#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jpk h LYS 2 N 0.00 0.26 -6.07 1.97 2.10 -2.11 -3.46 116.57 109.25 2jpk h LYS 2 Ca 0.00 -0.03 -0.41 0.00 -2.00 0.00 0.00 60.65 58.21 2jpk h LYS 2 Cb 0.00 -0.05 0.06 0.00 -0.90 0.00 0.00 32.23 31.34 2jpk h LYS 2 CO 0.00 0.25 -0.83 0.91 -2.00 0.00 0.00 179.45 177.78 2jpk n TRP 3 N -4.43 -1.92 -0.10 0.07 8.01 -1.26 -4.87 117.44 112.94 2jpk n TRP 3 Ca -0.00 0.84 0.05 0.00 -1.31 0.00 0.00 57.50 57.07 2jpk n TRP 3 Cb 0.14 -4.40 0.25 0.00 -2.01 0.00 0.00 31.31 25.30 2jpk n TRP 3 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2jpk n GLY 4 N -1.56 2.25 0.05 6.99 0.00 -1.26 -4.33 105.19 107.33 2jpk n GLY 4 Ca -0.30 -0.58 -0.02 0.00 0.00 0.00 0.00 46.02 45.13 2jpk n GLY 4 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 2jpk h TRP 5 N 2.61 0.00 0.00 1.61 6.55 -2.00 -3.23 115.95 121.49 2jpk h TRP 5 Ca 0.00 0.00 -0.04 0.00 0.95 0.00 0.00 58.89 59.80 2jpk h TRP 5 Cb 1.32 0.00 -0.01 0.00 -0.86 0.00 0.00 29.16 29.61 2jpk h TRP 5 CO 0.64 0.11 -0.20 1.37 -1.05 0.00 0.00 178.44 179.32 2jpk h LEU 6 N -1.00 0.00 -1.42 -4.49 8.10 -1.99 -2.10 115.31 112.41 2jpk h LEU 6 Ca -0.00 0.00 -0.06 0.00 0.11 0.00 0.00 57.88 57.93 2jpk h LEU 6 Cb 0.12 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 40.33 2jpk h LEU 6 CO -0.00 0.20 -0.29 0.00 -4.11 0.00 0.00 178.44 174.23 2jpk h ALA 7 N 1.80 1.47 0.00 0.17 0.00 -1.76 0.82 119.26 121.77 2jpk h ALA 7 Ca -0.00 -0.26 -0.23 0.00 0.00 0.00 0.00 54.91 54.42 2jpk h ALA 7 Cb 0.46 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.16 2jpk h ALA 7 CO 0.03 0.36 -1.54 0.91 0.00 0.00 0.00 179.25 179.01 2jpk n TRP 8 N -4.12 1.01 0.10 0.00 7.02 -0.86 -4.03 117.44 116.56 2jpk n TRP 8 Ca -0.02 0.35 -0.02 0.00 -1.02 0.00 0.00 57.50 56.79 2jpk n TRP 8 Cb 0.34 -1.14 -0.05 0.00 -2.42 0.00 0.00 31.31 28.04 2jpk n TRP 8 CO 0.00 0.00 0.00 0.28 -2.02 0.00 0.00 177.69 175.95 2jpk h VAL 9 N 0.00 1.29 0.44 -0.99 2.07 -1.13 -3.10 116.25 114.83 2jpk h VAL 9 Ca -0.22 -2.83 -0.01 0.00 0.82 0.00 0.00 66.70 64.46 2jpk h VAL 9 Cb 1.79 2.64 -0.02 0.00 -1.52 0.00 0.00 31.29 34.17 2jpk h VAL 9 CO 0.06 0.74 -0.49 0.44 0.02 0.00 0.00 177.57 178.34 2jpk h ASP 10 N 0.00 -1.36 0.91 0.57 5.19 -0.98 0.79 116.42 121.55 2jpk h ASP 10 Ca -0.01 0.11 -0.01 0.00 -0.62 0.00 0.00 57.03 56.50 2jpk h ASP 10 Cb 1.58 0.46 -0.00 0.00 0.18 0.00 0.00 39.33 41.55 2jpk h ASP 10 CO 0.10 -0.63 -0.06 1.55 -3.12 0.00 0.00 179.24 177.08 2jpk h PRO 11 N -0.94 0.00 0.03 3.56 0.13 -1.74 -2.89 132.00 130.14 2jpk h PRO 11 Ca -0.05 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.07 2jpk h PRO 11 Cb 0.82 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.96 2jpk h PRO 11 CO -0.09 0.06 -0.01 0.00 -0.23 0.00 0.00 178.00 177.73 2jpk h ALA 12 N 1.94 -0.03 -0.01 -0.56 0.00 -1.35 -2.61 119.26 116.63 2jpk h ALA 12 Ca -0.00 -0.31 -0.00 0.00 0.00 0.00 0.00 54.91 54.60 2jpk h ALA 12 Cb 0.54 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.34 2jpk h ALA 12 CO 0.01 -0.19 0.01 -0.92 0.00 0.00 0.00 179.25 178.16 2jpk h TYR 13 N -0.69 0.02 -0.12 0.00 3.20 -0.84 -2.14 116.97 116.39 2jpk h TYR 13 Ca -0.00 -0.00 0.04 0.00 3.14 0.00 0.00 58.73 61.90 2jpk h TYR 13 Cb 0.64 -0.01 -0.00 0.00 1.54 0.00 0.00 36.73 38.90 2jpk h TYR 13 CO 0.15 0.06 0.10 1.05 -1.64 0.00 0.00 178.16 177.88 2jpk h GLU 14 N -0.03 0.00 -0.42 1.82 4.11 -1.62 -1.50 114.58 116.94 2jpk h GLU 14 Ca 0.00 0.00 -0.13 0.00 0.07 0.00 0.00 59.36 59.30 2jpk h GLU 14 Cb 0.05 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 2jpk h GLU 14 CO -0.00 0.00 -0.26 0.74 0.07 0.00 0.00 179.01 179.56 2jpk h PHE 15 N 0.00 1.07 -0.11 2.06 -1.00 -0.99 -2.82 116.94 115.16 2jpk h PHE 15 Ca 0.06 -0.28 0.03 0.00 2.81 0.00 0.00 57.97 60.59 2jpk h PHE 15 Cb 0.25 -0.24 -0.00 0.00 3.61 0.00 0.00 35.95 39.57 2jpk h PHE 15 CO 0.00 1.09 0.11 0.82 -1.61 0.00 0.00 178.31 178.72 2jpk h ILE 16 N 0.74 0.55 -0.20 -0.55 1.08 -0.89 0.14 117.51 118.38 2jpk h ILE 16 Ca 0.09 0.00 -0.04 0.00 -0.39 0.00 0.00 64.86 64.51 2jpk h ILE 16 Cb 0.84 0.91 -0.01 0.00 -3.07 0.00 0.00 36.82 35.48 2jpk h ILE 16 CO 0.07 0.00 -0.08 0.11 -0.69 0.00 0.00 178.15 177.57 2jpk h LYS 17 N 0.00 0.30 0.00 2.37 1.79 -1.47 -3.07 116.57 116.50 2jpk h LYS 17 Ca 0.05 -0.06 -0.18 0.00 -2.18 0.00 0.00 60.65 58.28 2jpk h LYS 17 Cb 0.27 -0.05 -0.03 0.00 -1.58 0.00 0.00 32.23 30.84 2jpk h LYS 17 CO -0.00 0.40 -2.13 0.41 -1.08 0.00 0.00 179.45 177.05 2jpk n GLY 18 N -0.94 -0.94 0.30 3.86 0.00 -0.20 -3.26 105.19 104.00 2jpk n GLY 18 Ca -0.00 -0.40 0.14 0.00 0.00 0.00 0.00 46.02 45.75 2jpk n GLY 18 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2jpk h PHE 19 N 0.00 0.00 -0.37 1.61 3.57 -0.72 -3.28 116.94 117.75 2jpk h PHE 19 Ca -0.26 0.00 -0.27 0.00 3.53 0.00 0.00 57.97 60.96 2jpk h PHE 19 Cb 1.57 0.00 -0.22 0.00 2.79 0.00 0.00 35.95 40.09 2jpk h PHE 19 CO 0.00 0.00 -0.61 0.41 -2.23 0.00 0.00 178.31 175.88 2jpk n GLY 20 N -1.40 1.40 0.28 2.40 0.00 -1.17 -4.94 105.19 101.75 2jpk n GLY 20 Ca -0.02 -0.45 0.19 0.00 0.00 0.00 0.00 46.02 45.74 2jpk n GLY 20 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2jpk h LYS 21 N 2.50 0.00 0.00 1.61 -0.00 -1.62 -1.43 116.57 117.63 2jpk h LYS 21 Ca -0.17 0.00 -0.04 0.00 -0.00 0.00 0.00 60.65 60.43 2jpk h LYS 21 Cb 1.20 0.00 -0.01 0.00 -0.00 0.00 0.00 32.23 33.43 2jpk h LYS 21 CO 0.13 0.00 -0.20 0.78 -0.00 0.00 0.00 179.45 180.16 2jpk h GLY 22 N 0.41 0.00 -4.43 0.07 0.00 -1.90 -3.44 103.07 93.77 2jpk h GLY 22 Ca 0.00 0.00 -0.53 0.00 0.00 0.00 0.00 47.33 46.80 2jpk h GLY 22 CO 0.00 0.00 0.93 0.00 0.00 0.00 0.00 176.54 177.47 2jpk s ALA 23 N -3.80 3.82 -0.17 3.60 0.00 -0.54 -4.90 121.76 119.76 2jpk s ALA 23 Ca -0.00 1.57 0.17 0.00 0.00 0.00 0.00 51.96 53.70 2jpk s ALA 23 Cb 0.11 -3.66 -0.00 0.00 0.00 0.00 0.00 23.12 19.56 2jpk s ALA 23 CO 0.62 -0.96 1.18 0.82 0.00 0.00 0.00 175.76 177.42 2jpk h ILE 24 N 3.56 0.58 -0.90 0.00 5.03 -1.88 -3.33 117.51 120.57 2jpk h ILE 24 Ca -0.45 -1.93 0.03 0.00 -0.12 0.00 0.00 64.86 62.39 2jpk h ILE 24 Cb 1.21 2.15 -0.05 0.00 -3.03 0.00 0.00 36.82 37.10 2jpk h ILE 24 CO 0.86 0.33 0.59 0.07 -0.68 0.00 0.00 178.15 179.31 2jpk h LYS 25 N 0.00 1.10 0.00 2.37 5.09 -1.97 -1.10 116.57 122.05 2jpk h LYS 25 Ca -0.06 -0.07 -0.08 0.00 0.09 0.00 0.00 60.65 60.53 2jpk h LYS 25 Cb 1.40 -0.25 -0.01 0.00 0.10 0.00 0.00 32.23 33.47 2jpk h LYS 25 CO 0.05 0.73 -0.37 0.93 -2.09 0.00 0.00 179.45 178.69 2jpk h GLU 26 N 1.13 0.00 0.00 0.07 5.08 -1.94 -3.47 114.58 115.45 2jpk h GLU 26 Ca 0.35 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.71 2jpk h GLU 26 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2jpk h GLU 26 CO -0.10 0.37 0.00 0.41 -1.00 0.00 0.00 179.01 178.69 2jpk n GLY 27 N -0.19 3.42 0.00 -3.84 0.00 -0.42 -5.15 105.19 99.00 2jpk n GLY 27 Ca -0.01 -0.46 -0.00 0.00 0.00 0.00 0.00 46.02 45.54 2jpk n GLY 27 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2jpk n ASN 28 N 0.00 -1.79 0.19 1.61 2.85 -1.24 -4.84 115.26 112.03 2jpk n ASN 28 Ca 0.00 -0.10 0.07 0.00 -0.11 0.00 0.00 54.58 54.44 2jpk n ASN 28 Cb 0.00 -0.00 0.22 0.00 1.24 0.00 0.00 39.78 41.24 2jpk n ASN 28 CO 0.00 0.00 0.00 0.11 -2.11 0.00 0.00 177.26 175.26 2jpk h LYS 29 N 0.00 0.00 0.00 1.20 6.56 -1.96 -3.36 116.57 119.01 2jpk h LYS 29 Ca -0.00 0.00 -0.16 0.00 -1.06 0.00 0.00 60.65 59.43 2jpk h LYS 29 Cb 0.00 0.00 -0.26 0.00 -0.57 0.00 0.00 32.23 31.40 2jpk h LYS 29 CO 0.00 0.30 -0.67 -0.40 -2.06 0.00 0.00 179.45 176.62 2jpk n ASP 30 N -3.26 0.03 0.21 0.86 5.68 -1.26 -4.91 116.55 113.90 2jpk n ASP 30 Ca 0.02 -2.00 0.18 0.00 -0.50 0.00 0.00 54.79 52.48 2jpk n ASP 30 Cb 0.58 -0.01 0.84 0.00 -1.14 0.00 0.00 41.12 41.40 2jpk n ASP 30 CO 0.00 0.00 0.00 0.07 -1.33 0.00 0.00 177.20 175.94 2jpk h LYS 31 N 0.51 0.00 0.00 0.11 5.09 -1.92 0.17 116.57 120.54 2jpk h LYS 31 Ca -0.39 0.00 -0.06 0.00 0.09 0.00 0.00 60.65 60.28 2jpk h LYS 31 Cb 1.66 0.00 -0.01 0.00 0.10 0.00 0.00 32.23 33.98 2jpk h LYS 31 CO -0.09 0.00 -0.31 0.11 -2.09 0.00 0.00 179.45 177.07 2jpk h TRP 32 N 0.00 0.00 0.00 0.07 5.08 -1.89 -2.61 115.95 116.60 2jpk h TRP 32 Ca 0.09 0.00 -0.03 0.00 1.08 0.00 0.00 58.89 60.03 2jpk h TRP 32 Cb 0.52 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 26.68 2jpk h TRP 32 CO 0.00 0.31 -0.14 0.87 -1.28 0.00 0.00 178.44 178.20 2jpk h LYS 33 N 0.00 0.00 -0.07 0.12 1.57 -1.05 -1.27 116.57 115.87 2jpk h LYS 33 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2jpk h LYS 33 Cb 0.71 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.02 2jpk h LYS 33 CO 0.04 0.14 0.00 0.09 -0.57 0.00 0.00 179.45 179.15 2jpk n ASN 34 N -3.64 2.18 0.00 0.86 5.03 -0.99 -5.20 115.26 113.50 2jpk n ASN 34 Ca -0.02 -1.73 0.00 0.00 0.87 0.00 0.00 54.58 53.70 2jpk n ASN 34 Cb 0.26 -0.04 0.00 0.00 -1.02 0.00 0.00 39.78 38.99 2jpk n ASN 34 CO 0.00 0.00 0.00 -0.38 -1.83 0.00 0.00 177.26 175.05