#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 0.44 -5.95 -1.58 1.57 -2.11 -3.48 116.57 105.46 2jpk h LYS 2 Ca 0.00 -0.24 -0.39 0.00 -1.87 0.00 0.00 60.65 58.15 2jpk h LYS 2 Cb 0.00 0.01 0.09 0.00 0.08 0.00 0.00 32.23 32.41 2jpk h LYS 2 CO 0.00 0.82 -0.82 0.91 -0.57 0.00 0.00 179.45 179.79 2jpk n TRP 3 N -4.47 -2.00 -0.03 -1.35 8.01 -1.26 -4.88 117.44 111.46 2jpk n TRP 3 Ca -0.06 0.86 0.05 0.00 -1.31 0.00 0.00 57.50 57.04 2jpk n TRP 3 Cb 0.40 -4.55 0.24 0.00 -2.01 0.00 0.00 31.31 25.40 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 2.16 0.06 6.99 0.00 -1.26 -4.33 105.19 107.36 2jpk n GLY 4 Ca -0.29 -0.56 -0.01 0.00 0.00 0.00 0.00 46.02 45.16 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 2.55 -0.02 0.00 1.61 6.55 -2.01 -3.26 115.95 121.38 2jpk h TRP 5 Ca 0.00 -0.00 -0.03 0.00 0.95 0.00 0.00 58.89 59.81 2jpk h TRP 5 Cb 1.25 0.01 -0.00 0.00 -0.86 0.00 0.00 29.16 29.56 2jpk h TRP 5 CO 0.61 0.07 -0.12 -0.07 -1.05 0.00 0.00 178.44 177.88 2jpk h LEU 6 N -1.00 0.00 -1.56 -4.49 4.07 -1.99 -1.75 115.31 108.57 2jpk h LEU 6 Ca -0.00 0.00 -0.05 0.00 0.08 0.00 0.00 57.88 57.91 2jpk h LEU 6 Cb 0.10 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 41.83 2jpk h LEU 6 CO 0.00 0.12 -0.23 0.00 -1.08 0.00 0.00 178.44 177.25 2jpk h ALA 7 N 1.88 1.47 0.00 1.53 0.00 -1.76 -1.72 119.26 120.66 2jpk h ALA 7 Ca -0.00 -0.21 -0.22 0.00 0.00 0.00 0.00 54.91 54.48 2jpk h ALA 7 Cb 0.29 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.01 2jpk h ALA 7 CO 0.02 0.29 -1.55 0.91 0.00 0.00 0.00 179.25 178.92 2jpk n TRP 8 N -4.05 0.98 0.18 0.00 7.02 -0.70 -3.97 117.44 116.90 2jpk n TRP 8 Ca -0.02 0.34 0.05 0.00 -1.02 0.00 0.00 57.50 56.85 2jpk n TRP 8 Cb 0.30 -1.13 0.27 0.00 -2.42 0.00 0.00 31.31 28.33 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 0.83 0.96 -0.99 2.07 -1.10 -2.54 116.25 115.48 2jpk h VAL 9 Ca -0.22 -1.67 -0.05 0.00 0.82 0.00 0.00 66.70 65.59 2jpk h VAL 9 Cb 1.77 2.05 0.01 0.00 -1.52 0.00 0.00 31.29 33.60 2jpk h VAL 9 CO 0.06 0.38 -0.46 0.44 0.02 0.00 0.00 177.57 178.01 2jpk h ASP 10 N 0.00 -1.09 0.63 0.57 3.32 -1.45 0.23 116.42 118.63 2jpk h ASP 10 Ca -0.00 0.04 -0.07 0.00 0.02 0.00 0.00 57.03 57.01 2jpk h ASP 10 Cb 1.02 0.28 -0.01 0.00 0.22 0.00 0.00 39.33 40.84 2jpk h ASP 10 CO 0.05 -0.78 -0.35 1.55 -1.72 0.00 0.00 179.24 178.00 2jpk h PRO 11 N -1.29 0.00 0.04 3.56 0.13 -1.74 -2.52 132.00 130.18 2jpk h PRO 11 Ca -0.13 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.00 2jpk h PRO 11 Cb 0.99 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.12 2jpk h PRO 11 CO 0.22 0.35 -0.02 0.00 -0.23 0.00 0.00 178.00 178.31 2jpk h ALA 12 N 1.65 -0.06 -0.24 -0.56 0.00 -1.37 -2.64 119.26 116.05 2jpk h ALA 12 Ca -0.00 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.60 2jpk h ALA 12 Cb 0.76 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 2jpk h ALA 12 CO 0.05 -0.20 0.15 -0.92 0.00 0.00 0.00 179.25 178.33 2jpk h TYR 13 N -0.73 0.30 0.00 0.00 5.03 -0.56 -1.68 116.97 119.33 2jpk h TYR 13 Ca -0.01 0.01 -0.01 0.00 2.58 0.00 0.00 58.73 61.30 2jpk h TYR 13 Cb 0.63 -0.10 -0.00 0.00 1.55 0.00 0.00 36.73 38.81 2jpk h TYR 13 CO 0.14 0.19 -0.03 1.05 -1.32 0.00 0.00 178.16 178.19 2jpk h GLU 14 N 0.32 0.00 -0.08 1.82 4.11 -1.55 -2.20 114.58 116.99 2jpk h GLU 14 Ca 0.09 0.00 -0.07 0.00 0.07 0.00 0.00 59.36 59.45 2jpk h GLU 14 Cb -0.03 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.22 2jpk h GLU 14 CO -0.02 0.03 -0.21 0.35 0.07 0.00 0.00 179.01 179.23 2jpk h PHE 15 N 0.00 0.37 0.00 2.06 3.57 -0.94 -3.14 116.94 118.87 2jpk h PHE 15 Ca -0.00 -0.14 -0.03 0.00 3.53 0.00 0.00 57.97 61.33 2jpk h PHE 15 Cb 0.07 -0.07 -0.00 0.00 2.79 0.00 0.00 35.95 38.74 2jpk h PHE 15 CO 0.00 0.82 -0.15 0.82 -2.23 0.00 0.00 178.31 177.58 2jpk h ILE 16 N -0.18 0.68 -0.03 1.41 1.08 -0.90 0.27 117.51 119.84 2jpk h ILE 16 Ca -0.00 -0.61 0.01 0.00 -0.39 0.00 0.00 64.86 63.87 2jpk h ILE 16 Cb 0.82 1.38 -0.00 0.00 -3.07 0.00 0.00 36.82 35.94 2jpk h ILE 16 CO 0.05 0.14 0.08 0.11 -0.69 0.00 0.00 178.15 177.84 2jpk h LYS 17 N 0.00 0.00 0.00 2.37 1.79 -1.36 0.22 116.57 119.60 2jpk h LYS 17 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2jpk h LYS 17 Cb 0.37 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.02 2jpk h LYS 17 CO 0.02 0.00 -0.82 0.41 -1.08 0.00 0.00 179.45 177.98 2jpk n GLY 18 N -1.20 0.00 0.09 3.86 0.00 -0.81 -4.27 105.19 102.87 2jpk n GLY 18 Ca -0.02 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.97 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 -0.89 1.61 3.04 -0.44 -3.40 116.94 116.86 2jpk h PHE 19 Ca 0.00 0.00 -0.35 0.00 3.98 0.00 0.00 57.97 61.60 2jpk h PHE 19 Cb 0.82 0.00 -0.28 0.00 2.56 0.00 0.00 35.95 39.06 2jpk h PHE 19 CO 0.00 0.78 -0.81 0.41 -2.02 0.00 0.00 178.31 176.67 2jpk n GLY 20 N 1.34 1.96 0.28 2.40 0.00 0.69 -4.93 105.19 106.92 2jpk n GLY 20 Ca -0.02 -0.81 0.19 0.00 0.00 0.00 0.00 46.02 45.38 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 2.89 0.00 0.00 1.61 -0.00 -1.47 -3.36 116.57 116.25 2jpk h LYS 21 Ca -0.04 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.61 2jpk h LYS 21 Cb 1.08 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.31 2jpk h LYS 21 CO 0.29 0.00 0.00 0.41 -0.00 0.00 0.00 179.45 180.15 2jpk n GLY 22 N -0.89 0.59 3.45 0.07 0.00 -1.26 -5.01 105.19 102.13 2jpk n GLY 22 Ca -0.02 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.86 2jpk n GLY 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jpk n ALA 23 N -2.63 -2.64 0.13 4.61 0.00 -1.26 -4.90 120.51 113.82 2jpk n ALA 23 Ca 0.00 -0.14 0.03 0.00 0.00 0.00 0.00 53.44 53.33 2jpk n ALA 23 Cb 0.00 -1.47 0.02 0.00 0.00 0.00 0.00 19.45 18.00 2jpk n ALA 23 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 2jpk h ILE 24 N -0.13 0.70 -0.13 0.00 1.08 -1.95 -3.27 117.51 113.82 2jpk h ILE 24 Ca -0.35 -2.03 -0.04 0.00 -0.39 0.00 0.00 64.86 62.05 2jpk h ILE 24 Cb 1.22 2.30 -0.01 0.00 -3.07 0.00 0.00 36.82 37.25 2jpk h ILE 24 CO 0.35 0.40 -0.09 0.07 -0.69 0.00 0.00 178.15 178.19 2jpk h LYS 25 N 0.00 0.20 -0.06 2.37 5.09 -2.00 -2.00 116.57 120.17 2jpk h LYS 25 Ca -0.03 -0.04 -0.04 0.00 0.09 0.00 0.00 60.65 60.63 2jpk h LYS 25 Cb 1.36 -0.03 -0.01 0.00 0.10 0.00 0.00 32.23 33.65 2jpk h LYS 25 CO 0.05 0.30 -0.16 0.93 -2.09 0.00 0.00 179.45 178.48 2jpk h GLU 26 N 0.19 0.10 0.00 0.07 4.39 -1.94 -3.47 114.58 113.92 2jpk h GLU 26 Ca 0.04 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.72 2jpk h GLU 26 Cb 0.29 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 28.92 2jpk h GLU 26 CO 0.01 0.26 0.00 0.41 -1.16 0.00 0.00 179.01 178.54 2jpk n GLY 27 N -0.95 3.46 2.95 -3.84 0.00 -0.75 -5.13 105.19 100.94 2jpk n GLY 27 Ca -0.02 -0.72 -0.02 0.00 0.00 0.00 0.00 46.02 45.26 2jpk n GLY 27 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2jpk s ASN 28 N 0.00 -1.39 -0.07 1.61 0.01 -1.26 -4.95 114.94 108.90 2jpk s ASN 28 Ca 0.00 -1.33 -0.03 0.00 -0.71 0.00 0.00 52.86 50.79 2jpk s ASN 28 Cb 0.00 1.87 -0.02 0.00 0.41 0.00 0.00 41.25 43.51 2jpk s ASN 28 CO 0.00 -0.11 0.16 0.11 -1.51 0.00 0.00 177.10 175.75 2jpk h LYS 29 N 5.94 -0.12 -2.06 -0.60 6.56 -2.00 -3.35 116.57 120.94 2jpk h LYS 29 Ca 0.06 0.01 -0.45 0.00 -1.06 0.00 0.00 60.65 59.21 2jpk h LYS 29 Cb 1.14 0.03 -0.14 0.00 -0.57 0.00 0.00 32.23 32.68 2jpk h LYS 29 CO 0.06 -0.08 0.41 -0.40 -2.06 0.00 0.00 179.45 177.38 2jpk n ASP 30 N -4.39 6.33 0.08 0.86 5.75 -1.26 -4.41 116.55 119.51 2jpk n ASP 30 Ca -0.02 -3.02 -0.03 0.00 -0.01 0.00 0.00 54.79 51.72 2jpk n ASP 30 Cb 0.05 -1.29 -0.06 0.00 -1.03 0.00 0.00 41.12 38.78 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 3.14 0.00 0.00 0.11 5.09 -1.99 -3.22 116.57 119.71 2jpk h LYS 31 Ca 0.38 0.00 0.00 0.00 0.09 0.00 0.00 60.65 61.12 2jpk h LYS 31 Cb 0.87 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.20 2jpk h LYS 31 CO 0.78 0.71 0.00 0.11 -2.09 0.00 0.00 179.45 178.96 2jpk h TRP 32 N 0.00 0.00 -0.06 0.07 5.08 -1.91 -2.10 115.95 117.03 2jpk h TRP 32 Ca -0.04 0.00 0.02 0.00 1.08 0.00 0.00 58.89 59.95 2jpk h TRP 32 Cb 1.63 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 27.78 2jpk h TRP 32 CO 0.00 0.00 0.07 0.87 -1.28 0.00 0.00 178.44 178.10 2jpk h LYS 33 N 0.00 0.00 -0.45 0.12 1.79 -1.92 0.24 116.57 116.35 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 0.12 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.77 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 -3.86 2.62 0.00 0.86 3.02 -0.79 -5.23 115.26 111.88 2jpk n ASN 34 Ca -0.01 -1.96 0.00 0.00 -0.03 0.00 0.00 54.58 52.57 2jpk n ASN 34 Cb 0.16 -0.30 0.00 0.00 -0.61 0.00 0.00 39.78 39.03 2jpk n ASN 34 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26