#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 5.44 -2.09 -5.12 0.00 -1.26 -5.05 120.51 112.42 2jxh n ALA 2 Ca 0.00 -4.28 -0.42 0.00 0.00 0.00 0.00 53.44 48.74 2jxh n ALA 2 Cb 0.00 -0.92 -0.03 0.00 0.00 0.00 0.00 19.45 18.51 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 -5.41 3.14 0.10 0.00 -4.23 -1.26 -5.02 115.64 102.97 2jxh s THR 3 Ca 0.49 0.84 0.05 0.00 -1.18 0.00 0.00 61.69 61.89 2jxh s THR 3 Cb 0.41 -3.54 -0.04 0.00 1.34 0.00 0.00 72.50 70.67 2jxh s THR 3 CO -0.25 0.08 0.03 -0.89 -0.54 0.00 0.00 174.62 173.05 2jxh s THR 4 N 0.92 4.13 -0.44 3.99 2.01 -1.26 -5.05 115.64 119.95 2jxh s THR 4 Ca 0.64 -1.00 -0.27 0.00 0.31 0.00 0.00 61.69 61.37 2jxh s THR 4 Cb -0.38 -3.00 -0.03 0.00 0.01 0.00 0.00 72.50 69.10 2jxh s THR 4 CO 0.32 0.07 1.95 -0.89 -0.69 0.00 0.00 174.62 175.39 2jxh s THR 5 N -1.41 3.32 0.11 -0.82 2.01 -1.26 -4.96 115.64 112.64 2jxh s THR 5 Ca 0.27 0.28 0.09 0.00 0.31 0.00 0.00 61.69 62.64 2jxh s THR 5 Cb -0.11 -3.59 -0.04 0.00 0.01 0.00 0.00 72.50 68.77 2jxh s THR 5 CO 0.20 -0.48 -0.23 -0.76 -0.69 0.00 0.00 174.62 172.65 2jxh s LEU 6 N 8.54 2.31 0.01 4.42 1.43 -1.26 -5.11 118.68 129.02 2jxh s LEU 6 Ca 0.80 -0.71 -0.30 0.00 -1.03 0.00 0.00 54.13 52.89 2jxh s LEU 6 Cb -0.19 -1.03 -0.06 0.00 0.03 0.00 0.00 46.19 44.94 2jxh s LEU 6 CO 0.28 0.11 1.40 -0.83 0.23 0.00 0.00 176.35 177.54 2jxh s GLY 7 N -1.98 1.87 0.16 -3.19 0.00 -1.26 -5.02 107.32 97.91 2jxh s GLY 7 Ca 0.10 0.90 0.05 0.00 0.00 0.00 0.00 44.72 45.77 2jxh s GLY 7 CO 0.05 2.50 -0.11 0.14 0.00 0.00 0.00 173.10 175.68 2jxh s VAL 8 N 2.31 1.33 -0.31 1.40 1.01 -1.26 -5.13 120.40 119.76 2jxh s VAL 8 Ca 0.64 -2.09 -0.14 0.00 0.00 0.00 0.00 61.98 60.39 2jxh s VAL 8 Cb -0.32 -1.89 -0.03 0.00 0.00 0.00 0.00 36.38 34.14 2jxh s VAL 8 CO 0.27 -0.69 0.31 -0.54 0.00 0.00 0.00 175.10 174.45 2jxh s LYS 9 N -3.68 3.79 -0.02 2.72 -0.14 -1.26 -5.05 119.74 116.08 2jxh s LYS 9 Ca 0.18 -0.28 0.01 0.00 -1.36 0.00 0.00 55.97 54.53 2jxh s LYS 9 Cb 0.01 -3.73 0.01 0.00 -1.68 0.00 0.00 37.83 32.45 2jxh s LYS 9 CO 0.02 -0.36 -0.04 -0.51 -0.76 0.00 0.00 175.35 173.71 2jxh s LEU 10 N 1.95 1.57 0.68 3.17 1.43 -1.26 -5.11 118.68 121.09 2jxh s LEU 10 Ca 0.11 -0.09 -0.09 0.00 -1.03 0.00 0.00 54.13 53.03 2jxh s LEU 10 Cb -0.16 -0.32 0.02 0.00 0.03 0.00 0.00 46.19 45.76 2jxh s LEU 10 CO 0.11 -0.02 1.03 -0.62 0.23 0.00 0.00 176.35 177.08 2jxh s ASP 11 N 0.52 5.34 0.10 2.29 -1.08 -1.26 -4.87 116.67 117.71 2jxh s ASP 11 Ca -0.06 0.89 -0.31 0.00 -0.52 0.00 0.00 52.55 52.55 2jxh s ASP 11 Cb -0.09 -1.71 -0.13 0.00 -1.46 0.00 0.00 42.92 39.53 2jxh s ASP 11 CO -0.00 -1.32 1.62 0.44 0.52 0.00 0.00 175.17 176.42 2jxh h ASP 12 N -0.52 -0.93 0.29 -0.34 5.19 -2.01 -1.34 116.42 116.76 2jxh h ASP 12 Ca -0.45 0.08 -0.04 0.00 -0.62 0.00 0.00 57.03 56.00 2jxh h ASP 12 Cb 1.27 0.32 -0.01 0.00 0.18 0.00 0.00 39.33 41.09 2jxh h ASP 12 CO 0.63 -0.48 -0.18 1.55 -3.12 0.00 0.00 179.24 177.63 2jxh h PRO 13 N -0.70 0.00 -0.33 3.56 0.13 -1.99 -2.43 132.00 130.24 2jxh h PRO 13 Ca -0.02 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.97 2jxh h PRO 13 Cb 0.64 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.77 2jxh h PRO 13 CO -0.07 0.18 -0.35 1.79 -0.23 0.00 0.00 178.00 179.32 2jxh h THR 14 N 0.00 1.29 -0.65 1.56 1.35 -1.82 0.48 112.91 115.12 2jxh h THR 14 Ca -0.00 -1.53 -0.06 0.00 -0.55 0.00 0.00 66.41 64.27 2jxh h THR 14 Cb 0.38 1.50 -0.03 0.00 -1.73 0.00 0.00 68.15 68.27 2jxh h THR 14 CO 0.02 0.50 0.19 -0.09 -0.25 0.00 0.00 175.52 175.89 2jxh h ARG 15 N 0.60 1.03 -0.62 4.72 2.43 -0.92 0.67 114.38 122.28 2jxh h ARG 15 Ca 0.05 -0.23 -0.08 0.00 -0.81 0.00 0.00 59.98 58.91 2jxh h ARG 15 Cb 0.94 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 30.32 2jxh h ARG 15 CO 0.09 0.91 0.06 0.93 -1.51 0.00 0.00 179.97 180.45 2jxh h GLU 16 N 0.95 1.05 -0.06 0.20 5.08 -1.32 -2.21 114.58 118.28 2jxh h GLU 16 Ca 0.21 -0.30 -0.08 0.00 -1.00 0.00 0.00 59.36 58.19 2jxh h GLU 16 Cb 0.32 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.45 2jxh h GLU 16 CO -0.00 1.00 -0.33 -0.09 -1.00 0.00 0.00 179.01 178.59 2jxh h ARG 17 N 0.96 0.11 -0.98 2.33 2.43 0.68 -1.76 114.38 118.15 2jxh h ARG 17 Ca 0.18 -0.04 0.01 0.00 -0.81 0.00 0.00 59.98 59.32 2jxh h ARG 17 Cb 0.48 -0.01 -0.05 0.00 -0.42 0.00 0.00 29.97 29.97 2jxh h ARG 17 CO 0.02 0.43 0.64 -0.07 -1.51 0.00 0.00 179.97 179.48 2jxh h LEU 18 N 0.10 1.14 -0.87 3.80 4.07 0.93 0.38 115.31 124.86 2jxh h LEU 18 Ca 0.01 -0.04 -0.02 0.00 0.08 0.00 0.00 57.88 57.91 2jxh h LEU 18 Cb 0.63 -0.29 -0.04 0.00 1.08 0.00 0.00 40.66 42.04 2jxh h LEU 18 CO 0.05 0.84 0.47 0.50 -1.08 0.00 0.00 178.44 179.22 2jxh h LYS 19 N 1.33 1.22 -0.86 1.13 3.64 -0.94 0.54 116.57 122.64 2jxh h LYS 19 Ca 0.36 -0.15 -0.01 0.00 -1.27 0.00 0.00 60.65 59.58 2jxh h LYS 19 Cb -0.13 -0.24 -0.04 0.00 -0.41 0.00 0.00 32.23 31.41 2jxh h LYS 19 CO -0.07 0.90 0.49 0.00 -2.27 0.00 0.00 179.45 178.49 2jxh h ALA 20 N 1.26 1.10 -0.61 5.00 0.00 -0.70 0.48 119.26 125.79 2jxh h ALA 20 Ca 0.31 -0.12 -0.07 0.00 0.00 0.00 0.00 54.91 55.02 2jxh h ALA 20 Cb 0.04 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 17.46 2jxh h ALA 20 CO -0.05 0.60 0.09 0.00 0.00 0.00 0.00 179.25 179.89 2jxh h ALA 21 N 1.26 1.00 -0.53 0.00 0.00 0.75 0.17 119.26 121.92 2jxh h ALA 21 Ca 0.31 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2jxh h ALA 21 Cb 0.01 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.53 2jxh h ALA 21 CO -0.05 0.63 0.33 0.00 0.00 0.00 0.00 179.25 180.16 2jxh h ALA 22 N 1.15 0.68 -0.70 0.00 0.00 0.11 -0.36 119.26 120.14 2jxh h ALA 22 Ca 0.19 -0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.97 2jxh h ALA 22 Cb 0.42 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 2jxh h ALA 22 CO 0.01 0.14 0.14 1.96 0.00 0.00 0.00 179.25 181.51 2jxh h GLN 23 N 0.72 1.13 0.00 0.00 1.08 0.49 0.82 115.11 119.35 2jxh h GLN 23 Ca 0.19 -0.29 -0.01 0.00 -1.45 0.00 0.00 58.65 57.09 2jxh h GLN 23 Cb -0.04 -0.14 -0.00 0.00 -0.05 0.00 0.00 27.48 27.25 2jxh h GLN 23 CO -0.04 1.02 -0.05 0.66 -0.95 0.00 0.00 178.83 179.47 2jxh h SER 24 N 1.06 0.00 -0.22 1.46 4.64 -0.25 -2.61 113.55 117.64 2jxh h SER 24 Ca 0.21 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.53 2jxh h SER 24 Cb 0.41 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.50 2jxh h SER 24 CO 0.01 0.05 0.00 0.00 -0.87 0.00 0.00 176.83 176.02 2jxh n ILE 25 N -3.18 0.50 -3.54 0.95 0.00 -0.18 -4.99 119.36 108.92 2jxh n ILE 25 Ca 0.00 -0.75 -0.21 0.00 0.00 0.00 0.00 62.75 61.80 2jxh n ILE 25 Cb 0.31 0.89 0.08 0.00 0.00 0.00 0.00 39.64 40.92 2jxh n ILE 25 CO 0.00 0.00 0.00 0.47 0.00 0.00 0.00 176.55 177.02 2jxh n ASP 26 N 0.73 -3.71 -4.28 9.51 8.00 0.18 -5.02 116.55 121.96 2jxh n ASP 26 Ca 0.11 -0.61 -0.15 0.00 0.71 0.00 0.00 54.79 54.84 2jxh n ASP 26 Cb 0.40 -4.96 -0.10 0.00 -0.02 0.00 0.00 41.12 36.44 2jxh n ASP 26 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 2jxh s ARG 27 N -5.82 1.19 0.34 -1.24 1.81 0.23 -4.99 118.95 110.47 2jxh s ARG 27 Ca 0.25 -1.57 -0.24 0.00 -1.72 0.00 0.00 55.73 52.45 2jxh s ARG 27 Cb -0.11 -0.52 -0.10 0.00 -0.45 0.00 0.00 34.95 33.77 2jxh s ARG 27 CO 0.74 -0.06 0.92 -0.08 -0.68 0.00 0.00 175.30 176.15 2jxh s THR 28 N -3.46 4.28 0.19 0.02 -1.32 -1.26 -3.98 115.64 110.11 2jxh s THR 28 Ca 0.24 1.70 -0.16 0.00 -1.21 0.00 0.00 61.69 62.25 2jxh s THR 28 Cb 0.05 -3.91 0.18 0.00 -1.51 0.00 0.00 72.50 67.31 2jxh s THR 28 CO 0.05 0.05 1.31 -2.65 -2.21 0.00 0.00 174.62 171.17 2jxh n PRO 29 N 0.32 -0.22 -0.05 7.08 -0.02 -1.26 0.08 135.00 140.93 2jxh n PRO 29 Ca 0.03 1.30 -0.10 0.00 -2.02 0.00 0.00 63.50 62.71 2jxh n PRO 29 Cb 0.51 -1.93 -0.03 0.00 -0.02 0.00 0.00 33.50 32.03 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 0.26 -0.85 6.00 -0.00 -1.97 0.20 115.15 118.79 2jxh h HIS 30 Ca 0.28 0.00 -0.03 0.00 -0.00 0.00 0.00 60.37 60.62 2jxh h HIS 30 Cb 0.49 -0.09 -0.04 0.00 -0.00 0.00 0.00 27.41 27.77 2jxh h HIS 30 CO -0.76 0.18 0.42 2.35 -0.00 0.00 0.00 177.93 180.13 2jxh h TRP 31 N 0.27 1.21 -0.86 5.26 2.91 -1.43 -1.96 115.95 121.35 2jxh h TRP 31 Ca 0.07 -0.05 -0.02 0.00 1.13 0.00 0.00 58.89 60.02 2jxh h TRP 31 Cb -0.01 -0.38 -0.04 0.00 -0.51 0.00 0.00 29.16 28.22 2jxh h TRP 31 CO -0.06 0.86 0.45 1.25 -1.03 0.00 0.00 178.44 179.91 2jxh h LEU 32 N 1.20 1.09 -0.56 0.65 7.12 0.15 -1.97 115.31 122.99 2jxh h LEU 32 Ca 0.29 -0.12 0.09 0.00 0.13 0.00 0.00 57.88 58.28 2jxh h LEU 32 Cb 0.09 -0.28 -0.07 0.00 -0.53 0.00 0.00 40.66 39.87 2jxh h LEU 32 CO -0.04 0.90 0.16 0.40 -0.13 0.00 0.00 178.44 179.72 2jxh h ILE 33 N 1.20 0.73 -0.68 4.05 2.04 0.18 1.86 117.51 126.90 2jxh h ILE 33 Ca 0.30 -0.11 -0.01 0.00 1.00 0.00 0.00 64.86 66.04 2jxh h ILE 33 Cb 0.07 0.39 -0.03 0.00 -0.74 0.00 0.00 36.82 36.51 2jxh h ILE 33 CO -0.04 0.06 0.39 0.11 0.00 0.00 0.00 178.15 178.67 2jxh h LYS 34 N 0.31 0.93 0.08 2.37 1.57 -1.23 -2.84 116.57 117.77 2jxh h LYS 34 Ca 0.28 -0.09 -0.00 0.00 -1.87 0.00 0.00 60.65 58.96 2jxh h LYS 34 Cb 0.37 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.49 2jxh h LYS 34 CO -0.33 0.68 -0.04 1.96 -0.57 0.00 0.00 179.45 181.15 2jxh h GLN 35 N 0.93 -0.11 -1.01 3.15 4.20 -0.08 -0.97 115.11 121.21 2jxh h GLN 35 Ca 0.24 0.01 0.28 0.00 0.06 0.00 0.00 58.65 59.24 2jxh h GLN 35 Cb 0.00 0.02 -0.13 0.00 0.30 0.00 0.00 27.48 27.67 2jxh h GLN 35 CO -0.04 0.28 0.59 0.00 -0.67 0.00 0.00 178.83 178.98 2jxh h ALA 36 N 0.35 1.90 0.03 3.87 0.00 0.29 2.26 119.26 127.95 2jxh h ALA 36 Ca -0.01 0.15 -0.22 0.00 0.00 0.00 0.00 54.91 54.83 2jxh h ALA 36 Cb 0.43 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 2jxh h ALA 36 CO 0.02 -0.43 -1.19 0.97 0.00 0.00 0.00 179.25 178.61 2jxh h ILE 37 N 0.45 1.02 -0.08 0.00 6.09 -1.52 -3.02 117.51 120.45 2jxh h ILE 37 Ca 0.69 -2.25 -0.23 0.00 -1.37 0.00 0.00 64.86 61.70 2jxh h ILE 37 Cb 1.46 2.47 0.01 0.00 0.47 0.00 0.00 36.82 41.23 2jxh h ILE 37 CO -0.53 0.46 -0.85 2.19 -3.07 0.00 0.00 178.15 176.35 2jxh h PHE 38 N -0.80 1.02 0.00 2.19 -5.15 -0.55 -2.63 116.94 111.02 2jxh h PHE 38 Ca -0.31 -0.49 -0.05 0.00 -0.20 0.00 0.00 57.97 56.92 2jxh h PHE 38 Cb 1.40 -0.14 -0.01 0.00 0.22 0.00 0.00 35.95 37.42 2jxh h PHE 38 CO 0.12 1.33 -0.26 -0.97 -2.00 0.00 0.00 178.31 176.53 2jxh h ASN 39 N 0.42 0.00 -0.73 -0.68 -0.73 0.36 0.12 115.58 114.34 2jxh h ASN 39 Ca -0.08 0.00 0.01 0.00 1.87 0.00 0.00 56.30 58.09 2jxh h ASN 39 Cb 1.50 0.00 -0.04 0.00 0.27 0.00 0.00 38.32 40.05 2jxh h ASN 39 CO 0.17 0.26 0.48 0.22 -0.37 0.00 0.00 177.43 178.19 2jxh h TYR 40 N 0.00 0.93 -0.53 0.67 3.20 -1.35 0.89 116.97 120.77 2jxh h TYR 40 Ca -0.00 0.02 -0.08 0.00 3.14 0.00 0.00 58.73 61.80 2jxh h TYR 40 Cb 0.55 -0.31 -0.02 0.00 1.54 0.00 0.00 36.73 38.49 2jxh h TYR 40 CO 0.00 0.59 0.00 -0.07 -1.64 0.00 0.00 178.16 177.04 2jxh h LEU 41 N 0.99 0.92 -0.73 2.82 3.38 -0.71 -1.55 115.31 120.42 2jxh h LEU 41 Ca 0.27 -0.31 -0.06 0.00 0.09 0.00 0.00 57.88 57.87 2jxh h LEU 41 Cb -0.10 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.37 2jxh h LEU 41 CO -0.06 1.00 0.21 -0.08 0.09 0.00 0.00 178.44 179.61 2jxh h GLU 42 N 0.81 1.15 -0.43 1.13 4.81 0.04 -1.48 114.58 120.60 2jxh h GLU 42 Ca 0.15 -0.26 -0.14 0.00 -0.13 0.00 0.00 59.36 58.98 2jxh h GLU 42 Cb 0.53 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.74 2jxh h GLU 42 CO 0.03 0.99 -0.28 0.87 -0.73 0.00 0.00 179.01 179.89 2jxh h LYS 43 N 1.10 0.94 0.00 1.92 1.57 0.98 -2.27 116.57 120.81 2jxh h LYS 43 Ca 0.23 -0.44 0.00 0.00 -1.87 0.00 0.00 60.65 58.58 2jxh h LYS 43 Cb 0.33 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.63 2jxh h LYS 43 CO -0.00 1.10 0.00 1.47 -0.57 0.00 0.00 179.45 181.44 2jxh n LEU 44 N -4.09 0.52 0.00 2.94 -0.00 -0.60 -5.09 117.00 110.68 2jxh n LEU 44 Ca -0.01 0.58 0.15 0.00 -0.00 0.00 0.00 56.01 56.73 2jxh n LEU 44 Cb 0.49 -0.45 0.88 0.00 -0.00 0.00 0.00 43.42 44.34 2jxh n LEU 44 CO 0.47 -0.27 1.05 1.21 -0.00 0.00 0.00 177.39 179.85