#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tus s ALA 2 N 0.00 3.86 -0.28 1.96 0.00 -1.26 -4.98 121.76 121.07 1tus s ALA 2 Ca 0.00 1.49 0.01 0.00 0.00 0.00 0.00 51.96 53.46 1tus s ALA 2 Cb 0.00 -3.67 0.17 0.00 0.00 0.00 0.00 23.12 19.62 1tus s ALA 2 CO 0.00 -0.87 0.46 0.00 0.00 0.00 0.00 175.76 175.35 1tus s ALA 3 N 1.22 -1.55 -0.55 0.00 0.00 -1.26 -5.09 121.76 114.53 1tus s ALA 3 Ca 0.73 0.73 0.07 0.00 0.00 0.00 0.00 51.96 53.49 1tus s ALA 3 Cb -0.47 -2.10 0.26 0.00 0.00 0.00 0.00 23.12 20.81 1tus s ALA 3 CO 0.32 -1.62 0.70 0.28 0.00 0.00 0.00 175.76 175.44 1tus n VAL 4 N 5.38 1.42 -4.01 0.00 0.31 -1.26 -5.05 118.33 115.12 1tus n VAL 4 Ca 0.00 -4.87 -0.10 0.00 -0.01 0.00 0.00 64.34 59.37 1tus n VAL 4 Cb 0.51 -1.94 -0.03 0.00 -0.91 0.00 0.00 33.84 31.47 1tus n VAL 4 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1tus n SER 5 N 0.91 -0.59 -2.11 4.52 3.41 -1.26 -4.77 113.62 113.73 1tus n SER 5 Ca 0.27 -2.17 -0.09 0.00 -0.26 0.00 0.00 58.87 56.62 1tus n SER 5 Cb 0.45 1.21 -0.02 0.00 -0.26 0.00 0.00 64.21 65.59 1tus n SER 5 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 1tus n VAL 6 N -0.35 0.00 -3.05 -3.33 0.24 -1.26 -5.09 118.33 105.48 1tus n VAL 6 Ca 0.02 -1.06 -0.17 0.00 -2.04 0.00 0.00 64.34 61.10 1tus n VAL 6 Cb 0.34 0.61 -0.01 0.00 -1.47 0.00 0.00 33.84 33.31 1tus n VAL 6 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 1tus n ASP 7 N -1.99 -0.36 -2.18 -1.34 8.00 -1.26 -4.98 116.55 112.43 1tus n ASP 7 Ca 0.01 -3.09 -0.26 0.00 0.71 0.00 0.00 54.79 52.16 1tus n ASP 7 Cb 0.32 0.13 0.02 0.00 -0.02 0.00 0.00 41.12 41.57 1tus n ASP 7 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1tus n SER 9 N -0.68 7.63 0.00 0.00 7.64 -1.26 -3.12 113.62 123.83 1tus n SER 9 Ca 0.45 -3.12 0.00 0.00 1.01 0.00 0.00 58.87 57.22 1tus n SER 9 Cb 0.84 -1.39 0.00 0.00 -1.01 0.00 0.00 64.21 62.66 1tus n SER 9 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 1tus n GLU 10 N 2.11 0.00 -0.89 1.43 4.07 -1.26 -5.13 120.64 120.98 1tus n GLU 10 Ca 0.60 0.00 -0.33 0.00 -0.06 0.00 0.00 57.16 57.37 1tus n GLU 10 Cb 0.26 0.00 0.14 0.00 -0.06 0.00 0.00 31.44 31.78 1tus n GLU 10 CO 0.00 0.00 0.00 0.66 -0.06 0.00 0.00 177.13 177.73 1tus n TYR 11 N -0.08 0.53 -2.91 4.31 4.02 -1.18 -4.71 117.16 117.14 1tus n TYR 11 Ca 0.00 0.37 -0.30 0.00 -0.01 0.00 0.00 57.90 57.96 1tus n TYR 11 Cb 0.00 -2.00 -0.03 0.00 -0.02 0.00 0.00 39.34 37.29 1tus n TYR 11 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 176.86 174.60 1tus s PRO 12 N -4.17 3.78 0.44 -0.72 0.04 -1.26 -4.87 135.00 128.23 1tus s PRO 12 Ca 0.68 0.44 -0.05 0.00 0.04 0.00 0.00 61.00 62.11 1tus s PRO 12 Cb -0.26 -2.41 -0.04 0.00 0.04 0.00 0.00 34.50 31.83 1tus s PRO 12 CO 0.57 -0.00 0.73 0.21 0.04 0.00 0.00 177.00 178.55 1tus s LYS 13 N -3.77 3.58 0.40 4.56 2.47 -1.26 -4.99 119.74 120.72 1tus s LYS 13 Ca 0.51 0.16 0.22 0.00 -1.56 0.00 0.00 55.97 55.29 1tus s LYS 13 Cb -0.10 -2.44 0.51 0.00 -1.46 0.00 0.00 37.83 34.34 1tus s LYS 13 CO 0.30 -0.10 1.65 -1.00 0.16 0.00 0.00 175.35 176.37 1tus h PRO 14 N 0.58 0.00 -2.06 4.03 0.14 -2.01 -3.47 132.00 129.21 1tus h PRO 14 Ca -0.47 0.00 0.24 0.00 0.14 0.00 0.00 66.00 65.91 1tus h PRO 14 Cb 1.20 0.00 -0.08 0.00 0.14 0.00 0.00 31.00 32.26 1tus h PRO 14 CO 0.62 0.22 0.67 0.00 0.14 0.00 0.00 178.00 179.65 1tus s ALA 15 N -3.29 -1.92 -0.12 -0.56 0.00 -1.26 -5.19 121.76 109.41 1tus s ALA 15 Ca 0.04 0.21 -0.33 0.00 0.00 0.00 0.00 51.96 51.87 1tus s ALA 15 Cb 0.08 0.60 0.13 0.00 0.00 0.00 0.00 23.12 23.92 1tus s ALA 15 CO 0.67 -1.06 1.09 0.00 0.00 0.00 0.00 175.76 176.46 1tus n THR 17 N -0.14 3.61 0.00 0.00 -2.24 -1.26 -5.08 114.28 109.17 1tus n THR 17 Ca -0.03 -3.52 0.00 0.00 -2.27 0.00 0.00 64.05 58.23 1tus n THR 17 Cb 0.59 -1.19 0.00 0.00 -2.10 0.00 0.00 70.33 67.63 1tus n THR 17 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 1tus n LEU 18 N -0.76 0.00 0.00 3.22 -0.00 -1.26 -4.91 117.00 113.29 1tus n LEU 18 Ca 0.59 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.60 1tus n LEU 18 Cb 0.48 0.11 0.00 0.00 -0.00 0.00 0.00 43.42 44.02 1tus n LEU 18 CO 0.67 -0.11 0.00 1.21 -0.00 0.00 0.00 177.39 179.16 1tus n GLU 19 N -1.29 1.93 -0.09 1.96 2.13 -1.26 -5.05 120.64 118.97 1tus n GLU 19 Ca 0.00 0.00 -0.17 0.00 0.66 0.00 0.00 57.16 57.65 1tus n GLU 19 Cb 0.00 0.00 -0.10 0.00 0.27 0.00 0.00 31.44 31.61 1tus n GLU 19 CO 0.00 0.00 0.00 -0.92 -0.41 0.00 0.00 177.13 175.80 1tus h TYR 20 N -0.91 0.00 -2.27 4.31 3.20 -1.91 -3.40 116.97 115.98 1tus h TYR 20 Ca 0.00 0.00 -0.60 0.00 3.14 0.00 0.00 58.73 61.27 1tus h TYR 20 Cb 0.00 0.00 0.06 0.00 1.54 0.00 0.00 36.73 38.33 1tus h TYR 20 CO 0.00 1.16 0.70 2.89 -1.64 0.00 0.00 178.16 181.27 1tus n ARG 21 N -4.50 1.97 -2.87 1.82 1.85 -1.26 -4.27 116.66 109.40 1tus n ARG 21 Ca -0.24 0.71 -0.22 0.00 -1.00 0.00 0.00 57.85 57.10 1tus n ARG 21 Cb 0.57 -2.43 0.02 0.00 -1.05 0.00 0.00 32.46 29.56 1tus n ARG 21 CO 0.00 0.00 0.00 -1.25 -0.01 0.00 0.00 177.63 176.37 1tus s PRO 22 N 0.56 2.86 0.03 2.89 0.04 -1.26 -4.35 135.00 135.77 1tus s PRO 22 Ca 0.77 -0.64 0.00 0.00 0.04 0.00 0.00 61.00 61.18 1tus s PRO 22 Cb -0.71 -2.55 -0.00 0.00 0.04 0.00 0.00 34.50 31.28 1tus s PRO 22 CO 0.42 -0.43 0.01 1.28 0.04 0.00 0.00 177.00 178.32 1tus n LEU 23 N -2.16 0.00 -3.87 -3.56 4.77 -0.93 -0.56 117.00 110.70 1tus n LEU 23 Ca 0.04 -0.23 -0.26 0.00 -0.03 0.00 0.00 56.01 55.53 1tus n LEU 23 Cb 0.58 0.06 -0.17 0.00 -2.33 0.00 0.00 43.42 41.56 1tus n LEU 23 CO 0.46 -0.03 -0.42 0.00 -1.33 0.00 0.00 177.39 176.06 1tus s GLY 25 N 1.77 1.48 -0.61 0.00 0.00 -0.33 -1.55 107.32 108.07 1tus s GLY 25 Ca 0.05 -0.53 -0.02 0.00 0.00 0.00 0.00 44.72 44.22 1tus s GLY 25 CO -0.07 0.34 2.04 1.44 0.00 0.00 0.00 173.10 176.85 1tus n SER 26 N -5.26 7.48 -0.12 1.64 7.64 -0.31 -4.04 113.62 120.65 1tus n SER 26 Ca 0.08 -3.66 0.02 0.00 1.01 0.00 0.00 58.87 56.32 1tus n SER 26 Cb 0.57 -1.00 0.02 0.00 -1.01 0.00 0.00 64.21 62.80 1tus n SER 26 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 1tus n ASP 27 N -0.66 0.92 -1.55 6.43 5.75 -1.26 -4.81 116.55 121.37 1tus n ASP 27 Ca 0.57 -1.82 -0.11 0.00 -0.01 0.00 0.00 54.79 53.41 1tus n ASP 27 Cb 0.62 -0.11 0.01 0.00 -1.03 0.00 0.00 41.12 40.61 1tus n ASP 27 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 1tus n ASN 28 N -0.37 -3.81 -3.81 -1.12 5.03 -1.26 -5.01 115.26 104.91 1tus n ASN 28 Ca 0.03 -0.11 -0.15 0.00 0.87 0.00 0.00 54.58 55.22 1tus n ASN 28 Cb 0.50 -2.81 -0.16 0.00 -1.02 0.00 0.00 39.78 36.30 1tus n ASN 28 CO 0.00 0.00 0.00 -0.54 -1.83 0.00 0.00 177.26 174.89 1tus s LYS 29 N -4.95 0.09 0.53 3.52 1.02 -1.26 -5.05 119.74 113.63 1tus s LYS 29 Ca 0.11 0.10 -0.17 0.00 0.02 0.00 0.00 55.97 56.03 1tus s LYS 29 Cb -0.05 -0.28 -0.07 0.00 -0.52 0.00 0.00 37.83 36.91 1tus s LYS 29 CO 0.14 -0.11 1.00 0.99 -0.92 0.00 0.00 175.35 176.45 1tus s THR 30 N 0.79 4.36 -0.09 2.17 2.01 -1.26 -1.19 115.64 122.43 1tus s THR 30 Ca -0.07 1.15 0.02 0.00 0.31 0.00 0.00 61.69 63.10 1tus s THR 30 Cb -0.10 -3.64 0.01 0.00 0.01 0.00 0.00 72.50 68.78 1tus s THR 30 CO -0.02 -0.63 -0.13 -0.31 -0.69 0.00 0.00 174.62 172.84 1tus s TYR 31 N -2.56 1.70 -1.08 4.92 2.02 -0.84 -4.85 117.35 116.66 1tus s TYR 31 Ca 0.60 -0.74 0.25 0.00 -0.37 0.00 0.00 57.07 56.81 1tus s TYR 31 Cb -0.11 -1.26 1.10 0.00 -0.40 0.00 0.00 41.96 41.29 1tus s TYR 31 CO 0.31 -0.40 1.81 0.41 -1.57 0.00 0.00 175.55 176.11 1tus n GLY 32 N 4.12 -1.31 3.81 0.71 0.00 -1.26 -2.18 105.19 109.08 1tus n GLY 32 Ca -0.20 -0.09 -0.08 0.00 0.00 0.00 0.00 46.02 45.65 1tus n GLY 32 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1tus s ASN 33 N -2.92 -0.05 0.61 1.61 2.20 -1.26 -4.18 114.94 110.96 1tus s ASN 33 Ca 0.14 -1.00 0.37 0.00 -0.94 0.00 0.00 52.86 51.43 1tus s ASN 33 Cb 0.16 0.81 2.01 0.00 -2.00 0.00 0.00 41.25 42.23 1tus s ASN 33 CO 0.44 -1.58 2.26 0.11 -2.94 0.00 0.00 177.10 175.39 1tus h LYS 34 N 2.01 0.00 -0.01 3.55 1.57 -1.88 -2.06 116.57 119.74 1tus h LYS 34 Ca -0.28 0.00 -0.16 0.00 -1.87 0.00 0.00 60.65 58.34 1tus h LYS 34 Cb 1.25 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.57 1tus h LYS 34 CO 0.36 0.02 -0.63 0.00 -0.57 0.00 0.00 179.45 178.63 1tus h ASN 36 N -0.06 0.00 0.19 0.00 2.35 -1.93 -1.25 115.58 114.88 1tus h ASN 36 Ca -0.08 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.66 1tus h ASN 36 Cb 1.33 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.70 1tus h ASN 36 CO 0.12 0.28 -0.09 0.15 -1.65 0.00 0.00 177.43 176.24 1tus h PHE 37 N 0.00 -0.24 0.00 1.19 3.57 -1.40 -2.47 116.94 117.59 1tus h PHE 37 Ca -0.02 -0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.42 1tus h PHE 37 Cb 1.23 0.08 -0.01 0.00 2.79 0.00 0.00 35.95 40.04 1tus h PHE 37 CO 0.00 -0.15 -0.26 0.00 -2.23 0.00 0.00 178.31 175.68 1tus h ASN 39 N 0.00 0.11 -0.06 0.00 2.35 -1.32 -0.42 115.58 116.25 1tus h ASN 39 Ca -0.00 -0.03 -0.14 0.00 -0.55 0.00 0.00 56.30 55.58 1tus h ASN 39 Cb 0.67 -0.03 -0.01 0.00 0.05 0.00 0.00 38.32 39.00 1tus h ASN 39 CO 0.03 0.38 -0.42 0.00 -1.65 0.00 0.00 177.43 175.78 1tus h ALA 40 N 1.63 0.82 0.28 -0.83 0.00 -0.68 -2.59 119.26 117.89 1tus h ALA 40 Ca 0.02 -0.45 -0.01 0.00 0.00 0.00 0.00 54.91 54.47 1tus h ALA 40 Cb 0.53 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1tus h ALA 40 CO 0.04 0.65 -0.14 0.28 0.00 0.00 0.00 179.25 180.08 1tus h VAL 41 N 0.48 0.75 -0.45 0.00 2.07 -0.80 -1.38 116.25 116.92 1tus h VAL 41 Ca 0.04 -0.54 -0.03 0.00 0.82 0.00 0.00 66.70 67.00 1tus h VAL 41 Cb 0.93 1.04 -0.02 0.00 -1.52 0.00 0.00 31.29 31.71 1tus h VAL 41 CO 0.08 0.11 0.17 -0.37 0.02 0.00 0.00 177.57 177.58 1tus h VAL 42 N -0.67 1.18 -0.62 2.57 -1.51 -1.11 0.29 116.25 116.37 1tus h VAL 42 Ca -0.04 -0.57 -0.03 0.00 -1.23 0.00 0.00 66.70 64.83 1tus h VAL 42 Cb 0.47 0.65 -0.03 0.00 -2.13 0.00 0.00 31.29 30.25 1tus h VAL 42 CO 0.06 0.22 0.28 -0.33 -1.23 0.00 0.00 177.57 176.57 1tus h GLU 43 N 0.65 0.89 0.00 5.19 3.07 -1.47 -2.22 114.58 120.69 1tus h GLU 43 Ca 0.16 -0.12 -0.06 0.00 -0.50 0.00 0.00 59.36 58.84 1tus h GLU 43 Cb 0.15 -0.16 -0.01 0.00 -0.84 0.00 0.00 28.75 27.89 1tus h GLU 43 CO -0.01 0.71 -0.27 0.66 -1.40 0.00 0.00 179.01 178.70 1tus h SER 44 N 0.89 0.00 -2.98 1.42 4.64 0.21 -3.47 113.55 114.25 1tus h SER 44 Ca 0.22 0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 61.31 1tus h SER 44 Cb 0.12 0.00 0.05 0.00 -0.31 0.00 0.00 62.40 62.26 1tus h SER 44 CO -0.02 0.27 -0.35 -3.20 -0.87 0.00 0.00 176.83 172.66 1tus n ASN 45 N -3.41 -4.17 -2.57 4.97 4.05 -0.77 -4.18 115.26 109.18 1tus n ASN 45 Ca 0.00 -0.20 -0.02 0.00 0.45 0.00 0.00 54.58 54.81 1tus n ASN 45 Cb 0.46 -2.96 -0.02 0.00 1.23 0.00 0.00 39.78 38.50 1tus n ASN 45 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1tus n GLY 46 N -1.22 -4.62 0.00 8.20 0.00 -1.17 -4.98 105.19 101.39 1tus n GLY 46 Ca -0.04 0.96 0.00 0.00 0.00 0.00 0.00 46.02 46.94 1tus n GLY 46 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1tus n THR 47 N 1.05 0.00 0.00 2.61 5.66 -1.26 -5.00 114.28 117.34 1tus n THR 47 Ca -0.17 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.83 1tus n THR 47 Cb 0.27 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.05 1tus n THR 47 CO 0.00 0.00 0.00 -0.11 -3.05 0.00 0.00 175.07 171.91 1tus n LEU 48 N -0.63 0.15 -1.34 1.09 7.94 -1.26 -4.93 117.00 118.01 1tus n LEU 48 Ca 0.00 0.32 0.17 0.00 -1.11 0.00 0.00 56.01 55.39 1tus n LEU 48 Cb 0.00 0.00 -0.06 0.00 0.53 0.00 0.00 43.42 43.89 1tus n LEU 48 CO 0.00 0.00 -0.40 0.41 -1.11 0.00 0.00 177.39 176.29 1tus n THR 49 N -0.34 0.00 -3.21 1.96 -1.04 -1.26 -4.06 114.28 106.33 1tus n THR 49 Ca 0.00 0.38 -0.40 0.00 -2.04 0.00 0.00 64.05 61.99 1tus n THR 49 Cb 0.00 -0.83 -0.07 0.00 -1.82 0.00 0.00 70.33 67.61 1tus n THR 49 CO 0.00 0.00 0.00 -0.22 -0.64 0.00 0.00 175.07 174.21 1tus s LEU 50 N -7.03 4.06 0.17 -4.42 2.96 -1.26 -1.16 118.68 112.00 1tus s LEU 50 Ca 0.00 0.56 -0.11 0.00 -0.22 0.00 0.00 54.13 54.36 1tus s LEU 50 Cb 0.00 -2.70 0.07 0.00 0.50 0.00 0.00 46.19 44.06 1tus s LEU 50 CO 0.00 -0.29 1.70 -1.28 -1.32 0.00 0.00 176.35 175.15 1tus h SER 51 N 7.96 0.89 0.00 3.68 0.87 -1.48 -3.47 113.55 122.01 1tus h SER 51 Ca -0.29 -0.22 0.00 0.00 -1.23 0.00 0.00 61.79 60.06 1tus h SER 51 Cb 1.14 -0.23 0.00 0.00 -0.44 0.00 0.00 62.40 62.87 1tus h SER 51 CO 0.73 0.87 0.00 0.00 -0.53 0.00 0.00 176.83 177.90 1tus n HIS 52 N -4.38 0.00 -1.02 2.24 -0.00 -1.18 -5.03 115.22 105.84 1tus n HIS 52 Ca 0.03 0.00 -0.28 0.00 -0.00 0.00 0.00 57.72 57.47 1tus n HIS 52 Cb 0.22 0.00 0.20 0.00 -0.00 0.00 0.00 29.99 30.41 1tus n HIS 52 CO 0.00 0.00 0.00 -0.06 -0.00 0.00 0.00 176.34 176.28 1tus s PHE 53 N -1.62 1.88 0.25 -1.40 0.40 -1.26 -1.23 117.98 115.01 1tus s PHE 53 Ca 0.00 0.99 0.00 0.00 -0.60 0.00 0.00 56.93 57.32 1tus s PHE 53 Cb 0.00 -3.23 0.00 0.00 0.51 0.00 0.00 43.02 40.30 1tus s PHE 53 CO 0.00 -3.20 0.00 0.41 0.70 0.00 0.00 175.22 173.13 1tus n GLY 54 N -0.64 -2.28 3.38 4.36 0.00 0.27 -4.60 105.19 105.68 1tus n GLY 54 Ca 0.04 -1.29 -0.30 0.00 0.00 0.00 0.00 46.02 44.47 1tus n GLY 54 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1tus s LYS 55 N -2.61 -2.26 0.00 1.61 1.02 -1.24 -2.48 119.74 113.78 1tus s LYS 55 Ca 0.00 0.28 0.32 0.00 0.02 0.00 0.00 55.97 56.59 1tus s LYS 55 Cb 0.00 -1.44 1.91 0.00 -0.52 0.00 0.00 37.83 37.78 1tus s LYS 55 CO 0.00 -4.47 2.23 0.00 -0.92 0.00 0.00 175.35 172.19