#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 4.78 0.16 1.34 -1.09 -0.33 -4.89 121.20 121.17 1i8x s ILE 2 Ca 0.00 -1.18 0.00 0.00 -2.23 0.00 0.00 60.65 57.24 1i8x s ILE 2 Cb 0.00 -3.57 0.00 0.00 -1.58 0.00 0.00 42.46 37.31 1i8x s ILE 2 CO 0.00 -0.30 0.00 1.41 -1.23 0.00 0.00 174.94 174.82 1i8x n HIS 3 N -1.12 -1.33 0.00 3.97 8.25 -1.26 -2.53 115.22 121.20 1i8x n HIS 3 Ca -0.08 0.23 0.00 0.00 -0.26 0.00 0.00 57.72 57.61 1i8x n HIS 3 Cb 0.57 0.48 0.00 0.00 1.12 0.00 0.00 29.99 32.16 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 2.44 0.00 -1.77 0.00 2.03 -1.26 -4.86 116.55 113.13 1i8x n ASP 5 Ca 0.00 -0.13 -0.18 0.00 0.52 0.00 0.00 54.79 55.01 1i8x n ASP 5 Cb 0.00 -0.25 -0.06 0.00 -0.72 0.00 0.00 41.12 40.10 1i8x n ASP 5 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1i8x n ALA 6 N -1.25 -0.39 0.00 -1.67 0.00 -0.94 -4.68 120.51 111.59 1i8x n ALA 6 Ca 0.12 0.25 0.00 0.00 0.00 0.00 0.00 53.44 53.80 1i8x n ALA 6 Cb 0.16 -1.83 0.00 0.00 0.00 0.00 0.00 19.45 17.78 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 0.14 0.66 -3.73 0.00 0.00 -1.26 -4.99 120.51 111.33 1i8x n ALA 7 Ca -0.19 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 52.96 1i8x n ALA 7 Cb 0.60 0.01 -0.14 0.00 0.00 0.00 0.00 19.45 19.93 1i8x n ALA 7 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1i8x s THR 8 N -0.66 1.20 0.21 0.00 2.01 -1.26 -5.11 115.64 112.03 1i8x s THR 8 Ca 0.00 -2.07 -0.31 0.00 0.31 0.00 0.00 61.69 59.62 1i8x s THR 8 Cb 0.00 -1.86 -0.10 0.00 0.01 0.00 0.00 72.50 70.54 1i8x s THR 8 CO 0.00 -0.80 1.53 -0.63 -0.69 0.00 0.00 174.62 174.02 1i8x s ILE 9 N 0.89 2.55 0.18 1.82 1.01 -1.26 -4.65 121.20 121.74 1i8x s ILE 9 Ca 0.14 0.43 0.11 0.00 0.00 0.00 0.00 60.65 61.33 1i8x s ILE 9 Cb -0.21 -3.27 -0.04 0.00 0.01 0.00 0.00 42.46 38.94 1i8x s ILE 9 CO -0.10 0.05 -0.24 0.00 0.00 0.00 0.00 174.94 174.65 1i8x n PRO 11 N 0.41 1.87 0.25 0.00 -0.02 -1.26 -1.19 135.00 135.06 1i8x n PRO 11 Ca -0.14 0.67 0.17 0.00 -2.02 0.00 0.00 63.50 62.18 1i8x n PRO 11 Cb 0.55 -2.37 0.90 0.00 -0.02 0.00 0.00 33.50 32.57 1i8x n PRO 11 CO 0.00 0.00 0.00 0.22 1.98 0.00 0.00 175.50 177.70 1i8x h ASP 12 N 2.00 0.00 -0.41 2.55 1.82 -1.96 -0.16 116.42 120.26 1i8x h ASP 12 Ca -0.48 0.00 -0.05 0.00 -0.39 0.00 0.00 57.03 56.11 1i8x h ASP 12 Cb 1.30 0.00 -0.03 0.00 0.68 0.00 0.00 39.33 41.28 1i8x h ASP 12 CO 0.59 0.00 0.06 0.61 -1.61 0.00 0.00 179.24 178.90 1i8x n GLY 13 N -1.33 2.62 3.27 -0.78 0.00 -1.26 -4.91 105.19 102.80 1i8x n GLY 13 Ca -0.00 -0.61 -0.15 0.00 0.00 0.00 0.00 46.02 45.27 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 -2.12 0.00 0.12 2.61 -4.23 -0.07 -3.90 115.64 108.03 1i8x s THR 14 Ca 0.35 -1.94 0.05 0.00 -1.18 0.00 0.00 61.69 58.98 1i8x s THR 14 Cb 0.27 -2.49 -0.04 0.00 1.34 0.00 0.00 72.50 71.58 1i8x s THR 14 CO 0.10 0.00 -0.12 0.28 -0.54 0.00 0.00 174.62 174.33 1i8x s THR 15 N -3.83 1.20 -0.13 3.99 -1.32 -0.26 -4.82 115.64 110.47 1i8x s THR 15 Ca 0.38 -1.73 -0.29 0.00 -1.21 0.00 0.00 61.69 58.84 1i8x s THR 15 Cb 0.04 -1.51 -0.02 0.00 -1.51 0.00 0.00 72.50 69.50 1i8x s THR 15 CO 0.18 -0.49 1.34 0.00 -2.21 0.00 0.00 174.62 173.44 1i8x s SER 17 N 2.22 1.22 -0.18 0.00 0.15 -0.18 -4.95 113.70 111.98 1i8x s SER 17 Ca 0.59 -0.19 -0.09 0.00 0.70 0.00 0.00 55.95 56.96 1i8x s SER 17 Cb -0.24 -0.32 -0.05 0.00 -1.71 0.00 0.00 66.02 63.70 1i8x s SER 17 CO 0.18 0.07 0.13 -0.76 1.20 0.00 0.00 173.24 174.06 1i8x s LEU 18 N 0.18 4.26 0.72 3.45 1.43 -1.26 -1.14 118.68 126.31 1i8x s LEU 18 Ca -0.03 0.29 -0.11 0.00 -1.03 0.00 0.00 54.13 53.25 1i8x s LEU 18 Cb -0.08 -2.09 0.02 0.00 0.03 0.00 0.00 46.19 44.07 1i8x s LEU 18 CO 0.00 0.24 1.08 -0.94 0.23 0.00 0.00 176.35 176.96 1i8x s SER 19 N 0.00 5.27 0.00 2.29 1.04 -0.38 -4.86 113.70 117.07 1i8x s SER 19 Ca 0.10 1.31 0.00 0.00 0.48 0.00 0.00 55.95 57.84 1i8x s SER 19 Cb -0.11 -2.15 0.00 0.00 0.10 0.00 0.00 66.02 63.86 1i8x s SER 19 CO -0.00 -1.48 0.81 -2.65 0.98 0.00 0.00 173.24 170.90 1i8x n PRO 20 N -3.12 0.00 -0.22 4.02 -0.02 -1.26 -0.73 135.00 133.68 1i8x n PRO 20 Ca 0.07 0.31 0.09 0.00 -2.02 0.00 0.00 63.50 61.95 1i8x n PRO 20 Cb 0.56 -1.51 0.18 0.00 -0.02 0.00 0.00 33.50 32.71 1i8x n PRO 20 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1i8x n TYR 21 N -1.31 0.31 -3.10 6.00 4.01 -1.26 -4.98 117.16 116.84 1i8x n TYR 21 Ca 0.00 -0.99 -0.14 0.00 -0.16 0.00 0.00 57.90 56.61 1i8x n TYR 21 Cb 0.01 -0.21 0.06 0.00 -0.31 0.00 0.00 39.34 38.89 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 -1.14 -0.14 3.16 2.72 0.00 0.10 -5.02 105.19 104.87 1i8x n GLY 22 Ca 0.18 -0.05 -0.34 0.00 0.00 0.00 0.00 46.02 45.82 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 -3.25 2.48 -0.02 1.61 1.01 -1.25 -4.87 120.40 116.10 1i8x s VAL 23 Ca 0.10 -1.01 -0.30 0.00 0.00 0.00 0.00 61.98 60.77 1i8x s VAL 23 Cb -0.05 -2.18 -0.05 0.00 0.00 0.00 0.00 36.38 34.11 1i8x s VAL 23 CO 0.53 0.34 1.38 0.26 0.00 0.00 0.00 175.10 177.62 1i8x s TRP 24 N 1.30 2.84 -0.03 5.22 0.52 -1.26 -1.24 118.94 126.27 1i8x s TRP 24 Ca 0.02 0.84 -0.11 0.00 0.02 0.00 0.00 56.10 56.86 1i8x s TRP 24 Cb -0.15 -3.64 0.02 0.00 -1.15 0.00 0.00 33.47 28.55 1i8x s TRP 24 CO -0.08 -2.35 0.25 1.52 0.02 0.00 0.00 176.95 176.31 1i8x s TYR 25 N 2.56 -0.15 -0.19 -1.98 1.13 -0.29 -5.00 117.35 113.42 1i8x s TYR 25 Ca 0.63 0.29 -0.19 0.00 -1.41 0.00 0.00 57.07 56.38 1i8x s TYR 25 Cb -0.30 0.06 -0.03 0.00 -1.10 0.00 0.00 41.96 40.59 1i8x s TYR 25 CO 0.25 -0.29 0.55 0.00 -2.51 0.00 0.00 175.55 173.55 1i8x s SER 27 N 1.14 4.88 -0.03 0.00 0.15 -0.38 -4.83 113.70 114.63 1i8x s SER 27 Ca 0.25 -0.14 -0.30 0.00 0.70 0.00 0.00 55.95 56.46 1i8x s SER 27 Cb -0.16 -1.82 -0.03 0.00 -1.71 0.00 0.00 66.02 62.30 1i8x s SER 27 CO 0.10 0.13 1.16 -2.16 1.20 0.00 0.00 173.24 173.67 1i8x s PRO 28 N 0.63 4.39 -0.02 5.44 0.04 -1.26 -1.11 135.00 143.12 1i8x s PRO 28 Ca -0.01 1.64 0.20 0.00 0.04 0.00 0.00 61.00 62.87 1i8x s PRO 28 Cb -0.14 -3.51 -0.28 0.00 0.04 0.00 0.00 34.50 30.61 1i8x s PRO 28 CO 0.02 -0.36 0.62 1.97 0.04 0.00 0.00 177.00 179.29 1i8x n PHE 29 N 4.81 0.00 1.40 0.56 1.16 -1.25 -4.99 117.46 119.15 1i8x n PHE 29 Ca 0.10 0.00 0.14 0.00 -1.87 0.00 0.00 57.45 55.81 1i8x n PHE 29 Cb 0.47 -0.28 0.44 0.00 -1.61 0.00 0.00 39.48 38.51 1i8x n PHE 29 CO 0.00 0.00 0.00 -1.13 -1.87 0.00 0.00 176.76 173.76