.87 -1.26 -4.54 114.94 115.72 1e0g s ASN 23 Ca 0.24 -2.25 0.29 0.00 -1.57 0.00 0.00 52.86 49.57 1e0g s ASN 23 Cb 0.07 -2.01 1.48 0.00 -0.02 0.00 0.00 41.25 40.77 1e0g s ASN 23 CO 0.13 -0.60 1.88 0.40 -2.57 0.00 0.00 177.10 176.34 1e0g h ILE 24 N 5.71 0.29 -0.77 0.60 1.08 -1.91 0.93 117.51 123.44 1e0g h ILE 24 Ca -0.11 0.00 -0.00 0.00 -0.39 0.00 0.00 64.86 64.35 1e0g h ILE 24 Cb 1.04 0.61 -0.04 0.00 -3.07 0.00 0.00 36.82 35.37 1e0g h ILE 24 CO 0.81 0.00 0.47 0.07 -0.69 0.00 0.00 178.15 178.81 1e0g h LYS 25 N 0.00 1.05 -0.86 2.37 2.10 -1.98 0.31 116.57 119.56 1e0g h LYS 25 Ca 0.17 -0.09 -0.02 0.00 -2.00 0.00 0.00 60.65 58.70 1e0g h LYS 25 Cb 1.10 -0.22 -0.04 0.00 -0.90 0.00 0.00 32.23 32.17 1e0g h LYS 25 CO -0.00 0.74 0.45 -0.44 -2.00 0.00 0.00 179.45 178.19 1e0g h ASP 26 N 1.06 1.09 -0.65 7.07 3.32 0.47 0.52 116.42 129.30 1e0g h ASP 26 Ca 0.28 -0.11 0.05 0.00 0.02 0.00 0.00 57.03 57.27 1e0g h ASP 26 Cb -0.04 -0.28 -0.05 0.00 0.22 0.00 0.00 39.33 39.18 1e0g h ASP 26 CO -0.05 0.89 0.37 0.58 -1.72 0.00 0.00 179.24 179.31 1e0g h VAL 27 N 1.21 0.99 0.00 -1.35 2.07 -0.33 0.66 116.25 119.50 1e0g h VAL 27 Ca 0.30 -0.24 0.00 0.00 0.82 0.00 0.00 66.70 67.58 1e0g h VAL 27 Cb 0.06 0.24 0.00 0.00 -1.52 0.00 0.00 31.29 30.07 1e0g h VAL 27 CO -0.04 0.13 0.00 0.23 0.02 0.00 0.00 177.57 177.90 1e0g n MET 28 N -4.78 0.17 -0.01 1.57 2.81 0.85 -1.51 117.12 116.22 1e0g n MET 28 Ca 0.08 0.31 -0.17 0.00 -1.81 0.00 0.00 57.70 56.11 1e0g n MET 28 Cb 0.16 -1.77 -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 0.54 0.17 0.03 2.43 0.53 -3.32 114.38 114.76 1e0g h ARG 29 Ca 0.00 -0.48 -0.32 0.00 -0.81 0.00 0.00 59.98 58.36 1e0g h ARG 29 Cb 0.45 0.11 0.01 0.00 -0.42 0.00 0.00 29.97 30.13 1e0g h ARG 29 CO 0.00 1.11 -1.55 -1.49 -1.51 0.00 0.00 179.97 176.53 1e0g h TRP 30 N 0.13 0.67 -3.15 2.20 6.55 -1.08 -3.45 115.95 117.82 1e0g h TRP 30 Ca -0.06 -0.49 -0.59 0.00 0.95 0.00 0.00 58.89 58.70 1e0g h TRP 30 Cb 1.27 -0.03 -0.06 0.00 -0.86 0.00 0.00 29.16 29.48 1e0g h TRP 30 CO 0.12 1.50 -0.16 -0.80 -1.05 0.00 0.00 178.44 178.06 1e0g s ASN 31 N -7.24 6.82 -0.12 -3.49 0.01 -0.57 -4.96 114.94 105.39 1e0g s ASN 31 Ca -0.10 0.97 0.17 0.00 -0.71 0.00 0.00 52.86 53.18 1e0g s ASN 31 Cb 0.06 -2.28 -0.24 0.00 0.41 0.00 0.00 41.25 39.20 1e0g s ASN 31 CO 0.88 0.22 0.18 -1.54 -1.51 0.00 0.00 177.10 175.33 1e0g n SER 32 N 2.33 0.72 -3.90 -1.22 3.41 -1.26 -4.54 113.62 109.15 1e0g n SER 32 Ca -0.11 0.00 -0.30 0.00 -0.26 0.00 0.00 58.87 58.20 1e0g n SER 32 Cb 0.52 1.23 -0.14 0.00 -0.26 0.00 0.00 64.21 65.56 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 -4.81 4.26 -0.13 4.04 1.01 -1.26 -4.94 116.67 114.84 1e0g s ASP 33 Ca -0.08 -2.69 0.04 0.00 0.71 0.00 0.00 52.55 50.53 1e0g s ASP 33 Cb 0.07 -1.47 0.28 0.00 1.01 0.00 0.00 42.92 42.81 1e0g s ASP 33 CO 0.73 -0.28 1.14 0.35 0.21 0.00 0.00 175.17 177.33 1e0g n THR 34 N 3.52 1.40 0.49 -1.27 -2.24 -1.26 -4.16 114.28 110.75 1e0g n THR 34 Ca 0.05 -0.61 0.05 0.00 -2.27 0.00 0.00 64.05 61.27 1e0g n THR 34 Cb 0.35 -0.59 0.26 0.00 -2.10 0.00 0.00 70.33 68.25 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 0.07 1.64 1.90 6.98 0.00 -1.26 -1.57 120.51 128.27 1e0g n ALA 35 Ca 0.16 -0.05 0.13 0.00 0.00 0.00 0.00 53.44 53.68 1e0g n ALA 35 Cb 0.76 -1.17 0.71 0.00 0.00 0.00 0.00 19.45 19.75 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 -1.32 0.26 -4.36 0.00 3.02 -1.26 -4.54 115.26 107.06 1e0g n ASN 36 Ca 0.05 -1.26 -0.38 0.00 -0.03 0.00 0.00 54.58 52.96 1e0g n ASN 36 Cb 0.09 -0.01 -0.03 0.00 -0.61 0.00 0.00 39.78 39.22 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 -0.71 4.41 -4.79 3.41 4.32 -0.61 -4.61 117.00 118.42 1e0g n LEU 37 Ca 0.19 -3.56 -0.22 0.00 -0.02 0.00 0.00 56.01 52.40 1e0g n LEU 37 Cb 0.13 -1.66 -0.05 0.00 -1.62 0.00 0.00 43.42 40.22 1e0g n LEU 37 CO 0.15 -0.50 -0.15 -1.10 -1.22 0.00 0.00 177.39 174.57 1e0g s GLN 38 N 4.99 2.58 -1.02 3.23 -1.52 -1.26 -4.99 119.66 121.67 1e0g s GLN 38 Ca 0.59 -1.38 -0.24 0.00 -1.95 0.00 0.00 55.36 52.38 1e0g s GLN 38 Cb 0.05 -2.35 -0.07 0.00 -0.22 0.00 0.00 33.01 30.42 1e0g s GLN 38 CO 0.08 0.14 1.96 -1.25 -0.25 0.00 0.00 175.29 175.97 1e0g s PRO 39 N -3.91 2.47 0.00 2.91 0.04 -1.22 -1.43 135.00 133.87 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 29.37 1e0g s PRO 39 CO 0.24 -3.70 0.00 0.41 0.04 0.00 0.00 177.00 173.99 1e0g n GLY 40 N 6.41 1.37 3.74 0.56 0.00 0.21 -4.81 105.19 112.67 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 -0.35 0.00 0.00 0.00 173.32 172.97 1e0g s ASP 41 N -1.54 5.29 0.43 1.61 -1.08 -0.51 -4.85 116.67 116.02 1e0g s ASP 41 Ca 0.00 -0.13 -0.15 0.00 -0.52 0.00 0.00 52.55 51.75 1e0g s ASP 41 Cb 0.00 -1.34 -0.08 0.00 -1.46 0.00 0.00 42.92 40.04 1e0g s ASP 41 CO 0.00 0.14 0.87 -0.54 0.52 0.00 0.00 175.17 176.16 1e0g s LYS 42 N -2.57 3.97 -0.01 4.34 1.02 -1.26 -0.80 119.74 124.43 1e0g s LYS 42 Ca 0.28 0.79 0.01 0.00 0.02 0.00 0.00 55.97 57.07 1e0g s LYS 42 Cb -0.11 -2.28 0.01 0.00 -0.52 0.00 0.00 37.83 34.93 1e0g s LYS 42 CO 0.21 -0.07 -0.01 -0.51 -0.92 0.00 0.00 175.35 174.05 1e0g s LEU 43 N -3.60 1.65 0.07 3.17 1.43 0.16 -4.88 118.68 116.69 1e0g s LEU 43 Ca 0.56 -0.03 -0.31 0.00 -1.03 0.00 0.00 54.13 53.32 1e0g s LEU 43 Cb -0.10 -0.16 -0.06 0.00 0.03 0.00 0.00 46.19 45.90 1e0g s LEU 43 CO 0.25 -0.03 1.26 -0.89 0.23 0.00 0.00 176.35 177.18 1e0g s THR 44 N 0.39 3.81 -0.49 5.49 2.01 -1.26 -1.29 115.64 124.30 1e0g s THR 44 Ca -0.04 1.29 0.06 0.00 0.31 0.00 0.00 61.69 63.31 1e0g s THR 44 Cb -0.06 -3.83 0.39 0.00 0.01 0.00 0.00 72.50 69.00 1e0g s THR 44 CO -0.01 0.09 1.02 0.18 -0.69 0.00 0.00 174.62 175.21 1e0g n LEU 45 N 4.05 4.33 0.32 4.42 4.77 0.14 -4.78 117.00 130.25 1e0g n LEU 45 Ca 0.10 -5.34 0.18 0.00 -0.03 0.00 0.00 56.01 50.92 1e0g n LEU 45 Cb 0.45 -0.42 0.95 0.00 -2.33 0.00 0.00 43.42 42.07 1e0g n LEU 45 CO 0.57 2.26 1.15 -0.26 -1.33 0.00 0.00 177.39 179.78 1e0g h PHE 46 N 2.78 0.00 -0.91 -1.77 0.04 -1.92 -2.39 116.94 112.77 1e0g h PHE 46 Ca 0.20 0.00 0.35 0.00 2.80 0.00 0.00 57.97 61.33 1e0g h PHE 46 Cb 0.76 0.00 -0.16 0.00 2.20 0.00 0.00 35.95 38.74 1e0g h PHE 46 CO 0.80 0.00 0.39 1.33 -0.60 0.00 0.00 178.31 180.23 1e0g n VAL 47 N -3.02 -0.38 0.79 -0.55 0.24 -1.26 -4.94 118.33 109.20 1e0g n VAL 47 Ca -0.02 1.88 0.09 0.00 -2.04 0.00 0.00 64.34 64.25 1e0g n VAL 47 Cb 0.28 -2.98 0.08 0.00 -1.47 0.00 0.00 33.84 29.75 1e0g n VAL 47 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98