#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 6.44 -0.25 1.61 0.15 -1.26 -5.10 113.70 115.29 2yql s SER 2 Ca 0.00 0.55 -0.14 0.00 0.70 0.00 0.00 55.95 57.06 2yql s SER 2 Cb 0.00 -2.07 0.08 0.00 -1.71 0.00 0.00 66.02 62.32 2yql s SER 2 CO 0.00 -0.05 0.61 -0.94 1.20 0.00 0.00 173.24 174.06 2yql s SER 3 N -2.92 -0.84 0.13 5.45 1.04 -1.26 -5.17 113.70 110.13 2yql s SER 3 Ca 0.41 1.36 0.06 0.00 0.48 0.00 0.00 55.95 58.25 2yql s SER 3 Cb -0.11 1.29 -0.04 0.00 0.10 0.00 0.00 66.02 67.25 2yql s SER 3 CO 0.28 -0.23 -0.13 -0.83 0.98 0.00 0.00 173.24 173.30 2yql s GLY 4 N 1.67 1.10 -0.08 7.32 0.00 -1.26 -5.15 107.32 110.92 2yql s GLY 4 Ca -0.10 -1.35 0.03 0.00 0.00 0.00 0.00 44.72 43.30 2yql s GLY 4 CO -0.18 -1.41 -0.15 -0.56 0.00 0.00 0.00 173.10 170.79 2yql s SER 5 N -2.62 2.18 0.35 1.64 0.01 -1.26 -5.07 113.70 108.92 2yql s SER 5 Ca 0.11 -0.38 0.00 0.00 1.31 0.00 0.00 55.95 56.99 2yql s SER 5 Cb -0.04 -1.00 0.00 0.00 0.21 0.00 0.00 66.02 65.19 2yql s SER 5 CO 0.03 0.06 0.00 -1.54 0.41 0.00 0.00 173.24 172.20 2yql n SER 6 N 3.78 -7.41 0.00 2.44 3.41 -1.26 -5.01 113.62 109.58 2yql n SER 6 Ca -0.21 0.67 0.00 0.00 -0.26 0.00 0.00 58.87 59.06 2yql n SER 6 Cb 0.52 -3.87 0.00 0.00 -0.26 0.00 0.00 64.21 60.60 2yql n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2yql n GLY 7 N -3.90 3.21 1.35 5.00 0.00 -1.26 -5.11 105.19 104.48 2yql n GLY 7 Ca -0.01 -0.48 0.18 0.00 0.00 0.00 0.00 46.02 45.71 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 0.00 -3.39 -2.25 1.61 -0.00 -1.26 -4.90 115.22 105.03 2yql n HIS 8 Ca 0.00 1.70 -0.19 0.00 -0.00 0.00 0.00 57.72 59.23 2yql n HIS 8 Cb 0.00 -3.08 0.11 0.00 -0.00 0.00 0.00 29.99 27.02 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 -4.01 -0.28 -1.01 -0.41 -0.58 -1.26 -5.05 120.64 108.05 2yql n GLU 9 Ca 0.00 -1.88 0.01 0.00 -0.42 0.00 0.00 57.16 54.87 2yql n GLU 9 Cb 0.66 -0.68 -0.00 0.00 -0.57 0.00 0.00 31.44 30.85 2yql n GLU 9 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 2yql n ASP 10 N -3.17 0.31 -3.79 1.62 8.00 -1.26 -4.84 116.55 113.42 2yql n ASP 10 Ca 0.12 -1.90 -0.13 0.00 0.71 0.00 0.00 54.79 53.60 2yql n ASP 10 Cb 0.44 -0.16 -0.12 0.00 -0.02 0.00 0.00 41.12 41.27 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 -0.26 0.28 1.24 0.08 -1.26 -4.88 117.98 113.18 2yql s PHE 11 Ca 0.15 0.62 -0.29 0.00 0.12 0.00 0.00 56.93 57.53 2yql s PHE 11 Cb 0.17 0.08 -0.14 0.00 -0.57 0.00 0.00 43.02 42.57 2yql s PHE 11 CO -0.08 -0.13 1.17 0.00 -0.10 0.00 0.00 175.22 176.08 2yql n SER 13 N 1.40 6.51 0.00 0.00 2.88 -1.13 -2.50 113.62 120.77 2yql n SER 13 Ca 0.10 -3.40 0.00 0.00 -1.33 0.00 0.00 58.87 54.23 2yql n SER 13 Cb 0.32 -0.97 0.00 0.00 -0.75 0.00 0.00 64.21 62.80 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 -0.38 0.00 -0.01 2.46 0.31 -1.26 -4.95 118.33 114.50 2yql n VAL 14 Ca 0.47 0.00 0.01 0.00 -0.01 0.00 0.00 64.34 64.80 2yql n VAL 14 Cb 0.75 -0.13 -0.03 0.00 -0.91 0.00 0.00 33.84 33.51 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 -2.42 -4.23 0.00 1.74 -1.04 -5.00 116.66 103.85 2yql n ARG 16 Ca -0.03 2.12 -0.18 0.00 -0.77 0.00 0.00 57.85 58.98 2yql n ARG 16 Cb 0.32 -4.85 -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 -1.90 1.81 0.54 5.56 -0.14 -1.26 -4.88 119.74 119.45 2yql s LYS 17 Ca 0.11 -1.96 0.08 0.00 -1.36 0.00 0.00 55.97 52.85 2yql s LYS 17 Cb -0.03 0.36 0.06 0.00 -1.68 0.00 0.00 37.83 36.53 2yql s LYS 17 CO 0.65 -0.69 0.65 -1.54 -0.76 0.00 0.00 175.35 173.66 2yql s SER 18 N -3.34 5.08 0.00 2.83 1.04 -1.26 -3.86 113.70 114.19 2yql s SER 18 Ca 0.38 -0.86 0.00 0.00 0.48 0.00 0.00 55.95 55.95 2yql s SER 18 Cb 0.02 0.13 0.00 0.00 0.10 0.00 0.00 66.02 66.26 2yql s SER 18 CO 0.26 -1.16 0.00 0.61 0.98 0.00 0.00 173.24 173.93 2yql n GLY 19 N -2.04 0.26 3.75 7.32 0.00 -1.26 -4.99 105.19 108.23 2yql n GLY 19 Ca 0.10 -1.90 -0.37 0.00 0.00 0.00 0.00 46.02 43.85 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 4.19 0.05 1.61 -0.21 -1.26 -5.07 119.66 118.96 2yql s GLN 20 Ca 0.00 0.29 0.05 0.00 0.02 0.00 0.00 55.36 55.72 2yql s GLN 20 Cb 0.00 -3.38 -0.02 0.00 1.00 0.00 0.00 33.01 30.61 2yql s GLN 20 CO 0.00 0.33 -0.15 -0.51 -2.12 0.00 0.00 175.29 172.84 2yql s LEU 21 N 0.13 2.21 0.51 2.90 1.43 -1.26 -4.84 118.68 119.75 2yql s LEU 21 Ca 0.22 -0.53 -0.17 0.00 -1.03 0.00 0.00 54.13 52.62 2yql s LEU 21 Cb -0.15 -0.62 -0.08 0.00 0.03 0.00 0.00 46.19 45.38 2yql s LEU 21 CO 0.08 0.01 0.99 -0.22 0.23 0.00 0.00 176.35 177.44 2yql s LEU 22 N -1.38 3.67 -0.06 1.79 2.96 -1.05 -4.92 118.68 119.69 2yql s LEU 22 Ca 0.01 1.65 0.06 0.00 -0.22 0.00 0.00 54.13 55.63 2yql s LEU 22 Cb -0.09 -4.52 -0.01 0.00 0.50 0.00 0.00 46.19 42.07 2yql s LEU 22 CO 0.02 -0.64 -0.24 -0.04 -1.32 0.00 0.00 176.35 174.12 2yql s MET 23 N -3.87 2.56 0.32 1.98 -1.94 -1.26 -3.02 119.30 114.07 2yql s MET 23 Ca 0.61 -0.89 -0.24 0.00 -1.71 0.00 0.00 55.69 53.45 2yql s MET 23 Cb -0.11 -2.18 -0.10 0.00 2.01 0.00 0.00 34.83 34.45 2yql s MET 23 CO 0.28 0.39 0.90 0.00 -0.01 0.00 0.00 175.02 176.58 2yql n ASP 25 N 0.42 7.16 0.10 0.00 -0.08 -1.25 -4.48 116.55 118.42 2yql n ASP 25 Ca 0.02 -3.49 0.00 0.00 -1.51 0.00 0.00 54.79 49.81 2yql n ASP 25 Cb 0.51 -1.04 0.00 0.00 2.34 0.00 0.00 41.12 42.93 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 -0.27 0.00 -2.11 5.18 -1.04 -1.26 -5.05 114.28 109.73 2yql n THR 26 Ca 0.49 0.00 -0.01 0.00 -2.04 0.00 0.00 64.05 62.49 2yql n THR 26 Cb 0.57 -0.00 0.01 0.00 -1.82 0.00 0.00 70.33 69.09 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 4.75 -4.15 0.00 7.64 -1.26 -4.65 113.62 112.94 2yql n SER 28 Ca 0.01 -3.68 -0.14 0.00 1.01 0.00 0.00 58.87 56.07 2yql n SER 28 Cb 0.03 -0.63 -0.11 0.00 -1.01 0.00 0.00 64.21 62.50 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 -3.51 0.77 -0.02 1.43 1.81 -1.26 -4.12 118.95 114.04 2yql s ARG 29 Ca 0.48 -1.06 0.07 0.00 -1.72 0.00 0.00 55.73 53.50 2yql s ARG 29 Cb 0.26 -0.49 -0.02 0.00 -0.45 0.00 0.00 34.95 34.26 2yql s ARG 29 CO -0.13 0.08 -0.23 0.14 -0.68 0.00 0.00 175.30 174.48 2yql s VAL 30 N -2.15 1.81 -0.01 3.52 -7.23 -1.26 -3.47 120.40 111.60 2yql s VAL 30 Ca 0.02 -0.97 -0.00 0.00 -1.81 0.00 0.00 61.98 59.21 2yql s VAL 30 Cb -0.05 -1.50 0.02 0.00 0.56 0.00 0.00 36.38 35.41 2yql s VAL 30 CO -0.00 0.51 0.03 -0.31 -0.31 0.00 0.00 175.10 175.02 2yql s TYR 31 N -0.48 0.00 1.34 2.82 2.02 -1.17 -2.83 117.35 119.05 2yql s TYR 31 Ca 0.07 0.10 -0.21 0.00 -0.37 0.00 0.00 57.07 56.65 2yql s TYR 31 Cb -0.09 -0.11 0.33 0.00 -0.40 0.00 0.00 41.96 41.69 2yql s TYR 31 CO -0.00 -0.05 0.75 0.72 -1.57 0.00 0.00 175.55 175.40 2yql n HIS 32 N 3.63 -3.48 0.03 2.71 8.25 -1.26 -2.54 115.22 122.56 2yql n HIS 32 Ca -0.20 -0.63 0.01 0.00 -0.26 0.00 0.00 57.72 56.64 2yql n HIS 32 Cb 0.55 -1.25 -0.08 0.00 1.12 0.00 0.00 29.99 30.33 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 -4.15 117.00 119.55 2yql n LEU 33 Ca 0.12 0.34 0.10 0.00 -0.03 0.00 0.00 56.01 56.55 2yql n LEU 33 Cb 0.52 0.08 -0.16 0.00 -2.33 0.00 0.00 43.42 41.54 2yql n LEU 33 CO 0.34 0.14 -0.71 0.47 -1.33 0.00 0.00 177.39 176.30 2yql n ASP 34 N -2.85 0.36 -3.49 -1.43 8.00 -1.26 -0.35 116.55 115.54 2yql n ASP 34 Ca -0.10 -0.04 -0.40 0.00 0.71 0.00 0.00 54.79 54.95 2yql n ASP 34 Cb 0.83 1.89 0.02 0.00 -0.02 0.00 0.00 41.12 43.84 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 0.09 0.00 -3.35 0.00 4.77 -1.26 -4.33 117.00 112.91 2yql n LEU 36 Ca 0.50 -2.81 -0.14 0.00 -0.03 0.00 0.00 56.01 53.52 2yql n LEU 36 Cb 0.26 0.40 -0.08 0.00 -2.33 0.00 0.00 43.42 41.68 2yql n LEU 36 CO 0.53 -0.40 -0.13 -1.81 -1.33 0.00 0.00 177.39 174.25 2yql s ASP 37 N -3.44 1.05 0.97 -1.43 1.01 -1.26 -2.88 116.67 110.69 2yql s ASP 37 Ca 0.03 -0.94 -0.12 0.00 0.71 0.00 0.00 52.55 52.22 2yql s ASP 37 Cb 0.00 0.74 0.17 0.00 1.01 0.00 0.00 42.92 44.84 2yql s ASP 37 CO 0.02 -0.33 1.09 -2.16 0.21 0.00 0.00 175.17 174.00 2yql s PRO 38 N 2.07 0.67 0.65 8.23 0.04 -1.26 -4.69 135.00 140.72 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 -0.14 -1.76 -0.00 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 2.84 0.53 0.56 0.04 -1.14 -5.03 135.00 127.84 2yql s PRO 39 Ca 0.65 1.41 0.02 0.00 0.04 0.00 0.00 61.00 63.11 2yql s PRO 39 Cb -0.18 -1.95 0.00 0.00 0.04 0.00 0.00 34.50 32.40 2yql s PRO 39 CO 0.57 -1.22 0.09 -0.51 0.04 0.00 0.00 177.00 175.97 2yql s LEU 40 N -4.79 2.33 0.00 -3.56 1.43 0.53 -4.92 118.68 109.70 2yql s LEU 40 Ca 0.67 -1.59 0.00 0.00 -1.03 0.00 0.00 54.13 52.18 2yql s LEU 40 Cb -0.21 -0.81 0.00 0.00 0.03 0.00 0.00 46.19 45.20 2yql s LEU 40 CO 0.40 -0.93 0.00 1.17 0.23 0.00 0.00 176.35 177.22 2yql n LYS 41 N -1.39 0.00 -1.04 1.70 3.00 -1.23 -4.00 118.16 115.20 2yql n LYS 41 Ca -0.17 0.00 -0.04 0.00 -0.00 0.00 0.00 58.31 58.10 2yql n LYS 41 Cb 0.66 0.00 0.02 0.00 0.00 0.00 0.00 35.03 35.71 2yql n LYS 41 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.40 177.65 2yql n THR 42 N -2.10 0.00 -2.21 3.15 -2.24 -1.26 -4.90 114.28 104.71 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 66.97 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 -0.90 2.28 -1.09 -1.26 -4.92 121.20 118.87 2yql s ILE 43 Ca 0.12 0.91 -0.25 0.00 -2.23 0.00 0.00 60.65 59.20 2yql s ILE 43 Cb -0.01 -3.88 -0.05 0.00 -1.58 0.00 0.00 42.46 36.95 2yql s ILE 43 CO 0.08 -0.40 1.95 -2.16 -1.23 0.00 0.00 174.94 173.17 2yql s PRO 44 N 4.65 2.56 0.97 2.79 0.04 -1.26 -4.96 135.00 139.78 2yql s PRO 44 Ca 0.67 -0.30 -0.13 0.00 0.04 0.00 0.00 61.00 61.28 2yql s PRO 44 Cb -0.21 -5.06 0.04 0.00 0.04 0.00 0.00 34.50 29.31 2yql s PRO 44 CO 0.28 -3.38 0.36 1.63 0.04 0.00 0.00 177.00 175.93 2yql n LYS 45 N 8.85 -0.45 -0.45 4.56 5.02 -1.26 -4.59 118.16 129.84 2yql n LYS 45 Ca 0.40 -0.09 0.05 0.00 -2.02 0.00 0.00 58.31 56.65 2yql n LYS 45 Cb 0.47 -1.83 -0.03 0.00 -0.02 0.00 0.00 35.03 33.61 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 1.57 -2.87 3.50 0.72 0.00 -1.26 -4.68 105.19 102.18 2yql n GLY 46 Ca 0.06 -1.32 -0.42 0.00 0.00 0.00 0.00 46.02 44.33 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 -2.72 0.83 -3.43 1.61 1.56 -1.26 -4.91 117.12 108.79 2yql n MET 47 Ca -0.03 0.11 -0.34 0.00 -0.27 0.00 0.00 57.70 57.17 2yql n MET 47 Cb 0.21 -2.64 -0.06 0.00 2.15 0.00 0.00 33.22 32.89 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 9.69 3.54 -0.03 1.12 -0.00 -1.26 -5.09 118.94 126.92 2yql s TRP 48 Ca 1.11 0.93 -0.01 0.00 -0.00 0.00 0.00 56.10 58.14 2yql s TRP 48 Cb -0.67 -2.28 0.03 0.00 -0.00 0.00 0.00 33.47 30.55 2yql s TRP 48 CO 0.40 0.40 0.04 0.42 -0.00 0.00 0.00 176.95 178.20 2yql s ILE 49 N -1.56 -0.06 0.73 5.86 1.01 -1.26 -3.79 121.20 122.12 2yql s ILE 49 Ca 0.40 0.28 -0.16 0.00 0.00 0.00 0.00 60.65 61.16 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 0.20 0.12 0.60 0.00 0.00 0.00 0.00 174.94 175.86 2yql n PRO 51 N -0.95 0.03 0.16 0.00 -0.04 -1.26 -2.28 135.00 130.66 2yql n PRO 51 Ca 0.10 0.29 0.06 0.00 -0.04 0.00 0.00 63.50 63.91 2yql n PRO 51 Cb 0.50 -1.56 0.07 0.00 -0.04 0.00 0.00 33.50 32.47 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 -1.94 -3.17 114.38 112.28 2yql h ARG 52 Ca 0.00 0.00 -0.09 0.00 -1.26 0.00 0.00 59.98 58.63 2yql h ARG 52 Cb 0.26 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.57 2yql h ARG 52 CO 0.00 0.30 -0.58 0.00 0.56 0.00 0.00 179.97 180.25 2yql h GLN 54 N -1.00 0.04 -7.53 0.00 1.08 -1.69 -3.41 115.11 102.59 2yql h GLN 54 Ca -0.13 -0.00 -0.47 0.00 -1.45 0.00 0.00 58.65 56.60 2yql h GLN 54 Cb 0.85 -0.01 0.11 0.00 -0.05 0.00 0.00 27.48 28.38 2yql h GLN 54 CO -0.08 0.02 0.36 -0.51 -0.95 0.00 0.00 178.83 177.68 2yql s ASP 55 N -5.82 4.25 0.00 1.46 1.01 -1.20 -5.14 116.67 111.24 2yql s ASP 55 Ca -0.05 0.95 0.29 0.00 0.71 0.00 0.00 52.55 54.44 2yql s ASP 55 Cb 0.21 -1.53 1.20 0.00 1.01 0.00 0.00 42.92 43.81 2yql s ASP 55 CO 0.76 -2.08 1.83 1.67 0.21 0.00 0.00 175.17 177.56