#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 6.37 0.03 -1.12 1.04 -1.26 -5.04 113.70 113.72 1e0g s SER 2 Ca 0.00 0.28 -0.16 0.00 0.48 0.00 0.00 55.95 56.54 1e0g s SER 2 Cb 0.00 -1.96 -0.06 0.00 0.10 0.00 0.00 66.02 64.10 1e0g s SER 2 CO 0.00 0.12 0.47 -0.63 0.98 0.00 0.00 173.24 174.18 1e0g s ILE 3 N -1.60 4.92 -0.16 -1.02 1.01 -1.26 -4.95 121.20 118.14 1e0g s ILE 3 Ca 0.36 0.98 -0.01 0.00 0.00 0.00 0.00 60.65 61.97 1e0g s ILE 3 Cb -0.12 -3.78 0.05 0.00 0.01 0.00 0.00 42.46 38.61 1e0g s ILE 3 CO 0.28 0.57 -0.02 -0.89 0.00 0.00 0.00 174.94 174.88 1e0g s THR 4 N -1.09 0.83 -0.05 2.92 2.01 -1.26 0.07 115.64 119.08 1e0g s THR 4 Ca 0.26 -0.51 0.04 0.00 0.31 0.00 0.00 61.69 61.79 1e0g s THR 4 Cb -0.18 -1.11 -0.02 0.00 0.01 0.00 0.00 72.50 71.20 1e0g s THR 4 CO 0.16 0.04 -0.17 -0.72 -0.69 0.00 0.00 174.62 173.24 1e0g s TYR 5 N 1.75 2.63 -0.23 4.92 -0.85 -0.39 -4.75 117.35 120.42 1e0g s TYR 5 Ca 0.01 -0.29 -0.21 0.00 -0.52 0.00 0.00 57.07 56.05 1e0g s TYR 5 Cb -0.15 -1.62 -0.02 0.00 0.38 0.00 0.00 41.96 40.54 1e0g s TYR 5 CO -0.07 0.08 0.65 0.50 -1.52 0.00 0.00 175.55 175.19 1e0g s ARG 6 N -0.57 4.15 -0.43 -3.49 3.52 -1.26 0.71 118.95 121.60 1e0g s ARG 6 Ca 0.08 0.62 -0.29 0.00 -0.13 0.00 0.00 55.73 56.01 1e0g s ARG 6 Cb -0.11 -3.62 0.02 0.00 -1.56 0.00 0.00 34.95 29.67 1e0g s ARG 6 CO 0.01 -0.37 1.26 0.08 -0.81 0.00 0.00 175.30 175.48 1e0g s VAL 7 N 2.34 4.09 0.26 7.11 1.01 0.81 -4.85 120.40 131.17 1e0g s VAL 7 Ca 0.28 1.13 0.05 0.00 0.00 0.00 0.00 61.98 63.45 1e0g s VAL 7 Cb -0.16 -4.39 -0.03 0.00 0.00 0.00 0.00 36.38 31.81 1e0g s VAL 7 CO 0.09 -0.83 0.39 -0.13 0.00 0.00 0.00 175.10 174.62 1e0g s ARG 8 N 4.58 3.38 0.31 2.72 0.52 -1.26 0.61 118.95 129.81 1e0g s ARG 8 Ca 0.54 -0.80 -0.29 0.00 -0.52 0.00 0.00 55.73 54.67 1e0g s ARG 8 Cb -0.11 -2.87 -0.13 0.00 0.52 0.00 0.00 34.95 32.36 1e0g s ARG 8 CO 0.30 0.35 1.26 0.36 0.02 0.00 0.00 175.30 177.59 1e0g n LYS 9 N -1.47 1.96 0.00 3.54 -0.00 -1.26 -0.13 118.16 120.80 1e0g n LYS 9 Ca -0.07 0.69 0.00 0.00 -0.00 0.00 0.00 58.31 58.93 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 1.11 2.28 3.80 2.58 0.00 -1.26 -5.01 105.19 108.69 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 -2.80 7.16 0.02 1.61 1.11 0.82 -5.07 116.67 119.53 1e0g s ASP 11 Ca 0.00 1.49 0.08 0.00 0.18 0.00 0.00 52.55 54.30 1e0g s ASP 11 Cb 0.00 -2.44 -0.03 0.00 1.07 0.00 0.00 42.92 41.52 1e0g s ASP 11 CO 0.00 0.09 -0.23 -0.44 1.18 0.00 0.00 175.17 175.78 1e0g s SER 12 N -1.47 3.41 0.13 0.27 0.01 -1.26 -4.81 113.70 109.98 1e0g s SER 12 Ca 0.40 -0.48 -0.28 0.00 1.31 0.00 0.00 55.95 56.90 1e0g s SER 12 Cb -0.19 -0.44 -0.04 0.00 0.21 0.00 0.00 66.02 65.55 1e0g s SER 12 CO 0.22 0.28 1.59 -0.07 0.41 0.00 0.00 173.24 175.67 1e0g h LEU 13 N 4.90 -1.22 -0.62 2.44 -0.00 -1.99 0.46 115.31 119.29 1e0g h LEU 13 Ca -0.46 0.17 -0.02 0.00 -0.00 0.00 0.00 57.88 57.57 1e0g h LEU 13 Cb 1.14 0.50 -0.03 0.00 -0.00 0.00 0.00 40.66 42.28 1e0g h LEU 13 CO 0.46 -0.41 0.32 0.28 -0.00 0.00 0.00 178.44 179.09 1e0g h SER 14 N -0.47 0.79 -0.21 -0.43 0.02 -1.96 -1.64 113.55 109.65 1e0g h SER 14 Ca 0.08 -0.12 0.04 0.00 -0.84 0.00 0.00 61.79 60.95 1e0g h SER 14 Cb 0.61 -0.20 -0.03 0.00 0.14 0.00 0.00 62.40 62.91 1e0g h SER 14 CO -0.38 0.68 -0.01 -1.28 -1.14 0.00 0.00 176.83 174.70 1e0g h SER 15 N 0.84 -0.10 -0.57 3.07 0.87 -1.63 -1.37 113.55 114.66 1e0g h SER 15 Ca 0.21 0.05 0.04 0.00 -1.23 0.00 0.00 61.79 60.86 1e0g h SER 15 Cb 0.09 0.09 -0.04 0.00 -0.44 0.00 0.00 62.40 62.09 1e0g h SER 15 CO -0.03 -0.02 0.32 0.40 -0.53 0.00 0.00 176.83 176.97 1e0g h ILE 16 N 0.06 1.01 -0.64 2.23 5.03 0.10 -0.93 117.51 124.36 1e0g h ILE 16 Ca 0.10 -0.21 0.13 0.00 -0.12 0.00 0.00 64.86 64.76 1e0g h ILE 16 Cb 0.13 0.33 -0.10 0.00 -3.03 0.00 0.00 36.82 34.15 1e0g h ILE 16 CO -0.18 0.11 0.09 0.00 -0.68 0.00 0.00 178.15 177.49 1e0g h ALA 17 N 1.28 0.73 -0.98 1.87 0.00 -0.30 0.23 119.26 122.09 1e0g h ALA 17 Ca 0.24 0.17 0.21 0.00 0.00 0.00 0.00 54.91 55.53 1e0g h ALA 17 Cb 0.10 0.26 -0.09 0.00 0.00 0.00 0.00 17.79 18.05 1e0g h ALA 17 CO -0.14 -0.35 0.62 -0.22 0.00 0.00 0.00 179.25 179.16 1e0g h LYS 18 N 0.20 0.56 -0.36 0.00 3.64 -0.17 0.50 116.57 120.94 1e0g h LYS 18 Ca 0.35 -0.03 0.10 0.00 -1.27 0.00 0.00 60.65 59.79 1e0g h LYS 18 Cb 0.56 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.24 1e0g h LYS 18 CO -0.49 0.37 0.25 -0.09 -2.27 0.00 0.00 179.45 177.23 1e0g h ARG 19 N 0.58 0.02 -0.15 1.90 2.43 -0.35 -1.28 114.38 117.52 1e0g h ARG 19 Ca 0.55 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.71 1e0g h ARG 19 Cb 1.10 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.65 1e0g h ARG 19 CO -0.30 0.01 0.00 0.72 -1.51 0.00 0.00 179.97 178.90 1e0g n HIS 20 N -4.44 0.22 -3.77 2.20 -0.00 0.13 -4.98 115.22 104.59 1e0g n HIS 20 Ca 0.05 -0.53 -0.25 0.00 -0.00 0.00 0.00 57.72 57.00 1e0g n HIS 20 Cb 0.42 -0.05 0.02 0.00 -0.00 0.00 0.00 29.99 30.38 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 -0.13 -0.45 3.70 -1.41 0.00 0.11 -4.96 105.19 102.05 1e0g n GLY 21 Ca 0.06 0.22 -0.30 0.00 0.00 0.00 0.00 46.02 46.01 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 1.70 -0.54 1.61 -7.23 -0.71 -4.82 120.40 106.70 1e0g s VAL 22 Ca 0.12 -1.95 -0.09 0.00 -1.81 0.00 0.00 61.98 58.25 1e0g s VAL 22 Cb -0.04 -2.64 0.14 0.00 0.56 0.00 0.00 36.38 34.39 1e0g s VAL 22 CO 0.85 0.00 0.41 0.20 -0.31 0.00 0.00 175.10 176.25 1e0g s ASN 23 N -3.82 5.77 0.66 4.85 0.02 -1.26 -4.59 114.94 116.58 1e0g s ASN 23 Ca 0.24 -2.15 0.31 0.00 -1.02 0.00 0.00 52.86 50.24 1e0g s ASN 23 Cb 0.06 -2.01 1.66 0.00 0.02 0.00 0.00 41.25 40.98 1e0g s ASN 23 CO 0.13 -0.63 1.94 0.40 0.02 0.00 0.00 177.10 178.96 1e0g h ILE 24 N 5.85 0.01 -0.48 0.60 1.08 -1.91 0.93 117.51 123.58 1e0g h ILE 24 Ca -0.15 0.00 -0.11 0.00 -0.39 0.00 0.00 64.86 64.21 1e0g h ILE 24 Cb 1.05 0.68 -0.02 0.00 -3.07 0.00 0.00 36.82 35.47 1e0g h ILE 24 CO 0.83 0.00 -0.14 0.07 -0.69 0.00 0.00 178.15 178.22 1e0g h LYS 25 N 0.00 0.91 -0.83 2.37 2.10 -1.97 0.33 116.57 119.49 1e0g h LYS 25 Ca 0.01 -0.34 -0.02 0.00 -2.00 0.00 0.00 60.65 58.30 1e0g h LYS 25 Cb 0.65 -0.06 -0.04 0.00 -0.90 0.00 0.00 32.23 31.88 1e0g h LYS 25 CO -0.00 0.99 0.44 -0.44 -2.00 0.00 0.00 179.45 178.44 1e0g h ASP 26 N 0.81 1.05 -0.29 7.07 3.32 0.46 0.54 116.42 129.37 1e0g h ASP 26 Ca 0.12 -0.11 0.03 0.00 0.02 0.00 0.00 57.03 57.10 1e0g h ASP 26 Cb 0.67 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 39.92 1e0g h ASP 26 CO 0.05 0.86 0.09 0.58 -1.72 0.00 0.00 179.24 179.09 1e0g h VAL 27 N 1.15 0.90 0.00 -1.35 2.07 -0.70 0.57 116.25 118.90 1e0g h VAL 27 Ca 0.29 -0.07 0.00 0.00 0.82 0.00 0.00 66.70 67.74 1e0g h VAL 27 Cb 0.06 0.67 0.00 0.00 -1.52 0.00 0.00 31.29 30.50 1e0g h VAL 27 CO -0.04 0.04 0.00 0.23 0.02 0.00 0.00 177.57 177.81 1e0g n MET 28 N -5.05 0.12 0.02 1.57 2.81 0.11 -1.54 117.12 115.16 1e0g n MET 28 Ca -0.00 0.40 -0.18 0.00 -1.81 0.00 0.00 57.70 56.10 1e0g n MET 28 Cb 0.11 -1.75 -0.12 0.00 -0.71 0.00 0.00 33.22 30.76 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 0.41 0.02 0.03 2.43 0.52 -3.36 114.38 114.43 1e0g h ARG 29 Ca 0.00 -0.48 -0.03 0.00 -0.81 0.00 0.00 59.98 58.66 1e0g h ARG 29 Cb 0.27 0.15 0.00 0.00 -0.42 0.00 0.00 29.97 29.97 1e0g h ARG 29 CO 0.00 1.15 -0.16 -1.49 -1.51 0.00 0.00 179.97 177.96 1e0g h TRP 30 N -0.13 0.08 -2.92 2.20 6.55 -0.92 -3.44 115.95 117.37 1e0g h TRP 30 Ca -0.09 -0.06 -0.64 0.00 0.95 0.00 0.00 58.89 59.05 1e0g h TRP 30 Cb 1.41 -0.00 -0.09 0.00 -0.86 0.00 0.00 29.16 29.62 1e0g h TRP 30 CO 0.15 1.06 -0.47 0.54 -1.05 0.00 0.00 178.44 178.67 1e0g s ASN 31 N -6.35 6.33 0.00 -3.49 2.20 -0.59 -5.03 114.94 108.02 1e0g s ASN 31 Ca -0.19 0.39 0.00 0.00 -0.94 0.00 0.00 52.86 52.12 1e0g s ASN 31 Cb -0.02 -2.09 0.00 0.00 -2.00 0.00 0.00 41.25 37.14 1e0g s ASN 31 CO 0.71 0.31 0.00 -1.20 -2.94 0.00 0.00 177.10 173.97 1e0g n SER 32 N 2.64 0.00 -4.56 3.54 7.64 -1.26 -4.15 113.62 117.47 1e0g n SER 32 Ca -0.18 0.00 -0.31 0.00 1.01 0.00 0.00 58.87 59.39 1e0g n SER 32 Cb 0.54 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.69 1e0g n SER 32 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1e0g s ASP 33 N -1.00 5.17 -0.31 6.43 2.15 -1.26 -4.81 116.67 123.05 1e0g s ASP 33 Ca 0.00 -0.24 -0.04 0.00 0.43 0.00 0.00 52.55 52.69 1e0g s ASP 33 Cb 0.00 -2.55 -0.03 0.00 -0.30 0.00 0.00 42.92 40.04 1e0g s ASP 33 CO 0.00 -2.61 2.99 0.35 -0.17 0.00 0.00 175.17 175.73 1e0g n THR 34 N 7.62 3.18 0.45 1.71 -2.24 -1.26 -4.50 114.28 119.25 1e0g n THR 34 Ca 0.32 -2.45 0.05 0.00 -2.27 0.00 0.00 64.05 59.70 1e0g n THR 34 Cb 0.49 -1.70 0.26 0.00 -2.10 0.00 0.00 70.33 67.28 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 1.35 1.59 1.85 6.98 0.00 -1.26 -1.57 120.51 129.45 1e0g n ALA 35 Ca 0.46 -0.05 0.14 0.00 0.00 0.00 0.00 53.44 53.99 1e0g n ALA 35 Cb 0.66 -1.18 0.74 0.00 0.00 0.00 0.00 19.45 19.67 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 -1.40 0.40 -3.86 0.00 3.02 -1.26 -4.46 115.26 107.69 1e0g n ASN 36 Ca 0.04 -1.24 -0.42 0.00 -0.03 0.00 0.00 54.58 52.93 1e0g n ASN 36 Cb 0.11 -0.01 -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 -0.64 6.35 -4.79 3.41 4.32 -0.61 -4.53 117.00 120.52 1e0g n LEU 37 Ca 0.20 -4.02 -0.22 0.00 -0.02 0.00 0.00 56.01 51.95 1e0g n LEU 37 Cb 0.16 -1.64 -0.05 0.00 -1.62 0.00 0.00 43.42 40.27 1e0g n LEU 37 CO 0.16 0.84 -0.16 -1.10 -1.22 0.00 0.00 177.39 175.90 1e0g s GLN 38 N 3.51 2.58 -1.05 3.23 -0.21 -1.26 -4.99 119.66 121.46 1e0g s GLN 38 Ca 0.49 -1.37 -0.24 0.00 0.02 0.00 0.00 55.36 54.27 1e0g s GLN 38 Cb 0.12 -2.35 -0.08 0.00 1.00 0.00 0.00 33.01 31.71 1e0g s GLN 38 CO -0.05 0.17 1.96 -1.25 -2.12 0.00 0.00 175.29 174.00 1e0g s PRO 39 N -3.89 2.43 0.00 2.91 0.04 -1.22 -1.49 135.00 133.77 1e0g s PRO 39 Ca 0.38 -0.73 0.00 0.00 0.04 0.00 0.00 61.00 60.69 1e0g s PRO 39 Cb -0.05 -5.14 0.00 0.00 0.04 0.00 0.00 34.50 29.35 1e0g s PRO 39 CO 0.24 -3.83 0.00 0.41 0.04 0.00 0.00 177.00 173.87 1e0g n GLY 40 N 6.28 0.82 3.53 0.56 0.00 0.20 -4.76 105.19 111.82 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 -1.05 4.12 0.58 1.61 1.01 -0.56 -4.87 116.67 117.51 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 -0.69 -0.03 0.00 1.01 0.00 0.00 42.92 43.21 1e0g s ASP 41 CO 0.00 0.19 0.94 -1.59 0.21 0.00 0.00 175.17 174.92 1e0g s LYS 42 N -2.09 3.42 -0.02 8.23 -2.85 -1.26 -0.13 119.74 125.04 1e0g s LYS 42 Ca 0.19 0.45 -0.01 0.00 -1.00 0.00 0.00 55.97 55.60 1e0g s LYS 42 Cb -0.11 -2.19 0.01 0.00 -2.06 0.00 0.00 37.83 33.48 1e0g s LYS 42 CO 0.11 -0.51 0.04 -0.51 0.10 0.00 0.00 175.35 174.58 1e0g s LEU 43 N -5.03 1.62 -0.03 2.77 1.43 0.22 -4.83 118.68 114.82 1e0g s LEU 43 Ca 0.53 0.07 -0.30 0.00 -1.03 0.00 0.00 54.13 53.40 1e0g s LEU 43 Cb -0.11 0.09 -0.05 0.00 0.03 0.00 0.00 46.19 46.15 1e0g s LEU 43 CO 0.50 -0.05 1.38 -0.89 0.23 0.00 0.00 176.35 177.52 1e0g s THR 44 N 0.33 3.83 -0.58 5.49 2.01 -1.26 -1.27 115.64 124.20 1e0g s THR 44 Ca -0.03 1.17 0.04 0.00 0.31 0.00 0.00 61.69 63.19 1e0g s THR 44 Cb -0.04 -3.75 0.37 0.00 0.01 0.00 0.00 72.50 69.09 1e0g s THR 44 CO -0.01 -0.02 1.15 0.18 -0.69 0.00 0.00 174.62 175.22 1e0g n LEU 45 N 5.65 4.99 0.28 4.42 4.77 0.11 -4.78 117.00 132.43 1e0g n LEU 45 Ca 0.13 -5.43 0.17 0.00 -0.03 0.00 0.00 56.01 50.85 1e0g n LEU 45 Cb 0.44 -0.60 0.85 0.00 -2.33 0.00 0.00 43.42 41.78 1e0g n LEU 45 CO 0.58 2.25 1.15 -0.26 -1.33 0.00 0.00 177.39 179.78 1e0g h PHE 46 N 2.92 0.00 -1.00 -1.77 0.04 -1.92 -3.35 116.94 111.87 1e0g h PHE 46 Ca 0.26 0.00 -0.65 0.00 2.80 0.00 0.00 57.97 60.38 1e0g h PHE 46 Cb 0.62 0.00 0.11 0.00 2.20 0.00 0.00 35.95 38.88 1e0g h PHE 46 CO 0.89 0.00 -0.53 1.33 -0.60 0.00 0.00 178.31 179.40 1e0g n VAL 47 N -3.17 1.88 1.03 -0.55 0.24 -1.26 -4.93 118.33 111.58 1e0g n VAL 47 Ca 0.00 -0.48 0.08 0.00 -2.04 0.00 0.00 64.34 61.90 1e0g n VAL 47 Cb 0.39 0.00 0.49 0.00 -1.47 0.00 0.00 33.84 33.25 1e0g n VAL 47 CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86