#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yql s SER 2 N 0.00 -1.44 -0.10 1.61 1.04 -1.26 -5.16 113.70 108.39 2yql s SER 2 Ca 0.00 0.51 -0.30 0.00 0.48 0.00 0.00 55.95 56.64 2yql s SER 2 Cb 0.00 2.05 0.10 0.00 0.10 0.00 0.00 66.02 68.27 2yql s SER 2 CO 0.00 -0.27 0.86 -0.94 0.98 0.00 0.00 173.24 173.87 2yql s SER 3 N 2.85 -0.49 0.00 7.02 1.04 -1.26 -5.02 113.70 117.84 2yql s SER 3 Ca 0.15 0.50 0.00 0.00 0.48 0.00 0.00 55.95 57.08 2yql s SER 3 Cb -0.12 0.41 0.00 0.00 0.10 0.00 0.00 66.02 66.41 2yql s SER 3 CO -0.23 -0.47 0.00 0.61 0.98 0.00 0.00 173.24 174.13 2yql n GLY 4 N 0.73 0.66 3.42 7.32 0.00 -1.26 -5.13 105.19 110.93 2yql n GLY 4 Ca -0.14 -0.03 -0.14 0.00 0.00 0.00 0.00 46.02 45.71 2yql n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2yql s SER 5 N -1.43 -0.50 -0.39 1.61 1.04 -1.26 -5.13 113.70 107.64 2yql s SER 5 Ca 0.00 0.26 0.04 0.00 0.48 0.00 0.00 55.95 56.72 2yql s SER 5 Cb 0.00 0.52 0.11 0.00 0.10 0.00 0.00 66.02 66.75 2yql s SER 5 CO 0.00 -0.73 0.12 -0.44 0.98 0.00 0.00 173.24 173.17 2yql s SER 6 N -1.93 4.53 0.00 7.02 0.01 -1.26 -5.05 113.70 117.03 2yql s SER 6 Ca -0.06 -2.39 0.00 0.00 1.31 0.00 0.00 55.95 54.81 2yql s SER 6 Cb -0.01 -1.55 0.00 0.00 0.21 0.00 0.00 66.02 64.67 2yql s SER 6 CO -0.01 -0.33 0.00 0.61 0.41 0.00 0.00 173.24 173.92 2yql n GLY 7 N 3.93 4.01 0.69 3.44 0.00 -1.26 -5.15 105.19 110.85 2yql n GLY 7 Ca 0.04 -1.35 -0.05 0.00 0.00 0.00 0.00 46.02 44.67 2yql n GLY 7 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2yql n HIS 8 N -1.73 -3.66 -0.27 1.61 -0.00 -1.26 -5.08 115.22 104.83 2yql n HIS 8 Ca 0.00 -0.26 -0.08 0.00 -0.00 0.00 0.00 57.72 57.38 2yql n HIS 8 Cb 0.00 -0.16 0.07 0.00 -0.00 0.00 0.00 29.99 29.90 2yql n HIS 8 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 176.34 176.73 2yql n GLU 9 N -1.42 -2.28 -0.99 -0.41 1.02 -1.26 -5.02 120.64 110.28 2yql n GLU 9 Ca 0.03 -0.39 -0.03 0.00 -0.02 0.00 0.00 57.16 56.75 2yql n GLU 9 Cb 0.10 -0.45 -0.04 0.00 -0.02 0.00 0.00 31.44 31.04 2yql n GLU 9 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 2yql n ASP 10 N -3.61 -0.39 -3.80 1.62 8.00 -1.26 -4.90 116.55 112.20 2yql n ASP 10 Ca 0.04 -1.84 -0.13 0.00 0.71 0.00 0.00 54.79 53.57 2yql n ASP 10 Cb 0.15 0.11 -0.12 0.00 -0.02 0.00 0.00 41.12 41.24 2yql n ASP 10 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2yql s PHE 11 N 0.00 -0.24 0.27 1.24 0.08 -1.26 -4.91 117.98 113.16 2yql s PHE 11 Ca 0.07 0.57 -0.30 0.00 0.12 0.00 0.00 56.93 57.39 2yql s PHE 11 Cb 0.08 0.08 -0.14 0.00 -0.57 0.00 0.00 43.02 42.47 2yql s PHE 11 CO -0.03 -0.14 1.19 0.00 -0.10 0.00 0.00 175.22 176.14 2yql n SER 13 N 1.51 6.63 0.00 0.00 2.88 -1.20 -2.54 113.62 120.89 2yql n SER 13 Ca 0.10 -3.40 0.00 0.00 -1.33 0.00 0.00 58.87 54.24 2yql n SER 13 Cb 0.31 -0.98 0.00 0.00 -0.75 0.00 0.00 64.21 62.79 2yql n SER 13 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 2yql n VAL 14 N -0.35 0.00 -0.01 2.46 0.31 -1.26 -4.95 118.33 114.52 2yql n VAL 14 Ca 0.46 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.80 2yql n VAL 14 Cb 0.72 -0.15 -0.03 0.00 -0.91 0.00 0.00 33.84 33.46 2yql n VAL 14 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2yql n ARG 16 N -1.86 -2.51 -4.22 0.00 1.74 -1.05 -5.00 116.66 103.75 2yql n ARG 16 Ca -0.03 2.17 -0.17 0.00 -0.77 0.00 0.00 57.85 59.04 2yql n ARG 16 Cb 0.33 -4.86 -0.07 0.00 -1.02 0.00 0.00 32.46 26.84 2yql n ARG 16 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 2yql s LYS 17 N -1.85 1.74 0.56 5.56 -0.14 -1.26 -4.89 119.74 119.46 2yql s LYS 17 Ca 0.10 -1.91 0.08 0.00 -1.36 0.00 0.00 55.97 52.89 2yql s LYS 17 Cb -0.03 0.35 0.07 0.00 -1.68 0.00 0.00 37.83 36.54 2yql s LYS 17 CO 0.66 -0.66 0.67 -1.54 -0.76 0.00 0.00 175.35 173.72 2yql s SER 18 N -3.31 4.98 0.00 2.83 1.04 -1.26 -3.94 113.70 114.04 2yql s SER 18 Ca 0.38 -0.95 0.00 0.00 0.48 0.00 0.00 55.95 55.86 2yql s SER 18 Cb 0.02 0.29 0.00 0.00 0.10 0.00 0.00 66.02 66.43 2yql s SER 18 CO 0.24 -1.25 0.00 0.61 0.98 0.00 0.00 173.24 173.82 2yql n GLY 19 N -2.09 0.43 3.73 7.32 0.00 -1.26 -4.98 105.19 108.33 2yql n GLY 19 Ca 0.11 -1.70 -0.35 0.00 0.00 0.00 0.00 46.02 44.07 2yql n GLY 19 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2yql s GLN 20 N 0.00 3.90 0.10 1.61 -1.52 -1.26 -5.10 119.66 117.39 2yql s GLN 20 Ca 0.00 -0.25 0.06 0.00 -1.95 0.00 0.00 55.36 53.21 2yql s GLN 20 Cb 0.00 -3.27 -0.03 0.00 -0.22 0.00 0.00 33.01 29.49 2yql s GLN 20 CO 0.00 0.41 -0.15 -0.51 -0.25 0.00 0.00 175.29 174.79 2yql s LEU 21 N 0.01 2.34 0.34 2.90 1.43 -1.26 -4.79 118.68 119.65 2yql s LEU 21 Ca 0.08 -0.71 -0.12 0.00 -1.03 0.00 0.00 54.13 52.35 2yql s LEU 21 Cb -0.12 -0.56 -0.07 0.00 0.03 0.00 0.00 46.19 45.47 2yql s LEU 21 CO 0.00 -0.10 0.71 -0.22 0.23 0.00 0.00 176.35 176.97 2yql s LEU 22 N -2.09 3.99 -0.03 1.79 2.96 -0.87 -4.93 118.68 119.50 2yql s LEU 22 Ca 0.04 1.14 0.06 0.00 -0.22 0.00 0.00 54.13 55.15 2yql s LEU 22 Cb -0.08 -3.96 -0.02 0.00 0.50 0.00 0.00 46.19 42.63 2yql s LEU 22 CO 0.03 -0.26 -0.22 -0.04 -1.32 0.00 0.00 176.35 174.53 2yql s MET 23 N -3.33 2.26 0.27 1.98 -1.94 -1.26 -2.61 119.30 114.67 2yql s MET 23 Ca 0.51 -0.85 -0.21 0.00 -1.71 0.00 0.00 55.69 53.43 2yql s MET 23 Cb -0.10 -2.16 -0.09 0.00 2.01 0.00 0.00 34.83 34.49 2yql s MET 23 CO 0.24 0.57 0.79 0.00 -0.01 0.00 0.00 175.02 176.61 2yql n ASP 25 N 0.48 7.16 0.06 0.00 2.03 -1.24 -4.50 116.55 120.53 2yql n ASP 25 Ca -0.00 -3.50 0.00 0.00 0.52 0.00 0.00 54.79 51.81 2yql n ASP 25 Cb 0.51 -1.04 0.00 0.00 -0.72 0.00 0.00 41.12 39.87 2yql n ASP 25 CO 0.00 0.00 0.00 0.41 -1.92 0.00 0.00 177.20 175.69 2yql n THR 26 N -0.26 0.00 -1.97 5.18 -1.04 -1.26 -5.06 114.28 109.87 2yql n THR 26 Ca 0.50 0.00 -0.00 0.00 -2.04 0.00 0.00 64.05 62.50 2yql n THR 26 Cb 0.57 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.08 2yql n THR 26 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2yql n SER 28 N -3.00 4.57 -3.92 0.00 7.64 -1.26 -4.65 113.62 113.01 2yql n SER 28 Ca 0.00 -3.68 -0.17 0.00 1.01 0.00 0.00 58.87 56.03 2yql n SER 28 Cb 0.00 -0.59 -0.15 0.00 -1.01 0.00 0.00 64.21 62.46 2yql n SER 28 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 2yql s ARG 29 N -3.45 0.51 0.05 1.43 0.52 -1.26 -4.41 118.95 112.34 2yql s ARG 29 Ca 0.48 -0.12 0.01 0.00 -0.52 0.00 0.00 55.73 55.58 2yql s ARG 29 Cb 0.27 -0.53 -0.04 0.00 0.52 0.00 0.00 34.95 35.17 2yql s ARG 29 CO -0.13 0.02 0.14 0.14 0.02 0.00 0.00 175.30 175.49 2yql s VAL 30 N 0.34 4.95 -0.13 3.52 -7.23 -1.26 -3.71 120.40 116.88 2yql s VAL 30 Ca -0.04 -0.53 -0.09 0.00 -1.81 0.00 0.00 61.98 59.51 2yql s VAL 30 Cb -0.07 -3.37 0.04 0.00 0.56 0.00 0.00 36.38 33.53 2yql s VAL 30 CO -0.00 0.18 0.32 -0.31 -0.31 0.00 0.00 175.10 174.98 2yql s TYR 31 N -1.40 -0.42 1.37 2.82 2.02 -1.07 -3.27 117.35 117.40 2yql s TYR 31 Ca 0.30 0.96 -0.22 0.00 -0.37 0.00 0.00 57.07 57.74 2yql s TYR 31 Cb -0.12 0.14 0.34 0.00 -0.40 0.00 0.00 41.96 41.91 2yql s TYR 31 CO 0.23 -0.24 0.77 0.72 -1.57 0.00 0.00 175.55 175.46 2yql n HIS 32 N 3.65 -3.51 0.03 2.71 8.25 -1.26 -2.05 115.22 123.04 2yql n HIS 32 Ca -0.19 -0.64 0.00 0.00 -0.26 0.00 0.00 57.72 56.64 2yql n HIS 32 Cb 0.56 -1.28 -0.08 0.00 1.12 0.00 0.00 29.99 30.30 2yql n HIS 32 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2yql n LEU 33 N 0.00 0.81 -0.02 2.41 4.77 -1.26 -4.16 117.00 119.55 2yql n LEU 33 Ca 0.12 0.36 0.08 0.00 -0.03 0.00 0.00 56.01 56.54 2yql n LEU 33 Cb 0.53 0.08 -0.16 0.00 -2.33 0.00 0.00 43.42 41.54 2yql n LEU 33 CO 0.35 0.13 -0.78 0.47 -1.33 0.00 0.00 177.39 176.23 2yql n ASP 34 N -2.86 0.34 -3.40 -1.43 9.92 -1.25 -0.37 116.55 117.51 2yql n ASP 34 Ca -0.10 0.00 -0.40 0.00 -0.53 0.00 0.00 54.79 53.77 2yql n ASP 34 Cb 0.83 1.83 0.01 0.00 -0.64 0.00 0.00 41.12 43.15 2yql n ASP 34 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2yql n LEU 36 N 0.35 0.00 -3.35 0.00 4.77 -1.26 -4.34 117.00 113.16 2yql n LEU 36 Ca 0.52 -2.83 -0.14 0.00 -0.03 0.00 0.00 56.01 53.53 2yql n LEU 36 Cb 0.27 0.36 -0.08 0.00 -2.33 0.00 0.00 43.42 41.65 2yql n LEU 36 CO 0.54 -0.40 -0.13 -0.62 -1.33 0.00 0.00 177.39 175.45 2yql s ASP 37 N -3.47 1.04 0.97 -1.43 2.15 -1.26 -2.89 116.67 111.78 2yql s ASP 37 Ca 0.01 -0.94 -0.12 0.00 0.43 0.00 0.00 52.55 51.93 2yql s ASP 37 Cb 0.00 0.74 0.17 0.00 -0.30 0.00 0.00 42.92 43.53 2yql s ASP 37 CO 0.01 -0.33 1.09 -2.16 -0.17 0.00 0.00 175.17 173.61 2yql s PRO 38 N 2.08 0.64 0.81 4.34 0.04 -1.26 -4.64 135.00 137.01 2yql s PRO 38 Ca 0.12 0.60 -0.11 0.00 0.04 0.00 0.00 61.00 61.66 2yql s PRO 38 Cb -0.14 -1.76 0.08 0.00 0.04 0.00 0.00 34.50 32.73 2yql s PRO 38 CO -0.21 -2.61 1.09 -1.25 0.04 0.00 0.00 177.00 174.06 2yql s PRO 39 N -4.95 1.94 0.43 0.56 0.04 -1.14 -5.03 135.00 126.85 2yql s PRO 39 Ca 0.65 1.06 0.03 0.00 0.04 0.00 0.00 61.00 62.78 2yql s PRO 39 Cb -0.18 -1.87 -0.02 0.00 0.04 0.00 0.00 34.50 32.47 2yql s PRO 39 CO 0.57 -1.83 0.11 -0.51 0.04 0.00 0.00 177.00 175.38 2yql s LEU 40 N -6.02 2.04 0.00 -3.56 1.43 0.50 -4.92 118.68 108.16 2yql s LEU 40 Ca 0.62 -1.69 0.00 0.00 -1.03 0.00 0.00 54.13 52.03 2yql s LEU 40 Cb -0.17 -0.20 0.00 0.00 0.03 0.00 0.00 46.19 45.85 2yql s LEU 40 CO 0.56 -0.93 0.00 1.17 0.23 0.00 0.00 176.35 177.38 2yql n LYS 41 N -0.98 0.00 -1.03 1.70 4.81 -1.23 -3.90 118.16 117.53 2yql n LYS 41 Ca -0.08 0.00 -0.04 0.00 -0.87 0.00 0.00 58.31 57.32 2yql n LYS 41 Cb 0.65 0.00 0.02 0.00 0.02 0.00 0.00 35.03 35.72 2yql n LYS 41 CO 0.00 0.00 0.00 0.25 1.17 0.00 0.00 177.40 178.82 2yql n THR 42 N -2.30 0.00 -2.21 3.15 -2.24 -1.26 -4.90 114.28 104.52 2yql n THR 42 Ca 0.00 -0.29 -0.43 0.00 -2.27 0.00 0.00 64.05 61.06 2yql n THR 42 Cb 0.00 -1.23 -0.02 0.00 -2.10 0.00 0.00 70.33 66.98 2yql n THR 42 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 2yql s ILE 43 N -0.23 3.81 -0.79 2.28 1.01 -1.26 -4.93 121.20 121.10 2yql s ILE 43 Ca 0.12 0.90 -0.25 0.00 0.00 0.00 0.00 60.65 61.42 2yql s ILE 43 Cb -0.01 -3.87 -0.04 0.00 0.01 0.00 0.00 42.46 38.55 2yql s ILE 43 CO 0.08 -0.40 1.91 -2.16 0.00 0.00 0.00 174.94 174.37 2yql s PRO 44 N 4.66 2.58 0.86 2.79 0.04 -1.26 -4.96 135.00 139.71 2yql s PRO 44 Ca 0.67 0.06 -0.14 0.00 0.04 0.00 0.00 61.00 61.62 2yql s PRO 44 Cb -0.21 -4.80 0.01 0.00 0.04 0.00 0.00 34.50 29.53 2yql s PRO 44 CO 0.28 -3.13 0.45 0.36 0.04 0.00 0.00 177.00 175.00 2yql n LYS 45 N 8.98 -0.05 -0.30 4.56 2.85 -1.26 -4.60 118.16 128.34 2yql n LYS 45 Ca 0.33 0.03 0.03 0.00 -1.05 0.00 0.00 58.31 57.65 2yql n LYS 45 Cb 0.49 -1.85 -0.02 0.00 -0.65 0.00 0.00 35.03 33.00 2yql n LYS 45 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2yql n GLY 46 N 1.57 -2.79 3.49 2.58 0.00 -1.26 -4.72 105.19 104.06 2yql n GLY 46 Ca 0.08 -1.36 -0.45 0.00 0.00 0.00 0.00 46.02 44.29 2yql n GLY 46 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 2yql n MET 47 N -2.44 0.96 -3.41 1.61 0.00 -1.26 -4.92 117.12 107.66 2yql n MET 47 Ca -0.02 0.19 -0.35 0.00 -0.00 0.00 0.00 57.70 57.52 2yql n MET 47 Cb 0.14 -2.60 -0.06 0.00 0.00 0.00 0.00 33.22 30.70 2yql n MET 47 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 175.97 175.51 2yql s TRP 48 N 8.81 3.62 -0.03 1.12 -0.00 -1.26 -5.09 118.94 126.10 2yql s TRP 48 Ca 1.10 1.00 -0.00 0.00 -0.00 0.00 0.00 56.10 58.21 2yql s TRP 48 Cb -0.72 -2.32 0.03 0.00 -0.00 0.00 0.00 33.47 30.45 2yql s TRP 48 CO 0.43 0.47 0.02 0.42 -0.00 0.00 0.00 176.95 178.28 2yql s ILE 49 N -1.41 0.09 0.72 5.86 1.01 -1.26 -3.70 121.20 122.52 2yql s ILE 49 Ca 0.35 0.17 -0.16 0.00 0.00 0.00 0.00 60.65 61.01 2yql s ILE 49 Cb -0.15 -0.22 -0.03 0.00 0.01 0.00 0.00 42.46 42.07 2yql s ILE 49 CO 0.19 0.14 0.60 0.00 0.00 0.00 0.00 174.94 175.86 2yql n PRO 51 N -0.92 0.13 0.16 0.00 -0.04 -1.26 -2.35 135.00 130.72 2yql n PRO 51 Ca 0.10 0.37 0.05 0.00 -0.04 0.00 0.00 63.50 63.98 2yql n PRO 51 Cb 0.50 -1.74 0.14 0.00 -0.04 0.00 0.00 33.50 32.35 2yql n PRO 51 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2yql h ARG 52 N 0.00 0.00 0.00 0.54 -0.00 -1.89 -3.10 114.38 109.93 2yql h ARG 52 Ca 0.00 0.00 -0.09 0.00 -0.50 0.00 0.00 59.98 59.39 2yql h ARG 52 Cb 0.32 0.00 -0.01 0.00 0.00 0.00 0.00 29.97 30.27 2yql h ARG 52 CO 0.00 0.41 -0.58 0.00 0.00 0.00 0.00 179.97 179.80 2yql h GLN 54 N -1.00 0.04 -6.18 0.00 1.08 -1.67 -3.41 115.11 103.97 2yql h GLN 54 Ca -0.13 -0.00 -0.53 0.00 -1.45 0.00 0.00 58.65 56.54 2yql h GLN 54 Cb 0.89 -0.01 -0.07 0.00 -0.05 0.00 0.00 27.48 28.24 2yql h GLN 54 CO -0.08 0.03 -0.55 0.34 -0.95 0.00 0.00 178.83 177.61 2yql s ASP 55 N -5.77 5.03 0.00 1.46 -1.08 -1.17 -5.13 116.67 110.01 2yql s ASP 55 Ca -0.05 -0.50 0.28 0.00 -0.52 0.00 0.00 52.55 51.75 2yql s ASP 55 Cb 0.21 -1.05 1.65 0.00 -1.46 0.00 0.00 42.92 42.28 2yql s ASP 55 CO 0.76 -0.12 2.00 0.00 0.52 0.00 0.00 175.17 178.34