#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 0.27 -5.96 1.64 1.57 -2.11 -3.47 116.57 108.51 2jpk h LYS 2 Ca 0.00 -0.14 -0.39 0.00 -1.87 0.00 0.00 60.65 58.25 2jpk h LYS 2 Cb 0.00 0.00 0.09 0.00 0.08 0.00 0.00 32.23 32.40 2jpk h LYS 2 CO 0.00 0.67 -0.82 0.91 -0.57 0.00 0.00 179.45 179.64 2jpk n TRP 3 N -4.64 -2.00 -0.09 -1.35 8.01 -1.26 -4.88 117.44 111.23 2jpk n TRP 3 Ca -0.07 0.86 0.05 0.00 -1.31 0.00 0.00 57.50 57.03 2jpk n TRP 3 Cb 0.32 -4.54 0.25 0.00 -2.01 0.00 0.00 31.31 25.33 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 -1.45 2.25 0.05 6.99 0.00 -1.26 -4.32 105.19 107.45 2jpk n GLY 4 Ca -0.29 -0.58 -0.02 0.00 0.00 0.00 0.00 46.02 45.14 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 2.58 0.00 0.00 1.61 6.55 -2.00 -3.16 115.95 121.54 2jpk h TRP 5 Ca 0.00 0.00 -0.05 0.00 0.95 0.00 0.00 58.89 59.79 2jpk h TRP 5 Cb 1.31 0.00 -0.01 0.00 -0.86 0.00 0.00 29.16 29.61 2jpk h TRP 5 CO 0.64 0.10 -0.24 1.37 -1.05 0.00 0.00 178.44 179.26 2jpk h LEU 6 N -1.00 0.00 -1.27 -4.49 8.10 -1.99 -1.66 115.31 113.00 2jpk h LEU 6 Ca -0.00 0.00 -0.07 0.00 0.11 0.00 0.00 57.88 57.92 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 0.24 -0.34 0.00 -4.11 0.00 0.00 178.44 174.23 2jpk h ALA 7 N 1.76 1.25 0.00 0.17 0.00 -1.75 -1.60 119.26 119.08 2jpk h ALA 7 Ca -0.00 -0.31 -0.22 0.00 0.00 0.00 0.00 54.91 54.38 2jpk h ALA 7 Cb 0.49 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.19 2jpk h ALA 7 CO 0.03 0.42 -1.53 -1.49 0.00 0.00 0.00 179.25 176.68 2jpk h TRP 8 N 0.00 0.00 0.00 0.00 4.06 -1.36 -3.35 115.95 115.30 2jpk h TRP 8 Ca -0.00 0.00 -0.13 0.00 2.06 0.00 0.00 58.89 60.82 2jpk h TRP 8 Cb 0.68 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.82 2jpk h TRP 8 CO 0.00 0.77 -0.63 0.28 -3.56 0.00 0.00 178.44 175.30 2jpk h VAL 9 N 0.00 1.22 0.34 1.49 2.07 -1.13 -3.09 116.25 117.16 2jpk h VAL 9 Ca -0.21 -2.33 -0.00 0.00 0.82 0.00 0.00 66.70 64.97 2jpk h VAL 9 Cb 1.78 2.35 -0.03 0.00 -1.52 0.00 0.00 31.29 33.86 2jpk h VAL 9 CO 0.06 0.61 -0.50 0.44 0.02 0.00 0.00 177.57 178.21 2jpk h ASP 10 N 0.00 -1.42 0.85 0.57 3.32 -1.43 -0.91 116.42 117.41 2jpk h ASP 10 Ca -0.01 0.13 0.00 0.00 0.02 0.00 0.00 57.03 57.17 2jpk h ASP 10 Cb 1.30 0.49 0.00 0.00 0.22 0.00 0.00 39.33 41.34 2jpk h ASP 10 CO 0.08 -0.60 0.00 1.55 -1.72 0.00 0.00 179.24 178.55 2jpk h PRO 11 N -0.88 0.00 0.17 3.56 0.13 -1.76 -3.01 132.00 130.22 2jpk h PRO 11 Ca -0.04 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.08 2jpk h PRO 11 Cb 0.80 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.93 2jpk h PRO 11 CO -0.14 0.00 -0.08 0.00 -0.23 0.00 0.00 178.00 177.54 2jpk h ALA 12 N 2.13 -0.40 -0.46 -0.56 0.00 -1.27 -2.89 119.26 115.81 2jpk h ALA 12 Ca 0.00 -0.05 0.09 0.00 0.00 0.00 0.00 54.91 54.95 2jpk h ALA 12 Cb 0.43 0.09 -0.08 0.00 0.00 0.00 0.00 17.79 18.23 2jpk h ALA 12 CO 0.00 -0.38 -0.02 -0.92 0.00 0.00 0.00 179.25 177.93 2jpk h TYR 13 N -0.55 -0.06 -0.93 0.00 3.20 -1.26 0.31 116.97 117.66 2jpk h TYR 13 Ca -0.02 0.04 0.18 0.00 3.14 0.00 0.00 58.73 62.06 2jpk h TYR 13 Cb 0.17 0.10 -0.08 0.00 1.54 0.00 0.00 36.73 38.46 2jpk h TYR 13 CO 0.04 -0.12 0.60 0.93 -1.64 0.00 0.00 178.16 177.97 2jpk h GLU 14 N 0.09 0.61 -0.24 1.82 5.08 -1.66 0.11 114.58 120.39 2jpk h GLU 14 Ca 0.23 -0.04 -0.19 0.00 -1.00 0.00 0.00 59.36 58.36 2jpk h GLU 14 Cb 0.34 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.46 2jpk h GLU 14 CO -0.40 0.40 -0.60 0.74 -1.00 0.00 0.00 179.01 178.15 2jpk h PHE 15 N 0.63 1.06 -0.38 4.33 -1.00 -0.77 -2.39 116.94 118.42 2jpk h PHE 15 Ca 0.50 -0.41 -0.04 0.00 2.81 0.00 0.00 57.97 60.83 2jpk h PHE 15 Cb 0.92 -0.19 -0.02 0.00 3.61 0.00 0.00 35.95 40.28 2jpk h PHE 15 CO -0.00 1.23 0.07 0.82 -1.61 0.00 0.00 178.31 178.82 2jpk h ILE 16 N 0.58 1.24 0.00 -0.55 1.08 0.23 0.21 117.51 120.30 2jpk h ILE 16 Ca -0.01 -0.83 -0.05 0.00 -0.39 0.00 0.00 64.86 63.58 2jpk h ILE 16 Cb 1.22 1.05 -0.01 0.00 -3.07 0.00 0.00 36.82 36.01 2jpk h ILE 16 CO 0.13 0.28 -0.22 0.07 -0.69 0.00 0.00 178.15 177.73 2jpk h LYS 17 N 0.47 0.00 0.00 2.37 2.10 -0.90 -2.31 116.57 118.30 2jpk h LYS 17 Ca 0.12 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.77 2jpk h LYS 17 Cb 0.35 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.68 2jpk h LYS 17 CO 0.01 0.22 -0.75 0.78 -2.00 0.00 0.00 179.45 177.70 2jpk h GLY 18 N 1.10 0.00 1.55 0.07 0.00 -1.05 -2.53 103.07 102.22 2jpk h GLY 18 Ca -0.00 0.00 -0.27 0.00 0.00 0.00 0.00 47.33 47.06 2jpk h GLY 18 CO 0.03 0.00 -1.31 0.74 0.00 0.00 0.00 176.54 176.00 2jpk h PHE 19 N 0.00 0.37 -0.94 5.60 -1.00 -0.49 -3.37 116.94 117.11 2jpk h PHE 19 Ca 0.00 -0.27 -0.44 0.00 2.81 0.00 0.00 57.97 60.07 2jpk h PHE 19 Cb 0.99 -0.01 -0.41 0.00 3.61 0.00 0.00 35.95 40.12 2jpk h PHE 19 CO 0.00 1.25 -0.97 0.41 -1.61 0.00 0.00 178.31 177.39 2jpk n GLY 20 N 1.54 3.95 0.28 -1.45 0.00 -0.91 -4.84 105.19 103.76 2jpk n GLY 20 Ca -0.10 -1.96 0.19 0.00 0.00 0.00 0.00 46.02 44.16 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 2.60 0.00 -0.42 1.61 -0.00 -1.63 -3.36 116.57 115.36 2jpk h LYS 21 Ca 0.11 0.00 -0.07 0.00 -0.00 0.00 0.00 60.65 60.69 2jpk h LYS 21 Cb 1.22 0.00 -0.15 0.00 -0.00 0.00 0.00 32.23 33.30 2jpk h LYS 21 CO 0.58 0.00 -0.26 0.41 -0.00 0.00 0.00 179.45 180.17 2jpk n GLY 22 N -0.93 -1.21 3.17 0.07 0.00 -1.26 -5.09 105.19 99.94 2jpk n GLY 22 Ca -0.02 0.91 0.03 0.00 0.00 0.00 0.00 46.02 46.93 2jpk n GLY 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jpk s ALA 23 N 0.83 -2.44 -0.17 4.61 0.00 -1.26 -5.01 121.76 118.33 2jpk s ALA 23 Ca 0.27 0.70 0.17 0.00 0.00 0.00 0.00 51.96 53.09 2jpk s ALA 23 Cb 0.10 -2.64 -0.00 0.00 0.00 0.00 0.00 23.12 20.58 2jpk s ALA 23 CO -0.10 -2.01 1.18 0.82 0.00 0.00 0.00 175.76 175.65 2jpk h ILE 24 N 5.51 0.58 0.89 0.00 5.03 -1.94 -3.31 117.51 124.28 2jpk h ILE 24 Ca 0.01 -1.93 -0.04 0.00 -0.12 0.00 0.00 64.86 62.78 2jpk h ILE 24 Cb 1.19 2.15 0.01 0.00 -3.03 0.00 0.00 36.82 37.14 2jpk h ILE 24 CO 0.12 0.33 -0.43 0.11 -0.68 0.00 0.00 178.15 177.60 2jpk h LYS 25 N 0.00 -1.15 -0.30 2.37 6.56 -2.02 -2.65 116.57 119.38 2jpk h LYS 25 Ca -0.06 0.08 0.09 0.00 -1.06 0.00 0.00 60.65 59.69 2jpk h LYS 25 Cb 1.40 0.26 -0.01 0.00 -0.57 0.00 0.00 32.23 33.31 2jpk h LYS 25 CO 0.05 -0.77 0.25 1.05 -2.06 0.00 0.00 179.45 177.96 2jpk h GLU 26 N -1.20 0.00 0.00 3.15 4.11 -2.00 -3.45 114.58 115.18 2jpk h GLU 26 Ca -0.12 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.31 2jpk h GLU 26 Cb 0.92 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.17 2jpk h GLU 26 CO 0.20 0.00 0.00 0.41 0.07 0.00 0.00 179.01 179.69 2jpk n GLY 27 N -1.53 3.10 3.66 1.06 0.00 -1.00 -5.07 105.19 105.41 2jpk n GLY 27 Ca 0.04 -0.67 -0.51 0.00 0.00 0.00 0.00 46.02 44.89 2jpk n GLY 27 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2jpk n ASN 28 N 0.00 2.68 0.00 1.61 4.13 -1.25 -4.83 115.26 117.60 2jpk n ASN 28 Ca 0.00 1.06 0.14 0.00 1.68 0.00 0.00 54.58 57.46 2jpk n ASN 28 Cb 0.00 -1.29 0.74 0.00 -1.54 0.00 0.00 39.78 37.69 2jpk n ASN 28 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 2jpk n LYS 29 N 4.46 0.58 -2.70 3.52 5.02 -1.26 -3.65 118.16 124.14 2jpk n LYS 29 Ca 0.21 0.02 -0.06 0.00 -2.02 0.00 0.00 58.31 56.45 2jpk n LYS 29 Cb 0.23 -1.50 0.07 0.00 -0.02 0.00 0.00 35.03 33.82 2jpk n LYS 29 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 2jpk n ASP 30 N -1.17 -0.03 0.20 4.39 5.75 -1.26 -4.92 116.55 119.51 2jpk n ASP 30 Ca 0.16 -2.49 0.08 0.00 -0.01 0.00 0.00 54.79 52.53 2jpk n ASP 30 Cb 0.17 0.15 0.33 0.00 -1.03 0.00 0.00 41.12 40.73 2jpk n ASP 30 CO 0.00 0.00 0.00 0.07 -0.11 0.00 0.00 177.20 177.16 2jpk h LYS 31 N 2.39 0.00 0.00 0.11 5.09 -1.96 -2.94 116.57 119.26 2jpk h LYS 31 Ca -0.20 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.54 2jpk h LYS 31 Cb 1.25 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.58 2jpk h LYS 31 CO 0.19 0.29 0.00 0.11 -2.09 0.00 0.00 179.45 177.95 2jpk h TRP 32 N 0.00 0.00 -0.07 0.07 5.08 -1.91 -2.21 115.95 116.91 2jpk h TRP 32 Ca -0.00 0.00 0.02 0.00 1.08 0.00 0.00 58.89 59.99 2jpk h TRP 32 Cb 0.93 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 27.09 2jpk h TRP 32 CO 0.00 0.00 0.08 0.87 -1.28 0.00 0.00 178.44 178.11 2jpk h LYS 33 N 0.00 0.00 -0.52 0.12 1.79 -1.93 0.24 116.57 116.27 2jpk h LYS 33 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2jpk h LYS 33 Cb 0.19 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.84 2jpk h LYS 33 CO 0.00 0.00 0.00 0.09 -1.08 0.00 0.00 179.45 178.46 2jpk n ASN 34 N -3.88 2.80 0.00 0.86 3.02 -0.83 -5.23 115.26 112.00 2jpk n ASN 34 Ca -0.01 -2.02 0.00 0.00 -0.03 0.00 0.00 54.58 52.52 2jpk n ASN 34 Cb 0.18 -0.35 0.00 0.00 -0.61 0.00 0.00 39.78 38.99 2jpk n ASN 34 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26