#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3bdu s SER 3 N 0.00 5.58 0.35 6.43 0.01 -1.26 -4.39 113.70 120.42 3bdu s SER 3 Ca 0.00 2.74 -0.09 0.00 1.31 0.00 0.00 55.95 59.91 3bdu s SER 3 Cb 0.00 -2.64 -0.06 0.00 0.21 0.00 0.00 66.02 63.53 3bdu s SER 3 CO 0.00 -1.36 0.69 0.20 0.41 0.00 0.00 173.24 173.18 3bdu s ASN 4 N -0.88 6.53 0.04 2.44 0.01 -1.26 -0.36 114.94 121.46 3bdu s ASN 4 Ca 0.67 1.01 0.05 0.00 -0.71 0.00 0.00 52.86 53.88 3bdu s ASN 4 Cb -0.40 -2.27 -0.02 0.00 0.41 0.00 0.00 41.25 38.97 3bdu s ASN 4 CO 0.48 -0.30 -0.14 -0.31 -1.51 0.00 0.00 177.10 175.33 3bdu s TYR 5 N -2.21 1.19 -0.23 2.20 2.02 0.36 -0.09 117.35 120.58 3bdu s TYR 5 Ca 0.49 -0.36 -0.01 0.00 -0.37 0.00 0.00 57.07 56.82 3bdu s TYR 5 Cb -0.10 -0.71 0.02 0.00 -0.40 0.00 0.00 41.96 40.77 3bdu s TYR 5 CO 0.29 0.03 -0.08 0.08 -1.57 0.00 0.00 175.55 174.30 3bdu s VAL 6 N -0.88 2.78 -0.03 0.71 1.01 0.14 -0.23 120.40 123.90 3bdu s VAL 6 Ca 0.01 -0.96 -0.07 0.00 0.00 0.00 0.00 61.98 60.96 3bdu s VAL 6 Cb -0.08 -2.36 -0.04 0.00 0.00 0.00 0.00 36.38 33.89 3bdu s VAL 6 CO 0.01 0.28 0.23 -0.76 0.00 0.00 0.00 175.10 174.86 3bdu s LEU 7 N 1.33 4.39 -0.11 3.92 1.02 0.90 -1.01 118.68 129.12 3bdu s LEU 7 Ca 0.01 0.54 0.03 0.00 0.02 0.00 0.00 54.13 54.74 3bdu s LEU 7 Cb -0.16 -2.47 0.01 0.00 0.02 0.00 0.00 46.19 43.58 3bdu s LEU 7 CO -0.06 0.31 -0.21 -1.00 0.02 0.00 0.00 176.35 175.41 3bdu s HIS 8 N -1.20 2.42 0.63 0.29 3.76 -0.26 -0.23 115.29 120.69 3bdu s HIS 8 Ca 0.23 -1.07 -0.02 0.00 -0.15 0.00 0.00 55.06 54.05 3bdu s HIS 8 Cb -0.13 -1.64 0.05 0.00 1.11 0.00 0.00 32.58 31.96 3bdu s HIS 8 CO 0.13 -0.46 0.89 0.95 -0.85 0.00 0.00 174.74 175.39 3bdu s THR 9 N 0.57 2.47 -0.07 1.30 -4.23 -0.22 -0.64 115.64 114.82 3bdu s THR 9 Ca -0.14 -0.48 0.25 0.00 -1.18 0.00 0.00 61.69 60.14 3bdu s THR 9 Cb -0.17 -2.99 0.29 0.00 1.34 0.00 0.00 72.50 70.97 3bdu s THR 9 CO 0.04 0.00 1.76 0.78 -0.54 0.00 0.00 174.62 176.67 3bdu h ASN 10 N -0.25 0.00 -0.30 3.99 2.35 -1.33 -2.86 115.58 117.17 3bdu h ASN 10 Ca -0.43 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.30 3bdu h ASN 10 Cb 1.30 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.66 3bdu h ASN 10 CO 0.56 0.13 0.02 -0.90 -1.65 0.00 0.00 177.43 175.59 3bdu n ASP 11 N -3.20 3.36 0.00 5.81 5.68 -1.26 -4.91 116.55 122.02 3bdu n ASP 11 Ca 0.02 -2.48 0.00 0.00 -0.50 0.00 0.00 54.79 51.82 3bdu n ASP 11 Cb 0.46 -0.60 0.00 0.00 -1.14 0.00 0.00 41.12 39.84 3bdu n ASP 11 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3bdu n GLY 12 N 0.27 0.56 3.93 6.12 0.00 -1.08 -5.05 105.19 109.93 3bdu n GLY 12 Ca 0.15 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.92 3bdu n GLY 12 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3bdu s ARG 13 N -0.05 3.51 -0.09 1.61 0.52 -1.26 -4.86 118.95 118.33 3bdu s ARG 13 Ca 0.00 -0.19 0.03 0.00 -0.52 0.00 0.00 55.73 55.05 3bdu s ARG 13 Cb 0.00 -2.60 -0.01 0.00 0.52 0.00 0.00 34.95 32.85 3bdu s ARG 13 CO 0.00 0.08 -0.18 0.99 0.02 0.00 0.00 175.30 176.21 3bdu s THR 14 N -2.38 2.62 -0.06 0.02 2.01 -1.26 -1.06 115.64 115.54 3bdu s THR 14 Ca 0.42 -0.84 0.02 0.00 0.31 0.00 0.00 61.69 61.60 3bdu s THR 14 Cb -0.10 -2.04 0.02 0.00 0.01 0.00 0.00 72.50 70.39 3bdu s THR 14 CO 0.37 0.55 -0.10 -0.63 -0.69 0.00 0.00 174.62 174.13 3bdu s ILE 15 N 0.06 0.93 -0.15 1.82 1.01 0.68 -4.97 121.20 120.57 3bdu s ILE 15 Ca -0.07 -0.36 -0.17 0.00 0.00 0.00 0.00 60.65 60.05 3bdu s ILE 15 Cb -0.15 -0.88 -0.04 0.00 0.01 0.00 0.00 42.46 41.40 3bdu s ILE 15 CO 0.05 0.31 0.42 -0.69 0.00 0.00 0.00 174.94 175.03 3bdu s VAL 16 N 0.74 5.21 0.07 2.92 1.01 -1.26 -0.07 120.40 129.02 3bdu s VAL 16 Ca -0.14 0.81 0.08 0.00 0.00 0.00 0.00 61.98 62.74 3bdu s VAL 16 Cb -0.15 -3.76 -0.04 0.00 0.00 0.00 0.00 36.38 32.43 3bdu s VAL 16 CO 0.03 0.31 -0.19 0.00 0.00 0.00 0.00 175.10 175.25 3bdu s ALA 17 N 0.83 2.60 -0.42 5.51 0.00 0.68 -2.74 121.76 128.21 3bdu s ALA 17 Ca 0.22 -1.27 -0.10 0.00 0.00 0.00 0.00 51.96 50.81 3bdu s ALA 17 Cb -0.15 -0.67 0.07 0.00 0.00 0.00 0.00 23.12 22.37 3bdu s ALA 17 CO 0.08 0.58 0.26 -2.00 0.00 0.00 0.00 175.76 174.68 3bdu s GLU 18 N -1.72 2.66 0.00 0.00 2.12 -0.23 -0.49 118.70 121.05 3bdu s GLU 18 Ca 0.16 -1.40 0.00 0.00 0.36 0.00 0.00 54.97 54.09 3bdu s GLU 18 Cb -0.10 -3.79 0.00 0.00 0.26 0.00 0.00 34.13 30.49 3bdu s GLU 18 CO 0.07 -0.92 0.00 0.41 -0.54 0.00 0.00 175.26 174.28 3bdu n GLY 19 N 4.95 2.40 3.69 -1.50 0.00 0.51 -4.48 105.19 110.76 3bdu n GLY 19 Ca -0.10 -1.88 -0.42 0.00 0.00 0.00 0.00 46.02 43.61 3bdu n GLY 19 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3bdu s LYS 20 N -3.17 4.36 0.41 1.61 2.20 -1.26 -4.53 119.74 119.35 3bdu s LYS 20 Ca 0.00 1.73 -0.25 0.00 -0.36 0.00 0.00 55.97 57.09 3bdu s LYS 20 Cb 0.00 -3.53 -0.08 0.00 -1.51 0.00 0.00 37.83 32.71 3bdu s LYS 20 CO 0.00 -0.43 1.15 -2.14 -0.36 0.00 0.00 175.35 173.57 3bdu s PRO 21 N 2.05 4.04 0.17 4.03 0.02 -1.26 -4.93 135.00 139.12 3bdu s PRO 21 Ca 0.57 1.78 -0.13 0.00 0.02 0.00 0.00 61.00 63.24 3bdu s PRO 21 Cb -0.26 -2.62 0.01 0.00 0.02 0.00 0.00 34.50 31.64 3bdu s PRO 21 CO 0.24 -0.32 0.39 -1.59 -0.33 0.00 0.00 177.00 175.39 3bdu s LYS 22 N -2.37 1.21 0.22 5.54 -2.85 -0.84 -4.94 119.74 115.71 3bdu s LYS 22 Ca 0.58 -0.98 -0.30 0.00 -1.00 0.00 0.00 55.97 54.27 3bdu s LYS 22 Cb -0.29 0.44 -0.09 0.00 -2.06 0.00 0.00 37.83 35.84 3bdu s LYS 22 CO 0.36 -0.48 1.19 0.08 0.10 0.00 0.00 175.35 176.60 3bdu s VAL 23 N -3.90 3.47 -0.38 1.79 1.01 -1.26 0.29 120.40 121.42 3bdu s VAL 23 Ca 0.11 1.31 -0.18 0.00 0.00 0.00 0.00 61.98 63.22 3bdu s VAL 23 Cb 0.02 -3.83 0.01 0.00 0.00 0.00 0.00 36.38 32.57 3bdu s VAL 23 CO -0.03 0.24 0.52 -0.62 0.00 0.00 0.00 175.10 175.21 3bdu s ASP 24 N -0.15 6.29 0.63 3.32 -1.08 -1.26 -4.84 116.67 119.58 3bdu s ASP 24 Ca 0.51 -0.22 0.37 0.00 -0.52 0.00 0.00 52.55 52.68 3bdu s ASP 24 Cb -0.33 -2.27 1.99 0.00 -1.46 0.00 0.00 42.92 40.86 3bdu s ASP 24 CO 0.39 -0.55 2.12 0.44 0.52 0.00 0.00 175.17 178.09 3bdu h ASP 25 N 8.59 0.00 1.69 -0.34 3.45 -1.96 0.24 116.42 128.08 3bdu h ASP 25 Ca -0.27 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.19 3bdu h ASP 25 Cb 1.12 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.89 3bdu h ASP 25 CO 0.80 0.00 -0.28 -0.33 -1.57 0.00 0.00 179.24 177.86 3bdu h GLU 26 N 0.00 0.00 0.00 3.56 5.08 -2.03 -3.38 114.58 117.81 3bdu h GLU 26 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3bdu h GLU 26 Cb 0.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.52 3bdu h GLU 26 CO 0.00 0.00 -1.00 0.25 -1.00 0.00 0.00 179.01 177.26 3bdu n THR 27 N -2.93 0.00 -1.54 1.13 -2.24 -0.62 -5.27 114.28 102.82 3bdu n THR 27 Ca 0.03 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.81 3bdu n THR 27 Cb 0.53 -0.69 0.00 0.00 -2.10 0.00 0.00 70.33 68.07 3bdu n THR 27 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3bdu n GLY 28 N 2.89 0.47 3.36 3.38 0.00 0.73 -5.03 105.19 110.99 3bdu n GLY 28 Ca 0.00 -0.37 -0.36 0.00 0.00 0.00 0.00 46.02 45.29 3bdu n GLY 28 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3bdu s ILE 30 N -2.53 3.73 -0.08 -0.61 -1.09 0.15 -4.69 121.20 116.08 3bdu s ILE 30 Ca 0.00 -0.41 -0.04 0.00 -2.23 0.00 0.00 60.65 57.97 3bdu s ILE 30 Cb 0.00 -2.74 -0.04 0.00 -1.58 0.00 0.00 42.46 38.10 3bdu s ILE 30 CO 0.00 0.36 0.09 -0.55 -1.23 0.00 0.00 174.94 173.61 3bdu s SER 31 N 1.52 5.90 0.21 3.58 0.15 0.15 -0.28 113.70 124.93 3bdu s SER 31 Ca 0.06 0.30 -0.23 0.00 0.70 0.00 0.00 55.95 56.77 3bdu s SER 31 Cb -0.15 -1.80 0.04 0.00 -1.71 0.00 0.00 66.02 62.41 3bdu s SER 31 CO -0.00 0.36 0.78 -0.72 1.20 0.00 0.00 173.24 174.85 3bdu s TYR 32 N -1.04 -0.24 -0.16 3.44 1.13 0.14 -1.99 117.35 118.64 3bdu s TYR 32 Ca 0.17 -0.12 -0.01 0.00 -1.41 0.00 0.00 57.07 55.70 3bdu s TYR 32 Cb -0.12 0.66 -0.01 0.00 -1.10 0.00 0.00 41.96 41.39 3bdu s TYR 32 CO 0.07 -1.03 -0.13 0.99 -2.51 0.00 0.00 175.55 172.94 3bdu s THR 33 N -3.67 2.91 1.18 -3.49 2.01 -1.26 -0.00 115.64 113.31 3bdu s THR 33 Ca 0.09 -0.69 -0.19 0.00 0.31 0.00 0.00 61.69 61.21 3bdu s THR 33 Cb -0.04 -2.24 0.28 0.00 0.01 0.00 0.00 72.50 70.51 3bdu s THR 33 CO 0.02 0.50 1.15 1.51 -0.69 0.00 0.00 174.62 177.11 3bdu s ASP 34 N 0.76 1.12 0.28 3.53 1.47 -0.35 -1.06 116.67 122.42 3bdu s ASP 34 Ca -0.05 0.50 0.23 0.00 1.18 0.00 0.00 52.55 54.41 3bdu s ASP 34 Cb -0.15 -0.66 1.04 0.00 -0.34 0.00 0.00 42.92 42.80 3bdu s ASP 34 CO 0.01 -3.99 1.69 0.00 0.68 0.00 0.00 175.17 173.56 3bdu n ALA 35 N -4.65 1.43 -0.66 2.11 0.00 -1.11 -2.18 120.51 115.46 3bdu n ALA 35 Ca 0.14 0.13 0.09 0.00 0.00 0.00 0.00 53.44 53.80 3bdu n ALA 35 Cb 0.60 -1.36 0.33 0.00 0.00 0.00 0.00 19.45 19.02 3bdu n ALA 35 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3bdu n TYR 36 N -2.24 1.37 -0.99 0.00 4.01 -1.26 -4.96 117.16 113.09 3bdu n TYR 36 Ca 0.01 -0.65 0.00 0.00 -0.16 0.00 0.00 57.90 57.10 3bdu n TYR 36 Cb 0.16 -0.26 0.00 0.00 -0.31 0.00 0.00 39.34 38.93 3bdu n TYR 36 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3bdu n GLY 37 N 0.79 0.73 3.74 2.72 0.00 -0.93 -5.02 105.19 107.22 3bdu n GLY 37 Ca 0.24 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.88 3bdu n GLY 37 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3bdu s GLN 38 N -0.08 4.32 -0.04 1.61 0.74 -1.26 -4.83 119.66 120.12 3bdu s GLN 38 Ca 0.00 0.59 -0.30 0.00 0.05 0.00 0.00 55.36 55.70 3bdu s GLN 38 Cb 0.00 -3.40 -0.03 0.00 1.10 0.00 0.00 33.01 30.69 3bdu s GLN 38 CO 0.00 0.24 1.06 -0.65 -0.55 0.00 0.00 175.29 175.38 3bdu s GLN 39 N 0.31 4.46 0.13 1.67 -0.21 -1.26 -1.21 119.66 123.54 3bdu s GLN 39 Ca 0.29 1.50 0.01 0.00 0.02 0.00 0.00 55.36 57.17 3bdu s GLN 39 Cb -0.16 -3.49 -0.04 0.00 1.00 0.00 0.00 33.01 30.31 3bdu s GLN 39 CO 0.14 -0.25 -0.01 -0.65 -2.12 0.00 0.00 175.29 172.40 3bdu s GLN 40 N 1.60 0.92 0.01 2.91 -0.21 1.00 -4.98 119.66 120.92 3bdu s GLN 40 Ca 0.52 -1.41 0.00 0.00 0.02 0.00 0.00 55.36 54.49 3bdu s GLN 40 Cb -0.22 -0.05 -0.01 0.00 1.00 0.00 0.00 33.01 33.74 3bdu s GLN 40 CO 0.23 -0.13 -0.03 -0.65 -2.12 0.00 0.00 175.29 172.59 3bdu s GLN 41 N -3.93 0.22 0.01 2.91 -0.21 -1.26 -0.68 119.66 116.72 3bdu s GLN 41 Ca 0.18 -0.33 0.02 0.00 0.02 0.00 0.00 55.36 55.26 3bdu s GLN 41 Cb 0.07 -0.04 -0.01 0.00 1.00 0.00 0.00 33.01 34.02 3bdu s GLN 41 CO -0.01 0.00 -0.08 -1.50 -2.12 0.00 0.00 175.29 171.59 3bdu s ILE 42 N -0.69 0.58 0.17 1.08 2.07 0.62 -4.95 121.20 120.07 3bdu s ILE 42 Ca -0.07 -0.52 -0.32 0.00 -1.41 0.00 0.00 60.65 58.33 3bdu s ILE 42 Cb -0.05 -0.53 -0.11 0.00 0.13 0.00 0.00 42.46 41.91 3bdu s ILE 42 CO -0.00 0.02 1.64 0.21 -1.91 0.00 0.00 174.94 174.89 3bdu s ASN 43 N -0.56 6.51 0.41 4.50 3.84 -1.26 -0.67 114.94 127.71 3bdu s ASN 43 Ca -0.00 2.70 0.17 0.00 0.21 0.00 0.00 52.86 55.93 3bdu s ASN 43 Cb -0.05 -2.59 1.05 0.00 -0.55 0.00 0.00 41.25 39.12 3bdu s ASN 43 CO 0.00 -0.89 1.85 0.03 -2.79 0.00 0.00 177.10 175.31 3bdu h ARG 44 N 7.01 0.42 0.00 0.43 3.08 -1.93 0.13 114.38 123.52 3bdu h ARG 44 Ca -0.43 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 59.60 3bdu h ARG 44 Cb 1.20 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 31.16 3bdu h ARG 44 CO 0.93 0.28 0.00 -0.44 -1.07 0.00 0.00 179.97 179.67 3bdu h ASP 45 N 0.44 0.00 -0.36 7.04 3.32 -1.97 -1.96 116.42 122.93 3bdu h ASP 45 Ca 0.47 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.52 3bdu h ASP 45 Cb 1.12 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.67 3bdu h ASP 45 CO -0.19 0.00 0.00 -3.20 -1.72 0.00 0.00 179.24 174.13 3bdu n ASN 46 N -2.44 3.45 -4.47 6.45 4.05 0.46 -4.81 115.26 117.94 3bdu n ASN 46 Ca 0.01 -2.00 -0.39 0.00 0.45 0.00 0.00 54.58 52.65 3bdu n ASN 46 Cb 0.20 -0.23 -0.11 0.00 1.23 0.00 0.00 39.78 40.87 3bdu n ASN 46 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 3bdu s VAL 47 N -1.55 4.83 -0.15 3.44 1.01 -0.74 -0.90 120.40 126.36 3bdu s VAL 47 Ca 0.38 -0.33 -0.20 0.00 0.00 0.00 0.00 61.98 61.83 3bdu s VAL 47 Cb 0.23 -3.46 -0.17 0.00 0.00 0.00 0.00 36.38 32.97 3bdu s VAL 47 CO 0.32 0.06 0.42 0.50 0.00 0.00 0.00 175.10 176.39 3bdu h LYS 48 N 8.39 0.00 0.00 2.72 3.64 -1.09 -3.45 116.57 126.77 3bdu h LYS 48 Ca -0.32 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.06 3bdu h LYS 48 Cb 1.15 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.97 3bdu h LYS 48 CO 0.62 0.72 0.00 -0.85 -2.27 0.00 0.00 179.45 177.67 3bdu n GLU 49 N -4.61 0.00 -3.64 1.90 0.28 -1.04 -5.01 120.64 108.53 3bdu n GLU 49 Ca -0.13 0.00 -0.07 0.00 -0.16 0.00 0.00 57.16 56.80 3bdu n GLU 49 Cb 0.41 0.00 -0.07 0.00 1.43 0.00 0.00 31.44 33.21 3bdu n GLU 49 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 3bdu s ALA 51 N -1.27 -2.05 0.08 -1.84 0.00 -0.18 -1.11 121.76 115.40 3bdu s ALA 51 Ca 0.00 1.79 -0.26 0.00 0.00 0.00 0.00 51.96 53.49 3bdu s ALA 51 Cb 0.00 -1.47 -0.06 0.00 0.00 0.00 0.00 23.12 21.59 3bdu s ALA 51 CO 0.00 -0.20 0.82 0.21 0.00 0.00 0.00 175.76 176.58 3bdu s LYS 52 N -0.00 4.56 0.00 0.00 2.20 -1.26 0.28 119.74 125.52 3bdu s LYS 52 Ca 0.04 1.18 0.00 0.00 -0.36 0.00 0.00 55.97 56.83 3bdu s LYS 52 Cb -0.04 -3.35 0.00 0.00 -1.51 0.00 0.00 37.83 32.93 3bdu s LYS 52 CO -0.08 0.32 0.00 0.41 -0.36 0.00 0.00 175.35 175.63