#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 3.17 0.02 -2.24 1.04 -1.26 -5.00 113.70 109.43 1e0g s SER 2 Ca 0.00 -0.73 -0.17 0.00 0.48 0.00 0.00 55.95 55.53 1e0g s SER 2 Cb 0.00 -0.21 -0.06 0.00 0.10 0.00 0.00 66.02 65.85 1e0g s SER 2 CO 0.00 0.16 0.47 -0.63 0.98 0.00 0.00 173.24 174.22 1e0g s ILE 3 N -1.07 4.93 -0.16 -1.02 1.01 -1.26 -4.94 121.20 118.69 1e0g s ILE 3 Ca 0.13 0.99 -0.01 0.00 0.00 0.00 0.00 60.65 61.76 1e0g s ILE 3 Cb -0.10 -3.79 0.04 0.00 0.01 0.00 0.00 42.46 38.62 1e0g s ILE 3 CO 0.06 0.56 -0.05 -0.89 0.00 0.00 0.00 174.94 174.61 1e0g s THR 4 N -0.99 1.07 -0.05 2.92 2.01 -1.26 0.06 115.64 119.40 1e0g s THR 4 Ca 0.26 -0.60 0.06 0.00 0.31 0.00 0.00 61.69 61.72 1e0g s THR 4 Cb -0.18 -1.25 -0.01 0.00 0.01 0.00 0.00 72.50 71.07 1e0g s THR 4 CO 0.15 0.13 -0.24 -0.72 -0.69 0.00 0.00 174.62 173.25 1e0g s TYR 5 N 1.65 2.45 -0.24 4.92 -0.85 -0.43 -4.79 117.35 120.06 1e0g s TYR 5 Ca 0.01 -0.59 -0.21 0.00 -0.52 0.00 0.00 57.07 55.76 1e0g s TYR 5 Cb -0.15 -1.59 -0.02 0.00 0.38 0.00 0.00 41.96 40.58 1e0g s TYR 5 CO -0.08 -0.13 0.65 0.50 -1.52 0.00 0.00 175.55 174.97 1e0g s ARG 6 N -0.32 4.15 -0.42 -3.49 6.06 -1.26 0.60 118.95 124.28 1e0g s ARG 6 Ca 0.01 0.60 -0.29 0.00 -2.50 0.00 0.00 55.73 53.55 1e0g s ARG 6 Cb -0.13 -3.63 0.02 0.00 0.06 0.00 0.00 34.95 31.27 1e0g s ARG 6 CO 0.02 -0.37 1.30 0.08 -2.50 0.00 0.00 175.30 173.83 1e0g s VAL 7 N 2.37 4.05 0.26 7.11 1.01 0.95 -4.85 120.40 131.30 1e0g s VAL 7 Ca 0.28 1.09 0.05 0.00 0.00 0.00 0.00 61.98 63.40 1e0g s VAL 7 Cb -0.16 -4.33 -0.03 0.00 0.00 0.00 0.00 36.38 31.86 1e0g s VAL 7 CO 0.09 -0.79 0.39 -0.13 0.00 0.00 0.00 175.10 174.66 1e0g s ARG 8 N 4.64 3.39 0.31 2.72 0.52 -1.26 0.65 118.95 129.92 1e0g s ARG 8 Ca 0.56 -0.77 -0.29 0.00 -0.52 0.00 0.00 55.73 54.71 1e0g s ARG 8 Cb -0.12 -2.86 -0.13 0.00 0.52 0.00 0.00 34.95 32.36 1e0g s ARG 8 CO 0.30 0.35 1.25 0.36 0.02 0.00 0.00 175.30 177.58 1e0g n LYS 9 N -1.48 1.95 0.00 3.54 -0.00 -1.26 -0.28 118.16 120.63 1e0g n LYS 9 Ca -0.07 0.68 0.00 0.00 -0.00 0.00 0.00 58.31 58.92 1e0g n LYS 9 Cb 0.57 -2.24 0.00 0.00 -0.00 0.00 0.00 35.03 33.36 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 1.12 2.40 3.85 2.58 0.00 -1.26 -5.02 105.19 108.86 1e0g n GLY 10 Ca 0.07 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.77 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 -2.24 6.69 0.02 1.61 1.11 0.62 -5.07 116.67 119.41 1e0g s ASP 11 Ca 0.00 1.40 0.06 0.00 0.18 0.00 0.00 52.55 54.19 1e0g s ASP 11 Cb 0.00 -2.43 -0.02 0.00 1.07 0.00 0.00 42.92 41.54 1e0g s ASP 11 CO 0.00 -0.41 -0.17 -0.44 1.18 0.00 0.00 175.17 175.33 1e0g s SER 12 N -2.75 2.01 0.12 0.27 0.01 -1.26 -4.86 113.70 107.24 1e0g s SER 12 Ca 0.56 -0.41 -0.30 0.00 1.31 0.00 0.00 55.95 57.10 1e0g s SER 12 Cb -0.10 -0.18 -0.09 0.00 0.21 0.00 0.00 66.02 65.86 1e0g s SER 12 CO 0.25 0.14 1.59 -0.07 0.41 0.00 0.00 173.24 175.55 1e0g h LEU 13 N 5.22 -1.24 -0.45 2.44 -0.00 -1.99 0.51 115.31 119.81 1e0g h LEU 13 Ca -0.39 0.15 -0.01 0.00 -0.00 0.00 0.00 57.88 57.63 1e0g h LEU 13 Cb 1.16 0.48 -0.02 0.00 -0.00 0.00 0.00 40.66 42.28 1e0g h LEU 13 CO 0.46 -0.47 0.22 -1.28 -0.00 0.00 0.00 178.44 177.37 1e0g h SER 14 N -0.61 0.58 -0.70 -0.43 0.87 -1.97 -1.65 113.55 109.64 1e0g h SER 14 Ca 0.04 -0.12 0.06 0.00 -1.23 0.00 0.00 61.79 60.54 1e0g h SER 14 Cb 0.66 -0.15 -0.06 0.00 -0.44 0.00 0.00 62.40 62.42 1e0g h SER 14 CO -0.28 0.53 0.40 0.28 -0.53 0.00 0.00 176.83 177.23 1e0g h SER 15 N 0.58 0.60 -0.43 6.23 0.02 -1.80 -0.84 113.55 117.92 1e0g h SER 15 Ca 0.15 0.03 0.01 0.00 -0.84 0.00 0.00 61.79 61.14 1e0g h SER 15 Cb 0.10 -0.09 -0.02 0.00 0.14 0.00 0.00 62.40 62.53 1e0g h SER 15 CO -0.02 0.39 0.28 0.40 -1.14 0.00 0.00 176.83 176.74 1e0g h ILE 16 N 0.74 1.11 -0.65 3.27 5.03 0.36 -1.58 117.51 125.78 1e0g h ILE 16 Ca 0.31 -0.20 0.12 0.00 -0.12 0.00 0.00 64.86 64.98 1e0g h ILE 16 Cb 0.19 0.48 -0.09 0.00 -3.03 0.00 0.00 36.82 34.37 1e0g h ILE 16 CO -0.18 0.10 0.19 0.00 -0.68 0.00 0.00 178.15 177.59 1e0g h ALA 17 N 1.16 0.84 -0.99 1.87 0.00 -0.23 0.15 119.26 122.06 1e0g h ALA 17 Ca 0.16 0.12 0.21 0.00 0.00 0.00 0.00 54.91 55.40 1e0g h ALA 17 Cb -0.06 0.14 -0.10 0.00 0.00 0.00 0.00 17.79 17.77 1e0g h ALA 17 CO -0.04 -0.26 0.62 -0.22 0.00 0.00 0.00 179.25 179.35 1e0g h LYS 18 N 0.33 0.60 -0.38 0.00 3.64 -0.31 0.61 116.57 121.08 1e0g h LYS 18 Ca 0.35 -0.04 0.11 0.00 -1.27 0.00 0.00 60.65 59.80 1e0g h LYS 18 Cb 0.51 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 32.18 1e0g h LYS 18 CO -0.40 0.40 0.27 -0.09 -2.27 0.00 0.00 179.45 177.36 1e0g h ARG 19 N 0.62 0.01 -0.07 1.90 2.43 -0.48 -1.48 114.38 117.31 1e0g h ARG 19 Ca 0.56 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.73 1e0g h ARG 19 Cb 1.06 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.61 1e0g h ARG 19 CO -0.32 0.01 0.00 0.72 -1.51 0.00 0.00 179.97 178.86 1e0g n HIS 20 N -4.43 0.12 -3.80 2.20 -0.00 0.14 -4.99 115.22 104.47 1e0g n HIS 20 Ca 0.06 -0.61 -0.26 0.00 -0.00 0.00 0.00 57.72 56.90 1e0g n HIS 20 Cb 0.45 -0.08 0.01 0.00 -0.00 0.00 0.00 29.99 30.37 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 -0.51 -0.50 3.68 -1.41 0.00 0.17 -4.96 105.19 101.66 1e0g n GLY 21 Ca 0.06 0.25 -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 -3.73 1.64 -0.62 1.61 -7.23 -0.69 -4.80 120.40 106.59 1e0g s VAL 22 Ca 0.16 -2.00 -0.10 0.00 -1.81 0.00 0.00 61.98 58.24 1e0g s VAL 22 Cb -0.06 -2.64 0.16 0.00 0.56 0.00 0.00 36.38 34.40 1e0g s VAL 22 CO 0.86 0.00 0.51 0.20 -0.31 0.00 0.00 175.10 176.36 1e0g s ASN 23 N -3.78 5.98 0.59 4.85 0.01 -1.26 -4.60 114.94 116.73 1e0g s ASN 23 Ca 0.23 -2.34 0.29 0.00 -0.71 0.00 0.00 52.86 50.32 1e0g s ASN 23 Cb 0.06 -2.06 1.46 0.00 0.41 0.00 0.00 41.25 41.12 1e0g s ASN 23 CO 0.12 -0.61 1.87 0.40 -1.51 0.00 0.00 177.10 177.37 1e0g h ILE 24 N 5.51 0.32 -0.72 0.60 1.08 -1.91 0.92 117.51 123.31 1e0g h ILE 24 Ca -0.08 0.00 -0.01 0.00 -0.39 0.00 0.00 64.86 64.38 1e0g h ILE 24 Cb 1.04 0.59 -0.03 0.00 -3.07 0.00 0.00 36.82 35.35 1e0g h ILE 24 CO 0.82 0.00 0.41 0.07 -0.69 0.00 0.00 178.15 178.76 1e0g h LYS 25 N 0.00 1.00 -0.87 2.37 2.10 -1.98 0.19 116.57 119.38 1e0g h LYS 25 Ca 0.21 -0.10 -0.01 0.00 -2.00 0.00 0.00 60.65 58.75 1e0g h LYS 25 Cb 1.23 -0.20 -0.04 0.00 -0.90 0.00 0.00 32.23 32.32 1e0g h LYS 25 CO -0.00 0.73 0.50 -0.44 -2.00 0.00 0.00 179.45 178.23 1e0g h ASP 26 N 0.99 1.07 -0.59 7.07 3.32 0.45 0.51 116.42 129.25 1e0g h ASP 26 Ca 0.26 -0.08 0.06 0.00 0.02 0.00 0.00 57.03 57.28 1e0g h ASP 26 Cb 0.00 -0.27 -0.05 0.00 0.22 0.00 0.00 39.33 39.23 1e0g h ASP 26 CO -0.04 0.85 0.30 0.58 -1.72 0.00 0.00 179.24 179.20 1e0g h VAL 27 N 1.21 0.93 0.00 -1.35 2.07 -0.37 0.67 116.25 119.41 1e0g h VAL 27 Ca 0.31 -0.19 0.00 0.00 0.82 0.00 0.00 66.70 67.64 1e0g h VAL 27 Cb -0.00 0.33 0.00 0.00 -1.52 0.00 0.00 31.29 30.09 1e0g h VAL 27 CO -0.05 0.10 0.00 0.23 0.02 0.00 0.00 177.57 177.87 1e0g n MET 28 N -4.86 0.18 -0.02 1.57 2.81 0.46 -1.51 117.12 115.76 1e0g n MET 28 Ca 0.07 0.33 -0.17 0.00 -1.81 0.00 0.00 57.70 56.12 1e0g n MET 28 Cb 0.17 -1.79 -0.09 0.00 -0.71 0.00 0.00 33.22 30.79 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 0.51 0.11 0.03 2.43 0.52 -3.31 114.38 114.67 1e0g h ARG 29 Ca 0.00 -0.46 -0.30 0.00 -0.81 0.00 0.00 59.98 58.42 1e0g h ARG 29 Cb 0.45 0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 30.10 1e0g h ARG 29 CO 0.00 1.09 -1.48 -1.49 -1.51 0.00 0.00 179.97 176.58 1e0g h TRP 30 N 0.10 0.44 -3.19 2.20 6.55 -1.07 -3.44 115.95 117.52 1e0g h TRP 30 Ca -0.05 -0.32 -0.59 0.00 0.95 0.00 0.00 58.89 58.88 1e0g h TRP 30 Cb 1.23 -0.02 -0.06 0.00 -0.86 0.00 0.00 29.16 29.45 1e0g h TRP 30 CO 0.12 1.35 -0.14 -0.80 -1.05 0.00 0.00 178.44 177.92 1e0g s ASN 31 N -6.98 6.81 -0.15 -3.49 0.01 -0.57 -4.95 114.94 105.62 1e0g s ASN 31 Ca -0.08 0.97 0.19 0.00 -0.71 0.00 0.00 52.86 53.23 1e0g s ASN 31 Cb 0.07 -2.29 -0.27 0.00 0.41 0.00 0.00 41.25 39.17 1e0g s ASN 31 CO 0.86 0.18 0.19 -0.24 -1.51 0.00 0.00 177.10 176.58 1e0g n SER 32 N 2.57 0.03 -3.88 -1.22 2.88 -1.26 -4.57 113.62 108.16 1e0g n SER 32 Ca -0.10 0.01 -0.30 0.00 -1.33 0.00 0.00 58.87 57.15 1e0g n SER 32 Cb 0.52 1.22 -0.15 0.00 -0.75 0.00 0.00 64.21 65.05 1e0g n SER 32 CO 0.00 0.00 0.00 -1.81 -1.23 0.00 0.00 175.04 172.00 1e0g s ASP 33 N -5.26 4.36 -0.18 -3.46 1.11 -1.26 -4.95 116.67 107.02 1e0g s ASP 33 Ca -0.09 -2.09 0.04 0.00 0.18 0.00 0.00 52.55 50.59 1e0g s ASP 33 Cb 0.08 -1.30 0.37 0.00 1.07 0.00 0.00 42.92 43.15 1e0g s ASP 33 CO 0.85 -0.37 1.32 0.35 1.18 0.00 0.00 175.17 178.50 1e0g n THR 34 N 4.30 1.81 0.48 -1.27 -2.24 -1.26 -4.26 114.28 111.84 1e0g n THR 34 Ca 0.02 -0.86 0.05 0.00 -2.27 0.00 0.00 64.05 61.00 1e0g n THR 34 Cb 0.40 -0.58 0.26 0.00 -2.10 0.00 0.00 70.33 68.31 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 -0.05 1.63 1.59 6.98 0.00 -1.26 -1.58 120.51 127.82 1e0g n ALA 35 Ca 0.23 -0.05 0.10 0.00 0.00 0.00 0.00 53.44 53.73 1e0g n ALA 35 Cb 0.94 -1.17 0.48 0.00 0.00 0.00 0.00 19.45 19.70 1e0g n ALA 35 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1e0g n ASN 36 N -1.32 0.91 -4.07 0.00 2.85 -1.26 -4.56 115.26 107.80 1e0g n ASN 36 Ca 0.05 -1.55 -0.41 0.00 -0.11 0.00 0.00 54.58 52.56 1e0g n ASN 36 Cb 0.09 -0.05 -0.02 0.00 1.24 0.00 0.00 39.78 41.04 1e0g n ASN 36 CO 0.00 0.00 0.00 0.18 -2.11 0.00 0.00 177.26 175.33 1e0g n LEU 37 N -0.20 5.26 -4.78 1.20 4.32 -0.61 -4.57 117.00 117.62 1e0g n LEU 37 Ca 0.16 -3.71 -0.22 0.00 -0.02 0.00 0.00 56.01 52.22 1e0g n LEU 37 Cb 0.21 -1.59 -0.05 0.00 -1.62 0.00 0.00 43.42 40.37 1e0g n LEU 37 CO 0.12 0.15 -0.16 -1.10 -1.22 0.00 0.00 177.39 175.19 1e0g s GLN 38 N 4.29 2.56 -1.05 3.23 -1.52 -1.26 -4.99 119.66 120.91 1e0g s GLN 38 Ca 0.54 -1.39 -0.24 0.00 -1.95 0.00 0.00 55.36 52.32 1e0g s GLN 38 Cb 0.09 -2.33 -0.08 0.00 -0.22 0.00 0.00 33.01 30.47 1e0g s GLN 38 CO 0.03 0.15 1.97 -1.25 -0.25 0.00 0.00 175.29 175.94 1e0g s PRO 39 N -3.89 2.40 0.00 2.91 0.04 -1.22 -1.45 135.00 133.79 1e0g s PRO 39 Ca 0.38 -0.71 0.00 0.00 0.04 0.00 0.00 61.00 60.71 1e0g s PRO 39 Cb -0.05 -5.14 0.00 0.00 0.04 0.00 0.00 34.50 29.36 1e0g s PRO 39 CO 0.24 -3.85 0.00 0.41 0.04 0.00 0.00 177.00 173.84 1e0g n GLY 40 N 6.28 0.77 3.52 0.56 0.00 0.21 -4.72 105.19 111.80 1e0g n GLY 40 Ca 0.43 0.00 -0.30 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 -0.92 4.06 0.55 1.61 1.01 -0.53 -4.88 116.67 117.58 1e0g s ASP 41 Ca 0.00 -0.46 -0.09 0.00 0.71 0.00 0.00 52.55 52.71 1e0g s ASP 41 Cb 0.00 -0.67 -0.04 0.00 1.01 0.00 0.00 42.92 43.22 1e0g s ASP 41 CO 0.00 0.20 0.92 -0.54 0.21 0.00 0.00 175.17 175.96 1e0g s LYS 42 N -2.01 3.60 -0.03 8.23 1.02 -1.26 -0.04 119.74 129.26 1e0g s LYS 42 Ca 0.18 0.52 -0.02 0.00 0.02 0.00 0.00 55.97 56.68 1e0g s LYS 42 Cb -0.11 -2.21 0.02 0.00 -0.52 0.00 0.00 37.83 35.00 1e0g s LYS 42 CO 0.10 -0.39 0.07 -0.51 -0.92 0.00 0.00 175.35 173.70 1e0g s LEU 43 N -4.91 1.45 -0.06 3.17 1.43 0.20 -4.84 118.68 115.13 1e0g s LEU 43 Ca 0.52 0.13 -0.30 0.00 -1.03 0.00 0.00 54.13 53.45 1e0g s LEU 43 Cb -0.11 0.17 -0.04 0.00 0.03 0.00 0.00 46.19 46.24 1e0g s LEU 43 CO 0.49 -0.07 1.35 -0.89 0.23 0.00 0.00 176.35 177.46 1e0g s THR 44 N 0.45 3.97 -0.62 5.49 2.01 -1.26 -1.32 115.64 124.35 1e0g s THR 44 Ca -0.03 1.28 0.03 0.00 0.31 0.00 0.00 61.69 63.28 1e0g s THR 44 Cb -0.05 -3.82 0.37 0.00 0.01 0.00 0.00 72.50 69.01 1e0g s THR 44 CO -0.02 -0.04 1.25 0.18 -0.69 0.00 0.00 174.62 175.30 1e0g n LEU 45 N 5.81 5.31 0.24 4.42 4.77 0.11 -4.76 117.00 132.90 1e0g n LEU 45 Ca 0.13 -5.38 0.17 0.00 -0.03 0.00 0.00 56.01 50.91 1e0g n LEU 45 Cb 0.44 -0.66 0.81 0.00 -2.33 0.00 0.00 43.42 41.68 1e0g n LEU 45 CO 0.57 2.20 1.15 -0.26 -1.33 0.00 0.00 177.39 179.73 1e0g h PHE 46 N 2.99 0.00 -1.12 -1.77 0.04 -1.92 -3.35 116.94 111.81 1e0g h PHE 46 Ca 0.30 0.00 -0.64 0.00 2.80 0.00 0.00 57.97 60.43 1e0g h PHE 46 Cb 0.57 0.00 0.12 0.00 2.20 0.00 0.00 35.95 38.84 1e0g h PHE 46 CO 0.94 0.00 -0.61 1.33 -0.60 0.00 0.00 178.31 179.37 1e0g n VAL 47 N -3.27 1.64 0.53 -0.55 0.24 -1.26 -4.91 118.33 110.74 1e0g n VAL 47 Ca 0.02 -0.49 0.06 0.00 -2.04 0.00 0.00 64.34 61.89 1e0g n VAL 47 Cb 0.45 0.00 0.05 0.00 -1.47 0.00 0.00 33.84 32.87 1e0g n VAL 47 CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86