#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wdj s VAL 3 N 0.00 1.65 0.31 3.15 1.01 -1.26 -1.42 120.40 123.84 2wdj s VAL 3 Ca 0.00 -0.90 -0.14 0.00 0.00 0.00 0.00 61.98 60.94 2wdj s VAL 3 Cb 0.00 -1.66 0.02 0.00 0.00 0.00 0.00 36.38 34.74 2wdj s VAL 3 CO 0.00 0.27 0.63 0.00 0.00 0.00 0.00 175.10 176.00 2wdj s ARG 4 N 1.41 1.87 0.12 2.72 1.70 -1.24 -4.87 118.95 120.67 2wdj s ARG 4 Ca 0.01 -1.33 -0.07 0.00 -0.47 0.00 0.00 55.73 53.86 2wdj s ARG 4 Cb -0.15 0.55 -0.11 0.00 -0.57 0.00 0.00 34.95 34.66 2wdj s ARG 4 CO -0.09 -0.83 1.30 0.00 -1.08 0.00 0.00 175.30 174.59 2wdj h ALA 5 N 2.09 0.34 -3.08 7.88 0.00 -1.90 -0.57 119.26 124.02 2wdj h ALA 5 Ca -0.26 -0.68 -0.72 0.00 0.00 0.00 0.00 54.91 53.25 2wdj h ALA 5 Cb 1.25 -0.01 -0.33 0.00 0.00 0.00 0.00 17.79 18.70 2wdj h ALA 5 CO 0.34 0.76 -0.24 0.45 0.00 0.00 0.00 179.25 180.56 2wdj s SER 6 N -7.12 5.61 -0.06 0.00 0.15 -1.26 -4.79 113.70 106.24 2wdj s SER 6 Ca -0.07 -2.93 -0.19 0.00 0.70 0.00 0.00 55.95 53.46 2wdj s SER 6 Cb 0.09 -1.93 -0.05 0.00 -1.71 0.00 0.00 66.02 62.42 2wdj s SER 6 CO 0.88 -0.39 0.53 -0.69 1.20 0.00 0.00 173.24 174.78 2wdj s VAL 7 N -0.18 5.05 0.23 4.45 1.01 -1.26 -5.07 120.40 124.63 2wdj s VAL 7 Ca 0.18 1.10 -0.01 0.00 0.00 0.00 0.00 61.98 63.25 2wdj s VAL 7 Cb -0.17 -3.87 -0.03 0.00 0.00 0.00 0.00 36.38 32.31 2wdj s VAL 7 CO -0.05 0.38 0.21 -0.54 0.00 0.00 0.00 175.10 175.09 2wdj s LYS 8 N 0.15 1.35 -0.50 2.72 1.02 -1.26 -5.07 119.74 118.15 2wdj s LYS 8 Ca 0.29 -1.65 -0.29 0.00 0.02 0.00 0.00 55.97 54.34 2wdj s LYS 8 Cb -0.17 0.31 0.02 0.00 -0.52 0.00 0.00 37.83 37.47 2wdj s LYS 8 CO 0.14 -0.47 1.28 1.03 -0.92 0.00 0.00 175.35 176.41 2wdj s ARG 9 N -4.00 3.55 0.06 1.68 0.52 -1.26 -4.89 118.95 114.60 2wdj s ARG 9 Ca 0.37 0.57 0.02 0.00 -0.52 0.00 0.00 55.73 56.17 2wdj s ARG 9 Cb 0.05 -4.01 -0.25 0.00 0.52 0.00 0.00 34.95 31.27 2wdj s ARG 9 CO 0.14 -1.62 1.06 0.82 0.02 0.00 0.00 175.30 175.72 2wdj h ILE 10 N 6.31 1.41 -1.96 1.52 2.04 -1.97 -3.48 117.51 121.38 2wdj h ILE 10 Ca -0.25 -3.09 0.00 0.00 1.00 0.00 0.00 64.86 62.52 2wdj h ILE 10 Cb 1.08 2.79 0.00 0.00 -0.74 0.00 0.00 36.82 39.95 2wdj h ILE 10 CO 1.14 0.85 0.00 0.00 0.00 0.00 0.00 178.15 180.14 2wdj n ASP 12 N 0.00 3.85 -0.37 0.00 5.75 -1.26 -4.37 116.55 120.16 2wdj n ASP 12 Ca 0.00 0.00 0.14 0.00 -0.01 0.00 0.00 54.79 54.92 2wdj n ASP 12 Cb 0.00 1.14 0.56 0.00 -1.03 0.00 0.00 41.12 41.79 2wdj n ASP 12 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 2wdj n LYS 13 N -1.75 1.41 -2.05 0.11 5.02 -1.26 -4.91 118.16 114.73 2wdj n LYS 13 Ca -0.02 -0.74 -0.41 0.00 -2.02 0.00 0.00 58.31 55.12 2wdj n LYS 13 Cb 0.21 -1.48 -0.02 0.00 -0.02 0.00 0.00 35.03 33.71 2wdj n LYS 13 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2wdj s LYS 15 N -1.67 0.86 -0.52 0.00 2.20 0.23 -4.94 119.74 115.91 2wdj s LYS 15 Ca 0.51 -1.25 -0.27 0.00 -0.36 0.00 0.00 55.97 54.60 2wdj s LYS 15 Cb -0.41 -2.18 -0.04 0.00 -1.51 0.00 0.00 37.83 33.69 2wdj s LYS 15 CO 0.53 -0.99 2.06 0.08 -0.36 0.00 0.00 175.35 176.67 2wdj s VAL 16 N 1.43 3.23 0.17 4.02 1.01 -1.26 -2.66 120.40 126.33 2wdj s VAL 16 Ca 0.11 0.16 0.08 0.00 0.00 0.00 0.00 61.98 62.32 2wdj s VAL 16 Cb -0.18 -3.54 -0.04 0.00 0.00 0.00 0.00 36.38 32.62 2wdj s VAL 16 CO -0.21 -0.50 -0.05 -0.63 0.00 0.00 0.00 175.10 173.71 2wdj s ILE 17 N 9.91 3.49 -0.40 2.22 -1.09 -1.24 -4.99 121.20 129.10 2wdj s ILE 17 Ca 0.81 -1.49 0.02 0.00 -2.23 0.00 0.00 60.65 57.76 2wdj s ILE 17 Cb -0.16 -2.73 0.12 0.00 -1.58 0.00 0.00 42.46 38.10 2wdj s ILE 17 CO 0.25 -0.09 0.16 -0.60 -1.23 0.00 0.00 174.94 173.43 2wdj s ARG 18 N -2.82 1.28 -0.04 2.79 3.52 -1.26 -0.99 118.95 121.43 2wdj s ARG 18 Ca 0.26 -1.83 0.05 0.00 -0.13 0.00 0.00 55.73 54.08 2wdj s ARG 18 Cb -0.09 -2.59 -0.01 0.00 -1.56 0.00 0.00 34.95 30.70 2wdj s ARG 18 CO 0.17 -1.06 -0.18 -0.98 -0.81 0.00 0.00 175.30 172.44 2wdj s ARG 19 N 0.71 1.79 -0.82 5.12 1.70 -1.23 -4.73 118.95 121.49 2wdj s ARG 19 Ca 0.14 -0.64 0.00 0.00 -0.47 0.00 0.00 55.73 54.76 2wdj s ARG 19 Cb -0.22 -1.58 0.00 0.00 -0.57 0.00 0.00 34.95 32.58 2wdj s ARG 19 CO -0.08 0.28 0.00 0.72 -1.08 0.00 0.00 175.30 175.14 2wdj n HIS 20 N 3.04 0.00 0.00 5.89 8.25 -1.26 -3.46 115.22 127.67 2wdj n HIS 20 Ca -0.17 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.29 2wdj n HIS 20 Cb 0.53 -1.71 0.00 0.00 1.12 0.00 0.00 29.99 29.93 2wdj n HIS 20 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2wdj n GLY 21 N -1.57 2.81 3.90 -1.41 0.00 -1.26 -5.03 105.19 102.62 2wdj n GLY 21 Ca -0.08 -0.06 -0.28 0.00 0.00 0.00 0.00 46.02 45.60 2wdj n GLY 21 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2wdj s ARG 22 N 0.00 2.14 -0.39 1.61 0.52 -1.23 -5.05 118.95 116.56 2wdj s ARG 22 Ca 0.00 0.07 -0.06 0.00 -0.52 0.00 0.00 55.73 55.22 2wdj s ARG 22 Cb 0.00 -2.01 0.08 0.00 0.52 0.00 0.00 34.95 33.53 2wdj s ARG 22 CO 0.00 -1.44 0.19 0.08 0.02 0.00 0.00 175.30 174.16 2wdj s VAL 23 N -3.47 3.79 0.00 3.52 1.01 -1.26 -3.48 120.40 120.52 2wdj s VAL 23 Ca 0.61 -1.51 0.00 0.00 0.00 0.00 0.00 61.98 61.08 2wdj s VAL 23 Cb -0.11 -3.34 0.00 0.00 0.00 0.00 0.00 36.38 32.93 2wdj s VAL 23 CO 0.48 -0.45 0.00 -1.22 0.00 0.00 0.00 175.10 173.91 2wdj n TYR 24 N 4.79 -0.69 -3.62 5.22 4.02 -0.16 -1.60 117.16 125.12 2wdj n TYR 24 Ca -0.09 0.00 0.02 0.00 -0.01 0.00 0.00 57.90 57.82 2wdj n TYR 24 Cb 0.43 0.00 -0.06 0.00 -0.02 0.00 0.00 39.34 39.69 2wdj n TYR 24 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 2wdj s VAL 25 N 1.01 -0.01 0.08 -0.72 1.01 -1.00 -3.73 120.40 117.05 2wdj s VAL 25 Ca 0.00 0.00 0.07 0.00 0.00 0.00 0.00 61.98 62.05 2wdj s VAL 25 Cb 0.00 -1.00 -0.03 0.00 0.00 0.00 0.00 36.38 35.35 2wdj s VAL 25 CO 0.00 0.00 -0.19 -0.63 0.00 0.00 0.00 175.10 174.28 2wdj s ILE 26 N 1.16 1.50 0.03 2.22 1.09 -1.09 -2.79 121.20 123.32 2wdj s ILE 26 Ca -0.08 -1.41 0.00 0.00 -1.10 0.00 0.00 60.65 58.06 2wdj s ILE 26 Cb -0.02 -1.38 -0.00 0.00 -1.06 0.00 0.00 42.46 40.00 2wdj s ILE 26 CO -0.11 -0.08 0.04 0.00 -0.10 0.00 0.00 174.94 174.69 2wdj n GLU 28 N -0.05 0.00 -2.06 0.00 0.00 -1.26 -4.70 120.64 112.57 2wdj n GLU 28 Ca 0.00 0.16 -0.42 0.00 0.00 0.00 0.00 57.16 56.90 2wdj n GLU 28 Cb 0.05 -0.94 -0.03 0.00 0.00 0.00 0.00 31.44 30.52 2wdj n GLU 28 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 2wdj s ASN 29 N -1.84 6.71 0.00 4.31 2.20 -1.26 -4.87 114.94 120.19 2wdj s ASN 29 Ca 0.00 2.43 0.02 0.00 -0.94 0.00 0.00 52.86 54.36 2wdj s ASN 29 Cb 0.00 -2.58 0.10 0.00 -2.00 0.00 0.00 41.25 36.77 2wdj s ASN 29 CO 0.00 -0.75 0.55 -0.81 -2.94 0.00 0.00 177.10 173.15 2wdj n PRO 30 N 4.34 0.06 0.00 3.55 -0.04 -1.26 -2.85 135.00 138.79 2wdj n PRO 30 Ca 0.13 0.00 0.09 0.00 -0.04 0.00 0.00 63.50 63.68 2wdj n PRO 30 Cb 0.41 -1.46 0.38 0.00 -0.04 0.00 0.00 33.50 32.79 2wdj n PRO 30 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2wdj n LYS 31 N -0.96 0.01 -0.08 0.54 5.02 -1.26 -3.29 118.16 118.14 2wdj n LYS 31 Ca 0.01 0.19 0.03 0.00 -2.02 0.00 0.00 58.31 56.52 2wdj n LYS 31 Cb 0.01 -1.50 0.07 0.00 -0.02 0.00 0.00 35.03 33.59 2wdj n LYS 31 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 2wdj n HIS 32 N -1.50 0.21 -1.88 2.13 8.25 -1.13 -4.84 115.22 116.46 2wdj n HIS 32 Ca 0.04 -0.50 -0.29 0.00 -0.26 0.00 0.00 57.72 56.72 2wdj n HIS 32 Cb 0.21 -0.04 -0.05 0.00 1.12 0.00 0.00 29.99 31.23 2wdj n HIS 32 CO 0.00 0.00 0.00 0.21 0.64 0.00 0.00 176.34 177.19 2wdj s LYS 33 N -1.00 2.32 0.16 -0.41 2.20 -1.21 -4.73 119.74 117.07 2wdj s LYS 33 Ca 0.11 0.37 -0.01 0.00 -0.36 0.00 0.00 55.97 56.08 2wdj s LYS 33 Cb 0.06 -4.74 -0.04 0.00 -1.51 0.00 0.00 37.83 31.59 2wdj s LYS 33 CO 0.07 -3.39 0.35 -0.65 -0.36 0.00 0.00 175.35 171.37 2wdj s GLN 34 N 7.58 3.53 -0.28 4.03 -0.21 -1.12 -4.54 119.66 128.64 2wdj s GLN 34 Ca 0.78 -0.31 -0.00 0.00 0.02 0.00 0.00 55.36 55.85 2wdj s GLN 34 Cb -0.11 -2.89 0.14 0.00 1.00 0.00 0.00 33.01 31.16 2wdj s GLN 34 CO 0.11 0.46 0.36 0.50 -2.12 0.00 0.00 175.29 174.60 2wdj s ARG 35 N -3.00 0.36 -0.07 2.91 3.52 -0.51 -2.36 118.95 119.81 2wdj s ARG 35 Ca 0.38 0.15 -0.36 0.00 -0.13 0.00 0.00 55.73 55.77 2wdj s ARG 35 Cb -0.12 -0.49 -0.14 0.00 -1.56 0.00 0.00 34.95 32.65 2wdj s ARG 35 CO 0.28 -0.93 1.71 0.94 -0.81 0.00 0.00 175.30 176.48 2wdj n GLN 36 N 5.34 1.74 0.00 5.12 7.27 -0.63 -3.61 117.38 132.62 2wdj n GLN 36 Ca -0.01 0.63 0.00 0.00 0.07 0.00 0.00 57.00 57.69 2wdj n GLN 36 Cb 0.49 -2.39 0.00 0.00 2.41 0.00 0.00 30.24 30.75 2wdj n GLN 36 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54