#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jn0 n TYR 5 N 0.00 0.08 -4.50 -0.67 4.01 -1.26 -3.60 117.16 111.22 2jn0 n TYR 5 Ca 0.00 -0.63 -0.22 0.00 -0.16 0.00 0.00 57.90 56.89 2jn0 n TYR 5 Cb 0.00 -0.08 -0.16 0.00 -0.31 0.00 0.00 39.34 38.79 2jn0 n TYR 5 CO 0.00 0.00 0.00 0.14 -0.46 0.00 0.00 176.86 176.54 2jn0 s VAL 6 N -1.50 0.96 -0.40 -0.72 -7.23 -1.26 -0.51 120.40 109.74 2jn0 s VAL 6 Ca 0.11 -0.44 -0.03 0.00 -1.81 0.00 0.00 61.98 59.81 2jn0 s VAL 6 Cb 0.09 -0.86 0.10 0.00 0.56 0.00 0.00 36.38 36.28 2jn0 s VAL 6 CO 0.03 0.30 0.19 -0.32 -0.31 0.00 0.00 175.10 174.98 2jn0 s MET 7 N 0.27 2.06 -0.17 4.82 1.75 0.52 -4.61 119.30 123.94 2jn0 s MET 7 Ca -0.06 -1.75 -0.29 0.00 -1.25 0.00 0.00 55.69 52.34 2jn0 s MET 7 Cb -0.11 -3.55 -0.00 0.00 2.84 0.00 0.00 34.83 34.01 2jn0 s MET 7 CO 0.01 -1.03 1.01 0.00 -0.65 0.00 0.00 175.02 174.37 2jn0 s ALA 8 N 1.16 3.55 0.57 4.11 0.00 -0.36 -0.59 121.76 130.19 2jn0 s ALA 8 Ca 0.07 0.26 0.08 0.00 0.00 0.00 0.00 51.96 52.36 2jn0 s ALA 8 Cb -0.22 -3.48 0.08 0.00 0.00 0.00 0.00 23.12 19.49 2jn0 s ALA 8 CO -0.04 -0.83 0.64 0.25 0.00 0.00 0.00 175.76 175.79 2jn0 n THR 9 N 4.94 0.00 -0.30 0.00 -2.24 -0.69 -0.53 114.28 115.47 2jn0 n THR 9 Ca 0.10 -2.03 0.11 0.00 -2.27 0.00 0.00 64.05 59.96 2jn0 n THR 9 Cb 0.47 -0.31 0.27 0.00 -2.10 0.00 0.00 70.33 68.66 2jn0 n THR 9 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 2jn0 h LYS 10 N 0.00 0.41 0.00 -0.78 3.64 -0.72 0.14 116.57 119.26 2jn0 h LYS 10 Ca -0.30 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.05 2jn0 h LYS 10 Cb 1.25 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.98 2jn0 h LYS 10 CO 0.45 0.27 0.00 -0.25 -2.27 0.00 0.00 179.45 177.65 2jn0 n ASP 11 N -5.03 0.00 0.00 4.20 8.00 -1.26 -4.85 116.55 117.61 2jn0 n ASP 11 Ca 0.20 -0.53 0.00 0.00 0.71 0.00 0.00 54.79 55.17 2jn0 n ASP 11 Cb 0.59 -0.13 0.00 0.00 -0.02 0.00 0.00 41.12 41.56 2jn0 n ASP 11 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2jn0 n GLY 12 N 0.90 1.49 3.73 0.44 0.00 0.50 -5.02 105.19 107.25 2jn0 n GLY 12 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 2jn0 n GLY 12 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2jn0 s ARG 13 N -0.41 4.53 -0.35 1.61 1.70 -1.26 -4.69 118.95 120.08 2jn0 s ARG 13 Ca 0.00 1.77 -0.20 0.00 -0.47 0.00 0.00 55.73 56.84 2jn0 s ARG 13 Cb 0.00 -3.28 0.00 0.00 -0.57 0.00 0.00 34.95 31.10 2jn0 s ARG 13 CO 0.00 -0.04 0.60 1.41 -1.08 0.00 0.00 175.30 176.19 2jn0 s MET 14 N -0.07 3.67 -0.20 3.89 -2.45 -1.26 -1.70 119.30 121.17 2jn0 s MET 14 Ca 0.52 -0.01 -0.14 0.00 -1.25 0.00 0.00 55.69 54.81 2jn0 s MET 14 Cb -0.30 -3.81 -0.04 0.00 1.25 0.00 0.00 34.83 31.93 2jn0 s MET 14 CO 0.34 -0.70 0.33 0.42 1.05 0.00 0.00 175.02 176.46 2jn0 s ILE 15 N 2.60 5.25 -0.39 10.11 1.01 0.24 -4.92 121.20 135.11 2jn0 s ILE 15 Ca 0.23 0.57 -0.29 0.00 0.00 0.00 0.00 60.65 61.15 2jn0 s ILE 15 Cb -0.15 -3.66 0.01 0.00 0.01 0.00 0.00 42.46 38.67 2jn0 s ILE 15 CO 0.14 0.29 1.38 -0.76 0.00 0.00 0.00 174.94 175.99 2jn0 s LEU 16 N 1.13 3.66 0.21 2.97 2.01 -1.26 -0.36 118.68 127.03 2jn0 s LEU 16 Ca 0.16 0.91 0.08 0.00 0.01 0.00 0.00 54.13 55.29 2jn0 s LEU 16 Cb -0.14 -3.54 -0.04 0.00 0.01 0.00 0.00 46.19 42.48 2jn0 s LEU 16 CO 0.07 -1.34 0.02 0.42 1.01 0.00 0.00 176.35 176.52 2jn0 s THR 17 N 5.15 3.72 0.39 5.49 -4.23 0.33 -3.33 115.64 123.16 2jn0 s THR 17 Ca 0.60 -1.56 0.33 0.00 -1.18 0.00 0.00 61.69 59.88 2jn0 s THR 17 Cb -0.14 -2.92 0.36 0.00 1.34 0.00 0.00 72.50 71.14 2jn0 s THR 17 CO 0.30 -0.21 2.12 -0.78 -0.54 0.00 0.00 174.62 175.52 2jn0 h ASP 18 N 2.36 0.00 -4.70 3.99 3.58 -0.63 -3.41 116.42 117.61 2jn0 h ASP 18 Ca -0.46 0.00 0.00 0.00 0.42 0.00 0.00 57.03 56.99 2jn0 h ASP 18 Cb 1.22 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.27 2jn0 h ASP 18 CO 0.59 0.06 0.00 0.61 -2.88 0.00 0.00 179.24 177.62 2jn0 n GLY 19 N -0.58 -1.83 2.73 -0.78 0.00 -1.26 -4.82 105.19 98.65 2jn0 n GLY 19 Ca -0.01 -1.87 -0.11 0.00 0.00 0.00 0.00 46.02 44.02 2jn0 n GLY 19 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2jn0 n LYS 20 N -0.00 -3.13 -3.12 1.61 5.02 -1.24 -4.35 118.16 112.95 2jn0 n LYS 20 Ca 0.00 0.61 -0.33 0.00 -2.02 0.00 0.00 58.31 56.57 2jn0 n LYS 20 Cb 0.00 -4.72 -0.06 0.00 -0.02 0.00 0.00 35.03 30.22 2jn0 n LYS 20 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 2jn0 s PRO 21 N -4.47 4.03 -0.26 1.97 0.04 -1.26 -4.90 135.00 130.15 2jn0 s PRO 21 Ca 0.16 0.70 -0.06 0.00 0.04 0.00 0.00 61.00 61.85 2jn0 s PRO 21 Cb -0.02 -2.45 -0.00 0.00 0.04 0.00 0.00 34.50 32.06 2jn0 s PRO 21 CO 0.52 0.16 0.03 -1.21 0.04 0.00 0.00 177.00 176.54 2jn0 s GLU 22 N -2.93 3.30 -0.15 4.56 0.41 0.20 -4.93 118.70 119.16 2jn0 s GLU 22 Ca 0.54 -0.70 -0.14 0.00 -0.41 0.00 0.00 54.97 54.25 2jn0 s GLU 22 Cb -0.11 -3.22 -0.05 0.00 -1.78 0.00 0.00 34.13 28.98 2jn0 s GLU 22 CO 0.17 -0.30 0.31 0.42 -0.49 0.00 0.00 175.26 175.38 2jn0 s ILE 23 N 1.51 5.29 -0.81 -1.63 1.01 -1.26 0.15 121.20 125.45 2jn0 s ILE 23 Ca 0.04 0.60 -0.24 0.00 0.00 0.00 0.00 60.65 61.05 2jn0 s ILE 23 Cb -0.16 -3.65 0.06 0.00 0.01 0.00 0.00 42.46 38.72 2jn0 s ILE 23 CO 0.01 0.39 1.24 -1.81 0.00 0.00 0.00 174.94 174.76 2jn0 s ASP 24 N 0.43 6.30 0.00 3.58 1.01 0.10 -4.87 116.67 123.23 2jn0 s ASP 24 Ca 0.18 -1.00 0.22 0.00 0.71 0.00 0.00 52.55 52.65 2jn0 s ASP 24 Cb -0.13 -2.51 1.28 0.00 1.01 0.00 0.00 42.92 42.57 2jn0 s ASP 24 CO 0.05 -1.58 1.75 -0.90 0.21 0.00 0.00 175.17 174.70 2jn0 n ASP 25 N 8.57 0.00 0.04 0.27 5.75 -1.26 0.13 116.55 130.05 2jn0 n ASP 25 Ca 0.11 -1.09 0.12 0.00 -0.01 0.00 0.00 54.79 53.93 2jn0 n ASP 25 Cb 0.49 0.00 0.27 0.00 -1.03 0.00 0.00 41.12 40.84 2jn0 n ASP 25 CO 0.00 0.00 0.00 -0.90 -0.11 0.00 0.00 177.20 176.19 2jn0 n ASP 26 N -0.88 0.57 0.00 -1.12 5.75 -1.26 -4.49 116.55 115.12 2jn0 n ASP 26 Ca 0.16 0.10 0.00 0.00 -0.01 0.00 0.00 54.79 55.04 2jn0 n ASP 26 Cb 0.07 0.02 0.00 0.00 -1.03 0.00 0.00 41.12 40.18 2jn0 n ASP 26 CO 0.00 0.00 0.00 1.07 -0.11 0.00 0.00 177.20 178.16 2jn0 n THR 27 N -1.88 0.00 0.00 2.12 5.66 -0.94 -5.06 114.28 114.18 2jn0 n THR 27 Ca 0.05 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.05 2jn0 n THR 27 Cb 0.40 -0.08 0.00 0.00 -1.55 0.00 0.00 70.33 69.09 2jn0 n THR 27 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2jn0 n GLY 28 N 1.30 1.75 3.68 1.09 0.00 0.12 -5.00 105.19 108.13 2jn0 n GLY 28 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 2jn0 n GLY 28 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2jn0 s LEU 29 N 0.00 3.91 -0.35 0.99 1.43 -1.13 -1.53 118.68 122.00 2jn0 s LEU 29 Ca 0.00 0.16 -0.08 0.00 -1.03 0.00 0.00 54.13 53.17 2jn0 s LEU 29 Cb 0.00 -1.97 0.03 0.00 0.03 0.00 0.00 46.19 44.28 2jn0 s LEU 29 CO 0.00 0.23 0.15 -0.69 0.23 0.00 0.00 176.35 176.27 2jn0 s VAL 30 N 0.02 4.16 -0.58 -1.59 1.01 0.28 0.03 120.40 123.74 2jn0 s VAL 30 Ca 0.06 -0.94 -0.25 0.00 0.00 0.00 0.00 61.98 60.85 2jn0 s VAL 30 Cb -0.12 -3.31 0.04 0.00 0.00 0.00 0.00 36.38 32.99 2jn0 s VAL 30 CO 0.01 -0.16 1.02 -0.44 0.00 0.00 0.00 175.10 175.53 2jn0 s SER 31 N 1.48 6.35 0.50 3.32 0.01 0.12 -0.66 113.70 124.82 2jn0 s SER 31 Ca 0.01 -0.29 0.06 0.00 1.31 0.00 0.00 55.95 57.04 2jn0 s SER 31 Cb -0.19 -2.47 0.01 0.00 0.21 0.00 0.00 66.02 63.58 2jn0 s SER 31 CO 0.04 -1.34 0.34 -0.72 0.41 0.00 0.00 173.24 171.98 2jn0 s TYR 32 N 4.31 2.00 -0.20 2.43 1.13 0.92 -0.63 117.35 127.31 2jn0 s TYR 32 Ca 0.33 -0.74 0.01 0.00 -1.41 0.00 0.00 57.07 55.26 2jn0 s TYR 32 Cb -0.11 -1.95 0.03 0.00 -1.10 0.00 0.00 41.96 38.82 2jn0 s TYR 32 CO 0.20 -0.27 -0.17 -1.01 -2.51 0.00 0.00 175.55 171.79 2jn0 s HIS 33 N -2.69 2.82 1.05 -3.49 3.76 -1.25 -1.41 115.29 114.08 2jn0 s HIS 33 Ca 0.36 -1.76 -0.16 0.00 -0.15 0.00 0.00 55.06 53.35 2jn0 s HIS 33 Cb -0.01 -1.88 0.22 0.00 1.11 0.00 0.00 32.58 32.02 2jn0 s HIS 33 CO 0.22 -0.81 1.19 -0.51 -0.85 0.00 0.00 174.74 173.97 2jn0 s ASP 34 N 1.27 2.29 0.48 1.40 1.01 0.08 -0.03 116.67 123.17 2jn0 s ASP 34 Ca 0.02 0.60 0.17 0.00 0.71 0.00 0.00 52.55 54.05 2jn0 s ASP 34 Cb -0.15 -0.87 1.17 0.00 1.01 0.00 0.00 42.92 44.09 2jn0 s ASP 34 CO -0.11 -3.27 2.04 1.56 0.21 0.00 0.00 175.17 175.60 2jn0 h GLN 35 N -2.00 0.20 -0.00 8.23 4.20 -1.90 -0.03 115.11 123.81 2jn0 h GLN 35 Ca -0.46 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.24 2jn0 h GLN 35 Cb 1.28 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 29.02 2jn0 h GLN 35 CO 0.43 0.13 0.00 1.04 -0.67 0.00 0.00 178.83 179.76 2jn0 n GLN 36 N -4.47 1.04 -2.28 1.46 3.00 -1.26 -4.85 117.38 110.03 2jn0 n GLN 36 Ca 0.05 -0.06 -0.00 0.00 -0.01 0.00 0.00 57.00 56.98 2jn0 n GLN 36 Cb 0.32 -1.48 0.00 0.00 0.00 0.00 0.00 30.24 29.08 2jn0 n GLN 36 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2jn0 n GLY 37 N 0.99 0.66 3.59 1.08 0.00 -0.03 -5.04 105.19 106.45 2jn0 n GLY 37 Ca 0.23 -0.76 -0.36 0.00 0.00 0.00 0.00 46.02 45.13 2jn0 n GLY 37 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2jn0 s ASN 38 N -2.99 5.65 -0.63 1.61 0.01 -1.24 -4.87 114.94 112.48 2jn0 s ASN 38 Ca 0.01 0.01 -0.21 0.00 -0.71 0.00 0.00 52.86 51.96 2jn0 s ASN 38 Cb -0.00 -2.00 0.08 0.00 0.41 0.00 0.00 41.25 39.74 2jn0 s ASN 38 CO 0.01 0.08 0.86 0.00 -1.51 0.00 0.00 177.10 176.54 2jn0 s ALA 39 N 0.92 3.23 0.26 0.60 0.00 -1.25 -0.74 121.76 124.79 2jn0 s ALA 39 Ca 0.05 -1.98 0.11 0.00 0.00 0.00 0.00 51.96 50.14 2jn0 s ALA 39 Cb -0.14 -3.72 -0.05 0.00 0.00 0.00 0.00 23.12 19.21 2jn0 s ALA 39 CO 0.03 -2.59 -0.18 -1.64 0.00 0.00 0.00 175.76 171.38 2jn0 s MET 40 N 3.52 1.59 -0.17 0.00 -1.94 -0.50 -4.91 119.30 116.88 2jn0 s MET 40 Ca 0.18 -1.73 -0.02 0.00 -1.71 0.00 0.00 55.69 52.42 2jn0 s MET 40 Cb -0.20 -1.58 -0.01 0.00 2.01 0.00 0.00 34.83 35.06 2jn0 s MET 40 CO 0.09 0.28 -0.10 -0.65 -0.01 0.00 0.00 175.02 174.62 2jn0 s GLN 41 N -3.55 3.33 0.55 2.03 -0.21 -1.25 -0.06 119.66 120.50 2jn0 s GLN 41 Ca 0.28 -0.68 0.05 0.00 0.02 0.00 0.00 55.36 55.03 2jn0 s GLN 41 Cb -0.03 -2.78 0.05 0.00 1.00 0.00 0.00 33.01 31.25 2jn0 s GLN 41 CO 0.13 -0.01 0.41 0.44 -2.12 0.00 0.00 175.29 174.13 2jn0 n ILE 42 N 4.19 0.00 -3.02 1.08 -5.35 0.16 -4.81 119.36 111.61 2jn0 n ILE 42 Ca -0.19 -2.20 -0.39 0.00 -0.27 0.00 0.00 62.75 59.70 2jn0 n ILE 42 Cb 0.52 -0.01 -0.06 0.00 -1.74 0.00 0.00 39.64 38.35 2jn0 n ILE 42 CO 0.00 0.00 0.00 0.21 -1.76 0.00 0.00 176.55 175.00 2jn0 s ASN 43 N -4.25 7.27 0.38 7.28 3.84 -1.26 -0.55 114.94 127.65 2jn0 s ASN 43 Ca 0.31 1.50 0.08 0.00 0.21 0.00 0.00 52.86 54.97 2jn0 s ASN 43 Cb -0.02 -2.47 0.83 0.00 -0.55 0.00 0.00 41.25 39.04 2jn0 s ASN 43 CO 0.20 0.13 1.96 0.08 -2.79 0.00 0.00 177.10 176.68 2jn0 h ARG 44 N 4.95 0.63 0.00 0.43 0.11 -1.64 0.02 114.38 118.87 2jn0 h ARG 44 Ca -0.46 -0.04 0.00 0.00 0.10 0.00 0.00 59.98 59.58 2jn0 h ARG 44 Cb 1.21 -0.14 0.00 0.00 1.11 0.00 0.00 29.97 32.15 2jn0 h ARG 44 CO 0.68 0.41 0.00 -0.44 0.10 0.00 0.00 179.97 180.72 2jn0 h ASP 45 N 0.64 0.00 0.83 0.08 5.19 -1.93 -2.00 116.42 119.23 2jn0 h ASP 45 Ca 0.30 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.71 2jn0 h ASP 45 Cb 0.35 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.86 2jn0 h ASP 45 CO -0.10 0.00 -0.36 0.47 -3.12 0.00 0.00 179.24 176.13 2jn0 n ASP 46 N -2.98 0.47 -4.63 6.45 9.92 -0.04 -4.67 116.55 121.08 2jn0 n ASP 46 Ca 0.01 0.12 -0.43 0.00 -0.53 0.00 0.00 54.79 53.97 2jn0 n ASP 46 Cb 0.32 -0.07 -0.03 0.00 -0.64 0.00 0.00 41.12 40.71 2jn0 n ASP 46 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 2jn0 s VAL 47 N -3.06 4.60 0.00 2.53 1.01 -0.75 -0.03 120.40 124.70 2jn0 s VAL 47 Ca 0.10 1.55 0.00 0.00 0.00 0.00 0.00 61.98 63.63 2jn0 s VAL 47 Cb 0.16 -4.33 0.00 0.00 0.00 0.00 0.00 36.38 32.21 2jn0 s VAL 47 CO 0.65 -0.41 0.00 -0.24 0.00 0.00 0.00 175.10 175.10 2jn0 n SER 48 N 6.66 0.00 -3.96 3.32 2.88 -0.55 -4.81 113.62 117.15 2jn0 n SER 48 Ca 0.09 0.00 -0.30 0.00 -1.33 0.00 0.00 58.87 57.33 2jn0 n SER 48 Cb 0.47 -0.27 -0.16 0.00 -0.75 0.00 0.00 64.21 63.51 2jn0 n SER 48 CO 0.00 0.00 0.00 -1.10 -1.23 0.00 0.00 175.04 172.71 2jn0 s GLN 49 N -0.76 1.75 -0.15 -1.46 -1.52 0.31 -4.93 119.66 112.90 2jn0 s GLN 49 Ca 0.00 -1.00 -0.12 0.00 -1.95 0.00 0.00 55.36 52.28 2jn0 s GLN 49 Cb 0.00 -2.59 -0.06 0.00 -0.22 0.00 0.00 33.01 30.14 2jn0 s GLN 49 CO 0.00 -0.57 -0.27 -0.89 -0.25 0.00 0.00 175.29 173.31 2jn0 n ILE 50 N 4.65 1.32 -3.83 1.08 2.08 -1.26 -1.23 119.36 122.17 2jn0 n ILE 50 Ca -0.13 0.01 0.04 0.00 0.56 0.00 0.00 62.75 63.23 2jn0 n ILE 50 Cb 0.44 -2.02 0.01 0.00 -0.75 0.00 0.00 39.64 37.32 2jn0 n ILE 50 CO 0.00 0.00 0.00 -0.51 0.56 0.00 0.00 176.55 176.60 2jn0 s ILE 51 N -2.57 0.00 -0.39 1.39 2.07 -1.26 -4.73 121.20 115.71 2jn0 s ILE 51 Ca -0.25 -0.08 -0.28 0.00 -1.41 0.00 0.00 60.65 58.63 2jn0 s ILE 51 Cb 0.06 -2.57 -0.02 0.00 0.13 0.00 0.00 42.46 40.07 2jn0 s ILE 51 CO 0.34 0.00 1.82 -0.70 -1.91 0.00 0.00 174.94 174.49 2jn0 s GLU 52 N -2.07 3.17 0.00 3.50 2.12 -1.26 -5.15 118.70 119.00 2jn0 s GLU 52 Ca 0.24 1.25 0.26 0.00 0.36 0.00 0.00 54.97 57.09 2jn0 s GLU 52 Cb 0.03 -4.24 0.67 0.00 0.26 0.00 0.00 34.13 30.85 2jn0 s GLU 52 CO -0.04 -2.06 1.53 0.54 -0.54 0.00 0.00 175.26 174.70