#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ip0 n LYS 2 N 0.00 0.00 -2.69 5.56 4.01 -1.26 -5.06 118.16 118.73 1ip0 n LYS 2 Ca 0.00 0.00 -0.05 0.00 -0.51 0.00 0.00 58.31 57.75 1ip0 n LYS 2 Cb 0.00 -0.02 0.06 0.00 -0.51 0.00 0.00 35.03 34.56 1ip0 n LYS 2 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1ip0 n GLY 3 N 1.59 -1.35 2.82 0.72 0.00 -1.26 -5.06 105.19 102.64 1ip0 n GLY 3 Ca 0.00 0.86 -0.40 0.00 0.00 0.00 0.00 46.02 46.48 1ip0 n GLY 3 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1ip0 n HIS 4 N 1.76 2.65 -2.70 1.61 -0.00 -1.26 -4.98 115.22 112.29 1ip0 n HIS 4 Ca 0.05 -2.80 0.00 0.00 0.46 0.00 0.00 57.72 55.43 1ip0 n HIS 4 Cb 0.68 -1.12 0.00 0.00 -0.12 0.00 0.00 29.99 29.42 1ip0 n HIS 4 CO 0.00 0.00 0.00 1.19 0.46 0.00 0.00 176.34 177.99 1ip0 n PHE 5 N 0.71 0.00 -4.26 1.57 3.72 -1.26 -5.00 117.46 112.93 1ip0 n PHE 5 Ca 0.34 0.00 -0.34 0.00 -0.05 0.00 0.00 57.45 57.40 1ip0 n PHE 5 Cb 0.32 0.00 -0.14 0.00 -0.94 0.00 0.00 39.48 38.72 1ip0 n PHE 5 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 1ip0 s SER 6 N 0.91 4.35 0.26 4.37 0.01 -0.89 -5.01 113.70 117.70 1ip0 s SER 6 Ca 0.00 -0.31 -0.29 0.00 1.31 0.00 0.00 55.95 56.66 1ip0 s SER 6 Cb 0.00 -1.72 -0.09 0.00 0.21 0.00 0.00 66.02 64.42 1ip0 s SER 6 CO 0.00 0.08 0.95 -0.60 0.41 0.00 0.00 173.24 174.07 1ip0 s ARG 7 N 0.90 4.78 -0.13 12.44 3.52 -1.26 -1.18 118.95 138.02 1ip0 s ARG 7 Ca -0.01 1.45 -0.29 0.00 -0.13 0.00 0.00 55.73 56.75 1ip0 s ARG 7 Cb -0.15 -3.14 -0.01 0.00 -1.56 0.00 0.00 34.95 30.09 1ip0 s ARG 7 CO 0.01 0.44 1.00 0.00 -0.81 0.00 0.00 175.30 175.95 1ip0 s PRO 9 N 2.22 3.38 0.43 0.00 0.04 -1.26 -4.69 135.00 135.12 1ip0 s PRO 9 Ca 0.47 1.04 0.10 0.00 0.04 0.00 0.00 61.00 62.66 1ip0 s PRO 9 Cb -0.18 -2.05 0.97 0.00 0.04 0.00 0.00 34.50 33.28 1ip0 s PRO 9 CO 0.16 -0.74 2.05 0.87 0.04 0.00 0.00 177.00 179.37 1ip0 h LYS 10 N 0.17 0.42 -0.28 4.56 1.57 -1.95 -1.29 116.57 119.77 1ip0 h LYS 10 Ca -0.46 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.29 1ip0 h LYS 10 Cb 1.21 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 33.41 1ip0 h LYS 10 CO 0.59 0.28 0.15 0.37 -0.57 0.00 0.00 179.45 180.27 1ip0 h GLN 11 N 0.43 0.38 -0.27 3.15 4.15 -2.02 -2.18 115.11 118.74 1ip0 h GLN 11 Ca 0.16 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.55 1ip0 h GLN 11 Cb 0.11 -0.08 0.00 0.00 0.21 0.00 0.00 27.48 27.71 1ip0 h GLN 11 CO -0.04 0.28 0.00 0.66 -1.93 0.00 0.00 178.83 177.81 1ip0 n TYR 12 N -4.46 0.34 -1.66 3.99 4.01 -0.58 -4.61 117.16 114.20 1ip0 n TYR 12 Ca 0.01 -0.20 -0.31 0.00 -0.16 0.00 0.00 57.90 57.24 1ip0 n TYR 12 Cb 0.10 -0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.08 1ip0 n TYR 12 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 1ip0 n LYS 13 N 1.26 3.15 0.14 -0.72 5.02 -0.64 -4.48 118.16 121.88 1ip0 n LYS 13 Ca 0.16 -2.71 0.12 0.00 -2.02 0.00 0.00 58.31 53.86 1ip0 n LYS 13 Cb 0.54 -2.31 0.15 0.00 -0.02 0.00 0.00 35.03 33.40 1ip0 n LYS 13 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1ip0 h HIS 14 N 3.54 0.00 0.00 2.13 3.86 -1.81 -3.16 115.15 119.71 1ip0 h HIS 14 Ca 0.50 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.71 1ip0 h HIS 14 Cb 0.59 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.06 1ip0 h HIS 14 CO 1.52 0.00 -0.05 2.48 0.86 0.00 0.00 177.93 182.74 1ip0 n TYR 15 N -2.67 0.26 -3.57 2.45 0.18 -1.26 -4.69 117.16 107.86 1ip0 n TYR 15 Ca 0.03 0.07 -0.16 0.00 1.88 0.00 0.00 57.90 59.72 1ip0 n TYR 15 Cb 0.50 -0.60 -0.13 0.00 -0.38 0.00 0.00 39.34 38.73 1ip0 n TYR 15 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 1ip0 h ILE 17 N 6.31 0.00 -2.05 0.00 1.08 -1.59 -3.36 117.51 117.90 1ip0 h ILE 17 Ca -0.16 -0.31 -0.75 0.00 -0.39 0.00 0.00 64.86 63.25 1ip0 h ILE 17 Cb 1.14 0.00 -0.30 0.00 -3.07 0.00 0.00 36.82 34.59 1ip0 h ILE 17 CO 0.21 0.00 0.72 2.29 -0.69 0.00 0.00 178.15 180.68 1ip0 n LYS 18 N -3.63 3.79 -3.75 2.37 2.85 -0.79 -4.94 118.16 114.05 1ip0 n LYS 18 Ca -0.04 -4.13 -0.13 0.00 -1.05 0.00 0.00 58.31 52.96 1ip0 n LYS 18 Cb 0.11 -2.33 -0.10 0.00 -0.65 0.00 0.00 35.03 32.06 1ip0 n LYS 18 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 177.40 177.55 1ip0 s GLY 19 N -1.64 -0.28 0.77 2.58 0.00 -1.26 -2.27 107.32 105.22 1ip0 s GLY 19 Ca 0.47 1.02 -0.04 0.00 0.00 0.00 0.00 44.72 46.17 1ip0 s GLY 19 CO -0.27 0.87 1.05 0.54 0.00 0.00 0.00 173.10 175.29 1ip0 n ARG 20 N 2.80 -0.37 -3.65 2.90 1.74 0.51 -4.79 116.66 115.80 1ip0 n ARG 20 Ca -0.13 -2.49 -0.13 0.00 -0.77 0.00 0.00 57.85 54.32 1ip0 n ARG 20 Cb 0.57 -0.81 -0.08 0.00 -1.02 0.00 0.00 32.46 31.13 1ip0 n ARG 20 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1ip0 s ARG 22 N 0.44 2.53 -0.33 0.00 3.52 0.11 -1.27 118.95 123.96 1ip0 s ARG 22 Ca -0.01 -1.21 -0.15 0.00 -0.13 0.00 0.00 55.73 54.24 1ip0 s ARG 22 Cb -0.05 -3.22 -0.02 0.00 -1.56 0.00 0.00 34.95 30.11 1ip0 s ARG 22 CO -0.01 -0.60 0.35 0.12 -0.81 0.00 0.00 175.30 174.35 1ip0 s PHE 23 N 1.30 3.22 -0.29 5.12 2.19 -0.32 -2.23 117.98 126.95 1ip0 s PHE 23 Ca -0.04 0.04 -0.23 0.00 0.33 0.00 0.00 56.93 57.03 1ip0 s PHE 23 Cb -0.19 -2.63 -0.00 0.00 -1.31 0.00 0.00 43.02 38.89 1ip0 s PHE 23 CO -0.01 -0.38 0.77 0.08 1.83 0.00 0.00 175.22 177.52 1ip0 s VAL 24 N 1.99 4.82 -0.11 3.12 1.01 -0.91 -2.09 120.40 128.23 1ip0 s VAL 24 Ca 0.12 1.20 -0.12 0.00 0.00 0.00 0.00 61.98 63.17 1ip0 s VAL 24 Cb -0.16 -4.12 -0.11 0.00 0.00 0.00 0.00 36.38 31.99 1ip0 s VAL 24 CO 0.11 -0.20 0.33 0.58 0.00 0.00 0.00 175.10 175.92 1ip0 h VAL 25 N 5.56 0.73 -0.21 2.92 2.07 -1.94 -2.58 116.25 122.80 1ip0 h VAL 25 Ca -0.25 -1.53 0.06 0.00 0.82 0.00 0.00 66.70 65.80 1ip0 h VAL 25 Cb 1.10 1.38 -0.07 0.00 -1.52 0.00 0.00 31.29 32.18 1ip0 h VAL 25 CO 0.87 0.25 -0.33 0.00 0.02 0.00 0.00 177.57 178.38 1ip0 h ALA 26 N -0.59 -0.33 -2.86 1.67 0.00 -1.96 -3.23 119.26 111.96 1ip0 h ALA 26 Ca -0.00 0.04 -0.74 0.00 0.00 0.00 0.00 54.91 54.22 1ip0 h ALA 26 Cb 0.41 0.64 -0.30 0.00 0.00 0.00 0.00 17.79 18.54 1ip0 h ALA 26 CO 0.00 -0.78 -0.23 -2.00 0.00 0.00 0.00 179.25 176.24 1ip0 s GLU 27 N -5.99 2.86 -0.92 0.00 2.12 -1.26 -5.01 118.70 110.50 1ip0 s GLU 27 Ca -0.15 -2.24 -0.24 0.00 0.36 0.00 0.00 54.97 52.70 1ip0 s GLU 27 Cb 0.11 -4.02 -0.23 0.00 0.26 0.00 0.00 34.13 30.25 1ip0 s GLU 27 CO 0.66 -1.22 2.37 0.94 -0.54 0.00 0.00 175.26 177.47 1ip0 n GLN 28 N 4.14 0.00 -3.27 4.30 7.27 -1.20 -4.51 117.38 124.11 1ip0 n GLN 28 Ca 0.04 0.00 -0.19 0.00 0.07 0.00 0.00 57.00 56.92 1ip0 n GLN 28 Cb 0.42 -1.28 -0.07 0.00 2.41 0.00 0.00 30.24 31.72 1ip0 n GLN 28 CO 0.00 0.00 0.00 0.99 0.07 0.00 0.00 177.06 178.12 1ip0 s THR 29 N 6.36 -0.21 -0.53 1.69 2.01 -0.98 -4.96 115.64 119.02 1ip0 s THR 29 Ca 1.25 -1.59 -0.28 0.00 0.31 0.00 0.00 61.69 61.37 1ip0 s THR 29 Cb -1.07 -0.76 0.03 0.00 0.01 0.00 0.00 72.50 70.70 1ip0 s THR 29 CO 0.47 -0.72 1.23 -2.16 -0.69 0.00 0.00 174.62 172.75 1ip0 s PRO 30 N 0.84 3.54 -0.11 4.92 0.04 -1.26 -2.15 135.00 140.82 1ip0 s PRO 30 Ca 0.25 0.43 0.02 0.00 0.04 0.00 0.00 61.00 61.74 1ip0 s PRO 30 Cb -0.07 -4.00 0.01 0.00 0.04 0.00 0.00 34.50 30.48 1ip0 s PRO 30 CO -0.08 -1.63 -0.17 -1.12 0.04 0.00 0.00 177.00 174.04 1ip0 s SER 31 N 3.14 2.52 -0.19 6.66 0.01 -0.95 -5.01 113.70 119.89 1ip0 s SER 31 Ca 0.48 -0.45 -0.07 0.00 1.31 0.00 0.00 55.95 57.22 1ip0 s SER 31 Cb -0.08 -1.14 -0.04 0.00 0.21 0.00 0.00 66.02 64.97 1ip0 s SER 31 CO 0.28 0.04 0.05 0.00 0.41 0.00 0.00 173.24 174.02 1ip0 s VAL 33 N 0.60 2.81 0.69 0.00 1.01 0.12 -4.94 120.40 120.69 1ip0 s VAL 33 Ca 0.02 -1.21 -0.11 0.00 0.00 0.00 0.00 61.98 60.68 1ip0 s VAL 33 Cb -0.13 -2.51 0.00 0.00 0.00 0.00 0.00 36.38 33.75 1ip0 s VAL 33 CO 0.02 0.08 1.08 0.00 0.00 0.00 0.00 175.10 176.28 1ip0 s ASP 35 N -4.31 6.36 0.26 0.00 1.11 -0.96 -4.80 116.67 114.33 1ip0 s ASP 35 Ca 0.58 2.93 -0.01 0.00 0.18 0.00 0.00 52.55 56.22 1ip0 s ASP 35 Cb -0.11 -2.62 0.55 0.00 1.07 0.00 0.00 42.92 41.81 1ip0 s ASP 35 CO 0.52 -0.95 1.74 -0.08 1.18 0.00 0.00 175.17 177.58 1ip0 h GLU 36 N 5.74 0.52 -1.50 8.23 4.81 -1.93 -1.05 114.58 129.40 1ip0 h GLU 36 Ca -0.45 -0.03 -0.41 0.00 -0.13 0.00 0.00 59.36 58.33 1ip0 h GLU 36 Cb 1.21 -0.12 -0.17 0.00 0.63 0.00 0.00 28.75 30.30 1ip0 h GLU 36 CO 0.87 0.35 0.50 0.41 -0.73 0.00 0.00 179.01 180.41 1ip0 n GLY 37 N -1.33 4.46 3.80 1.92 0.00 -1.26 -4.94 105.19 107.84 1ip0 n GLY 37 Ca 0.17 -1.42 -0.23 0.00 0.00 0.00 0.00 46.02 44.55 1ip0 n GLY 37 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1ip0 s TYR 38 N -2.19 2.69 0.05 1.61 1.13 -0.40 -0.54 117.35 119.71 1ip0 s TYR 38 Ca 0.40 -0.48 -0.04 0.00 -1.41 0.00 0.00 57.07 55.54 1ip0 s TYR 38 Cb 0.31 -1.95 -0.02 0.00 -1.10 0.00 0.00 41.96 39.20 1ip0 s TYR 38 CO -0.04 0.11 0.06 0.42 -2.51 0.00 0.00 175.55 173.60 1ip0 s ILE 39 N -2.49 0.16 0.00 -3.49 1.01 0.59 -4.57 121.20 112.41 1ip0 s ILE 39 Ca 0.43 -1.35 0.00 0.00 0.00 0.00 0.00 60.65 59.73 1ip0 s ILE 39 Cb -0.01 -1.17 0.00 0.00 0.01 0.00 0.00 42.46 41.29 1ip0 s ILE 39 CO 0.25 -0.75 0.00 0.61 0.00 0.00 0.00 174.94 175.05 1ip0 n GLY 40 N 0.41 2.22 0.19 6.18 0.00 -1.26 -0.41 105.19 112.52 1ip0 n GLY 40 Ca -0.17 -1.83 -0.17 0.00 0.00 0.00 0.00 46.02 43.86 1ip0 n GLY 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ip0 h ALA 41 N 0.00 0.24 -0.56 4.61 0.00 -2.00 -3.16 119.26 118.40 1ip0 h ALA 41 Ca 0.00 -0.55 -0.20 0.00 0.00 0.00 0.00 54.91 54.17 1ip0 h ALA 41 Cb 0.00 -0.01 -0.12 0.00 0.00 0.00 0.00 17.79 17.66 1ip0 h ALA 41 CO 0.00 0.51 0.25 0.54 0.00 0.00 0.00 179.25 180.55 1ip0 n ARG 42 N -4.11 2.70 -3.48 0.00 1.74 -1.26 -4.90 116.66 107.35 1ip0 n ARG 42 Ca -0.08 -2.12 -0.20 0.00 -0.77 0.00 0.00 57.85 54.68 1ip0 n ARG 42 Cb 0.66 -1.91 0.06 0.00 -1.02 0.00 0.00 32.46 30.25 1ip0 n ARG 42 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1ip0 n GLU 44 N -3.86 0.45 -1.89 0.00 2.13 -1.02 -1.89 120.64 114.57 1ip0 n GLU 44 Ca -0.18 0.19 -0.29 0.00 0.66 0.00 0.00 57.16 57.53 1ip0 n GLU 44 Cb 0.64 -1.27 0.11 0.00 0.27 0.00 0.00 31.44 31.19 1ip0 n GLU 44 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 1ip0 s ARG 45 N -2.39 1.73 0.03 5.31 0.52 0.46 -4.89 118.95 119.73 1ip0 s ARG 45 Ca -0.29 0.04 -0.06 0.00 -0.52 0.00 0.00 55.73 54.90 1ip0 s ARG 45 Cb 0.11 -1.93 -0.01 0.00 0.52 0.00 0.00 34.95 33.64 1ip0 s ARG 45 CO 0.38 -1.74 0.12 0.54 0.02 0.00 0.00 175.30 174.62 1ip0 s VAL 46 N -3.61 0.12 -0.40 3.52 0.11 -1.26 -0.30 120.40 118.58 1ip0 s VAL 46 Ca 0.64 -1.00 0.05 0.00 -2.93 0.00 0.00 61.98 58.73 1ip0 s VAL 46 Cb -0.10 -0.84 0.46 0.00 -1.53 0.00 0.00 36.38 34.37 1ip0 s VAL 46 CO 0.50 -0.55 1.46 -0.67 -3.33 0.00 0.00 175.10 172.50 1ip0 n ASP 47 N 0.84 5.51 -3.19 3.54 2.03 0.30 -4.74 116.55 120.84 1ip0 n ASP 47 Ca -0.19 -3.77 0.01 0.00 0.52 0.00 0.00 54.79 51.36 1ip0 n ASP 47 Cb 0.58 -0.55 -0.02 0.00 -0.72 0.00 0.00 41.12 40.41 1ip0 n ASP 47 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 1ip0 s LEU 48 N -3.64 -1.26 -0.17 -2.67 0.20 -1.26 -4.94 118.68 104.95 1ip0 s LEU 48 Ca 0.54 0.70 -0.13 0.00 0.69 0.00 0.00 54.13 55.93 1ip0 s LEU 48 Cb 0.44 1.96 -0.08 0.00 -0.43 0.00 0.00 46.19 48.08 1ip0 s LEU 48 CO 0.02 -0.27 -0.07 0.49 -0.29 0.00 0.00 176.35 176.23 1ip0 n PHE 49 N 5.42 0.92 1.49 5.38 3.01 -1.26 -5.15 117.46 127.27 1ip0 n PHE 49 Ca -0.01 0.40 0.14 0.00 1.01 0.00 0.00 57.45 58.99 1ip0 n PHE 49 Cb 0.51 -0.87 0.51 0.00 -0.01 0.00 0.00 39.48 39.62 1ip0 n PHE 49 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43