#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 6.56 -0.13 1.61 0.15 -1.26 -4.91 113.70 115.72 2emy s SER 2 Ca 0.00 0.28 -0.18 0.00 0.70 0.00 0.00 55.95 56.75 2emy s SER 2 Cb 0.00 -2.50 -0.15 0.00 -1.71 0.00 0.00 66.02 61.65 2emy s SER 2 CO 0.00 -1.18 0.42 0.28 1.20 0.00 0.00 173.24 173.97 2emy h SER 3 N 9.18 0.00 -0.68 5.45 0.02 -2.12 -3.51 113.55 121.90 2emy h SER 3 Ca -0.24 -0.57 0.00 0.00 -0.84 0.00 0.00 61.79 60.14 2emy h SER 3 Cb 1.07 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.61 2emy h SER 3 CO 1.09 0.85 0.00 0.61 -1.14 0.00 0.00 176.83 178.24 2emy n GLY 4 N 1.66 -1.80 3.84 -3.77 0.00 -1.26 -5.14 105.19 98.71 2emy n GLY 4 Ca -0.08 -1.40 -0.31 0.00 0.00 0.00 0.00 46.02 44.23 2emy n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2emy s SER 5 N -1.50 5.33 -0.31 1.61 1.04 -1.26 -5.00 113.70 113.60 2emy s SER 5 Ca 0.00 1.41 0.08 0.00 0.48 0.00 0.00 55.95 57.92 2emy s SER 5 Cb 0.00 -2.27 0.46 0.00 0.10 0.00 0.00 66.02 64.30 2emy s SER 5 CO 0.00 -1.45 1.17 -1.20 0.98 0.00 0.00 173.24 172.74 2emy n SER 6 N -3.11 4.70 0.00 7.02 7.64 -1.26 -5.07 113.62 123.54 2emy n SER 6 Ca 0.07 -3.65 0.00 0.00 1.01 0.00 0.00 58.87 56.30 2emy n SER 6 Cb 0.55 -0.37 0.00 0.00 -1.01 0.00 0.00 64.21 63.38 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 -0.66 0.53 3.45 0.23 0.00 -1.26 -5.11 105.19 102.37 2emy n GLY 7 Ca 0.41 -1.76 -0.22 0.00 0.00 0.00 0.00 46.02 44.45 2emy n GLY 7 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2emy s THR 8 N -2.40 1.03 0.00 2.61 -4.23 -1.26 -5.16 115.64 106.23 2emy s THR 8 Ca 0.00 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.51 2emy s THR 8 Cb 0.00 -2.69 0.00 0.00 1.34 0.00 0.00 72.50 71.15 2emy s THR 8 CO 0.00 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.69 2emy n GLY 9 N -0.72 1.08 4.16 3.99 0.00 -1.26 -4.79 105.19 107.65 2emy n GLY 9 Ca -0.03 -0.74 -0.33 0.00 0.00 0.00 0.00 46.02 44.92 2emy n GLY 9 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2emy n GLU 10 N 0.00 -3.07 -3.86 1.61 -0.58 -1.26 -4.91 120.64 108.57 2emy n GLU 10 Ca 0.00 0.36 -0.33 0.00 -0.42 0.00 0.00 57.16 56.78 2emy n GLU 10 Cb 0.00 -4.86 -0.12 0.00 -0.57 0.00 0.00 31.44 25.89 2emy n GLU 10 CO 0.00 0.00 0.00 -0.80 -0.48 0.00 0.00 177.13 175.85 2emy s ASN 11 N -3.64 4.72 0.00 1.62 0.01 -1.26 -4.78 114.94 111.60 2emy s ASN 11 Ca 0.50 -2.88 0.15 0.00 -0.71 0.00 0.00 52.86 49.93 2emy s ASN 11 Cb -0.27 -1.73 0.78 0.00 0.41 0.00 0.00 41.25 40.44 2emy s ASN 11 CO 0.92 -0.30 1.39 -0.81 -1.51 0.00 0.00 177.10 176.80 2emy n PRO 12 N 3.36 0.27 -3.95 -0.60 -0.04 -1.25 -4.36 135.00 128.42 2emy n PRO 12 Ca 0.06 0.12 -0.31 0.00 -0.04 0.00 0.00 63.50 63.33 2emy n PRO 12 Cb 0.35 -1.50 -0.15 0.00 -0.04 0.00 0.00 33.50 32.16 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 3.07 0.09 0.54 2.02 -1.20 -5.04 117.35 114.37 2emy s TYR 13 Ca 0.16 -2.48 0.09 0.00 -0.37 0.00 0.00 57.07 54.47 2emy s TYR 13 Cb 0.10 -2.36 -0.04 0.00 -0.40 0.00 0.00 41.96 39.26 2emy s TYR 13 CO 0.22 -0.90 -0.19 -1.21 -1.57 0.00 0.00 175.55 171.89 2emy s GLU 14 N 1.15 1.83 -0.43 -0.62 2.02 -1.26 0.54 118.70 121.93 2emy s GLU 14 Ca 0.06 -1.13 -0.27 0.00 0.02 0.00 0.00 54.97 53.64 2emy s GLU 14 Cb -0.19 -2.11 0.02 0.00 0.10 0.00 0.00 34.13 31.96 2emy s GLU 14 CO -0.11 0.50 1.02 0.00 0.02 0.00 0.00 175.26 176.68 2emy n HIS 16 N 7.30 0.00 -0.08 0.00 1.44 -1.26 0.30 115.22 122.92 2emy n HIS 16 Ca 0.09 0.00 -0.15 0.00 -2.01 0.00 0.00 57.72 55.65 2emy n HIS 16 Cb 0.48 -0.22 -0.12 0.00 0.12 0.00 0.00 29.99 30.26 2emy n HIS 16 CO 0.00 0.00 0.00 0.93 -2.81 0.00 0.00 176.34 174.46 2emy h GLU 17 N 0.00 0.00 0.00 -1.40 5.08 -1.98 -3.44 114.58 112.85 2emy h GLU 17 Ca 0.00 0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 58.24 2emy h GLU 17 Cb 0.12 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.35 2emy h GLU 17 CO 0.00 0.92 -1.43 0.00 -1.00 0.00 0.00 179.01 177.50 2emy n GLY 19 N 2.86 1.40 3.73 0.00 0.00 0.15 -5.04 105.19 108.28 2emy n GLY 19 Ca -0.14 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.59 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 0.44 0.01 1.61 2.20 -1.23 -4.67 119.74 118.10 2emy s LYS 20 Ca 0.00 0.23 0.00 0.00 -0.36 0.00 0.00 55.97 55.84 2emy s LYS 20 Cb 0.00 -1.76 -0.01 0.00 -1.51 0.00 0.00 37.83 34.55 2emy s LYS 20 CO 0.00 -2.66 -0.02 0.00 -0.36 0.00 0.00 175.35 172.30 2emy s ALA 21 N -3.19 0.15 0.05 3.13 0.00 -1.26 -0.30 121.76 120.35 2emy s ALA 21 Ca 0.66 -0.32 -0.02 0.00 0.00 0.00 0.00 51.96 52.28 2emy s ALA 21 Cb -0.14 0.05 -0.03 0.00 0.00 0.00 0.00 23.12 22.99 2emy s ALA 21 CO 0.55 -0.05 0.01 -0.06 0.00 0.00 0.00 175.76 176.21 2emy s PHE 22 N -0.69 0.44 -0.09 0.00 0.40 0.19 -4.97 117.98 113.26 2emy s PHE 22 Ca -0.07 -0.95 -0.26 0.00 -0.60 0.00 0.00 56.93 55.05 2emy s PHE 22 Cb -0.05 -0.32 -0.22 0.00 0.51 0.00 0.00 43.02 42.94 2emy s PHE 22 CO -0.00 -0.40 0.90 1.03 0.70 0.00 0.00 175.22 177.45 2emy h SER 23 N 3.16 -0.02 -2.00 1.36 0.87 -1.86 -3.18 113.55 111.88 2emy h SER 23 Ca -0.34 -0.73 -0.48 0.00 -1.23 0.00 0.00 61.79 59.02 2emy h SER 23 Cb 1.15 0.01 -0.03 0.00 -0.44 0.00 0.00 62.40 63.09 2emy h SER 23 CO 0.63 0.75 -0.44 -0.13 -0.53 0.00 0.00 176.83 177.11 2emy s ARG 24 N -2.95 3.00 0.08 2.24 0.52 -1.26 -4.59 118.95 115.99 2emy s ARG 24 Ca -0.17 -1.07 -0.22 0.00 -0.52 0.00 0.00 55.73 53.75 2emy s ARG 24 Cb -0.01 -2.65 -0.13 0.00 0.52 0.00 0.00 34.95 32.68 2emy s ARG 24 CO 0.63 0.23 1.66 -0.22 0.02 0.00 0.00 175.30 177.62 2emy h LYS 25 N 1.23 0.10 -0.94 3.54 1.63 -1.96 -2.84 116.57 117.32 2emy h LYS 25 Ca -0.47 -0.01 0.05 0.00 -0.85 0.00 0.00 60.65 59.36 2emy h LYS 25 Cb 1.25 -0.02 -0.06 0.00 -0.60 0.00 0.00 32.23 32.80 2emy h LYS 25 CO 0.58 0.17 0.61 0.10 -3.45 0.00 0.00 179.45 177.46 2emy h TYR 26 N 0.01 1.13 -0.52 1.91 -0.00 -1.99 -0.72 116.97 116.79 2emy h TYR 26 Ca 0.02 0.03 0.15 0.00 -0.00 0.00 0.00 58.73 58.94 2emy h TYR 26 Cb 0.10 -0.37 -0.02 0.00 -0.00 0.00 0.00 36.73 36.44 2emy h TYR 26 CO -0.04 0.62 0.51 1.96 -0.00 0.00 0.00 178.16 181.21 2emy h GLN 27 N 1.14 0.00 0.11 0.10 4.20 -1.91 -0.49 115.11 118.26 2emy h GLN 27 Ca 0.39 0.00 -0.31 0.00 0.06 0.00 0.00 58.65 58.79 2emy h GLN 27 Cb 0.08 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.85 2emy h GLN 27 CO -0.15 0.00 -1.62 1.25 -0.67 0.00 0.00 178.83 177.64 2emy h LEU 28 N 0.00 0.35 -0.37 1.46 5.85 -1.13 -3.36 115.31 118.12 2emy h LEU 28 Ca 0.25 -0.84 0.07 0.00 0.84 0.00 0.00 57.88 58.19 2emy h LEU 28 Cb 1.26 -0.12 -0.06 0.00 0.37 0.00 0.00 40.66 42.12 2emy h LEU 28 CO -0.00 1.70 0.00 0.40 -0.34 0.00 0.00 178.44 180.20 2emy h ILE 29 N -0.25 0.73 -0.81 4.05 5.03 -0.62 -0.19 117.51 125.44 2emy h ILE 29 Ca -0.36 -0.04 0.19 0.00 -0.12 0.00 0.00 64.86 64.54 2emy h ILE 29 Cb 1.81 0.61 -0.05 0.00 -3.03 0.00 0.00 36.82 36.16 2emy h ILE 29 CO 0.04 0.02 0.55 -1.28 -0.68 0.00 0.00 178.15 176.79 2emy h SER 30 N 0.10 0.28 -0.03 1.72 0.87 -1.45 -1.15 113.55 113.89 2emy h SER 30 Ca 0.18 0.02 -0.08 0.00 -1.23 0.00 0.00 61.79 60.68 2emy h SER 30 Cb 0.25 -0.03 0.01 0.00 -0.44 0.00 0.00 62.40 62.19 2emy h SER 30 CO -0.30 0.12 -0.30 -0.74 -0.53 0.00 0.00 176.83 175.08 2emy h HIS 31 N 0.29 0.36 -1.00 2.24 -0.00 -1.22 -3.19 115.15 112.63 2emy h HIS 31 Ca 0.40 -0.18 0.29 0.00 -0.00 0.00 0.00 60.37 60.89 2emy h HIS 31 Cb 1.14 -0.05 -0.04 0.00 -0.00 0.00 0.00 27.41 28.46 2emy h HIS 31 CO -0.00 0.94 0.72 1.96 -0.00 0.00 0.00 177.93 181.54 2emy h GLN 32 N -0.31 0.02 -0.81 5.26 4.20 -0.11 0.23 115.11 123.58 2emy h GLN 32 Ca -0.03 -0.00 0.17 0.00 0.06 0.00 0.00 58.65 58.85 2emy h GLN 32 Cb 1.00 -0.00 -0.06 0.00 0.30 0.00 0.00 27.48 28.72 2emy h GLN 32 CO 0.06 0.01 0.54 0.00 -0.67 0.00 0.00 178.83 178.77 2emy h ARG 33 N 0.02 0.39 0.00 1.46 2.47 -1.46 0.35 114.38 117.61 2emy h ARG 33 Ca 0.48 -0.02 -0.02 0.00 -1.26 0.00 0.00 59.98 59.16 2emy h ARG 33 Cb 1.89 -0.09 -0.00 0.00 -1.65 0.00 0.00 29.97 30.12 2emy h ARG 33 CO -0.02 0.26 -0.09 1.79 0.56 0.00 0.00 179.97 182.47 2emy h THR 34 N 0.40 0.45 0.21 2.04 1.35 -0.72 -2.72 112.91 113.92 2emy h THR 34 Ca 0.41 -0.46 -0.32 0.00 -0.55 0.00 0.00 66.41 65.49 2emy h THR 34 Cb 0.98 1.31 0.02 0.00 -1.73 0.00 0.00 68.15 68.74 2emy h THR 34 CO -0.14 0.09 -1.50 0.45 -0.25 0.00 0.00 175.52 174.17 2emy h HIS 35 N 0.00 0.80 -1.65 4.73 3.86 -0.43 -3.46 115.15 119.00 2emy h HIS 35 Ca -0.00 -0.59 -0.67 0.00 -1.16 0.00 0.00 60.37 57.95 2emy h HIS 35 Cb 0.31 -0.03 0.09 0.00 1.06 0.00 0.00 27.41 28.83 2emy h HIS 35 CO 0.00 1.58 0.03 0.00 0.86 0.00 0.00 177.93 180.40 2emy n ALA 36 N -2.79 -1.64 0.00 2.45 0.00 -0.99 -4.54 120.51 112.99 2emy n ALA 36 Ca -0.20 0.47 0.00 0.00 0.00 0.00 0.00 53.44 53.71 2emy n ALA 36 Cb 1.05 -1.89 0.00 0.00 0.00 0.00 0.00 19.45 18.61 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 1.82 -1.01 3.82 0.00 0.00 -1.26 -5.03 105.19 103.53 2emy n GLY 37 Ca 0.16 0.44 -0.05 0.00 0.00 0.00 0.00 46.02 46.56 2emy n GLY 37 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2emy s GLU 38 N 0.00 1.59 0.58 1.61 -1.05 -1.26 -5.15 118.70 115.02 2emy s GLU 38 Ca 0.00 -0.96 -0.20 0.00 -0.15 0.00 0.00 54.97 53.66 2emy s GLU 38 Cb 0.00 0.49 -0.04 0.00 -0.44 0.00 0.00 34.13 34.14 2emy s GLU 38 CO 0.00 -0.74 1.23 0.36 0.95 0.00 0.00 175.26 177.07 2emy n LYS 39 N -0.55 1.32 -1.15 -4.83 2.85 -1.26 -4.99 118.16 109.55 2emy n LYS 39 Ca -0.05 0.50 -0.29 0.00 -1.05 0.00 0.00 58.31 57.42 2emy n LYS 39 Cb 0.60 -2.45 0.18 0.00 -0.65 0.00 0.00 35.03 32.72 2emy n LYS 39 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 177.40 176.10 2emy s PRO 40 N -2.97 0.25 -0.49 -1.58 0.04 -1.26 -4.94 135.00 124.06 2emy s PRO 40 Ca 0.76 0.47 -0.28 0.00 0.04 0.00 0.00 61.00 61.98 2emy s PRO 40 Cb -0.41 -1.72 0.01 0.00 0.04 0.00 0.00 34.50 32.42 2emy s PRO 40 CO 0.46 -2.84 1.38 -1.54 0.04 0.00 0.00 177.00 174.50 2emy s SER 41 N -3.46 6.27 0.00 6.66 1.04 -1.26 -4.97 113.70 117.98 2emy s SER 41 Ca 0.66 0.54 0.00 0.00 0.48 0.00 0.00 55.95 57.63 2emy s SER 41 Cb -0.19 -2.54 0.00 0.00 0.10 0.00 0.00 66.02 63.39 2emy s SER 41 CO 0.58 -1.54 0.00 0.61 0.98 0.00 0.00 173.24 173.87 2emy n GLY 42 N 5.14 5.61 3.73 7.32 0.00 -1.26 -5.14 105.19 120.59 2emy n GLY 42 Ca 0.14 -2.11 -0.30 0.00 0.00 0.00 0.00 46.02 43.75 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 -0.81 1.55 -0.14 1.61 0.04 -1.26 -5.03 135.00 130.96 2emy s PRO 43 Ca 0.00 0.92 -0.14 0.00 0.04 0.00 0.00 61.00 61.82 2emy s PRO 43 Cb 0.00 -1.83 -0.05 0.00 0.04 0.00 0.00 34.50 32.66 2emy s PRO 43 CO 0.00 -2.07 0.32 -1.12 0.04 0.00 0.00 177.00 174.17 2emy s SER 44 N -3.42 6.49 -0.21 6.66 0.01 -1.26 -5.06 113.70 116.92 2emy s SER 44 Ca 0.63 0.58 -0.21 0.00 1.31 0.00 0.00 55.95 58.25 2emy s SER 44 Cb -0.18 -2.19 -0.02 0.00 0.21 0.00 0.00 66.02 63.84 2emy s SER 44 CO 0.57 0.12 0.66 -0.44 0.41 0.00 0.00 173.24 174.56 2emy s SER 45 N 0.30 6.70 0.00 2.44 0.01 -1.26 -5.37 113.70 116.52 2emy s SER 45 Ca 0.18 0.86 0.00 0.00 1.31 0.00 0.00 55.95 58.30 2emy s SER 45 Cb -0.13 -2.36 0.00 0.00 0.21 0.00 0.00 66.02 63.73 2emy s SER 45 CO 0.05 -0.32 0.00 0.61 0.41 0.00 0.00 173.24 173.99