#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3jqo s SER 16 N 0.00 -0.46 0.00 0.00 0.01 -1.26 -5.14 113.70 106.85 3jqo s SER 16 Ca 0.00 0.94 0.00 0.00 1.31 0.00 0.00 55.95 58.20 3jqo s SER 16 Cb 0.00 1.59 0.00 0.00 0.21 0.00 0.00 66.02 67.82 3jqo s SER 16 CO 0.00 -0.25 0.00 -1.54 0.41 0.00 0.00 173.24 171.86 3jqo n SER 17 N 5.40 0.00 -3.52 2.44 3.41 -1.26 -4.93 113.62 115.17 3jqo n SER 17 Ca -0.07 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.54 3jqo n SER 17 Cb 0.50 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.45 3jqo n SER 17 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3jqo n GLY 18 N 0.05 -2.11 3.55 5.00 0.00 -1.26 -4.98 105.19 105.44 3jqo n GLY 18 Ca 0.00 -1.39 -0.48 0.00 0.00 0.00 0.00 46.02 44.15 3jqo n GLY 18 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3jqo n HIS 19 N -0.49 1.01 -4.05 1.61 -0.00 -1.26 -4.99 115.22 107.05 3jqo n HIS 19 Ca 0.00 0.75 -0.34 0.00 -0.00 0.00 0.00 57.72 58.12 3jqo n HIS 19 Cb 0.00 -2.22 -0.10 0.00 -0.00 0.00 0.00 29.99 27.67 3jqo n HIS 19 CO 0.00 0.00 0.00 -1.59 -0.00 0.00 0.00 176.34 174.75 3jqo s LYS 20 N -0.73 3.92 0.90 -0.41 -2.85 -1.26 -5.09 119.74 114.22 3jqo s LYS 20 Ca 0.69 -0.38 -0.12 0.00 -1.00 0.00 0.00 55.97 55.17 3jqo s LYS 20 Cb -0.85 -3.18 0.13 0.00 -2.06 0.00 0.00 37.83 31.87 3jqo s LYS 20 CO 0.55 0.24 1.10 -1.25 0.10 0.00 0.00 175.35 176.09 3jqo s PRO 21 N 0.44 1.20 0.91 1.78 0.04 -1.26 -5.01 135.00 133.10 3jqo s PRO 21 Ca 0.02 0.66 -0.11 0.00 0.04 0.00 0.00 61.00 61.61 3jqo s PRO 21 Cb -0.13 -1.81 0.14 0.00 0.04 0.00 0.00 34.50 32.74 3jqo s PRO 21 CO 0.01 -2.24 1.09 -1.25 0.04 0.00 0.00 177.00 174.65 3jqo s PRO 22 N -5.02 1.12 0.69 0.56 0.04 -1.26 -4.96 135.00 126.18 3jqo s PRO 22 Ca 0.63 1.01 -0.16 0.00 0.04 0.00 0.00 61.00 62.52 3jqo s PRO 22 Cb -0.17 -1.78 0.02 0.00 0.04 0.00 0.00 34.50 32.61 3jqo s PRO 22 CO 0.56 -2.39 1.21 -2.14 0.04 0.00 0.00 177.00 174.29 3jqo s PRO 23 N -4.82 2.37 0.03 0.56 0.02 -1.26 -5.02 135.00 126.88 3jqo s PRO 23 Ca 0.64 1.78 0.01 0.00 0.02 0.00 0.00 61.00 63.45 3jqo s PRO 23 Cb -0.19 -1.86 -0.04 0.00 0.02 0.00 0.00 34.50 32.43 3jqo s PRO 23 CO 0.58 -1.66 0.08 -1.21 -0.33 0.00 0.00 177.00 174.46 3jqo s GLU 24 N -3.77 2.98 0.63 5.54 0.41 -1.26 -5.09 118.70 118.15 3jqo s GLU 24 Ca 0.75 -0.57 -0.17 0.00 -0.41 0.00 0.00 54.97 54.57 3jqo s GLU 24 Cb -0.30 -2.80 -0.01 0.00 -1.78 0.00 0.00 34.13 29.24 3jqo s GLU 24 CO 0.42 0.61 1.17 -1.25 -0.49 0.00 0.00 175.26 175.73 3jqo s PRO 25 N -1.99 2.80 -0.35 0.39 0.04 -1.26 -5.00 135.00 129.64 3jqo s PRO 25 Ca 0.25 1.68 -0.15 0.00 0.04 0.00 0.00 61.00 62.82 3jqo s PRO 25 Cb -0.12 -1.92 -0.01 0.00 0.04 0.00 0.00 34.50 32.49 3jqo s PRO 25 CO 0.17 -1.30 0.33 0.34 0.04 0.00 0.00 177.00 176.58 3jqo s ASP 26 N -1.95 6.15 0.00 6.66 -1.08 -1.26 -4.98 116.67 120.21 3jqo s ASP 26 Ca 0.74 -0.34 0.22 0.00 -0.52 0.00 0.00 52.55 52.64 3jqo s ASP 26 Cb -0.27 -2.18 0.83 0.00 -1.46 0.00 0.00 42.92 39.84 3jqo s ASP 26 CO 0.37 -0.33 1.60 0.79 0.52 0.00 0.00 175.17 178.11 3jqo n TRP 27 N 5.31 0.16 -0.33 -5.34 7.02 -1.26 -4.42 117.44 118.58 3jqo n TRP 27 Ca -0.10 -0.08 0.26 0.00 -1.02 0.00 0.00 57.50 56.56 3jqo n TRP 27 Cb 0.49 0.00 0.49 0.00 -2.42 0.00 0.00 31.31 29.87 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 2.15 0.05 -3.67 -0.99 0.02 -2.05 -3.05 113.55 106.01 3jqo h SER 28 Ca 0.00 0.27 -0.67 0.00 -0.84 0.00 0.00 61.79 60.54 3jqo h SER 28 Cb 0.47 0.35 -0.34 0.00 0.14 0.00 0.00 62.40 63.01 3jqo h SER 28 CO 0.00 -0.41 -0.77 0.21 -1.14 0.00 0.00 176.83 174.72 3jqo s ASN 29 N -4.69 4.39 0.10 3.07 2.47 -1.26 -5.09 114.94 113.93 3jqo s ASN 29 Ca -0.10 -1.15 0.08 0.00 0.42 0.00 0.00 52.86 52.10 3jqo s ASN 29 Cb 0.32 -1.61 -0.04 0.00 -1.45 0.00 0.00 41.25 38.47 3jqo s ASN 29 CO 0.78 -0.17 -0.15 -0.89 -3.72 0.00 0.00 177.10 172.95 3jqo s THR 30 N 1.22 3.04 -0.05 -5.21 2.01 -1.16 -5.06 115.64 110.43 3jqo s THR 30 Ca -0.04 -1.36 -0.21 0.00 0.31 0.00 0.00 61.69 60.39 3jqo s THR 30 Cb -0.18 -2.39 0.04 0.00 0.01 0.00 0.00 72.50 69.98 3jqo s THR 30 CO -0.05 0.15 0.46 -0.69 -0.69 0.00 0.00 174.62 173.80 3jqo s VAL 31 N -1.13 0.03 0.44 3.82 1.01 -1.26 -5.14 120.40 118.17 3jqo s VAL 31 Ca 0.19 -0.25 -0.23 0.00 0.00 0.00 0.00 61.98 61.68 3jqo s VAL 31 Cb -0.11 -0.76 -0.08 0.00 0.00 0.00 0.00 36.38 35.44 3jqo s VAL 31 CO 0.11 -0.14 1.15 -2.84 0.00 0.00 0.00 175.10 173.38 3jqo s PRO 32 N -1.11 3.85 -0.05 2.72 0.02 -1.26 -4.94 135.00 134.23 3jqo s PRO 32 Ca -0.11 1.76 -0.18 0.00 0.02 0.00 0.00 61.00 62.49 3jqo s PRO 32 Cb -0.03 -2.46 -0.12 0.00 0.02 0.00 0.00 34.50 31.90 3jqo s PRO 32 CO 0.06 -0.47 0.73 0.28 -0.33 0.00 0.00 177.00 177.26 3jqo h VAL 33 N 1.98 0.55 -2.24 3.83 2.07 -2.01 -3.42 116.25 117.01 3jqo h VAL 33 Ca -0.49 -0.99 -0.57 0.00 0.82 0.00 0.00 66.70 65.47 3jqo h VAL 33 Cb 1.24 0.93 -0.10 0.00 -1.52 0.00 0.00 31.29 31.84 3jqo h VAL 33 CO 0.61 0.15 1.01 0.20 0.02 0.00 0.00 177.57 179.56 3jqo s ASN 34 N -5.33 6.23 0.46 0.57 0.01 -1.26 -4.81 114.94 110.81 3jqo s ASN 34 Ca -0.10 -0.76 0.26 0.00 -0.71 0.00 0.00 52.86 51.55 3jqo s ASN 34 Cb 0.00 -2.53 0.97 0.00 0.41 0.00 0.00 41.25 40.11 3jqo s ASN 34 CO 0.37 -1.69 1.84 0.11 -1.51 0.00 0.00 177.10 176.23 3jqo h LYS 35 N 9.86 0.00 -4.19 -0.60 1.79 -2.02 -3.45 116.57 117.96 3jqo h LYS 35 Ca -0.20 0.00 -0.12 0.00 -2.18 0.00 0.00 60.65 58.15 3jqo h LYS 35 Cb 1.05 0.00 -0.15 0.00 -1.58 0.00 0.00 32.23 31.55 3jqo h LYS 35 CO 1.28 0.16 -0.63 0.95 -1.08 0.00 0.00 179.45 180.13 3jqo s THR 36 N -3.61 0.20 -0.11 -0.16 -4.23 -1.26 -5.13 115.64 101.34 3jqo s THR 36 Ca 0.01 -1.73 -0.30 0.00 -1.18 0.00 0.00 61.69 58.50 3jqo s THR 36 Cb 0.09 -1.53 -0.01 0.00 1.34 0.00 0.00 72.50 72.39 3jqo s THR 36 CO 0.62 -0.91 1.07 -0.63 -0.54 0.00 0.00 174.62 174.23 3jqo s ILE 37 N -3.92 4.62 0.88 2.99 1.09 -1.26 -5.03 121.20 120.56 3jqo s ILE 37 Ca 0.08 1.91 -0.11 0.00 -1.10 0.00 0.00 60.65 61.42 3jqo s ILE 37 Cb 0.08 -4.23 0.12 0.00 -1.06 0.00 0.00 42.46 37.37 3jqo s ILE 37 CO -0.09 -0.03 1.09 -2.16 -0.10 0.00 0.00 174.94 173.65 3jqo s PRO 38 N 2.28 1.39 -0.00 2.79 0.04 -1.26 -5.07 135.00 135.16 3jqo s PRO 38 Ca 0.50 0.96 0.06 0.00 0.04 0.00 0.00 61.00 62.56 3jqo s PRO 38 Cb -0.20 -1.81 -0.02 0.00 0.04 0.00 0.00 34.50 32.51 3jqo s PRO 38 CO 0.17 -2.19 -0.19 0.14 0.04 0.00 0.00 177.00 174.98 3jqo s VAL 39 N -2.89 1.50 -0.45 -0.36 -7.23 -1.26 -5.11 120.40 104.61 3jqo s VAL 39 Ca 0.63 -0.88 -0.22 0.00 -1.81 0.00 0.00 61.98 59.70 3jqo s VAL 39 Cb -0.18 -1.26 0.03 0.00 0.56 0.00 0.00 36.38 35.52 3jqo s VAL 39 CO 0.57 0.36 0.73 -0.62 -0.31 0.00 0.00 175.10 175.84 3jqo s ASP 40 N -0.61 6.37 -0.06 4.85 2.15 -1.26 -4.91 116.67 123.20 3jqo s ASP 40 Ca 0.07 -0.23 0.05 0.00 0.43 0.00 0.00 52.55 52.87 3jqo s ASP 40 Cb -0.08 -2.36 0.25 0.00 -0.30 0.00 0.00 42.92 40.43 3jqo s ASP 40 CO -0.00 -0.88 0.94 0.35 -0.17 0.00 0.00 175.17 175.41 3jqo n THR 41 N 6.03 0.78 0.66 1.71 -2.24 -1.26 -5.37 114.28 114.58 3jqo n THR 41 Ca 0.01 -0.42 0.08 0.00 -2.27 0.00 0.00 64.05 61.45 3jqo n THR 41 Cb 0.48 -0.34 0.07 0.00 -2.10 0.00 0.00 70.33 68.44 3jqo n THR 41 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50