#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fc6 h SER 2 N 0.00 -0.25 -4.88 1.61 0.87 -2.02 -3.46 113.55 105.42 2fc6 h SER 2 Ca 0.00 0.02 -0.36 0.00 -1.23 0.00 0.00 61.79 60.23 2fc6 h SER 2 Cb 0.00 0.09 -0.14 0.00 -0.44 0.00 0.00 62.40 61.90 2fc6 h SER 2 CO 0.00 -0.15 -0.59 -0.44 -0.53 0.00 0.00 176.83 175.12 2fc6 s SER 3 N -5.00 1.11 0.00 6.23 0.01 -1.26 -5.05 113.70 109.74 2fc6 s SER 3 Ca -0.14 -1.47 0.00 0.00 1.31 0.00 0.00 55.95 55.65 2fc6 s SER 3 Cb 0.06 0.31 0.00 0.00 0.21 0.00 0.00 66.02 66.61 2fc6 s SER 3 CO 0.66 -0.83 0.00 0.61 0.41 0.00 0.00 173.24 174.09 2fc6 n GLY 4 N -0.47 0.35 0.44 3.44 0.00 -1.26 -4.66 105.19 103.03 2fc6 n GLY 4 Ca 0.01 -0.67 -0.14 0.00 0.00 0.00 0.00 46.02 45.22 2fc6 n GLY 4 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2fc6 h SER 5 N 0.00 -1.45 0.60 1.61 0.02 -1.99 -3.00 113.55 109.34 2fc6 h SER 5 Ca 0.00 0.17 -0.03 0.00 -0.84 0.00 0.00 61.79 61.09 2fc6 h SER 5 Cb 0.00 0.56 0.01 0.00 0.14 0.00 0.00 62.40 63.10 2fc6 h SER 5 CO 0.00 -0.49 -0.29 -1.28 -1.14 0.00 0.00 176.83 173.63 2fc6 h SER 6 N -0.63 -0.68 0.00 3.07 0.87 -2.07 -3.47 113.55 110.65 2fc6 h SER 6 Ca 0.03 -0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.58 2fc6 h SER 6 Cb 0.69 0.18 0.00 0.00 -0.44 0.00 0.00 62.40 62.83 2fc6 h SER 6 CO -0.34 -0.41 0.00 0.61 -0.53 0.00 0.00 176.83 176.16 2fc6 n GLY 7 N -1.11 1.51 3.11 5.77 0.00 -1.13 -5.18 105.19 108.16 2fc6 n GLY 7 Ca -0.12 0.47 -0.17 0.00 0.00 0.00 0.00 46.02 46.20 2fc6 n GLY 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fc6 s LEU 10 N 0.42 3.99 0.51 0.00 2.01 -1.26 -5.06 118.68 119.29 2fc6 s LEU 10 Ca 0.13 1.04 -0.21 0.00 0.01 0.00 0.00 54.13 55.10 2fc6 s LEU 10 Cb -0.22 -3.87 -0.06 0.00 0.01 0.00 0.00 46.19 42.05 2fc6 s LEU 10 CO -0.04 -0.25 1.14 -2.16 1.01 0.00 0.00 176.35 176.05 2fc6 s PRO 11 N -3.40 3.50 -0.56 1.29 0.04 -1.26 -4.94 135.00 129.68 2fc6 s PRO 11 Ca 0.50 1.67 -0.27 0.00 0.04 0.00 0.00 61.00 62.94 2fc6 s PRO 11 Cb -0.11 -2.15 -0.02 0.00 0.04 0.00 0.00 34.50 32.26 2fc6 s PRO 11 CO 0.26 -0.74 1.83 -1.25 0.04 0.00 0.00 177.00 177.14 2fc6 s PRO 12 N -3.07 2.78 0.26 0.56 0.04 -1.26 -4.97 135.00 129.34 2fc6 s PRO 12 Ca 0.69 0.75 -0.30 0.00 0.04 0.00 0.00 61.00 62.19 2fc6 s PRO 12 Cb -0.26 -4.34 -0.09 0.00 0.04 0.00 0.00 34.50 29.85 2fc6 s PRO 12 CO 0.30 -2.54 1.02 0.00 0.04 0.00 0.00 177.00 175.82 2fc6 s ALA 13 N 8.57 3.37 -0.25 8.56 0.00 -1.26 -5.04 121.76 135.72 2fc6 s ALA 13 Ca 0.69 0.76 -0.08 0.00 0.00 0.00 0.00 51.96 53.34 2fc6 s ALA 13 Cb -0.14 -3.27 -0.03 0.00 0.00 0.00 0.00 23.12 19.68 2fc6 s ALA 13 CO 0.23 0.01 0.08 0.99 0.00 0.00 0.00 175.76 177.08 2fc6 s THR 14 N -1.18 4.43 -0.19 0.00 2.01 -1.26 -5.06 115.64 114.38 2fc6 s THR 14 Ca 0.43 -0.13 -0.28 0.00 0.31 0.00 0.00 61.69 62.01 2fc6 s THR 14 Cb -0.29 -3.07 0.12 0.00 0.01 0.00 0.00 72.50 69.27 2fc6 s THR 14 CO 0.37 0.34 0.97 -2.28 -0.69 0.00 0.00 174.62 173.32 2fc6 s HIS 15 N 1.57 -0.44 0.05 4.92 2.46 -1.26 -5.16 115.29 117.44 2fc6 s HIS 15 Ca 0.06 0.88 -0.19 0.00 0.47 0.00 0.00 55.06 56.28 2fc6 s HIS 15 Cb -0.15 0.41 -0.06 0.00 -0.13 0.00 0.00 32.58 32.65 2fc6 s HIS 15 CO 0.04 -0.33 0.55 0.50 -2.47 0.00 0.00 174.74 173.03 2fc6 s ARG 16 N -0.64 4.17 0.71 2.88 3.52 -1.26 -5.07 118.95 123.27 2fc6 s ARG 16 Ca -0.01 0.69 -0.13 0.00 -0.13 0.00 0.00 55.73 56.15 2fc6 s ARG 16 Cb -0.02 -3.25 0.03 0.00 -1.56 0.00 0.00 34.95 30.15 2fc6 s ARG 16 CO -0.00 0.61 1.10 -1.25 -0.81 0.00 0.00 175.30 174.95 2fc6 s PRO 17 N -0.99 2.55 0.47 5.12 0.04 -1.26 -5.02 135.00 135.91 2fc6 s PRO 17 Ca 0.28 1.28 -0.20 0.00 0.04 0.00 0.00 61.00 62.41 2fc6 s PRO 17 Cb -0.19 -1.93 -0.09 0.00 0.04 0.00 0.00 34.50 32.33 2fc6 s PRO 17 CO 0.18 -1.43 0.98 -3.38 0.04 0.00 0.00 177.00 173.39 2fc6 s HIS 18 N -2.61 3.25 -0.05 0.56 -3.43 -1.26 -5.00 115.29 106.76 2fc6 s HIS 18 Ca 0.64 1.57 -0.30 0.00 -0.80 0.00 0.00 55.06 56.17 2fc6 s HIS 18 Cb -0.19 -2.89 -0.05 0.00 -1.43 0.00 0.00 32.58 28.02 2fc6 s HIS 18 CO 0.48 -0.39 1.49 -1.25 -2.00 0.00 0.00 174.74 173.07 2fc6 s PRO 19 N -3.45 4.23 0.28 -0.38 0.04 -1.26 -4.91 135.00 129.55 2fc6 s PRO 19 Ca 0.63 2.02 0.09 0.00 0.04 0.00 0.00 61.00 63.77 2fc6 s PRO 19 Cb -0.11 -3.76 0.39 0.00 0.04 0.00 0.00 34.50 31.05 2fc6 s PRO 19 CO 0.20 -0.71 1.64 0.00 0.04 0.00 0.00 177.00 178.17 2fc6 h THR 20 N 5.26 1.39 -0.71 1.26 1.03 -1.96 -3.44 112.91 115.74 2fc6 h THR 20 Ca -0.37 -1.89 0.19 0.00 -0.01 0.00 0.00 66.41 64.33 2fc6 h THR 20 Cb 1.17 1.98 -0.22 0.00 -1.07 0.00 0.00 68.15 70.01 2fc6 h THR 20 CO 0.94 0.55 0.09 -0.44 -0.01 0.00 0.00 175.52 176.65 2fc6 s SER 21 N -6.88 -0.67 0.43 0.00 0.01 -1.26 -5.12 113.70 100.21 2fc6 s SER 21 Ca -0.03 0.59 -0.23 0.00 1.31 0.00 0.00 55.95 57.59 2fc6 s SER 21 Cb 0.13 1.63 -0.08 0.00 0.21 0.00 0.00 66.02 67.90 2fc6 s SER 21 CO 0.77 -0.13 1.08 -0.63 0.41 0.00 0.00 173.24 174.74 2fc6 s ILE 22 N 2.76 3.58 1.34 1.44 1.09 -1.26 -2.52 121.20 127.63 2fc6 s ILE 22 Ca 0.02 1.17 -0.21 0.00 -1.10 0.00 0.00 60.65 60.53 2fc6 s ILE 22 Cb -0.10 -3.58 0.34 0.00 -1.06 0.00 0.00 42.46 38.06 2fc6 s ILE 22 CO -0.15 -0.04 0.99 0.00 -0.10 0.00 0.00 174.94 175.65 2fc6 n ASP 24 N -5.32 2.39 -0.01 0.00 9.92 -1.26 -4.16 116.55 118.11 2fc6 n ASP 24 Ca 0.12 -0.06 -0.00 0.00 -0.53 0.00 0.00 54.79 54.31 2fc6 n ASP 24 Cb 0.60 0.05 -0.00 0.00 -0.64 0.00 0.00 41.12 41.13 2fc6 n ASP 24 CO 0.00 0.00 0.00 0.78 0.13 0.00 0.00 177.20 178.11 2fc6 h ASN 25 N 0.00 -0.02 -0.87 -2.24 2.35 -1.95 -3.35 115.58 109.50 2fc6 h ASN 25 Ca -0.38 0.00 0.14 0.00 -0.55 0.00 0.00 56.30 55.52 2fc6 h ASN 25 Cb 1.66 0.01 -0.07 0.00 0.05 0.00 0.00 38.32 39.97 2fc6 h ASN 25 CO -0.04 0.15 0.56 0.15 -1.65 0.00 0.00 177.43 176.61 2fc6 h PHE 26 N -0.37 0.77 -0.49 1.19 3.04 -1.17 0.22 116.94 120.13 2fc6 h PHE 26 Ca -0.00 0.02 0.05 0.00 3.98 0.00 0.00 57.97 62.02 2fc6 h PHE 26 Cb 0.02 -0.24 -0.07 0.00 2.56 0.00 0.00 35.95 38.22 2fc6 h PHE 26 CO 0.01 0.29 -0.35 1.03 -2.02 0.00 0.00 178.31 177.26 2fc6 h SER 27 N 0.66 -1.27 0.00 0.41 0.87 -1.72 -0.49 113.55 112.00 2fc6 h SER 27 Ca 0.43 0.18 0.00 0.00 -1.23 0.00 0.00 61.79 61.18 2fc6 h SER 27 Cb 0.73 0.55 0.00 0.00 -0.44 0.00 0.00 62.40 63.23 2fc6 h SER 27 CO -0.19 -0.18 -0.74 0.00 -0.53 0.00 0.00 176.83 175.19 2fc6 n ALA 28 N -3.08 0.65 -0.33 6.23 0.00 -1.06 -4.52 120.51 118.40 2fc6 n ALA 28 Ca 0.00 -0.66 0.18 0.00 0.00 0.00 0.00 53.44 52.96 2fc6 n ALA 28 Cb 0.18 0.02 0.42 0.00 0.00 0.00 0.00 19.45 20.06 2fc6 n ALA 28 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 2fc6 h TYR 29 N -0.79 0.87 0.00 0.00 -1.99 -0.76 -3.45 116.97 110.85 2fc6 h TYR 29 Ca 0.00 0.03 0.00 0.00 2.00 0.00 0.00 58.73 60.76 2fc6 h TYR 29 Cb 0.74 -0.26 0.00 0.00 2.00 0.00 0.00 36.73 39.21 2fc6 h TYR 29 CO -0.32 0.13 0.00 0.41 -0.00 0.00 0.00 178.16 178.38 2fc6 n GLY 30 N -1.39 3.33 3.77 3.88 0.00 -0.19 -4.92 105.19 109.67 2fc6 n GLY 30 Ca 0.24 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.01 2fc6 n GLY 30 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 2fc6 s TRP 31 N -2.60 3.07 -0.09 1.61 1.48 -1.26 -4.59 118.94 116.56 2fc6 s TRP 31 Ca 0.00 -0.06 -0.07 0.00 -1.06 0.00 0.00 56.10 54.91 2fc6 s TRP 31 Cb 0.00 -1.45 0.03 0.00 -1.16 0.00 0.00 33.47 30.89 2fc6 s TRP 31 CO 0.00 0.52 0.23 0.00 -4.06 0.00 0.00 176.95 173.65 2fc6 n PRO 33 N 3.52 0.49 -0.00 0.00 -0.04 -1.26 -2.02 135.00 135.69 2fc6 n PRO 33 Ca -0.18 0.00 0.03 0.00 -0.04 0.00 0.00 63.50 63.31 2fc6 n PRO 33 Cb 0.56 -1.47 -0.05 0.00 -0.04 0.00 0.00 33.50 32.50 2fc6 n PRO 33 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2fc6 n LEU 34 N -0.97 0.10 0.00 1.53 4.77 -1.26 -5.07 117.00 116.10 2fc6 n LEU 34 Ca 0.11 -0.16 0.00 0.00 -0.03 0.00 0.00 56.01 55.93 2fc6 n LEU 34 Cb 0.05 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 2fc6 n LEU 34 CO 0.08 0.02 0.00 0.61 -1.33 0.00 0.00 177.39 176.78 2fc6 n GLY 35 N 1.81 2.05 0.22 -0.72 0.00 -0.86 -3.11 105.19 104.59 2fc6 n GLY 35 Ca -0.00 -0.55 -0.07 0.00 0.00 0.00 0.00 46.02 45.40 2fc6 n GLY 35 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2fc6 h PRO 36 N 0.00 0.52 -0.03 1.61 0.13 -1.98 -2.92 132.00 129.33 2fc6 h PRO 36 Ca 0.00 -0.27 0.01 0.00 -0.87 0.00 0.00 66.00 64.86 2fc6 h PRO 36 Cb 0.00 0.01 -0.00 0.00 0.13 0.00 0.00 31.00 31.14 2fc6 h PRO 36 CO 0.00 0.85 0.03 1.96 -0.23 0.00 0.00 178.00 180.61 2fc6 h GLN 37 N 0.42 0.00 -6.07 0.86 4.20 -1.96 -3.44 115.11 109.12 2fc6 h GLN 37 Ca 0.03 0.00 -0.70 0.00 0.06 0.00 0.00 58.65 58.04 2fc6 h GLN 37 Cb 0.93 0.00 0.09 0.00 0.30 0.00 0.00 27.48 28.79 2fc6 h GLN 37 CO 0.08 0.00 -0.18 0.00 -0.67 0.00 0.00 178.83 178.06 2fc6 h PRO 39 N 2.07 0.00 -6.68 0.00 0.13 -1.91 -3.44 132.00 122.16 2fc6 h PRO 39 Ca -0.38 0.00 -0.50 0.00 -0.87 0.00 0.00 66.00 64.24 2fc6 h PRO 39 Cb 1.42 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.53 2fc6 h PRO 39 CO 0.62 0.36 0.05 -0.65 -0.23 0.00 0.00 178.00 178.14 2fc6 s GLN 40 N -3.86 3.88 0.70 0.86 -0.21 -1.26 -4.95 119.66 114.82 2fc6 s GLN 40 Ca -0.01 0.50 -0.11 0.00 0.02 0.00 0.00 55.36 55.76 2fc6 s GLN 40 Cb 0.12 -2.48 0.01 0.00 1.00 0.00 0.00 33.01 31.67 2fc6 s GLN 40 CO 0.69 0.14 1.07 0.45 -2.12 0.00 0.00 175.29 175.52 2fc6 s SER 41 N -2.56 5.41 -0.52 5.90 0.15 -1.05 -4.63 113.70 116.41 2fc6 s SER 41 Ca 0.51 1.38 0.07 0.00 0.70 0.00 0.00 55.95 58.62 2fc6 s SER 41 Cb -0.10 -2.25 0.28 0.00 -1.71 0.00 0.00 66.02 62.24 2fc6 s SER 41 CO 0.22 -1.39 0.72 1.41 1.20 0.00 0.00 173.24 175.40 2fc6 n HIS 42 N -3.07 2.07 -3.26 3.44 -0.00 -1.26 -1.24 115.22 111.90 2fc6 n HIS 42 Ca 0.07 -3.91 -0.44 0.00 -0.00 0.00 0.00 57.72 53.45 2fc6 n HIS 42 Cb 0.55 -0.47 -0.07 0.00 -0.00 0.00 0.00 29.99 30.00 2fc6 n HIS 42 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.34 175.83 2fc6 s ASP 43 N -2.30 6.20 -0.45 0.41 1.01 -1.26 -4.97 116.67 115.31 2fc6 s ASP 43 Ca 0.40 -0.90 -0.16 0.00 0.71 0.00 0.00 52.55 52.61 2fc6 s ASP 43 Cb 0.21 -2.24 0.05 0.00 1.01 0.00 0.00 42.92 41.95 2fc6 s ASP 43 CO -0.07 -0.73 0.38 -0.63 0.21 0.00 0.00 175.17 174.33 2fc6 s ILE 44 N 2.25 5.21 -0.16 0.77 1.09 -1.26 -4.91 121.20 124.19 2fc6 s ILE 44 Ca 0.12 -0.83 -0.03 0.00 -1.10 0.00 0.00 60.65 58.80 2fc6 s ILE 44 Cb -0.19 -4.06 -0.02 0.00 -1.06 0.00 0.00 42.46 37.12 2fc6 s ILE 44 CO 0.12 -0.49 -0.05 -0.94 -0.10 0.00 0.00 174.94 173.48 2fc6 s SER 45 N 2.22 4.56 -0.69 3.58 1.04 -1.26 -4.74 113.70 118.41 2fc6 s SER 45 Ca 0.06 -0.22 -0.00 0.00 0.48 0.00 0.00 55.95 56.26 2fc6 s SER 45 Cb -0.22 -1.74 0.00 0.00 0.10 0.00 0.00 66.02 64.16 2fc6 s SER 45 CO 0.09 0.13 0.65 0.61 0.98 0.00 0.00 173.24 175.70 2fc6 n GLY 46 N 3.80 -1.18 0.00 7.32 0.00 -1.26 -4.88 105.19 108.99 2fc6 n GLY 46 Ca -0.18 0.44 0.07 0.00 0.00 0.00 0.00 46.02 46.36 2fc6 n GLY 46 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2fc6 n PRO 47 N -1.70 0.12 -0.03 1.61 -0.04 -1.26 -2.91 135.00 130.80 2fc6 n PRO 47 Ca 0.00 0.19 -0.21 0.00 -0.04 0.00 0.00 63.50 63.44 2fc6 n PRO 47 Cb 0.50 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.33 2fc6 n PRO 47 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2fc6 h SER 48 N 0.00 0.27 -3.27 3.54 0.87 -2.01 -3.45 113.55 109.50 2fc6 h SER 48 Ca 0.00 -0.78 -0.57 0.00 -1.23 0.00 0.00 61.79 59.21 2fc6 h SER 48 Cb 0.18 -0.09 -0.06 0.00 -0.44 0.00 0.00 62.40 62.00 2fc6 h SER 48 CO 0.00 1.63 0.48 -0.55 -0.53 0.00 0.00 176.83 177.86 2fc6 s SER 49 N -6.96 7.08 0.00 6.23 0.15 -1.15 -5.29 113.70 113.76 2fc6 s SER 49 Ca -0.23 1.33 0.00 0.00 0.70 0.00 0.00 55.95 57.74 2fc6 s SER 49 Cb 0.05 -2.50 0.00 0.00 -1.71 0.00 0.00 66.02 61.86 2fc6 s SER 49 CO 0.71 -0.43 0.00 0.61 1.20 0.00 0.00 173.24 175.33