#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3jqo n GLY 18 N 0.00 0.43 2.79 0.23 0.00 -1.26 -5.16 105.19 102.22 3jqo n GLY 18 Ca 0.00 -0.83 -0.23 0.00 0.00 0.00 0.00 46.02 44.96 3jqo n GLY 18 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3jqo s HIS 19 N -2.00 0.70 -0.21 1.61 0.09 -1.26 -5.13 115.29 109.10 3jqo s HIS 19 Ca 0.00 -0.19 -0.13 0.00 -0.00 0.00 0.00 55.06 54.74 3jqo s HIS 19 Cb 0.00 -0.81 -0.05 0.00 -0.00 0.00 0.00 32.58 31.73 3jqo s HIS 19 CO 0.00 -0.32 0.27 -1.59 -0.00 0.00 0.00 174.74 173.10 3jqo s LYS 20 N 1.87 4.15 0.93 1.40 -2.85 -1.26 -5.08 119.74 118.91 3jqo s LYS 20 Ca 0.04 -0.02 -0.12 0.00 -1.00 0.00 0.00 55.97 54.87 3jqo s LYS 20 Cb -0.12 -3.51 0.15 0.00 -2.06 0.00 0.00 37.83 32.28 3jqo s LYS 20 CO -0.05 0.07 1.09 -1.25 0.10 0.00 0.00 175.35 175.31 3jqo s PRO 21 N 1.01 0.98 0.95 1.78 0.04 -1.26 -4.99 135.00 133.51 3jqo s PRO 21 Ca 0.14 0.80 -0.12 0.00 0.04 0.00 0.00 61.00 61.86 3jqo s PRO 21 Cb -0.14 -1.78 0.16 0.00 0.04 0.00 0.00 34.50 32.79 3jqo s PRO 21 CO 0.05 -2.43 1.09 -1.25 0.04 0.00 0.00 177.00 174.50 3jqo s PRO 22 N -4.90 0.80 0.74 0.56 0.04 -1.26 -4.95 135.00 126.02 3jqo s PRO 22 Ca 0.64 0.68 -0.14 0.00 0.04 0.00 0.00 61.00 62.21 3jqo s PRO 22 Cb -0.19 -1.77 0.04 0.00 0.04 0.00 0.00 34.50 32.63 3jqo s PRO 22 CO 0.58 -2.52 1.19 -2.14 0.04 0.00 0.00 177.00 174.15 3jqo s PRO 23 N -4.94 2.11 0.13 0.56 0.02 -1.26 -5.04 135.00 126.58 3jqo s PRO 23 Ca 0.64 1.70 0.06 0.00 0.02 0.00 0.00 61.00 63.42 3jqo s PRO 23 Cb -0.18 -1.84 -0.04 0.00 0.02 0.00 0.00 34.50 32.46 3jqo s PRO 23 CO 0.57 -1.84 0.03 -1.21 -0.33 0.00 0.00 177.00 174.22 3jqo s GLU 24 N -4.01 2.58 0.46 5.54 0.41 -1.26 -5.09 118.70 117.33 3jqo s GLU 24 Ca 0.73 -0.92 -0.20 0.00 -0.41 0.00 0.00 54.97 54.17 3jqo s GLU 24 Cb -0.28 -2.51 -0.10 0.00 -1.78 0.00 0.00 34.13 29.47 3jqo s GLU 24 CO 0.46 0.50 0.97 -1.25 -0.49 0.00 0.00 175.26 175.46 3jqo s PRO 25 N -2.66 4.08 -0.27 0.39 0.04 -1.26 -5.00 135.00 130.32 3jqo s PRO 25 Ca 0.27 1.13 -0.16 0.00 0.04 0.00 0.00 61.00 62.28 3jqo s PRO 25 Cb -0.11 -2.15 -0.03 0.00 0.04 0.00 0.00 34.50 32.25 3jqo s PRO 25 CO 0.19 -0.16 0.42 0.34 0.04 0.00 0.00 177.00 177.83 3jqo s ASP 26 N -2.33 6.31 0.00 6.66 -1.08 -1.26 -4.97 116.67 120.00 3jqo s ASP 26 Ca 0.62 0.35 0.22 0.00 -0.52 0.00 0.00 52.55 53.22 3jqo s ASP 26 Cb -0.11 -2.23 0.59 0.00 -1.46 0.00 0.00 42.92 39.71 3jqo s ASP 26 CO 0.18 -0.23 1.48 0.79 0.52 0.00 0.00 175.17 177.91 3jqo n TRP 27 N 5.41 0.29 -0.33 -5.34 7.02 -1.26 -4.46 117.44 118.77 3jqo n TRP 27 Ca -0.07 -0.14 0.19 0.00 -1.02 0.00 0.00 57.50 56.46 3jqo n TRP 27 Cb 0.50 0.00 0.38 0.00 -2.42 0.00 0.00 31.31 29.77 3jqo n TRP 27 CO 0.00 0.00 0.00 0.77 -2.02 0.00 0.00 177.69 176.44 3jqo h SER 28 N 3.29 -0.21 -3.79 -0.99 0.02 -2.05 -3.17 113.55 106.65 3jqo h SER 28 Ca 0.00 0.27 -0.67 0.00 -0.84 0.00 0.00 61.79 60.55 3jqo h SER 28 Cb 0.72 0.41 -0.36 0.00 0.14 0.00 0.00 62.40 63.31 3jqo h SER 28 CO 0.00 -0.36 -0.79 0.21 -1.14 0.00 0.00 176.83 174.75 3jqo s ASN 29 N -4.88 4.43 0.17 3.07 2.47 -1.26 -5.11 114.94 113.83 3jqo s ASN 29 Ca -0.12 -1.31 0.09 0.00 0.42 0.00 0.00 52.86 51.94 3jqo s ASN 29 Cb 0.30 -1.58 -0.04 0.00 -1.45 0.00 0.00 41.25 38.48 3jqo s ASN 29 CO 0.78 -0.19 -0.09 -0.89 -3.72 0.00 0.00 177.10 172.99 3jqo s THR 30 N 1.15 3.25 -0.04 -5.21 2.01 -1.20 -5.07 115.64 110.53 3jqo s THR 30 Ca -0.07 -1.59 -0.22 0.00 0.31 0.00 0.00 61.69 60.12 3jqo s THR 30 Cb -0.19 -2.60 0.04 0.00 0.01 0.00 0.00 72.50 69.76 3jqo s THR 30 CO -0.05 -0.08 0.48 -0.69 -0.69 0.00 0.00 174.62 173.59 3jqo s VAL 31 N -1.63 0.03 0.50 3.82 1.01 -1.26 -5.14 120.40 117.73 3jqo s VAL 31 Ca 0.24 -0.25 -0.21 0.00 0.00 0.00 0.00 61.98 61.76 3jqo s VAL 31 Cb -0.09 -0.78 -0.07 0.00 0.00 0.00 0.00 36.38 35.44 3jqo s VAL 31 CO 0.15 -0.14 1.12 -2.84 0.00 0.00 0.00 175.10 173.40 3jqo s PRO 32 N -1.20 3.60 -0.10 2.72 0.02 -1.26 -4.95 135.00 133.84 3jqo s PRO 32 Ca -0.12 1.62 -0.26 0.00 0.02 0.00 0.00 61.00 62.26 3jqo s PRO 32 Cb -0.03 -2.18 -0.27 0.00 0.02 0.00 0.00 34.50 32.04 3jqo s PRO 32 CO 0.07 -0.65 0.85 0.28 -0.33 0.00 0.00 177.00 177.22 3jqo h VAL 33 N 1.53 1.67 -2.35 3.83 2.07 -2.00 -3.42 116.25 117.58 3jqo h VAL 33 Ca -0.50 -2.32 -0.65 0.00 0.82 0.00 0.00 66.70 64.05 3jqo h VAL 33 Cb 1.25 3.23 -0.15 0.00 -1.52 0.00 0.00 31.29 34.10 3jqo h VAL 33 CO 0.59 0.62 0.80 0.20 0.02 0.00 0.00 177.57 179.80 3jqo s ASN 34 N -6.44 6.41 0.49 0.57 0.01 -1.26 -4.80 114.94 109.92 3jqo s ASN 34 Ca -0.17 -1.49 0.25 0.00 -0.71 0.00 0.00 52.86 50.74 3jqo s ASN 34 Cb -0.01 -2.43 1.28 0.00 0.41 0.00 0.00 41.25 40.49 3jqo s ASN 34 CO 0.74 -1.29 2.00 0.11 -1.51 0.00 0.00 177.10 177.15 3jqo h LYS 35 N 9.28 0.00 -4.57 -0.60 1.79 -2.02 -3.44 116.57 117.01 3jqo h LYS 35 Ca -0.03 0.00 -0.23 0.00 -2.18 0.00 0.00 60.65 58.20 3jqo h LYS 35 Cb 1.04 0.00 -0.15 0.00 -1.58 0.00 0.00 32.23 31.54 3jqo h LYS 35 CO 1.18 0.16 -0.64 0.95 -1.08 0.00 0.00 179.45 180.03 3jqo s THR 36 N -4.12 0.19 -0.14 -0.16 -4.23 -1.26 -5.13 115.64 100.78 3jqo s THR 36 Ca -0.02 -1.96 -0.24 0.00 -1.18 0.00 0.00 61.69 58.29 3jqo s THR 36 Cb 0.13 -2.27 -0.02 0.00 1.34 0.00 0.00 72.50 71.68 3jqo s THR 36 CO 0.61 -0.26 0.75 -0.63 -0.54 0.00 0.00 174.62 174.55 3jqo s ILE 37 N -4.01 4.96 0.82 2.99 1.09 -1.26 -5.04 121.20 120.75 3jqo s ILE 37 Ca 0.30 1.49 -0.11 0.00 -1.10 0.00 0.00 60.65 61.23 3jqo s ILE 37 Cb 0.07 -4.07 0.09 0.00 -1.06 0.00 0.00 42.46 37.49 3jqo s ILE 37 CO 0.07 0.11 1.09 -2.16 -0.10 0.00 0.00 174.94 173.95 3jqo s PRO 38 N 1.70 1.86 -0.02 2.79 0.04 -1.26 -5.07 135.00 135.04 3jqo s PRO 38 Ca 0.36 1.01 0.05 0.00 0.04 0.00 0.00 61.00 62.46 3jqo s PRO 38 Cb -0.17 -1.86 -0.01 0.00 0.04 0.00 0.00 34.50 32.50 3jqo s PRO 38 CO 0.14 -1.87 -0.18 0.14 0.04 0.00 0.00 177.00 175.26 3jqo s VAL 39 N -2.93 1.43 -0.44 -0.36 -7.23 -1.26 -5.11 120.40 104.51 3jqo s VAL 39 Ca 0.62 -0.76 -0.22 0.00 -1.81 0.00 0.00 61.98 59.81 3jqo s VAL 39 Cb -0.17 -1.20 0.02 0.00 0.56 0.00 0.00 36.38 35.59 3jqo s VAL 39 CO 0.56 0.41 0.71 -0.62 -0.31 0.00 0.00 175.10 175.85 3jqo s ASP 40 N -0.34 6.37 -0.02 4.85 2.15 -1.26 -4.93 116.67 123.49 3jqo s ASP 40 Ca 0.05 -0.22 -0.00 0.00 0.43 0.00 0.00 52.55 52.80 3jqo s ASP 40 Cb -0.08 -2.35 0.02 0.00 -0.30 0.00 0.00 42.92 40.21 3jqo s ASP 40 CO -0.00 -0.84 1.93 0.35 -0.17 0.00 0.00 175.17 176.43 3jqo n THR 41 N 5.98 1.98 -1.08 1.71 -2.24 -1.26 -5.37 114.28 114.00 3jqo n THR 41 Ca 0.00 -0.54 0.00 0.00 -2.27 0.00 0.00 64.05 61.24 3jqo n THR 41 Cb 0.48 -1.45 0.00 0.00 -2.10 0.00 0.00 70.33 67.26 3jqo n THR 41 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50