#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 0.52 0.23 1.61 1.04 -1.26 -5.04 113.70 110.81 2emg s SER 2 Ca 0.00 0.39 -0.07 0.00 0.48 0.00 0.00 55.95 56.75 2emg s SER 2 Cb 0.00 0.35 0.35 0.00 0.10 0.00 0.00 66.02 66.82 2emg s SER 2 CO 0.00 -0.23 1.76 -1.28 0.98 0.00 0.00 173.24 174.47 2emg h SER 3 N 8.16 0.38 -3.87 7.02 0.87 -2.14 -3.46 113.55 120.50 2emg h SER 3 Ca -0.18 0.07 -0.21 0.00 -1.23 0.00 0.00 61.79 60.24 2emg h SER 3 Cb 1.12 0.02 0.09 0.00 -0.44 0.00 0.00 62.40 63.19 2emg h SER 3 CO 0.19 0.20 -0.41 0.61 -0.53 0.00 0.00 176.83 176.89 2emg n GLY 4 N -1.30 0.06 3.95 5.77 0.00 -1.26 -5.04 105.19 107.36 2emg n GLY 4 Ca 0.11 -0.15 -0.21 0.00 0.00 0.00 0.00 46.02 45.77 2emg n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2emg s SER 5 N -3.39 5.05 0.16 1.61 0.01 -1.26 -5.15 113.70 110.73 2emg s SER 5 Ca 0.22 -0.85 -0.14 0.00 1.31 0.00 0.00 55.95 56.48 2emg s SER 5 Cb -0.10 -0.08 0.02 0.00 0.21 0.00 0.00 66.02 66.07 2emg s SER 5 CO 0.42 -0.99 0.39 -0.55 0.41 0.00 0.00 173.24 172.92 2emg s SER 6 N -4.36 -0.14 0.00 2.44 0.15 -1.26 -5.10 113.70 105.44 2emg s SER 6 Ca 0.50 -0.55 0.00 0.00 0.70 0.00 0.00 55.95 56.59 2emg s SER 6 Cb -0.05 0.49 0.00 0.00 -1.71 0.00 0.00 66.02 64.75 2emg s SER 6 CO 0.30 -0.92 0.00 0.61 1.20 0.00 0.00 173.24 174.43 2emg n GLY 7 N -0.25 -1.28 2.61 9.45 0.00 -1.26 -5.13 105.19 109.33 2emg n GLY 7 Ca -0.11 0.43 -0.29 0.00 0.00 0.00 0.00 46.02 46.04 2emg n GLY 7 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2emg s THR 8 N 0.00 0.88 0.00 2.61 2.01 -1.26 -4.99 115.64 114.88 2emg s THR 8 Ca 0.00 -2.20 0.00 0.00 0.31 0.00 0.00 61.69 59.80 2emg s THR 8 Cb 0.00 -1.62 0.00 0.00 0.01 0.00 0.00 72.50 70.89 2emg s THR 8 CO 0.00 -0.93 0.00 0.61 -0.69 0.00 0.00 174.62 173.61 2emg n GLY 9 N 3.76 -0.93 3.15 4.40 0.00 -1.26 -5.14 105.19 109.17 2emg n GLY 9 Ca 0.10 0.67 -0.38 0.00 0.00 0.00 0.00 46.02 46.40 2emg n GLY 9 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2emg n GLU 10 N 0.00 0.00 -4.44 1.61 -0.00 -1.26 -4.98 120.64 111.57 2emg n GLU 10 Ca 0.00 0.00 -0.21 0.00 -0.00 0.00 0.00 57.16 56.95 2emg n GLU 10 Cb 0.00 -0.97 -0.14 0.00 -0.00 0.00 0.00 31.44 30.34 2emg n GLU 10 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.13 176.33 2emg s ASN 11 N -0.97 1.66 -0.01 -1.84 0.01 -1.26 -5.06 114.94 107.48 2emg s ASN 11 Ca 0.56 -0.40 -0.25 0.00 -0.71 0.00 0.00 52.86 52.06 2emg s ASN 11 Cb -0.51 -0.13 -0.19 0.00 0.41 0.00 0.00 41.25 40.83 2emg s ASN 11 CO 0.63 0.08 1.28 1.55 -1.51 0.00 0.00 177.10 179.13 2emg h PRO 12 N 5.18 0.08 -2.34 -0.60 0.13 -1.94 -3.48 132.00 129.03 2emg h PRO 12 Ca -0.37 -0.04 -0.01 0.00 -0.87 0.00 0.00 66.00 64.71 2emg h PRO 12 Cb 1.17 0.00 -0.16 0.00 0.13 0.00 0.00 31.00 32.14 2emg h PRO 12 CO 0.45 0.55 0.27 -0.06 -0.23 0.00 0.00 178.00 178.98 2emg s PHE 13 N -4.26 -0.55 -0.11 1.56 0.08 -1.26 -5.03 117.98 108.41 2emg s PHE 13 Ca -0.16 0.69 -0.08 0.00 0.12 0.00 0.00 56.93 57.50 2emg s PHE 13 Cb 0.02 0.48 0.04 0.00 -0.57 0.00 0.00 43.02 42.99 2emg s PHE 13 CO 0.69 -0.66 0.28 0.42 -0.10 0.00 0.00 175.22 175.85 2emg s ILE 14 N -2.31 -0.01 -0.98 0.64 1.01 -1.26 -3.23 121.20 115.05 2emg s ILE 14 Ca -0.04 0.05 -0.24 0.00 0.00 0.00 0.00 60.65 60.43 2emg s ILE 14 Cb -0.01 -0.41 0.01 0.00 0.01 0.00 0.00 42.46 42.06 2emg s ILE 14 CO -0.01 0.02 1.68 0.00 0.00 0.00 0.00 174.94 176.63 2emg h SER 16 N 10.38 0.00 0.33 0.00 0.02 -1.96 1.80 113.55 124.12 2emg h SER 16 Ca 0.16 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 61.10 2emg h SER 16 Cb 1.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.55 2emg h SER 16 CO 1.33 0.00 -0.16 -0.33 -1.14 0.00 0.00 176.83 176.53 2emg h GLU 17 N 0.00 -0.42 0.00 3.45 4.39 -2.00 -3.41 114.58 116.59 2emg h GLU 17 Ca 0.68 0.03 -0.38 0.00 0.34 0.00 0.00 59.36 60.03 2emg h GLU 17 Cb 3.20 0.10 -0.06 0.00 -0.10 0.00 0.00 28.75 31.88 2emg h GLU 17 CO -0.01 -0.28 -2.39 0.00 -1.16 0.00 0.00 179.01 175.17 2emg n GLY 19 N 2.03 0.89 3.62 0.00 0.00 0.59 -4.99 105.19 107.33 2emg n GLY 19 Ca -0.45 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.22 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 0.23 3.96 0.01 1.61 2.20 -1.26 -4.70 119.74 121.79 2emg s LYS 20 Ca 0.00 -0.35 -0.22 0.00 -0.36 0.00 0.00 55.97 55.05 2emg s LYS 20 Cb 0.00 -3.26 -0.05 0.00 -1.51 0.00 0.00 37.83 33.01 2emg s LYS 20 CO 0.00 0.22 0.64 0.54 -0.36 0.00 0.00 175.35 176.39 2emg s VAL 21 N 0.53 4.86 0.08 4.02 0.11 -1.26 -1.59 120.40 127.16 2emg s VAL 21 Ca 0.04 1.35 0.09 0.00 -2.93 0.00 0.00 61.98 60.52 2emg s VAL 21 Cb -0.13 -3.98 -0.03 0.00 -1.53 0.00 0.00 36.38 30.71 2emg s VAL 21 CO 0.01 0.40 -0.23 -0.36 -3.33 0.00 0.00 175.10 171.59 2emg s PHE 22 N -0.14 1.96 0.06 1.54 0.40 -1.20 -5.02 117.98 115.58 2emg s PHE 22 Ca 0.33 -0.40 -0.19 0.00 -0.60 0.00 0.00 56.93 56.07 2emg s PHE 22 Cb -0.19 -1.11 -0.13 0.00 0.51 0.00 0.00 43.02 42.11 2emg s PHE 22 CO 0.19 0.19 1.38 1.15 0.70 0.00 0.00 175.22 178.83 2emg h THR 23 N 4.13 1.33 -3.75 0.64 2.02 -1.98 -3.37 112.91 111.94 2emg h THR 23 Ca -0.46 -1.29 -0.68 0.00 0.77 0.00 0.00 66.41 64.74 2emg h THR 23 Cb 1.17 1.77 -0.19 0.00 -1.74 0.00 0.00 68.15 69.15 2emg h THR 23 CO 0.41 0.39 -0.72 -2.28 0.37 0.00 0.00 175.52 173.69 2emg s HIS 24 N -4.38 2.83 0.58 3.16 5.65 -1.26 -4.95 115.29 116.93 2emg s HIS 24 Ca -0.14 -0.06 0.28 0.00 0.25 0.00 0.00 55.06 55.39 2emg s HIS 24 Cb 0.06 -1.63 1.73 0.00 -1.18 0.00 0.00 32.58 31.56 2emg s HIS 24 CO 0.77 0.31 2.22 -0.22 -0.65 0.00 0.00 174.74 177.17 2emg h LYS 25 N 4.93 0.00 -0.27 2.88 3.64 -1.96 -1.64 116.57 124.16 2emg h LYS 25 Ca -0.48 0.00 -0.19 0.00 -1.27 0.00 0.00 60.65 58.71 2emg h LYS 25 Cb 1.16 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.99 2emg h LYS 25 CO 0.52 0.00 -0.58 0.00 -2.27 0.00 0.00 179.45 177.12 2emg h THR 26 N 0.00 1.27 -0.54 1.00 1.03 -1.98 -2.49 112.91 111.20 2emg h THR 26 Ca 0.01 -1.76 -0.05 0.00 -0.01 0.00 0.00 66.41 64.60 2emg h THR 26 Cb 0.07 1.69 -0.02 0.00 -1.07 0.00 0.00 68.15 68.81 2emg h THR 26 CO -0.00 0.57 0.13 -1.13 -0.01 0.00 0.00 175.52 175.08 2emg h ASN 27 N 0.65 0.78 0.06 0.00 -0.73 -1.72 -2.15 115.58 112.47 2emg h ASN 27 Ca 0.00 -0.14 -0.00 0.00 1.87 0.00 0.00 56.30 58.03 2emg h ASN 27 Cb 1.20 -0.20 0.00 0.00 0.27 0.00 0.00 38.32 39.58 2emg h ASN 27 CO 0.13 0.77 -0.03 0.25 -0.37 0.00 0.00 177.43 178.17 2emg h LEU 28 N 0.80 -0.07 -0.82 0.34 5.85 -1.47 -2.58 115.31 117.36 2emg h LEU 28 Ca 0.18 -0.36 0.11 0.00 0.84 0.00 0.00 57.88 58.65 2emg h LEU 28 Cb 0.30 0.02 -0.08 0.00 0.37 0.00 0.00 40.66 41.27 2emg h LEU 28 CO -0.00 0.33 0.44 0.40 -0.34 0.00 0.00 178.44 179.28 2emg h ILE 29 N -0.49 0.84 -0.21 4.05 2.04 -1.35 0.48 117.51 122.87 2emg h ILE 29 Ca -0.01 -0.24 -0.04 0.00 1.00 0.00 0.00 64.86 65.57 2emg h ILE 29 Cb 0.43 0.07 -0.01 0.00 -0.74 0.00 0.00 36.82 36.57 2emg h ILE 29 CO 0.01 0.13 -0.07 0.40 0.00 0.00 0.00 178.15 178.62 2emg h ILE 30 N 0.70 1.17 0.10 -0.67 2.04 -1.37 -3.08 117.51 116.41 2emg h ILE 30 Ca 0.41 -0.71 -0.00 0.00 1.00 0.00 0.00 64.86 65.56 2emg h ILE 30 Cb 0.47 1.09 0.00 0.00 -0.74 0.00 0.00 36.82 37.64 2emg h ILE 30 CO -0.29 0.23 -0.05 -0.74 0.00 0.00 0.00 178.15 177.30 2emg h HIS 31 N 0.31 -0.12 -0.67 1.37 -0.00 -0.56 -3.13 115.15 112.35 2emg h HIS 31 Ca 0.07 -0.00 0.19 0.00 -0.00 0.00 0.00 60.37 60.63 2emg h HIS 31 Cb 0.32 0.04 -0.03 0.00 -0.00 0.00 0.00 27.41 27.74 2emg h HIS 31 CO 0.01 0.39 1.02 1.96 -0.00 0.00 0.00 177.93 181.31 2emg h GLN 32 N -0.76 0.00 -1.00 5.26 4.20 -1.01 0.25 115.11 122.05 2emg h GLN 32 Ca -0.01 0.00 0.24 0.00 0.06 0.00 0.00 58.65 58.93 2emg h GLN 32 Cb 0.57 0.00 -0.12 0.00 0.30 0.00 0.00 27.48 28.22 2emg h GLN 32 CO 0.02 0.00 0.59 0.87 -0.67 0.00 0.00 178.83 179.64 2emg h LYS 33 N 0.00 0.59 0.00 1.46 1.79 -1.55 0.69 116.57 119.55 2emg h LYS 33 Ca 0.32 -0.04 -0.00 0.00 -2.18 0.00 0.00 60.65 58.75 2emg h LYS 33 Cb 2.36 -0.13 -0.00 0.00 -1.58 0.00 0.00 32.23 32.88 2emg h LYS 33 CO -0.00 0.39 -0.01 -0.84 -1.08 0.00 0.00 179.45 177.91 2emg h ILE 34 N 0.61 0.71 0.09 1.86 3.07 -0.73 -1.59 117.51 121.53 2emg h ILE 34 Ca 0.63 -0.04 -0.26 0.00 1.55 0.00 0.00 64.86 66.75 2emg h ILE 34 Cb 1.16 1.02 0.00 0.00 -0.27 0.00 0.00 36.82 38.74 2emg h ILE 34 CO -0.46 0.01 -1.14 0.45 -1.05 0.00 0.00 178.15 175.95 2emg h HIS 35 N 0.00 0.50 -3.55 0.16 3.86 0.21 -3.39 115.15 112.95 2emg h HIS 35 Ca -0.00 -0.33 -0.79 0.00 -1.16 0.00 0.00 60.37 58.08 2emg h HIS 35 Cb 0.02 -0.03 -0.29 0.00 1.06 0.00 0.00 27.41 28.17 2emg h HIS 35 CO 0.00 1.22 0.40 -0.08 0.86 0.00 0.00 177.93 180.34 2emg s THR 36 N -2.83 5.87 -0.32 2.45 -1.32 -0.60 -4.65 115.64 114.23 2emg s THR 36 Ca -0.04 -3.46 0.02 0.00 -1.21 0.00 0.00 61.69 57.00 2emg s THR 36 Cb 0.08 -4.53 0.12 0.00 -1.51 0.00 0.00 72.50 66.66 2emg s THR 36 CO 0.87 -1.18 1.12 0.61 -2.21 0.00 0.00 174.62 173.84 2emg n GLY 37 N 2.68 -0.67 3.16 6.08 0.00 -1.25 -4.88 105.19 110.30 2emg n GLY 37 Ca 0.24 0.08 -0.23 0.00 0.00 0.00 0.00 46.02 46.11 2emg n GLY 37 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2emg s GLU 38 N 0.05 1.22 0.19 1.61 1.03 -1.26 -5.10 118.70 116.44 2emg s GLU 38 Ca 0.07 -0.67 -0.19 0.00 0.03 0.00 0.00 54.97 54.21 2emg s GLU 38 Cb 0.11 -1.22 -0.08 0.00 -0.80 0.00 0.00 34.13 32.15 2emg s GLU 38 CO -0.04 0.32 0.68 -0.98 -1.33 0.00 0.00 175.26 173.91 2emg s ARG 39 N -0.68 4.21 0.89 -4.83 1.70 -1.26 -5.07 118.95 113.92 2emg s ARG 39 Ca 0.05 0.80 -0.12 0.00 -0.47 0.00 0.00 55.73 55.99 2emg s ARG 39 Cb -0.07 -2.95 0.13 0.00 -0.57 0.00 0.00 34.95 31.49 2emg s ARG 39 CO 0.00 0.45 1.09 -1.25 -1.08 0.00 0.00 175.30 174.51 2emg s PRO 40 N -1.84 1.27 0.16 3.89 0.04 -1.26 -4.94 135.00 132.33 2emg s PRO 40 Ca 0.40 0.82 -0.30 0.00 0.04 0.00 0.00 61.00 61.97 2emg s PRO 40 Cb -0.17 -1.81 -0.04 0.00 0.04 0.00 0.00 34.50 32.52 2emg s PRO 40 CO 0.21 -2.23 1.55 0.77 0.04 0.00 0.00 177.00 177.33 2emg h SER 41 N -1.54 -1.97 0.00 6.66 0.02 -1.99 -3.48 113.55 111.25 2emg h SER 41 Ca -0.49 0.30 0.00 0.00 -0.84 0.00 0.00 61.79 60.76 2emg h SER 41 Cb 1.28 0.87 0.00 0.00 0.14 0.00 0.00 62.40 64.70 2emg h SER 41 CO 0.55 -0.28 0.00 0.61 -1.14 0.00 0.00 176.83 176.56 2emg n GLY 42 N -1.31 -0.50 0.13 -3.77 0.00 -1.26 -4.94 105.19 93.54 2emg n GLY 42 Ca 0.02 -0.99 0.12 0.00 0.00 0.00 0.00 46.02 45.17 2emg n GLY 42 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2emg n PRO 43 N 0.00 0.19 -1.31 1.61 -0.04 -1.26 -4.80 135.00 129.39 2emg n PRO 43 Ca 0.00 0.43 -0.39 0.00 -0.04 0.00 0.00 63.50 63.49 2emg n PRO 43 Cb 0.00 -1.87 -0.13 0.00 -0.04 0.00 0.00 33.50 31.46 2emg n PRO 43 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2emg n SER 44 N -2.24 0.33 0.00 3.54 7.64 -1.26 -4.57 113.62 117.06 2emg n SER 44 Ca 0.02 0.24 0.00 0.00 1.01 0.00 0.00 58.87 60.14 2emg n SER 44 Cb 0.23 -0.82 0.00 0.00 -1.01 0.00 0.00 64.21 62.61 2emg n SER 44 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2emg n SER 45 N 8.95 1.28 0.00 6.43 3.41 -1.26 -5.11 113.62 127.32 2emg n SER 45 Ca 0.57 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 59.18 2emg n SER 45 Cb 0.02 0.05 0.00 0.00 -0.26 0.00 0.00 64.21 64.01 2emg n SER 45 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49