#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 0.61 -5.69 1.97 6.56 -2.11 -3.47 116.57 114.44 2jpk h LYS 2 Ca 0.00 -0.28 -0.34 0.00 -1.06 0.00 0.00 60.65 58.98 2jpk h LYS 2 Cb 0.00 -0.01 0.16 0.00 -0.57 0.00 0.00 32.23 31.81 2jpk h LYS 2 CO 0.00 0.86 -0.78 0.91 -2.06 0.00 0.00 179.45 178.37 2jpk n TRP 3 N -4.07 -2.18 -0.03 -1.35 8.01 -1.26 -4.89 117.44 111.67 2jpk n TRP 3 Ca -0.01 0.92 0.05 0.00 -1.31 0.00 0.00 57.50 57.15 2jpk n TRP 3 Cb 0.47 -4.93 0.24 0.00 -2.01 0.00 0.00 31.31 25.08 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 -1.19 2.16 0.05 6.99 0.00 -1.26 -4.24 105.19 107.71 2jpk n GLY 4 Ca -0.27 -0.56 -0.01 0.00 0.00 0.00 0.00 46.02 45.17 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 2.53 -0.01 0.00 1.61 6.55 -2.00 -3.21 115.95 121.42 2jpk h TRP 5 Ca 0.00 -0.00 -0.07 0.00 0.95 0.00 0.00 58.89 59.77 2jpk h TRP 5 Cb 1.26 0.00 -0.01 0.00 -0.86 0.00 0.00 29.16 29.55 2jpk h TRP 5 CO 0.61 0.08 -0.32 1.37 -1.05 0.00 0.00 178.44 179.13 2jpk h LEU 6 N -1.00 0.00 -1.53 -4.49 8.10 -2.00 -2.62 115.31 111.77 2jpk h LEU 6 Ca -0.00 0.00 -0.05 0.00 0.11 0.00 0.00 57.88 57.94 2jpk h LEU 6 Cb 0.09 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 40.31 2jpk h LEU 6 CO 0.00 0.32 -0.23 0.00 -4.11 0.00 0.00 178.44 174.42 2jpk h ALA 7 N 1.68 1.31 0.00 0.17 0.00 -1.74 -2.38 119.26 118.30 2jpk h ALA 7 Ca -0.00 -0.21 -0.16 0.00 0.00 0.00 0.00 54.91 54.54 2jpk h ALA 7 Cb 0.74 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.47 2jpk h ALA 7 CO 0.04 0.29 -1.42 0.91 0.00 0.00 0.00 179.25 179.07 2jpk n TRP 8 N -3.81 0.95 -0.03 0.00 7.02 -1.02 -4.09 117.44 116.47 2jpk n TRP 8 Ca -0.02 0.31 -0.11 0.00 -1.02 0.00 0.00 57.50 56.67 2jpk n TRP 8 Cb 0.33 -1.07 0.03 0.00 -2.42 0.00 0.00 31.31 28.18 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 1.30 0.20 -0.99 2.07 -1.13 -2.73 116.25 114.98 2jpk h VAL 9 Ca -0.16 -1.76 0.01 0.00 0.82 0.00 0.00 66.70 65.61 2jpk h VAL 9 Cb 1.55 1.70 -0.04 0.00 -1.52 0.00 0.00 31.29 32.98 2jpk h VAL 9 CO 0.04 0.56 -0.50 0.44 0.02 0.00 0.00 177.57 178.13 2jpk h ASP 10 N 0.52 -1.48 0.42 0.57 3.32 -1.59 -0.80 116.42 117.38 2jpk h ASP 10 Ca 0.01 0.15 0.00 0.00 0.02 0.00 0.00 57.03 57.21 2jpk h ASP 10 Cb 1.10 0.53 0.00 0.00 0.22 0.00 0.00 39.33 41.18 2jpk h ASP 10 CO 0.11 -0.56 0.00 -0.81 -1.72 0.00 0.00 179.24 176.26 2jpk n PRO 11 N -5.34 0.07 0.12 3.56 -0.04 -1.24 -3.37 135.00 128.75 2jpk n PRO 11 Ca -0.09 0.22 -0.08 0.00 -0.04 0.00 0.00 63.50 63.51 2jpk n PRO 11 Cb 0.41 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.32 2jpk n PRO 11 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2jpk h ALA 12 N 2.56 -0.38 -0.07 0.55 0.00 -0.82 -2.79 119.26 118.31 2jpk h ALA 12 Ca 0.00 -0.14 0.04 0.00 0.00 0.00 0.00 54.91 54.81 2jpk h ALA 12 Cb 0.21 0.15 -0.06 0.00 0.00 0.00 0.00 17.79 18.09 2jpk h ALA 12 CO 0.00 -0.38 -0.33 1.88 0.00 0.00 0.00 179.25 180.42 2jpk h TYR 13 N -1.04 -0.92 -0.88 0.00 -1.99 -1.48 0.18 116.97 110.84 2jpk h TYR 13 Ca -0.04 0.03 0.19 0.00 2.00 0.00 0.00 58.73 60.91 2jpk h TYR 13 Cb 0.41 0.41 -0.07 0.00 2.00 0.00 0.00 36.73 39.49 2jpk h TYR 13 CO 0.03 -0.41 0.58 0.93 -0.00 0.00 0.00 178.16 179.28 2jpk h GLU 14 N -0.44 0.44 -0.03 4.88 4.39 -1.70 0.27 114.58 122.39 2jpk h GLU 14 Ca 0.08 -0.03 -0.02 0.00 0.34 0.00 0.00 59.36 59.73 2jpk h GLU 14 Cb 0.56 -0.10 0.00 0.00 -0.10 0.00 0.00 28.75 29.11 2jpk h GLU 14 CO -0.32 0.29 -0.06 0.35 -1.16 0.00 0.00 179.01 178.11 2jpk h PHE 15 N 0.45 0.11 0.00 4.33 3.57 -0.79 -3.17 116.94 121.45 2jpk h PHE 15 Ca 0.45 -0.04 -0.03 0.00 3.53 0.00 0.00 57.97 61.88 2jpk h PHE 15 Cb 1.06 -0.02 -0.00 0.00 2.79 0.00 0.00 35.95 39.77 2jpk h PHE 15 CO -0.00 0.67 -0.15 0.82 -2.23 0.00 0.00 178.31 177.42 2jpk h ILE 16 N -0.47 0.69 -0.20 1.41 1.08 0.31 0.26 117.51 120.59 2jpk h ILE 16 Ca -0.00 -0.61 0.06 0.00 -0.39 0.00 0.00 64.86 63.92 2jpk h ILE 16 Cb 0.67 1.37 -0.01 0.00 -3.07 0.00 0.00 36.82 35.78 2jpk h ILE 16 CO 0.01 0.14 0.24 0.11 -0.69 0.00 0.00 178.15 177.97 2jpk h LYS 17 N 0.00 0.00 0.00 2.37 1.79 -0.48 -1.90 116.57 118.35 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 0.36 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.01 2jpk h LYS 17 CO 0.02 0.00 -0.11 0.41 -1.08 0.00 0.00 179.45 178.69 2jpk n GLY 18 N -1.39 -0.13 0.41 3.86 0.00 -0.87 -4.39 105.19 102.67 2jpk n GLY 18 Ca 0.02 0.00 0.23 0.00 0.00 0.00 0.00 46.02 46.27 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 -1.40 1.61 3.04 -0.65 -2.94 116.94 116.60 2jpk h PHE 19 Ca 0.00 0.00 -0.41 0.00 3.98 0.00 0.00 57.97 61.54 2jpk h PHE 19 Cb 0.11 0.00 -0.39 0.00 2.56 0.00 0.00 35.95 38.23 2jpk h PHE 19 CO 0.00 0.00 -1.16 0.41 -2.02 0.00 0.00 178.31 175.54 2jpk n GLY 20 N -1.62 2.42 0.28 2.40 0.00 -1.00 -4.90 105.19 102.77 2jpk n GLY 20 Ca 0.12 -1.41 0.19 0.00 0.00 0.00 0.00 46.02 44.91 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 2.98 0.00 -0.05 1.61 -0.00 -1.17 -3.29 116.57 116.66 2jpk h LYS 21 Ca -0.02 0.00 -0.24 0.00 -0.00 0.00 0.00 60.65 60.40 2jpk h LYS 21 Cb 1.09 0.00 -0.16 0.00 -0.00 0.00 0.00 32.23 33.16 2jpk h LYS 21 CO 0.48 0.00 -0.43 0.41 -0.00 0.00 0.00 179.45 179.91 2jpk n GLY 22 N -0.95 0.91 3.70 0.07 0.00 -1.26 -5.04 105.19 102.61 2jpk n GLY 22 Ca -0.02 -0.07 -0.42 0.00 0.00 0.00 0.00 46.02 45.51 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 0.16 3.52 -0.17 4.61 0.00 -1.24 -4.91 121.76 123.74 2jpk s ALA 23 Ca 0.22 0.84 0.17 0.00 0.00 0.00 0.00 51.96 53.20 2jpk s ALA 23 Cb 0.33 -3.54 -0.01 0.00 0.00 0.00 0.00 23.12 19.90 2jpk s ALA 23 CO -0.06 -0.74 1.15 0.82 0.00 0.00 0.00 175.76 176.92 2jpk h ILE 24 N 4.78 0.56 -0.37 0.00 5.03 -1.97 -3.22 117.51 122.31 2jpk h ILE 24 Ca -0.38 -1.91 -0.14 0.00 -0.12 0.00 0.00 64.86 62.31 2jpk h ILE 24 Cb 1.19 2.12 -0.01 0.00 -3.03 0.00 0.00 36.82 37.09 2jpk h ILE 24 CO 0.87 0.32 -0.32 0.07 -0.68 0.00 0.00 178.15 178.41 2jpk h LYS 25 N 0.00 0.87 -0.21 2.37 5.09 -2.04 -3.13 116.57 119.53 2jpk h LYS 25 Ca -0.07 -0.44 -0.14 0.00 0.09 0.00 0.00 60.65 60.09 2jpk h LYS 25 Cb 1.40 0.01 -0.01 0.00 0.10 0.00 0.00 32.23 33.73 2jpk h LYS 25 CO 0.05 1.09 -0.46 0.93 -2.09 0.00 0.00 179.45 178.96 2jpk h GLU 26 N 0.68 0.53 0.00 0.07 5.08 -1.99 -3.48 114.58 115.47 2jpk h GLU 26 Ca 0.07 -0.29 0.00 0.00 -1.00 0.00 0.00 59.36 58.13 2jpk h GLU 26 Cb 0.90 0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.17 2jpk h GLU 26 CO 0.08 0.88 0.00 0.41 -1.00 0.00 0.00 179.01 179.39 2jpk n GLY 27 N 0.08 3.36 3.55 -3.84 0.00 -1.18 -5.04 105.19 102.12 2jpk n GLY 27 Ca -0.02 -0.38 -0.30 0.00 0.00 0.00 0.00 46.02 45.31 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 4.48 0.08 1.61 -0.87 -1.26 -4.79 114.94 114.19 2jpk s ASN 28 Ca 0.00 0.59 -0.16 0.00 -1.57 0.00 0.00 52.86 51.73 2jpk s ASN 28 Cb 0.00 -2.52 -0.11 0.00 -0.02 0.00 0.00 41.25 38.60 2jpk s ASN 28 CO 0.00 -3.03 1.37 0.07 -2.57 0.00 0.00 177.10 172.93 2jpk h LYS 29 N 16.67 0.64 -1.92 -0.60 2.10 -1.96 -3.21 116.57 128.29 2jpk h LYS 29 Ca -0.16 -0.38 -0.42 0.00 -2.00 0.00 0.00 60.65 57.69 2jpk h LYS 29 Cb 1.17 0.03 -0.15 0.00 -0.90 0.00 0.00 32.23 32.38 2jpk h LYS 29 CO 1.14 0.99 0.28 -0.25 -2.00 0.00 0.00 179.45 179.61 2jpk n ASP 30 N -4.27 6.28 0.10 7.07 9.92 -1.26 -4.34 116.55 130.04 2jpk n ASP 30 Ca -0.05 -3.07 0.04 0.00 -0.53 0.00 0.00 54.79 51.18 2jpk n ASP 30 Cb 0.50 -1.23 -0.01 0.00 -0.64 0.00 0.00 41.12 39.74 2jpk n ASP 30 CO 0.00 0.00 0.00 0.07 0.13 0.00 0.00 177.20 177.40 2jpk h LYS 31 N 2.70 0.00 0.00 -1.24 5.09 -1.96 -3.30 116.57 117.87 2jpk h LYS 31 Ca 0.34 0.00 -0.03 0.00 0.09 0.00 0.00 60.65 61.05 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 0.75 0.28 -0.14 0.11 -2.09 0.00 0.00 179.45 178.36 2jpk h TRP 32 N 0.00 0.00 0.00 0.07 5.08 -1.88 -2.19 115.95 117.03 2jpk h TRP 32 Ca -0.07 0.00 -0.03 0.00 1.08 0.00 0.00 58.89 59.87 2jpk h TRP 32 Cb 1.36 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 27.52 2jpk h TRP 32 CO 0.00 0.14 -0.14 0.87 -1.28 0.00 0.00 178.44 178.03 2jpk h LYS 33 N 0.00 0.00 -0.55 0.12 1.57 -1.92 -1.32 116.57 114.48 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 0.44 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.75 2jpk h LYS 33 CO 0.02 0.14 0.00 0.09 -0.57 0.00 0.00 179.45 179.13 2jpk n ASN 34 N -3.64 3.01 0.00 0.86 3.02 -0.82 -5.22 115.26 112.46 2jpk n ASN 34 Ca -0.02 -2.12 0.00 0.00 -0.03 0.00 0.00 54.58 52.41 2jpk n ASN 34 Cb 0.26 -0.39 0.00 0.00 -0.61 0.00 0.00 39.78 39.04 2jpk n ASN 34 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26