#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2df0 n LYS 2 N 0.00 0.00 -0.06 0.38 4.81 -1.26 -5.16 118.16 116.87 2df0 n LYS 2 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 2df0 n LYS 2 Cb 0.00 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.05 2df0 n LYS 2 CO 0.00 0.00 0.00 -0.35 1.17 0.00 0.00 177.40 178.22 2df0 n PRO 3 N -3.35 1.38 -1.92 1.64 -0.04 -1.26 -4.96 135.00 126.49 2df0 n PRO 3 Ca 0.00 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 63.03 2df0 n PRO 3 Cb 0.00 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 33.43 2df0 n PRO 3 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 2df0 s GLU 4 N 0.25 3.55 -0.27 0.54 2.56 -1.26 -4.96 118.70 119.10 2df0 s GLU 4 Ca 0.00 1.78 0.03 0.00 0.00 0.00 0.00 54.97 56.78 2df0 s GLU 4 Cb 0.00 -4.17 0.07 0.00 2.00 0.00 0.00 34.13 32.02 2df0 s GLU 4 CO 0.00 -1.61 -0.08 0.00 -0.56 0.00 0.00 175.26 173.01 2df0 s ALA 5 N 6.32 2.62 0.24 6.30 0.00 -1.26 -4.92 121.76 131.06 2df0 s ALA 5 Ca 0.82 -1.89 0.31 0.00 0.00 0.00 0.00 51.96 51.20 2df0 s ALA 5 Cb -0.28 -1.65 1.38 0.00 0.00 0.00 0.00 23.12 22.56 2df0 s ALA 5 CO 0.33 -1.28 2.00 -1.35 0.00 0.00 0.00 175.76 175.47 2df0 h PRO 6 N 7.75 0.00 0.00 0.00 0.11 -1.93 -3.48 132.00 134.45 2df0 h PRO 6 Ca -0.17 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.94 2df0 h PRO 6 Cb 1.04 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.15 2df0 h PRO 6 CO 0.47 0.09 0.00 0.41 -0.21 0.00 0.00 178.00 178.76 2df0 n GLY 7 N -0.21 3.42 0.39 -0.55 0.00 -1.26 -2.37 105.19 104.61 2df0 n GLY 7 Ca -0.00 -0.11 0.03 0.00 0.00 0.00 0.00 46.02 45.94 2df0 n GLY 7 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2df0 n GLU 8 N 13.36 1.47 -3.28 1.61 4.71 -1.26 -4.33 120.64 132.91 2df0 n GLU 8 Ca 0.00 -0.63 -0.19 0.00 -0.01 0.00 0.00 57.16 56.33 2df0 n GLU 8 Cb 0.00 -1.21 -0.07 0.00 -1.01 0.00 0.00 31.44 29.14 2df0 n GLU 8 CO 0.00 0.00 0.00 0.34 0.09 0.00 0.00 177.13 177.56 2df0 s ASP 9 N -0.88 1.00 -0.62 1.62 2.15 -1.00 -5.01 116.67 113.92 2df0 s ASP 9 Ca 0.12 -2.17 0.05 0.00 0.43 0.00 0.00 52.55 50.97 2df0 s ASP 9 Cb 0.06 0.35 0.16 0.00 -0.30 0.00 0.00 42.92 43.20 2df0 s ASP 9 CO 0.07 -0.20 0.44 0.00 -0.17 0.00 0.00 175.17 175.31 2df0 s ALA 10 N 0.84 3.26 0.21 3.66 0.00 -1.26 -4.78 121.76 123.70 2df0 s ALA 10 Ca 0.24 -3.49 0.00 0.00 0.00 0.00 0.00 51.96 48.72 2df0 s ALA 10 Cb -0.07 -2.05 0.00 0.00 0.00 0.00 0.00 23.12 21.00 2df0 s ALA 10 CO -0.08 -2.07 0.00 0.43 0.00 0.00 0.00 175.76 174.04 2df0 n SER 11 N 2.30 -7.58 0.00 0.00 7.64 -1.26 0.17 113.62 114.89 2df0 n SER 11 Ca 0.20 0.99 0.09 0.00 1.01 0.00 0.00 58.87 61.17 2df0 n SER 11 Cb 0.37 -2.80 0.55 0.00 -1.01 0.00 0.00 64.21 61.31 2df0 n SER 11 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 2df0 n PRO 12 N -3.41 0.55 -0.57 1.43 -0.04 -1.26 -4.30 135.00 127.39 2df0 n PRO 12 Ca 0.01 0.02 -0.00 0.00 -0.04 0.00 0.00 63.50 63.48 2df0 n PRO 12 Cb 0.42 -1.50 -0.00 0.00 -0.04 0.00 0.00 33.50 32.38 2df0 n PRO 12 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 2df0 n GLU 13 N -1.04 0.00 0.00 0.54 4.07 -1.22 -4.92 120.64 118.07 2df0 n GLU 13 Ca 0.13 -0.01 0.07 0.00 -0.06 0.00 0.00 57.16 57.29 2df0 n GLU 13 Cb 0.08 0.47 -0.08 0.00 -0.06 0.00 0.00 31.44 31.84 2df0 n GLU 13 CO 0.00 0.00 0.00 0.39 -0.06 0.00 0.00 177.13 177.46 2df0 n GLU 14 N -0.00 1.99 0.13 5.31 -0.58 0.13 -4.46 120.64 123.14 2df0 n GLU 14 Ca -0.00 -0.02 -0.01 0.00 -0.42 0.00 0.00 57.16 56.70 2df0 n GLU 14 Cb 0.27 -1.22 0.13 0.00 -0.57 0.00 0.00 31.44 30.05 2df0 n GLU 14 CO 0.00 0.00 0.00 1.37 -0.48 0.00 0.00 177.13 178.02 2df0 h LEU 15 N 0.05 0.00 -1.06 -4.62 8.10 -1.64 -3.25 115.31 112.89 2df0 h LEU 15 Ca 0.00 0.00 0.02 0.00 0.11 0.00 0.00 57.88 58.01 2df0 h LEU 15 Cb 0.36 0.00 -0.05 0.00 -0.44 0.00 0.00 40.66 40.53 2df0 h LEU 15 CO 0.00 0.66 0.63 -0.55 -4.11 0.00 0.00 178.44 175.07 2df0 h ASN 16 N 0.00 1.08 1.24 0.17 7.08 -1.88 0.38 115.58 123.65 2df0 h ASN 16 Ca -0.01 -0.02 0.00 0.00 -3.08 0.00 0.00 56.30 53.19 2df0 h ASN 16 Cb 1.21 -0.26 0.00 0.00 -2.08 0.00 0.00 38.32 37.19 2df0 h ASN 16 CO 0.09 0.77 -0.08 0.54 -2.08 0.00 0.00 177.43 176.67 2df0 n ARG 17 N -4.41 0.17 -0.06 4.14 1.74 -1.24 -0.81 116.66 116.21 2df0 n ARG 17 Ca 0.12 0.13 -0.14 0.00 -0.77 0.00 0.00 57.85 57.19 2df0 n ARG 17 Cb 0.05 -1.69 -0.07 0.00 -1.02 0.00 0.00 32.46 29.73 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 0.00 0.54 -0.11 -1.55 3.20 -0.52 0.36 116.97 118.89 2df0 h TYR 18 Ca 0.00 -0.18 -0.03 0.00 3.14 0.00 0.00 58.73 61.67 2df0 h TYR 18 Cb 0.66 -0.11 -0.01 0.00 1.54 0.00 0.00 36.73 38.81 2df0 h TYR 18 CO 0.00 0.85 -0.05 1.88 -1.64 0.00 0.00 178.16 179.19 2df0 h TYR 19 N 0.07 0.16 0.00 -3.82 0.05 -0.07 -0.17 116.97 113.18 2df0 h TYR 19 Ca 0.02 -0.01 -0.11 0.00 0.05 0.00 0.00 58.73 58.68 2df0 h TYR 19 Cb 0.78 -0.05 -0.02 0.00 1.01 0.00 0.00 36.73 38.46 2df0 h TYR 19 CO 0.09 0.22 -0.66 0.00 -1.05 0.00 0.00 178.16 176.76 2df0 h ALA 20 N 1.79 0.13 -0.65 3.88 0.00 -0.85 0.44 119.26 124.01 2df0 h ALA 20 Ca 0.04 -0.82 -0.03 0.00 0.00 0.00 0.00 54.91 54.10 2df0 h ALA 20 Cb 0.21 0.41 -0.03 0.00 0.00 0.00 0.00 17.79 18.37 2df0 h ALA 20 CO 0.01 0.39 0.29 0.66 0.00 0.00 0.00 179.25 180.60 2df0 h SER 21 N -1.00 0.85 0.12 0.00 4.64 -0.31 0.41 113.55 118.26 2df0 h SER 21 Ca -0.17 -0.10 -0.15 0.00 -0.47 0.00 0.00 61.79 60.90 2df0 h SER 21 Cb 1.05 -0.22 -0.01 0.00 -0.31 0.00 0.00 62.40 62.91 2df0 h SER 21 CO -0.10 0.74 -0.52 0.25 -0.87 0.00 0.00 176.83 176.33 2df0 h LEU 22 N 0.93 0.48 -1.10 5.97 5.85 -1.14 -1.71 115.31 124.59 2df0 h LEU 22 Ca 0.22 -0.25 -0.06 0.00 0.84 0.00 0.00 57.88 58.64 2df0 h LEU 22 Cb 0.14 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.02 2df0 h LEU 22 CO -0.03 0.92 -0.29 -0.09 -0.34 0.00 0.00 178.44 178.61 2df0 h ARG 23 N 0.34 0.00 -0.22 1.25 2.43 0.46 0.42 114.38 119.06 2df0 h ARG 23 Ca 0.01 0.00 -0.21 0.00 -0.81 0.00 0.00 59.98 58.97 2df0 h ARG 23 Cb 1.03 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 30.59 2df0 h ARG 23 CO 0.09 0.29 -0.67 0.45 -1.51 0.00 0.00 179.97 178.62 2df0 h HIS 24 N 0.00 1.10 -0.59 2.20 3.86 0.04 0.48 115.15 122.24 2df0 h HIS 24 Ca -0.00 -0.44 -0.01 0.00 -1.16 0.00 0.00 60.37 58.75 2df0 h HIS 24 Cb 0.78 -0.19 -0.03 0.00 1.06 0.00 0.00 27.41 29.03 2df0 h HIS 24 CO 0.00 1.28 0.32 -0.92 0.86 0.00 0.00 177.93 179.47 2df0 h TYR 25 N 0.61 0.82 -0.34 2.45 3.20 -0.85 -1.65 116.97 121.21 2df0 h TYR 25 Ca -0.02 -0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.82 2df0 h TYR 25 Cb 1.29 -0.26 -0.02 0.00 1.54 0.00 0.00 36.73 39.28 2df0 h TYR 25 CO 0.08 0.59 0.16 -0.07 -1.64 0.00 0.00 178.16 177.28 2df0 h LEU 26 N 0.80 0.44 -1.02 2.82 3.38 -0.03 0.36 115.31 122.06 2df0 h LEU 26 Ca 0.21 -0.13 0.26 0.00 0.09 0.00 0.00 57.88 58.31 2df0 h LEU 26 Cb 0.05 -0.11 -0.13 0.00 0.09 0.00 0.00 40.66 40.56 2df0 h LEU 26 CO -0.03 0.44 0.60 -1.13 0.09 0.00 0.00 178.44 178.41 2df0 h ASN 27 N 0.41 0.65 0.00 -0.43 -0.73 0.28 -1.41 115.58 114.35 2df0 h ASN 27 Ca 0.12 0.14 -0.00 0.00 1.87 0.00 0.00 56.30 58.42 2df0 h ASN 27 Cb 0.12 0.05 -0.00 0.00 0.27 0.00 0.00 38.32 38.76 2df0 h ASN 27 CO -0.01 0.07 -0.09 0.25 -0.37 0.00 0.00 177.43 177.28 2df0 h LEU 28 N 0.54 0.00 -1.90 0.34 5.85 -0.80 -3.38 115.31 115.96 2df0 h LEU 28 Ca 0.66 -0.12 0.06 0.00 0.84 0.00 0.00 57.88 59.32 2df0 h LEU 28 Cb 1.30 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.32 2df0 h LEU 28 CO -0.49 0.61 0.43 1.62 -0.34 0.00 0.00 178.44 180.27 2df0 h VAL 29 N -1.00 0.18 0.00 1.05 3.04 -0.07 1.00 116.25 120.46 2df0 h VAL 29 Ca -0.01 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.68 2df0 h VAL 29 Cb 0.20 0.62 0.00 0.00 -2.01 0.00 0.00 31.29 30.10 2df0 h VAL 29 CO -0.00 0.00 0.00 1.07 -1.01 0.00 0.00 177.57 177.63 2df0 n THR 30 N -3.27 0.00 -0.34 3.17 5.66 -0.55 -2.79 114.28 116.15 2df0 n THR 30 Ca 0.03 0.00 0.19 0.00 -3.05 0.00 0.00 64.05 61.22 2df0 n THR 30 Cb 0.54 -0.63 0.40 0.00 -1.55 0.00 0.00 70.33 69.09 2df0 n THR 30 CO 0.00 0.00 0.00 -0.09 -3.05 0.00 0.00 175.07 171.93 2df0 h ARG 31 N 0.00 0.52 -0.17 1.09 9.65 0.82 0.64 114.38 126.93 2df0 h ARG 31 Ca 0.00 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.85 2df0 h ARG 31 Cb 0.00 -0.12 0.00 0.00 -1.39 0.00 0.00 29.97 28.46 2df0 h ARG 31 CO 0.00 0.35 0.00 0.00 2.80 0.00 0.00 179.97 183.12 2df0 n GLN 32 N -4.90 1.74 -0.23 0.20 -0.00 -1.12 -3.92 117.38 109.14 2df0 n GLN 32 Ca 0.28 -1.11 0.10 0.00 -0.00 0.00 0.00 57.00 56.27 2df0 n GLN 32 Cb 0.79 -1.39 0.38 0.00 -0.00 0.00 0.00 30.24 30.01 2df0 n GLN 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2df0 h ARG 33 N 2.23 0.68 0.00 2.61 -0.00 -1.09 -3.54 114.38 115.27 2df0 h ARG 33 Ca 0.00 -0.04 0.00 0.00 -0.50 0.00 0.00 59.98 59.44 2df0 h ARG 33 Cb 0.49 -0.15 0.00 0.00 0.00 0.00 0.00 29.97 30.31 2df0 h ARG 33 CO 0.00 0.45 0.00 0.98 0.00 0.00 0.00 179.97 181.40