#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qjk n ASP 3 N 0.00 -1.73 -3.48 3.54 8.00 -1.26 -5.16 116.55 116.46 1qjk n ASP 3 Ca 0.00 -1.73 -0.12 0.00 0.71 0.00 0.00 54.79 53.65 1qjk n ASP 3 Cb 0.00 0.94 -0.04 0.00 -0.02 0.00 0.00 41.12 42.00 1qjk n ASP 3 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1qjk s VAL 4 N 0.57 0.00 -0.04 2.53 1.01 -1.26 -5.04 120.40 118.18 1qjk s VAL 4 Ca 0.26 -1.45 0.09 0.00 0.00 0.00 0.00 61.98 60.88 1qjk s VAL 4 Cb 0.16 -2.52 -0.13 0.00 0.00 0.00 0.00 36.38 33.89 1qjk s VAL 4 CO -0.11 0.00 0.15 0.29 0.00 0.00 0.00 175.10 175.43 1qjk n LYS 5 N -0.49 0.99 -2.47 2.72 4.76 -1.24 -4.81 118.16 117.62 1qjk n LYS 5 Ca -0.01 -0.06 -0.39 0.00 -2.87 0.00 0.00 58.31 54.97 1qjk n LYS 5 Cb 0.61 -1.22 -0.02 0.00 -1.84 0.00 0.00 35.03 32.56 1qjk n LYS 5 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1qjk h VAL 7 N 6.02 0.11 -0.28 0.00 2.07 -1.89 0.76 116.25 123.04 1qjk h VAL 7 Ca 0.34 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.92 1qjk h VAL 7 Cb 0.92 0.16 -0.08 0.00 -1.52 0.00 0.00 31.29 30.77 1qjk h VAL 7 CO 1.40 0.00 -0.32 0.00 0.02 0.00 0.00 177.57 178.67 1qjk n THR 10 N -3.24 0.72 -0.05 0.00 -1.04 0.12 -2.72 114.28 108.08 1qjk n THR 10 Ca -0.16 0.18 -0.07 0.00 -2.04 0.00 0.00 64.05 61.96 1qjk n THR 10 Cb 1.03 -1.00 -0.04 0.00 -1.82 0.00 0.00 70.33 68.51 1qjk n THR 10 CO 0.00 0.00 0.00 1.21 -0.64 0.00 0.00 175.07 175.64 1qjk n GLU 11 N -1.29 0.22 0.00 -2.82 2.13 0.55 -4.91 120.64 114.52 1qjk n GLU 11 Ca 0.05 0.06 0.00 0.00 0.66 0.00 0.00 57.16 57.93 1qjk n GLU 11 Cb 0.09 -1.09 0.00 0.00 0.27 0.00 0.00 31.44 30.71 1qjk n GLU 11 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1qjk n GLY 12 N 2.90 1.59 3.80 8.31 0.00 -0.87 -5.08 105.19 115.83 1qjk n GLY 12 Ca -0.17 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.55 1qjk n GLY 12 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1qjk s LYS 13 N -0.10 0.07 -0.37 1.61 1.02 0.01 -4.97 119.74 117.00 1qjk s LYS 13 Ca 0.00 -0.22 -0.28 0.00 0.02 0.00 0.00 55.97 55.49 1qjk s LYS 13 Cb 0.00 -1.76 0.02 0.00 -0.52 0.00 0.00 37.83 35.57 1qjk s LYS 13 CO 0.00 -2.83 1.05 -1.83 -0.92 0.00 0.00 175.35 170.82 1qjk s GLU 14 N -5.66 3.92 0.11 1.68 -1.05 -1.26 -4.72 118.70 111.71 1qjk s GLU 14 Ca 0.72 0.81 0.05 0.00 -0.15 0.00 0.00 54.97 56.40 1qjk s GLU 14 Cb -0.07 -3.80 -0.04 0.00 -0.44 0.00 0.00 34.13 29.78 1qjk s GLU 14 CO 0.54 -1.03 0.01 0.00 0.95 0.00 0.00 175.26 175.73 1qjk n ALA 16 N 0.40 3.51 -1.37 0.00 0.00 -1.26 -4.30 120.51 117.48 1qjk n ALA 16 Ca -0.10 -0.40 0.08 0.00 0.00 0.00 0.00 53.44 53.01 1qjk n ALA 16 Cb 0.53 -0.54 0.17 0.00 0.00 0.00 0.00 19.45 19.61 1qjk n ALA 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1qjk n PHE 18 N -1.23 -1.99 -3.69 0.00 7.35 -1.26 -3.28 117.46 113.36 1qjk n PHE 18 Ca 0.17 0.21 -0.25 0.00 -0.76 0.00 0.00 57.45 56.82 1qjk n PHE 18 Cb 0.67 -1.75 0.03 0.00 0.35 0.00 0.00 39.48 38.79 1qjk n PHE 18 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1qjk n GLY 19 N 1.88 -0.65 2.62 7.13 0.00 -1.26 -4.99 105.19 109.92 1qjk n GLY 19 Ca 0.06 0.31 -0.18 0.00 0.00 0.00 0.00 46.02 46.21 1qjk n GLY 19 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1qjk n GLN 20 N -4.15 0.47 -0.06 1.61 6.02 -1.21 -5.06 117.38 115.01 1qjk n GLN 20 Ca -0.20 -2.71 -0.09 0.00 -0.01 0.00 0.00 57.00 53.99 1qjk n GLN 20 Cb 0.64 1.87 -0.15 0.00 1.02 0.00 0.00 30.24 33.62 1qjk n GLN 20 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 1qjk n ASP 21 N -1.81 0.42 0.23 1.08 2.03 -1.26 -3.89 116.55 113.37 1qjk n ASP 21 Ca 0.01 0.20 0.16 0.00 0.52 0.00 0.00 54.79 55.68 1qjk n ASP 21 Cb 0.49 0.49 0.81 0.00 -0.72 0.00 0.00 41.12 42.18 1qjk n ASP 21 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1qjk h VAL 24 N 0.10 0.00 -0.10 0.00 2.07 -1.13 -2.11 116.25 115.08 1qjk h VAL 24 Ca -0.13 -0.20 0.03 0.00 0.82 0.00 0.00 66.70 67.21 1qjk h VAL 24 Cb 1.64 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 31.41 1qjk h VAL 24 CO 0.18 0.00 0.14 0.00 0.02 0.00 0.00 177.57 177.92 1qjk h THR 25 N -1.03 0.35 -0.13 2.57 1.03 -1.43 -3.30 112.91 110.96 1qjk h THR 25 Ca -0.09 0.00 -0.06 0.00 -0.01 0.00 0.00 66.41 66.26 1qjk h THR 25 Cb 0.64 0.88 -0.02 0.00 -1.07 0.00 0.00 68.15 68.57 1qjk h THR 25 CO 0.14 0.00 -0.05 0.61 -0.01 0.00 0.00 175.52 176.21 1qjk n GLY 26 N -1.31 0.55 0.16 2.99 0.00 -0.40 -4.85 105.19 102.33 1qjk n GLY 26 Ca -0.00 -0.26 0.10 0.00 0.00 0.00 0.00 46.02 45.86 1qjk n GLY 26 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1qjk n GLU 27 N -2.01 0.13 -0.34 1.61 0.28 -0.85 0.18 120.64 119.63 1qjk n GLU 27 Ca -0.03 0.62 0.12 0.00 -0.16 0.00 0.00 57.16 57.71 1qjk n GLU 27 Cb 0.20 -1.97 0.30 0.00 1.43 0.00 0.00 31.44 31.40 1qjk n GLU 27 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1qjk n LYS 30 N -0.06 1.14 0.10 0.00 2.85 -0.85 -4.93 118.16 116.41 1qjk n LYS 30 Ca 0.01 -2.40 0.00 0.00 -1.05 0.00 0.00 58.31 54.87 1qjk n LYS 30 Cb 0.97 -0.67 0.00 0.00 -0.65 0.00 0.00 35.03 34.68 1qjk n LYS 30 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 1qjk n ASP 31 N -0.24 -1.22 0.00 -5.58 8.00 -1.26 -4.97 116.55 111.27 1qjk n ASP 31 Ca 0.04 0.36 0.00 0.00 0.71 0.00 0.00 54.79 55.91 1qjk n ASP 31 Cb 0.81 1.33 0.00 0.00 -0.02 0.00 0.00 41.12 43.23 1qjk n ASP 31 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1qjk n GLY 32 N -0.14 -0.34 0.69 0.44 0.00 -1.26 -5.17 105.19 99.41 1qjk n GLY 32 Ca 0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 46.02 46.00 1qjk n GLY 32 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1qjk n THR 33 N -2.11 0.00 -4.36 2.61 5.66 -1.26 -5.11 114.28 109.71 1qjk n THR 33 Ca 0.00 -0.10 -0.19 0.00 -3.05 0.00 0.00 64.05 60.71 1qjk n THR 33 Cb 0.00 0.14 -0.10 0.00 -1.55 0.00 0.00 70.33 68.82 1qjk n THR 33 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1qjk n GLY 36 N -3.62 -0.27 0.00 0.00 0.00 -1.26 -5.08 105.19 94.96 1qjk n GLY 36 Ca -0.06 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.92 1qjk n GLY 36 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71