#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b8w s VAL 2 N 0.00 5.01 0.06 -4.37 1.01 -1.26 -5.04 120.40 115.81 1b8w s VAL 2 Ca 0.00 0.64 0.00 0.00 0.00 0.00 0.00 61.98 62.63 1b8w s VAL 2 Cb 0.00 -3.93 -0.00 0.00 0.00 0.00 0.00 36.38 32.45 1b8w s VAL 2 CO 0.00 -0.10 0.01 0.00 0.00 0.00 0.00 175.10 175.01 1b8w n GLN 3 N 5.72 1.29 0.00 2.72 6.02 -1.26 -5.09 117.38 126.78 1b8w n GLN 3 Ca -0.04 -0.48 0.00 0.00 -0.01 0.00 0.00 57.00 56.48 1b8w n GLN 3 Cb 0.49 0.20 0.00 0.00 1.02 0.00 0.00 30.24 31.95 1b8w n GLN 3 CO 0.00 0.00 0.00 1.58 -1.01 0.00 0.00 177.06 177.63 1b8w n HIS 4 N -0.14 -0.07 -3.54 1.08 -0.00 -1.26 -5.10 115.22 106.18 1b8w n HIS 4 Ca -0.02 0.00 -0.32 0.00 0.46 0.00 0.00 57.72 57.84 1b8w n HIS 4 Cb 0.08 0.31 -0.05 0.00 -0.12 0.00 0.00 29.99 30.21 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 -1.62 3.73 0.00 1.57 3.00 -1.26 -5.07 118.95 119.31 1b8w s ARG 5 Ca 0.00 0.12 0.00 0.00 0.00 0.00 0.00 55.73 55.85 1b8w s ARG 5 Cb 0.00 -2.80 0.00 0.00 0.00 0.00 0.00 34.95 32.15 1b8w s ARG 5 CO 0.00 0.43 0.16 -0.35 0.00 0.00 0.00 175.30 175.53 1b8w n PRO 6 N 0.19 0.00 -3.64 3.54 -0.04 -1.26 -5.03 135.00 128.76 1b8w n PRO 6 Ca -0.02 0.00 -0.15 0.00 -0.04 0.00 0.00 63.50 63.28 1b8w n PRO 6 Cb 0.52 -0.56 -0.07 0.00 -0.04 0.00 0.00 33.50 33.34 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 -0.31 0.84 1.12 0.54 0.52 -1.25 -5.03 118.95 115.37 1b8w s ARG 7 Ca 0.00 0.18 -0.18 0.00 -0.52 0.00 0.00 55.73 55.21 1b8w s ARG 7 Cb 0.00 0.39 0.25 0.00 0.52 0.00 0.00 34.95 36.12 1b8w s ARG 7 CO 0.00 -0.23 1.17 0.16 0.02 0.00 0.00 175.30 176.42 1b8w s ASP 8 N -0.98 1.68 -0.25 0.23 -4.77 -1.26 0.39 116.67 111.71 1b8w s ASP 8 Ca -0.10 0.54 -0.10 0.00 -3.30 0.00 0.00 52.55 49.59 1b8w s ASP 8 Cb -0.03 -0.74 -0.12 0.00 -1.09 0.00 0.00 42.92 40.95 1b8w s ASP 8 CO 0.06 -3.64 -0.30 0.00 0.70 0.00 0.00 175.17 171.99 1b8w h GLU 10 N -0.74 0.39 0.00 0.00 4.81 -1.83 0.24 114.58 117.45 1b8w h GLU 10 Ca -0.62 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 58.57 1b8w h GLU 10 Cb 1.60 -0.08 -0.00 0.00 0.63 0.00 0.00 28.75 30.90 1b8w h GLU 10 CO -0.33 0.30 -0.02 1.03 -0.73 0.00 0.00 179.01 179.26 1b8w h SER 11 N 0.39 0.00 -0.12 1.04 0.87 -1.89 -2.26 113.55 111.57 1b8w h SER 11 Ca 0.10 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.66 1b8w h SER 11 Cb 0.03 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.99 1b8w h SER 11 CO -0.02 0.02 0.00 2.30 -0.53 0.00 0.00 176.83 178.60 1b8w n ILE 12 N -3.13 0.13 -2.23 2.23 -5.35 -0.38 -4.95 119.36 105.68 1b8w n ILE 12 Ca 0.00 -0.57 0.00 0.00 -0.27 0.00 0.00 62.75 61.92 1b8w n ILE 12 Cb 0.29 1.36 0.00 0.00 -1.74 0.00 0.00 39.64 39.56 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 1.38 -1.89 -4.51 7.28 4.05 -0.85 -5.08 115.26 115.65 1b8w n ASN 13 Ca 0.15 0.00 -0.27 0.00 0.45 0.00 0.00 54.58 54.91 1b8w n ASN 13 Cb 0.60 -0.47 -0.09 0.00 1.23 0.00 0.00 39.78 41.04 1b8w n ASN 13 CO 0.00 0.00 0.00 -0.83 -3.05 0.00 0.00 177.26 173.38 1b8w s GLY 14 N -2.93 2.56 0.15 8.20 0.00 -0.07 -4.70 107.32 110.54 1b8w s GLY 14 Ca 0.00 -1.48 0.07 0.00 0.00 0.00 0.00 44.72 43.30 1b8w s GLY 14 CO 0.00 -2.00 0.00 0.54 0.00 0.00 0.00 173.10 171.65 1b8w s VAL 15 N -3.02 3.81 -0.62 1.40 0.11 -0.74 -3.88 120.40 117.46 1b8w s VAL 15 Ca 0.25 -1.30 -0.11 0.00 -2.93 0.00 0.00 61.98 57.89 1b8w s VAL 15 Cb 0.06 -2.89 0.16 0.00 -1.53 0.00 0.00 36.38 32.18 1b8w s VAL 15 CO 0.12 -0.05 0.52 0.00 -3.33 0.00 0.00 175.10 172.37 1b8w n ARG 17 N 4.43 3.25 -3.16 0.00 0.63 -0.63 -4.86 116.66 116.30 1b8w n ARG 17 Ca 0.01 0.00 -0.39 0.00 -0.92 0.00 0.00 57.85 56.55 1b8w n ARG 17 Cb 0.42 0.00 -0.06 0.00 0.45 0.00 0.00 32.46 33.27 1b8w n ARG 17 CO 0.00 0.00 0.00 -1.58 -2.51 0.00 0.00 177.63 173.54 1b8w s HIS 18 N 1.23 3.74 -2.00 -0.14 2.46 -1.26 -1.24 115.29 118.08 1b8w s HIS 18 Ca 0.00 1.30 0.05 0.00 0.47 0.00 0.00 55.06 56.88 1b8w s HIS 18 Cb 0.00 -2.64 0.30 0.00 -0.13 0.00 0.00 32.58 30.11 1b8w s HIS 18 CO 0.00 0.40 0.69 0.36 -2.47 0.00 0.00 174.74 173.72 1b8w n LYS 19 N 2.43 0.22 -0.59 2.88 2.85 -1.24 -0.95 118.16 123.76 1b8w n LYS 19 Ca -0.07 0.00 0.05 0.00 -1.05 0.00 0.00 58.31 57.24 1b8w n LYS 19 Cb 0.51 -1.36 0.08 0.00 -0.65 0.00 0.00 35.03 33.60 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 -0.86 1.13 0.00 -5.58 2.03 -1.26 -5.00 116.55 107.01 1b8w n ASP 20 Ca 0.04 -2.61 0.00 0.00 0.52 0.00 0.00 54.79 52.74 1b8w n ASP 20 Cb 0.02 -0.34 0.00 0.00 -0.72 0.00 0.00 41.12 40.08 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 -0.49 0.00 0.04 5.18 -1.04 -0.13 -5.01 114.28 112.83 1b8w n THR 21 Ca 0.09 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.10 1b8w n THR 21 Cb 0.77 -0.39 0.00 0.00 -1.82 0.00 0.00 70.33 68.89 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 -2.47 12.58 3.14 -1.26 -4.99 118.33 125.34 1b8w n VAL 22 Ca 0.00 0.00 -0.10 0.00 -2.96 0.00 0.00 64.34 61.28 1b8w n VAL 22 Cb 0.00 0.00 0.04 0.00 -1.06 0.00 0.00 33.84 32.82 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 -2.48 2.94 -3.60 6.55 2.85 -1.26 -4.93 115.26 115.33 1b8w n ASN 23 Ca 0.00 -2.77 -0.34 0.00 -0.11 0.00 0.00 54.58 51.35 1b8w n ASN 23 Cb 0.00 -0.42 -0.03 0.00 1.24 0.00 0.00 39.78 40.57 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 0.77 0.00 -4.05 0.00 5.12 -1.26 -4.44 116.66 112.80 1b8w n ARG 25 Ca 0.31 0.00 -0.33 0.00 -1.93 0.00 0.00 57.85 55.90 1b8w n ARG 25 Cb 0.36 0.00 -0.06 0.00 -1.16 0.00 0.00 32.46 31.60 1b8w n ARG 25 CO 0.00 0.00 0.00 -2.00 -1.93 0.00 0.00 177.63 173.70 1b8w s GLU 26 N 0.00 3.15 -1.01 5.56 2.12 -1.23 -1.18 118.70 126.10 1b8w s GLU 26 Ca 0.00 -0.46 -0.09 0.00 0.36 0.00 0.00 54.97 54.78 1b8w s GLU 26 Cb 0.00 -2.91 0.26 0.00 0.26 0.00 0.00 34.13 31.73 1b8w s GLU 26 CO 0.00 0.65 0.98 0.42 -0.54 0.00 0.00 175.26 176.77 1b8w s ILE 27 N -1.24 5.65 0.00 -3.70 1.01 -0.12 -4.86 121.20 117.94 1b8w s ILE 27 Ca 0.24 -3.27 0.00 0.00 0.00 0.00 0.00 60.65 57.63 1b8w s ILE 27 Cb -0.12 -4.43 0.00 0.00 0.01 0.00 0.00 42.46 37.92 1b8w s ILE 27 CO 0.16 -1.13 0.89 0.49 0.00 0.00 0.00 174.94 175.35 1b8w n PHE 28 N 2.94 0.00 -0.04 3.97 3.72 -1.26 -1.17 117.46 125.62 1b8w n PHE 28 Ca 0.21 0.00 0.02 0.00 -0.05 0.00 0.00 57.45 57.63 1b8w n PHE 28 Cb 0.41 -0.39 0.04 0.00 -0.94 0.00 0.00 39.48 38.59 1b8w n PHE 28 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 1b8w n LEU 29 N -2.53 -0.02 0.00 4.37 4.77 -1.26 -4.23 117.00 118.10 1b8w n LEU 29 Ca 0.00 0.21 -0.19 0.00 -0.03 0.00 0.00 56.01 56.00 1b8w n LEU 29 Cb 0.00 -0.08 0.07 0.00 -2.33 0.00 0.00 43.42 41.09 1b8w n LEU 29 CO 0.00 -0.21 0.39 0.00 -1.33 0.00 0.00 177.39 176.23 1b8w n ALA 30 N -3.61 1.04 -2.34 -1.18 0.00 -0.32 -3.97 120.51 110.13 1b8w n ALA 30 Ca 0.03 -2.01 -0.21 0.00 0.00 0.00 0.00 53.44 51.25 1b8w n ALA 30 Cb 0.09 0.51 -0.08 0.00 0.00 0.00 0.00 19.45 19.98 1b8w n ALA 30 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1b8w s ASP 31 N -4.56 1.94 0.00 0.00 1.11 1.26 -4.78 116.67 111.64 1b8w s ASP 31 Ca 0.60 -1.75 0.00 0.00 0.18 0.00 0.00 52.55 51.58 1b8w s ASP 31 Cb -0.05 0.56 0.00 0.00 1.07 0.00 0.00 42.92 44.51 1b8w s ASP 31 CO 0.38 -1.05 0.00 0.00 1.18 0.00 0.00 175.17 175.69 1b8w n TYR 33 N 0.00 0.00 0.16 0.00 4.01 -1.26 -4.70 117.16 115.37 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 0.00 0.03 0.00 -0.31 0.00 0.00 39.34 39.06 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 0.06 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.43 1b8w h ASN 34 CO 0.00 0.01 0.00 -0.67 -1.65 0.00 0.00 177.43 175.12 1b8w n ASP 35 N -2.64 0.00 -0.09 5.81 2.03 -1.26 -4.64 116.55 115.76 1b8w n ASP 35 Ca 0.01 0.00 0.02 0.00 0.52 0.00 0.00 54.79 55.34 1b8w n ASP 35 Cb 0.54 0.00 -0.00 0.00 -0.72 0.00 0.00 41.12 40.93 1b8w n ASP 35 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1b8w n GLY 36 N -1.51 -0.13 3.72 0.27 0.00 -1.26 -5.02 105.19 101.25 1b8w n GLY 36 Ca 0.00 -0.13 -0.25 0.00 0.00 0.00 0.00 46.02 45.64 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 -0.96 2.58 0.50 1.61 -0.21 -1.26 -3.60 119.66 118.33 1b8w s GLN 37 Ca 0.04 -1.09 0.01 0.00 0.02 0.00 0.00 55.36 54.33 1b8w s GLN 37 Cb 0.04 -2.42 -0.00 0.00 1.00 0.00 0.00 33.01 31.62 1b8w s GLN 37 CO 0.13 0.44 0.04 -1.59 -2.12 0.00 0.00 175.29 172.19 1b8w s LYS 38 N -3.24 2.17 0.29 2.91 -2.85 -0.37 -4.01 119.74 114.64 1b8w s LYS 38 Ca 0.30 -2.40 -0.10 0.00 -1.00 0.00 0.00 55.97 52.77 1b8w s LYS 38 Cb -0.09 -1.25 -0.07 0.00 -2.06 0.00 0.00 37.83 34.36 1b8w s LYS 38 CO 0.21 -0.45 0.63 0.00 0.10 0.00 0.00 175.35 175.83 1b8w n ARG 41 N 1.05 0.50 -0.50 0.00 1.74 -0.33 -1.80 116.66 117.33 1b8w n ARG 41 Ca -0.20 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.88 1b8w n ARG 41 Cb 0.57 -1.25 0.00 0.00 -1.02 0.00 0.00 32.46 30.76 1b8w n ARG 41 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74