#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yql n SER 2 N 0.00 5.02 -4.56 1.61 7.64 -1.26 -5.00 113.62 117.07 2yql n SER 2 Ca 0.00 -3.35 -0.31 0.00 1.01 0.00 0.00 58.87 56.22 2yql n SER 2 Cb 0.00 -1.02 -0.05 0.00 -1.01 0.00 0.00 64.21 62.13 2yql n SER 2 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2yql s SER 3 N -1.57 5.50 0.00 6.43 0.01 -1.26 -4.33 113.70 118.49 2yql s SER 3 Ca 0.33 -1.02 0.00 0.00 1.31 0.00 0.00 55.95 56.58 2yql s SER 3 Cb 0.05 -2.57 0.00 0.00 0.21 0.00 0.00 66.02 63.72 2yql s SER 3 CO 0.01 -2.44 0.00 0.61 0.41 0.00 0.00 173.24 171.83 2yql n GLY 4 N 6.70 -0.01 0.15 3.44 0.00 -1.26 -4.99 105.19 109.22 2yql n GLY 4 Ca 0.39 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.41 2yql n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2yql n SER 5 N -2.26 3.36 -3.82 1.61 7.64 -1.26 -5.04 113.62 113.84 2yql n SER 5 Ca 0.00 0.00 -0.25 0.00 1.01 0.00 0.00 58.87 59.63 2yql n SER 5 Cb 0.00 0.00 0.02 0.00 -1.01 0.00 0.00 64.21 63.22 2yql n SER 5 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2yql n SER 6 N -2.56 -1.76 -2.69 6.43 7.64 -1.26 -4.89 113.62 114.53 2yql n SER 6 Ca 0.00 -0.86 -0.06 0.00 1.01 0.00 0.00 58.87 58.96 2yql n SER 6 Cb 0.49 -3.75 0.08 0.00 -1.01 0.00 0.00 64.21 60.03 2yql n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2yql n GLY 7 N -1.68 0.47 6.64 0.23 0.00 -1.26 -5.15 105.19 104.44 2yql n GLY 7 Ca -0.22 0.01 0.01 0.00 0.00 0.00 0.00 46.02 45.82 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 -0.31 -1.84 -0.66 1.61 -0.00 -1.26 -4.76 115.22 107.99 2yql n HIS 8 Ca -0.07 0.08 -0.29 0.00 -0.00 0.00 0.00 57.72 57.44 2yql n HIS 8 Cb 0.77 0.06 0.23 0.00 -0.00 0.00 0.00 29.99 31.04 2yql n HIS 8 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 176.34 175.13 2yql s GLU 9 N -0.12 -0.43 -0.09 -0.41 2.02 -1.26 -4.99 118.70 113.42 2yql s GLU 9 Ca 0.00 0.91 0.23 0.00 0.02 0.00 0.00 54.97 56.13 2yql s GLU 9 Cb 0.00 -1.60 0.44 0.00 0.10 0.00 0.00 34.13 33.07 2yql s GLU 9 CO 0.00 -3.42 1.17 -0.25 0.02 0.00 0.00 175.26 172.78 2yql n ASP 10 N -4.71 1.34 -3.80 -0.19 8.00 -1.26 -4.77 116.55 111.16 2yql n ASP 10 Ca 0.05 -2.31 -0.13 0.00 0.71 0.00 0.00 54.79 53.12 2yql n ASP 10 Cb 0.54 -0.36 -0.12 0.00 -0.02 0.00 0.00 41.12 41.16 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 -1.25 -0.23 0.26 1.24 0.08 -1.26 -4.88 117.98 111.94 2yql s PHE 11 Ca 0.34 0.56 -0.30 0.00 0.12 0.00 0.00 56.93 57.65 2yql s PHE 11 Cb 0.38 0.08 -0.14 0.00 -0.57 0.00 0.00 43.02 42.76 2yql s PHE 11 CO -0.13 -0.13 1.19 0.00 -0.10 0.00 0.00 175.22 176.06 2yql n SER 13 N 1.53 6.62 0.00 0.00 7.64 -1.16 -2.53 113.62 125.73 2yql n SER 13 Ca 0.10 -3.40 0.00 0.00 1.01 0.00 0.00 58.87 56.58 2yql n SER 13 Cb 0.31 -0.98 0.00 0.00 -1.01 0.00 0.00 64.21 62.53 2yql n SER 13 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 2yql n VAL 14 N -0.36 0.00 -0.01 0.44 0.31 -1.26 -4.95 118.33 112.50 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 33.47 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 -1.85 -2.13 -3.94 0.00 5.12 -1.05 -5.00 116.66 107.81 2yql n ARG 16 Ca -0.03 1.95 -0.10 0.00 -1.93 0.00 0.00 57.85 57.74 2yql n ARG 16 Cb 0.32 -5.18 -0.10 0.00 -1.16 0.00 0.00 32.46 26.34 2yql n ARG 16 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 2yql s LYS 17 N -2.39 0.42 1.18 5.56 1.02 -1.26 -4.89 119.74 119.37 2yql s LYS 17 Ca 0.21 -0.58 -0.18 0.00 0.02 0.00 0.00 55.97 55.45 2yql s LYS 17 Cb -0.06 0.16 0.27 0.00 -0.52 0.00 0.00 37.83 37.68 2yql s LYS 17 CO 0.68 -0.09 1.09 -1.54 -0.92 0.00 0.00 175.35 174.57 2yql s SER 18 N -1.57 1.13 0.00 2.83 1.04 -1.26 -3.99 113.70 111.88 2yql s SER 18 Ca -0.13 0.79 0.00 0.00 0.48 0.00 0.00 55.95 57.08 2yql s SER 18 Cb -0.07 -1.15 0.00 0.00 0.10 0.00 0.00 66.02 64.90 2yql s SER 18 CO -0.01 -4.01 0.00 0.61 0.98 0.00 0.00 173.24 170.81 2yql n GLY 19 N -0.77 -0.45 3.74 7.32 0.00 -1.26 -5.00 105.19 108.76 2yql n GLY 19 Ca 0.11 -2.20 -0.40 0.00 0.00 0.00 0.00 46.02 43.53 2yql n GLY 19 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2yql s GLN 20 N 0.00 4.62 0.11 1.61 -2.07 -1.26 -5.02 119.66 117.65 2yql s GLN 20 Ca 0.00 1.28 0.06 0.00 -1.82 0.00 0.00 55.36 54.88 2yql s GLN 20 Cb 0.00 -3.36 -0.03 0.00 -1.09 0.00 0.00 33.01 28.53 2yql s GLN 20 CO 0.00 0.28 -0.14 -0.51 -1.32 0.00 0.00 175.29 173.60 2yql s LEU 21 N -0.16 2.36 0.45 2.60 1.43 -1.26 -4.85 118.68 119.24 2yql s LEU 21 Ca 0.43 -0.75 -0.14 0.00 -1.03 0.00 0.00 54.13 52.64 2yql s LEU 21 Cb -0.22 -0.55 -0.07 0.00 0.03 0.00 0.00 46.19 45.37 2yql s LEU 21 CO 0.27 -0.12 0.87 -0.22 0.23 0.00 0.00 176.35 177.38 2yql s LEU 22 N -2.22 3.77 -0.03 1.79 2.96 -1.02 -4.92 118.68 119.00 2yql s LEU 22 Ca 0.06 1.35 0.07 0.00 -0.22 0.00 0.00 54.13 55.39 2yql s LEU 22 Cb -0.07 -4.25 -0.02 0.00 0.50 0.00 0.00 46.19 42.35 2yql s LEU 22 CO 0.03 -0.46 -0.22 -0.04 -1.32 0.00 0.00 176.35 174.33 2yql s MET 23 N -3.84 2.22 0.21 1.98 -1.94 -1.26 -2.93 119.30 113.73 2yql s MET 23 Ca 0.55 -0.86 -0.17 0.00 -1.71 0.00 0.00 55.69 53.49 2yql s MET 23 Cb -0.10 -2.15 -0.08 0.00 2.01 0.00 0.00 34.83 34.51 2yql s MET 23 CO 0.29 0.58 0.67 0.00 -0.01 0.00 0.00 175.02 176.55 2yql n ASP 25 N 0.61 7.15 0.08 0.00 2.03 -1.25 -4.49 116.55 120.69 2yql n ASP 25 Ca -0.02 -3.49 0.00 0.00 0.52 0.00 0.00 54.79 51.79 2yql n ASP 25 Cb 0.51 -1.05 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 -0.25 0.00 -2.29 5.18 -1.04 -1.26 -5.05 114.28 109.57 2yql n THR 26 Ca 0.49 0.00 -0.01 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 4.71 -3.93 0.00 7.64 -1.26 -4.62 113.62 113.16 2yql n SER 28 Ca 0.01 -3.69 -0.19 0.00 1.01 0.00 0.00 58.87 56.00 2yql n SER 28 Cb 0.02 -0.59 -0.16 0.00 -1.01 0.00 0.00 64.21 62.47 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 -3.54 0.79 0.00 1.43 1.81 -1.26 -4.34 118.95 113.85 2yql s ARG 29 Ca 0.48 -0.17 -0.02 0.00 -1.72 0.00 0.00 55.73 54.31 2yql s ARG 29 Cb 0.29 -0.78 -0.04 0.00 -0.45 0.00 0.00 34.95 33.97 2yql s ARG 29 CO -0.15 0.00 0.16 0.14 -0.68 0.00 0.00 175.30 174.77 2yql s VAL 30 N 0.56 5.22 -0.09 3.52 -7.23 -1.26 -3.85 120.40 117.26 2yql s VAL 30 Ca -0.08 -0.27 -0.06 0.00 -1.81 0.00 0.00 61.98 59.76 2yql s VAL 30 Cb -0.11 -3.44 0.03 0.00 0.56 0.00 0.00 36.38 33.42 2yql s VAL 30 CO 0.00 0.30 0.21 -0.31 -0.31 0.00 0.00 175.10 175.00 2yql s TYR 31 N -1.32 -0.26 1.36 2.82 2.02 -1.15 -2.97 117.35 117.85 2yql s TYR 31 Ca 0.27 0.64 -0.22 0.00 -0.37 0.00 0.00 57.07 57.39 2yql s TYR 31 Cb -0.12 0.04 0.34 0.00 -0.40 0.00 0.00 41.96 41.82 2yql s TYR 31 CO 0.19 -0.17 0.76 0.72 -1.57 0.00 0.00 175.55 175.48 2yql n HIS 32 N 3.62 -3.49 0.03 2.71 8.25 -1.26 -2.43 115.22 122.65 2yql n HIS 32 Ca -0.19 -0.63 0.01 0.00 -0.26 0.00 0.00 57.72 56.65 2yql n HIS 32 Cb 0.55 -1.27 -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 0.81 -0.01 2.41 4.77 -1.26 -4.15 117.00 119.57 2yql n LEU 33 Ca 0.12 0.35 0.10 0.00 -0.03 0.00 0.00 56.01 56.55 2yql n LEU 33 Cb 0.53 0.07 -0.15 0.00 -2.33 0.00 0.00 43.42 41.53 2yql n LEU 33 CO 0.34 0.12 -0.74 0.47 -1.33 0.00 0.00 177.39 176.25 2yql n ASP 34 N -2.85 0.46 -3.43 -1.43 8.00 -1.26 -0.36 116.55 115.68 2yql n ASP 34 Ca -0.09 0.00 -0.40 0.00 0.71 0.00 0.00 54.79 55.01 2yql n ASP 34 Cb 0.81 1.89 0.01 0.00 -0.02 0.00 0.00 41.12 43.82 2yql n ASP 34 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2yql n LEU 36 N 0.23 0.00 -3.35 0.00 4.77 -1.26 -4.34 117.00 113.05 2yql n LEU 36 Ca 0.51 -2.80 -0.14 0.00 -0.03 0.00 0.00 56.01 53.55 2yql n LEU 36 Cb 0.27 0.39 -0.07 0.00 -2.33 0.00 0.00 43.42 41.67 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 -3.43 0.99 0.97 -1.43 -1.08 -1.26 -2.90 116.67 108.52 2yql s ASP 37 Ca 0.02 -0.92 -0.12 0.00 -0.52 0.00 0.00 52.55 51.01 2yql s ASP 37 Cb 0.00 0.76 0.17 0.00 -1.46 0.00 0.00 42.92 42.40 2yql s ASP 37 CO 0.02 -0.33 1.09 -2.16 0.52 0.00 0.00 175.17 174.31 2yql s PRO 38 N 2.09 0.67 0.65 4.34 0.04 -1.26 -4.65 135.00 136.88 2yql s PRO 38 Ca 0.12 0.62 -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 2.85 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 0.01 0.00 0.04 0.00 0.00 34.50 32.41 2yql s PRO 39 CO 0.57 -1.21 0.10 -0.51 0.04 0.00 0.00 177.00 175.99 2yql s LEU 40 N -4.76 2.34 0.00 -3.56 1.43 0.51 -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 -1.04 1.70 4.81 -1.23 -4.02 118.16 116.97 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 -2.34 0.00 -2.22 3.15 -2.24 -1.26 -4.91 114.28 104.46 2yql n THR 42 Ca 0.00 -0.30 -0.43 0.00 -2.27 0.00 0.00 64.05 61.05 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 -0.25 3.82 -1.04 2.28 1.09 -1.26 -4.92 121.20 120.92 2yql s ILE 43 Ca 0.12 0.91 -0.24 0.00 -1.10 0.00 0.00 60.65 60.35 2yql s ILE 43 Cb -0.01 -3.88 -0.07 0.00 -1.06 0.00 0.00 42.46 37.44 2yql s ILE 43 CO 0.08 -0.40 1.94 -2.16 -0.10 0.00 0.00 174.94 174.30 2yql s PRO 44 N 4.64 2.53 1.02 2.79 0.04 -1.26 -4.95 135.00 139.80 2yql s PRO 44 Ca 0.67 -0.71 -0.15 0.00 0.04 0.00 0.00 61.00 60.84 2yql s PRO 44 Cb -0.21 -5.15 0.06 0.00 0.04 0.00 0.00 34.50 29.24 2yql s PRO 44 CO 0.28 -3.67 0.20 1.17 0.04 0.00 0.00 177.00 175.02 2yql n LYS 45 N 8.58 -0.82 -0.59 4.56 4.81 -1.26 -4.58 118.16 128.86 2yql n LYS 45 Ca 0.42 -0.21 0.07 0.00 -0.87 0.00 0.00 58.31 57.73 2yql n LYS 45 Cb 0.47 -1.77 -0.04 0.00 0.02 0.00 0.00 35.03 33.71 2yql n LYS 45 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2yql n GLY 46 N 1.77 -2.85 3.51 3.14 0.00 -1.26 -4.65 105.19 104.84 2yql n GLY 46 Ca 0.04 -1.29 -0.42 0.00 0.00 0.00 0.00 46.02 44.35 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 -2.99 0.81 -3.61 1.61 1.56 -1.26 -4.92 117.12 108.33 2yql n MET 47 Ca -0.04 0.10 -0.33 0.00 -0.27 0.00 0.00 57.70 57.16 2yql n MET 47 Cb 0.28 -2.65 -0.05 0.00 2.15 0.00 0.00 33.22 32.95 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 9.85 3.52 -0.03 1.12 -0.00 -1.26 -5.10 118.94 127.05 2yql s TRP 48 Ca 1.11 0.69 -0.01 0.00 -0.00 0.00 0.00 56.10 57.90 2yql s TRP 48 Cb -0.66 -2.09 0.03 0.00 -0.00 0.00 0.00 33.47 30.75 2yql s TRP 48 CO 0.39 0.46 0.05 0.42 -0.00 0.00 0.00 176.95 178.27 2yql s ILE 49 N -1.54 -0.08 0.73 5.86 1.01 -1.26 -3.82 121.20 122.10 2yql s ILE 49 Ca 0.37 0.27 -0.16 0.00 0.00 0.00 0.00 60.65 61.13 2yql s ILE 49 Cb -0.13 -0.11 -0.02 0.00 0.01 0.00 0.00 42.46 42.21 2yql s ILE 49 CO 0.21 0.11 0.66 0.00 0.00 0.00 0.00 174.94 175.92 2yql n PRO 51 N -1.10 0.06 0.15 0.00 -0.04 -1.26 -2.33 135.00 130.48 2yql n PRO 51 Ca 0.11 0.31 0.04 0.00 -0.04 0.00 0.00 63.50 63.92 2yql n PRO 51 Cb 0.50 -1.62 0.07 0.00 -0.04 0.00 0.00 33.50 32.41 2yql n PRO 51 CO 0.00 0.00 0.00 -0.09 -0.04 0.00 0.00 175.50 175.37 2yql h ARG 52 N 0.00 0.00 0.00 0.54 1.12 -1.93 -3.14 114.38 110.97 2yql h ARG 52 Ca 0.00 0.00 -0.09 0.00 -1.11 0.00 0.00 59.98 58.78 2yql h ARG 52 Cb 0.28 0.00 -0.01 0.00 -0.01 0.00 0.00 29.97 30.23 2yql h ARG 52 CO 0.00 0.45 -0.55 0.00 -3.11 0.00 0.00 179.97 176.76 2yql h GLN 54 N -1.00 0.04 0.09 0.00 1.08 -1.68 -2.78 115.11 110.86 2yql h GLN 54 Ca -0.13 -0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.06 2yql h GLN 54 Cb 0.88 -0.01 0.00 0.00 -0.05 0.00 0.00 27.48 28.30 2yql h GLN 54 CO -0.08 0.03 -0.04 0.22 -0.95 0.00 0.00 178.83 178.01 2yql h ASP 55 N 0.04 -0.10 0.00 1.46 3.58 -1.68 -3.52 116.42 116.20 2yql h ASP 55 Ca 0.39 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.84 2yql h ASP 55 Cb 1.48 0.03 0.00 0.00 1.72 0.00 0.00 39.33 42.56 2yql h ASP 55 CO -0.02 0.05 0.00 1.67 -2.88 0.00 0.00 179.24 178.06