#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 6.36 -0.09 1.61 1.04 -1.26 -5.11 113.70 116.26 2emb s SER 2 Ca 0.00 0.29 -0.04 0.00 0.48 0.00 0.00 55.95 56.68 2emb s SER 2 Cb 0.00 -1.96 0.04 0.00 0.10 0.00 0.00 66.02 64.20 2emb s SER 2 CO 0.00 0.00 0.20 -0.94 0.98 0.00 0.00 173.24 173.49 2emb s SER 3 N -3.19 -0.20 0.00 7.02 1.04 -1.26 -4.96 113.70 112.16 2emb s SER 3 Ca 0.37 0.43 0.00 0.00 0.48 0.00 0.00 55.95 57.22 2emb s SER 3 Cb -0.11 0.32 0.00 0.00 0.10 0.00 0.00 66.02 66.33 2emb s SER 3 CO 0.29 -0.15 0.00 0.61 0.98 0.00 0.00 173.24 174.97 2emb n GLY 4 N 4.09 0.83 3.19 7.32 0.00 -1.26 -5.03 105.19 114.33 2emb n GLY 4 Ca -0.24 -0.46 -0.40 0.00 0.00 0.00 0.00 46.02 44.91 2emb n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2emb s SER 5 N -2.58 6.34 0.29 1.61 0.01 -1.26 -5.00 113.70 113.11 2emb s SER 5 Ca 0.00 -3.45 -0.19 0.00 1.31 0.00 0.00 55.95 53.62 2emb s SER 5 Cb 0.00 -2.02 0.06 0.00 0.21 0.00 0.00 66.02 64.27 2emb s SER 5 CO 0.00 -0.28 0.87 -0.94 0.41 0.00 0.00 173.24 173.30 2emb s SER 6 N 0.64 -0.04 0.00 2.44 1.04 -1.26 -5.11 113.70 111.41 2emb s SER 6 Ca 0.26 -0.88 0.00 0.00 0.48 0.00 0.00 55.95 55.80 2emb s SER 6 Cb -0.10 0.70 0.00 0.00 0.10 0.00 0.00 66.02 66.72 2emb s SER 6 CO -0.10 -1.38 0.00 0.61 0.98 0.00 0.00 173.24 173.35 2emb n GLY 7 N -0.57 -0.59 3.32 7.32 0.00 -1.26 -5.02 105.19 108.38 2emb n GLY 7 Ca -0.06 0.23 -0.44 0.00 0.00 0.00 0.00 46.02 45.75 2emb n GLY 7 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2emb s HIS 8 N 0.00 4.21 -0.05 1.61 -0.00 -1.26 -4.86 115.29 114.93 2emb s HIS 8 Ca 0.00 -2.69 -0.10 0.00 -0.00 0.00 0.00 55.06 52.27 2emb s HIS 8 Cb 0.00 -3.78 -0.06 0.00 -0.00 0.00 0.00 32.58 28.75 2emb s HIS 8 CO 0.00 -0.93 0.42 1.15 -0.00 0.00 0.00 174.74 175.38 2emb h THR 9 N 3.77 0.00 -4.09 -5.38 2.02 -2.01 -3.45 112.91 103.76 2emb h THR 9 Ca 0.17 -0.71 -0.53 0.00 0.77 0.00 0.00 66.41 66.12 2emb h THR 9 Cb 0.88 0.00 0.11 0.00 -1.74 0.00 0.00 68.15 67.40 2emb h THR 9 CO 0.98 0.00 0.48 -0.13 0.37 0.00 0.00 175.52 177.22 2emb s ARG 10 N -2.72 3.02 0.00 6.66 0.52 -1.26 -4.93 118.95 120.23 2emb s ARG 10 Ca -0.05 1.83 0.23 0.00 -0.52 0.00 0.00 55.73 57.22 2emb s ARG 10 Cb 0.01 -1.95 0.51 0.00 0.52 0.00 0.00 34.95 34.03 2emb s ARG 10 CO 0.16 -1.17 1.44 1.17 0.02 0.00 0.00 175.30 176.91 2emb n LYS 11 N -1.53 2.22 -1.08 3.54 3.00 -1.26 -5.00 118.16 118.04 2emb n LYS 11 Ca 0.13 -1.82 -0.37 0.00 -0.00 0.00 0.00 58.31 56.26 2emb n LYS 11 Cb 0.49 -1.47 -0.02 0.00 0.00 0.00 0.00 35.03 34.03 2emb n LYS 11 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.40 180.29 2emb n ARG 12 N 1.07 0.00 -3.00 1.64 1.85 -1.26 -4.90 116.66 112.06 2emb n ARG 12 Ca 0.17 0.00 -0.32 0.00 -1.00 0.00 0.00 57.85 56.70 2emb n ARG 12 Cb 0.52 -0.79 -0.05 0.00 -1.05 0.00 0.00 32.46 31.09 2emb n ARG 12 CO 0.00 0.00 0.00 0.71 -0.01 0.00 0.00 177.63 178.33 2emb s TYR 13 N -0.90 3.39 0.17 2.89 1.51 -1.01 -4.85 117.35 118.55 2emb s TYR 13 Ca 0.50 1.23 0.09 0.00 -1.01 0.00 0.00 57.07 57.87 2emb s TYR 13 Cb -0.68 -2.56 -0.04 0.00 -0.11 0.00 0.00 41.96 38.57 2emb s TYR 13 CO 0.45 0.00 -0.19 -1.21 -1.11 0.00 0.00 175.55 173.49 2emb s GLU 14 N -3.26 1.32 -0.20 -0.62 8.01 -1.26 -1.07 118.70 121.62 2emb s GLU 14 Ca 0.55 -1.43 -0.06 0.00 0.01 0.00 0.00 54.97 54.04 2emb s GLU 14 Cb -0.10 -1.44 -0.03 0.00 -4.31 0.00 0.00 34.13 28.25 2emb s GLU 14 CO 0.21 0.30 0.02 0.00 0.01 0.00 0.00 175.26 175.80 2emb n SER 16 N 4.08 1.87 -0.02 0.00 2.88 -1.26 -0.73 113.62 120.44 2emb n SER 16 Ca -0.17 -2.17 -0.05 0.00 -1.33 0.00 0.00 58.87 55.16 2emb n SER 16 Cb 0.52 -0.53 -0.02 0.00 -0.75 0.00 0.00 64.21 63.43 2emb n SER 16 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 2emb n LYS 17 N 0.11 0.11 -0.02 -1.46 3.00 -1.26 -4.81 118.16 113.83 2emb n LYS 17 Ca 0.05 0.05 0.02 0.00 -0.00 0.00 0.00 58.31 58.43 2emb n LYS 17 Cb 0.42 -0.69 0.03 0.00 0.00 0.00 0.00 35.03 34.80 2emb n LYS 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2emb n GLN 19 N 0.18 -4.73 -3.33 0.00 6.02 0.09 -5.01 117.38 110.60 2emb n GLN 19 Ca 0.03 0.73 -0.22 0.00 -0.01 0.00 0.00 57.00 57.53 2emb n GLN 19 Cb 0.17 -5.43 0.04 0.00 1.02 0.00 0.00 30.24 26.04 2emb n GLN 19 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2emb s ALA 20 N -3.50 4.65 0.05 -1.58 0.00 -1.24 -4.83 121.76 115.31 2emb s ALA 20 Ca 0.12 -1.85 0.04 0.00 0.00 0.00 0.00 51.96 50.26 2emb s ALA 20 Cb -0.02 -1.20 -0.02 0.00 0.00 0.00 0.00 23.12 21.87 2emb s ALA 20 CO 0.78 -0.76 -0.11 0.95 0.00 0.00 0.00 175.76 176.61 2emb s THR 21 N -2.73 0.87 0.14 0.00 -4.23 -1.26 -2.19 115.64 106.23 2emb s THR 21 Ca 0.52 -1.11 -0.00 0.00 -1.18 0.00 0.00 61.69 59.93 2emb s THR 21 Cb -0.04 -0.85 -0.04 0.00 1.34 0.00 0.00 72.50 72.90 2emb s THR 21 CO 0.33 -0.22 0.03 -0.36 -0.54 0.00 0.00 174.62 173.86 2emb s PHE 22 N -1.16 0.96 -0.20 3.99 0.08 -0.24 -4.97 117.98 116.44 2emb s PHE 22 Ca -0.04 -1.15 -0.12 0.00 0.12 0.00 0.00 56.93 55.74 2emb s PHE 22 Cb -0.09 -0.55 -0.20 0.00 -0.57 0.00 0.00 43.02 41.61 2emb s PHE 22 CO 0.01 -0.40 0.10 0.09 -0.10 0.00 0.00 175.22 174.92 2emb n ASN 23 N -0.13 1.99 -4.96 1.36 3.02 -1.26 -2.41 115.26 112.86 2emb n ASN 23 Ca -0.06 0.25 -0.23 0.00 -0.03 0.00 0.00 54.58 54.51 2emb n ASN 23 Cb 0.63 -0.82 0.02 0.00 -0.61 0.00 0.00 39.78 39.00 2emb n ASN 23 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2emb s LEU 24 N -7.33 2.90 -0.21 3.41 1.02 -1.26 -4.72 118.68 112.49 2emb s LEU 24 Ca -0.29 -1.06 -0.21 0.00 0.02 0.00 0.00 54.13 52.59 2emb s LEU 24 Cb 0.08 -1.41 -0.18 0.00 0.02 0.00 0.00 46.19 44.70 2emb s LEU 24 CO 0.63 -1.18 0.17 -1.14 0.02 0.00 0.00 176.35 174.86 2emb n ARG 25 N -1.95 0.56 -0.37 1.70 0.63 -1.26 -4.14 116.66 111.82 2emb n ARG 25 Ca 0.06 0.57 0.34 0.00 -0.92 0.00 0.00 57.85 57.90 2emb n ARG 25 Cb 0.63 -1.74 0.70 0.00 0.45 0.00 0.00 32.46 32.50 2emb n ARG 25 CO 0.00 0.00 0.00 1.57 -2.51 0.00 0.00 177.63 176.69 2emb h LYS 26 N -1.00 0.09 -0.31 -0.14 2.10 -2.00 0.31 116.57 115.62 2emb h LYS 26 Ca -0.34 -0.01 -0.02 0.00 -2.00 0.00 0.00 60.65 58.28 2emb h LYS 26 Cb 1.27 -0.02 -0.01 0.00 -0.90 0.00 0.00 32.23 32.57 2emb h LYS 26 CO -0.21 0.06 0.11 0.45 -2.00 0.00 0.00 179.45 177.86 2emb h HIS 27 N 0.09 0.48 0.24 0.07 3.86 -2.00 -2.06 115.15 115.84 2emb h HIS 27 Ca 0.63 -0.04 0.00 0.00 -1.16 0.00 0.00 60.37 59.80 2emb h HIS 27 Cb 2.27 -0.14 -0.02 0.00 1.06 0.00 0.00 27.41 30.58 2emb h HIS 27 CO -0.00 0.48 -0.24 1.25 0.86 0.00 0.00 177.93 180.28 2emb h LEU 28 N 0.34 -0.64 -0.49 2.43 5.85 -0.55 0.23 115.31 122.48 2emb h LEU 28 Ca 0.10 0.06 0.09 0.00 0.84 0.00 0.00 57.88 58.97 2emb h LEU 28 Cb 0.22 0.22 -0.07 0.00 0.37 0.00 0.00 40.66 41.39 2emb h LEU 28 CO -0.01 -0.35 0.06 0.40 -0.34 0.00 0.00 178.44 178.20 2emb h ILE 29 N -0.51 0.68 -0.19 4.05 2.04 -1.47 -0.09 117.51 122.02 2emb h ILE 29 Ca -0.00 -0.06 -0.06 0.00 1.00 0.00 0.00 64.86 65.73 2emb h ILE 29 Cb 0.47 0.48 -0.01 0.00 -0.74 0.00 0.00 36.82 37.02 2emb h ILE 29 CO -0.05 0.03 -0.16 -0.61 0.00 0.00 0.00 178.15 177.36 2emb h GLN 30 N 0.18 0.32 -0.22 2.37 5.75 -1.08 -2.95 115.11 119.49 2emb h GLN 30 Ca 0.25 -0.09 -0.03 0.00 -0.15 0.00 0.00 58.65 58.63 2emb h GLN 30 Cb 0.35 -0.04 -0.01 0.00 1.07 0.00 0.00 27.48 28.85 2emb h GLN 30 CO -0.35 0.49 0.03 1.25 -2.65 0.00 0.00 178.83 177.59 2emb h HIS 31 N 0.30 0.40 -0.98 3.99 2.76 0.12 -3.00 115.15 118.74 2emb h HIS 31 Ca 0.06 -0.06 0.33 0.00 -2.20 0.00 0.00 60.37 58.50 2emb h HIS 31 Cb 0.47 -0.11 -0.17 0.00 1.55 0.00 0.00 27.41 29.15 2emb h HIS 31 CO 0.01 0.52 0.37 1.96 -1.30 0.00 0.00 177.93 179.49 2emb h GLN 32 N 0.17 0.11 -0.97 5.26 4.20 -0.95 0.57 115.11 123.49 2emb h GLN 32 Ca 0.07 -0.01 0.31 0.00 0.06 0.00 0.00 58.65 59.08 2emb h GLN 32 Cb 0.34 -0.02 -0.15 0.00 0.30 0.00 0.00 27.48 27.95 2emb h GLN 32 CO 0.01 0.07 0.48 0.87 -0.67 0.00 0.00 178.83 179.59 2emb h LYS 33 N 0.11 0.27 -0.87 1.46 6.56 -1.61 0.76 116.57 123.25 2emb h LYS 33 Ca 0.71 -0.02 0.16 0.00 -1.06 0.00 0.00 60.65 60.45 2emb h LYS 33 Cb 1.68 -0.06 -0.07 0.00 -0.57 0.00 0.00 32.23 33.21 2emb h LYS 33 CO -0.75 0.18 0.57 1.79 -2.06 0.00 0.00 179.45 179.17 2emb h THR 34 N 0.28 0.77 -0.12 -0.16 1.35 -0.02 0.41 112.91 115.42 2emb h THR 34 Ca 0.70 -0.19 -0.00 0.00 -0.55 0.00 0.00 66.41 66.36 2emb h THR 34 Cb 1.56 0.18 -0.00 0.00 -1.73 0.00 0.00 68.15 68.16 2emb h THR 34 CO -0.63 0.10 0.01 1.41 -0.25 0.00 0.00 175.52 176.15 2emb n HIS 35 N -4.54 0.43 -3.82 4.73 8.25 0.26 -4.77 115.22 115.78 2emb n HIS 35 Ca 0.17 -0.17 -0.36 0.00 -0.26 0.00 0.00 57.72 57.10 2emb n HIS 35 Cb 0.55 -0.19 -0.13 0.00 1.12 0.00 0.00 29.99 31.34 2emb n HIS 35 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2emb s ALA 36 N -1.33 3.00 0.00 -1.41 0.00 0.14 -4.99 121.76 117.18 2emb s ALA 36 Ca 0.11 -1.23 -0.02 0.00 0.00 0.00 0.00 51.96 50.81 2emb s ALA 36 Cb 0.09 -1.95 -0.11 0.00 0.00 0.00 0.00 23.12 21.15 2emb s ALA 36 CO 0.03 -0.58 2.62 0.00 0.00 0.00 0.00 175.76 177.83 2emb n ALA 37 N 4.86 4.91 -3.44 0.00 0.00 -1.26 -4.64 120.51 120.93 2emb n ALA 37 Ca -0.17 -0.76 0.01 0.00 0.00 0.00 0.00 53.44 52.53 2emb n ALA 37 Cb 0.50 -1.58 -0.03 0.00 0.00 0.00 0.00 19.45 18.35 2emb n ALA 37 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 2emb s LYS 38 N 0.48 0.57 0.19 0.00 -2.85 -1.26 -5.17 119.74 111.70 2emb s LYS 38 Ca 0.28 1.26 -0.23 0.00 -1.00 0.00 0.00 55.97 56.27 2emb s LYS 38 Cb 0.13 0.74 0.05 0.00 -2.06 0.00 0.00 37.83 36.69 2emb s LYS 38 CO 0.00 -0.37 0.79 -1.54 0.10 0.00 0.00 175.35 174.33 2emb s SER 39 N 2.88 -0.30 0.19 0.03 1.04 -1.26 -5.10 113.70 111.17 2emb s SER 39 Ca 0.05 -0.39 0.00 0.00 0.48 0.00 0.00 55.95 56.09 2emb s SER 39 Cb -0.13 0.60 0.00 0.00 0.10 0.00 0.00 66.02 66.59 2emb s SER 39 CO -0.20 -1.08 0.00 0.61 0.98 0.00 0.00 173.24 173.55 2emb n GLY 40 N -0.43 0.77 0.00 7.32 0.00 -1.26 -4.93 105.19 106.66 2emb n GLY 40 Ca -0.07 -1.91 0.06 0.00 0.00 0.00 0.00 46.02 44.10 2emb n GLY 40 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2emb n PRO 41 N -0.46 0.49 -1.54 1.61 -0.04 -1.26 -4.76 135.00 129.04 2emb n PRO 41 Ca 0.00 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 63.14 2emb n PRO 41 Cb 0.00 -1.36 -0.08 0.00 -0.04 0.00 0.00 33.50 32.02 2emb n PRO 41 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2emb n SER 42 N -0.86 1.42 -3.79 3.54 3.41 -1.26 -4.84 113.62 111.23 2emb n SER 42 Ca 0.08 -0.54 -0.10 0.00 -0.26 0.00 0.00 58.87 58.05 2emb n SER 42 Cb 0.04 -1.36 -0.05 0.00 -0.26 0.00 0.00 64.21 62.58 2emb n SER 42 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2emb s SER 43 N 10.20 -0.14 0.00 4.04 1.04 -1.26 -5.16 113.70 122.43 2emb s SER 43 Ca 1.09 -0.58 0.00 0.00 0.48 0.00 0.00 55.95 56.94 2emb s SER 43 Cb -0.47 0.50 0.00 0.00 0.10 0.00 0.00 66.02 66.14 2emb s SER 43 CO 0.31 -0.94 0.00 0.61 0.98 0.00 0.00 173.24 174.19