#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fik s LYS 2 N 0.00 4.22 0.00 0.03 1.02 -0.63 -4.20 119.74 120.18 3fik s LYS 2 Ca 0.00 1.36 0.06 0.00 0.02 0.00 0.00 55.97 57.41 3fik s LYS 2 Cb 0.00 -2.44 0.04 0.00 -0.52 0.00 0.00 37.83 34.91 3fik s LYS 2 CO 0.00 -0.07 0.67 1.33 -0.92 0.00 0.00 175.35 176.37 3fik n VAL 3 N -0.20 0.00 -1.53 3.17 0.24 -1.26 -0.39 118.33 118.36 3fik n VAL 3 Ca 0.05 -0.49 -0.41 0.00 -2.04 0.00 0.00 64.34 61.45 3fik n VAL 3 Cb 0.51 1.12 0.01 0.00 -1.47 0.00 0.00 33.84 34.02 3fik n VAL 3 CO 0.00 0.00 0.00 -1.14 -2.14 0.00 0.00 176.83 173.55 3fik n ARG 4 N 0.26 0.89 -0.20 7.34 0.63 -1.26 -4.71 116.66 119.60 3fik n ARG 4 Ca 0.04 0.32 -0.02 0.00 -0.92 0.00 0.00 57.85 57.27 3fik n ARG 4 Cb 0.16 -1.76 0.18 0.00 0.45 0.00 0.00 32.46 31.49 3fik n ARG 4 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 3fik h ALA 5 N 1.07 1.27 -2.81 5.13 0.00 -1.86 -3.39 119.26 118.67 3fik h ALA 5 Ca -0.42 -0.14 -0.60 0.00 0.00 0.00 0.00 54.91 53.75 3fik h ALA 5 Cb 1.37 -0.28 -0.07 0.00 0.00 0.00 0.00 17.79 18.82 3fik h ALA 5 CO 0.54 0.56 -0.22 -1.12 0.00 0.00 0.00 179.25 179.01 3fik s SER 6 N -6.44 6.70 -0.16 0.00 0.01 -1.26 -4.72 113.70 107.82 3fik s SER 6 Ca -0.11 0.83 -0.16 0.00 1.31 0.00 0.00 55.95 57.82 3fik s SER 6 Cb 0.16 -2.24 -0.05 0.00 0.21 0.00 0.00 66.02 64.10 3fik s SER 6 CO 0.80 0.21 -0.31 0.52 0.41 0.00 0.00 173.24 174.87 3fik n VAL 7 N 2.61 1.40 -0.18 3.43 0.31 -1.26 -5.02 118.33 119.62 3fik n VAL 7 Ca -0.12 0.17 0.00 0.00 -0.01 0.00 0.00 64.34 64.38 3fik n VAL 7 Cb 0.52 -2.31 0.00 0.00 -0.91 0.00 0.00 33.84 31.14 3fik n VAL 7 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 3fik n LYS 8 N -4.37 0.00 -4.23 5.55 4.76 -1.26 -4.81 118.16 113.80 3fik n LYS 8 Ca -0.12 0.00 -0.19 0.00 -2.87 0.00 0.00 58.31 55.13 3fik n LYS 8 Cb 0.45 0.00 -0.11 0.00 -1.84 0.00 0.00 35.03 33.53 3fik n LYS 8 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 3fik s LYS 9 N 0.00 0.99 -0.06 1.97 1.02 -1.26 -4.94 119.74 117.46 3fik s LYS 9 Ca 0.00 -1.17 0.09 0.00 0.02 0.00 0.00 55.97 54.91 3fik s LYS 9 Cb 0.00 -0.95 -0.13 0.00 -0.52 0.00 0.00 37.83 36.23 3fik s LYS 9 CO 0.00 0.19 0.10 1.28 -0.92 0.00 0.00 175.35 176.00 3fik n LEU 10 N 0.76 0.00 -3.83 3.17 7.99 -1.26 -5.06 117.00 118.78 3fik n LEU 10 Ca -0.17 0.00 -0.09 0.00 -0.01 0.00 0.00 56.01 55.74 3fik n LEU 10 Cb 0.56 0.15 0.02 0.00 -0.11 0.00 0.00 43.42 44.04 3fik n LEU 10 CO 0.25 0.15 0.50 0.00 -1.51 0.00 0.00 177.39 176.79 3fik n ARG 12 N -0.52 2.85 -0.05 0.00 1.85 -1.26 -3.46 116.66 116.07 3fik n ARG 12 Ca -0.07 -2.22 0.07 0.00 -1.00 0.00 0.00 57.85 54.63 3fik n ARG 12 Cb 0.60 -1.64 0.09 0.00 -1.05 0.00 0.00 32.46 30.45 3fik n ARG 12 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 3fik n ASN 13 N 1.01 2.40 -4.07 2.89 3.02 -1.26 -4.95 115.26 114.30 3fik n ASN 13 Ca 0.20 -1.68 -0.32 0.00 -0.03 0.00 0.00 54.58 52.75 3fik n ASN 13 Cb 0.64 -0.06 -0.16 0.00 -0.61 0.00 0.00 39.78 39.59 3fik n ASN 13 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3fik s LYS 15 N 1.25 2.19 -0.43 0.00 -2.85 -1.25 -4.88 119.74 113.77 3fik s LYS 15 Ca -0.01 -1.19 -0.13 0.00 -1.00 0.00 0.00 55.97 53.64 3fik s LYS 15 Cb -0.16 -2.25 0.06 0.00 -2.06 0.00 0.00 37.83 33.42 3fik s LYS 15 CO -0.09 0.45 0.31 0.42 0.10 0.00 0.00 175.35 176.54 3fik s ILE 16 N -1.67 4.84 0.18 3.79 1.01 -1.26 -3.59 121.20 124.50 3fik s ILE 16 Ca 0.25 -1.06 0.02 0.00 0.00 0.00 0.00 60.65 59.87 3fik s ILE 16 Cb -0.09 -3.84 -0.01 0.00 0.01 0.00 0.00 42.46 38.53 3fik s ILE 16 CO 0.16 -0.45 0.09 1.33 0.00 0.00 0.00 174.94 176.07 3fik n VAL 17 N 5.08 0.00 -4.06 2.92 0.24 -1.25 -5.11 118.33 116.15 3fik n VAL 17 Ca -0.11 -1.12 -0.14 0.00 -2.04 0.00 0.00 64.34 60.93 3fik n VAL 17 Cb 0.44 0.46 -0.04 0.00 -1.47 0.00 0.00 33.84 33.23 3fik n VAL 17 CO 0.00 0.00 0.00 -1.59 -2.14 0.00 0.00 176.83 173.10 3fik s LYS 18 N -2.70 1.89 -0.15 7.34 -2.85 -1.26 -3.32 119.74 118.70 3fik s LYS 18 Ca 0.13 -1.68 -0.02 0.00 -1.00 0.00 0.00 55.97 53.39 3fik s LYS 18 Cb 0.01 0.46 0.05 0.00 -2.06 0.00 0.00 37.83 36.28 3fik s LYS 18 CO 0.09 -0.79 0.03 1.03 0.10 0.00 0.00 175.35 175.81 3fik s ARG 19 N -3.11 0.60 6.59 1.78 0.52 -0.76 -4.79 118.95 119.78 3fik s ARG 19 Ca 0.29 -0.21 0.00 0.00 -0.52 0.00 0.00 55.73 55.29 3fik s ARG 19 Cb -0.01 -1.68 0.00 0.00 0.52 0.00 0.00 34.95 33.78 3fik s ARG 19 CO 0.18 -0.52 0.00 -0.25 0.02 0.00 0.00 175.30 174.73 3fik n ASP 20 N 5.10 0.00 -0.01 0.23 9.92 -1.26 -2.36 116.55 128.17 3fik n ASP 20 Ca -0.08 0.00 0.15 0.00 -0.53 0.00 0.00 54.79 54.33 3fik n ASP 20 Cb 0.48 0.00 0.82 0.00 -0.64 0.00 0.00 41.12 41.79 3fik n ASP 20 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3fik n GLY 21 N 0.00 -1.16 3.57 0.44 0.00 -1.26 -4.77 105.19 102.01 3fik n GLY 21 Ca 0.00 -0.17 -0.33 0.00 0.00 0.00 0.00 46.02 45.52 3fik n GLY 21 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3fik s VAL 22 N -2.35 3.59 -0.41 1.61 -7.23 -0.99 -4.78 120.40 109.83 3fik s VAL 22 Ca 0.36 -0.60 -0.13 0.00 -1.81 0.00 0.00 61.98 59.80 3fik s VAL 22 Cb 0.21 -2.49 0.04 0.00 0.56 0.00 0.00 36.38 34.70 3fik s VAL 22 CO 0.43 0.54 0.27 -0.63 -0.31 0.00 0.00 175.10 175.40 3fik s ILE 23 N -0.85 4.84 0.32 -0.62 -1.09 -1.26 -1.82 121.20 120.71 3fik s ILE 23 Ca 0.14 -0.90 0.06 0.00 -2.23 0.00 0.00 60.65 57.71 3fik s ILE 23 Cb -0.11 -3.76 -0.01 0.00 -1.58 0.00 0.00 42.46 36.99 3fik s ILE 23 CO 0.03 -0.35 0.45 -0.13 -1.23 0.00 0.00 174.94 173.72 3fik s ARG 24 N 1.59 3.20 -0.07 2.79 1.81 -1.21 -3.29 118.95 123.77 3fik s ARG 24 Ca 0.03 -0.91 -0.03 0.00 -1.72 0.00 0.00 55.73 53.10 3fik s ARG 24 Cb -0.20 -2.82 0.04 0.00 -0.45 0.00 0.00 34.95 31.52 3fik s ARG 24 CO 0.07 0.14 0.14 0.08 -0.68 0.00 0.00 175.30 175.05 3fik s VAL 25 N -2.15 -0.17 0.08 3.52 1.01 -1.18 -3.80 120.40 117.70 3fik s VAL 25 Ca 0.42 0.30 -0.13 0.00 0.00 0.00 0.00 61.98 62.58 3fik s VAL 25 Cb -0.09 -0.25 -0.06 0.00 0.00 0.00 0.00 36.38 35.97 3fik s VAL 25 CO 0.31 0.13 0.45 -0.51 0.00 0.00 0.00 175.10 175.48 3fik s ILE 26 N 1.88 5.00 -0.02 2.22 2.07 -1.24 -2.28 121.20 128.83 3fik s ILE 26 Ca -0.01 0.67 0.02 0.00 -1.41 0.00 0.00 60.65 59.93 3fik s ILE 26 Cb -0.12 -3.70 0.00 0.00 0.13 0.00 0.00 42.46 38.78 3fik s ILE 26 CO -0.05 0.35 -0.09 0.00 -1.91 0.00 0.00 174.94 173.24 3fik h SER 28 N 6.35 0.00 0.00 0.00 0.02 -1.99 -3.45 113.55 114.48 3fik h SER 28 Ca -0.33 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.62 3fik h SER 28 Cb 1.17 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.71 3fik h SER 28 CO 0.49 0.11 0.00 0.00 -1.14 0.00 0.00 176.83 176.29 3fik n ALA 29 N -2.13 0.00 -1.76 3.77 0.00 -1.26 -5.08 120.51 114.05 3fik n ALA 29 Ca 0.02 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.08 3fik n ALA 29 Cb 0.50 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.98 3fik n ALA 29 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 3fik s GLU 30 N 4.48 3.40 -1.49 0.00 2.56 -1.26 -4.92 118.70 121.47 3fik s GLU 30 Ca 0.00 2.16 -0.09 0.00 0.00 0.00 0.00 54.97 57.04 3fik s GLU 30 Cb 0.00 -2.38 0.01 0.00 2.00 0.00 0.00 34.13 33.75 3fik s GLU 30 CO 0.00 -0.96 2.65 -0.35 -0.56 0.00 0.00 175.26 176.05 3fik n PRO 31 N -0.71 3.93 -0.55 4.30 -0.04 -1.26 -3.28 135.00 137.39 3fik n PRO 31 Ca 0.08 -2.73 0.04 0.00 -0.04 0.00 0.00 63.50 60.86 3fik n PRO 31 Cb 0.45 -2.79 0.06 0.00 -0.04 0.00 0.00 33.50 31.18 3fik n PRO 31 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 3fik n LYS 32 N 3.18 0.52 0.00 0.54 5.02 -1.26 -1.70 118.16 124.46 3fik n LYS 32 Ca 0.69 -1.84 0.00 0.00 -2.02 0.00 0.00 58.31 55.14 3fik n LYS 32 Cb 0.26 -0.81 0.00 0.00 -0.02 0.00 0.00 35.03 34.45 3fik n LYS 32 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 3fik n HIS 33 N -0.44 0.00 -1.89 2.13 8.25 -1.21 -4.84 115.22 117.23 3fik n HIS 33 Ca 0.07 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.23 3fik n HIS 33 Cb 0.75 0.00 0.03 0.00 1.12 0.00 0.00 29.99 31.89 3fik n HIS 33 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 3fik s LYS 34 N -0.09 3.22 0.08 -0.41 1.02 -1.26 -4.66 119.74 117.65 3fik s LYS 34 Ca 0.00 0.60 0.07 0.00 0.02 0.00 0.00 55.97 56.66 3fik s LYS 34 Cb 0.00 -2.05 -0.04 0.00 -0.52 0.00 0.00 37.83 35.22 3fik s LYS 34 CO 0.00 -0.80 -0.15 -0.65 -0.92 0.00 0.00 175.35 172.83 3fik s GLN 35 N -5.27 2.03 -0.09 1.68 -1.52 -0.97 -1.60 119.66 113.93 3fik s GLN 35 Ca 0.57 -1.04 0.13 0.00 -1.95 0.00 0.00 55.36 53.07 3fik s GLN 35 Cb -0.11 -2.22 -0.20 0.00 -0.22 0.00 0.00 33.01 30.26 3fik s GLN 35 CO 0.53 0.52 0.16 -2.13 -0.25 0.00 0.00 175.29 174.11 3fik n ARG 36 N 1.04 1.23 -3.52 2.91 0.63 0.48 -3.13 116.66 116.30 3fik n ARG 36 Ca -0.15 -0.06 -0.10 0.00 -0.92 0.00 0.00 57.85 56.62 3fik n ARG 36 Cb 0.52 -1.36 -0.03 0.00 0.45 0.00 0.00 32.46 32.04 3fik n ARG 36 CO 0.00 0.00 0.00 1.14 -2.51 0.00 0.00 177.63 176.26 3fik s GLN 37 N -2.61 0.81 0.00 -0.14 -2.07 -1.21 -4.49 119.66 109.96 3fik s GLN 37 Ca -0.06 -0.11 0.27 0.00 -1.82 0.00 0.00 55.36 53.64 3fik s GLN 37 Cb 0.06 0.38 0.82 0.00 -1.09 0.00 0.00 33.01 33.18 3fik s GLN 37 CO 0.59 -0.32 1.62 0.41 -1.32 0.00 0.00 175.29 176.28