#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 0.18 0.04 1.61 0.15 -1.26 -5.03 113.70 109.39 2yql s SER 2 Ca 0.00 -0.58 0.00 0.00 0.70 0.00 0.00 55.95 56.07 2yql s SER 2 Cb 0.00 0.25 0.00 0.00 -1.71 0.00 0.00 66.02 64.56 2yql s SER 2 CO 0.00 -0.55 0.00 -0.24 1.20 0.00 0.00 173.24 173.65 2yql n SER 3 N 0.58 -0.37 0.00 5.45 2.88 -1.26 -5.10 113.62 115.81 2yql n SER 3 Ca -0.18 0.40 0.00 0.00 -1.33 0.00 0.00 58.87 57.76 2yql n SER 3 Cb 0.59 0.68 0.00 0.00 -0.75 0.00 0.00 64.21 64.73 2yql n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2yql n GLY 4 N -1.06 -0.87 3.26 0.46 0.00 -1.26 -5.14 105.19 100.59 2yql n GLY 4 Ca 0.00 0.34 -0.10 0.00 0.00 0.00 0.00 46.02 46.26 2yql n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2yql s SER 5 N -2.67 -0.07 -0.55 1.61 0.15 -1.26 -5.05 113.70 105.85 2yql s SER 5 Ca 0.00 -0.46 -0.02 0.00 0.70 0.00 0.00 55.95 56.17 2yql s SER 5 Cb 0.00 0.41 0.28 0.00 -1.71 0.00 0.00 66.02 65.00 2yql s SER 5 CO 0.00 -0.79 2.19 -0.24 1.20 0.00 0.00 173.24 175.60 2yql n SER 6 N -0.13 7.05 0.00 5.45 2.88 -1.26 -5.01 113.62 122.60 2yql n SER 6 Ca -0.16 -3.46 0.00 0.00 -1.33 0.00 0.00 58.87 53.93 2yql n SER 6 Cb 0.63 -1.07 0.00 0.00 -0.75 0.00 0.00 64.21 63.02 2yql n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2yql n GLY 7 N -0.09 -1.89 3.65 0.46 0.00 -1.26 -4.95 105.19 101.12 2yql n GLY 7 Ca 0.48 -1.54 -0.27 0.00 0.00 0.00 0.00 46.02 44.70 2yql n GLY 7 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2yql s HIS 8 N 0.00 2.82 0.43 1.61 0.09 -1.26 -4.86 115.29 114.12 2yql s HIS 8 Ca 0.00 -0.14 -0.07 0.00 -0.00 0.00 0.00 55.06 54.84 2yql s HIS 8 Cb 0.00 -1.37 0.11 0.00 -0.00 0.00 0.00 32.58 31.32 2yql s HIS 8 CO 0.00 0.52 0.29 0.39 -0.00 0.00 0.00 174.74 175.94 2yql n GLU 9 N -0.09 -2.53 -1.03 1.40 1.02 -1.26 -5.01 120.64 113.14 2yql n GLU 9 Ca -0.10 -0.48 0.00 0.00 -0.02 0.00 0.00 57.16 56.57 2yql n GLU 9 Cb 0.55 -0.56 -0.01 0.00 -0.02 0.00 0.00 31.44 31.40 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 -3.79 0.20 -3.80 1.62 8.00 -1.26 -4.84 116.55 112.69 2yql n ASP 10 Ca 0.04 -1.88 -0.13 0.00 0.71 0.00 0.00 54.79 53.54 2yql n ASP 10 Cb 0.18 -0.11 -0.12 0.00 -0.02 0.00 0.00 41.12 41.06 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 -0.22 0.25 1.24 0.08 -1.26 -4.85 117.98 113.22 2yql s PHE 11 Ca 0.14 0.54 -0.30 0.00 0.12 0.00 0.00 56.93 57.43 2yql s PHE 11 Cb 0.16 0.08 -0.14 0.00 -0.57 0.00 0.00 43.02 42.55 2yql s PHE 11 CO -0.07 -0.14 1.21 0.00 -0.10 0.00 0.00 175.22 176.12 2yql n SER 13 N 1.62 6.71 0.00 0.00 2.88 -1.15 -2.53 113.62 121.15 2yql n SER 13 Ca 0.11 -3.40 0.00 0.00 -1.33 0.00 0.00 58.87 54.24 2yql n SER 13 Cb 0.31 -0.99 0.00 0.00 -0.75 0.00 0.00 64.21 62.78 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 -0.33 0.00 -0.01 2.46 0.31 -1.26 -4.95 118.33 114.54 2yql n VAL 14 Ca 0.46 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.79 2yql n VAL 14 Cb 0.70 -0.14 -0.03 0.00 -0.91 0.00 0.00 33.84 33.45 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 -1.89 -2.63 -4.26 0.00 1.74 -1.05 -5.00 116.66 103.57 2yql n ARG 16 Ca -0.03 2.24 -0.19 0.00 -0.77 0.00 0.00 57.85 59.10 2yql n ARG 16 Cb 0.36 -4.82 -0.08 0.00 -1.02 0.00 0.00 32.46 26.91 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 -1.72 1.77 0.06 5.56 -0.14 -1.26 -4.89 119.74 119.11 2yql s LYS 17 Ca 0.07 -1.99 0.02 0.00 -1.36 0.00 0.00 55.97 52.71 2yql s LYS 17 Cb -0.02 0.34 -0.04 0.00 -1.68 0.00 0.00 37.83 36.43 2yql s LYS 17 CO 0.66 -0.67 0.08 -1.54 -0.76 0.00 0.00 175.35 173.12 2yql s SER 18 N -3.36 5.59 0.00 2.83 1.04 -1.26 -4.04 113.70 114.50 2yql s SER 18 Ca 0.40 0.04 0.00 0.00 0.48 0.00 0.00 55.95 56.87 2yql s SER 18 Cb 0.02 -1.53 0.00 0.00 0.10 0.00 0.00 66.02 64.61 2yql s SER 18 CO 0.27 0.20 0.00 0.61 0.98 0.00 0.00 173.24 175.30 2yql n GLY 19 N 0.63 0.87 3.71 7.32 0.00 -1.26 -5.07 105.19 111.40 2yql n GLY 19 Ca -0.09 -1.93 -0.42 0.00 0.00 0.00 0.00 46.02 43.57 2yql n GLY 19 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2yql s GLN 20 N -1.60 4.57 0.09 1.61 2.00 -1.26 -5.02 119.66 120.05 2yql s GLN 20 Ca 0.00 1.47 0.06 0.00 -2.00 0.00 0.00 55.36 54.89 2yql s GLN 20 Cb 0.00 -3.43 -0.03 0.00 0.80 0.00 0.00 33.01 30.35 2yql s GLN 20 CO 0.00 -0.02 -0.15 -0.51 -0.50 0.00 0.00 175.29 174.11 2yql s LEU 21 N 0.79 2.31 0.45 3.68 1.43 -1.26 -4.84 118.68 121.23 2yql s LEU 21 Ca 0.52 -0.67 -0.14 0.00 -1.03 0.00 0.00 54.13 52.81 2yql s LEU 21 Cb -0.23 -0.58 -0.07 0.00 0.03 0.00 0.00 46.19 45.34 2yql s LEU 21 CO 0.29 -0.07 0.87 -0.22 0.23 0.00 0.00 176.35 177.45 2yql s LEU 22 N -1.92 3.76 -0.01 1.79 2.96 -0.96 -4.91 118.68 119.39 2yql s LEU 22 Ca 0.02 1.36 0.08 0.00 -0.22 0.00 0.00 54.13 55.36 2yql s LEU 22 Cb -0.09 -4.26 -0.02 0.00 0.50 0.00 0.00 46.19 42.32 2yql s LEU 22 CO 0.03 -0.47 -0.25 -0.04 -1.32 0.00 0.00 176.35 174.30 2yql s MET 23 N -3.87 2.09 0.24 1.98 -1.94 -1.26 -2.62 119.30 113.93 2yql s MET 23 Ca 0.55 -0.94 -0.18 0.00 -1.71 0.00 0.00 55.69 53.41 2yql s MET 23 Cb -0.10 -2.07 -0.08 0.00 2.01 0.00 0.00 34.83 34.59 2yql s MET 23 CO 0.30 0.56 0.71 0.00 -0.01 0.00 0.00 175.02 176.57 2yql n ASP 25 N 0.52 7.12 0.09 0.00 -0.08 -1.25 -4.49 116.55 118.46 2yql n ASP 25 Ca -0.01 -3.46 0.00 0.00 -1.51 0.00 0.00 54.79 49.80 2yql n ASP 25 Cb 0.51 -1.04 0.00 0.00 2.34 0.00 0.00 41.12 42.94 2yql n ASP 25 CO 0.00 0.00 0.00 0.41 0.12 0.00 0.00 177.20 177.73 2yql n THR 26 N -0.25 0.00 -1.94 5.18 -1.04 -1.26 -5.06 114.28 109.91 2yql n THR 26 Ca 0.48 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.49 2yql n THR 26 Cb 0.59 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.10 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 4.42 -3.90 0.00 3.41 -1.26 -4.65 113.62 108.64 2yql n SER 28 Ca 0.00 -3.66 -0.13 0.00 -0.26 0.00 0.00 58.87 54.82 2yql n SER 28 Cb 0.00 -0.57 -0.14 0.00 -0.26 0.00 0.00 64.21 63.24 2yql n SER 28 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2yql s ARG 29 N -3.38 0.12 0.08 4.33 0.52 -1.26 -4.14 118.95 115.22 2yql s ARG 29 Ca 0.48 -0.09 0.04 0.00 -0.52 0.00 0.00 55.73 55.63 2yql s ARG 29 Cb 0.27 -0.09 -0.04 0.00 0.52 0.00 0.00 34.95 35.61 2yql s ARG 29 CO -0.13 0.02 0.05 0.14 0.02 0.00 0.00 175.30 175.40 2yql s VAL 30 N -0.15 4.34 -0.11 3.52 -7.23 -1.26 -3.61 120.40 115.90 2yql s VAL 30 Ca -0.01 -0.84 -0.07 0.00 -1.81 0.00 0.00 61.98 59.25 2yql s VAL 30 Cb -0.01 -3.08 0.04 0.00 0.56 0.00 0.00 36.38 33.89 2yql s VAL 30 CO -0.00 0.13 0.27 -0.31 -0.31 0.00 0.00 175.10 174.88 2yql s TYR 31 N -1.35 -0.34 1.37 2.82 2.02 -1.08 -2.95 117.35 117.85 2yql s TYR 31 Ca 0.28 0.80 -0.22 0.00 -0.37 0.00 0.00 57.07 57.56 2yql s TYR 31 Cb -0.12 0.09 0.34 0.00 -0.40 0.00 0.00 41.96 41.87 2yql s TYR 31 CO 0.20 -0.20 0.76 0.72 -1.57 0.00 0.00 175.55 175.47 2yql n HIS 32 N 3.64 -3.51 0.03 2.71 8.25 -1.26 -2.26 115.22 122.82 2yql n HIS 32 Ca -0.19 -0.63 0.01 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 30.31 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 0.79 -0.01 2.41 4.77 -1.26 -4.15 117.00 119.54 2yql n LEU 33 Ca 0.12 0.34 0.10 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 0.12 -0.74 0.47 -1.33 0.00 0.00 177.39 176.26 2yql n ASP 34 N -2.83 0.39 -3.45 -1.43 9.92 -1.26 -0.37 116.55 117.52 2yql n ASP 34 Ca -0.10 0.00 -0.40 0.00 -0.53 0.00 0.00 54.79 53.76 2yql n ASP 34 Cb 0.81 1.91 0.02 0.00 -0.64 0.00 0.00 41.12 43.22 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 0.17 0.00 -3.35 0.00 4.77 -1.26 -4.34 117.00 112.98 2yql n LEU 36 Ca 0.51 -2.79 -0.14 0.00 -0.03 0.00 0.00 56.01 53.56 2yql n LEU 36 Cb 0.26 0.38 -0.08 0.00 -2.33 0.00 0.00 43.42 41.66 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 -3.42 1.00 0.97 -1.43 2.15 -1.26 -2.89 116.67 111.78 2yql s ASP 37 Ca 0.02 -0.93 -0.12 0.00 0.43 0.00 0.00 52.55 51.95 2yql s ASP 37 Cb 0.00 0.76 0.17 0.00 -0.30 0.00 0.00 42.92 43.55 2yql s ASP 37 CO 0.01 -0.33 1.09 -2.16 -0.17 0.00 0.00 175.17 173.62 2yql s PRO 38 N 2.08 0.67 0.65 4.34 0.04 -1.26 -4.64 135.00 136.88 2yql s PRO 38 Ca 0.12 0.61 -0.15 0.00 0.04 0.00 0.00 61.00 61.62 2yql s PRO 38 Cb -0.13 -1.76 -0.01 0.00 0.04 0.00 0.00 34.50 32.64 2yql s PRO 38 CO -0.21 -2.59 1.11 -1.25 0.04 0.00 0.00 177.00 174.10 2yql s PRO 39 N -4.95 2.86 0.53 0.56 0.04 -1.14 -5.03 135.00 127.86 2yql s PRO 39 Ca 0.65 1.41 0.02 0.00 0.04 0.00 0.00 61.00 63.12 2yql s PRO 39 Cb -0.18 -1.96 0.00 0.00 0.04 0.00 0.00 34.50 32.40 2yql s PRO 39 CO 0.57 -1.21 0.10 -0.51 0.04 0.00 0.00 177.00 176.00 2yql s LEU 40 N -4.76 2.35 0.00 -3.56 1.43 0.50 -4.92 118.68 109.72 2yql s LEU 40 Ca 0.68 -1.58 0.00 0.00 -1.03 0.00 0.00 54.13 52.19 2yql s LEU 40 Cb -0.21 -0.82 0.00 0.00 0.03 0.00 0.00 46.19 45.19 2yql s LEU 40 CO 0.40 -0.95 0.00 1.17 0.23 0.00 0.00 176.35 177.20 2yql n LYS 41 N -1.41 0.00 -1.03 1.70 4.81 -1.23 -4.01 118.16 116.99 2yql n LYS 41 Ca -0.16 0.00 -0.04 0.00 -0.87 0.00 0.00 58.31 57.24 2yql n LYS 41 Cb 0.66 0.00 0.02 0.00 0.02 0.00 0.00 35.03 35.73 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 -2.44 0.00 -2.22 3.15 -2.24 -1.26 -4.91 114.28 104.36 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 -0.24 3.82 -1.14 2.28 1.09 -1.26 -4.91 121.20 120.85 2yql s ILE 43 Ca 0.12 0.91 -0.23 0.00 -1.10 0.00 0.00 60.65 60.35 2yql s ILE 43 Cb -0.01 -3.88 -0.08 0.00 -1.06 0.00 0.00 42.46 37.43 2yql s ILE 43 CO 0.08 -0.41 1.94 -2.16 -0.10 0.00 0.00 174.94 174.29 2yql s PRO 44 N 4.64 2.50 0.96 2.79 0.04 -1.26 -4.95 135.00 139.73 2yql s PRO 44 Ca 0.67 -1.01 -0.13 0.00 0.04 0.00 0.00 61.00 60.56 2yql s PRO 44 Cb -0.21 -5.21 0.03 0.00 0.04 0.00 0.00 34.50 29.15 2yql s PRO 44 CO 0.28 -3.88 0.34 1.63 0.04 0.00 0.00 177.00 175.41 2yql n LYS 45 N 8.38 -0.38 -0.24 4.56 5.02 -1.26 -4.60 118.16 129.65 2yql n LYS 45 Ca 0.44 -0.07 0.03 0.00 -2.02 0.00 0.00 58.31 56.69 2yql n LYS 45 Cb 0.47 -1.82 -0.02 0.00 -0.02 0.00 0.00 35.03 33.64 2yql n LYS 45 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2yql n GLY 46 N 1.60 -2.66 3.51 0.72 0.00 -1.26 -4.70 105.19 102.39 2yql n GLY 46 Ca 0.06 -1.39 -0.42 0.00 0.00 0.00 0.00 46.02 44.27 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 -2.45 0.80 -3.70 1.61 1.56 -1.26 -4.92 117.12 108.77 2yql n MET 47 Ca -0.01 0.10 -0.33 0.00 -0.27 0.00 0.00 57.70 57.19 2yql n MET 47 Cb 0.11 -2.64 -0.05 0.00 2.15 0.00 0.00 33.22 32.80 2yql n MET 47 CO 0.00 0.00 0.00 -0.46 -0.73 0.00 0.00 175.97 174.78 2yql s TRP 48 N 9.84 3.52 -0.03 1.12 -0.00 -1.26 -5.10 118.94 127.03 2yql s TRP 48 Ca 1.12 0.57 -0.01 0.00 -0.00 0.00 0.00 56.10 57.78 2yql s TRP 48 Cb -0.67 -2.01 0.03 0.00 -0.00 0.00 0.00 33.47 30.83 2yql s TRP 48 CO 0.39 0.50 0.05 0.42 -0.00 0.00 0.00 176.95 178.32 2yql s ILE 49 N -1.52 -0.08 0.73 5.86 1.01 -1.26 -3.84 121.20 122.10 2yql s ILE 49 Ca 0.36 0.28 -0.16 0.00 0.00 0.00 0.00 60.65 61.13 2yql s ILE 49 Cb -0.13 -0.12 -0.02 0.00 0.01 0.00 0.00 42.46 42.20 2yql s ILE 49 CO 0.22 0.11 0.67 0.00 0.00 0.00 0.00 174.94 175.94 2yql n PRO 51 N -1.12 0.04 0.15 0.00 -0.04 -1.26 -2.33 135.00 130.44 2yql n PRO 51 Ca 0.11 0.29 0.03 0.00 -0.04 0.00 0.00 63.50 63.89 2yql n PRO 51 Cb 0.50 -1.58 0.04 0.00 -0.04 0.00 0.00 33.50 32.42 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 2.47 -1.93 -3.16 114.38 112.30 2yql h ARG 52 Ca 0.00 0.00 -0.08 0.00 -1.26 0.00 0.00 59.98 58.64 2yql h ARG 52 Cb 0.27 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.58 2yql h ARG 52 CO 0.00 0.47 -0.53 0.00 0.56 0.00 0.00 179.97 180.47 2yql h GLN 54 N -1.00 0.03 -2.85 0.00 1.08 -1.69 -3.47 115.11 107.21 2yql h GLN 54 Ca -0.12 -0.00 0.32 0.00 -1.45 0.00 0.00 58.65 57.40 2yql h GLN 54 Cb 0.87 -0.01 -0.11 0.00 -0.05 0.00 0.00 27.48 28.18 2yql h GLN 54 CO -0.08 0.02 -0.67 -3.47 -0.95 0.00 0.00 178.83 173.68 2yql n ASP 55 N -4.32 -7.43 0.00 1.46 -0.08 -1.19 -5.13 116.55 99.86 2yql n ASP 55 Ca 0.16 0.76 0.00 0.00 -1.51 0.00 0.00 54.79 54.20 2yql n ASP 55 Cb 0.83 -3.93 0.00 0.00 2.34 0.00 0.00 41.12 40.37 2yql n ASP 55 CO 0.00 0.00 0.00 1.67 0.12 0.00 0.00 177.20 178.99