#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2emb s SER 2 N 0.00 -0.61 0.00 1.61 1.04 -1.26 -5.08 113.70 109.40 2emb s SER 2 Ca 0.00 0.54 0.00 0.00 0.48 0.00 0.00 55.95 56.97 2emb s SER 2 Cb 0.00 0.53 0.00 0.00 0.10 0.00 0.00 66.02 66.65 2emb s SER 2 CO 0.00 -0.66 0.00 -1.20 0.98 0.00 0.00 173.24 172.36 2emb n SER 3 N 0.62 0.61 0.00 7.02 7.64 -1.26 -5.03 113.62 123.22 2emb n SER 3 Ca -0.18 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.70 2emb n SER 3 Cb 0.59 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.79 2emb n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2emb n GLY 4 N 2.60 1.29 3.35 0.23 0.00 -1.26 -4.90 105.19 106.50 2emb n GLY 4 Ca 0.00 -0.06 -0.34 0.00 0.00 0.00 0.00 46.02 45.62 2emb n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2emb s SER 5 N 0.00 4.18 -0.21 1.61 0.15 -1.26 -5.01 113.70 113.16 2emb s SER 5 Ca 0.00 -0.35 -0.20 0.00 0.70 0.00 0.00 55.95 56.10 2emb s SER 5 Cb 0.00 -1.68 -0.18 0.00 -1.71 0.00 0.00 66.02 62.45 2emb s SER 5 CO 0.00 0.08 0.15 -1.54 1.20 0.00 0.00 173.24 173.13 2emb n SER 6 N 4.13 1.86 0.16 5.45 3.41 -1.26 -4.49 113.62 122.88 2emb n SER 6 Ca -0.18 0.43 -0.14 0.00 -0.26 0.00 0.00 58.87 58.71 2emb n SER 6 Cb 0.52 -0.95 -0.07 0.00 -0.26 0.00 0.00 64.21 63.45 2emb n SER 6 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 2emb h GLY 7 N -1.00 -0.76 -6.98 5.00 0.00 -2.02 -3.45 103.07 93.85 2emb h GLY 7 Ca -0.35 0.42 -0.59 0.00 0.00 0.00 0.00 47.33 46.81 2emb h GLY 7 CO -0.21 -0.28 -0.90 1.57 0.00 0.00 0.00 176.54 176.72 2emb n HIS 8 N -5.45 -1.39 0.08 5.60 -0.00 -1.26 -4.81 115.22 107.99 2emb n HIS 8 Ca -0.08 0.70 -0.00 0.00 -0.00 0.00 0.00 57.72 58.34 2emb n HIS 8 Cb 0.36 -2.60 -0.04 0.00 -0.00 0.00 0.00 29.99 27.71 2emb n HIS 8 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2emb h THR 9 N -1.38 0.79 -3.99 3.57 1.03 -1.98 -3.46 112.91 107.50 2emb h THR 9 Ca -0.62 -2.26 -0.47 0.00 -0.01 0.00 0.00 66.41 63.05 2emb h THR 9 Cb 1.39 2.30 0.01 0.00 -1.07 0.00 0.00 68.15 70.77 2emb h THR 9 CO 0.79 0.45 0.39 -0.60 -0.01 0.00 0.00 175.52 176.54 2emb s ARG 10 N -2.90 4.17 -0.17 0.00 3.52 -1.26 -5.05 118.95 117.25 2emb s ARG 10 Ca 0.00 1.40 -0.30 0.00 -0.13 0.00 0.00 55.73 56.70 2emb s ARG 10 Cb 0.08 -2.44 0.14 0.00 -1.56 0.00 0.00 34.95 31.17 2emb s ARG 10 CO 0.79 -0.12 1.05 0.21 -0.81 0.00 0.00 175.30 176.41 2emb s LYS 11 N -2.68 0.52 0.03 5.12 2.36 -1.26 -5.18 119.74 118.66 2emb s LYS 11 Ca 0.59 0.12 0.03 0.00 -2.55 0.00 0.00 55.97 54.16 2emb s LYS 11 Cb -0.18 0.25 -0.02 0.00 -1.05 0.00 0.00 37.83 36.82 2emb s LYS 11 CO 0.23 -0.16 -0.09 -0.98 1.55 0.00 0.00 175.35 175.90 2emb s ARG 12 N -1.14 0.61 -0.04 4.03 1.70 -1.26 -5.08 118.95 117.76 2emb s ARG 12 Ca -0.00 -0.60 -0.25 0.00 -0.47 0.00 0.00 55.73 54.41 2emb s ARG 12 Cb -0.01 -0.50 -0.04 0.00 -0.57 0.00 0.00 34.95 33.83 2emb s ARG 12 CO 0.00 0.12 0.76 0.71 -1.08 0.00 0.00 175.30 175.81 2emb s TYR 13 N -0.89 3.61 0.09 5.89 1.51 -1.25 -4.97 117.35 121.33 2emb s TYR 13 Ca -0.04 1.36 0.08 0.00 -1.01 0.00 0.00 57.07 57.46 2emb s TYR 13 Cb -0.07 -2.86 -0.04 0.00 -0.11 0.00 0.00 41.96 38.88 2emb s TYR 13 CO 0.00 0.09 -0.16 -1.21 -1.11 0.00 0.00 175.55 173.16 2emb s GLU 14 N 0.74 1.95 0.81 -0.62 8.01 -1.26 -2.37 118.70 125.97 2emb s GLU 14 Ca 0.40 -1.08 -0.12 0.00 0.01 0.00 0.00 54.97 54.19 2emb s GLU 14 Cb -0.19 -2.18 0.08 0.00 -4.31 0.00 0.00 34.13 27.53 2emb s GLU 14 CO 0.20 0.51 1.14 0.00 0.01 0.00 0.00 175.26 177.13 2emb n SER 16 N -3.38 2.16 -0.01 0.00 2.88 -1.26 -3.68 113.62 110.33 2emb n SER 16 Ca 0.07 -0.10 -0.00 0.00 -1.33 0.00 0.00 58.87 57.51 2emb n SER 16 Cb 0.59 -0.17 -0.00 0.00 -0.75 0.00 0.00 64.21 63.88 2emb n SER 16 CO 0.00 0.00 0.00 0.50 -1.23 0.00 0.00 175.04 174.31 2emb h LYS 17 N 0.00 0.00 0.00 -1.46 3.64 -2.00 -3.38 116.57 113.37 2emb h LYS 17 Ca -0.47 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.91 2emb h LYS 17 Cb 1.77 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.59 2emb h LYS 17 CO -0.06 0.00 0.00 0.00 -2.27 0.00 0.00 179.45 177.12 2emb n GLN 19 N -2.78 -6.81 -1.44 0.00 6.02 -1.24 -4.97 117.38 106.16 2emb n GLN 19 Ca 0.04 0.75 -0.13 0.00 -0.01 0.00 0.00 57.00 57.65 2emb n GLN 19 Cb 0.46 -5.71 0.08 0.00 1.02 0.00 0.00 30.24 26.09 2emb n GLN 19 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2emb n ALA 20 N -4.70 -0.19 -2.45 -1.58 0.00 -1.26 -4.59 120.51 105.73 2emb n ALA 20 Ca -0.07 -1.00 -0.21 0.00 0.00 0.00 0.00 53.44 52.16 2emb n ALA 20 Cb 0.58 0.10 -0.11 0.00 0.00 0.00 0.00 19.45 20.02 2emb n ALA 20 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2emb s THR 21 N -1.85 1.74 0.12 0.00 -4.23 -1.26 -1.41 115.64 108.75 2emb s THR 21 Ca 0.37 -1.90 -0.07 0.00 -1.18 0.00 0.00 61.69 58.90 2emb s THR 21 Cb -0.02 -1.81 -0.01 0.00 1.34 0.00 0.00 72.50 72.00 2emb s THR 21 CO 0.25 -0.34 0.19 -0.36 -0.54 0.00 0.00 174.62 173.81 2emb s PHE 22 N -2.11 0.38 -0.21 3.99 0.08 -1.00 -5.01 117.98 114.10 2emb s PHE 22 Ca 0.15 -0.79 -0.12 0.00 0.12 0.00 0.00 56.93 56.29 2emb s PHE 22 Cb -0.05 -0.15 -0.19 0.00 -0.57 0.00 0.00 43.02 42.06 2emb s PHE 22 CO 0.06 -0.59 0.04 0.09 -0.10 0.00 0.00 175.22 174.71 2emb n ASN 23 N -0.11 1.97 -4.83 1.36 4.13 -1.26 -3.97 115.26 112.56 2emb n ASN 23 Ca -0.11 0.25 -0.31 0.00 1.68 0.00 0.00 54.58 56.10 2emb n ASN 23 Cb 0.63 -0.81 -0.06 0.00 -1.54 0.00 0.00 39.78 38.00 2emb n ASN 23 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 2emb s LEU 24 N -7.34 4.00 -0.04 3.41 1.43 -1.26 -4.88 118.68 114.01 2emb s LEU 24 Ca -0.31 0.09 -0.21 0.00 -1.03 0.00 0.00 54.13 52.68 2emb s LEU 24 Cb 0.09 -2.64 -0.15 0.00 0.03 0.00 0.00 46.19 43.52 2emb s LEU 24 CO 0.61 0.18 0.90 -0.09 0.23 0.00 0.00 176.35 178.18 2emb h ARG 25 N 3.25 -0.28 -1.44 1.70 2.43 -1.99 -3.16 114.38 114.90 2emb h ARG 25 Ca -0.46 0.02 0.42 0.00 -0.81 0.00 0.00 59.98 59.14 2emb h ARG 25 Cb 1.16 0.06 -0.06 0.00 -0.42 0.00 0.00 29.97 30.72 2emb h ARG 25 CO 0.69 0.10 1.08 1.57 -1.51 0.00 0.00 179.97 181.91 2emb h LYS 26 N -0.88 0.00 -0.17 0.20 2.10 -2.01 0.51 116.57 116.32 2emb h LYS 26 Ca -0.03 0.00 -0.03 0.00 -2.00 0.00 0.00 60.65 58.59 2emb h LYS 26 Cb 0.51 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.83 2emb h LYS 26 CO 0.05 0.00 -0.01 0.45 -2.00 0.00 0.00 179.45 177.94 2emb h HIS 27 N 0.00 0.34 0.44 0.07 3.86 -1.97 -3.17 115.15 114.72 2emb h HIS 27 Ca 0.68 -0.06 -0.01 0.00 -1.16 0.00 0.00 60.37 59.82 2emb h HIS 27 Cb 2.83 -0.09 -0.02 0.00 1.06 0.00 0.00 27.41 31.19 2emb h HIS 27 CO 0.00 0.53 -0.45 1.25 0.86 0.00 0.00 177.93 180.12 2emb h LEU 28 N 0.06 -1.23 -0.93 2.43 5.85 -0.02 -0.22 115.31 121.24 2emb h LEU 28 Ca 0.05 0.10 0.20 0.00 0.84 0.00 0.00 57.88 59.07 2emb h LEU 28 Cb 0.40 0.41 -0.18 0.00 0.37 0.00 0.00 40.66 41.66 2emb h LEU 28 CO 0.01 -0.60 -0.19 -0.38 -0.34 0.00 0.00 178.44 176.94 2emb n ILE 29 N -5.53 -0.39 -0.07 4.05 -0.00 -1.12 0.44 119.36 116.75 2emb n ILE 29 Ca -0.11 2.12 -0.12 0.00 -0.00 0.00 0.00 62.75 64.64 2emb n ILE 29 Cb 0.43 -2.97 -0.05 0.00 -0.00 0.00 0.00 39.64 37.05 2emb n ILE 29 CO 0.00 0.00 0.00 -0.61 -0.00 0.00 0.00 176.55 175.94 2emb h GLN 30 N 0.00 0.40 -0.06 0.38 -0.00 -1.43 -2.78 115.11 111.63 2emb h GLN 30 Ca 0.47 -0.16 0.02 0.00 -0.00 0.00 0.00 58.65 58.97 2emb h GLN 30 Cb 0.76 -0.02 -0.00 0.00 0.00 0.00 0.00 27.48 28.22 2emb h GLN 30 CO -0.95 0.66 0.06 1.25 0.00 0.00 0.00 178.83 179.86 2emb h HIS 31 N 0.12 0.00 -0.09 3.99 2.76 0.18 -0.93 115.15 121.18 2emb h HIS 31 Ca 0.05 0.00 -0.09 0.00 -2.20 0.00 0.00 60.37 58.13 2emb h HIS 31 Cb 0.52 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.48 2emb h HIS 31 CO 0.05 0.00 -0.28 1.96 -1.30 0.00 0.00 177.93 178.36 2emb h GLN 32 N 0.00 0.34 0.00 5.26 4.20 0.01 -3.17 115.11 121.76 2emb h GLN 32 Ca 0.03 -0.25 -0.09 0.00 0.06 0.00 0.00 58.65 58.39 2emb h GLN 32 Cb 0.15 0.04 -0.01 0.00 0.30 0.00 0.00 27.48 27.96 2emb h GLN 32 CO -0.00 0.88 -0.44 1.57 -0.67 0.00 0.00 178.83 180.17 2emb h LYS 33 N -0.13 0.00 0.00 1.46 2.10 -1.16 -2.56 116.57 116.28 2emb h LYS 33 Ca -0.01 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.64 2emb h LYS 33 Cb 0.91 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.24 2emb h LYS 33 CO 0.06 0.44 0.00 1.79 -2.00 0.00 0.00 179.45 179.74 2emb h THR 34 N 0.00 0.00 -0.24 0.07 1.35 -1.20 -2.47 112.91 110.42 2emb h THR 34 Ca -0.00 -0.31 -0.14 0.00 -0.55 0.00 0.00 66.41 65.40 2emb h THR 34 Cb 0.80 1.31 -0.01 0.00 -1.73 0.00 0.00 68.15 68.52 2emb h THR 34 CO 0.06 0.00 -0.44 0.45 -0.25 0.00 0.00 175.52 175.33 2emb h HIS 35 N 0.00 0.72 -3.53 4.73 3.86 -1.43 -3.40 115.15 116.10 2emb h HIS 35 Ca 0.00 -0.22 -0.68 0.00 -1.16 0.00 0.00 60.37 58.31 2emb h HIS 35 Cb 0.31 -0.15 -0.18 0.00 1.06 0.00 0.00 27.41 28.46 2emb h HIS 35 CO 0.00 0.93 -0.08 0.00 0.86 0.00 0.00 177.93 179.64 2emb s ALA 36 N -4.19 3.40 -0.47 2.45 0.00 -0.93 -5.00 121.76 117.01 2emb s ALA 36 Ca -0.08 -1.45 -0.26 0.00 0.00 0.00 0.00 51.96 50.17 2emb s ALA 36 Cb 0.12 -3.16 -0.06 0.00 0.00 0.00 0.00 23.12 20.02 2emb s ALA 36 CO 0.83 -1.69 2.33 0.00 0.00 0.00 0.00 175.76 177.23 2emb s ALA 37 N 2.39 1.81 -1.47 0.00 0.00 -1.21 -2.47 121.76 120.80 2emb s ALA 37 Ca 0.15 0.04 -0.11 0.00 0.00 0.00 0.00 51.96 52.04 2emb s ALA 37 Cb -0.16 -4.31 0.06 0.00 0.00 0.00 0.00 23.12 18.71 2emb s ALA 37 CO 0.15 -4.22 0.98 1.17 0.00 0.00 0.00 175.76 173.84 2emb n LYS 38 N 8.99 -5.87 -3.76 0.00 4.81 -1.26 -1.31 118.16 119.77 2emb n LYS 38 Ca 0.34 0.64 -0.26 0.00 -0.87 0.00 0.00 58.31 58.16 2emb n LYS 38 Cb 0.53 -5.52 0.05 0.00 0.02 0.00 0.00 35.03 30.12 2emb n LYS 38 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 2emb n SER 39 N -2.90 -4.57 -3.63 3.14 2.88 -1.03 -4.95 113.62 102.54 2emb n SER 39 Ca -0.02 -0.70 -0.04 0.00 -1.33 0.00 0.00 58.87 56.78 2emb n SER 39 Cb 0.56 -4.34 -0.05 0.00 -0.75 0.00 0.00 64.21 59.62 2emb n SER 39 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2emb s GLY 40 N -3.54 0.09 0.99 0.46 0.00 -0.42 -5.12 107.32 99.78 2emb s GLY 40 Ca 0.50 2.87 -0.12 0.00 0.00 0.00 0.00 44.72 47.97 2emb s GLY 40 CO 0.79 1.30 1.09 2.56 0.00 0.00 0.00 173.10 178.85 2emb s PRO 41 N -0.76 0.48 -0.17 2.90 0.04 -1.26 -3.32 135.00 132.90 2emb s PRO 41 Ca 0.07 0.54 -0.13 0.00 0.04 0.00 0.00 61.00 61.52 2emb s PRO 41 Cb -0.02 -1.74 -0.22 0.00 0.04 0.00 0.00 34.50 32.56 2emb s PRO 41 CO -0.08 -2.71 0.23 -1.13 0.04 0.00 0.00 177.00 173.35 2emb n SER 42 N -4.16 1.99 -0.17 6.66 3.41 -1.26 -4.43 113.62 115.66 2emb n SER 42 Ca 0.05 0.30 -0.13 0.00 -0.26 0.00 0.00 58.87 58.83 2emb n SER 42 Cb 0.57 -0.89 -0.09 0.00 -0.26 0.00 0.00 64.21 63.54 2emb n SER 42 CO 0.00 0.00 0.00 -1.28 -0.16 0.00 0.00 175.04 173.60 2emb h SER 43 N -0.47 -1.87 0.00 4.04 0.87 -2.03 -3.55 113.55 110.54 2emb h SER 43 Ca -0.42 0.25 0.00 0.00 -1.23 0.00 0.00 61.79 60.40 2emb h SER 43 Cb 1.68 0.78 0.00 0.00 -0.44 0.00 0.00 62.40 64.42 2emb h SER 43 CO -0.08 -0.38 0.00 0.61 -0.53 0.00 0.00 176.83 176.45