#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i8x s ILE 2 N 0.00 4.10 0.00 1.34 -1.09 -0.19 -4.87 121.20 120.49 1i8x s ILE 2 Ca 0.00 1.91 0.00 0.00 -2.23 0.00 0.00 60.65 60.33 1i8x s ILE 2 Cb 0.00 -4.22 0.00 0.00 -1.58 0.00 0.00 42.46 36.66 1i8x s ILE 2 CO 0.00 0.37 0.00 1.41 -1.23 0.00 0.00 174.94 175.49 1i8x n HIS 3 N 2.10 0.00 0.00 3.97 8.25 -1.26 -0.96 115.22 127.33 1i8x n HIS 3 Ca 0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.47 1i8x n HIS 3 Cb 0.47 0.02 0.00 0.00 1.12 0.00 0.00 29.99 31.60 1i8x n HIS 3 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1i8x n ASP 5 N 2.57 0.00 -1.85 0.00 -0.08 -1.26 -4.85 116.55 111.09 1i8x n ASP 5 Ca 0.00 -0.78 -0.21 0.00 -1.51 0.00 0.00 54.79 52.29 1i8x n ASP 5 Cb 0.00 -0.00 -0.06 0.00 2.34 0.00 0.00 41.12 43.40 1i8x n ASP 5 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1i8x n ALA 6 N -1.00 -0.41 0.00 -1.67 0.00 -0.97 -4.77 120.51 111.69 1i8x n ALA 6 Ca 0.19 0.28 0.00 0.00 0.00 0.00 0.00 53.44 53.91 1i8x n ALA 6 Cb 0.09 -2.09 0.00 0.00 0.00 0.00 0.00 19.45 17.45 1i8x n ALA 6 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1i8x n ALA 7 N 0.29 2.51 -2.82 0.00 0.00 -1.26 -5.07 120.51 114.17 1i8x n ALA 7 Ca -0.22 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 52.94 1i8x n ALA 7 Cb 0.68 0.49 -0.05 0.00 0.00 0.00 0.00 19.45 20.56 1i8x n ALA 7 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 1i8x s THR 8 N -1.99 4.70 -0.09 0.00 -1.32 -1.26 -5.12 115.64 110.57 1i8x s THR 8 Ca 0.00 -0.84 0.00 0.00 -1.21 0.00 0.00 61.69 59.65 1i8x s THR 8 Cb 0.00 -3.34 -0.03 0.00 -1.51 0.00 0.00 72.50 67.62 1i8x s THR 8 CO 0.00 0.01 -0.09 -0.63 -2.21 0.00 0.00 174.62 171.70 1i8x s ILE 9 N -1.58 3.50 0.11 5.08 1.01 -1.26 -4.30 121.20 123.77 1i8x s ILE 9 Ca 0.31 -0.53 0.01 0.00 0.00 0.00 0.00 60.65 60.43 1i8x s ILE 9 Cb -0.11 -2.45 -0.04 0.00 0.01 0.00 0.00 42.46 39.87 1i8x s ILE 9 CO 0.24 0.57 -0.02 0.00 0.00 0.00 0.00 174.94 175.73 1i8x s PRO 11 N -3.91 3.43 0.00 0.00 0.04 -1.26 -1.02 135.00 132.27 1i8x s PRO 11 Ca 0.16 1.91 0.06 0.00 0.04 0.00 0.00 61.00 63.17 1i8x s PRO 11 Cb 0.06 -2.26 0.28 0.00 0.04 0.00 0.00 34.50 32.62 1i8x s PRO 11 CO -0.02 -0.86 1.11 -3.47 0.04 0.00 0.00 177.00 173.80 1i8x n ASP 12 N -0.87 0.00 -1.76 6.66 2.03 -1.26 -1.94 116.55 119.41 1i8x n ASP 12 Ca 0.09 0.34 -0.11 0.00 0.52 0.00 0.00 54.79 55.63 1i8x n ASP 12 Cb 0.48 -0.39 0.23 0.00 -0.72 0.00 0.00 41.12 40.72 1i8x n ASP 12 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1i8x n GLY 13 N -0.82 4.35 3.32 0.27 0.00 -1.26 -4.94 105.19 106.10 1i8x n GLY 13 Ca 0.02 -1.10 -0.14 0.00 0.00 0.00 0.00 46.02 44.80 1i8x n GLY 13 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1i8x s THR 14 N -3.17 0.00 0.21 2.61 -4.23 -0.82 -4.25 115.64 106.00 1i8x s THR 14 Ca 0.52 -1.86 0.08 0.00 -1.18 0.00 0.00 61.69 59.25 1i8x s THR 14 Cb 0.44 -2.49 -0.05 0.00 1.34 0.00 0.00 72.50 71.75 1i8x s THR 14 CO 0.08 0.00 -0.14 0.28 -0.54 0.00 0.00 174.62 174.30 1i8x s THR 15 N -3.77 1.76 -0.36 3.99 -1.32 -0.40 -4.88 115.64 110.66 1i8x s THR 15 Ca 0.36 -2.22 -0.29 0.00 -1.21 0.00 0.00 61.69 58.33 1i8x s THR 15 Cb 0.04 -2.06 0.00 0.00 -1.51 0.00 0.00 72.50 68.97 1i8x s THR 15 CO 0.17 -0.58 1.44 0.00 -2.21 0.00 0.00 174.62 173.44 1i8x s SER 17 N 3.92 3.61 -0.23 0.00 0.15 -0.52 -4.96 113.70 115.67 1i8x s SER 17 Ca 0.63 -0.36 -0.12 0.00 0.70 0.00 0.00 55.95 56.80 1i8x s SER 17 Cb -0.16 -0.97 -0.05 0.00 -1.71 0.00 0.00 66.02 63.13 1i8x s SER 17 CO 0.30 0.27 0.23 -0.76 1.20 0.00 0.00 173.24 174.48 1i8x s LEU 18 N -0.29 4.13 0.68 3.45 1.43 -1.25 -1.27 118.68 125.56 1i8x s LEU 18 Ca 0.01 0.23 -0.11 0.00 -1.03 0.00 0.00 54.13 53.24 1i8x s LEU 18 Cb -0.13 -2.22 0.01 0.00 0.03 0.00 0.00 46.19 43.88 1i8x s LEU 18 CO 0.03 0.03 1.06 -0.94 0.23 0.00 0.00 176.35 176.75 1i8x s SER 19 N 1.02 5.57 0.16 2.29 1.04 -0.11 -4.81 113.70 118.86 1i8x s SER 19 Ca 0.11 1.11 0.08 0.00 0.48 0.00 0.00 55.95 57.72 1i8x s SER 19 Cb -0.14 -1.97 0.41 0.00 0.10 0.00 0.00 66.02 64.43 1i8x s SER 19 CO 0.05 -1.24 1.12 -0.81 0.98 0.00 0.00 173.24 173.34 1i8x n PRO 20 N -2.91 0.05 -1.00 4.02 -0.04 -1.26 -0.37 135.00 133.49 1i8x n PRO 20 Ca 0.06 0.47 -0.05 0.00 -0.04 0.00 0.00 63.50 63.94 1i8x n PRO 20 Cb 0.57 -1.85 0.16 0.00 -0.04 0.00 0.00 33.50 32.34 1i8x n PRO 20 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1i8x n TYR 21 N -1.72 1.07 -3.57 0.54 4.01 -1.26 -4.97 117.16 111.26 1i8x n TYR 21 Ca -0.01 -1.75 -0.23 0.00 -0.16 0.00 0.00 57.90 55.76 1i8x n TYR 21 Cb 0.19 -0.40 0.05 0.00 -0.31 0.00 0.00 39.34 38.87 1i8x n TYR 21 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1i8x n GLY 22 N -1.03 -0.71 3.25 2.72 0.00 0.50 -4.99 105.19 104.93 1i8x n GLY 22 Ca 0.31 0.33 -0.33 0.00 0.00 0.00 0.00 46.02 46.33 1i8x n GLY 22 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1i8x s VAL 23 N -3.53 2.71 -0.88 1.61 1.01 -1.24 -4.84 120.40 115.25 1i8x s VAL 23 Ca 0.25 -0.74 -0.22 0.00 0.00 0.00 0.00 61.98 61.27 1i8x s VAL 23 Cb -0.06 -2.16 0.08 0.00 0.00 0.00 0.00 36.38 34.24 1i8x s VAL 23 CO 0.80 0.50 1.20 0.26 0.00 0.00 0.00 175.10 177.87 1i8x s TRP 24 N 0.98 2.76 0.30 5.22 0.52 -1.26 -0.93 118.94 126.53 1i8x s TRP 24 Ca -0.02 -0.91 0.09 0.00 0.02 0.00 0.00 56.10 55.28 1i8x s TRP 24 Cb -0.15 -4.44 -0.05 0.00 -1.15 0.00 0.00 33.47 27.68 1i8x s TRP 24 CO -0.02 -1.72 0.02 1.52 0.02 0.00 0.00 176.95 176.77 1i8x s TYR 25 N 3.97 2.65 -0.25 -1.98 1.13 -0.40 -4.92 117.35 117.55 1i8x s TYR 25 Ca 0.35 -0.31 -0.24 0.00 -1.41 0.00 0.00 57.07 55.45 1i8x s TYR 25 Cb -0.06 -1.35 -0.00 0.00 -1.10 0.00 0.00 41.96 39.44 1i8x s TYR 25 CO -0.03 0.53 0.82 0.00 -2.51 0.00 0.00 175.55 174.36 1i8x s SER 27 N 1.39 4.70 0.04 0.00 0.15 -0.51 -4.89 113.70 114.58 1i8x s SER 27 Ca 0.34 -0.68 -0.30 0.00 0.70 0.00 0.00 55.95 56.01 1i8x s SER 27 Cb -0.15 -1.78 -0.06 0.00 -1.71 0.00 0.00 66.02 62.32 1i8x s SER 27 CO 0.08 -0.13 1.26 -2.84 1.20 0.00 0.00 173.24 172.81 1i8x s PRO 28 N 1.44 4.38 0.00 5.44 0.02 -1.26 -1.27 135.00 143.75 1i8x s PRO 28 Ca 0.03 1.83 0.22 0.00 0.02 0.00 0.00 61.00 63.10 1i8x s PRO 28 Cb -0.16 -3.41 0.17 0.00 0.02 0.00 0.00 34.50 31.11 1i8x s PRO 28 CO -0.01 -0.37 1.20 1.97 -0.33 0.00 0.00 177.00 179.46 1i8x n PHE 29 N 4.40 0.00 -1.83 6.54 1.16 -1.26 -4.99 117.46 121.48 1i8x n PHE 29 Ca 0.10 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.68 1i8x n PHE 29 Cb 0.45 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 38.32 1i8x n PHE 29 CO 0.00 0.00 0.00 0.43 -1.87 0.00 0.00 176.76 175.32