#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 0.23 -0.60 1.61 0.15 -1.26 -5.11 113.70 108.72 2emg s SER 2 Ca 0.00 -0.60 -0.20 0.00 0.70 0.00 0.00 55.95 55.86 2emg s SER 2 Cb 0.00 0.20 0.10 0.00 -1.71 0.00 0.00 66.02 64.61 2emg s SER 2 CO 0.00 -0.49 0.75 -0.55 1.20 0.00 0.00 173.24 174.15 2emg s SER 3 N -2.13 6.18 0.60 5.45 0.15 -1.26 -4.93 113.70 117.76 2emg s SER 3 Ca -0.05 -1.36 0.00 0.00 0.70 0.00 0.00 55.95 55.24 2emg s SER 3 Cb -0.01 -2.32 0.00 0.00 -1.71 0.00 0.00 66.02 61.98 2emg s SER 3 CO -0.05 -1.17 0.00 0.61 1.20 0.00 0.00 173.24 173.83 2emg n GLY 4 N 5.29 -3.41 3.64 9.45 0.00 -1.26 -5.04 105.19 113.86 2emg n GLY 4 Ca -0.09 -1.05 -0.10 0.00 0.00 0.00 0.00 46.02 44.79 2emg n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2emg s SER 5 N -7.05 -0.59 -0.42 1.61 1.04 -1.26 -5.06 113.70 101.97 2emg s SER 5 Ca 0.00 1.10 0.05 0.00 0.48 0.00 0.00 55.95 57.58 2emg s SER 5 Cb 0.00 1.14 0.43 0.00 0.10 0.00 0.00 66.02 67.69 2emg s SER 5 CO 0.00 -0.19 1.22 -1.20 0.98 0.00 0.00 173.24 174.06 2emg n SER 6 N 2.73 5.06 0.00 7.02 7.64 -1.26 -5.05 113.62 129.76 2emg n SER 6 Ca -0.14 -3.74 0.00 0.00 1.01 0.00 0.00 58.87 56.00 2emg n SER 6 Cb 0.56 -0.47 0.00 0.00 -1.01 0.00 0.00 64.21 63.29 2emg n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2emg n GLY 7 N -0.58 1.24 3.03 0.23 0.00 -1.26 -4.45 105.19 103.41 2emg n GLY 7 Ca 0.43 0.50 -0.09 0.00 0.00 0.00 0.00 46.02 46.85 2emg n GLY 7 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2emg s THR 8 N 0.00 0.11 0.18 2.61 -1.32 -1.26 -5.17 115.64 110.79 2emg s THR 8 Ca 0.00 -0.92 -0.12 0.00 -1.21 0.00 0.00 61.69 59.43 2emg s THR 8 Cb 0.00 -0.45 0.01 0.00 -1.51 0.00 0.00 72.50 70.55 2emg s THR 8 CO 0.00 -0.51 0.39 -0.83 -2.21 0.00 0.00 174.62 171.46 2emg s GLY 9 N -1.60 0.26 0.02 6.08 0.00 -1.26 -5.18 107.32 105.64 2emg s GLY 9 Ca -0.13 -0.63 -0.14 0.00 0.00 0.00 0.00 44.72 43.81 2emg s GLY 9 CO -0.01 -0.61 0.31 -1.83 0.00 0.00 0.00 173.10 170.96 2emg s GLU 10 N -3.93 0.75 -0.21 2.90 -1.05 -1.26 -5.17 118.70 110.73 2emg s GLU 10 Ca 0.14 -0.37 -0.15 0.00 -0.15 0.00 0.00 54.97 54.44 2emg s GLU 10 Cb 0.01 0.33 0.06 0.00 -0.44 0.00 0.00 34.13 34.09 2emg s GLU 10 CO -0.01 -0.23 0.53 0.54 0.95 0.00 0.00 175.26 177.05 2emg s ASN 11 N -1.75 -0.63 0.00 0.83 4.22 -1.26 -5.12 114.94 111.23 2emg s ASN 11 Ca -0.09 1.12 0.00 0.00 -2.14 0.00 0.00 52.86 51.75 2emg s ASN 11 Cb -0.03 1.06 0.00 0.00 1.28 0.00 0.00 41.25 43.56 2emg s ASN 11 CO -0.00 -0.20 0.00 -0.81 -2.04 0.00 0.00 177.10 174.05 2emg n PRO 12 N 3.57 0.00 -4.74 3.55 -0.04 -1.26 -4.95 135.00 131.13 2emg n PRO 12 Ca -0.18 0.00 -0.31 0.00 -0.04 0.00 0.00 63.50 62.97 2emg n PRO 12 Cb 0.57 -0.23 -0.13 0.00 -0.04 0.00 0.00 33.50 33.67 2emg n PRO 12 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 2emg s PHE 13 N 0.00 2.60 0.05 0.54 0.08 -1.25 -5.07 117.98 114.93 2emg s PHE 13 Ca 0.00 -0.23 0.01 0.00 0.12 0.00 0.00 56.93 56.83 2emg s PHE 13 Cb 0.00 -1.51 -0.03 0.00 -0.57 0.00 0.00 43.02 40.91 2emg s PHE 13 CO 0.00 0.23 -0.05 0.42 -0.10 0.00 0.00 175.22 175.71 2emg s ILE 14 N -0.87 0.41 -0.31 0.64 -1.09 -1.26 -2.98 121.20 115.74 2emg s ILE 14 Ca 0.14 -1.42 -0.12 0.00 -2.23 0.00 0.00 60.65 57.02 2emg s ILE 14 Cb -0.11 -1.00 -0.03 0.00 -1.58 0.00 0.00 42.46 39.74 2emg s ILE 14 CO 0.04 -0.67 0.22 0.00 -1.23 0.00 0.00 174.94 173.30 2emg n SER 16 N 5.10 0.00 -0.10 0.00 2.88 -1.26 -0.57 113.62 119.67 2emg n SER 16 Ca -0.13 -0.51 -0.23 0.00 -1.33 0.00 0.00 58.87 56.66 2emg n SER 16 Cb 0.51 -0.04 -0.12 0.00 -0.75 0.00 0.00 64.21 63.81 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 -1.04 0.60 0.00 -1.46 -0.58 -1.26 -4.85 120.64 112.05 2emg n GLU 17 Ca 0.14 0.44 -0.02 0.00 -0.42 0.00 0.00 57.16 57.30 2emg n GLU 17 Cb 0.08 -1.67 -0.01 0.00 -0.57 0.00 0.00 31.44 29.27 2emg n GLU 17 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2emg n GLY 19 N 2.98 1.57 3.93 0.00 0.00 0.26 -4.99 105.19 108.93 2emg n GLY 19 Ca -0.03 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.73 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 0.00 2.77 -0.15 1.61 2.20 -1.26 -4.72 119.74 120.18 2emg s LYS 20 Ca 0.00 -0.13 0.01 0.00 -0.36 0.00 0.00 55.97 55.49 2emg s LYS 20 Cb 0.00 -2.28 0.01 0.00 -1.51 0.00 0.00 37.83 34.04 2emg s LYS 20 CO 0.00 -0.77 -0.18 0.08 -0.36 0.00 0.00 175.35 174.11 2emg s VAL 21 N -3.00 2.34 -0.07 4.02 1.01 -1.26 -2.28 120.40 121.16 2emg s VAL 21 Ca 0.55 -0.88 0.05 0.00 0.00 0.00 0.00 61.98 61.70 2emg s VAL 21 Cb -0.11 -1.97 -0.01 0.00 0.00 0.00 0.00 36.38 34.30 2emg s VAL 21 CO 0.44 0.53 -0.24 -0.36 0.00 0.00 0.00 175.10 175.47 2emg s PHE 22 N 0.91 2.50 0.14 5.22 0.40 -1.16 -5.03 117.98 120.97 2emg s PHE 22 Ca -0.04 -0.79 -0.12 0.00 -0.60 0.00 0.00 56.93 55.37 2emg s PHE 22 Cb -0.15 -1.64 -0.01 0.00 0.51 0.00 0.00 43.02 41.72 2emg s PHE 22 CO -0.03 -0.26 1.54 1.15 0.70 0.00 0.00 175.22 178.32 2emg h THR 23 N 5.23 1.27 -3.34 0.64 2.02 -1.99 -3.32 112.91 113.42 2emg h THR 23 Ca -0.28 -1.25 -0.66 0.00 0.77 0.00 0.00 66.41 64.99 2emg h THR 23 Cb 1.19 1.17 -0.28 0.00 -1.74 0.00 0.00 68.15 68.49 2emg h THR 23 CO 0.48 0.42 -0.74 -2.28 0.37 0.00 0.00 175.52 173.77 2emg s HIS 24 N -4.76 2.92 0.33 3.16 5.65 -1.26 -4.89 115.29 116.43 2emg s HIS 24 Ca -0.12 -0.94 0.10 0.00 0.25 0.00 0.00 55.06 54.35 2emg s HIS 24 Cb 0.11 -2.03 0.98 0.00 -1.18 0.00 0.00 32.58 30.45 2emg s HIS 24 CO 0.84 -0.50 1.60 1.57 -0.65 0.00 0.00 174.74 177.60 2emg h LYS 25 N 7.79 0.09 -0.98 2.88 2.10 -2.01 0.71 116.57 127.15 2emg h LYS 25 Ca -0.39 -0.01 0.24 0.00 -2.00 0.00 0.00 60.65 58.50 2emg h LYS 25 Cb 1.17 -0.02 -0.12 0.00 -0.90 0.00 0.00 32.23 32.35 2emg h LYS 25 CO 0.60 0.06 0.54 0.00 -2.00 0.00 0.00 179.45 178.65 2emg h THR 26 N 0.09 0.52 -0.11 0.07 1.03 -1.97 0.59 112.91 113.12 2emg h THR 26 Ca 0.69 -0.18 -0.09 0.00 -0.01 0.00 0.00 66.41 66.81 2emg h THR 26 Cb 1.58 -0.06 -0.01 0.00 -1.07 0.00 0.00 68.15 68.59 2emg h THR 26 CO -0.77 0.10 -0.35 -1.13 -0.01 0.00 0.00 175.52 173.35 2emg h ASN 27 N 0.53 0.24 -0.01 0.00 -0.73 0.03 -2.03 115.58 113.61 2emg h ASN 27 Ca 0.63 -0.09 -0.02 0.00 1.87 0.00 0.00 56.30 58.69 2emg h ASN 27 Cb 1.19 -0.07 0.00 0.00 0.27 0.00 0.00 38.32 39.72 2emg h ASN 27 CO -0.49 0.58 -0.08 0.25 -0.37 0.00 0.00 177.43 177.32 2emg h LEU 28 N 0.20 0.08 -0.61 0.34 5.85 0.15 -1.80 115.31 119.51 2emg h LEU 28 Ca 0.02 -0.72 0.04 0.00 0.84 0.00 0.00 57.88 58.06 2emg h LEU 28 Cb 0.73 -0.03 -0.05 0.00 0.37 0.00 0.00 40.66 41.68 2emg h LEU 28 CO 0.05 0.79 0.35 0.40 -0.34 0.00 0.00 178.44 179.70 2emg h ILE 29 N -0.62 1.01 -0.04 4.05 2.04 -0.73 0.16 117.51 123.37 2emg h ILE 29 Ca -0.01 -0.23 -0.11 0.00 1.00 0.00 0.00 64.86 65.51 2emg h ILE 29 Cb 0.80 0.28 -0.01 0.00 -0.74 0.00 0.00 36.82 37.14 2emg h ILE 29 CO 0.02 0.12 -0.49 0.40 0.00 0.00 0.00 178.15 178.20 2emg h ILE 30 N 0.67 1.35 0.06 -0.67 2.04 -1.45 -3.23 117.51 116.28 2emg h ILE 30 Ca 0.26 -1.70 -0.00 0.00 1.00 0.00 0.00 64.86 64.42 2emg h ILE 30 Cb 0.11 1.87 0.00 0.00 -0.74 0.00 0.00 36.82 38.05 2emg h ILE 30 CO -0.14 0.50 -0.03 -0.74 0.00 0.00 0.00 178.15 177.73 2emg h HIS 31 N 0.09 -0.08 -0.66 1.37 -0.00 -0.42 -3.09 115.15 112.37 2emg h HIS 31 Ca 0.00 -0.00 0.19 0.00 -0.00 0.00 0.00 60.37 60.56 2emg h HIS 31 Cb 0.90 0.03 -0.03 0.00 -0.00 0.00 0.00 27.41 28.31 2emg h HIS 31 CO 0.01 0.45 1.01 1.96 -0.00 0.00 0.00 177.93 181.35 2emg h GLN 32 N -0.66 0.00 -0.58 5.26 4.20 -0.74 0.50 115.11 123.09 2emg h GLN 32 Ca -0.01 0.00 0.04 0.00 0.06 0.00 0.00 58.65 58.75 2emg h GLN 32 Cb 0.56 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 28.29 2emg h GLN 32 CO 0.01 0.00 0.32 0.87 -0.67 0.00 0.00 178.83 179.36 2emg h LYS 33 N 0.00 0.59 -0.15 1.46 1.57 -1.62 -0.82 116.57 117.59 2emg h LYS 33 Ca 0.31 -0.04 0.04 0.00 -1.87 0.00 0.00 60.65 59.10 2emg h LYS 33 Cb 2.32 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 34.49 2emg h LYS 33 CO -0.00 0.39 0.67 -0.84 -0.57 0.00 0.00 179.45 179.10 2emg h ILE 34 N 0.61 0.04 0.08 1.86 3.07 -0.19 0.84 117.51 123.82 2emg h ILE 34 Ca 0.25 0.00 -0.33 0.00 1.55 0.00 0.00 64.86 66.33 2emg h ILE 34 Cb 0.12 0.36 -0.03 0.00 -0.27 0.00 0.00 36.82 37.01 2emg h ILE 34 CO -0.15 0.00 -1.85 0.45 -1.05 0.00 0.00 178.15 175.54 2emg h HIS 35 N 0.00 0.30 -1.59 0.16 3.86 -1.31 -3.39 115.15 113.19 2emg h HIS 35 Ca 0.07 -0.22 -0.63 0.00 -1.16 0.00 0.00 60.37 58.43 2emg h HIS 35 Cb 1.42 -0.01 -0.38 0.00 1.06 0.00 0.00 27.41 29.49 2emg h HIS 35 CO 0.00 1.46 -0.27 -2.37 0.86 0.00 0.00 177.93 177.61 2emg n THR 36 N -3.32 2.70 0.08 2.45 5.66 0.27 -4.73 114.28 117.39 2emg n THR 36 Ca -0.25 -4.72 0.00 0.00 -3.05 0.00 0.00 64.05 56.03 2emg n THR 36 Cb 1.05 -1.25 0.00 0.00 -1.55 0.00 0.00 70.33 68.58 2emg n THR 36 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2emg n GLY 37 N -0.51 -0.15 2.96 1.09 0.00 -0.07 -4.92 105.19 103.58 2emg n GLY 37 Ca 0.43 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 46.10 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 -3.32 2.87 -4.75 1.61 -0.58 -1.26 -5.04 120.64 110.18 2emg n GLU 38 Ca 0.00 -4.53 -0.27 0.00 -0.42 0.00 0.00 57.16 51.94 2emg n GLU 38 Cb 0.00 -2.39 -0.14 0.00 -0.57 0.00 0.00 31.44 28.33 2emg n GLU 38 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 2emg s ARG 39 N -1.82 1.51 0.16 3.49 1.81 -1.26 -5.05 118.95 117.80 2emg s ARG 39 Ca 0.30 -0.93 -0.08 0.00 -1.72 0.00 0.00 55.73 53.29 2emg s ARG 39 Cb -0.01 -1.60 0.02 0.00 -0.45 0.00 0.00 34.95 32.91 2emg s ARG 39 CO -0.07 0.42 1.50 -1.00 -0.68 0.00 0.00 175.30 175.46 2emg h PRO 40 N 4.99 0.85 -4.13 3.54 0.13 -1.99 -3.38 132.00 132.00 2emg h PRO 40 Ca -0.43 -0.45 -0.76 0.00 -0.87 0.00 0.00 66.00 63.49 2emg h PRO 40 Cb 1.15 0.02 -0.24 0.00 0.13 0.00 0.00 31.00 32.06 2emg h PRO 40 CO 0.44 1.09 0.27 -1.54 -0.23 0.00 0.00 178.00 178.03 2emg s SER 41 N -6.85 6.72 0.00 1.44 1.04 -1.26 -4.97 113.70 109.82 2emg s SER 41 Ca -0.10 -2.51 0.00 0.00 0.48 0.00 0.00 55.95 53.82 2emg s SER 41 Cb 0.11 -2.26 0.00 0.00 0.10 0.00 0.00 66.02 63.98 2emg s SER 41 CO 0.87 -0.70 0.00 0.61 0.98 0.00 0.00 173.24 175.00 2emg n GLY 42 N 4.37 4.32 3.55 7.32 0.00 -1.26 -5.09 105.19 118.40 2emg n GLY 42 Ca 0.15 -1.09 -0.35 0.00 0.00 0.00 0.00 46.02 44.73 2emg n GLY 42 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2emg s PRO 43 N 1.19 2.61 -0.23 1.61 0.04 -1.26 -4.85 135.00 134.10 2emg s PRO 43 Ca 0.00 0.38 -0.02 0.00 0.04 0.00 0.00 61.00 61.40 2emg s PRO 43 Cb 0.00 -4.56 0.07 0.00 0.04 0.00 0.00 34.50 30.05 2emg s PRO 43 CO 0.00 -2.90 2.39 -1.13 0.04 0.00 0.00 177.00 175.40 2emg n SER 44 N 13.08 6.06 -4.32 6.66 3.41 -1.26 -4.77 113.62 132.48 2emg n SER 44 Ca 0.26 -2.87 -0.38 0.00 -0.26 0.00 0.00 58.87 55.62 2emg n SER 44 Cb 0.51 -1.16 -0.05 0.00 -0.26 0.00 0.00 64.21 63.25 2emg n SER 44 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2emg n SER 45 N 1.00 -2.48 0.00 4.04 7.64 -1.26 -5.31 113.62 117.25 2emg n SER 45 Ca 0.29 -1.10 0.00 0.00 1.01 0.00 0.00 58.87 59.07 2emg n SER 45 Cb 0.60 -2.35 0.00 0.00 -1.01 0.00 0.00 64.21 61.45 2emg n SER 45 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64