#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jn0 s TYR 5 N 0.00 1.20 -0.30 1.24 2.02 -1.26 -4.70 117.35 115.55 2jn0 s TYR 5 Ca 0.00 -0.27 -0.18 0.00 -0.37 0.00 0.00 57.07 56.25 2jn0 s TYR 5 Cb 0.00 -0.75 0.19 0.00 -0.40 0.00 0.00 41.96 41.00 2jn0 s TYR 5 CO 0.00 -0.00 1.22 0.54 -1.57 0.00 0.00 175.55 175.74 2jn0 s VAL 6 N -0.50 0.00 -0.34 0.71 0.11 -1.26 -4.24 120.40 114.88 2jn0 s VAL 6 Ca 0.04 0.00 -0.07 0.00 -2.93 0.00 0.00 61.98 59.01 2jn0 s VAL 6 Cb -0.06 -1.00 0.03 0.00 -1.53 0.00 0.00 36.38 33.82 2jn0 s VAL 6 CO 0.00 0.00 0.12 -0.32 -3.33 0.00 0.00 175.10 171.58 2jn0 s MET 7 N 0.85 2.70 -0.13 1.54 1.75 0.10 -4.14 119.30 121.97 2jn0 s MET 7 Ca -0.04 -1.14 -0.18 0.00 -1.25 0.00 0.00 55.69 53.08 2jn0 s MET 7 Cb -0.03 -3.51 -0.04 0.00 2.84 0.00 0.00 34.83 34.09 2jn0 s MET 7 CO -0.12 -0.66 0.49 0.00 -0.65 0.00 0.00 175.02 174.08 2jn0 s ALA 8 N 1.44 3.48 0.74 4.11 0.00 -0.06 -0.56 121.76 130.91 2jn0 s ALA 8 Ca -0.01 -0.21 0.01 0.00 0.00 0.00 0.00 51.96 51.75 2jn0 s ALA 8 Cb -0.19 -2.68 0.14 0.00 0.00 0.00 0.00 23.12 20.39 2jn0 s ALA 8 CO 0.04 -0.06 1.01 0.25 0.00 0.00 0.00 175.76 176.99 2jn0 n THR 9 N 3.80 0.00 -0.26 0.00 -2.24 -0.78 -0.28 114.28 114.52 2jn0 n THR 9 Ca -0.07 -1.65 0.02 0.00 -2.27 0.00 0.00 64.05 60.08 2jn0 n THR 9 Cb 0.51 -0.85 0.15 0.00 -2.10 0.00 0.00 70.33 68.04 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 0.67 -0.04 -0.78 3.64 0.04 -2.26 116.57 117.83 2jn0 h LYS 10 Ca -0.33 -0.04 -0.04 0.00 -1.27 0.00 0.00 60.65 58.97 2jn0 h LYS 10 Cb 1.26 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.92 2jn0 h LYS 10 CO 0.37 0.44 -0.16 -0.44 -2.27 0.00 0.00 179.45 177.39 2jn0 h ASP 11 N 0.69 0.06 0.00 4.20 3.32 -1.95 -3.46 116.42 119.28 2jn0 h ASP 11 Ca 0.37 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.40 2jn0 h ASP 11 Cb 0.35 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 39.89 2jn0 h ASP 11 CO -0.25 0.23 0.00 0.61 -1.72 0.00 0.00 179.24 178.11 2jn0 n GLY 12 N -0.99 1.15 3.73 2.75 0.00 -0.85 -5.08 105.19 105.89 2jn0 n GLY 12 Ca -0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 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 -0.43 4.40 -0.31 1.61 1.70 -1.26 -4.76 118.95 119.90 2jn0 s ARG 13 Ca 0.00 1.95 -0.13 0.00 -0.47 0.00 0.00 55.73 57.08 2jn0 s ARG 13 Cb 0.00 -3.26 -0.03 0.00 -0.57 0.00 0.00 34.95 31.10 2jn0 s ARG 13 CO 0.00 -0.27 0.29 -1.64 -1.08 0.00 0.00 175.30 172.60 2jn0 s MET 14 N 0.48 3.73 -0.21 3.89 -1.94 -1.26 -1.87 119.30 122.12 2jn0 s MET 14 Ca 0.58 -0.37 -0.13 0.00 -1.71 0.00 0.00 55.69 54.07 2jn0 s MET 14 Cb -0.34 -3.74 -0.05 0.00 2.01 0.00 0.00 34.83 32.71 2jn0 s MET 14 CO 0.33 -0.37 0.25 0.42 -0.01 0.00 0.00 175.02 175.64 2jn0 s ILE 15 N 1.88 5.31 -0.28 2.53 1.01 0.27 -4.94 121.20 126.98 2jn0 s ILE 15 Ca 0.10 0.40 -0.29 0.00 0.00 0.00 0.00 60.65 60.86 2jn0 s ILE 15 Cb -0.16 -3.59 -0.00 0.00 0.01 0.00 0.00 42.46 38.72 2jn0 s ILE 15 CO 0.11 0.34 1.32 -0.76 0.00 0.00 0.00 174.94 175.95 2jn0 s LEU 16 N 0.92 3.90 0.13 2.97 2.01 -1.26 -0.72 118.68 126.63 2jn0 s LEU 16 Ca 0.13 1.27 0.06 0.00 0.01 0.00 0.00 54.13 55.59 2jn0 s LEU 16 Cb -0.13 -3.54 -0.04 0.00 0.01 0.00 0.00 46.19 42.49 2jn0 s LEU 16 CO 0.04 -1.07 -0.13 0.42 1.01 0.00 0.00 176.35 176.62 2jn0 s THR 17 N 4.38 1.29 0.17 5.49 -4.23 -1.26 -4.18 115.64 117.30 2jn0 s THR 17 Ca 0.57 -1.77 -0.24 0.00 -1.18 0.00 0.00 61.69 59.07 2jn0 s THR 17 Cb -0.18 -1.57 -0.08 0.00 1.34 0.00 0.00 72.50 72.01 2jn0 s THR 17 CO 0.23 -0.47 0.76 1.51 -0.54 0.00 0.00 174.62 176.11 2jn0 s ASP 18 N -2.57 7.34 0.81 3.99 1.47 -1.23 -4.10 116.67 122.38 2jn0 s ASP 18 Ca 0.10 1.60 -0.13 0.00 1.18 0.00 0.00 52.55 55.30 2jn0 s ASP 18 Cb -0.04 -2.48 0.09 0.00 -0.34 0.00 0.00 42.92 40.14 2jn0 s ASP 18 CO 0.03 0.20 1.19 -0.83 0.68 0.00 0.00 175.17 176.43 2jn0 s GLY 19 N -1.19 2.09 0.00 2.12 0.00 -1.26 -4.55 107.32 104.52 2jn0 s GLY 19 Ca 0.36 0.78 0.00 0.00 0.00 0.00 0.00 44.72 45.86 2jn0 s GLY 19 CO 0.25 1.20 0.00 0.28 0.00 0.00 0.00 173.10 174.83 2jn0 n LYS 20 N -3.38 0.00 -2.53 2.90 5.02 -1.26 -5.02 118.16 113.89 2jn0 n LYS 20 Ca 0.13 0.18 -0.42 0.00 -2.02 0.00 0.00 58.31 56.18 2jn0 n LYS 20 Cb 0.51 -0.54 -0.03 0.00 -0.02 0.00 0.00 35.03 34.95 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 -1.45 4.50 -0.50 1.97 0.04 -1.26 -4.88 135.00 133.42 2jn0 s PRO 21 Ca 0.00 1.65 -0.23 0.00 0.04 0.00 0.00 61.00 62.46 2jn0 s PRO 21 Cb 0.00 -3.37 0.04 0.00 0.04 0.00 0.00 34.50 31.21 2jn0 s PRO 21 CO 0.00 -0.14 0.83 -2.00 0.04 0.00 0.00 177.00 175.73 2jn0 s GLU 22 N 0.83 3.33 -0.12 4.56 -6.30 0.59 -4.84 118.70 116.74 2jn0 s GLU 22 Ca 0.55 -0.29 -0.23 0.00 -2.50 0.00 0.00 54.97 52.50 2jn0 s GLU 22 Cb -0.27 -4.01 -0.03 0.00 0.00 0.00 0.00 34.13 29.82 2jn0 s GLU 22 CO 0.30 -1.30 0.69 0.42 0.02 0.00 0.00 175.26 175.38 2jn0 s ILE 23 N 3.49 5.02 -0.37 -3.70 1.01 -1.26 0.35 121.20 125.74 2jn0 s ILE 23 Ca 0.28 1.37 -0.18 0.00 0.00 0.00 0.00 60.65 62.12 2jn0 s ILE 23 Cb -0.13 -4.02 0.00 0.00 0.01 0.00 0.00 42.46 38.33 2jn0 s ILE 23 CO 0.19 0.18 0.52 -0.62 0.00 0.00 0.00 174.94 175.22 2jn0 s ASP 24 N 0.94 6.30 0.00 3.58 -1.08 0.15 -4.93 116.67 121.63 2jn0 s ASP 24 Ca 0.35 -0.16 0.16 0.00 -0.52 0.00 0.00 52.55 52.37 2jn0 s ASP 24 Cb -0.17 -2.27 0.60 0.00 -1.46 0.00 0.00 42.92 39.63 2jn0 s ASP 24 CO 0.15 -0.54 1.44 0.47 0.52 0.00 0.00 175.17 177.20 2jn0 n ASP 25 N 5.81 1.37 -0.11 -0.34 8.00 -1.26 -1.28 116.55 128.73 2jn0 n ASP 25 Ca -0.05 -1.78 -0.21 0.00 0.71 0.00 0.00 54.79 53.47 2jn0 n ASP 25 Cb 0.49 -0.12 -0.08 0.00 -0.02 0.00 0.00 41.12 41.38 2jn0 n ASP 25 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2jn0 n ASP 26 N 0.17 1.90 0.01 -2.24 8.00 -1.26 -4.58 116.55 118.55 2jn0 n ASP 26 Ca 0.13 0.41 0.11 0.00 0.71 0.00 0.00 54.79 56.15 2jn0 n ASP 26 Cb 0.26 -0.87 -0.12 0.00 -0.02 0.00 0.00 41.12 40.37 2jn0 n ASP 26 CO 0.00 0.00 0.00 1.07 -0.39 0.00 0.00 177.20 177.88 2jn0 n THR 27 N -4.39 0.10 -1.48 -3.53 5.66 -1.26 -4.99 114.28 104.39 2jn0 n THR 27 Ca -0.35 -0.41 0.00 0.00 -3.05 0.00 0.00 64.05 60.24 2jn0 n THR 27 Cb 0.68 0.11 0.00 0.00 -1.55 0.00 0.00 70.33 69.57 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 1.29 0.92 3.83 1.09 0.00 -0.41 -4.98 105.19 106.93 2jn0 n GLY 28 Ca -0.02 -0.56 -0.22 0.00 0.00 0.00 0.00 46.02 45.23 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 -0.23 3.67 -0.22 0.99 1.43 -1.03 -0.29 118.68 122.99 2jn0 s LEU 29 Ca 0.00 -0.40 0.01 0.00 -1.03 0.00 0.00 54.13 52.71 2jn0 s LEU 29 Cb 0.00 -2.24 0.05 0.00 0.03 0.00 0.00 46.19 44.03 2jn0 s LEU 29 CO 0.00 -0.20 -0.10 -0.69 0.23 0.00 0.00 176.35 175.60 2jn0 s VAL 30 N -2.23 1.78 -0.68 -1.59 1.01 0.22 0.30 120.40 119.20 2jn0 s VAL 30 Ca 0.37 -1.24 -0.25 0.00 0.00 0.00 0.00 61.98 60.86 2jn0 s VAL 30 Cb -0.07 -1.90 0.05 0.00 0.00 0.00 0.00 36.38 34.46 2jn0 s VAL 30 CO 0.25 0.06 1.11 -0.44 0.00 0.00 0.00 175.10 176.08 2jn0 s SER 31 N 1.31 6.19 0.61 3.32 0.01 0.15 -0.77 113.70 124.53 2jn0 s SER 31 Ca -0.04 -0.66 0.06 0.00 1.31 0.00 0.00 55.95 56.62 2jn0 s SER 31 Cb -0.18 -2.49 0.09 0.00 0.21 0.00 0.00 66.02 63.66 2jn0 s SER 31 CO -0.07 -1.60 0.84 -0.72 0.41 0.00 0.00 173.24 172.10 2jn0 s TYR 32 N 4.80 1.58 -0.06 2.43 1.13 0.14 -0.30 117.35 127.07 2jn0 s TYR 32 Ca 0.29 -0.56 0.04 0.00 -1.41 0.00 0.00 57.07 55.43 2jn0 s TYR 32 Cb -0.12 -2.46 0.00 0.00 -1.10 0.00 0.00 41.96 38.28 2jn0 s TYR 32 CO 0.14 -1.26 -0.18 -1.01 -2.51 0.00 0.00 175.55 170.72 2jn0 s HIS 33 N -2.78 1.91 0.61 -3.49 3.76 -1.26 -1.60 115.29 112.44 2jn0 s HIS 33 Ca 0.63 -0.65 -0.18 0.00 -0.15 0.00 0.00 55.06 54.71 2jn0 s HIS 33 Cb -0.06 -1.30 -0.02 0.00 1.11 0.00 0.00 32.58 32.30 2jn0 s HIS 33 CO 0.40 -0.26 1.16 -0.51 -0.85 0.00 0.00 174.74 174.68 2jn0 s ASP 34 N 0.25 5.21 0.00 1.40 1.01 0.17 -3.58 116.67 121.13 2jn0 s ASP 34 Ca -0.10 2.22 0.22 0.00 0.71 0.00 0.00 52.55 55.59 2jn0 s ASP 34 Cb -0.14 -2.58 1.02 0.00 1.01 0.00 0.00 42.92 42.22 2jn0 s ASP 34 CO 0.04 -1.57 1.70 0.00 0.21 0.00 0.00 175.17 175.56 2jn0 n GLN 35 N -1.85 0.15 0.02 8.23 6.02 -1.26 -1.72 117.38 126.97 2jn0 n GLN 35 Ca 0.12 0.10 0.13 0.00 -0.01 0.00 0.00 57.00 57.35 2jn0 n GLN 35 Cb 0.51 -1.50 0.45 0.00 1.02 0.00 0.00 30.24 30.72 2jn0 n GLN 35 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 177.06 176.99 2jn0 n GLN 36 N -1.40 0.07 -0.71 -1.09 7.27 -1.26 -4.93 117.38 115.34 2jn0 n GLN 36 Ca 0.08 0.04 0.00 0.00 0.07 0.00 0.00 57.00 57.19 2jn0 n GLN 36 Cb 0.22 -1.57 0.00 0.00 2.41 0.00 0.00 30.24 31.30 2jn0 n GLN 36 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2jn0 n GLY 37 N 1.45 1.36 3.36 1.69 0.00 -0.70 -5.09 105.19 107.27 2jn0 n GLY 37 Ca 0.06 -0.29 -0.33 0.00 0.00 0.00 0.00 46.02 45.46 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 -2.34 4.09 -0.23 1.61 0.01 -1.25 -4.90 114.94 111.93 2jn0 s ASN 38 Ca 0.00 -0.33 -0.20 0.00 -0.71 0.00 0.00 52.86 51.62 2jn0 s ASN 38 Cb 0.00 -1.64 -0.02 0.00 0.41 0.00 0.00 41.25 40.00 2jn0 s ASN 38 CO 0.00 0.13 0.61 0.00 -1.51 0.00 0.00 177.10 176.34 2jn0 s ALA 39 N 0.54 3.58 0.08 0.60 0.00 -1.26 0.46 121.76 125.77 2jn0 s ALA 39 Ca -0.08 -0.39 0.02 0.00 0.00 0.00 0.00 51.96 51.51 2jn0 s ALA 39 Cb -0.15 -2.98 -0.04 0.00 0.00 0.00 0.00 23.12 19.94 2jn0 s ALA 39 CO 0.04 -0.69 -0.07 -1.64 0.00 0.00 0.00 175.76 173.40 2jn0 s MET 40 N 2.23 0.76 -0.14 0.00 -1.94 -0.63 -4.98 119.30 114.60 2jn0 s MET 40 Ca 0.26 -1.20 0.02 0.00 -1.71 0.00 0.00 55.69 53.06 2jn0 s MET 40 Cb -0.16 -0.22 0.01 0.00 2.01 0.00 0.00 34.83 36.47 2jn0 s MET 40 CO 0.09 -0.00 -0.21 -0.65 -0.01 0.00 0.00 175.02 174.24 2jn0 s GLN 41 N -3.32 3.06 0.55 2.03 -0.21 -1.26 0.28 119.66 120.79 2jn0 s GLN 41 Ca 0.07 -0.83 0.07 0.00 0.02 0.00 0.00 55.36 54.68 2jn0 s GLN 41 Cb 0.02 -2.46 0.07 0.00 1.00 0.00 0.00 33.01 31.63 2jn0 s GLN 41 CO -0.04 0.01 0.57 0.44 -2.12 0.00 0.00 175.29 174.16 2jn0 n ILE 42 N 4.02 0.00 -2.85 1.08 -5.35 0.05 -4.84 119.36 111.48 2jn0 n ILE 42 Ca -0.20 -2.02 -0.36 0.00 -0.27 0.00 0.00 62.75 59.90 2jn0 n ILE 42 Cb 0.52 -0.26 -0.06 0.00 -1.74 0.00 0.00 39.64 38.09 2jn0 n ILE 42 CO 0.00 0.00 0.00 0.20 -1.76 0.00 0.00 176.55 174.99 2jn0 s ASN 43 N -4.31 7.25 0.06 7.28 0.01 -1.26 0.69 114.94 124.66 2jn0 s ASN 43 Ca 0.43 1.74 0.18 0.00 -0.71 0.00 0.00 52.86 54.51 2jn0 s ASN 43 Cb -0.03 -2.54 0.77 0.00 0.41 0.00 0.00 41.25 39.85 2jn0 s ASN 43 CO 0.28 -0.07 1.58 -1.14 -1.51 0.00 0.00 177.10 176.23 2jn0 n ARG 44 N 0.48 0.05 0.24 -0.60 0.63 0.61 -0.89 116.66 117.18 2jn0 n ARG 44 Ca 0.02 0.26 0.13 0.00 -0.92 0.00 0.00 57.85 57.34 2jn0 n ARG 44 Cb 0.51 -1.59 0.44 0.00 0.45 0.00 0.00 32.46 32.26 2jn0 n ARG 44 CO 0.00 0.00 0.00 0.22 -2.51 0.00 0.00 177.63 175.34 2jn0 h ASP 45 N 0.00 0.00 0.00 6.15 1.82 -1.91 -3.28 116.42 119.19 2jn0 h ASP 45 Ca 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.64 2jn0 h ASP 45 Cb 0.32 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.33 2jn0 h ASP 45 CO 0.00 0.08 -1.17 0.47 -1.61 0.00 0.00 179.24 177.00 2jn0 n ASP 46 N -3.16 0.79 -4.86 2.28 8.00 -0.07 -4.85 116.55 114.69 2jn0 n ASP 46 Ca 0.02 -0.68 -0.31 0.00 0.71 0.00 0.00 54.79 54.53 2jn0 n ASP 46 Cb 0.43 1.25 0.01 0.00 -0.02 0.00 0.00 41.12 42.79 2jn0 n ASP 46 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 2jn0 s VAL 47 N -2.94 4.56 0.32 2.53 -7.23 -1.13 0.65 120.40 117.16 2jn0 s VAL 47 Ca 0.03 0.92 0.00 0.00 -1.81 0.00 0.00 61.98 61.12 2jn0 s VAL 47 Cb 0.14 -3.77 0.00 0.00 0.56 0.00 0.00 36.38 33.31 2jn0 s VAL 47 CO 0.78 -1.00 0.00 -0.24 -0.31 0.00 0.00 175.10 174.34 2jn0 n SER 48 N -2.53 -2.19 -4.04 4.85 2.88 -1.08 -4.23 113.62 107.28 2jn0 n SER 48 Ca 0.06 0.60 -0.32 0.00 -1.33 0.00 0.00 58.87 57.89 2jn0 n SER 48 Cb 0.54 2.17 -0.14 0.00 -0.75 0.00 0.00 64.21 66.03 2jn0 n SER 48 CO 0.00 0.00 0.00 -1.58 -1.23 0.00 0.00 175.04 172.23 2jn0 s GLN 49 N -1.76 1.60 -0.31 -1.46 0.74 0.62 -5.01 119.66 114.07 2jn0 s GLN 49 Ca 0.00 -1.86 -0.03 0.00 0.05 0.00 0.00 55.36 53.53 2jn0 s GLN 49 Cb 0.00 -3.28 0.05 0.00 1.10 0.00 0.00 33.01 30.88 2jn0 s GLN 49 CO 0.00 -0.96 0.03 0.42 -0.55 0.00 0.00 175.29 174.23 2jn0 s ILE 50 N 0.95 3.15 -0.73 -2.34 1.01 -1.26 -0.88 121.20 121.10 2jn0 s ILE 50 Ca 0.10 -1.37 0.18 0.00 0.00 0.00 0.00 60.65 59.56 2jn0 s ILE 50 Cb -0.20 -2.82 -0.22 0.00 0.01 0.00 0.00 42.46 39.23 2jn0 s ILE 50 CO -0.07 -0.15 0.72 -0.38 0.00 0.00 0.00 174.94 175.06 2jn0 n ILE 51 N 4.65 0.00 0.00 2.92 5.41 -1.26 -4.65 119.36 126.44 2jn0 n ILE 51 Ca -0.12 -0.13 0.00 0.00 1.00 0.00 0.00 62.75 63.50 2jn0 n ILE 51 Cb 0.43 0.84 0.00 0.00 -0.71 0.00 0.00 39.64 40.20 2jn0 n ILE 51 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 2jn0 n GLU 52 N -1.56 0.00 -0.42 0.38 1.02 -1.26 -5.03 120.64 113.76 2jn0 n GLU 52 Ca 0.02 0.46 0.00 0.00 -0.02 0.00 0.00 57.16 57.63 2jn0 n GLU 52 Cb 0.32 -1.28 0.00 0.00 -0.02 0.00 0.00 31.44 30.46 2jn0 n GLU 52 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18