#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2emy s SER 2 N 0.00 4.22 -0.17 1.61 1.04 -1.26 -4.97 113.70 114.17 2emy s SER 2 Ca 0.00 -1.67 -0.15 0.00 0.48 0.00 0.00 55.95 54.61 2emy s SER 2 Cb 0.00 -1.22 -0.06 0.00 0.10 0.00 0.00 66.02 64.83 2emy s SER 2 CO 0.00 -0.35 -0.31 -0.24 0.98 0.00 0.00 173.24 173.32 2emy n SER 3 N 4.59 1.83 0.00 7.02 2.88 -1.26 -5.09 113.62 123.59 2emy n SER 3 Ca -0.03 0.31 0.00 0.00 -1.33 0.00 0.00 58.87 57.82 2emy n SER 3 Cb 0.43 -0.70 0.00 0.00 -0.75 0.00 0.00 64.21 63.18 2emy n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2emy n GLY 4 N 1.63 0.55 3.26 0.46 0.00 -1.26 -5.09 105.19 104.73 2emy n GLY 4 Ca -0.20 -0.59 -0.44 0.00 0.00 0.00 0.00 46.02 44.80 2emy n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2emy s SER 5 N 0.00 6.36 0.02 1.61 0.15 -1.26 -5.02 113.70 115.55 2emy s SER 5 Ca 0.00 -2.85 0.00 0.00 0.70 0.00 0.00 55.95 53.81 2emy s SER 5 Cb 0.00 -2.10 -0.02 0.00 -1.71 0.00 0.00 66.02 62.19 2emy s SER 5 CO 0.00 -0.48 -0.03 -0.44 1.20 0.00 0.00 173.24 173.49 2emy s SER 6 N 1.60 0.28 0.00 5.45 0.01 -1.26 -5.07 113.70 114.71 2emy s SER 6 Ca 0.19 -0.45 0.00 0.00 1.31 0.00 0.00 55.95 57.00 2emy s SER 6 Cb -0.13 0.08 0.00 0.00 0.21 0.00 0.00 66.02 66.19 2emy s SER 6 CO -0.08 -0.26 0.00 0.61 0.41 0.00 0.00 173.24 173.93 2emy n GLY 7 N 1.75 -3.01 0.05 3.44 0.00 -1.26 -5.02 105.19 101.14 2emy n GLY 7 Ca -0.23 -0.66 -0.01 0.00 0.00 0.00 0.00 46.02 45.13 2emy n GLY 7 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2emy h THR 8 N 0.00 0.00 -5.09 2.61 1.35 -2.05 -3.49 112.91 106.24 2emy h THR 8 Ca 0.00 -0.89 -0.11 0.00 -0.55 0.00 0.00 66.41 64.86 2emy h THR 8 Cb 0.00 0.00 0.01 0.00 -1.73 0.00 0.00 68.15 66.43 2emy h THR 8 CO 0.00 0.00 -0.80 0.61 -0.25 0.00 0.00 175.52 175.08 2emy n GLY 9 N 1.77 0.05 0.22 5.82 0.00 -1.26 -4.83 105.19 106.97 2emy n GLY 9 Ca -0.01 0.31 -0.05 0.00 0.00 0.00 0.00 46.02 46.27 2emy n GLY 9 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2emy h GLU 10 N 2.41 0.47 -3.87 1.61 4.81 -1.98 -3.44 114.58 114.59 2emy h GLU 10 Ca -0.15 -0.22 -0.37 0.00 -0.13 0.00 0.00 59.36 58.49 2emy h GLU 10 Cb 0.85 -0.01 -0.07 0.00 0.63 0.00 0.00 28.75 30.14 2emy h GLU 10 CO 0.06 0.76 1.40 0.09 -0.73 0.00 0.00 179.01 180.60 2emy n ASN 11 N -4.06 -0.04 0.00 1.04 3.02 -1.26 -4.68 115.26 109.28 2emy n ASN 11 Ca -0.01 0.03 0.07 0.00 -0.03 0.00 0.00 54.58 54.64 2emy n ASN 11 Cb 0.47 -0.66 0.39 0.00 -0.61 0.00 0.00 39.78 39.38 2emy n ASN 11 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 2emy n PRO 12 N 6.14 0.26 -4.00 3.52 -0.04 -1.25 -4.41 135.00 135.23 2emy n PRO 12 Ca 0.51 0.12 -0.31 0.00 -0.04 0.00 0.00 63.50 63.78 2emy n PRO 12 Cb 0.04 -1.50 -0.15 0.00 -0.04 0.00 0.00 33.50 31.85 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 -2.46 3.03 -0.00 0.54 2.02 -1.21 -5.04 117.35 114.23 2emy s TYR 13 Ca 0.16 -2.29 0.08 0.00 -0.37 0.00 0.00 57.07 54.64 2emy s TYR 13 Cb 0.10 -2.06 -0.02 0.00 -0.40 0.00 0.00 41.96 39.58 2emy s TYR 13 CO 0.22 -0.87 -0.24 -1.21 -1.57 0.00 0.00 175.55 171.88 2emy s GLU 14 N 1.17 1.89 0.01 -0.62 2.02 -1.26 0.50 118.70 122.42 2emy s GLU 14 Ca -0.02 -0.92 -0.30 0.00 0.02 0.00 0.00 54.97 53.75 2emy s GLU 14 Cb -0.19 -1.89 -0.06 0.00 0.10 0.00 0.00 34.13 32.09 2emy s GLU 14 CO -0.07 0.51 1.41 0.00 0.02 0.00 0.00 175.26 177.13 2emy n HIS 16 N 5.31 0.80 -0.00 0.00 1.44 -1.26 -2.26 115.22 119.24 2emy n HIS 16 Ca 0.13 -0.52 -0.01 0.00 -2.01 0.00 0.00 57.72 55.31 2emy n HIS 16 Cb 0.43 -0.33 -0.00 0.00 0.12 0.00 0.00 29.99 30.21 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 0.11 0.02 -0.07 -1.40 1.02 -1.26 -4.93 120.64 114.13 2emy n GLU 17 Ca 0.13 0.01 -0.11 0.00 -0.02 0.00 0.00 57.16 57.17 2emy n GLU 17 Cb 0.69 -0.55 -0.05 0.00 -0.02 0.00 0.00 31.44 31.51 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 2.58 1.78 3.80 0.00 0.00 -0.96 -5.06 105.19 107.32 2emy n GLY 19 Ca -0.24 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.49 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 1.33 0.02 1.61 2.20 -1.26 -4.74 119.74 118.91 2emy s LYS 20 Ca 0.00 0.33 0.02 0.00 -0.36 0.00 0.00 55.97 55.96 2emy s LYS 20 Cb 0.00 -1.86 -0.01 0.00 -1.51 0.00 0.00 37.83 34.45 2emy s LYS 20 CO 0.00 -2.08 -0.06 0.00 -0.36 0.00 0.00 175.35 172.85 2emy s ALA 21 N -3.28 0.49 0.06 3.13 0.00 -1.26 -0.72 121.76 120.17 2emy s ALA 21 Ca 0.63 -0.47 -0.00 0.00 0.00 0.00 0.00 51.96 52.11 2emy s ALA 21 Cb -0.15 -0.03 -0.04 0.00 0.00 0.00 0.00 23.12 22.90 2emy s ALA 21 CO 0.53 0.04 -0.04 -0.06 0.00 0.00 0.00 175.76 176.24 2emy s PHE 22 N -0.72 0.59 -0.10 0.00 0.40 0.18 -4.98 117.98 113.36 2emy s PHE 22 Ca -0.04 -1.02 -0.27 0.00 -0.60 0.00 0.00 56.93 55.01 2emy s PHE 22 Cb -0.06 -0.41 -0.23 0.00 0.51 0.00 0.00 43.02 42.83 2emy s PHE 22 CO 0.00 -0.33 0.89 0.77 0.70 0.00 0.00 175.22 177.25 2emy h SER 23 N 3.16 -0.01 -1.69 1.36 0.02 -1.94 -3.20 113.55 111.24 2emy h SER 23 Ca -0.34 -0.77 -0.48 0.00 -0.84 0.00 0.00 61.79 59.35 2emy h SER 23 Cb 1.15 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.67 2emy h SER 23 CO 0.65 0.79 -0.39 -0.13 -1.14 0.00 0.00 176.83 176.61 2emy s ARG 24 N -2.86 2.72 0.08 3.45 0.52 -1.26 -4.58 118.95 117.02 2emy s ARG 24 Ca -0.17 -1.34 -0.19 0.00 -0.52 0.00 0.00 55.73 53.51 2emy s ARG 24 Cb -0.01 -2.51 -0.09 0.00 0.52 0.00 0.00 34.95 32.86 2emy s ARG 24 CO 0.65 -0.04 1.55 -0.22 0.02 0.00 0.00 175.30 177.25 2emy h LYS 25 N 1.08 0.38 -0.95 3.54 1.63 -1.96 -3.02 116.57 117.26 2emy h LYS 25 Ca -0.43 -0.10 0.02 0.00 -0.85 0.00 0.00 60.65 59.28 2emy h LYS 25 Cb 1.26 -0.04 -0.05 0.00 -0.60 0.00 0.00 32.23 32.80 2emy h LYS 25 CO 0.56 0.52 0.63 0.10 -3.45 0.00 0.00 179.45 177.81 2emy h TYR 26 N 0.17 1.18 -0.56 1.91 -0.00 -1.99 -1.24 116.97 116.44 2emy h TYR 26 Ca 0.07 0.03 0.16 0.00 -0.00 0.00 0.00 58.73 58.99 2emy h TYR 26 Cb 0.33 -0.40 -0.02 0.00 -0.00 0.00 0.00 36.73 36.64 2emy h TYR 26 CO 0.02 0.72 0.49 1.96 -0.00 0.00 0.00 178.16 181.35 2emy h GLN 27 N 1.26 0.00 0.06 0.10 4.20 -1.94 -1.30 115.11 117.49 2emy h GLN 27 Ca 0.36 0.00 -0.21 0.00 0.06 0.00 0.00 58.65 58.86 2emy h GLN 27 Cb -0.10 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.67 2emy h GLN 27 CO -0.09 0.00 -1.11 1.25 -0.67 0.00 0.00 178.83 178.21 2emy h LEU 28 N 0.00 0.18 -0.45 1.46 5.85 -1.25 -3.35 115.31 117.75 2emy h LEU 28 Ca 0.27 -0.77 0.09 0.00 0.84 0.00 0.00 57.88 58.31 2emy h LEU 28 Cb 1.24 -0.06 -0.09 0.00 0.37 0.00 0.00 40.66 42.12 2emy h LEU 28 CO -0.00 1.47 -0.13 0.40 -0.34 0.00 0.00 178.44 179.84 2emy h ILE 29 N -0.66 0.53 -0.87 4.05 5.03 -0.73 0.17 117.51 125.03 2emy h ILE 29 Ca -0.26 0.00 0.23 0.00 -0.12 0.00 0.00 64.86 64.71 2emy h ILE 29 Cb 1.47 0.53 -0.05 0.00 -3.03 0.00 0.00 36.82 35.74 2emy h ILE 29 CO -0.04 0.00 0.61 -1.28 -0.68 0.00 0.00 178.15 176.75 2emy h SER 30 N -0.02 0.16 0.01 1.72 0.87 -1.47 -0.66 113.55 114.17 2emy h SER 30 Ca 0.22 0.02 -0.10 0.00 -1.23 0.00 0.00 61.79 60.69 2emy h SER 30 Cb 0.35 -0.01 0.01 0.00 -0.44 0.00 0.00 62.40 62.30 2emy h SER 30 CO -0.47 0.06 -0.41 -0.74 -0.53 0.00 0.00 176.83 174.74 2emy h HIS 31 N 0.16 0.39 -0.38 2.24 -0.00 -0.84 -3.20 115.15 113.51 2emy h HIS 31 Ca 0.43 -0.22 0.11 0.00 -0.00 0.00 0.00 60.37 60.69 2emy h HIS 31 Cb 1.45 -0.04 -0.02 0.00 -0.00 0.00 0.00 27.41 28.80 2emy h HIS 31 CO -0.00 1.05 0.56 1.96 -0.00 0.00 0.00 177.93 181.50 2emy h GLN 32 N -0.39 0.00 -0.27 5.26 4.20 0.08 0.27 115.11 124.27 2emy h GLN 32 Ca -0.06 0.00 0.06 0.00 0.06 0.00 0.00 58.65 58.72 2emy h GLN 32 Cb 1.18 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.94 2emy h GLN 32 CO 0.08 0.00 0.19 0.00 -0.67 0.00 0.00 178.83 178.43 2emy h ARG 33 N 0.00 0.07 0.00 1.46 2.47 -1.48 0.55 114.38 117.45 2emy h ARG 33 Ca 0.18 -0.00 -0.04 0.00 -1.26 0.00 0.00 59.98 58.85 2emy h ARG 33 Cb 1.29 -0.02 -0.01 0.00 -1.65 0.00 0.00 29.97 29.59 2emy h ARG 33 CO -0.00 0.05 -0.21 1.79 0.56 0.00 0.00 179.97 182.15 2emy h THR 34 N 0.07 0.60 -0.18 2.04 1.35 -0.66 -2.07 112.91 114.07 2emy h THR 34 Ca 0.12 -0.98 0.00 0.00 -0.55 0.00 0.00 66.41 65.00 2emy h THR 34 Cb 0.40 1.65 0.00 0.00 -1.73 0.00 0.00 68.15 68.47 2emy h THR 34 CO -0.01 0.21 0.00 1.41 -0.25 0.00 0.00 175.52 176.88 2emy n HIS 35 N -3.49 0.24 -0.04 4.73 8.25 0.18 -3.90 115.22 121.18 2emy n HIS 35 Ca -0.01 -0.12 -0.06 0.00 -0.26 0.00 0.00 57.72 57.27 2emy n HIS 35 Cb 0.38 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.45 2emy n HIS 35 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2emy n ALA 36 N 0.12 1.88 -1.11 -1.41 0.00 -0.81 -5.03 120.51 114.15 2emy n ALA 36 Ca 0.12 -0.37 -0.44 0.00 0.00 0.00 0.00 53.44 52.76 2emy n ALA 36 Cb 0.24 0.31 -0.06 0.00 0.00 0.00 0.00 19.45 19.94 2emy n ALA 36 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2emy n GLY 37 N 3.01 -0.14 3.46 0.00 0.00 -1.02 -4.93 105.19 105.56 2emy n GLY 37 Ca -0.16 0.58 -0.15 0.00 0.00 0.00 0.00 46.02 46.29 2emy n GLY 37 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2emy s GLU 38 N 0.37 1.83 -0.05 1.61 2.02 -1.26 -5.08 118.70 118.14 2emy s GLU 38 Ca 0.67 -1.75 0.05 0.00 0.02 0.00 0.00 54.97 53.96 2emy s GLU 38 Cb -0.94 0.42 -0.00 0.00 0.10 0.00 0.00 34.13 33.71 2emy s GLU 38 CO 0.44 -0.74 -0.19 0.21 0.02 0.00 0.00 175.26 175.00 2emy s LYS 39 N -3.23 1.99 1.23 1.61 2.20 -1.26 -5.14 119.74 117.13 2emy s LYS 39 Ca 0.32 -0.67 -0.21 0.00 -0.36 0.00 0.00 55.97 55.05 2emy s LYS 39 Cb 0.00 -1.70 0.30 0.00 -1.51 0.00 0.00 37.83 34.93 2emy s LYS 39 CO 0.20 0.26 1.09 -0.35 -0.36 0.00 0.00 175.35 176.19 2emy n PRO 40 N 3.14 -3.14 -4.35 4.03 -0.04 -1.26 -5.08 135.00 128.31 2emy n PRO 40 Ca -0.18 -1.74 -0.23 0.00 -0.04 0.00 0.00 63.50 61.30 2emy n PRO 40 Cb 0.53 -1.63 -0.08 0.00 -0.04 0.00 0.00 33.50 32.27 2emy n PRO 40 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2emy s SER 41 N -4.45 4.22 0.00 3.54 1.04 -1.26 -5.12 113.70 111.67 2emy s SER 41 Ca 0.71 -0.77 0.00 0.00 0.48 0.00 0.00 55.95 56.37 2emy s SER 41 Cb -0.07 -0.66 0.00 0.00 0.10 0.00 0.00 66.02 65.39 2emy s SER 41 CO 0.54 0.02 0.00 0.61 0.98 0.00 0.00 173.24 175.39 2emy n GLY 42 N -0.75 0.77 3.67 7.32 0.00 -1.26 -5.04 105.19 109.89 2emy n GLY 42 Ca -0.06 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.67 2emy n GLY 42 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2emy s PRO 43 N 0.28 0.27 0.33 1.61 0.04 -1.26 -4.94 135.00 131.33 2emy s PRO 43 Ca 0.00 0.47 -0.26 0.00 0.04 0.00 0.00 61.00 61.25 2emy s PRO 43 Cb 0.00 -1.72 -0.14 0.00 0.04 0.00 0.00 34.50 32.68 2emy s PRO 43 CO 0.00 -2.83 0.84 0.43 0.04 0.00 0.00 177.00 175.48 2emy n SER 44 N -4.24 0.49 -4.68 6.66 7.64 -1.26 -4.77 113.62 113.45 2emy n SER 44 Ca 0.05 1.09 -0.49 0.00 1.01 0.00 0.00 58.87 60.53 2emy n SER 44 Cb 0.57 -1.22 -0.05 0.00 -1.01 0.00 0.00 64.21 62.51 2emy n SER 44 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2emy n SER 45 N 1.22 3.41 0.00 6.43 2.88 -1.26 -5.21 113.62 121.08 2emy n SER 45 Ca 0.11 0.98 0.00 0.00 -1.33 0.00 0.00 58.87 58.63 2emy n SER 45 Cb 0.34 -1.36 0.00 0.00 -0.75 0.00 0.00 64.21 62.44 2emy n SER 45 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42