#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2emg s SER 2 N 0.00 0.01 0.01 1.61 0.15 -1.26 -5.15 113.70 109.07 2emg s SER 2 Ca 0.00 0.19 0.01 0.00 0.70 0.00 0.00 55.95 56.85 2emg s SER 2 Cb 0.00 0.08 -0.01 0.00 -1.71 0.00 0.00 66.02 64.38 2emg s SER 2 CO 0.00 -0.15 -0.03 -0.44 1.20 0.00 0.00 173.24 173.82 2emg s SER 3 N 1.19 0.34 0.00 5.45 0.01 -1.26 -5.06 113.70 114.37 2emg s SER 3 Ca -0.08 -0.16 0.00 0.00 1.31 0.00 0.00 55.95 57.01 2emg s SER 3 Cb -0.12 -0.01 0.00 0.00 0.21 0.00 0.00 66.02 66.10 2emg s SER 3 CO -0.05 -0.04 0.00 0.61 0.41 0.00 0.00 173.24 174.17 2emg n GLY 4 N 2.65 -1.65 3.58 3.44 0.00 -1.26 -5.13 105.19 106.83 2emg n GLY 4 Ca -0.15 0.66 -0.42 0.00 0.00 0.00 0.00 46.02 46.11 2emg n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2emg s SER 5 N 0.00 6.57 -0.34 1.61 0.15 -1.26 -4.92 113.70 115.51 2emg s SER 5 Ca 0.00 0.35 0.06 0.00 0.70 0.00 0.00 55.95 57.06 2emg s SER 5 Cb 0.00 -2.42 0.45 0.00 -1.71 0.00 0.00 66.02 62.34 2emg s SER 5 CO 0.00 -0.82 1.22 -0.24 1.20 0.00 0.00 173.24 174.60 2emg n SER 6 N 6.64 5.05 -3.66 5.45 2.88 -1.26 -5.06 113.62 123.65 2emg n SER 6 Ca 0.05 -3.75 -0.27 0.00 -1.33 0.00 0.00 58.87 53.57 2emg n SER 6 Cb 0.48 -0.40 0.20 0.00 -0.75 0.00 0.00 64.21 63.74 2emg n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2emg n GLY 7 N -0.67 -1.87 3.66 0.46 0.00 -1.26 -4.90 105.19 100.60 2emg n GLY 7 Ca 0.44 -1.64 -0.57 0.00 0.00 0.00 0.00 46.02 44.25 2emg n GLY 7 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2emg n THR 8 N -4.00 0.16 -0.06 2.61 -1.04 -1.26 -4.88 114.28 105.81 2emg n THR 8 Ca 0.15 -0.03 -0.17 0.00 -2.04 0.00 0.00 64.05 61.96 2emg n THR 8 Cb 0.54 -0.96 -0.13 0.00 -1.82 0.00 0.00 70.33 67.96 2emg n THR 8 CO 0.00 0.00 0.00 1.23 -0.64 0.00 0.00 175.07 175.66 2emg h GLY 9 N 5.93 0.06 -2.62 3.41 0.00 -2.01 -3.46 103.07 104.37 2emg h GLY 9 Ca -0.47 -0.15 -0.49 0.00 0.00 0.00 0.00 47.33 46.22 2emg h GLY 9 CO 0.88 0.13 0.43 -1.83 0.00 0.00 0.00 176.54 176.16 2emg s GLU 10 N -2.30 3.96 -0.26 4.80 -1.05 -1.26 -5.05 118.70 117.54 2emg s GLU 10 Ca -0.21 1.57 -0.01 0.00 -0.15 0.00 0.00 54.97 56.17 2emg s GLU 10 Cb 0.00 -2.41 0.13 0.00 -0.44 0.00 0.00 34.13 31.41 2emg s GLU 10 CO 0.69 -0.33 0.33 -0.80 0.95 0.00 0.00 175.26 176.09 2emg s ASN 11 N -1.57 0.91 -0.02 0.83 0.01 -1.26 -5.04 114.94 108.79 2emg s ASN 11 Ca 0.61 -0.27 -0.25 0.00 -0.71 0.00 0.00 52.86 52.24 2emg s ASN 11 Cb -0.23 0.80 -0.19 0.00 0.41 0.00 0.00 41.25 42.03 2emg s ASN 11 CO 0.28 -0.34 1.22 1.55 -1.51 0.00 0.00 177.10 178.31 2emg h PRO 12 N 8.23 -0.06 -1.91 -0.60 0.13 -1.94 -3.46 132.00 132.38 2emg h PRO 12 Ca -0.15 0.00 0.03 0.00 -0.87 0.00 0.00 66.00 65.01 2emg h PRO 12 Cb 1.12 0.01 -0.22 0.00 0.13 0.00 0.00 31.00 32.05 2emg h PRO 12 CO 0.29 0.40 0.12 -0.06 -0.23 0.00 0.00 178.00 178.52 2emg s PHE 13 N -4.22 -0.91 -0.06 1.56 0.08 -1.26 -5.02 117.98 108.16 2emg s PHE 13 Ca -0.15 1.90 0.01 0.00 0.12 0.00 0.00 56.93 58.80 2emg s PHE 13 Cb 0.02 0.51 0.02 0.00 -0.57 0.00 0.00 43.02 43.00 2emg s PHE 13 CO 0.64 -0.45 -0.06 0.42 -0.10 0.00 0.00 175.22 175.67 2emg s ILE 14 N 1.29 0.70 0.07 0.64 1.01 -1.26 -2.34 121.20 121.31 2emg s ILE 14 Ca -0.07 -0.19 -0.32 0.00 0.00 0.00 0.00 60.65 60.06 2emg s ILE 14 Cb -0.05 -0.72 -0.11 0.00 0.01 0.00 0.00 42.46 41.59 2emg s ILE 14 CO -0.15 0.27 1.82 0.00 0.00 0.00 0.00 174.94 176.88 2emg n SER 16 N 5.68 3.87 0.00 0.00 2.88 -1.26 -2.41 113.62 122.38 2emg n SER 16 Ca 0.19 -2.44 0.00 0.00 -1.33 0.00 0.00 58.87 55.30 2emg n SER 16 Cb 0.34 -0.71 0.00 0.00 -0.75 0.00 0.00 64.21 63.09 2emg n SER 16 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 2emg n GLU 17 N 0.37 0.00 -0.02 -1.46 1.02 -1.26 -4.77 120.64 114.53 2emg n GLU 17 Ca 0.13 0.00 -0.04 0.00 -0.02 0.00 0.00 57.16 57.23 2emg n GLU 17 Cb 0.69 -0.45 -0.01 0.00 -0.02 0.00 0.00 31.44 31.65 2emg n GLU 17 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2emg n GLY 19 N 2.78 0.99 3.70 0.00 0.00 -1.01 -5.03 105.19 106.61 2emg n GLY 19 Ca -0.07 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.60 2emg n GLY 19 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2emg s LYS 20 N 0.03 3.22 -0.11 1.61 2.20 -1.26 -4.81 119.74 120.61 2emg s LYS 20 Ca 0.00 -0.36 -0.12 0.00 -0.36 0.00 0.00 55.97 55.13 2emg s LYS 20 Cb 0.00 -2.92 -0.05 0.00 -1.51 0.00 0.00 37.83 33.36 2emg s LYS 20 CO 0.00 0.64 0.27 0.08 -0.36 0.00 0.00 175.35 175.98 2emg s VAL 21 N -0.69 5.30 -0.03 4.02 1.01 -1.26 -1.19 120.40 127.55 2emg s VAL 21 Ca 0.11 0.50 0.05 0.00 0.00 0.00 0.00 61.98 62.65 2emg s VAL 21 Cb -0.12 -3.58 -0.01 0.00 0.00 0.00 0.00 36.38 32.68 2emg s VAL 21 CO 0.02 0.50 -0.20 -0.36 0.00 0.00 0.00 175.10 175.07 2emg s PHE 22 N -0.32 1.89 0.10 5.22 0.40 -0.99 -5.03 117.98 119.25 2emg s PHE 22 Ca 0.17 -0.47 -0.27 0.00 -0.60 0.00 0.00 56.93 55.76 2emg s PHE 22 Cb -0.13 -1.24 -0.12 0.00 0.51 0.00 0.00 43.02 42.03 2emg s PHE 22 CO 0.06 -0.12 1.67 1.79 0.70 0.00 0.00 175.22 179.31 2emg h THR 23 N 4.97 0.58 -3.34 0.64 1.35 -1.99 -3.37 112.91 111.76 2emg h THR 23 Ca -0.35 0.00 -0.65 0.00 -0.55 0.00 0.00 66.41 64.86 2emg h THR 23 Cb 1.16 0.58 -0.33 0.00 -1.73 0.00 0.00 68.15 67.83 2emg h THR 23 CO 0.48 0.00 -0.87 -1.38 -0.25 0.00 0.00 175.52 173.50 2emg s HIS 24 N -6.11 2.39 0.17 4.73 0.00 -1.26 -4.89 115.29 110.32 2emg s HIS 24 Ca -0.15 -0.99 -0.13 0.00 -3.00 0.00 0.00 55.06 50.79 2emg s HIS 24 Cb 0.06 -1.62 0.18 0.00 -4.00 0.00 0.00 32.58 27.21 2emg s HIS 24 CO 0.65 -0.41 1.15 1.17 -1.00 0.00 0.00 174.74 176.30 2emg n LYS 25 N 3.62 -0.17 -0.25 -0.38 3.00 -1.26 0.51 118.16 123.22 2emg n LYS 25 Ca -0.20 1.14 0.04 0.00 -0.00 0.00 0.00 58.31 59.30 2emg n LYS 25 Cb 0.53 -1.70 0.10 0.00 0.00 0.00 0.00 35.03 33.96 2emg n LYS 25 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.40 179.81 2emg n THR 26 N -5.10 -0.29 -0.16 3.15 -1.04 -1.26 0.22 114.28 109.80 2emg n THR 26 Ca 0.08 1.59 -0.08 0.00 -2.04 0.00 0.00 64.05 63.59 2emg n THR 26 Cb 0.30 -2.20 0.01 0.00 -1.82 0.00 0.00 70.33 66.62 2emg n THR 26 CO 0.00 0.00 0.00 -1.13 -0.64 0.00 0.00 175.07 173.30 2emg h ASN 27 N 0.00 0.64 -0.17 8.00 -0.73 -0.36 -2.33 115.58 120.64 2emg h ASN 27 Ca 0.33 -0.16 -0.00 0.00 1.87 0.00 0.00 56.30 58.34 2emg h ASN 27 Cb 0.50 -0.17 -0.01 0.00 0.27 0.00 0.00 38.32 38.92 2emg h ASN 27 CO -0.71 0.63 0.09 0.25 -0.37 0.00 0.00 177.43 177.31 2emg h LEU 28 N 0.62 0.21 -1.16 0.34 5.85 0.27 -1.77 115.31 119.67 2emg h LEU 28 Ca 0.16 -0.10 0.11 0.00 0.84 0.00 0.00 57.88 58.89 2emg h LEU 28 Cb 0.17 -0.05 -0.07 0.00 0.37 0.00 0.00 40.66 41.08 2emg h LEU 28 CO -0.01 0.25 0.59 0.40 -0.34 0.00 0.00 178.44 179.33 2emg h ILE 29 N 0.16 0.93 -0.11 4.05 2.04 -0.40 0.77 117.51 124.95 2emg h ILE 29 Ca 0.06 -0.30 -0.12 0.00 1.00 0.00 0.00 64.86 65.49 2emg h ILE 29 Cb 0.09 -0.03 -0.01 0.00 -0.74 0.00 0.00 36.82 36.13 2emg h ILE 29 CO -0.01 0.16 -0.48 0.40 0.00 0.00 0.00 178.15 178.22 2emg h ILE 30 N 0.88 1.34 0.34 -0.67 2.04 -1.06 -3.23 117.51 117.15 2emg h ILE 30 Ca 0.44 -1.70 -0.02 0.00 1.00 0.00 0.00 64.86 64.59 2emg h ILE 30 Cb 0.50 1.79 0.00 0.00 -0.74 0.00 0.00 36.82 38.37 2emg h ILE 30 CO -0.21 0.51 -0.16 -0.74 0.00 0.00 0.00 178.15 177.55 2emg h HIS 31 N 0.22 -0.42 -1.02 1.37 -0.00 -0.18 -3.20 115.15 111.93 2emg h HIS 31 Ca 0.01 -0.01 0.30 0.00 -0.00 0.00 0.00 60.37 60.67 2emg h HIS 31 Cb 0.93 0.14 -0.04 0.00 -0.00 0.00 0.00 27.41 28.44 2emg h HIS 31 CO 0.02 -0.26 1.22 1.96 -0.00 0.00 0.00 177.93 180.87 2emg h GLN 32 N -1.10 0.00 -0.76 5.26 4.20 -1.02 0.46 115.11 122.15 2emg h GLN 32 Ca -0.05 0.00 0.14 0.00 0.06 0.00 0.00 58.65 58.81 2emg h GLN 32 Cb 0.35 0.00 -0.09 0.00 0.30 0.00 0.00 27.48 28.03 2emg h GLN 32 CO 0.08 0.00 0.30 0.87 -0.67 0.00 0.00 178.83 179.41 2emg h LYS 33 N 0.00 0.44 -0.79 1.46 1.57 -1.56 0.19 116.57 117.87 2emg h LYS 33 Ca 0.48 -0.03 0.21 0.00 -1.87 0.00 0.00 60.65 59.45 2emg h LYS 33 Cb 2.92 -0.10 -0.04 0.00 0.08 0.00 0.00 32.23 35.10 2emg h LYS 33 CO -0.01 0.29 0.56 -0.84 -0.57 0.00 0.00 179.45 178.88 2emg h ILE 34 N 0.45 0.64 -0.24 1.86 3.07 -0.27 0.15 117.51 123.17 2emg h ILE 34 Ca 0.42 -0.03 -0.17 0.00 1.55 0.00 0.00 64.86 66.62 2emg h ILE 34 Cb 0.63 0.53 -0.00 0.00 -0.27 0.00 0.00 36.82 37.70 2emg h ILE 34 CO -0.40 0.02 -0.52 0.45 -1.05 0.00 0.00 178.15 176.64 2emg h HIS 35 N 0.10 0.86 -3.43 0.16 3.86 -0.79 -3.35 115.15 112.57 2emg h HIS 35 Ca 0.38 -0.30 -0.60 0.00 -1.16 0.00 0.00 60.37 58.69 2emg h HIS 35 Cb 1.37 -0.17 -0.12 0.00 1.06 0.00 0.00 27.41 29.56 2emg h HIS 35 CO -0.00 1.07 -0.36 -0.08 0.86 0.00 0.00 177.93 179.42 2emg s THR 36 N -4.09 5.30 0.00 2.45 -1.32 0.53 -4.40 115.64 114.11 2emg s THR 36 Ca -0.09 0.45 0.00 0.00 -1.21 0.00 0.00 61.69 60.84 2emg s THR 36 Cb 0.11 -3.60 0.00 0.00 -1.51 0.00 0.00 72.50 67.50 2emg s THR 36 CO 0.86 0.34 0.00 0.61 -2.21 0.00 0.00 174.62 174.22 2emg n GLY 37 N 3.81 1.42 0.27 6.08 0.00 -1.26 -4.83 105.19 110.68 2emg n GLY 37 Ca -0.12 -0.46 -0.20 0.00 0.00 0.00 0.00 46.02 45.23 2emg n GLY 37 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2emg n GLU 38 N 0.00 0.47 -1.68 1.61 4.71 -1.26 -5.00 120.64 119.48 2emg n GLU 38 Ca 0.00 0.18 -0.40 0.00 -0.01 0.00 0.00 57.16 56.93 2emg n GLU 38 Cb 0.00 -1.30 0.03 0.00 -1.01 0.00 0.00 31.44 29.15 2emg n GLU 38 CO 0.00 0.00 0.00 0.54 0.09 0.00 0.00 177.13 177.76 2emg n ARG 39 N -3.70 1.60 -2.22 3.49 5.12 -1.26 -4.92 116.66 114.77 2emg n ARG 39 Ca -0.40 0.58 -0.42 0.00 -1.93 0.00 0.00 57.85 55.68 2emg n ARG 39 Cb 0.82 -2.34 -0.03 0.00 -1.16 0.00 0.00 32.46 29.75 2emg n ARG 39 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 2emg s PRO 40 N -2.44 4.38 0.00 5.56 0.04 -1.26 -4.67 135.00 136.61 2emg s PRO 40 Ca 0.66 2.04 0.05 0.00 0.04 0.00 0.00 61.00 63.80 2emg s PRO 40 Cb -0.48 -3.21 -0.03 0.00 0.04 0.00 0.00 34.50 30.82 2emg s PRO 40 CO 0.54 -0.29 -0.13 -1.12 0.04 0.00 0.00 177.00 176.04 2emg s SER 41 N 0.52 4.18 0.47 6.66 0.01 -1.26 -5.01 113.70 119.26 2emg s SER 41 Ca 0.58 -0.26 -0.23 0.00 1.31 0.00 0.00 55.95 57.35 2emg s SER 41 Cb -0.36 -0.85 -0.07 0.00 0.21 0.00 0.00 66.02 64.95 2emg s SER 41 CO 0.36 0.29 1.22 -0.83 0.41 0.00 0.00 173.24 174.69 2emg s GLY 42 N -1.26 2.82 0.01 3.44 0.00 -1.26 -4.97 107.32 106.11 2emg s GLY 42 Ca 0.15 1.05 -0.23 0.00 0.00 0.00 0.00 44.72 45.68 2emg s GLY 42 CO 0.05 1.53 1.31 -0.56 0.00 0.00 0.00 173.10 175.43 2emg h PRO 43 N 2.03 0.18 -5.29 2.90 0.13 -2.02 -3.42 132.00 126.51 2emg h PRO 43 Ca -0.50 -0.10 -0.63 0.00 -0.87 0.00 0.00 66.00 63.91 2emg h PRO 43 Cb 1.26 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.25 2emg h PRO 43 CO 0.60 0.61 -0.05 -1.12 -0.23 0.00 0.00 178.00 177.81 2emg s SER 44 N -5.91 6.37 -1.01 1.44 0.01 -1.26 -5.00 113.70 108.33 2emg s SER 44 Ca -0.15 0.31 -0.23 0.00 1.31 0.00 0.00 55.95 57.19 2emg s SER 44 Cb 0.03 -2.27 0.03 0.00 0.21 0.00 0.00 66.02 64.03 2emg s SER 44 CO 0.71 -0.34 1.58 -0.44 0.41 0.00 0.00 173.24 175.16 2emg s SER 45 N 1.63 6.21 0.00 2.44 0.01 -1.26 -5.18 113.70 117.55 2emg s SER 45 Ca 0.20 -1.34 0.00 0.00 1.31 0.00 0.00 55.95 56.11 2emg s SER 45 Cb -0.16 -2.57 0.00 0.00 0.21 0.00 0.00 66.02 63.51 2emg s SER 45 CO 0.11 -1.78 0.00 0.61 0.41 0.00 0.00 173.24 172.59