#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i8y s ASP 3 N 11.76 4.74 0.72 0.00 -1.08 -1.26 -4.68 116.67 126.88 1i8y s ASP 3 Ca 0.97 -1.15 0.00 0.00 -0.52 0.00 0.00 52.55 51.85 1i8y s ASP 3 Cb -0.18 0.36 0.00 0.00 -1.46 0.00 0.00 42.92 41.64 1i8y s ASP 3 CO 0.27 -1.14 0.00 0.00 0.52 0.00 0.00 175.17 174.82 1i8y n ALA 4 N -1.86 0.00 -2.89 3.66 0.00 -1.26 -3.60 120.51 114.56 1i8y n ALA 4 Ca 0.02 0.00 -0.44 0.00 0.00 0.00 0.00 53.44 53.03 1i8y n ALA 4 Cb 0.64 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.09 1i8y n ALA 4 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1i8y n ALA 5 N 4.06 4.61 -0.26 0.00 0.00 -1.26 -4.61 120.51 123.06 1i8y n ALA 5 Ca 0.00 -4.47 0.00 0.00 0.00 0.00 0.00 53.44 48.97 1i8y n ALA 5 Cb 0.00 -2.76 0.00 0.00 0.00 0.00 0.00 19.45 16.69 1i8y n ALA 5 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1i8y n THR 6 N 3.17 0.00 -3.38 0.00 -1.04 -1.24 -5.09 114.28 106.71 1i8y n THR 6 Ca 0.32 0.00 -0.18 0.00 -2.04 0.00 0.00 64.05 62.16 1i8y n THR 6 Cb 0.38 -0.44 0.01 0.00 -1.82 0.00 0.00 70.33 68.47 1i8y n THR 6 CO 0.00 0.00 0.00 -0.38 -0.64 0.00 0.00 175.07 174.05 1i8y n ILE 7 N -2.11 -6.69 -1.15 12.58 5.41 -1.26 -4.96 119.36 121.17 1i8y n ILE 7 Ca 0.00 0.08 -0.29 0.00 1.00 0.00 0.00 62.75 63.54 1i8y n ILE 7 Cb 0.00 -4.92 0.17 0.00 -0.71 0.00 0.00 39.64 34.18 1i8y n ILE 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1i8y n PRO 9 N -4.12 0.17 0.31 0.00 -0.02 -1.26 -4.79 135.00 125.29 1i8y n PRO 9 Ca 0.06 0.07 0.19 0.00 -2.02 0.00 0.00 63.50 61.80 1i8y n PRO 9 Cb 0.56 -1.37 1.05 0.00 -0.02 0.00 0.00 33.50 33.72 1i8y n PRO 9 CO 0.00 0.00 0.00 0.22 1.98 0.00 0.00 175.50 177.70 1i8y h ASP 10 N -0.25 0.00 -0.52 2.55 1.82 -2.03 -0.63 116.42 117.36 1i8y h ASP 10 Ca -0.44 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.20 1i8y h ASP 10 Cb 1.39 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.40 1i8y h ASP 10 CO 0.40 0.00 0.00 0.61 -1.61 0.00 0.00 179.24 178.64 1i8y n GLY 11 N -1.21 3.17 3.09 -0.78 0.00 -1.26 -4.95 105.19 103.25 1i8y n GLY 11 Ca -0.03 -0.94 -0.10 0.00 0.00 0.00 0.00 46.02 44.95 1i8y n GLY 11 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1i8y s THR 12 N -2.65 0.47 0.21 2.61 -4.23 -0.24 -3.12 115.64 108.69 1i8y s THR 12 Ca 0.52 -1.49 0.10 0.00 -1.18 0.00 0.00 61.69 59.63 1i8y s THR 12 Cb 0.39 -1.11 -0.04 0.00 1.34 0.00 0.00 72.50 73.08 1i8y s THR 12 CO 0.16 -0.69 -0.11 0.28 -0.54 0.00 0.00 174.62 173.72 1i8y s THR 13 N -2.67 3.05 -0.15 3.99 -1.32 -1.26 -4.59 115.64 112.70 1i8y s THR 13 Ca 0.00 -1.86 -0.01 0.00 -1.21 0.00 0.00 61.69 58.61 1i8y s THR 13 Cb -0.01 -2.55 -0.01 0.00 -1.51 0.00 0.00 72.50 68.42 1i8y s THR 13 CO -0.04 -0.21 -0.11 0.00 -2.21 0.00 0.00 174.62 172.05 1i8y s SER 15 N 0.57 -0.06 -0.44 0.00 0.01 -1.25 -1.69 113.70 110.84 1i8y s SER 15 Ca -0.07 0.10 -0.16 0.00 1.31 0.00 0.00 55.95 57.13 1i8y s SER 15 Cb -0.15 0.19 0.04 0.00 0.21 0.00 0.00 66.02 66.30 1i8y s SER 15 CO 0.03 -0.08 0.40 -0.22 0.41 0.00 0.00 173.24 173.78 1i8y s LEU 16 N -0.19 5.16 0.79 2.44 2.96 -1.26 -3.54 118.68 125.04 1i8y s LEU 16 Ca -0.02 -0.95 -0.13 0.00 -0.22 0.00 0.00 54.13 52.81 1i8y s LEU 16 Cb -0.02 -2.26 0.07 0.00 0.50 0.00 0.00 46.19 44.48 1i8y s LEU 16 CO 0.00 -0.59 1.17 -0.94 -1.32 0.00 0.00 176.35 174.68 1i8y s SER 17 N 2.06 3.84 0.48 3.68 1.04 -0.50 -4.86 113.70 119.44 1i8y s SER 17 Ca 0.08 2.24 0.27 0.00 0.48 0.00 0.00 55.95 59.02 1i8y s SER 17 Cb -0.20 -2.57 1.47 0.00 0.10 0.00 0.00 66.02 64.82 1i8y s SER 17 CO 0.10 -2.49 1.81 1.55 0.98 0.00 0.00 173.24 175.19 1i8y h PRO 18 N -0.88 0.00 0.08 4.02 0.13 -1.97 0.19 132.00 133.58 1i8y h PRO 18 Ca -0.46 0.00 -0.28 0.00 -0.87 0.00 0.00 66.00 64.39 1i8y h PRO 18 Cb 1.28 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.39 1i8y h PRO 18 CO 0.47 0.00 -1.43 1.88 -0.23 0.00 0.00 178.00 178.69 1i8y h TYR 19 N 0.00 0.31 0.00 1.56 -1.99 -2.03 -3.48 116.97 111.34 1i8y h TYR 19 Ca 0.00 -0.23 0.00 0.00 2.00 0.00 0.00 58.73 60.50 1i8y h TYR 19 Cb 0.27 -0.01 0.00 0.00 2.00 0.00 0.00 36.73 38.99 1i8y h TYR 19 CO 0.00 1.25 0.00 0.41 -0.00 0.00 0.00 178.16 179.82 1i8y n GLY 20 N 1.58 0.93 3.21 3.88 0.00 0.06 -5.15 105.19 109.70 1i8y n GLY 20 Ca -0.13 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.71 1i8y n GLY 20 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1i8y s VAL 21 N -1.17 1.25 -0.14 1.61 1.01 -1.26 -4.93 120.40 116.78 1i8y s VAL 21 Ca 0.00 -1.53 0.00 0.00 0.00 0.00 0.00 61.98 60.45 1i8y s VAL 21 Cb 0.00 -1.33 -0.01 0.00 0.00 0.00 0.00 36.38 35.03 1i8y s VAL 21 CO 0.00 -0.32 -0.14 0.26 0.00 0.00 0.00 175.10 174.90 1i8y s TRP 22 N -1.73 2.80 0.08 5.22 0.52 -1.26 -1.41 118.94 123.16 1i8y s TRP 22 Ca 0.04 -0.77 0.06 0.00 0.02 0.00 0.00 56.10 55.46 1i8y s TRP 22 Cb -0.07 -1.86 -0.03 0.00 -1.15 0.00 0.00 33.47 30.36 1i8y s TRP 22 CO 0.03 -0.30 -0.16 1.52 0.02 0.00 0.00 176.95 178.06 1i8y s TYR 23 N 0.50 1.39 -0.09 -1.98 -0.85 -1.23 -5.00 117.35 110.09 1i8y s TYR 23 Ca -0.09 -0.46 -0.04 0.00 -0.52 0.00 0.00 57.07 55.96 1i8y s TYR 23 Cb -0.16 -0.77 0.05 0.00 0.38 0.00 0.00 41.96 41.46 1i8y s TYR 23 CO 0.04 0.11 0.18 0.00 -1.52 0.00 0.00 175.55 174.36 1i8y s SER 25 N 2.29 1.46 0.08 0.00 0.15 -1.26 -4.94 113.70 111.48 1i8y s SER 25 Ca 0.02 -0.39 -0.30 0.00 0.70 0.00 0.00 55.95 55.99 1i8y s SER 25 Cb -0.12 -0.10 -0.05 0.00 -1.71 0.00 0.00 66.02 64.04 1i8y s SER 25 CO -0.06 0.04 0.97 -2.16 1.20 0.00 0.00 173.24 173.23 1i8y s PRO 26 N -0.91 4.66 -0.54 5.44 0.04 -1.26 -4.22 135.00 138.21 1i8y s PRO 26 Ca 0.01 1.45 -0.15 0.00 0.04 0.00 0.00 61.00 62.36 1i8y s PRO 26 Cb -0.07 -3.40 0.13 0.00 0.04 0.00 0.00 34.50 31.21 1i8y s PRO 26 CO 0.01 0.14 0.49 -0.06 0.04 0.00 0.00 177.00 177.61 1i8y s PHE 27 N 0.27 3.30 0.00 0.56 0.08 -1.18 -5.05 117.98 115.97 1i8y s PHE 27 Ca 0.48 -1.42 0.00 0.00 0.12 0.00 0.00 56.93 56.11 1i8y s PHE 27 Cb -0.23 -3.75 0.00 0.00 -0.57 0.00 0.00 43.02 38.47 1i8y s PHE 27 CO 0.29 -1.01 0.00 -1.13 -0.10 0.00 0.00 175.22 173.27