#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yql h SER 2 N 0.00 0.71 -2.71 1.61 0.02 -2.12 -3.45 113.55 107.61 2yql h SER 2 Ca 0.00 -0.52 -0.58 0.00 -0.84 0.00 0.00 61.79 59.85 2yql h SER 2 Cb 0.00 -0.20 -0.09 0.00 0.14 0.00 0.00 62.40 62.25 2yql h SER 2 CO 0.00 1.09 -0.61 -0.55 -1.14 0.00 0.00 176.83 175.62 2yql s SER 3 N -6.58 5.14 -0.34 3.07 0.15 -1.26 -5.05 113.70 108.84 2yql s SER 3 Ca -0.12 -0.28 0.03 0.00 0.70 0.00 0.00 55.95 56.28 2yql s SER 3 Cb 0.08 -1.22 0.19 0.00 -1.71 0.00 0.00 66.02 63.35 2yql s SER 3 CO 0.83 0.07 1.20 0.61 1.20 0.00 0.00 173.24 177.14 2yql n GLY 4 N -0.34 -0.66 3.58 9.45 0.00 -1.26 -5.07 105.19 110.89 2yql n GLY 4 Ca -0.09 0.23 -0.40 0.00 0.00 0.00 0.00 46.02 45.77 2yql n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2yql s SER 5 N -0.36 6.44 0.00 1.61 0.01 -1.26 -4.84 113.70 115.31 2yql s SER 5 Ca 0.11 -2.25 -0.00 0.00 1.31 0.00 0.00 55.95 55.12 2yql s SER 5 Cb 0.18 -2.58 0.00 0.00 0.21 0.00 0.00 66.02 63.83 2yql s SER 5 CO -0.08 -1.59 0.01 -0.24 0.41 0.00 0.00 173.24 171.75 2yql n SER 6 N 9.69 -0.02 -3.30 2.44 2.88 -1.26 -5.11 113.62 118.94 2yql n SER 6 Ca 0.48 -1.02 -0.25 0.00 -1.33 0.00 0.00 58.87 56.74 2yql n SER 6 Cb 0.46 0.04 -0.07 0.00 -0.75 0.00 0.00 64.21 63.89 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 -0.01 3.99 1.38 0.46 0.00 -1.26 -5.10 105.19 104.65 2yql n GLY 7 Ca -0.00 -2.24 0.19 0.00 0.00 0.00 0.00 46.02 43.97 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 1.03 -3.48 -0.41 1.61 -0.00 -1.26 -4.86 115.22 107.85 2yql n HIS 8 Ca 0.26 1.75 -0.16 0.00 -0.00 0.00 0.00 57.72 59.57 2yql n HIS 8 Cb 0.47 -3.16 0.15 0.00 -0.00 0.00 0.00 29.99 27.44 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 -4.12 -2.95 -0.95 -0.41 1.02 -1.26 -5.01 120.64 106.95 2yql n GLU 9 Ca 0.00 -0.84 -0.01 0.00 -0.02 0.00 0.00 57.16 56.30 2yql n GLU 9 Cb 0.63 -0.95 -0.01 0.00 -0.02 0.00 0.00 31.44 31.09 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 -4.29 0.05 -3.80 1.62 9.92 -1.26 -4.87 116.55 113.92 2yql n ASP 10 Ca 0.08 -1.81 -0.13 0.00 -0.53 0.00 0.00 54.79 52.40 2yql n ASP 10 Cb 0.32 -0.06 -0.11 0.00 -0.64 0.00 0.00 41.12 40.62 2yql n ASP 10 CO 0.00 0.00 0.00 -0.36 0.13 0.00 0.00 177.20 176.97 2yql s PHE 11 N 0.00 -0.22 0.25 1.24 0.08 -1.26 -4.81 117.98 113.26 2yql s PHE 11 Ca 0.11 0.53 -0.30 0.00 0.12 0.00 0.00 56.93 57.39 2yql s PHE 11 Cb 0.12 0.08 -0.14 0.00 -0.57 0.00 0.00 43.02 42.51 2yql s PHE 11 CO -0.05 -0.17 1.21 0.00 -0.10 0.00 0.00 175.22 176.11 2yql n SER 13 N 1.63 6.57 0.00 0.00 2.88 -1.20 -2.52 113.62 120.98 2yql n SER 13 Ca 0.11 -3.40 0.00 0.00 -1.33 0.00 0.00 58.87 54.25 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 -0.36 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 0.73 -0.14 -0.03 0.00 -0.91 0.00 0.00 33.84 33.49 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 -2.49 -3.98 0.00 1.74 -1.05 -5.00 116.66 104.02 2yql n ARG 16 Ca -0.03 2.16 -0.09 0.00 -0.77 0.00 0.00 57.85 59.12 2yql n ARG 16 Cb 0.33 -4.85 -0.10 0.00 -1.02 0.00 0.00 32.46 26.82 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 0.55 0.22 5.56 -0.14 -1.26 -4.89 119.74 117.93 2yql s LYS 17 Ca 0.10 -0.86 -0.18 0.00 -1.36 0.00 0.00 55.97 53.67 2yql s LYS 17 Cb -0.03 0.21 -0.08 0.00 -1.68 0.00 0.00 37.83 36.25 2yql s LYS 17 CO 0.65 -0.12 0.70 0.45 -0.76 0.00 0.00 175.35 176.27 2yql s SER 18 N -2.25 6.98 0.00 2.83 0.15 -1.26 -3.91 113.70 116.24 2yql s SER 18 Ca -0.03 1.35 0.00 0.00 0.70 0.00 0.00 55.95 57.96 2yql s SER 18 Cb -0.00 -2.39 0.00 0.00 -1.71 0.00 0.00 66.02 61.92 2yql s SER 18 CO -0.06 0.01 0.00 0.61 1.20 0.00 0.00 173.24 175.00 2yql n GLY 19 N 0.58 0.83 3.70 9.45 0.00 -1.26 -5.08 105.19 113.42 2yql n GLY 19 Ca -0.02 -1.77 -0.42 0.00 0.00 0.00 0.00 46.02 43.81 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 -2.00 4.48 0.11 1.61 -0.21 -1.26 -5.01 119.66 117.38 2yql s GLN 20 Ca 0.00 1.50 0.06 0.00 0.02 0.00 0.00 55.36 56.94 2yql s GLN 20 Cb 0.00 -3.47 -0.04 0.00 1.00 0.00 0.00 33.01 30.51 2yql s GLN 20 CO 0.00 -0.19 -0.14 -0.51 -2.12 0.00 0.00 175.29 172.33 2yql s LEU 21 N 1.38 2.38 0.39 2.90 1.43 -1.26 -4.84 118.68 121.05 2yql s LEU 21 Ca 0.53 -0.77 -0.11 0.00 -1.03 0.00 0.00 54.13 52.74 2yql s LEU 21 Cb -0.22 -0.55 -0.07 0.00 0.03 0.00 0.00 46.19 45.38 2yql s LEU 21 CO 0.25 -0.13 0.76 -0.22 0.23 0.00 0.00 176.35 177.24 2yql s LEU 22 N -2.30 3.88 -0.02 1.79 2.96 -0.96 -4.92 118.68 119.11 2yql s LEU 22 Ca 0.07 1.16 0.07 0.00 -0.22 0.00 0.00 54.13 55.21 2yql s LEU 22 Cb -0.06 -4.03 -0.02 0.00 0.50 0.00 0.00 46.19 42.59 2yql s LEU 22 CO 0.03 -0.36 -0.24 -0.04 -1.32 0.00 0.00 176.35 174.42 2yql s MET 23 N -3.67 2.03 0.31 1.98 -1.94 -1.26 -2.62 119.30 114.12 2yql s MET 23 Ca 0.52 -0.87 -0.22 0.00 -1.71 0.00 0.00 55.69 53.40 2yql s MET 23 Cb -0.10 -1.93 -0.09 0.00 2.01 0.00 0.00 34.83 34.71 2yql s MET 23 CO 0.28 0.51 0.85 0.00 -0.01 0.00 0.00 175.02 176.65 2yql n ASP 25 N 0.35 7.09 0.09 0.00 2.03 -1.25 -4.48 116.55 120.38 2yql n ASP 25 Ca 0.01 -3.42 0.00 0.00 0.52 0.00 0.00 54.79 51.90 2yql n ASP 25 Cb 0.51 -1.02 0.00 0.00 -0.72 0.00 0.00 41.12 39.89 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 -0.28 0.00 -2.05 5.18 -1.04 -1.26 -5.06 114.28 109.77 2yql n THR 26 Ca 0.46 0.00 -0.01 0.00 -2.04 0.00 0.00 64.05 62.47 2yql n THR 26 Cb 0.62 -0.01 0.00 0.00 -1.82 0.00 0.00 70.33 69.12 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 4.40 -3.92 0.00 7.64 -1.26 -4.63 113.62 112.85 2yql n SER 28 Ca 0.00 -3.60 -0.13 0.00 1.01 0.00 0.00 58.87 56.15 2yql n SER 28 Cb 0.01 -0.64 -0.14 0.00 -1.01 0.00 0.00 64.21 62.44 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 -3.16 0.22 0.07 1.43 0.52 -1.26 -4.34 118.95 112.42 2yql s ARG 29 Ca 0.45 -0.16 0.04 0.00 -0.52 0.00 0.00 55.73 55.54 2yql s ARG 29 Cb 0.23 -0.17 -0.04 0.00 0.52 0.00 0.00 34.95 35.49 2yql s ARG 29 CO -0.09 0.04 0.00 0.14 0.02 0.00 0.00 175.30 175.42 2yql s VAL 30 N -0.22 4.07 -0.13 3.52 -7.23 -1.26 -3.50 120.40 115.65 2yql s VAL 30 Ca -0.01 -0.88 -0.09 0.00 -1.81 0.00 0.00 61.98 59.19 2yql s VAL 30 Cb -0.02 -2.91 0.04 0.00 0.56 0.00 0.00 36.38 34.06 2yql s VAL 30 CO -0.00 0.19 0.34 -0.31 -0.31 0.00 0.00 175.10 175.00 2yql s TYR 31 N -1.25 -0.43 1.36 2.82 2.02 -1.08 -3.25 117.35 117.54 2yql s TYR 31 Ca 0.24 0.99 -0.22 0.00 -0.37 0.00 0.00 57.07 57.71 2yql s TYR 31 Cb -0.12 0.15 0.34 0.00 -0.40 0.00 0.00 41.96 41.93 2yql s TYR 31 CO 0.16 -0.24 0.76 0.72 -1.57 0.00 0.00 175.55 175.38 2yql n HIS 32 N 3.62 -3.50 0.03 2.71 8.25 -1.26 -2.25 115.22 122.82 2yql n HIS 32 Ca -0.19 -0.63 0.00 0.00 -0.26 0.00 0.00 57.72 56.64 2yql n HIS 32 Cb 0.56 -1.27 -0.09 0.00 1.12 0.00 0.00 29.99 30.32 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 0.80 -0.01 2.41 4.77 -1.26 -4.16 117.00 119.55 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 0.08 -0.16 0.00 -2.33 0.00 0.00 43.42 41.54 2yql n LEU 33 CO 0.35 0.14 -0.76 0.47 -1.33 0.00 0.00 177.39 176.26 2yql n ASP 34 N -2.85 0.29 -3.43 -1.43 9.92 -1.26 -0.35 116.55 117.44 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 0.83 1.91 0.01 0.00 -0.64 0.00 0.00 41.12 43.24 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 0.23 0.00 -3.35 0.00 4.77 -1.26 -4.34 117.00 113.04 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 0.27 0.37 -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 -3.43 1.04 0.97 -1.43 -1.08 -1.26 -2.89 116.67 108.59 2yql s ASP 37 Ca 0.02 -0.95 -0.12 0.00 -0.52 0.00 0.00 52.55 50.98 2yql s ASP 37 Cb 0.00 0.74 0.17 0.00 -1.46 0.00 0.00 42.92 42.37 2yql s ASP 37 CO 0.01 -0.33 1.09 -2.16 0.52 0.00 0.00 175.17 174.31 2yql s PRO 38 N 2.07 0.66 0.67 4.34 0.04 -1.26 -4.65 135.00 136.88 2yql s PRO 38 Ca 0.12 0.61 -0.15 0.00 0.04 0.00 0.00 61.00 61.63 2yql s PRO 38 Cb -0.14 -1.76 0.00 0.00 0.04 0.00 0.00 34.50 32.65 2yql s PRO 38 CO -0.21 -2.59 1.11 -1.25 0.04 0.00 0.00 177.00 174.09 2yql s PRO 39 N -4.95 2.75 0.52 0.56 0.04 -1.14 -5.03 135.00 127.75 2yql s PRO 39 Ca 0.65 1.37 0.01 0.00 0.04 0.00 0.00 61.00 63.07 2yql s PRO 39 Cb -0.18 -1.95 -0.00 0.00 0.04 0.00 0.00 34.50 32.41 2yql s PRO 39 CO 0.57 -1.28 0.02 -0.51 0.04 0.00 0.00 177.00 175.84 2yql s LEU 40 N -4.96 2.26 0.00 -3.56 1.43 0.52 -4.92 118.68 109.46 2yql s LEU 40 Ca 0.66 -1.66 0.00 0.00 -1.03 0.00 0.00 54.13 52.10 2yql s LEU 40 Cb -0.20 -0.74 0.00 0.00 0.03 0.00 0.00 46.19 45.28 2yql s LEU 40 CO 0.43 -0.90 0.00 1.17 0.23 0.00 0.00 176.35 177.28 2yql n LYS 41 N -1.31 0.00 -1.04 1.70 4.81 -1.23 -3.98 118.16 117.11 2yql n LYS 41 Ca -0.20 0.00 -0.04 0.00 -0.87 0.00 0.00 58.31 57.20 2yql n LYS 41 Cb 0.67 0.00 0.02 0.00 0.02 0.00 0.00 35.03 35.74 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 -2.09 0.00 -2.21 3.15 -2.24 -1.26 -4.90 114.28 104.74 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 -0.96 2.28 1.09 -1.26 -4.92 121.20 121.00 2yql s ILE 43 Ca 0.12 0.90 -0.24 0.00 -1.10 0.00 0.00 60.65 60.33 2yql s ILE 43 Cb -0.01 -3.88 -0.06 0.00 -1.06 0.00 0.00 42.46 37.46 2yql s ILE 43 CO 0.08 -0.41 1.94 -2.16 -0.10 0.00 0.00 174.94 174.30 2yql s PRO 44 N 4.66 2.54 0.88 2.79 0.04 -1.26 -4.96 135.00 139.69 2yql s PRO 44 Ca 0.67 -0.47 -0.14 0.00 0.04 0.00 0.00 61.00 61.10 2yql s PRO 44 Cb -0.21 -5.10 0.01 0.00 0.04 0.00 0.00 34.50 29.24 2yql s PRO 44 CO 0.28 -3.50 0.45 1.63 0.04 0.00 0.00 177.00 175.90 2yql n LYS 45 N 8.74 -0.09 -0.16 4.56 4.01 -1.26 -4.59 118.16 129.37 2yql n LYS 45 Ca 0.41 0.02 0.02 0.00 -0.51 0.00 0.00 58.31 58.25 2yql n LYS 45 Cb 0.47 -1.85 -0.01 0.00 -0.51 0.00 0.00 35.03 33.13 2yql n LYS 45 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2yql n GLY 46 N 1.55 -2.67 3.51 0.72 0.00 -1.26 -4.72 105.19 102.32 2yql n GLY 46 Ca 0.08 -1.41 -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 -2.28 0.81 -3.54 1.61 0.00 -1.26 -4.91 117.12 107.55 2yql n MET 47 Ca -0.01 0.10 -0.34 0.00 -0.00 0.00 0.00 57.70 57.45 2yql n MET 47 Cb 0.07 -2.63 -0.05 0.00 0.00 0.00 0.00 33.22 30.61 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 9.76 3.57 -0.03 1.12 -0.00 -1.26 -5.09 118.94 127.01 2yql s TRP 48 Ca 1.12 0.82 -0.00 0.00 -0.00 0.00 0.00 56.10 58.03 2yql s TRP 48 Cb -0.67 -2.19 0.03 0.00 -0.00 0.00 0.00 33.47 30.64 2yql s TRP 48 CO 0.39 0.48 0.03 0.42 -0.00 0.00 0.00 176.95 178.28 2yql s ILE 49 N -1.46 -0.05 0.73 5.86 1.01 -1.26 -3.78 121.20 122.25 2yql s ILE 49 Ca 0.35 0.25 -0.16 0.00 0.00 0.00 0.00 60.65 61.10 2yql s ILE 49 Cb -0.14 -0.11 -0.03 0.00 0.01 0.00 0.00 42.46 42.19 2yql s ILE 49 CO 0.19 0.12 0.59 0.00 0.00 0.00 0.00 174.94 175.83 2yql n PRO 51 N -0.91 0.10 0.16 0.00 -0.04 -1.26 -2.35 135.00 130.70 2yql n PRO 51 Ca 0.10 0.35 0.04 0.00 -0.04 0.00 0.00 63.50 63.95 2yql n PRO 51 Cb 0.50 -1.70 0.12 0.00 -0.04 0.00 0.00 33.50 32.38 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 -3.09 114.38 112.37 2yql h ARG 52 Ca 0.00 0.00 -0.07 0.00 -1.26 0.00 0.00 59.98 58.65 2yql h ARG 52 Cb 0.31 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.62 2yql h ARG 52 CO 0.00 0.42 -0.47 0.00 0.56 0.00 0.00 179.97 180.48 2yql h GLN 54 N -1.00 0.04 0.00 0.00 1.08 -1.68 -2.86 115.11 110.70 2yql h GLN 54 Ca -0.10 -0.00 -0.11 0.00 -1.45 0.00 0.00 58.65 56.99 2yql h GLN 54 Cb 0.75 -0.01 -0.02 0.00 -0.05 0.00 0.00 27.48 28.15 2yql h GLN 54 CO -0.06 0.03 -0.99 -3.47 -0.95 0.00 0.00 178.83 173.39 2yql n ASP 55 N -4.32 1.86 0.00 1.46 2.03 -1.17 -5.13 116.55 111.28 2yql n ASP 55 Ca 0.16 0.50 0.00 0.00 0.52 0.00 0.00 54.79 55.98 2yql n ASP 55 Cb 0.85 -0.87 0.00 0.00 -0.72 0.00 0.00 41.12 40.38 2yql n ASP 55 CO 0.00 0.00 0.00 1.67 -1.92 0.00 0.00 177.20 176.95