#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2df0 h LYS 2 N 0.00 -0.22 -5.24 0.38 1.63 -2.04 -3.17 116.57 107.92 2df0 h LYS 2 Ca 0.00 0.01 -0.47 0.00 -0.85 0.00 0.00 60.65 59.34 2df0 h LYS 2 Cb 0.00 0.05 -0.02 0.00 -0.60 0.00 0.00 32.23 31.66 2df0 h LYS 2 CO 0.00 -0.15 1.61 -2.30 -3.45 0.00 0.00 179.45 175.16 2df0 n PRO 3 N -5.24 1.86 -2.54 1.90 -0.02 -1.26 -4.95 135.00 124.75 2df0 n PRO 3 Ca -0.06 -2.45 -0.33 0.00 -2.02 0.00 0.00 63.50 58.63 2df0 n PRO 3 Cb 0.16 -3.49 -0.04 0.00 -0.02 0.00 0.00 33.50 30.11 2df0 n PRO 3 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 2df0 s GLU 4 N 5.67 3.89 -0.49 -0.52 0.41 -1.20 -5.04 118.70 121.43 2df0 s GLU 4 Ca 0.63 1.20 0.06 0.00 -0.41 0.00 0.00 54.97 56.45 2df0 s GLU 4 Cb 0.04 -2.12 0.18 0.00 -1.78 0.00 0.00 34.13 30.46 2df0 s GLU 4 CO 0.12 -0.33 0.63 0.00 -0.49 0.00 0.00 175.26 175.19 2df0 s ALA 5 N -2.21 -1.36 0.20 5.21 0.00 -1.26 -4.85 121.76 117.49 2df0 s ALA 5 Ca 0.64 -0.81 -0.09 0.00 0.00 0.00 0.00 51.96 51.70 2df0 s ALA 5 Cb -0.13 -2.47 0.14 0.00 0.00 0.00 0.00 23.12 20.66 2df0 s ALA 5 CO 0.22 -2.18 1.78 -1.35 0.00 0.00 0.00 175.76 174.23 2df0 h PRO 6 N 5.33 1.10 0.00 0.00 0.11 -1.96 -3.49 132.00 133.09 2df0 h PRO 6 Ca 0.10 -0.18 0.00 0.00 0.11 0.00 0.00 66.00 66.04 2df0 h PRO 6 Cb 1.07 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 31.99 2df0 h PRO 6 CO 0.10 0.87 0.00 0.41 -0.21 0.00 0.00 178.00 179.17 2df0 n GLY 7 N -0.94 1.35 0.19 -0.55 0.00 -1.26 -4.85 105.19 99.13 2df0 n GLY 7 Ca 0.07 -0.45 0.07 0.00 0.00 0.00 0.00 46.02 45.70 2df0 n GLY 7 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 2df0 h GLU 8 N 0.00 0.00 -2.23 1.61 4.11 -2.04 -3.13 114.58 112.90 2df0 h GLU 8 Ca 0.00 0.00 -0.75 0.00 0.07 0.00 0.00 59.36 58.68 2df0 h GLU 8 Cb 0.00 0.00 -0.31 0.00 0.50 0.00 0.00 28.75 28.94 2df0 h GLU 8 CO 0.00 0.32 0.56 -0.40 0.07 0.00 0.00 179.01 179.56 2df0 n ASP 9 N -3.34 6.57 0.00 3.06 5.75 -1.26 -4.87 116.55 122.46 2df0 n ASP 9 Ca 0.01 -3.70 0.00 0.00 -0.01 0.00 0.00 54.79 51.09 2df0 n ASP 9 Cb 0.54 -0.99 0.00 0.00 -1.03 0.00 0.00 41.12 39.64 2df0 n ASP 9 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2df0 n ALA 10 N -0.14 0.00 -0.60 2.12 0.00 -1.18 -4.32 120.51 116.38 2df0 n ALA 10 Ca 0.43 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.87 2df0 n ALA 10 Cb 0.30 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.75 2df0 n ALA 10 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2df0 n SER 11 N 0.00 0.00 0.04 0.00 7.64 -1.25 0.30 113.62 120.35 2df0 n SER 11 Ca 0.00 0.00 0.12 0.00 1.01 0.00 0.00 58.87 60.00 2df0 n SER 11 Cb 0.00 0.00 0.48 0.00 -1.01 0.00 0.00 64.21 63.68 2df0 n SER 11 CO 0.00 0.00 0.00 -2.65 -3.01 0.00 0.00 175.04 169.38 2df0 n PRO 12 N 0.00 0.08 0.00 1.43 -0.02 -1.26 -3.79 135.00 131.44 2df0 n PRO 12 Ca 0.00 0.16 0.00 0.00 -2.02 0.00 0.00 63.50 61.64 2df0 n PRO 12 Cb 0.00 -1.62 0.00 0.00 -0.02 0.00 0.00 33.50 31.86 2df0 n PRO 12 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2df0 n GLU 13 N -1.77 0.00 -0.01 -0.52 4.71 0.15 -4.81 120.64 118.39 2df0 n GLU 13 Ca 0.05 0.00 0.11 0.00 -0.01 0.00 0.00 57.16 57.31 2df0 n GLU 13 Cb 0.30 0.00 0.57 0.00 -1.01 0.00 0.00 31.44 31.31 2df0 n GLU 13 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 2df0 n GLU 14 N -0.24 1.15 0.12 3.49 -0.58 -1.14 -1.74 120.64 121.70 2df0 n GLU 14 Ca 0.00 -0.22 -0.02 0.00 -0.42 0.00 0.00 57.16 56.50 2df0 n GLU 14 Cb 0.00 -1.34 0.11 0.00 -0.57 0.00 0.00 31.44 29.64 2df0 n GLU 14 CO 0.00 0.00 0.00 1.25 -0.48 0.00 0.00 177.13 177.90 2df0 h LEU 15 N 0.47 0.00 0.34 -4.62 5.85 -1.72 -2.59 115.31 113.04 2df0 h LEU 15 Ca 0.00 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.70 2df0 h LEU 15 Cb 0.10 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.13 2df0 h LEU 15 CO 0.00 0.68 -0.17 0.78 -0.34 0.00 0.00 178.44 179.39 2df0 h ASN 16 N 0.00 -0.41 0.01 1.25 -0.26 -1.52 -1.36 115.58 113.30 2df0 h ASN 16 Ca -0.01 0.02 0.00 0.00 -0.56 0.00 0.00 56.30 55.75 2df0 h ASN 16 Cb 1.25 0.11 0.00 0.00 -1.06 0.00 0.00 38.32 38.62 2df0 h ASN 16 CO 0.09 -0.29 -0.00 0.54 -1.06 0.00 0.00 177.43 176.71 2df0 n ARG 17 N -5.29 1.17 0.04 0.81 1.74 -1.24 -1.24 116.66 112.64 2df0 n ARG 17 Ca -0.10 -0.26 -0.12 0.00 -0.77 0.00 0.00 57.85 56.59 2df0 n ARG 17 Cb 0.21 -1.49 -0.13 0.00 -1.02 0.00 0.00 32.46 30.02 2df0 n ARG 17 CO 0.00 0.00 0.00 -0.92 -1.52 0.00 0.00 177.63 175.19 2df0 h TYR 18 N 0.65 0.21 0.00 -1.55 3.20 -0.96 0.53 116.97 119.05 2df0 h TYR 18 Ca 0.00 -0.15 -0.09 0.00 3.14 0.00 0.00 58.73 61.63 2df0 h TYR 18 Cb 0.15 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.39 2df0 h TYR 18 CO 0.00 1.18 -0.43 1.88 -1.64 0.00 0.00 178.16 179.14 2df0 h TYR 19 N 0.03 0.00 0.19 -3.82 0.05 -0.88 -1.55 116.97 111.00 2df0 h TYR 19 Ca -0.18 0.00 -0.35 0.00 0.05 0.00 0.00 58.73 58.25 2df0 h TYR 19 Cb 1.94 0.00 0.01 0.00 1.01 0.00 0.00 36.73 39.69 2df0 h TYR 19 CO 0.03 0.43 -1.70 0.00 -1.05 0.00 0.00 178.16 175.88 2df0 h ALA 20 N 1.57 0.13 -0.06 3.88 0.00 -1.13 0.28 119.26 123.92 2df0 h ALA 20 Ca -0.00 -1.10 -0.15 0.00 0.00 0.00 0.00 54.91 53.66 2df0 h ALA 20 Cb 1.12 0.40 -0.01 0.00 0.00 0.00 0.00 17.79 19.30 2df0 h ALA 20 CO 0.06 1.00 -0.61 0.66 0.00 0.00 0.00 179.25 180.35 2df0 h SER 21 N 0.11 0.25 -0.59 0.00 4.64 -0.00 0.57 113.55 118.52 2df0 h SER 21 Ca -0.32 -0.14 -0.08 0.00 -0.47 0.00 0.00 61.79 60.78 2df0 h SER 21 Cb 2.10 -0.07 -0.02 0.00 -0.31 0.00 0.00 62.40 64.10 2df0 h SER 21 CO 0.19 0.79 0.07 -0.07 -0.87 0.00 0.00 176.83 176.94 2df0 h LEU 22 N 0.16 0.97 -0.06 5.97 3.38 -1.33 -1.60 115.31 122.79 2df0 h LEU 22 Ca -0.01 -0.28 0.00 0.00 0.09 0.00 0.00 57.88 57.69 2df0 h LEU 22 Cb 1.11 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 41.60 2df0 h LEU 22 CO 0.09 1.00 0.00 -1.14 0.09 0.00 0.00 178.44 178.49 2df0 n ARG 23 N -4.27 0.07 0.01 1.13 0.00 0.98 0.12 116.66 114.70 2df0 n ARG 23 Ca 0.03 0.14 -0.18 0.00 -0.00 0.00 0.00 57.85 57.84 2df0 n ARG 23 Cb 0.30 -1.60 -0.11 0.00 0.00 0.00 0.00 32.46 31.05 2df0 n ARG 23 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 2df0 h HIS 24 N 0.00 0.61 -0.60 -0.14 3.86 0.56 0.38 115.15 119.82 2df0 h HIS 24 Ca 0.00 -0.34 -0.08 0.00 -1.16 0.00 0.00 60.37 58.79 2df0 h HIS 24 Cb 0.49 -0.07 -0.02 0.00 1.06 0.00 0.00 27.41 28.87 2df0 h HIS 24 CO 0.00 1.17 0.06 -0.92 0.86 0.00 0.00 177.93 179.10 2df0 h TYR 25 N -0.12 1.09 -0.26 2.45 3.20 -0.88 -0.68 116.97 121.77 2df0 h TYR 25 Ca -0.08 -0.17 -0.05 0.00 3.14 0.00 0.00 58.73 61.57 2df0 h TYR 25 Cb 1.35 -0.29 -0.01 0.00 1.54 0.00 0.00 36.73 39.32 2df0 h TYR 25 CO 0.15 0.95 -0.02 -0.07 -1.64 0.00 0.00 178.16 177.53 2df0 h LEU 26 N 0.92 0.46 -1.96 2.82 3.38 -0.38 -0.37 115.31 120.19 2df0 h LEU 26 Ca 0.18 -0.33 0.22 0.00 0.09 0.00 0.00 57.88 58.04 2df0 h LEU 26 Cb 0.47 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.07 2df0 h LEU 26 CO 0.02 0.68 0.61 -1.13 0.09 0.00 0.00 178.44 178.71 2df0 h ASN 27 N 0.23 0.00 0.06 -0.43 -1.24 -0.01 -1.32 115.58 112.87 2df0 h ASN 27 Ca 0.07 0.00 -0.00 0.00 0.71 0.00 0.00 56.30 57.08 2df0 h ASN 27 Cb 0.46 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.51 2df0 h ASN 27 CO 0.02 0.00 -0.03 0.25 -1.29 0.00 0.00 177.43 176.38 2df0 h LEU 28 N 0.00 -0.06 -2.38 0.34 5.85 -0.40 -3.36 115.31 115.29 2df0 h LEU 28 Ca 0.36 -0.35 0.03 0.00 0.84 0.00 0.00 57.88 58.76 2df0 h LEU 28 Cb 1.57 0.02 -0.00 0.00 0.37 0.00 0.00 40.66 42.61 2df0 h LEU 28 CO -0.00 0.59 0.16 -0.37 -0.34 0.00 0.00 178.44 178.47 2df0 h VAL 29 N -0.99 0.28 -0.07 1.05 -1.51 -0.47 0.67 116.25 115.22 2df0 h VAL 29 Ca -0.01 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.46 2df0 h VAL 29 Cb 0.41 0.86 0.00 0.00 -2.13 0.00 0.00 31.29 30.43 2df0 h VAL 29 CO 0.01 0.00 0.00 1.07 -1.23 0.00 0.00 177.57 177.42 2df0 n THR 30 N -3.48 0.27 -0.14 7.19 5.66 -0.55 -4.25 114.28 118.98 2df0 n THR 30 Ca -0.00 -0.15 -0.08 0.00 -3.05 0.00 0.00 64.05 60.77 2df0 n THR 30 Cb 0.26 -0.35 -0.02 0.00 -1.55 0.00 0.00 70.33 68.67 2df0 n THR 30 CO 0.00 0.00 0.00 0.03 -3.05 0.00 0.00 175.07 172.05 2df0 h ARG 31 N 0.47 -0.25 0.00 1.09 3.08 0.17 -2.62 114.38 116.33 2df0 h ARG 31 Ca 0.00 0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.07 2df0 h ARG 31 Cb 0.54 0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.64 2df0 h ARG 31 CO 0.04 -0.16 -1.14 0.00 -1.07 0.00 0.00 179.97 177.64 2df0 n GLN 32 N -5.42 0.61 -2.98 0.04 0.00 -1.26 -5.04 117.38 103.33 2df0 n GLN 32 Ca 0.01 -0.04 -0.13 0.00 0.00 0.00 0.00 57.00 56.84 2df0 n GLN 32 Cb 0.35 -1.43 0.01 0.00 0.00 0.00 0.00 30.24 29.17 2df0 n GLN 32 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.06 174.93 2df0 n ARG 33 N -1.62 -2.26 0.00 2.61 0.63 -0.99 -5.24 116.66 109.79 2df0 n ARG 33 Ca 0.02 1.97 0.03 0.00 -0.92 0.00 0.00 57.85 58.96 2df0 n ARG 33 Cb 0.35 -5.06 0.03 0.00 0.45 0.00 0.00 32.46 28.22 2df0 n ARG 33 CO 0.00 0.00 0.00 0.66 -2.51 0.00 0.00 177.63 175.78