#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ql0 s LYS 2 N 0.00 1.27 0.05 3.17 -2.85 -1.26 -5.16 119.74 114.97 2ql0 s LYS 2 Ca 0.00 -1.45 -0.02 0.00 -1.00 0.00 0.00 55.97 53.50 2ql0 s LYS 2 Cb 0.00 -1.24 -0.03 0.00 -2.06 0.00 0.00 37.83 34.50 2ql0 s LYS 2 CO 0.00 0.24 0.01 0.21 0.10 0.00 0.00 175.35 175.91 2ql0 s LYS 3 N -3.02 0.61 0.19 1.78 2.20 -1.26 -4.94 119.74 115.30 2ql0 s LYS 3 Ca 0.17 -1.08 0.03 0.00 -0.36 0.00 0.00 55.97 54.74 2ql0 s LYS 3 Cb -0.04 0.22 -0.05 0.00 -1.51 0.00 0.00 37.83 36.45 2ql0 s LYS 3 CO 0.06 -0.13 -0.03 0.71 -0.36 0.00 0.00 175.35 175.61 2ql0 s TYR 4 N -3.54 1.40 0.00 4.03 1.51 -1.26 -3.19 117.35 116.30 2ql0 s TYR 4 Ca 0.03 -0.90 -0.04 0.00 -1.01 0.00 0.00 57.07 55.16 2ql0 s TYR 4 Cb 0.05 -0.78 -0.00 0.00 -0.11 0.00 0.00 41.96 41.11 2ql0 s TYR 4 CO -0.09 -0.04 0.07 0.54 -1.11 0.00 0.00 175.55 174.92 2ql0 s VAL 5 N -3.45 0.07 -0.23 0.71 0.11 -0.83 -2.13 120.40 114.65 2ql0 s VAL 5 Ca 0.24 -0.61 -0.26 0.00 -2.93 0.00 0.00 61.98 58.42 2ql0 s VAL 5 Cb 0.05 -0.30 -0.00 0.00 -1.53 0.00 0.00 36.38 34.60 2ql0 s VAL 5 CO 0.05 -0.33 0.91 0.00 -3.33 0.00 0.00 175.10 172.40 2ql0 n THR 7 N 5.25 0.15 -0.12 0.00 -2.24 -1.23 -0.36 114.28 115.73 2ql0 n THR 7 Ca 0.08 -0.18 -0.24 0.00 -2.27 0.00 0.00 64.05 61.44 2ql0 n THR 7 Cb 0.47 0.05 -0.11 0.00 -2.10 0.00 0.00 70.33 68.65 2ql0 n THR 7 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2ql0 n VAL 8 N -0.17 1.53 -0.08 2.28 0.31 -1.26 -4.77 118.33 116.16 2ql0 n VAL 8 Ca 0.09 -0.16 -0.17 0.00 -0.01 0.00 0.00 64.34 64.09 2ql0 n VAL 8 Cb 0.14 -1.99 -0.06 0.00 -0.91 0.00 0.00 33.84 31.02 2ql0 n VAL 8 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2ql0 n GLY 10 N 2.04 0.68 3.70 0.00 0.00 0.51 -5.06 105.19 107.06 2ql0 n GLY 10 Ca -0.33 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.27 2ql0 n GLY 10 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2ql0 s TYR 11 N -1.66 3.06 -0.15 1.61 5.04 -1.25 -4.60 117.35 119.40 2ql0 s TYR 11 Ca 0.00 0.92 -0.22 0.00 -2.44 0.00 0.00 57.07 55.33 2ql0 s TYR 11 Cb 0.00 -3.64 -0.03 0.00 0.35 0.00 0.00 41.96 38.64 2ql0 s TYR 11 CO 0.00 -2.29 0.68 -1.83 -1.34 0.00 0.00 175.55 170.77 2ql0 s GLU 12 N 1.79 4.30 0.05 4.97 -1.05 -1.26 -1.13 118.70 126.37 2ql0 s GLU 12 Ca 0.63 0.76 -0.29 0.00 -0.15 0.00 0.00 54.97 55.93 2ql0 s GLU 12 Cb -0.33 -3.53 -0.05 0.00 -0.44 0.00 0.00 34.13 29.78 2ql0 s GLU 12 CO 0.28 -0.14 0.92 -0.47 0.95 0.00 0.00 175.26 176.79 2ql0 s TYR 13 N 1.55 3.74 -0.42 4.83 5.04 -0.91 -4.99 117.35 126.18 2ql0 s TYR 13 Ca 0.33 1.68 -0.04 0.00 -2.44 0.00 0.00 57.07 56.59 2ql0 s TYR 13 Cb -0.16 -3.02 0.11 0.00 0.35 0.00 0.00 41.96 39.24 2ql0 s TYR 13 CO 0.13 0.14 0.24 0.34 -1.34 0.00 0.00 175.55 175.06 2ql0 s ASP 14 N 0.36 5.36 0.00 4.32 2.15 -1.26 -4.26 116.67 123.34 2ql0 s ASP 14 Ca 0.46 -2.01 0.23 0.00 0.43 0.00 0.00 52.55 51.66 2ql0 s ASP 14 Cb -0.22 -1.87 1.24 0.00 -0.30 0.00 0.00 42.92 41.78 2ql0 s ASP 14 CO 0.27 -0.58 1.76 -0.81 -0.17 0.00 0.00 175.17 175.64 2ql0 n PRO 15 N 4.66 0.47 0.16 4.34 -0.04 -1.26 -2.34 135.00 140.99 2ql0 n PRO 15 Ca -0.03 0.05 0.13 0.00 -0.04 0.00 0.00 63.50 63.60 2ql0 n PRO 15 Cb 0.41 -1.50 0.35 0.00 -0.04 0.00 0.00 33.50 32.72 2ql0 n PRO 15 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2ql0 h ALA 16 N 3.22 1.00 0.00 0.55 0.00 -1.91 -2.26 119.26 119.86 2ql0 h ALA 16 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2ql0 h ALA 16 Cb 0.14 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.93 2ql0 h ALA 16 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 179.25 178.40 2ql0 n GLU 17 N -2.62 -0.03 0.00 0.00 0.28 -0.99 -4.06 120.64 113.23 2ql0 n GLU 17 Ca 0.04 -0.65 0.00 0.00 -0.16 0.00 0.00 57.16 56.39 2ql0 n GLU 17 Cb 0.44 -0.93 0.00 0.00 1.43 0.00 0.00 31.44 32.38 2ql0 n GLU 17 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2ql0 n GLY 18 N -0.10 3.68 3.15 -1.84 0.00 -1.05 -4.32 105.19 104.70 2ql0 n GLY 18 Ca 0.00 -0.04 0.05 0.00 0.00 0.00 0.00 46.02 46.02 2ql0 n GLY 18 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2ql0 s ASP 19 N -4.00 -1.05 0.00 1.61 -0.00 -1.26 -4.66 116.67 107.31 2ql0 s ASP 19 Ca 0.00 0.12 0.22 0.00 -0.00 0.00 0.00 52.55 52.89 2ql0 s ASP 19 Cb 0.00 1.67 1.01 0.00 -0.00 0.00 0.00 42.92 45.60 2ql0 s ASP 19 CO 0.00 -0.19 1.71 -0.81 -0.00 0.00 0.00 175.17 175.88 2ql0 n PRO 20 N 5.26 0.12 0.03 8.23 -0.04 -1.26 -2.42 135.00 144.92 2ql0 n PRO 20 Ca 0.07 0.11 -0.06 0.00 -0.04 0.00 0.00 63.50 63.58 2ql0 n PRO 20 Cb 0.56 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.41 2ql0 n PRO 20 CO 0.00 0.00 0.00 0.22 -0.04 0.00 0.00 175.50 175.68 2ql0 h ASP 21 N 0.00 0.00 -4.37 3.54 3.58 -1.94 -3.47 116.42 113.75 2ql0 h ASP 21 Ca 0.00 0.00 -0.40 0.00 0.42 0.00 0.00 57.03 57.05 2ql0 h ASP 21 Cb 0.31 0.00 -0.07 0.00 1.72 0.00 0.00 39.33 41.29 2ql0 h ASP 21 CO 0.00 0.90 -0.28 0.59 -2.88 0.00 0.00 179.24 177.58 2ql0 n ASN 22 N -3.16 2.74 -3.92 2.28 3.02 -1.02 -5.03 115.26 110.18 2ql0 n ASN 22 Ca -0.08 -2.34 -0.42 0.00 -0.03 0.00 0.00 54.58 51.71 2ql0 n ASN 22 Cb 0.95 0.18 -0.00 0.00 -0.61 0.00 0.00 39.78 40.30 2ql0 n ASN 22 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2ql0 n GLY 23 N 1.19 3.99 2.98 7.41 0.00 -1.26 -4.81 105.19 114.69 2ql0 n GLY 23 Ca -0.11 -1.56 -0.09 0.00 0.00 0.00 0.00 46.02 44.26 2ql0 n GLY 23 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ql0 s VAL 24 N 3.46 0.12 0.24 1.61 1.01 -1.20 -5.04 120.40 120.60 2ql0 s VAL 24 Ca 0.49 -0.86 -0.00 0.00 0.00 0.00 0.00 61.98 61.61 2ql0 s VAL 24 Cb 0.12 -0.26 -0.04 0.00 0.00 0.00 0.00 36.38 36.20 2ql0 s VAL 24 CO -0.05 -0.46 0.42 -0.54 0.00 0.00 0.00 175.10 174.47 2ql0 s LYS 25 N -1.37 3.51 -1.01 2.72 -0.14 -1.26 -4.22 119.74 117.97 2ql0 s LYS 25 Ca -0.15 -0.37 -0.23 0.00 -1.36 0.00 0.00 55.97 53.86 2ql0 s LYS 25 Cb -0.09 -2.80 0.00 0.00 -1.68 0.00 0.00 37.83 33.25 2ql0 s LYS 25 CO -0.01 0.35 1.72 -1.25 -0.76 0.00 0.00 175.35 175.40 2ql0 s PRO 26 N -3.59 3.11 0.00 -1.68 0.04 -1.26 -3.83 135.00 127.79 2ql0 s PRO 26 Ca 0.38 -0.86 0.00 0.00 0.04 0.00 0.00 61.00 60.56 2ql0 s PRO 26 Cb -0.10 -5.24 0.00 0.00 0.04 0.00 0.00 34.50 29.19 2ql0 s PRO 26 CO 0.30 -2.84 0.00 0.41 0.04 0.00 0.00 177.00 174.91 2ql0 n GLY 27 N 6.66 0.27 2.69 0.56 0.00 -1.26 -4.84 105.19 109.27 2ql0 n GLY 27 Ca 0.38 -0.52 -0.27 0.00 0.00 0.00 0.00 46.02 45.61 2ql0 n GLY 27 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ql0 s THR 28 N 0.00 0.29 0.87 2.61 2.01 -0.85 -5.00 115.64 115.57 2ql0 s THR 28 Ca 0.00 -0.43 -0.13 0.00 0.31 0.00 0.00 61.69 61.44 2ql0 s THR 28 Cb 0.00 -0.87 0.04 0.00 0.01 0.00 0.00 72.50 71.68 2ql0 s THR 28 CO 0.00 -0.25 0.66 -1.54 -0.69 0.00 0.00 174.62 172.80 2ql0 n SER 29 N 5.14 -1.04 -0.05 3.53 3.41 -1.26 -4.65 113.62 118.70 2ql0 n SER 29 Ca -0.08 0.45 0.01 0.00 -0.26 0.00 0.00 58.87 58.98 2ql0 n SER 29 Cb 0.48 -1.30 0.31 0.00 -0.26 0.00 0.00 64.21 63.44 2ql0 n SER 29 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 175.04 175.03 2ql0 h PHE 30 N -1.20 0.64 0.00 7.33 3.04 -1.92 0.08 116.94 124.90 2ql0 h PHE 30 Ca -0.44 -0.03 0.00 0.00 3.98 0.00 0.00 57.97 61.48 2ql0 h PHE 30 Cb 1.30 -0.20 0.00 0.00 2.56 0.00 0.00 35.95 39.61 2ql0 h PHE 30 CO 0.41 0.52 0.00 -0.44 -2.02 0.00 0.00 178.31 176.77 2ql0 h ASP 31 N 0.63 0.00 1.45 0.41 5.19 -1.99 -2.09 116.42 120.02 2ql0 h ASP 31 Ca 0.15 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.56 2ql0 h ASP 31 Cb 0.16 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.67 2ql0 h ASP 31 CO -0.01 0.00 -0.40 -0.78 -3.12 0.00 0.00 179.24 174.93 2ql0 h ASP 32 N 0.00 0.00 -3.77 6.45 1.82 -1.32 -3.46 116.42 116.14 2ql0 h ASP 32 Ca 0.00 -0.03 -0.54 0.00 -0.39 0.00 0.00 57.03 56.07 2ql0 h ASP 32 Cb 0.59 0.00 0.19 0.00 0.68 0.00 0.00 39.33 40.79 2ql0 h ASP 32 CO 0.00 0.02 -0.07 0.18 -1.61 0.00 0.00 179.24 177.76 2ql0 n LEU 33 N -2.71 2.39 0.00 2.28 4.77 -0.79 -4.95 117.00 118.00 2ql0 n LEU 33 Ca 0.03 0.52 0.00 0.00 -0.03 0.00 0.00 56.01 56.53 2ql0 n LEU 33 Cb 0.51 -1.36 0.00 0.00 -2.33 0.00 0.00 43.42 40.23 2ql0 n LEU 33 CO 0.36 -2.52 0.00 -0.81 -1.33 0.00 0.00 177.39 173.08 2ql0 n PRO 34 N -2.32 0.53 -0.10 3.23 -0.04 -1.26 -4.99 135.00 130.05 2ql0 n PRO 34 Ca 0.11 0.00 0.04 0.00 -0.04 0.00 0.00 63.50 63.61 2ql0 n PRO 34 Cb 0.51 0.00 0.09 0.00 -0.04 0.00 0.00 33.50 34.06 2ql0 n PRO 34 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2ql0 n ALA 35 N -3.00 2.17 -2.03 0.55 0.00 -1.26 -4.45 120.51 112.49 2ql0 n ALA 35 Ca 0.00 -1.02 0.05 0.00 0.00 0.00 0.00 53.44 52.47 2ql0 n ALA 35 Cb 0.00 -0.28 0.10 0.00 0.00 0.00 0.00 19.45 19.27 2ql0 n ALA 35 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2ql0 n ASP 36 N 0.21 1.31 -4.89 0.00 10.43 -1.26 -5.07 116.55 117.28 2ql0 n ASP 36 Ca 0.07 -2.86 -0.29 0.00 2.57 0.00 0.00 54.79 54.28 2ql0 n ASP 36 Cb 0.34 -0.40 -0.03 0.00 1.84 0.00 0.00 41.12 42.87 2ql0 n ASP 36 CO 0.00 0.00 0.00 0.86 -1.07 0.00 0.00 177.20 176.99 2ql0 s TRP 37 N -1.50 3.47 0.32 1.24 -0.00 -1.26 -5.09 118.94 116.11 2ql0 s TRP 37 Ca 0.34 0.78 0.07 0.00 -0.00 0.00 0.00 56.10 57.29 2ql0 s TRP 37 Cb 0.36 -2.21 -0.03 0.00 -0.00 0.00 0.00 33.47 31.59 2ql0 s TRP 37 CO -0.11 0.10 0.26 1.33 -0.00 0.00 0.00 176.95 178.53 2ql0 n VAL 38 N -0.98 0.00 -2.67 5.86 0.24 -1.26 -4.57 118.33 114.95 2ql0 n VAL 38 Ca -0.00 -2.31 -0.41 0.00 -2.04 0.00 0.00 64.34 59.58 2ql0 n VAL 38 Cb 0.54 1.13 -0.04 0.00 -1.47 0.00 0.00 33.84 34.00 2ql0 n VAL 38 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2ql0 n PRO 40 N 2.54 0.70 -0.09 0.00 -0.04 -1.26 -2.32 135.00 134.53 2ql0 n PRO 40 Ca 0.02 0.01 -0.09 0.00 -0.04 0.00 0.00 63.50 63.40 2ql0 n PRO 40 Cb 0.48 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.41 2ql0 n PRO 40 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2ql0 n VAL 41 N -1.03 1.48 0.00 0.52 0.31 -1.26 -4.94 118.33 113.40 2ql0 n VAL 41 Ca 0.17 0.14 0.00 0.00 -0.01 0.00 0.00 64.34 64.64 2ql0 n VAL 41 Cb 0.09 -2.34 0.00 0.00 -0.91 0.00 0.00 33.84 30.68 2ql0 n VAL 41 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2ql0 n GLY 43 N 2.62 -0.16 3.73 0.00 0.00 -0.98 -4.85 105.19 105.55 2ql0 n GLY 43 Ca 0.00 -0.17 -0.25 0.00 0.00 0.00 0.00 46.02 45.60 2ql0 n GLY 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ql0 s ALA 44 N 0.00 3.37 0.87 4.61 0.00 -1.26 -4.62 121.76 124.73 2ql0 s ALA 44 Ca 0.00 -1.38 -0.12 0.00 0.00 0.00 0.00 51.96 50.46 2ql0 s ALA 44 Cb 0.00 -1.12 0.11 0.00 0.00 0.00 0.00 23.12 22.11 2ql0 s ALA 44 CO 0.00 0.41 1.12 -1.25 0.00 0.00 0.00 175.76 176.04 2ql0 s PRO 45 N -3.29 1.50 0.67 0.00 0.04 -1.26 -2.13 135.00 130.52 2ql0 s PRO 45 Ca 0.30 0.42 0.42 0.00 0.04 0.00 0.00 61.00 62.18 2ql0 s PRO 45 Cb -0.09 -1.87 2.29 0.00 0.04 0.00 0.00 34.50 34.88 2ql0 s PRO 45 CO 0.21 -1.98 2.30 0.87 0.04 0.00 0.00 177.00 178.45 2ql0 h LYS 46 N -1.34 0.00 -0.14 4.56 1.57 -1.91 -0.17 116.57 119.14 2ql0 h LYS 46 Ca -0.49 0.00 0.04 0.00 -1.87 0.00 0.00 60.65 58.33 2ql0 h LYS 46 Cb 1.31 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.61 2ql0 h LYS 46 CO 0.61 0.00 0.32 0.66 -0.57 0.00 0.00 179.45 180.47 2ql0 h SER 47 N 0.00 0.00 0.18 0.86 4.64 -1.98 0.32 113.55 117.57 2ql0 h SER 47 Ca 0.00 0.00 -0.31 0.00 -0.47 0.00 0.00 61.79 61.01 2ql0 h SER 47 Cb 0.11 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.14 2ql0 h SER 47 CO -0.00 0.00 -2.11 -0.62 -0.87 0.00 0.00 176.83 173.23 2ql0 n GLU 48 N -3.26 0.67 -2.48 4.77 -0.58 -0.08 -4.91 120.64 114.77 2ql0 n GLU 48 Ca 0.01 0.08 -0.42 0.00 -0.42 0.00 0.00 57.16 56.41 2ql0 n GLU 48 Cb 0.41 -1.61 -0.03 0.00 -0.57 0.00 0.00 31.44 29.63 2ql0 n GLU 48 CO 0.00 0.00 0.00 -0.06 -0.48 0.00 0.00 177.13 176.59 2ql0 s PHE 49 N -2.61 3.49 0.44 -0.32 0.40 0.11 -3.48 117.98 116.01 2ql0 s PHE 49 Ca -0.08 1.41 0.01 0.00 -0.60 0.00 0.00 56.93 57.66 2ql0 s PHE 49 Cb 0.07 -3.35 -0.00 0.00 0.51 0.00 0.00 43.02 40.25 2ql0 s PHE 49 CO 0.83 -0.99 0.02 0.39 0.70 0.00 0.00 175.22 176.17 2ql0 n GLU 50 N 3.68 0.85 -3.68 0.44 -0.58 -0.98 -4.91 120.64 115.46 2ql0 n GLU 50 Ca 0.08 -3.30 -0.37 0.00 -0.42 0.00 0.00 57.16 53.15 2ql0 n GLU 50 Cb 0.47 1.01 -0.10 0.00 -0.57 0.00 0.00 31.44 32.25 2ql0 n GLU 50 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2ql0 s ALA 51 N -2.82 3.50 -2.00 0.62 0.00 -1.26 -1.96 121.76 117.84 2ql0 s ALA 51 Ca 0.03 -0.98 0.03 0.00 0.00 0.00 0.00 51.96 51.04 2ql0 s ALA 51 Cb 0.00 -2.31 0.20 0.00 0.00 0.00 0.00 23.12 21.01 2ql0 s ALA 51 CO 0.02 -0.32 0.68 0.00 0.00 0.00 0.00 175.76 176.14