#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b8w n VAL 2 N 0.00 0.00 -2.46 1.97 0.24 -1.26 -4.87 118.33 111.95 1b8w n VAL 2 Ca 0.00 0.00 -0.01 0.00 -2.04 0.00 0.00 64.34 62.29 1b8w n VAL 2 Cb 0.00 -0.44 0.00 0.00 -1.47 0.00 0.00 33.84 31.93 1b8w n VAL 2 CO 0.00 0.00 0.00 1.67 -2.14 0.00 0.00 176.83 176.36 1b8w n GLN 3 N -0.26 -0.18 -0.10 7.34 7.27 -1.26 -4.99 117.38 125.20 1b8w n GLN 3 Ca 0.00 0.02 -0.20 0.00 0.07 0.00 0.00 57.00 56.89 1b8w n GLN 3 Cb 0.00 -2.71 -0.08 0.00 2.41 0.00 0.00 30.24 29.86 1b8w n GLN 3 CO 0.00 0.00 0.00 1.58 0.07 0.00 0.00 177.06 178.71 1b8w n HIS 4 N -2.74 0.00 -4.21 3.69 -0.00 -1.26 -5.04 115.22 105.66 1b8w n HIS 4 Ca -0.00 0.00 -0.18 0.00 0.46 0.00 0.00 57.72 57.99 1b8w n HIS 4 Cb 0.50 -0.77 -0.12 0.00 -0.12 0.00 0.00 29.99 29.49 1b8w n HIS 4 CO 0.00 0.00 0.00 1.03 0.46 0.00 0.00 176.34 177.83 1b8w s ARG 5 N -2.39 0.93 0.00 1.57 0.52 -1.26 -5.10 118.95 113.22 1b8w s ARG 5 Ca -0.29 -1.10 0.00 0.00 -0.52 0.00 0.00 55.73 53.82 1b8w s ARG 5 Cb 0.10 -0.89 0.00 0.00 0.52 0.00 0.00 34.95 34.68 1b8w s ARG 5 CO 0.40 0.19 0.66 -0.35 0.02 0.00 0.00 175.30 176.22 1b8w n PRO 6 N 0.92 0.00 -3.69 3.54 -0.04 -1.26 -4.94 135.00 129.54 1b8w n PRO 6 Ca -0.18 0.31 -0.11 0.00 -0.04 0.00 0.00 63.50 63.48 1b8w n PRO 6 Cb 0.55 -1.22 -0.09 0.00 -0.04 0.00 0.00 33.50 32.70 1b8w n PRO 6 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1b8w s ARG 7 N -1.94 0.55 0.59 0.54 0.52 -1.25 -5.06 118.95 112.89 1b8w s ARG 7 Ca 0.00 0.82 -0.17 0.00 -0.52 0.00 0.00 55.73 55.86 1b8w s ARG 7 Cb 0.00 0.16 -0.03 0.00 0.52 0.00 0.00 34.95 35.59 1b8w s ARG 7 CO 0.00 -0.11 1.11 0.16 0.02 0.00 0.00 175.30 176.47 1b8w s ASP 8 N 0.87 5.53 -0.03 0.23 1.47 -1.26 0.15 116.67 123.63 1b8w s ASP 8 Ca -0.05 2.04 -0.25 0.00 1.18 0.00 0.00 52.55 55.47 1b8w s ASP 8 Cb -0.05 -2.56 -0.21 0.00 -0.34 0.00 0.00 42.92 39.76 1b8w s ASP 8 CO -0.07 -1.34 1.17 0.00 0.68 0.00 0.00 175.17 175.61 1b8w h GLU 10 N -0.50 0.47 0.00 0.00 4.22 -1.80 0.34 114.58 117.32 1b8w h GLU 10 Ca -0.00 -0.05 -0.02 0.00 0.08 0.00 0.00 59.36 59.38 1b8w h GLU 10 Cb 0.67 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 29.82 1b8w h GLU 10 CO 0.01 0.37 -0.07 1.03 -2.18 0.00 0.00 179.01 178.17 1b8w h SER 11 N 0.48 0.00 -0.17 1.04 0.87 -1.88 -1.54 113.55 112.35 1b8w h SER 11 Ca 0.12 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.68 1b8w h SER 11 Cb 0.05 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.01 1b8w h SER 11 CO -0.02 0.07 0.00 2.30 -0.53 0.00 0.00 176.83 178.66 1b8w n ILE 12 N -3.39 0.20 -2.27 2.23 -5.35 -0.49 -4.95 119.36 105.34 1b8w n ILE 12 Ca -0.01 -0.60 0.00 0.00 -0.27 0.00 0.00 62.75 61.87 1b8w n ILE 12 Cb 0.23 1.30 0.00 0.00 -1.74 0.00 0.00 39.64 39.42 1b8w n ILE 12 CO 0.00 0.00 0.00 -3.20 -1.76 0.00 0.00 176.55 171.59 1b8w n ASN 13 N 1.41 -1.87 -4.58 7.28 5.15 -0.58 -5.08 115.26 116.99 1b8w n ASN 13 Ca 0.16 0.00 -0.30 0.00 -0.60 0.00 0.00 54.58 53.85 1b8w n ASN 13 Cb 0.60 -0.47 -0.09 0.00 -0.53 0.00 0.00 39.78 39.30 1b8w n ASN 13 CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 1b8w s GLY 14 N -2.93 2.76 0.36 8.20 0.00 -0.01 -4.80 107.32 110.90 1b8w s GLY 14 Ca 0.00 -1.10 0.08 0.00 0.00 0.00 0.00 44.72 43.70 1b8w s GLY 14 CO 0.00 -2.08 0.23 0.54 0.00 0.00 0.00 173.10 171.80 1b8w s VAL 15 N -2.94 3.03 -0.35 1.40 0.11 -0.75 -3.79 120.40 117.11 1b8w s VAL 15 Ca 0.18 -1.54 0.02 0.00 -2.93 0.00 0.00 61.98 57.71 1b8w s VAL 15 Cb 0.04 -3.04 0.10 0.00 -1.53 0.00 0.00 36.38 31.95 1b8w s VAL 15 CO 0.09 -0.13 0.07 0.00 -3.33 0.00 0.00 175.10 171.81 1b8w n ARG 17 N 4.37 3.74 -3.20 0.00 1.74 -0.56 -4.84 116.66 117.91 1b8w n ARG 17 Ca 0.00 0.00 -0.39 0.00 -0.77 0.00 0.00 57.85 56.69 1b8w n ARG 17 Cb 0.42 0.00 -0.06 0.00 -1.02 0.00 0.00 32.46 31.80 1b8w n ARG 17 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 1b8w s HIS 18 N 1.64 3.68 -1.96 -1.55 3.76 -1.26 -1.24 115.29 118.37 1b8w s HIS 18 Ca 0.00 1.20 0.00 0.00 -0.15 0.00 0.00 55.06 56.11 1b8w s HIS 18 Cb 0.00 -2.61 0.00 0.00 1.11 0.00 0.00 32.58 31.08 1b8w s HIS 18 CO 0.00 0.35 0.44 0.36 -0.85 0.00 0.00 174.74 175.04 1b8w n LYS 19 N 2.72 0.45 -1.09 1.40 2.85 -1.25 -1.58 118.16 121.65 1b8w n LYS 19 Ca -0.07 0.00 0.02 0.00 -1.05 0.00 0.00 58.31 57.22 1b8w n LYS 19 Cb 0.51 -1.01 0.01 0.00 -0.65 0.00 0.00 35.03 33.89 1b8w n LYS 19 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 177.40 173.88 1b8w n ASP 20 N -0.47 0.61 0.00 -5.58 2.03 -1.26 -5.03 116.55 106.85 1b8w n ASP 20 Ca 0.00 -2.01 0.00 0.00 0.52 0.00 0.00 54.79 53.30 1b8w n ASP 20 Cb 0.01 -0.26 0.00 0.00 -0.72 0.00 0.00 41.12 40.14 1b8w n ASP 20 CO 0.00 0.00 0.00 0.41 -1.92 0.00 0.00 177.20 175.69 1b8w n THR 21 N 0.29 0.00 0.04 5.18 -1.04 -0.62 -5.02 114.28 113.11 1b8w n THR 21 Ca 0.04 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.05 1b8w n THR 21 Cb 0.97 -0.51 0.00 0.00 -1.82 0.00 0.00 70.33 68.97 1b8w n THR 21 CO 0.00 0.00 0.00 0.55 -0.64 0.00 0.00 175.07 174.98 1b8w n VAL 22 N 0.00 0.00 -1.50 12.58 3.14 -1.26 -4.97 118.33 126.33 1b8w n VAL 22 Ca 0.00 0.00 0.06 0.00 -2.96 0.00 0.00 64.34 61.44 1b8w n VAL 22 Cb 0.00 0.00 0.10 0.00 -1.06 0.00 0.00 33.84 32.88 1b8w n VAL 22 CO 0.00 0.00 0.00 -3.20 -6.46 0.00 0.00 176.83 167.17 1b8w n ASN 23 N -2.53 1.51 -4.39 6.55 2.85 -1.26 -4.98 115.26 113.02 1b8w n ASN 23 Ca 0.00 -2.81 -0.45 0.00 -0.11 0.00 0.00 54.58 51.21 1b8w n ASN 23 Cb 0.00 -0.37 -0.03 0.00 1.24 0.00 0.00 39.78 40.62 1b8w n ASN 23 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1b8w n ARG 25 N 5.84 0.27 -3.92 0.00 1.74 -1.26 -4.79 116.66 114.54 1b8w n ARG 25 Ca 0.06 0.10 -0.30 0.00 -0.77 0.00 0.00 57.85 56.94 1b8w n ARG 25 Cb 0.46 -1.63 -0.04 0.00 -1.02 0.00 0.00 32.46 30.23 1b8w n ARG 25 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 1b8w s GLU 26 N 0.45 3.44 -0.86 5.56 2.12 -1.23 -1.10 118.70 127.09 1b8w s GLU 26 Ca 0.91 -0.46 -0.05 0.00 0.36 0.00 0.00 54.97 55.74 1b8w s GLU 26 Cb -1.22 -3.03 0.22 0.00 0.26 0.00 0.00 34.13 30.36 1b8w s GLU 26 CO 0.57 0.59 0.75 0.42 -0.54 0.00 0.00 175.26 177.06 1b8w s ILE 27 N -1.55 4.64 0.01 -3.70 1.01 -0.13 -4.86 121.20 116.62 1b8w s ILE 27 Ca 0.35 -3.41 -0.03 0.00 0.00 0.00 0.00 60.65 57.56 1b8w s ILE 27 Cb -0.13 -3.88 -0.01 0.00 0.01 0.00 0.00 42.46 38.45 1b8w s ILE 27 CO 0.28 -1.05 1.04 -0.26 0.00 0.00 0.00 174.94 174.96 1b8w h PHE 28 N 6.57 -0.14 -0.46 3.97 -1.00 -1.97 0.20 116.94 124.11 1b8w h PHE 28 Ca 0.12 0.01 0.12 0.00 2.81 0.00 0.00 57.97 61.02 1b8w h PHE 28 Cb 0.88 0.07 -0.09 0.00 3.61 0.00 0.00 35.95 40.43 1b8w h PHE 28 CO 0.77 -0.03 -0.03 1.28 -1.61 0.00 0.00 178.31 178.69 1b8w n LEU 29 N -3.08 -0.09 -4.90 1.54 4.77 -1.26 -4.08 117.00 109.91 1b8w n LEU 29 Ca -0.00 0.79 -0.33 0.00 -0.03 0.00 0.00 56.01 56.43 1b8w n LEU 29 Cb 0.02 -0.27 -0.05 0.00 -2.33 0.00 0.00 43.42 40.79 1b8w n LEU 29 CO -0.01 -0.78 -0.13 0.00 -1.33 0.00 0.00 177.39 175.14 1b8w s ALA 30 N -5.37 3.94 0.30 -1.18 0.00 0.06 -3.80 121.76 115.71 1b8w s ALA 30 Ca -0.06 -0.73 0.03 0.00 0.00 0.00 0.00 51.96 51.20 1b8w s ALA 30 Cb 0.13 -1.92 0.03 0.00 0.00 0.00 0.00 23.12 21.36 1b8w s ALA 30 CO 0.36 0.73 0.24 -0.25 0.00 0.00 0.00 175.76 176.84 1b8w n ASP 31 N 0.88 1.88 -0.03 0.00 9.92 0.39 -4.33 116.55 125.26 1b8w n ASP 31 Ca -0.10 -2.01 0.00 0.00 -0.53 0.00 0.00 54.79 52.15 1b8w n ASP 31 Cb 0.52 -0.04 0.00 0.00 -0.64 0.00 0.00 41.12 40.96 1b8w n ASP 31 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1b8w n TYR 33 N 0.00 0.00 0.17 0.00 4.01 -1.26 -4.59 117.16 115.49 1b8w n TYR 33 Ca 0.00 0.00 0.12 0.00 -0.16 0.00 0.00 57.90 57.86 1b8w n TYR 33 Cb 0.00 0.02 0.02 0.00 -0.31 0.00 0.00 39.34 39.08 1b8w n TYR 33 CO 0.00 0.00 0.00 -0.91 -0.46 0.00 0.00 176.86 175.49 1b8w h ASN 34 N 0.00 0.00 0.00 7.72 2.35 -1.98 -3.48 115.58 120.19 1b8w h ASN 34 Ca 0.00 -0.03 0.00 0.00 -0.55 0.00 0.00 56.30 55.72 1b8w h ASN 34 Cb 0.22 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.59 1b8w h ASN 34 CO 0.00 0.02 0.00 0.47 -1.65 0.00 0.00 177.43 176.27 1b8w n ASP 35 N -2.61 0.00 0.00 5.81 9.92 -1.26 -4.70 116.55 123.70 1b8w n ASP 35 Ca 0.01 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.27 1b8w n ASP 35 Cb 0.53 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 41.01 1b8w n ASP 35 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1b8w n GLY 36 N -2.00 -0.32 3.51 0.44 0.00 -1.26 -5.05 105.19 100.52 1b8w n GLY 36 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 1b8w n GLY 36 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1b8w s GLN 37 N -0.20 1.84 0.12 1.61 -0.21 -1.26 -3.86 119.66 117.70 1b8w s GLN 37 Ca 0.00 -1.65 0.00 0.00 0.02 0.00 0.00 55.36 53.73 1b8w s GLN 37 Cb 0.00 -1.89 -0.00 0.00 1.00 0.00 0.00 33.01 32.12 1b8w s GLN 37 CO 0.00 0.35 0.01 0.36 -2.12 0.00 0.00 175.29 173.89 1b8w n LYS 38 N -0.61 1.43 -3.34 2.91 -0.00 -0.37 -3.97 118.16 114.22 1b8w n LYS 38 Ca -0.06 -0.94 -0.33 0.00 -0.00 0.00 0.00 58.31 56.98 1b8w n LYS 38 Cb 0.59 0.33 -0.06 0.00 -0.00 0.00 0.00 35.03 35.89 1b8w n LYS 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1b8w n ARG 41 N 1.42 1.00 -0.23 0.00 1.74 -0.26 -1.82 116.66 118.52 1b8w n ARG 41 Ca -0.23 -0.36 0.00 0.00 -0.77 0.00 0.00 57.85 56.49 1b8w n ARG 41 Cb 0.55 -1.54 0.00 0.00 -1.02 0.00 0.00 32.46 30.45 1b8w n ARG 41 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74