#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bx7 s ASN 4 N 0.00 6.79 0.93 1.61 2.47 -1.26 -5.06 114.94 120.43 1bx7 s ASN 4 Ca 0.00 1.77 -0.08 0.00 0.42 0.00 0.00 52.86 54.97 1bx7 s ASN 4 Cb 0.00 -2.55 0.13 0.00 -1.45 0.00 0.00 41.25 37.38 1bx7 s ASN 4 CO 0.00 -0.47 0.77 0.35 -3.72 0.00 0.00 177.10 174.03 1bx7 n THR 5 N -0.67 0.00 -3.63 -5.21 -2.24 -1.26 -5.01 114.28 96.26 1bx7 n THR 5 Ca 0.07 -0.65 -0.39 0.00 -2.27 0.00 0.00 64.05 60.81 1bx7 n THR 5 Cb 0.53 -1.60 -0.10 0.00 -2.10 0.00 0.00 70.33 67.06 1bx7 n THR 5 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1bx7 n GLY 7 N 4.83 -0.50 1.65 0.00 0.00 -1.06 -1.45 105.19 108.66 1bx7 n GLY 7 Ca -0.08 0.01 0.00 0.00 0.00 0.00 0.00 46.02 45.95 1bx7 n GLY 7 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bx7 n GLY 8 N -0.93 0.78 3.38 -0.02 0.00 -1.26 -5.03 105.19 102.11 1bx7 n GLY 8 Ca -0.19 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.62 1bx7 n GLY 8 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1bx7 s GLU 9 N -0.42 1.44 -0.23 1.61 -1.05 -0.53 -4.98 118.70 114.54 1bx7 s GLU 9 Ca 0.00 -1.61 -0.14 0.00 -0.15 0.00 0.00 54.97 53.07 1bx7 s GLU 9 Cb 0.00 -1.39 -0.04 0.00 -0.44 0.00 0.00 34.13 32.26 1bx7 s GLU 9 CO 0.00 0.25 0.30 0.99 0.95 0.00 0.00 175.26 177.76 1bx7 s THR 10 N -2.61 5.26 0.30 1.83 2.01 -1.26 -0.18 115.64 120.99 1bx7 s THR 10 Ca 0.24 0.48 -0.28 0.00 0.31 0.00 0.00 61.69 62.44 1bx7 s THR 10 Cb -0.03 -3.63 -0.09 0.00 0.01 0.00 0.00 72.50 68.75 1bx7 s THR 10 CO 0.09 0.28 0.99 0.00 -0.69 0.00 0.00 174.62 175.29 1bx7 s SER 12 N -1.32 2.99 0.48 0.00 1.04 -1.26 -4.89 113.70 110.74 1bx7 s SER 12 Ca 0.47 0.71 0.15 0.00 0.48 0.00 0.00 55.95 57.76 1bx7 s SER 12 Cb -0.24 -1.08 1.15 0.00 0.10 0.00 0.00 66.02 65.95 1bx7 s SER 12 CO 0.31 -2.85 2.08 0.00 0.98 0.00 0.00 173.24 173.75 1bx7 h ALA 13 N -1.71 2.01 0.00 5.32 0.00 -1.98 -1.29 119.26 121.61 1bx7 h ALA 13 Ca -0.48 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.42 1bx7 h ALA 13 Cb 1.30 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1bx7 h ALA 13 CO 0.51 -0.06 0.00 0.00 0.00 0.00 0.00 179.25 179.70 1bx7 h ALA 14 N 1.85 1.00 -2.04 0.00 0.00 -1.92 -3.47 119.26 114.68 1bx7 h ALA 14 Ca 0.12 0.00 -0.49 0.00 0.00 0.00 0.00 54.91 54.53 1bx7 h ALA 14 Cb 0.22 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.97 1bx7 h ALA 14 CO -0.02 0.00 -0.48 -0.65 0.00 0.00 0.00 179.25 178.11 1bx7 s GLN 15 N -3.44 2.92 0.07 0.00 -0.21 -0.49 -1.43 119.66 117.08 1bx7 s GLN 15 Ca 0.04 -1.11 0.04 0.00 0.02 0.00 0.00 55.36 54.35 1bx7 s GLN 15 Cb 0.09 -2.58 -0.03 0.00 1.00 0.00 0.00 33.01 31.49 1bx7 s GLN 15 CO 0.52 0.27 -0.12 0.54 -2.12 0.00 0.00 175.29 174.37 1bx7 s VAL 16 N -2.18 0.97 -0.41 1.09 0.11 0.39 -4.72 120.40 115.64 1bx7 s VAL 16 Ca 0.37 -1.30 -0.20 0.00 -2.93 0.00 0.00 61.98 57.92 1bx7 s VAL 16 Cb -0.07 -1.00 0.02 0.00 -1.53 0.00 0.00 36.38 33.79 1bx7 s VAL 16 CO 0.26 -0.30 0.58 0.00 -3.33 0.00 0.00 175.10 172.31 1bx7 s LEU 18 N 2.60 1.81 -1.63 0.00 1.43 -0.25 -4.73 118.68 117.90 1bx7 s LEU 18 Ca 0.20 -0.42 -0.16 0.00 -1.03 0.00 0.00 54.13 52.72 1bx7 s LEU 18 Cb -0.15 -1.09 0.13 0.00 0.03 0.00 0.00 46.19 45.10 1bx7 s LEU 18 CO 0.17 0.07 0.84 0.29 0.23 0.00 0.00 176.35 177.95 1bx7 n LYS 19 N 3.85 -4.04 -1.36 1.70 5.02 -1.26 -1.67 118.16 120.42 1bx7 n LYS 19 Ca -0.20 0.46 -0.08 0.00 -2.02 0.00 0.00 58.31 56.46 1bx7 n LYS 19 Cb 0.52 -5.22 -0.03 0.00 -0.02 0.00 0.00 35.03 30.28 1bx7 n LYS 19 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1bx7 n GLY 20 N -1.53 0.89 3.08 0.72 0.00 -1.26 -5.03 105.19 102.06 1bx7 n GLY 20 Ca 0.04 -0.65 -0.17 0.00 0.00 0.00 0.00 46.02 45.24 1bx7 n GLY 20 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bx7 s LYS 21 N -2.92 0.71 -0.08 1.61 3.01 -0.67 -2.57 119.74 118.83 1bx7 s LYS 21 Ca 0.00 -0.61 -0.30 0.00 -1.01 0.00 0.00 55.97 54.05 1bx7 s LYS 21 Cb 0.00 -0.64 -0.03 0.00 -1.01 0.00 0.00 37.83 36.16 1bx7 s LYS 21 CO 0.00 0.16 1.16 0.00 0.51 0.00 0.00 175.35 177.17 1bx7 s VAL 23 N 2.30 1.00 0.29 0.00 -7.23 -0.47 -4.95 120.40 111.34 1bx7 s VAL 23 Ca 0.54 -1.69 -0.29 0.00 -1.81 0.00 0.00 61.98 58.73 1bx7 s VAL 23 Cb -0.23 -1.42 -0.10 0.00 0.56 0.00 0.00 36.38 35.19 1bx7 s VAL 23 CO 0.20 -0.56 1.40 0.00 -0.31 0.00 0.00 175.10 175.83 1bx7 s ASN 25 N 0.03 1.90 0.71 0.00 3.84 -0.52 -4.75 114.94 116.16 1bx7 s ASN 25 Ca 0.55 1.04 -0.16 0.00 0.21 0.00 0.00 52.86 54.50 1bx7 s ASN 25 Cb -0.42 -1.61 0.03 0.00 -0.55 0.00 0.00 41.25 38.70 1bx7 s ASN 25 CO 0.49 -3.56 1.24 -1.84 -2.79 0.00 0.00 177.10 170.64 1bx7 n GLU 26 N -4.44 0.74 -4.10 0.43 0.28 -1.26 -4.97 120.64 107.31 1bx7 n GLU 26 Ca 0.07 0.32 -0.35 0.00 -0.16 0.00 0.00 57.16 57.04 1bx7 n GLU 26 Cb 0.58 -2.48 -0.12 0.00 1.43 0.00 0.00 31.44 30.84 1bx7 n GLU 26 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 177.13 177.05 1bx7 s VAL 27 N -1.68 3.95 -0.29 3.84 1.01 -1.26 -5.05 120.40 120.92 1bx7 s VAL 27 Ca 0.79 -0.32 -0.04 0.00 0.00 0.00 0.00 61.98 62.42 1bx7 s VAL 27 Cb -0.35 -2.78 0.10 0.00 0.00 0.00 0.00 36.38 33.35 1bx7 s VAL 27 CO 0.45 0.44 0.12 -1.00 0.00 0.00 0.00 175.10 175.11 1bx7 s HIS 28 N 0.93 0.46 -0.07 5.22 3.76 -1.26 -5.12 115.29 119.21 1bx7 s HIS 28 Ca 0.01 -0.94 0.03 0.00 -0.15 0.00 0.00 55.06 54.01 1bx7 s HIS 28 Cb -0.14 -0.97 0.01 0.00 1.11 0.00 0.00 32.58 32.58 1bx7 s HIS 28 CO 0.02 -0.82 -0.16 0.00 -0.85 0.00 0.00 174.74 172.93 1bx7 h ARG 30 N 6.76 0.02 -6.94 0.00 3.08 -1.99 -3.46 114.38 111.84 1bx7 h ARG 30 Ca -0.29 -0.03 -0.55 0.00 0.07 0.00 0.00 59.98 59.18 1bx7 h ARG 30 Cb 1.20 0.01 0.12 0.00 0.08 0.00 0.00 29.97 31.38 1bx7 h ARG 30 CO 0.47 0.80 0.64 0.44 -1.07 0.00 0.00 179.97 181.25 1bx7 n ILE 31 N -3.23 2.80 -3.79 2.04 -5.35 -1.26 -4.99 119.36 105.59 1bx7 n ILE 31 Ca -0.08 -0.50 -0.37 0.00 -0.27 0.00 0.00 62.75 61.53 1bx7 n ILE 31 Cb 0.99 -1.76 -0.13 0.00 -1.74 0.00 0.00 39.64 37.01 1bx7 n ILE 31 CO 0.00 0.00 0.00 -0.13 -1.76 0.00 0.00 176.55 174.66 1bx7 s ARG 32 N -2.41 3.25 -0.04 6.28 3.00 -1.26 -5.04 118.95 122.73 1bx7 s ARG 32 Ca 0.62 -0.74 0.06 0.00 0.00 0.00 0.00 55.73 55.67 1bx7 s ARG 32 Cb -0.46 -3.29 -0.01 0.00 0.00 0.00 0.00 34.95 31.18 1bx7 s ARG 32 CO 0.57 -0.35 -0.23 0.00 0.00 0.00 0.00 175.30 175.30 1bx7 h LYS 34 N 5.85 0.00 -0.04 0.00 3.64 -1.99 -2.20 116.57 121.84 1bx7 h LYS 34 Ca -0.36 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.01 1bx7 h LYS 34 Cb 1.15 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.97 1bx7 h LYS 34 CO 0.47 0.17 -0.13 0.66 -2.27 0.00 0.00 179.45 178.35 1bx7 n TYR 35 N -4.30 0.13 -4.25 1.91 4.01 -1.26 -5.11 117.16 108.28 1bx7 n TYR 35 Ca -0.02 -1.14 0.00 0.00 -0.16 0.00 0.00 57.90 56.57 1bx7 n TYR 35 Cb 0.24 -0.20 0.00 0.00 -0.31 0.00 0.00 39.34 39.06 1bx7 n TYR 35 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1bx7 n GLY 36 N -1.27 -1.71 3.88 2.72 0.00 -0.83 -4.55 105.19 103.43 1bx7 n GLY 36 Ca 0.18 -1.31 -0.30 0.00 0.00 0.00 0.00 46.02 44.59 1bx7 n GLY 36 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1bx7 s LEU 37 N 0.00 3.96 0.21 0.99 1.43 -1.26 -0.53 118.68 123.48 1bx7 s LEU 37 Ca 0.00 1.03 -0.30 0.00 -1.03 0.00 0.00 54.13 53.83 1bx7 s LEU 37 Cb 0.00 -3.87 -0.08 0.00 0.03 0.00 0.00 46.19 42.27 1bx7 s LEU 37 CO 0.00 -0.28 1.09 -0.75 0.23 0.00 0.00 176.35 176.63 1bx7 s LYS 38 N -3.53 4.63 -0.08 1.70 2.20 0.66 -4.25 119.74 121.07 1bx7 s LYS 38 Ca 0.49 1.73 -0.03 0.00 -0.36 0.00 0.00 55.97 57.80 1bx7 s LYS 38 Cb -0.10 -3.25 -0.04 0.00 -1.51 0.00 0.00 37.83 32.93 1bx7 s LYS 38 CO 0.28 0.15 0.07 0.15 -0.36 0.00 0.00 175.35 175.63 1bx7 s LYS 39 N -0.76 3.17 0.48 4.03 1.02 -1.26 -4.33 119.74 122.08 1bx7 s LYS 39 Ca 0.47 -0.32 -0.07 0.00 0.02 0.00 0.00 55.97 56.07 1bx7 s LYS 39 Cb -0.30 -2.95 0.11 0.00 -0.52 0.00 0.00 37.83 34.17 1bx7 s LYS 39 CO 0.37 0.72 0.65 -0.40 -0.92 0.00 0.00 175.35 175.76 1bx7 n ASP 40 N 1.87 0.14 0.00 2.83 5.68 0.32 -4.86 116.55 122.53 1bx7 n ASP 40 Ca -0.18 -1.29 0.08 0.00 -0.50 0.00 0.00 54.79 52.90 1bx7 n ASP 40 Cb 0.54 -0.49 0.35 0.00 -1.14 0.00 0.00 41.12 40.39 1bx7 n ASP 40 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 1bx7 n GLU 41 N -2.35 0.05 0.00 0.11 4.71 -1.26 -1.01 120.64 120.88 1bx7 n GLU 41 Ca 0.08 0.21 0.12 0.00 -0.01 0.00 0.00 57.16 57.56 1bx7 n GLU 41 Cb 0.29 -1.50 0.09 0.00 -1.01 0.00 0.00 31.44 29.31 1bx7 n GLU 41 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 1bx7 n ASN 42 N -1.46 2.86 0.00 1.62 3.02 -1.26 -4.96 115.26 115.08 1bx7 n ASN 42 Ca 0.05 -1.93 0.00 0.00 -0.03 0.00 0.00 54.58 52.67 1bx7 n ASN 42 Cb 0.18 0.07 0.00 0.00 -0.61 0.00 0.00 39.78 39.41 1bx7 n ASN 42 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1bx7 n GLY 43 N 1.36 0.65 3.83 7.41 0.00 -0.18 -4.96 105.19 113.29 1bx7 n GLY 43 Ca 0.13 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.82 1bx7 n GLY 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bx7 n GLU 45 N -0.23 4.55 -3.68 0.00 1.02 -1.26 -0.52 120.64 120.51 1bx7 n GLU 45 Ca 0.04 -4.70 -0.09 0.00 -0.02 0.00 0.00 57.16 52.39 1bx7 n GLU 45 Cb 0.53 -2.41 -0.10 0.00 -0.02 0.00 0.00 31.44 29.44 1bx7 n GLU 45 CO 0.00 0.00 0.00 -0.47 1.18 0.00 0.00 177.13 177.84 1bx7 s TYR 46 N -3.72 -0.72 0.83 -0.32 5.04 -1.26 -4.30 117.35 112.91 1bx7 s TYR 46 Ca 0.40 1.48 -0.11 0.00 -2.44 0.00 0.00 57.07 56.40 1bx7 s TYR 46 Cb 0.18 0.35 0.10 0.00 0.35 0.00 0.00 41.96 42.94 1bx7 s TYR 46 CO -0.08 -0.39 1.14 -2.14 -1.34 0.00 0.00 175.55 172.74 1bx7 s PRO 47 N 1.54 1.61 -0.02 4.97 0.02 -1.26 -4.79 135.00 137.08 1bx7 s PRO 47 Ca -0.09 1.48 -0.30 0.00 0.02 0.00 0.00 61.00 62.11 1bx7 s PRO 47 Cb -0.08 -1.80 -0.06 0.00 0.02 0.00 0.00 34.50 32.58 1bx7 s PRO 47 CO -0.14 -2.18 1.57 0.00 -0.33 0.00 0.00 177.00 175.92 1bx7 s SER 49 N 2.71 -0.12 0.18 0.00 0.15 -1.26 -5.05 113.70 110.31 1bx7 s SER 49 Ca 0.70 -0.12 -0.30 0.00 0.70 0.00 0.00 55.95 56.93 1bx7 s SER 49 Cb -0.34 0.33 -0.08 0.00 -1.71 0.00 0.00 66.02 64.23 1bx7 s SER 49 CO 0.29 -0.55 1.02 0.00 1.20 0.00 0.00 173.24 175.19 1bx7 s ALA 51 N -0.49 2.95 0.35 0.00 0.00 0.31 -4.44 121.76 120.44 1bx7 s ALA 51 Ca 0.46 1.06 0.13 0.00 0.00 0.00 0.00 51.96 53.60 1bx7 s ALA 51 Cb -0.27 -3.44 0.68 0.00 0.00 0.00 0.00 23.12 20.10 1bx7 s ALA 51 CO 0.33 -0.85 1.80 0.87 0.00 0.00 0.00 175.76 177.91 1bx7 h LYS 52 N 1.94 0.00 0.00 0.00 1.57 -1.91 -3.42 116.57 114.74 1bx7 h LYS 52 Ca -0.50 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.28 1bx7 h LYS 52 Cb 1.26 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.57 1bx7 h LYS 52 CO 0.60 0.40 0.00 0.00 -0.57 0.00 0.00 179.45 179.88