#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2em4 s SER 2 N 0.00 3.80 0.16 1.61 0.01 -1.26 -5.12 113.70 112.90 2em4 s SER 2 Ca 0.00 -1.33 0.08 0.00 1.31 0.00 0.00 55.95 56.01 2em4 s SER 2 Cb 0.00 -1.02 -0.04 0.00 0.21 0.00 0.00 66.02 65.17 2em4 s SER 2 CO 0.00 -0.31 -0.08 -0.55 0.41 0.00 0.00 173.24 172.71 2em4 s SER 3 N 1.50 4.40 0.00 2.44 0.15 -1.26 -4.97 113.70 115.97 2em4 s SER 3 Ca 0.01 -0.49 0.00 0.00 0.70 0.00 0.00 55.95 56.18 2em4 s SER 3 Cb -0.18 -0.82 0.00 0.00 -1.71 0.00 0.00 66.02 63.31 2em4 s SER 3 CO -0.12 0.12 0.00 0.61 1.20 0.00 0.00 173.24 175.05 2em4 n GLY 4 N 0.19 -1.28 3.38 9.45 0.00 -1.26 -5.06 105.19 110.62 2em4 n GLY 4 Ca -0.11 0.46 -0.45 0.00 0.00 0.00 0.00 46.02 45.92 2em4 n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2em4 s SER 5 N -4.00 6.47 -0.05 1.61 0.15 -1.26 -4.75 113.70 111.88 2em4 s SER 5 Ca 0.00 -1.96 -0.01 0.00 0.70 0.00 0.00 55.95 54.68 2em4 s SER 5 Cb 0.00 -2.30 -0.03 0.00 -1.71 0.00 0.00 66.02 61.98 2em4 s SER 5 CO 0.00 -0.95 -0.05 -0.24 1.20 0.00 0.00 173.24 173.20 2em4 n SER 6 N 5.73 2.63 -2.73 5.45 2.88 -1.26 -5.00 113.62 121.32 2em4 n SER 6 Ca 0.07 0.00 -0.03 0.00 -1.33 0.00 0.00 58.87 57.58 2em4 n SER 6 Cb 0.46 -0.10 0.02 0.00 -0.75 0.00 0.00 64.21 63.84 2em4 n SER 6 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2em4 s GLY 7 N -4.67 -1.64 0.11 0.46 0.00 -1.26 -5.16 107.32 95.16 2em4 s GLY 7 Ca -0.07 0.24 0.08 0.00 0.00 0.00 0.00 44.72 44.97 2em4 s GLY 7 CO 0.11 4.05 -0.20 -1.08 0.00 0.00 0.00 173.10 175.98 2em4 s THR 8 N 1.02 1.70 0.00 0.90 -1.32 -1.26 -4.98 115.64 111.69 2em4 s THR 8 Ca 0.25 -1.62 0.00 0.00 -1.21 0.00 0.00 61.69 59.11 2em4 s THR 8 Cb 0.07 -1.60 0.00 0.00 -1.51 0.00 0.00 72.50 69.46 2em4 s THR 8 CO -0.09 -0.13 0.00 0.61 -2.21 0.00 0.00 174.62 172.80 2em4 n GLY 9 N 0.91 -2.63 0.22 6.08 0.00 -1.26 -5.08 105.19 103.43 2em4 n GLY 9 Ca -0.18 -0.30 -0.00 0.00 0.00 0.00 0.00 46.02 45.53 2em4 n GLY 9 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2em4 n GLN 10 N 0.01 0.02 -1.01 1.61 3.00 -1.26 -5.01 117.38 114.73 2em4 n GLN 10 Ca 0.00 0.01 -0.35 0.00 -0.01 0.00 0.00 57.00 56.65 2em4 n GLN 10 Cb 0.00 -0.44 -0.02 0.00 0.00 0.00 0.00 30.24 29.78 2em4 n GLN 10 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.06 179.95 2em4 n ARG 11 N -2.60 0.00 0.00 -1.09 0.00 -1.26 -4.75 116.66 106.96 2em4 n ARG 11 Ca -0.01 0.00 0.07 0.00 -0.00 0.00 0.00 57.85 57.92 2em4 n ARG 11 Cb 0.02 -0.73 0.38 0.00 -0.00 0.00 0.00 32.46 32.13 2em4 n ARG 11 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.63 177.28 2em4 n PRO 12 N 0.74 0.24 -3.77 2.89 -0.04 -1.26 -4.53 135.00 129.27 2em4 n PRO 12 Ca 0.13 0.13 -0.22 0.00 -0.04 0.00 0.00 63.50 63.50 2em4 n PRO 12 Cb 0.19 -1.50 -0.18 0.00 -0.04 0.00 0.00 33.50 31.97 2em4 n PRO 12 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 2em4 s TYR 13 N -2.51 0.51 0.04 0.54 2.02 -1.25 -5.07 117.35 111.63 2em4 s TYR 13 Ca 0.15 -0.06 -0.02 0.00 -0.37 0.00 0.00 57.07 56.77 2em4 s TYR 13 Cb 0.10 -0.70 -0.03 0.00 -0.40 0.00 0.00 41.96 40.93 2em4 s TYR 13 CO 0.22 -0.28 -0.00 -1.21 -1.57 0.00 0.00 175.55 172.70 2em4 s GLU 14 N 1.93 0.54 -0.22 -0.62 2.02 -1.26 -1.53 118.70 119.55 2em4 s GLU 14 Ca 0.04 -0.99 0.01 0.00 0.02 0.00 0.00 54.97 54.05 2em4 s GLU 14 Cb -0.12 0.19 0.03 0.00 0.10 0.00 0.00 34.13 34.33 2em4 s GLU 14 CO -0.04 -0.11 -0.13 0.00 0.02 0.00 0.00 175.26 175.00 2em4 h ILE 16 N 6.24 1.34 -0.84 0.00 6.09 -1.94 0.44 117.51 128.85 2em4 h ILE 16 Ca -0.34 -2.55 0.12 0.00 -1.37 0.00 0.00 64.86 60.72 2em4 h ILE 16 Cb 1.10 2.66 -0.13 0.00 0.47 0.00 0.00 36.82 40.92 2em4 h ILE 16 CO 0.57 0.77 -0.36 1.21 -3.07 0.00 0.00 178.15 177.26 2em4 n GLU 17 N -3.74 -0.24 -0.05 2.19 0.00 -1.26 -3.27 120.64 114.28 2em4 n GLU 17 Ca -0.11 1.28 -0.06 0.00 0.00 0.00 0.00 57.16 58.27 2em4 n GLU 17 Cb 0.96 -1.90 -0.05 0.00 0.00 0.00 0.00 31.44 30.45 2em4 n GLU 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2em4 n GLY 19 N 2.91 1.19 3.72 0.00 0.00 0.14 -5.10 105.19 108.05 2em4 n GLY 19 Ca -0.16 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.67 2em4 n GLY 19 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2em4 n LYS 20 N -0.07 0.60 -3.84 1.61 5.02 -0.63 -4.86 118.16 115.99 2em4 n LYS 20 Ca 0.00 -2.96 -0.11 0.00 -2.02 0.00 0.00 58.31 53.22 2em4 n LYS 20 Cb 0.00 -0.24 -0.08 0.00 -0.02 0.00 0.00 35.03 34.68 2em4 n LYS 20 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2em4 s ALA 21 N -2.68 -0.41 0.13 7.82 0.00 -1.26 -0.27 121.76 125.09 2em4 s ALA 21 Ca 0.58 -0.22 -0.06 0.00 0.00 0.00 0.00 51.96 52.26 2em4 s ALA 21 Cb -0.05 0.26 -0.02 0.00 0.00 0.00 0.00 23.12 23.32 2em4 s ALA 21 CO 0.37 -0.35 0.18 -0.06 0.00 0.00 0.00 175.76 175.90 2em4 s PHE 22 N -2.43 0.46 -0.12 0.00 0.40 -0.59 -4.98 117.98 110.73 2em4 s PHE 22 Ca -0.06 -0.86 0.20 0.00 -0.60 0.00 0.00 56.93 55.60 2em4 s PHE 22 Cb -0.02 -0.19 -0.21 0.00 0.51 0.00 0.00 43.02 43.12 2em4 s PHE 22 CO -0.03 -0.60 0.59 1.63 0.70 0.00 0.00 175.22 177.51 2em4 n LYS 23 N -0.12 0.65 -3.83 0.44 4.76 -1.26 -3.86 118.16 114.93 2em4 n LYS 23 Ca -0.09 0.01 -0.12 0.00 -2.87 0.00 0.00 58.31 55.24 2em4 n LYS 23 Cb 0.63 -1.65 -0.13 0.00 -1.84 0.00 0.00 35.03 32.03 2em4 n LYS 23 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 2em4 s THR 24 N -3.12 -0.00 0.15 -0.18 -4.23 -1.26 -4.88 115.64 102.12 2em4 s THR 24 Ca -0.06 0.01 -0.20 0.00 -1.18 0.00 0.00 61.69 60.26 2em4 s THR 24 Cb 0.10 -0.15 0.04 0.00 1.34 0.00 0.00 72.50 73.83 2em4 s THR 24 CO 0.85 0.01 1.66 0.11 -0.54 0.00 0.00 174.62 176.70 2em4 h LYS 25 N 6.08 -0.13 -1.09 3.99 1.57 -1.98 -1.09 116.57 123.92 2em4 h LYS 25 Ca -0.26 0.01 0.37 0.00 -1.87 0.00 0.00 60.65 58.89 2em4 h LYS 25 Cb 1.20 0.03 -0.10 0.00 0.08 0.00 0.00 32.23 33.44 2em4 h LYS 25 CO 0.44 -0.09 0.72 0.43 -0.57 0.00 0.00 179.45 180.39 2em4 n SER 26 N -5.32 0.13 -0.06 0.86 7.64 -1.26 0.60 113.62 116.20 2em4 n SER 26 Ca -0.00 0.98 -0.03 0.00 1.01 0.00 0.00 58.87 60.82 2em4 n SER 26 Cb 0.24 -0.48 -0.02 0.00 -1.01 0.00 0.00 64.21 62.94 2em4 n SER 26 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 2em4 h SER 27 N 0.00 0.00 0.10 6.43 0.02 -1.64 -3.35 113.55 115.12 2em4 h SER 27 Ca 0.66 -0.05 0.02 0.00 -0.84 0.00 0.00 61.79 61.58 2em4 h SER 27 Cb 2.22 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 64.71 2em4 h SER 27 CO -0.29 0.67 -0.38 0.25 -1.14 0.00 0.00 176.83 175.94 2em4 h LEU 28 N -1.00 -1.11 -0.82 5.07 5.85 -0.26 -2.58 115.31 120.45 2em4 h LEU 28 Ca -0.01 0.13 0.11 0.00 0.84 0.00 0.00 57.88 58.95 2em4 h LEU 28 Cb 0.32 0.42 -0.12 0.00 0.37 0.00 0.00 40.66 41.65 2em4 h LEU 28 CO -0.01 -0.45 -0.37 -0.38 -0.34 0.00 0.00 178.44 176.89 2em4 n ILE 29 N -5.45 -0.47 -0.26 4.05 5.41 0.20 0.15 119.36 122.99 2em4 n ILE 29 Ca -0.07 1.95 0.05 0.00 1.00 0.00 0.00 62.75 65.68 2em4 n ILE 29 Cb 0.36 -2.53 0.19 0.00 -0.71 0.00 0.00 39.64 36.95 2em4 n ILE 29 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2em4 h HIS 31 N 0.52 0.89 -0.49 0.00 -0.00 0.15 -2.53 115.15 113.70 2em4 h HIS 31 Ca 0.41 -0.16 0.04 0.00 -0.00 0.00 0.00 60.37 60.66 2em4 h HIS 31 Cb 0.59 -0.23 -0.04 0.00 -0.00 0.00 0.00 27.41 27.73 2em4 h HIS 31 CO -0.14 0.87 0.25 0.00 -0.00 0.00 0.00 177.93 178.92 2em4 h ARG 32 N 0.74 0.48 -0.40 5.26 3.08 0.12 -2.11 114.38 121.55 2em4 h ARG 32 Ca 0.12 -0.03 -0.09 0.00 0.07 0.00 0.00 59.98 60.05 2em4 h ARG 32 Cb 0.59 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.52 2em4 h ARG 32 CO 0.04 0.32 -0.13 0.00 -1.07 0.00 0.00 179.97 179.13 2em4 h ARG 33 N 0.50 0.71 -0.53 0.04 3.08 -1.26 -3.08 114.38 113.85 2em4 h ARG 33 Ca 0.21 -0.24 0.11 0.00 0.07 0.00 0.00 59.98 60.13 2em4 h ARG 33 Cb 0.11 -0.06 -0.10 0.00 0.08 0.00 0.00 29.97 30.00 2em4 h ARG 33 CO -0.14 0.81 -0.07 1.03 -1.07 0.00 0.00 179.97 180.53 2em4 h SER 34 N 0.65 -0.37 -0.75 7.04 0.87 -0.94 -2.43 113.55 117.61 2em4 h SER 34 Ca 0.11 0.15 0.07 0.00 -1.23 0.00 0.00 61.79 60.88 2em4 h SER 34 Cb 0.59 0.28 -0.09 0.00 -0.44 0.00 0.00 62.40 62.74 2em4 h SER 34 CO 0.04 -0.14 -0.44 1.41 -0.53 0.00 0.00 176.83 177.17 2em4 n HIS 35 N -5.32 -0.33 -1.10 2.24 8.25 -1.13 -4.45 115.22 113.39 2em4 n HIS 35 Ca 0.06 0.93 -0.34 0.00 -0.26 0.00 0.00 57.72 58.11 2em4 n HIS 35 Cb 0.29 -0.55 0.12 0.00 1.12 0.00 0.00 29.99 30.97 2em4 n HIS 35 CO 0.00 0.00 0.00 -2.37 0.64 0.00 0.00 176.34 174.61 2em4 n THR 36 N -4.79 1.84 -1.21 1.59 5.66 -0.92 -4.22 114.28 112.23 2em4 n THR 36 Ca 0.01 -0.23 0.00 0.00 -3.05 0.00 0.00 64.05 60.78 2em4 n THR 36 Cb 0.19 -1.08 0.00 0.00 -1.55 0.00 0.00 70.33 67.89 2em4 n THR 36 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2em4 n GLY 37 N 0.79 0.86 2.98 1.09 0.00 -1.26 -5.03 105.19 104.63 2em4 n GLY 37 Ca 0.12 -0.32 -0.10 0.00 0.00 0.00 0.00 46.02 45.73 2em4 n GLY 37 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2em4 s GLU 38 N -2.32 0.29 0.02 1.61 2.02 -1.26 -5.16 118.70 113.89 2em4 s GLU 38 Ca 0.00 -0.51 0.04 0.00 0.02 0.00 0.00 54.97 54.52 2em4 s GLU 38 Cb 0.00 0.11 -0.02 0.00 0.10 0.00 0.00 34.13 34.32 2em4 s GLU 38 CO 0.00 -0.05 -0.13 0.15 0.02 0.00 0.00 175.26 175.25 2em4 s LYS 39 N -1.27 0.94 -0.52 1.61 -0.14 -1.26 -5.10 119.74 114.00 2em4 s LYS 39 Ca -0.14 -0.61 -0.27 0.00 -1.36 0.00 0.00 55.97 53.59 2em4 s LYS 39 Cb -0.09 -0.92 -0.02 0.00 -1.68 0.00 0.00 37.83 35.13 2em4 s LYS 39 CO -0.01 0.24 1.81 -1.25 -0.76 0.00 0.00 175.35 175.38 2em4 s PRO 40 N -0.77 2.89 -0.97 -1.68 0.04 -1.26 -4.93 135.00 128.32 2em4 s PRO 40 Ca 0.03 0.84 -0.20 0.00 0.04 0.00 0.00 61.00 61.71 2em4 s PRO 40 Cb -0.06 -4.31 0.11 0.00 0.04 0.00 0.00 34.50 30.27 2em4 s PRO 40 CO 0.00 -2.41 1.25 0.45 0.04 0.00 0.00 177.00 176.33 2em4 s SER 41 N 7.23 6.61 0.14 6.66 0.15 -1.26 -4.91 113.70 128.31 2em4 s SER 41 Ca 0.70 -1.90 0.00 0.00 0.70 0.00 0.00 55.95 55.45 2em4 s SER 41 Cb -0.15 -2.46 0.00 0.00 -1.71 0.00 0.00 66.02 61.70 2em4 s SER 41 CO 0.25 -1.19 0.00 0.61 1.20 0.00 0.00 173.24 174.11 2em4 n GLY 42 N 5.88 -1.47 3.62 9.45 0.00 -1.26 -4.92 105.19 116.49 2em4 n GLY 42 Ca 0.28 -1.29 -0.30 0.00 0.00 0.00 0.00 46.02 44.71 2em4 n GLY 42 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2em4 s PRO 43 N 0.00 -0.76 -0.86 1.61 0.04 -1.26 -5.00 135.00 128.77 2em4 s PRO 43 Ca 0.00 0.10 -0.03 0.00 0.04 0.00 0.00 61.00 61.11 2em4 s PRO 43 Cb 0.00 -1.64 0.21 0.00 0.04 0.00 0.00 34.50 33.12 2em4 s PRO 43 CO 0.00 -3.44 0.74 0.45 0.04 0.00 0.00 177.00 174.79 2em4 s SER 44 N -3.76 5.95 -0.41 6.66 0.15 -1.26 -5.01 113.70 116.02 2em4 s SER 44 Ca 0.69 -3.55 -0.05 0.00 0.70 0.00 0.00 55.95 53.75 2em4 s SER 44 Cb -0.12 -1.92 0.10 0.00 -1.71 0.00 0.00 66.02 62.36 2em4 s SER 44 CO 0.57 -0.23 0.21 -0.94 1.20 0.00 0.00 173.24 174.05 2em4 s SER 45 N 0.12 5.36 0.00 5.45 1.04 -1.26 -5.28 113.70 119.13 2em4 s SER 45 Ca 0.26 -1.80 0.00 0.00 0.48 0.00 0.00 55.95 54.89 2em4 s SER 45 Cb -0.10 -1.88 0.00 0.00 0.10 0.00 0.00 66.02 64.15 2em4 s SER 45 CO -0.11 -0.53 0.00 0.61 0.98 0.00 0.00 173.24 174.20