#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jxh n ALA 2 N 0.00 5.09 -2.07 -5.12 0.00 -1.26 -5.03 120.51 112.13 2jxh n ALA 2 Ca 0.00 -3.52 -0.42 0.00 0.00 0.00 0.00 53.44 49.50 2jxh n ALA 2 Cb 0.00 -0.78 -0.03 0.00 0.00 0.00 0.00 19.45 18.64 2jxh n ALA 2 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2jxh s THR 3 N -4.22 3.02 0.34 0.00 -4.23 -1.26 -5.01 115.64 104.28 2jxh s THR 3 Ca 0.52 0.73 0.02 0.00 -1.18 0.00 0.00 61.69 61.78 2jxh s THR 3 Cb 0.43 -3.47 -0.03 0.00 1.34 0.00 0.00 72.50 70.78 2jxh s THR 3 CO 0.01 0.06 0.53 0.42 -0.54 0.00 0.00 174.62 175.09 2jxh s THR 4 N 1.15 4.86 -0.39 3.99 -4.23 -1.26 -5.03 115.64 114.73 2jxh s THR 4 Ca 0.67 -0.61 -0.29 0.00 -1.18 0.00 0.00 61.69 60.28 2jxh s THR 4 Cb -0.40 -3.76 0.00 0.00 1.34 0.00 0.00 72.50 69.68 2jxh s THR 4 CO 0.31 -0.45 1.55 -0.89 -0.54 0.00 0.00 174.62 174.60 2jxh s THR 5 N -2.28 3.75 0.03 3.99 2.01 -1.26 -4.98 115.64 116.89 2jxh s THR 5 Ca 0.41 0.76 0.07 0.00 0.31 0.00 0.00 61.69 63.23 2jxh s THR 5 Cb -0.10 -4.02 -0.02 0.00 0.01 0.00 0.00 72.50 68.37 2jxh s THR 5 CO 0.35 -0.66 -0.21 -0.76 -0.69 0.00 0.00 174.62 172.65 2jxh s LEU 6 N 5.98 2.14 -0.00 4.42 1.43 -1.26 -5.11 118.68 126.27 2jxh s LEU 6 Ca 0.67 -0.49 -0.30 0.00 -1.03 0.00 0.00 54.13 52.99 2jxh s LEU 6 Cb -0.16 -0.99 -0.06 0.00 0.03 0.00 0.00 46.19 45.00 2jxh s LEU 6 CO 0.33 0.18 1.45 -0.83 0.23 0.00 0.00 176.35 177.70 2jxh s GLY 7 N -1.01 1.78 0.25 -3.19 0.00 -1.26 -5.01 107.32 98.88 2jxh s GLY 7 Ca 0.08 0.91 0.03 0.00 0.00 0.00 0.00 44.72 45.73 2jxh s GLY 7 CO 0.01 2.60 0.01 0.14 0.00 0.00 0.00 173.10 175.86 2jxh s VAL 8 N 2.61 1.03 -0.16 1.40 1.01 -1.26 -5.15 120.40 119.88 2jxh s VAL 8 Ca 0.65 -2.03 -0.03 0.00 0.00 0.00 0.00 61.98 60.58 2jxh s VAL 8 Cb -0.32 -2.43 -0.02 0.00 0.00 0.00 0.00 36.38 33.61 2jxh s VAL 8 CO 0.27 -0.25 -0.06 -0.54 0.00 0.00 0.00 175.10 174.51 2jxh s LYS 9 N -3.88 3.53 -0.02 2.72 1.02 -1.26 -5.10 119.74 116.75 2jxh s LYS 9 Ca 0.30 -0.59 0.02 0.00 0.02 0.00 0.00 55.97 55.72 2jxh s LYS 9 Cb 0.06 -2.86 0.01 0.00 -0.52 0.00 0.00 37.83 34.51 2jxh s LYS 9 CO 0.10 0.13 -0.05 -0.51 -0.92 0.00 0.00 175.35 174.11 2jxh s LEU 10 N 0.61 1.72 0.41 3.17 1.43 -1.26 -5.16 118.68 119.61 2jxh s LEU 10 Ca -0.04 -0.11 0.01 0.00 -1.03 0.00 0.00 54.13 52.96 2jxh s LEU 10 Cb -0.15 -0.35 -0.01 0.00 0.03 0.00 0.00 46.19 45.72 2jxh s LEU 10 CO 0.03 0.02 0.62 -0.62 0.23 0.00 0.00 176.35 176.62 2jxh s ASP 11 N 0.29 5.95 0.07 2.29 -1.08 -1.26 -4.99 116.67 117.94 2jxh s ASP 11 Ca -0.03 0.26 -0.32 0.00 -0.52 0.00 0.00 52.55 51.95 2jxh s ASP 11 Cb -0.07 -1.61 -0.18 0.00 -1.46 0.00 0.00 42.92 39.60 2jxh s ASP 11 CO -0.00 -0.58 1.64 0.44 0.52 0.00 0.00 175.17 177.19 2jxh h ASP 12 N 0.54 -0.66 -0.87 -0.34 3.32 -2.01 -2.22 116.42 114.17 2jxh h ASP 12 Ca -0.47 0.02 0.10 0.00 0.02 0.00 0.00 57.03 56.70 2jxh h ASP 12 Cb 1.25 0.17 -0.06 0.00 0.22 0.00 0.00 39.33 40.90 2jxh h ASP 12 CO 0.58 -0.47 0.57 1.55 -1.72 0.00 0.00 179.24 179.74 2jxh h PRO 13 N -0.78 0.84 -0.30 3.56 0.13 -2.00 -1.01 132.00 132.44 2jxh h PRO 13 Ca -0.08 -0.05 -0.13 0.00 -0.87 0.00 0.00 66.00 64.87 2jxh h PRO 13 Cb 0.60 -0.19 -0.01 0.00 0.13 0.00 0.00 31.00 31.53 2jxh h PRO 13 CO 0.13 0.55 -0.36 0.00 -0.23 0.00 0.00 178.00 178.10 2jxh h THR 14 N 0.86 1.29 -0.24 1.56 1.03 -1.95 -0.74 112.91 114.71 2jxh h THR 14 Ca 0.40 -1.51 0.00 0.00 -0.01 0.00 0.00 66.41 65.30 2jxh h THR 14 Cb 0.41 1.44 -0.01 0.00 -1.07 0.00 0.00 68.15 68.92 2jxh h THR 14 CO -0.17 0.49 0.15 -0.09 -0.01 0.00 0.00 175.52 175.89 2jxh h ARG 15 N 0.57 0.30 -0.45 0.00 1.12 -0.57 0.63 114.38 115.98 2jxh h ARG 15 Ca 0.06 -0.02 0.00 0.00 -1.11 0.00 0.00 59.98 58.91 2jxh h ARG 15 Cb 0.88 -0.07 -0.02 0.00 -0.01 0.00 0.00 29.97 30.75 2jxh h ARG 15 CO 0.08 0.20 0.29 0.93 -3.11 0.00 0.00 179.97 178.36 2jxh h GLU 16 N 0.31 0.59 -0.50 0.20 5.08 -1.18 -1.15 114.58 117.94 2jxh h GLU 16 Ca 0.09 -0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.38 2jxh h GLU 16 Cb -0.02 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.07 2jxh h GLU 16 CO -0.03 0.40 0.19 -0.09 -1.00 0.00 0.00 179.01 178.48 2jxh h ARG 17 N 0.60 0.71 0.00 2.33 2.43 -0.55 0.57 114.38 120.48 2jxh h ARG 17 Ca 0.16 -0.10 -0.02 0.00 -0.81 0.00 0.00 59.98 59.21 2jxh h ARG 17 Cb -0.06 -0.13 -0.00 0.00 -0.42 0.00 0.00 29.97 29.36 2jxh h ARG 17 CO -0.03 0.59 -0.07 -0.07 -1.51 0.00 0.00 179.97 178.88 2jxh h LEU 18 N 0.71 0.00 -0.67 3.80 4.07 0.14 -0.05 115.31 123.30 2jxh h LEU 18 Ca 0.17 0.00 -0.08 0.00 0.08 0.00 0.00 57.88 58.05 2jxh h LEU 18 Cb 0.15 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 41.87 2jxh h LEU 18 CO -0.02 0.07 0.12 0.50 -1.08 0.00 0.00 178.44 178.04 2jxh h LYS 19 N 0.00 1.10 -0.89 1.13 3.64 0.13 0.72 116.57 122.40 2jxh h LYS 19 Ca -0.00 -0.29 -0.02 0.00 -1.27 0.00 0.00 60.65 59.07 2jxh h LYS 19 Cb 0.13 -0.13 -0.04 0.00 -0.41 0.00 0.00 32.23 31.78 2jxh h LYS 19 CO 0.01 1.00 0.49 0.00 -2.27 0.00 0.00 179.45 178.68 2jxh h ALA 20 N 1.05 1.14 -0.60 5.00 0.00 -0.83 0.31 119.26 125.34 2jxh h ALA 20 Ca 0.21 -0.13 -0.09 0.00 0.00 0.00 0.00 54.91 54.90 2jxh h ALA 20 Cb 0.42 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 2jxh h ALA 20 CO 0.01 0.65 0.02 0.00 0.00 0.00 0.00 179.25 179.93 2jxh h ALA 21 N 1.27 0.90 -0.93 0.00 0.00 -0.37 -1.49 119.26 118.64 2jxh h ALA 21 Ca 0.31 -0.30 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 2jxh h ALA 21 Cb 0.02 -0.23 -0.05 0.00 0.00 0.00 0.00 17.79 17.54 2jxh h ALA 21 CO -0.05 0.66 0.57 0.00 0.00 0.00 0.00 179.25 180.43 2jxh h ALA 22 N 1.06 1.18 -0.84 0.00 0.00 0.14 -1.63 119.26 119.17 2jxh h ALA 22 Ca 0.17 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 2jxh h ALA 22 Cb 0.52 -0.37 -0.04 0.00 0.00 0.00 0.00 17.79 17.90 2jxh h ALA 22 CO 0.03 0.63 0.39 1.96 0.00 0.00 0.00 179.25 182.26 2jxh h GLN 23 N 1.28 1.22 -0.53 0.00 1.08 -0.00 0.85 115.11 119.01 2jxh h GLN 23 Ca 0.33 -0.19 0.00 0.00 -1.45 0.00 0.00 58.65 57.35 2jxh h GLN 23 Cb -0.07 -0.22 -0.03 0.00 -0.05 0.00 0.00 27.48 27.12 2jxh h GLN 23 CO -0.06 0.94 0.34 0.77 -0.95 0.00 0.00 178.83 179.87 2jxh h SER 24 N 1.20 0.62 -0.32 1.46 0.02 -0.36 -2.43 113.55 113.74 2jxh h SER 24 Ca 0.29 -0.02 0.00 0.00 -0.84 0.00 0.00 61.79 61.22 2jxh h SER 24 Cb 0.14 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.52 2jxh h SER 24 CO -0.03 0.46 0.00 0.00 -1.14 0.00 0.00 176.83 176.12 2jxh n ILE 25 N -4.44 1.65 -4.18 3.27 0.13 -0.78 -4.99 119.36 110.02 2jxh n ILE 25 Ca 0.05 -1.42 -0.32 0.00 -1.10 0.00 0.00 62.75 59.96 2jxh n ILE 25 Cb 0.06 0.13 -0.05 0.00 -0.84 0.00 0.00 39.64 38.94 2jxh n ILE 25 CO 0.00 0.00 0.00 -0.90 2.80 0.00 0.00 176.55 178.45 2jxh n ASP 26 N 0.07 -1.07 -4.56 9.51 5.75 0.26 -4.95 116.55 121.57 2jxh n ASP 26 Ca 0.17 -1.10 -0.26 0.00 -0.01 0.00 0.00 54.79 53.59 2jxh n ASP 26 Cb 0.67 -2.47 -0.10 0.00 -1.03 0.00 0.00 41.12 38.19 2jxh n ASP 26 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 2jxh s ARG 27 N -6.94 1.86 0.17 0.11 1.81 0.57 -4.99 118.95 111.54 2jxh s ARG 27 Ca 0.31 -1.93 -0.30 0.00 -1.72 0.00 0.00 55.73 52.09 2jxh s ARG 27 Cb -0.17 -1.72 -0.08 0.00 -0.45 0.00 0.00 34.95 32.53 2jxh s ARG 27 CO 0.94 0.13 1.18 0.99 -0.68 0.00 0.00 175.30 177.86 2jxh s THR 28 N -2.61 3.68 0.17 0.02 2.01 -1.26 -4.50 115.64 113.16 2jxh s THR 28 Ca 0.33 1.39 -0.24 0.00 0.31 0.00 0.00 61.69 63.48 2jxh s THR 28 Cb 0.03 -3.89 0.05 0.00 0.01 0.00 0.00 72.50 68.70 2jxh s THR 28 CO 0.17 0.21 1.43 -2.65 -0.69 0.00 0.00 174.62 173.09 2jxh n PRO 29 N 2.67 -0.33 -0.01 4.92 -0.02 -1.26 0.11 135.00 141.09 2jxh n PRO 29 Ca 0.05 1.41 -0.11 0.00 -2.02 0.00 0.00 63.50 62.83 2jxh n PRO 29 Cb 0.45 -2.08 -0.05 0.00 -0.02 0.00 0.00 33.50 31.80 2jxh n PRO 29 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2jxh h HIS 30 N 0.00 0.14 -0.93 6.00 2.76 -1.98 -0.85 115.15 120.29 2jxh h HIS 30 Ca 0.22 0.00 0.01 0.00 -2.20 0.00 0.00 60.37 58.39 2jxh h HIS 30 Cb 0.45 -0.05 -0.05 0.00 1.55 0.00 0.00 27.41 29.32 2jxh h HIS 30 CO -0.90 0.09 0.60 2.35 -1.30 0.00 0.00 177.93 178.77 2jxh h TRP 31 N 0.14 1.18 -0.35 5.26 2.91 -1.62 -0.61 115.95 122.87 2jxh h TRP 31 Ca 0.04 0.02 0.01 0.00 1.13 0.00 0.00 58.89 60.08 2jxh h TRP 31 Cb -0.01 -0.40 -0.02 0.00 -0.51 0.00 0.00 29.16 28.22 2jxh h TRP 31 CO -0.07 0.76 0.23 1.25 -1.03 0.00 0.00 178.44 179.58 2jxh h LEU 32 N 1.26 0.39 -0.42 0.65 7.12 0.15 -0.45 115.31 124.01 2jxh h LEU 32 Ca 0.34 -0.01 0.01 0.00 0.13 0.00 0.00 57.88 58.34 2jxh h LEU 32 Cb -0.12 -0.10 -0.02 0.00 -0.53 0.00 0.00 40.66 39.89 2jxh h LEU 32 CO -0.07 0.28 0.28 0.40 -0.13 0.00 0.00 178.44 179.20 2jxh h ILE 33 N 0.46 1.10 -0.61 4.05 2.04 0.31 2.12 117.51 126.99 2jxh h ILE 33 Ca 0.13 -0.19 -0.01 0.00 1.00 0.00 0.00 64.86 65.78 2jxh h ILE 33 Cb -0.04 0.49 -0.03 0.00 -0.74 0.00 0.00 36.82 36.50 2jxh h ILE 33 CO -0.03 0.10 0.33 0.11 0.00 0.00 0.00 178.15 178.66 2jxh h LYS 34 N 0.56 0.85 -0.39 2.37 1.79 -1.07 -2.38 116.57 118.30 2jxh h LYS 34 Ca 0.16 -0.10 -0.16 0.00 -2.18 0.00 0.00 60.65 58.36 2jxh h LYS 34 Cb -0.05 -0.16 -0.01 0.00 -1.58 0.00 0.00 32.23 30.42 2jxh h LYS 34 CO -0.04 0.65 -0.38 1.96 -1.08 0.00 0.00 179.45 180.56 2jxh h GLN 35 N 0.82 0.94 -0.88 3.15 4.20 -0.38 -3.02 115.11 119.94 2jxh h GLN 35 Ca 0.21 -0.49 0.21 0.00 0.06 0.00 0.00 58.65 58.64 2jxh h GLN 35 Cb 0.06 0.02 -0.12 0.00 0.30 0.00 0.00 27.48 27.73 2jxh h GLN 35 CO -0.03 1.15 0.37 0.00 -0.67 0.00 0.00 178.83 179.64 2jxh h ALA 36 N 0.79 1.38 0.05 3.87 0.00 0.40 2.46 119.26 128.20 2jxh h ALA 36 Ca 0.06 0.16 -0.00 0.00 0.00 0.00 0.00 54.91 55.13 2jxh h ALA 36 Cb 0.97 0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.92 2jxh h ALA 36 CO 0.09 -0.33 -0.02 0.97 0.00 0.00 0.00 179.25 179.96 2jxh h ILE 37 N 0.39 1.31 -0.17 0.00 6.09 -1.47 -0.21 117.51 123.46 2jxh h ILE 37 Ca 0.54 -1.49 -0.20 0.00 -1.37 0.00 0.00 64.86 62.35 2jxh h ILE 37 Cb 1.01 2.24 0.00 0.00 0.47 0.00 0.00 36.82 40.54 2jxh h ILE 37 CO -0.52 0.36 -0.68 2.19 -3.07 0.00 0.00 178.15 176.42 2jxh h PHE 38 N -0.76 0.88 0.00 2.19 -5.15 -1.16 -2.46 116.94 110.48 2jxh h PHE 38 Ca -0.01 -0.36 -0.04 0.00 -0.20 0.00 0.00 57.97 57.36 2jxh h PHE 38 Cb 0.64 -0.15 -0.01 0.00 0.22 0.00 0.00 35.95 36.65 2jxh h PHE 38 CO 0.14 1.16 -0.21 -0.97 -2.00 0.00 0.00 178.31 176.43 2jxh h ASN 39 N 0.48 0.00 -0.60 -0.68 -0.00 0.40 0.23 115.58 115.42 2jxh h ASN 39 Ca -0.02 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 56.28 2jxh h ASN 39 Cb 1.28 0.00 -0.03 0.00 -0.00 0.00 0.00 38.32 39.57 2jxh h ASN 39 CO 0.13 0.21 0.39 0.22 -0.00 0.00 0.00 177.43 178.38 2jxh h TYR 40 N 0.00 0.76 -0.07 0.67 3.20 -0.56 0.54 116.97 121.52 2jxh h TYR 40 Ca -0.00 0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.86 2jxh h TYR 40 Cb 0.57 -0.25 -0.00 0.00 1.54 0.00 0.00 36.73 38.58 2jxh h TYR 40 CO 0.00 0.49 -0.05 -0.07 -1.64 0.00 0.00 178.16 176.89 2jxh h LEU 41 N 0.81 0.16 -0.99 2.82 3.38 -0.88 -3.09 115.31 117.51 2jxh h LEU 41 Ca 0.22 -0.45 0.00 0.00 0.09 0.00 0.00 57.88 57.74 2jxh h LEU 41 Cb -0.07 -0.04 -0.05 0.00 0.09 0.00 0.00 40.66 40.58 2jxh h LEU 41 CO -0.05 0.57 0.61 -0.08 0.09 0.00 0.00 178.44 179.59 2jxh h GLU 42 N -0.26 1.29 -0.86 1.13 4.81 -0.39 -2.32 114.58 117.98 2jxh h GLU 42 Ca 0.01 -0.10 -0.02 0.00 -0.13 0.00 0.00 59.36 59.12 2jxh h GLU 42 Cb 0.52 -0.28 -0.04 0.00 0.63 0.00 0.00 28.75 29.58 2jxh h GLU 42 CO 0.01 0.88 0.45 -0.22 -0.73 0.00 0.00 179.01 179.41 2jxh h LYS 43 N 1.32 1.22 0.00 1.92 3.64 0.08 -2.65 116.57 122.11 2jxh h LYS 43 Ca 0.35 -0.16 -0.11 0.00 -1.27 0.00 0.00 60.65 59.47 2jxh h LYS 43 Cb -0.10 -0.23 -0.02 0.00 -0.41 0.00 0.00 32.23 31.47 2jxh h LYS 43 CO -0.07 0.91 -0.50 1.37 -2.27 0.00 0.00 179.45 178.88 2jxh h LEU 44 N 1.21 0.00 0.00 5.20 8.10 -1.42 -3.51 115.31 124.89 2jxh h LEU 44 Ca 0.30 0.00 0.00 0.00 0.11 0.00 0.00 57.88 58.29 2jxh h LEU 44 Cb 0.06 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.28 2jxh h LEU 44 CO -0.04 0.50 0.00 -0.62 -4.11 0.00 0.00 178.44 174.17