#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2emy h SER 2 N 0.00 -0.82 -2.90 1.61 0.87 -2.11 -3.41 113.55 106.79 2emy h SER 2 Ca 0.00 0.14 -0.52 0.00 -1.23 0.00 0.00 61.79 60.17 2emy h SER 2 Cb 0.00 0.37 0.07 0.00 -0.44 0.00 0.00 62.40 62.40 2emy h SER 2 CO 0.00 -0.30 0.96 -0.94 -0.53 0.00 0.00 176.83 176.03 2emy s SER 3 N -5.00 6.39 -0.45 6.23 1.04 -1.26 -4.94 113.70 115.71 2emy s SER 3 Ca -0.15 2.89 0.08 0.00 0.48 0.00 0.00 55.95 59.25 2emy s SER 3 Cb 0.11 -2.61 0.39 0.00 0.10 0.00 0.00 66.02 64.01 2emy s SER 3 CO 0.67 -0.95 0.97 0.61 0.98 0.00 0.00 173.24 175.53 2emy n GLY 4 N 3.34 4.69 0.40 7.32 0.00 -1.26 -4.78 105.19 114.90 2emy n GLY 4 Ca 0.13 -2.34 0.00 0.00 0.00 0.00 0.00 46.02 43.82 2emy n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2emy n SER 5 N -0.21 2.40 -0.29 1.61 2.88 -1.26 -4.78 113.62 113.97 2emy n SER 5 Ca 0.29 0.00 -0.01 0.00 -1.33 0.00 0.00 58.87 57.82 2emy n SER 5 Cb 0.61 0.00 0.03 0.00 -0.75 0.00 0.00 64.21 64.09 2emy n SER 5 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2emy n SER 6 N -2.68 -0.49 0.00 -3.46 7.64 -1.26 -4.50 113.62 108.87 2emy n SER 6 Ca 0.00 1.30 0.00 0.00 1.01 0.00 0.00 58.87 61.18 2emy n SER 6 Cb 0.49 -0.30 0.00 0.00 -1.01 0.00 0.00 64.21 63.39 2emy n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2emy n GLY 7 N -1.35 1.09 3.75 0.23 0.00 -1.26 -4.45 105.19 103.19 2emy n GLY 7 Ca 0.08 0.76 -0.36 0.00 0.00 0.00 0.00 46.02 46.50 2emy n GLY 7 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2emy s THR 8 N 0.00 2.46 -0.20 2.61 -1.32 -1.26 -4.97 115.64 112.95 2emy s THR 8 Ca 0.00 0.28 0.24 0.00 -1.21 0.00 0.00 61.69 61.00 2emy s THR 8 Cb 0.00 -3.08 0.49 0.00 -1.51 0.00 0.00 72.50 68.40 2emy s THR 8 CO 0.00 -0.07 1.12 0.61 -2.21 0.00 0.00 174.62 174.07 2emy n GLY 9 N 0.58 1.61 2.51 6.08 0.00 -1.26 -4.93 105.19 109.78 2emy n GLY 9 Ca 0.14 -1.01 -0.28 0.00 0.00 0.00 0.00 46.02 44.87 2emy n GLY 9 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2emy n GLU 10 N -0.37 2.41 -3.78 1.61 4.07 -1.26 -4.78 120.64 118.55 2emy n GLU 10 Ca 0.07 -2.42 -0.30 0.00 -0.06 0.00 0.00 57.16 54.45 2emy n GLU 10 Cb 0.87 -2.14 -0.14 0.00 -0.06 0.00 0.00 31.44 29.97 2emy n GLU 10 CO 0.00 0.00 0.00 -0.80 -0.06 0.00 0.00 177.13 176.27 2emy s ASN 11 N 0.22 3.96 0.00 4.31 -0.87 -1.26 -4.66 114.94 116.64 2emy s ASN 11 Ca 0.58 -2.31 0.15 0.00 -1.57 0.00 0.00 52.86 49.70 2emy s ASN 11 Cb 0.39 -1.11 0.78 0.00 -0.02 0.00 0.00 41.25 41.29 2emy s ASN 11 CO -0.23 -0.32 1.39 -0.81 -2.57 0.00 0.00 177.10 174.56 2emy n PRO 12 N 3.98 0.27 -4.00 -0.60 -0.04 -1.24 -4.42 135.00 128.94 2emy n PRO 12 Ca 0.05 0.12 -0.31 0.00 -0.04 0.00 0.00 63.50 63.31 2emy n PRO 12 Cb 0.37 -1.50 -0.15 0.00 -0.04 0.00 0.00 33.50 32.18 2emy n PRO 12 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 2emy s TYR 13 N -2.45 2.97 0.03 0.54 2.02 -1.17 -5.04 117.35 114.26 2emy s TYR 13 Ca 0.16 -2.22 0.09 0.00 -0.37 0.00 0.00 57.07 54.72 2emy s TYR 13 Cb 0.10 -1.98 -0.03 0.00 -0.40 0.00 0.00 41.96 39.65 2emy s TYR 13 CO 0.22 -0.86 -0.26 -1.21 -1.57 0.00 0.00 175.55 171.87 2emy s GLU 14 N 1.19 1.85 -0.03 -0.62 2.02 -1.26 0.63 118.70 122.49 2emy s GLU 14 Ca -0.03 -1.06 -0.30 0.00 0.02 0.00 0.00 54.97 53.60 2emy s GLU 14 Cb -0.19 -1.97 -0.05 0.00 0.10 0.00 0.00 34.13 32.02 2emy s GLU 14 CO -0.07 0.52 1.36 0.00 0.02 0.00 0.00 175.26 177.09 2emy n HIS 16 N 5.51 0.79 0.00 0.00 1.44 -1.26 -2.34 115.22 119.35 2emy n HIS 16 Ca 0.13 -0.64 0.00 0.00 -2.01 0.00 0.00 57.72 55.20 2emy n HIS 16 Cb 0.44 -0.37 0.00 0.00 0.12 0.00 0.00 29.99 30.18 2emy n HIS 16 CO 0.00 0.00 0.00 0.39 -2.81 0.00 0.00 176.34 173.92 2emy n GLU 17 N 0.08 0.00 -0.06 -1.40 1.02 -1.26 -4.94 120.64 114.08 2emy n GLU 17 Ca 0.14 0.00 -0.11 0.00 -0.02 0.00 0.00 57.16 57.17 2emy n GLU 17 Cb 0.72 -0.51 -0.05 0.00 -0.02 0.00 0.00 31.44 31.59 2emy n GLU 17 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2emy n GLY 19 N 2.51 1.49 3.79 0.00 0.00 -0.99 -5.06 105.19 106.93 2emy n GLY 19 Ca -0.22 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.50 2emy n GLY 19 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2emy s LYS 20 N 0.00 0.46 -0.00 1.61 2.20 -1.26 -4.74 119.74 118.02 2emy s LYS 20 Ca 0.00 -0.00 -0.03 0.00 -0.36 0.00 0.00 55.97 55.58 2emy s LYS 20 Cb 0.00 -1.79 -0.01 0.00 -1.51 0.00 0.00 37.83 34.53 2emy s LYS 20 CO 0.00 -2.60 0.05 0.00 -0.36 0.00 0.00 175.35 172.44 2emy s ALA 21 N -3.40 -0.10 0.02 3.13 0.00 -1.26 -1.17 121.76 118.98 2emy s ALA 21 Ca 0.68 -0.20 -0.04 0.00 0.00 0.00 0.00 51.96 52.40 2emy s ALA 21 Cb -0.10 0.05 -0.01 0.00 0.00 0.00 0.00 23.12 23.06 2emy s ALA 21 CO 0.54 -0.13 0.07 -0.06 0.00 0.00 0.00 175.76 176.17 2emy s PHE 22 N -0.94 0.18 0.01 0.00 0.40 0.21 -4.97 117.98 112.85 2emy s PHE 22 Ca -0.10 -0.41 -0.24 0.00 -0.60 0.00 0.00 56.93 55.58 2emy s PHE 22 Cb -0.06 -0.13 -0.18 0.00 0.51 0.00 0.00 43.02 43.15 2emy s PHE 22 CO 0.00 -0.29 1.33 1.03 0.70 0.00 0.00 175.22 178.00 2emy h SER 23 N 4.13 0.10 -1.73 1.36 0.87 -1.85 -3.09 113.55 113.35 2emy h SER 23 Ca -0.32 -0.44 -0.49 0.00 -1.23 0.00 0.00 61.79 59.31 2emy h SER 23 Cb 1.19 -0.03 -0.04 0.00 -0.44 0.00 0.00 62.40 63.09 2emy h SER 23 CO 0.45 0.52 -0.42 -0.13 -0.53 0.00 0.00 176.83 176.71 2emy s ARG 24 N -4.46 2.66 0.03 2.24 0.52 -1.26 -4.52 118.95 114.15 2emy s ARG 24 Ca -0.15 -1.38 -0.25 0.00 -0.52 0.00 0.00 55.73 53.43 2emy s ARG 24 Cb 0.03 -2.45 -0.17 0.00 0.52 0.00 0.00 34.95 32.88 2emy s ARG 24 CO 0.69 -0.01 1.41 -0.22 0.02 0.00 0.00 175.30 177.20 2emy h LYS 25 N 1.17 -0.21 -0.90 3.54 1.63 -1.96 -3.08 116.57 116.77 2emy h LYS 25 Ca -0.44 0.01 0.12 0.00 -0.85 0.00 0.00 60.65 59.50 2emy h LYS 25 Cb 1.26 0.05 -0.08 0.00 -0.60 0.00 0.00 32.23 32.85 2emy h LYS 25 CO 0.58 0.07 0.52 0.10 -3.45 0.00 0.00 179.45 177.27 2emy h TYR 26 N -0.48 0.94 -0.47 1.91 -0.00 -1.99 0.11 116.97 116.99 2emy h TYR 26 Ca -0.02 0.03 0.14 0.00 -0.00 0.00 0.00 58.73 58.88 2emy h TYR 26 Cb 0.37 -0.29 -0.02 0.00 -0.00 0.00 0.00 36.73 36.80 2emy h TYR 26 CO 0.01 0.34 0.48 1.96 -0.00 0.00 0.00 178.16 180.96 2emy h GLN 27 N 0.82 0.00 0.11 0.10 4.20 -1.95 -0.56 115.11 117.83 2emy h GLN 27 Ca 0.45 0.00 -0.29 0.00 0.06 0.00 0.00 58.65 58.87 2emy h GLN 27 Cb 0.49 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.26 2emy h GLN 27 CO -0.28 0.00 -1.49 1.25 -0.67 0.00 0.00 178.83 177.63 2emy h LEU 28 N 0.00 0.35 -0.32 1.46 5.85 -0.81 -3.35 115.31 118.48 2emy h LEU 28 Ca 0.22 -0.84 0.06 0.00 0.84 0.00 0.00 57.88 58.17 2emy h LEU 28 Cb 1.19 -0.11 -0.06 0.00 0.37 0.00 0.00 40.66 42.04 2emy h LEU 28 CO -0.00 1.65 -0.08 0.40 -0.34 0.00 0.00 178.44 180.06 2emy h ILE 29 N -0.31 0.67 -0.87 4.05 5.03 -0.63 -0.02 117.51 125.43 2emy h ILE 29 Ca -0.33 0.00 0.22 0.00 -0.12 0.00 0.00 64.86 64.63 2emy h ILE 29 Cb 1.76 0.67 -0.05 0.00 -3.03 0.00 0.00 36.82 36.17 2emy h ILE 29 CO 0.04 0.00 0.60 -1.28 -0.68 0.00 0.00 178.15 176.83 2emy h SER 30 N -0.00 0.24 0.05 1.72 0.87 -1.50 -1.48 113.55 113.45 2emy h SER 30 Ca 0.16 0.03 -0.00 0.00 -1.23 0.00 0.00 61.79 60.74 2emy h SER 30 Cb 0.24 -0.02 0.00 0.00 -0.44 0.00 0.00 62.40 62.18 2emy h SER 30 CO -0.33 0.09 -0.02 -0.74 -0.53 0.00 0.00 176.83 175.29 2emy h HIS 31 N 0.24 -0.06 -1.15 2.24 -0.00 -1.18 -3.19 115.15 112.06 2emy h HIS 31 Ca 0.44 -0.00 0.33 0.00 -0.00 0.00 0.00 60.37 61.14 2emy h HIS 31 Cb 1.35 0.02 -0.05 0.00 -0.00 0.00 0.00 27.41 28.73 2emy h HIS 31 CO -0.00 0.56 0.96 1.96 -0.00 0.00 0.00 177.93 181.41 2emy h GLN 32 N -0.76 0.00 -1.10 5.26 4.20 -0.27 0.19 115.11 122.63 2emy h GLN 32 Ca -0.01 0.00 0.31 0.00 0.06 0.00 0.00 58.65 59.01 2emy h GLN 32 Cb 0.64 0.00 -0.10 0.00 0.30 0.00 0.00 27.48 28.32 2emy h GLN 32 CO 0.01 0.00 0.71 0.00 -0.67 0.00 0.00 178.83 178.88 2emy h ARG 33 N 0.00 0.31 -0.79 1.46 2.47 -1.47 0.46 114.38 116.81 2emy h ARG 33 Ca 0.54 -0.02 -0.05 0.00 -1.26 0.00 0.00 59.98 59.20 2emy h ARG 33 Cb 2.46 -0.07 -0.03 0.00 -1.65 0.00 0.00 29.97 30.68 2emy h ARG 33 CO -0.01 0.20 0.31 1.79 0.56 0.00 0.00 179.97 182.83 2emy h THR 34 N 0.32 1.26 -0.33 2.04 1.35 -0.84 -2.88 112.91 113.83 2emy h THR 34 Ca 0.65 -0.83 -0.17 0.00 -0.55 0.00 0.00 66.41 65.51 2emy h THR 34 Cb 1.76 0.32 -0.00 0.00 -1.73 0.00 0.00 68.15 68.51 2emy h THR 34 CO -0.33 0.34 -0.48 0.45 -0.25 0.00 0.00 175.52 175.25 2emy h HIS 35 N 1.15 1.11 -0.99 4.73 3.86 -0.29 -3.18 115.15 121.53 2emy h HIS 35 Ca 0.26 -0.37 0.34 0.00 -1.16 0.00 0.00 60.37 59.45 2emy h HIS 35 Cb 0.22 -0.22 -0.18 0.00 1.06 0.00 0.00 27.41 28.29 2emy h HIS 35 CO 0.02 1.20 0.27 0.00 0.86 0.00 0.00 177.93 180.28 2emy h ALA 36 N 0.74 1.64 -3.69 2.45 0.00 -1.02 -3.47 119.26 115.92 2emy h ALA 36 Ca 0.04 0.30 0.26 0.00 0.00 0.00 0.00 54.91 55.51 2emy h ALA 36 Cb 1.08 0.46 -0.14 0.00 0.00 0.00 0.00 17.79 19.19 2emy h ALA 36 CO 0.11 -0.74 -1.23 0.41 0.00 0.00 0.00 179.25 177.79 2emy n GLY 37 N -1.38 -3.63 2.13 0.00 0.00 -1.20 -4.75 105.19 96.35 2emy n GLY 37 Ca 0.30 -0.98 -0.25 0.00 0.00 0.00 0.00 46.02 45.09 2emy n GLY 37 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2emy n GLU 38 N -3.91 3.55 -4.24 1.61 1.02 -1.26 -5.00 120.64 112.41 2emy n GLU 38 Ca -0.07 -4.23 -0.28 0.00 -0.02 0.00 0.00 57.16 52.56 2emy n GLU 38 Cb 0.65 -2.27 -0.17 0.00 -0.02 0.00 0.00 31.44 29.63 2emy n GLU 38 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 2emy s LYS 39 N -3.59 2.00 0.62 3.49 2.36 -1.26 -5.13 119.74 118.22 2emy s LYS 39 Ca 0.51 -0.47 -0.16 0.00 -2.55 0.00 0.00 55.97 53.29 2emy s LYS 39 Cb 0.41 -1.80 -0.02 0.00 -1.05 0.00 0.00 37.83 35.37 2emy s LYS 39 CO -0.02 -0.14 1.12 -1.25 1.55 0.00 0.00 175.35 176.61 2emy s PRO 40 N 1.23 3.00 -0.84 4.03 0.04 -1.26 -3.96 135.00 137.24 2emy s PRO 40 Ca -0.02 1.46 -0.00 0.00 0.04 0.00 0.00 61.00 62.48 2emy s PRO 40 Cb -0.14 -1.97 0.00 0.00 0.04 0.00 0.00 34.50 32.43 2emy s PRO 40 CO -0.05 -1.11 0.70 0.43 0.04 0.00 0.00 177.00 177.02 2emy n SER 41 N -2.03 -2.26 -4.09 6.66 7.64 -1.26 -4.99 113.62 113.30 2emy n SER 41 Ca 0.11 -0.42 -0.36 0.00 1.01 0.00 0.00 58.87 59.21 2emy n SER 41 Cb 0.52 -3.69 -0.08 0.00 -1.01 0.00 0.00 64.21 59.95 2emy n SER 41 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2emy s GLY 42 N -3.88 2.80 0.06 0.23 0.00 -1.25 -4.91 107.32 100.36 2emy s GLY 42 Ca 0.03 -3.58 -0.19 0.00 0.00 0.00 0.00 44.72 40.99 2emy s GLY 42 CO 0.50 1.14 1.37 -0.56 0.00 0.00 0.00 173.10 175.55 2emy h PRO 43 N 6.44 0.46 -5.54 2.90 0.13 -1.95 -3.39 132.00 131.06 2emy h PRO 43 Ca 0.08 -0.25 -0.64 0.00 -0.87 0.00 0.00 66.00 64.33 2emy h PRO 43 Cb 0.87 0.01 -0.14 0.00 0.13 0.00 0.00 31.00 31.87 2emy h PRO 43 CO 0.77 0.82 0.93 -1.12 -0.23 0.00 0.00 178.00 179.17 2emy s SER 44 N -6.26 6.42 0.20 1.44 0.01 -1.26 -4.88 113.70 109.37 2emy s SER 44 Ca -0.14 -1.43 -0.11 0.00 1.31 0.00 0.00 55.95 55.59 2emy s SER 44 Cb 0.06 -2.46 0.25 0.00 0.21 0.00 0.00 66.02 64.08 2emy s SER 44 CO 0.78 -1.36 1.73 0.77 0.41 0.00 0.00 173.24 175.57 2emy h SER 45 N 9.40 0.15 0.00 2.44 4.64 -1.97 -3.54 113.55 124.67 2emy h SER 45 Ca -0.01 0.08 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 2emy h SER 45 Cb 1.04 0.08 0.00 0.00 -0.31 0.00 0.00 62.40 63.21 2emy h SER 45 CO 1.22 0.10 0.00 0.61 -0.87 0.00 0.00 176.83 177.89