#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 0.35 -0.93 1.47 0.00 -1.26 -4.96 121.76 116.44 1tus s ALA 2 Ca 0.00 -0.25 -0.01 0.00 0.00 0.00 0.00 51.96 51.70 1tus s ALA 2 Cb 0.00 -3.18 0.26 0.00 0.00 0.00 0.00 23.12 20.21 1tus s ALA 2 CO 0.00 -3.27 1.05 0.00 0.00 0.00 0.00 175.76 173.54 1tus n ALA 3 N -4.49 4.38 -2.17 0.00 0.00 -1.26 -4.69 120.51 112.28 1tus n ALA 3 Ca 0.04 -4.72 -0.20 0.00 0.00 0.00 0.00 53.44 48.56 1tus n ALA 3 Cb 0.56 -1.82 -0.03 0.00 0.00 0.00 0.00 19.45 18.16 1tus n ALA 3 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 1tus n VAL 4 N 1.67 -0.68 -3.74 0.00 3.14 -1.26 -4.92 118.33 112.54 1tus n VAL 4 Ca 0.25 0.00 -0.25 0.00 -2.96 0.00 0.00 64.34 61.38 1tus n VAL 4 Cb 0.37 -2.58 0.01 0.00 -1.06 0.00 0.00 33.84 30.57 1tus n VAL 4 CO 0.00 0.00 0.00 -0.94 -6.46 0.00 0.00 176.83 169.43 1tus s SER 5 N -2.23 4.69 0.01 6.55 1.04 -1.26 -4.85 113.70 117.64 1tus s SER 5 Ca 0.00 -1.22 0.00 0.00 0.48 0.00 0.00 55.95 55.22 1tus s SER 5 Cb 0.00 0.49 -0.01 0.00 0.10 0.00 0.00 66.02 66.60 1tus s SER 5 CO 0.00 -1.20 -0.03 -0.69 0.98 0.00 0.00 173.24 172.31 1tus s VAL 6 N -2.78 0.13 -0.36 5.02 1.01 -1.26 -4.97 120.40 117.18 1tus s VAL 6 Ca 0.38 -0.53 0.00 0.00 0.00 0.00 0.00 61.98 61.83 1tus s VAL 6 Cb -0.03 -0.21 0.12 0.00 0.00 0.00 0.00 36.38 36.26 1tus s VAL 6 CO 0.24 -0.25 0.17 -1.81 0.00 0.00 0.00 175.10 173.44 1tus s ASP 7 N -0.82 3.73 -0.17 3.32 1.01 -1.26 -4.98 116.67 117.50 1tus s ASP 7 Ca -0.08 -2.08 0.19 0.00 0.71 0.00 0.00 52.55 51.29 1tus s ASP 7 Cb -0.06 -0.85 0.46 0.00 1.01 0.00 0.00 42.92 43.48 1tus s ASP 7 CO -0.00 -0.34 1.16 0.00 0.21 0.00 0.00 175.17 176.19 1tus n SER 9 N -0.35 7.77 0.00 0.00 2.88 -1.26 -3.12 113.62 119.53 1tus n SER 9 Ca 0.15 -2.99 0.00 0.00 -1.33 0.00 0.00 58.87 54.70 1tus n SER 9 Cb 0.92 -1.43 0.00 0.00 -0.75 0.00 0.00 64.21 62.95 1tus n SER 9 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 1tus n GLU 10 N 2.55 0.00 -0.69 -1.46 0.00 -1.26 -5.12 120.64 114.65 1tus n GLU 10 Ca 0.64 0.00 -0.31 0.00 0.00 0.00 0.00 57.16 57.48 1tus n GLU 10 Cb 0.26 0.00 0.16 0.00 0.00 0.00 0.00 31.44 31.86 1tus n GLU 10 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 1tus n TYR 11 N -0.08 0.11 -2.53 4.31 4.02 -1.18 -4.77 117.16 117.03 1tus n TYR 11 Ca 0.00 0.32 -0.25 0.00 -0.01 0.00 0.00 57.90 57.96 1tus n TYR 11 Cb 0.00 -1.92 0.03 0.00 -0.02 0.00 0.00 39.34 37.43 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 -4.35 2.90 -0.32 -0.72 0.04 -1.26 -4.88 135.00 126.40 1tus s PRO 12 Ca 0.64 -0.17 -0.02 0.00 0.04 0.00 0.00 61.00 61.50 1tus s PRO 12 Cb -0.22 -2.34 0.11 0.00 0.04 0.00 0.00 34.50 32.08 1tus s PRO 12 CO 0.61 -0.63 0.15 0.15 0.04 0.00 0.00 177.00 177.32 1tus s LYS 13 N -4.89 0.55 0.66 4.56 1.02 -1.26 -4.96 119.74 115.40 1tus s LYS 13 Ca 0.53 -1.01 0.27 0.00 0.02 0.00 0.00 55.97 55.78 1tus s LYS 13 Cb -0.10 -1.59 1.45 0.00 -0.52 0.00 0.00 37.83 37.07 1tus s LYS 13 CO 0.43 -1.06 1.83 -1.35 -0.92 0.00 0.00 175.35 174.28 1tus h PRO 14 N 7.87 0.00 -5.91 -1.68 0.10 -2.00 -3.10 132.00 127.28 1tus h PRO 14 Ca -0.11 0.00 -0.49 0.00 0.10 0.00 0.00 66.00 65.50 1tus h PRO 14 Cb 1.00 0.00 -0.08 0.00 0.10 0.00 0.00 31.00 32.02 1tus h PRO 14 CO 0.42 0.00 1.31 0.00 0.10 0.00 0.00 178.00 179.84 1tus s ALA 15 N -4.16 2.39 0.12 -0.75 0.00 -1.26 -4.91 121.76 113.18 1tus s ALA 15 Ca -0.03 -2.10 0.01 0.00 0.00 0.00 0.00 51.96 49.84 1tus s ALA 15 Cb 0.09 -4.56 0.01 0.00 0.00 0.00 0.00 23.12 18.65 1tus s ALA 15 CO 0.29 -4.08 0.06 0.00 0.00 0.00 0.00 175.76 172.02 1tus n THR 17 N -0.60 0.94 0.14 0.00 -1.04 -1.26 -5.02 114.28 107.44 1tus n THR 17 Ca -0.02 -1.19 0.00 0.00 -2.04 0.00 0.00 64.05 60.80 1tus n THR 17 Cb 0.14 0.16 0.00 0.00 -1.82 0.00 0.00 70.33 68.81 1tus n THR 17 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1tus n LEU 18 N -0.67 -2.51 0.00 -4.42 4.77 -1.26 -4.79 117.00 108.12 1tus n LEU 18 Ca 0.08 0.74 0.00 0.00 -0.03 0.00 0.00 56.01 56.80 1tus n LEU 18 Cb 0.69 2.53 0.00 0.00 -2.33 0.00 0.00 43.42 44.31 1tus n LEU 18 CO 0.00 0.18 0.00 -1.84 -1.33 0.00 0.00 177.39 174.40 1tus n GLU 19 N -3.24 1.52 -3.44 3.23 0.00 -1.26 -5.09 120.64 112.36 1tus n GLU 19 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 57.16 56.81 1tus n GLU 19 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 31.44 31.38 1tus n GLU 19 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.13 176.66 1tus s TYR 20 N 0.00 3.62 0.00 -1.84 6.14 -1.26 -4.59 117.35 119.41 1tus s TYR 20 Ca 0.00 0.97 0.00 0.00 0.64 0.00 0.00 57.07 58.68 1tus s TYR 20 Cb 0.00 -2.30 0.00 0.00 0.42 0.00 0.00 41.96 40.08 1tus s TYR 20 CO 0.00 0.48 0.00 2.89 0.64 0.00 0.00 175.55 179.56 1tus n ARG 21 N 0.95 0.00 -3.05 4.97 1.85 -0.91 -5.01 116.66 115.46 1tus n ARG 21 Ca -0.07 0.00 -0.39 0.00 -1.00 0.00 0.00 57.85 56.39 1tus n ARG 21 Cb 0.52 0.00 -0.06 0.00 -1.05 0.00 0.00 32.46 31.87 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 -0.19 4.47 0.00 2.89 0.04 -1.20 -3.84 135.00 137.17 1tus s PRO 22 Ca 0.00 1.04 0.00 0.00 0.04 0.00 0.00 61.00 62.08 1tus s PRO 22 Cb 0.00 -3.27 0.00 0.00 0.04 0.00 0.00 34.50 31.27 1tus s PRO 22 CO 0.00 0.55 0.00 1.28 0.04 0.00 0.00 177.00 178.87 1tus n LEU 23 N 1.80 0.00 -4.12 -3.56 4.32 -0.94 -1.62 117.00 112.87 1tus n LEU 23 Ca -0.06 0.00 -0.33 0.00 -0.02 0.00 0.00 56.01 55.60 1tus n LEU 23 Cb 0.49 0.00 -0.16 0.00 -1.62 0.00 0.00 43.42 42.14 1tus n LEU 23 CO 0.45 -0.06 -0.52 0.00 -1.22 0.00 0.00 177.39 176.04 1tus s GLY 25 N 1.27 2.61 -0.56 0.00 0.00 -0.83 -1.80 107.32 108.01 1tus s GLY 25 Ca 0.03 0.12 -0.02 0.00 0.00 0.00 0.00 44.72 44.85 1tus s GLY 25 CO -0.12 0.48 2.04 -1.26 0.00 0.00 0.00 173.10 174.24 1tus n SER 26 N 0.83 7.33 -0.13 1.64 2.88 -0.44 -3.66 113.62 122.07 1tus n SER 26 Ca -0.03 -3.56 -0.25 0.00 -1.33 0.00 0.00 58.87 53.70 1tus n SER 26 Cb 0.51 -1.01 -0.11 0.00 -0.75 0.00 0.00 64.21 62.86 1tus n SER 26 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 1tus n ASP 27 N -0.52 1.97 0.00 -3.46 5.75 -1.26 -4.74 116.55 114.28 1tus n ASP 27 Ca 0.53 0.14 0.00 0.00 -0.01 0.00 0.00 54.79 55.45 1tus n ASP 27 Cb 0.63 -0.66 0.00 0.00 -1.03 0.00 0.00 41.12 40.06 1tus n ASP 27 CO 0.00 0.00 0.00 -0.46 -0.11 0.00 0.00 177.20 176.63 1tus n ASN 28 N -3.84 0.00 -4.43 -1.12 0.23 -1.25 -5.17 115.26 99.68 1tus n ASN 28 Ca -0.50 0.00 -0.27 0.00 -0.53 0.00 0.00 54.58 53.28 1tus n ASN 28 Cb 0.93 0.00 -0.12 0.00 -2.08 0.00 0.00 39.78 38.51 1tus n ASN 28 CO 0.00 0.00 0.00 -1.59 -0.93 0.00 0.00 177.26 174.74 1tus s LYS 29 N -0.26 1.56 0.41 -3.83 -2.85 -1.24 -5.05 119.74 108.48 1tus s LYS 29 Ca 0.00 -1.52 -0.23 0.00 -1.00 0.00 0.00 55.97 53.22 1tus s LYS 29 Cb 0.00 -1.86 -0.09 0.00 -2.06 0.00 0.00 37.83 33.82 1tus s LYS 29 CO 0.00 0.40 1.04 0.99 0.10 0.00 0.00 175.35 177.88 1tus s THR 30 N -1.70 3.80 -0.15 3.79 2.01 -1.26 -1.96 115.64 120.17 1tus s THR 30 Ca 0.21 1.32 -0.00 0.00 0.31 0.00 0.00 61.69 63.53 1tus s THR 30 Cb -0.08 -3.65 -0.01 0.00 0.01 0.00 0.00 72.50 68.77 1tus s THR 30 CO 0.10 -0.05 -0.13 -0.31 -0.69 0.00 0.00 174.62 173.55 1tus s TYR 31 N -1.74 2.82 0.12 4.92 2.02 -0.88 -4.82 117.35 119.78 1tus s TYR 31 Ca 0.59 -0.81 -0.19 0.00 -0.37 0.00 0.00 57.07 56.29 1tus s TYR 31 Cb -0.20 -1.89 -0.06 0.00 -0.40 0.00 0.00 41.96 39.42 1tus s TYR 31 CO 0.25 -0.34 1.72 0.78 -1.57 0.00 0.00 175.55 176.39 1tus h GLY 32 N 7.06 0.37 -2.34 0.71 0.00 -1.88 -2.51 103.07 104.48 1tus h GLY 32 Ca -0.30 -0.17 -0.33 0.00 0.00 0.00 0.00 47.33 46.54 1tus h GLY 32 CO 0.57 0.16 -0.59 0.54 0.00 0.00 0.00 176.54 177.21 1tus s ASN 33 N -5.53 0.86 0.37 0.19 4.22 -1.25 -2.14 114.94 111.66 1tus s ASN 33 Ca -0.13 -1.46 0.17 0.00 -2.14 0.00 0.00 52.86 49.30 1tus s ASN 33 Cb 0.08 0.34 0.70 0.00 1.28 0.00 0.00 41.25 43.65 1tus s ASN 33 CO 0.71 -0.84 1.76 0.50 -2.04 0.00 0.00 177.10 177.18 1tus h LYS 34 N 2.43 0.00 0.00 3.55 3.64 -1.81 0.19 116.57 124.57 1tus h LYS 34 Ca -0.35 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.02 1tus h LYS 34 Cb 1.25 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 33.07 1tus h LYS 34 CO 0.53 0.40 -0.04 0.00 -2.27 0.00 0.00 179.45 178.07 1tus n ASN 36 N -3.14 0.53 0.47 0.00 5.03 -0.82 -3.51 115.26 113.83 1tus n ASN 36 Ca 0.02 0.00 -0.19 0.00 0.87 0.00 0.00 54.58 55.28 1tus n ASN 36 Cb 0.40 1.69 -0.09 0.00 -1.02 0.00 0.00 39.78 40.76 1tus n ASN 36 CO 0.00 0.00 0.00 0.15 -1.83 0.00 0.00 177.26 175.58 1tus h PHE 37 N 0.00 -1.12 0.00 3.10 3.57 -0.74 -2.01 116.94 119.74 1tus h PHE 37 Ca -0.10 -0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.37 1tus h PHE 37 Cb 1.15 0.37 -0.00 0.00 2.79 0.00 0.00 35.95 40.26 1tus h PHE 37 CO 0.00 -0.70 -0.01 0.00 -2.23 0.00 0.00 178.31 175.37 1tus h ASN 39 N 0.00 0.12 0.08 0.00 -0.26 -1.59 -0.88 115.58 113.05 1tus h ASN 39 Ca -0.00 -0.08 -0.01 0.00 -0.56 0.00 0.00 56.30 55.64 1tus h ASN 39 Cb 0.02 -0.04 -0.00 0.00 -1.06 0.00 0.00 38.32 37.24 1tus h ASN 39 CO 0.00 0.80 -0.06 0.00 -1.06 0.00 0.00 177.43 177.11 1tus h ALA 40 N 1.20 1.76 0.05 -0.83 0.00 -0.19 -0.92 119.26 120.34 1tus h ALA 40 Ca -0.02 -0.05 -0.25 0.00 0.00 0.00 0.00 54.91 54.59 1tus h ALA 40 Cb 1.27 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.03 1tus h ALA 40 CO 0.10 0.07 -1.35 0.28 0.00 0.00 0.00 179.25 178.35 1tus h VAL 41 N 0.00 0.94 -0.47 0.00 2.07 -0.87 -2.73 116.25 115.18 1tus h VAL 41 Ca -0.00 -2.27 -0.02 0.00 0.82 0.00 0.00 66.70 65.23 1tus h VAL 41 Cb 0.11 2.46 -0.02 0.00 -1.52 0.00 0.00 31.29 32.32 1tus h VAL 41 CO 0.01 0.53 0.20 -0.37 0.02 0.00 0.00 177.57 177.96 1tus h VAL 42 N -0.64 1.17 -0.28 2.57 -1.51 -1.16 -1.89 116.25 114.52 1tus h VAL 42 Ca -0.33 -0.52 -0.02 0.00 -1.23 0.00 0.00 66.70 64.60 1tus h VAL 42 Cb 1.53 0.60 -0.01 0.00 -2.13 0.00 0.00 31.29 31.27 1tus h VAL 42 CO -0.08 0.21 0.11 -0.33 -1.23 0.00 0.00 177.57 176.25 1tus h GLU 43 N 0.67 0.41 0.00 5.19 3.07 -1.27 -2.29 114.58 120.36 1tus h GLU 43 Ca 0.16 -0.07 0.00 0.00 -0.50 0.00 0.00 59.36 58.95 1tus h GLU 43 Cb 0.12 -0.07 0.00 0.00 -0.84 0.00 0.00 28.75 27.96 1tus h GLU 43 CO -0.02 0.43 0.00 -1.13 -1.40 0.00 0.00 179.01 176.90 1tus n SER 44 N -4.76 0.02 -0.52 1.42 3.41 -0.76 -4.89 113.62 107.53 1tus n SER 44 Ca -0.02 0.50 -0.05 0.00 -0.26 0.00 0.00 58.87 59.04 1tus n SER 44 Cb 0.13 -0.51 -0.01 0.00 -0.26 0.00 0.00 64.21 63.56 1tus n SER 44 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1tus n ASN 45 N -1.52 -2.52 -0.17 4.04 4.05 -0.86 -4.29 115.26 113.99 1tus n ASN 45 Ca 0.06 0.03 0.00 0.00 0.45 0.00 0.00 54.58 55.11 1tus n ASN 45 Cb 0.29 -1.54 0.00 0.00 1.23 0.00 0.00 39.78 39.75 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 -1.35 0.97 0.00 8.20 0.00 -1.16 -5.01 105.19 106.85 1tus n GLY 46 Ca -0.06 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.79 0.00 -2.75 2.61 5.66 -1.26 -5.03 114.28 112.72 1tus n THR 47 Ca 0.00 0.00 -0.34 0.00 -3.05 0.00 0.00 64.05 60.66 1tus n THR 47 Cb 0.16 -0.42 -0.06 0.00 -1.55 0.00 0.00 70.33 68.46 1tus n THR 47 CO 0.00 0.00 0.00 -0.22 -3.05 0.00 0.00 175.07 171.80 1tus s LEU 48 N -3.99 4.02 0.24 1.09 0.20 -1.26 -5.04 118.68 113.94 1tus s LEU 48 Ca 0.00 1.78 -0.19 0.00 0.69 0.00 0.00 54.13 56.41 1tus s LEU 48 Cb 0.00 -4.41 0.02 0.00 -0.43 0.00 0.00 46.19 41.37 1tus s LEU 48 CO 0.00 -0.37 0.61 -0.89 -0.29 0.00 0.00 176.35 175.41 1tus s THR 49 N -2.00 0.01 0.08 3.68 2.01 -1.26 -4.84 115.64 113.31 1tus s THR 49 Ca 0.60 -0.95 -0.30 0.00 0.31 0.00 0.00 61.69 61.34 1tus s THR 49 Cb -0.13 -1.86 -0.06 0.00 0.01 0.00 0.00 72.50 70.47 1tus s THR 49 CO 0.17 -0.03 1.17 -0.22 -0.69 0.00 0.00 174.62 175.02 1tus s LEU 50 N -2.92 4.39 -0.01 4.42 2.96 -1.26 -1.33 118.68 124.93 1tus s LEU 50 Ca 0.12 2.01 -0.06 0.00 -0.22 0.00 0.00 54.13 55.98 1tus s LEU 50 Cb -0.03 -3.58 -0.29 0.00 0.50 0.00 0.00 46.19 42.79 1tus s LEU 50 CO 0.03 -0.42 0.79 -1.28 -1.32 0.00 0.00 176.35 174.15 1tus h SER 51 N 6.52 0.48 0.00 3.68 0.87 -1.66 -3.47 113.55 119.97 1tus h SER 51 Ca -0.42 -0.68 0.00 0.00 -1.23 0.00 0.00 61.79 59.46 1tus h SER 51 Cb 1.21 -0.16 0.00 0.00 -0.44 0.00 0.00 62.40 63.02 1tus h SER 51 CO 0.79 1.57 0.00 0.00 -0.53 0.00 0.00 176.83 178.66 1tus n HIS 52 N -3.50 0.00 -1.76 2.24 -0.00 -1.22 -5.04 115.22 105.93 1tus n HIS 52 Ca -0.19 0.00 -0.30 0.00 -0.00 0.00 0.00 57.72 57.23 1tus n HIS 52 Cb 1.06 0.00 0.07 0.00 -0.00 0.00 0.00 29.99 31.12 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 -2.00 3.04 0.28 -1.40 0.40 -1.26 -1.55 117.98 115.49 1tus s PHE 53 Ca 0.00 1.00 0.00 0.00 -0.60 0.00 0.00 56.93 57.33 1tus s PHE 53 Cb 0.00 -3.19 0.00 0.00 0.51 0.00 0.00 43.02 40.34 1tus s PHE 53 CO 0.00 -1.56 0.00 0.41 0.70 0.00 0.00 175.22 174.77 1tus n GLY 54 N -2.74 -1.90 2.07 4.36 0.00 -0.64 -4.66 105.19 101.67 1tus n GLY 54 Ca 0.07 -1.19 -0.17 0.00 0.00 0.00 0.00 46.02 44.73 1tus n GLY 54 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1tus n LYS 55 N -3.73 -1.84 0.00 1.61 2.85 -1.20 -2.54 118.16 113.32 1tus n LYS 55 Ca 0.01 -1.05 0.13 0.00 -1.05 0.00 0.00 58.31 56.34 1tus n LYS 55 Cb 0.55 -0.90 0.27 0.00 -0.65 0.00 0.00 35.03 34.30 1tus n LYS 55 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35