#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fc6 n SER 2 N 0.00 -5.35 -3.64 1.61 2.88 -1.26 -4.99 113.62 102.88 2fc6 n SER 2 Ca 0.00 -0.54 -0.10 0.00 -1.33 0.00 0.00 58.87 56.90 2fc6 n SER 2 Cb 0.00 -4.95 -0.03 0.00 -0.75 0.00 0.00 64.21 58.47 2fc6 n SER 2 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2fc6 s SER 3 N -3.54 0.10 -1.41 -3.46 1.04 -1.26 -5.07 113.70 100.10 2fc6 s SER 3 Ca 0.45 -1.03 -0.15 0.00 0.48 0.00 0.00 55.95 55.70 2fc6 s SER 3 Cb -0.20 0.67 0.05 0.00 0.10 0.00 0.00 66.02 66.65 2fc6 s SER 3 CO 0.71 -1.30 2.08 0.61 0.98 0.00 0.00 173.24 176.32 2fc6 n GLY 4 N -0.46 3.90 0.43 7.32 0.00 -1.26 -4.36 105.19 110.76 2fc6 n GLY 4 Ca -0.03 -1.56 -0.06 0.00 0.00 0.00 0.00 46.02 44.37 2fc6 n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2fc6 n SER 5 N 6.73 1.88 -4.50 1.61 7.64 -1.26 -4.96 113.62 120.75 2fc6 n SER 5 Ca 0.51 0.03 -0.42 0.00 1.01 0.00 0.00 58.87 60.00 2fc6 n SER 5 Cb 0.41 -0.16 -0.10 0.00 -1.01 0.00 0.00 64.21 63.35 2fc6 n SER 5 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2fc6 s SER 6 N -5.19 6.14 0.00 6.43 0.15 -1.26 -4.88 113.70 115.09 2fc6 s SER 6 Ca -0.10 -0.56 0.00 0.00 0.70 0.00 0.00 55.95 55.99 2fc6 s SER 6 Cb 0.03 -2.18 0.00 0.00 -1.71 0.00 0.00 66.02 62.16 2fc6 s SER 6 CO 0.14 -0.41 0.00 0.61 1.20 0.00 0.00 173.24 174.78 2fc6 n GLY 7 N 5.08 0.35 3.33 9.45 0.00 -1.26 -5.11 105.19 117.04 2fc6 n GLY 7 Ca -0.10 -0.72 -0.53 0.00 0.00 0.00 0.00 46.02 44.68 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 -2.92 4.39 0.56 0.00 1.02 -1.26 -5.08 118.68 115.40 2fc6 s LEU 10 Ca 0.11 0.80 -0.19 0.00 0.02 0.00 0.00 54.13 54.87 2fc6 s LEU 10 Cb 0.05 -2.78 -0.05 0.00 0.02 0.00 0.00 46.19 43.43 2fc6 s LEU 10 CO -0.06 0.24 1.13 -2.16 0.02 0.00 0.00 176.35 175.52 2fc6 s PRO 11 N -1.60 3.27 -0.74 1.29 0.04 -1.26 -4.93 135.00 131.07 2fc6 s PRO 11 Ca 0.29 1.58 -0.26 0.00 0.04 0.00 0.00 61.00 62.65 2fc6 s PRO 11 Cb -0.15 -2.00 -0.03 0.00 0.04 0.00 0.00 34.50 32.37 2fc6 s PRO 11 CO 0.16 -0.91 1.90 -1.25 0.04 0.00 0.00 177.00 176.93 2fc6 s PRO 12 N -3.41 2.59 0.15 0.56 0.04 -1.26 -4.58 135.00 129.08 2fc6 s PRO 12 Ca 0.72 0.20 0.00 0.00 0.04 0.00 0.00 61.00 61.96 2fc6 s PRO 12 Cb -0.23 -4.70 0.00 0.00 0.04 0.00 0.00 34.50 29.61 2fc6 s PRO 12 CO 0.29 -3.03 0.00 0.00 0.04 0.00 0.00 177.00 174.31 2fc6 n ALA 13 N 13.31 3.00 -2.68 8.56 0.00 -1.26 -5.11 120.51 136.33 2fc6 n ALA 13 Ca 0.29 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.50 2fc6 n ALA 13 Cb 0.50 0.16 -0.07 0.00 0.00 0.00 0.00 19.45 20.04 2fc6 n ALA 13 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2fc6 s THR 14 N -2.00 3.68 0.22 0.00 -4.23 -1.26 -5.14 115.64 106.91 2fc6 s THR 14 Ca 0.00 -1.71 0.02 0.00 -1.18 0.00 0.00 61.69 58.81 2fc6 s THR 14 Cb 0.00 -2.95 -0.05 0.00 1.34 0.00 0.00 72.50 70.85 2fc6 s THR 14 CO 0.00 -0.31 0.05 -1.00 -0.54 0.00 0.00 174.62 172.82 2fc6 s HIS 15 N -2.15 1.40 -0.12 3.99 3.76 -1.26 -5.14 115.29 115.76 2fc6 s HIS 15 Ca 0.31 -1.10 -0.05 0.00 -0.15 0.00 0.00 55.06 54.07 2fc6 s HIS 15 Cb -0.07 -0.81 -0.04 0.00 1.11 0.00 0.00 32.58 32.77 2fc6 s HIS 15 CO 0.20 -0.27 0.06 0.50 -0.85 0.00 0.00 174.74 174.39 2fc6 s ARG 16 N -3.97 3.37 -0.52 1.40 3.52 -1.26 -5.05 118.95 116.44 2fc6 s ARG 16 Ca 0.31 -0.31 -0.27 0.00 -0.13 0.00 0.00 55.73 55.33 2fc6 s ARG 16 Cb 0.07 -3.02 -0.02 0.00 -1.56 0.00 0.00 34.95 30.43 2fc6 s ARG 16 CO 0.09 0.62 1.80 -1.25 -0.81 0.00 0.00 175.30 175.76 2fc6 s PRO 17 N -0.62 2.90 0.37 5.12 0.04 -1.26 -4.97 135.00 136.58 2fc6 s PRO 17 Ca 0.11 0.86 -0.27 0.00 0.04 0.00 0.00 61.00 61.74 2fc6 s PRO 17 Cb -0.12 -4.30 -0.09 0.00 0.04 0.00 0.00 34.50 30.02 2fc6 s PRO 17 CO 0.02 -2.39 1.30 -1.01 0.04 0.00 0.00 177.00 174.96 2fc6 s HIS 18 N 8.16 2.93 1.16 0.56 3.76 -1.26 -5.02 115.29 125.59 2fc6 s HIS 18 Ca 0.70 1.42 -0.18 0.00 -0.15 0.00 0.00 55.06 56.85 2fc6 s HIS 18 Cb -0.15 -3.66 0.27 0.00 1.11 0.00 0.00 32.58 30.14 2fc6 s HIS 18 CO 0.25 -1.95 1.11 -1.25 -0.85 0.00 0.00 174.74 172.05 2fc6 s PRO 19 N -2.05 -0.86 0.32 8.40 0.04 -1.26 -4.98 135.00 134.61 2fc6 s PRO 19 Ca 0.53 0.07 -0.29 0.00 0.04 0.00 0.00 61.00 61.35 2fc6 s PRO 19 Cb -0.38 -1.63 -0.10 0.00 0.04 0.00 0.00 34.50 32.43 2fc6 s PRO 19 CO 0.50 -3.50 1.31 -0.08 0.04 0.00 0.00 177.00 175.28 2fc6 s THR 20 N -3.00 2.73 0.03 1.26 -1.32 -1.26 -4.99 115.64 109.10 2fc6 s THR 20 Ca 0.70 0.73 -0.23 0.00 -1.21 0.00 0.00 61.69 61.67 2fc6 s THR 20 Cb -0.12 -3.46 -0.06 0.00 -1.51 0.00 0.00 72.50 67.35 2fc6 s THR 20 CO 0.56 0.17 0.70 -0.55 -2.21 0.00 0.00 174.62 173.29 2fc6 s SER 21 N -0.41 7.13 0.33 8.08 0.15 -1.26 -4.92 113.70 122.81 2fc6 s SER 21 Ca 0.50 1.35 -0.23 0.00 0.70 0.00 0.00 55.95 58.26 2fc6 s SER 21 Cb -0.40 -2.43 -0.10 0.00 -1.71 0.00 0.00 66.02 61.39 2fc6 s SER 21 CO 0.52 0.06 0.90 -0.63 1.20 0.00 0.00 173.24 175.29 2fc6 s ILE 22 N -0.18 4.34 1.28 6.45 1.09 -1.26 -1.68 121.20 131.23 2fc6 s ILE 22 Ca 0.35 1.61 -0.18 0.00 -1.10 0.00 0.00 60.65 61.33 2fc6 s ILE 22 Cb -0.20 -3.87 0.32 0.00 -1.06 0.00 0.00 42.46 37.65 2fc6 s ILE 22 CO 0.21 0.03 1.00 0.00 -0.10 0.00 0.00 174.94 176.08 2fc6 n ASP 24 N -5.18 1.97 -0.02 0.00 2.03 -1.26 -4.18 116.55 109.91 2fc6 n ASP 24 Ca 0.09 0.00 -0.01 0.00 0.52 0.00 0.00 54.79 55.39 2fc6 n ASP 24 Cb 0.58 1.28 -0.00 0.00 -0.72 0.00 0.00 41.12 42.25 2fc6 n ASP 24 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 2fc6 h ASN 25 N 0.00 0.00 -0.17 1.67 7.08 -1.94 -3.38 115.58 118.83 2fc6 h ASN 25 Ca -0.14 0.00 0.05 0.00 -3.08 0.00 0.00 56.30 53.13 2fc6 h ASN 25 Cb 1.08 0.00 -0.01 0.00 -2.08 0.00 0.00 38.32 37.31 2fc6 h ASN 25 CO 0.01 0.16 0.20 0.15 -2.08 0.00 0.00 177.43 175.87 2fc6 h PHE 26 N -0.23 0.00 0.09 4.14 3.04 -1.50 0.81 116.94 123.30 2fc6 h PHE 26 Ca 0.00 0.00 0.01 0.00 3.98 0.00 0.00 57.97 61.96 2fc6 h PHE 26 Cb 0.10 0.00 -0.02 0.00 2.56 0.00 0.00 35.95 38.58 2fc6 h PHE 26 CO -0.04 0.00 -0.29 1.03 -2.02 0.00 0.00 178.31 176.98 2fc6 h SER 27 N 0.00 -0.88 0.00 0.41 0.87 -1.75 -2.69 113.55 109.52 2fc6 h SER 27 Ca 0.08 0.09 -0.13 0.00 -1.23 0.00 0.00 61.79 60.61 2fc6 h SER 27 Cb 0.48 0.32 -0.02 0.00 -0.44 0.00 0.00 62.40 62.74 2fc6 h SER 27 CO -0.00 -0.32 -1.30 0.00 -0.53 0.00 0.00 176.83 174.68 2fc6 n ALA 28 N -2.70 0.88 -0.06 6.23 0.00 -1.09 -4.59 120.51 119.18 2fc6 n ALA 28 Ca -0.05 -0.80 -0.07 0.00 0.00 0.00 0.00 53.44 52.52 2fc6 n ALA 28 Cb 0.23 0.01 -0.01 0.00 0.00 0.00 0.00 19.45 19.69 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 -1.00 -0.41 0.00 0.00 -1.99 -1.05 -3.47 116.97 109.05 2fc6 h TYR 29 Ca -0.19 0.03 0.00 0.00 2.00 0.00 0.00 58.73 60.57 2fc6 h TYR 29 Cb 1.09 0.23 0.00 0.00 2.00 0.00 0.00 36.73 40.04 2fc6 h TYR 29 CO -0.28 -0.24 0.00 0.41 -0.00 0.00 0.00 178.16 178.05 2fc6 n GLY 30 N -1.33 1.20 3.86 3.88 0.00 -0.86 -4.95 105.19 107.00 2fc6 n GLY 30 Ca -0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 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 -1.61 3.20 -0.09 1.61 1.48 -1.26 -4.57 118.94 117.69 2fc6 s TRP 31 Ca 0.00 -0.09 -0.07 0.00 -1.06 0.00 0.00 56.10 54.88 2fc6 s TRP 31 Cb 0.00 -1.46 0.03 0.00 -1.16 0.00 0.00 33.47 30.88 2fc6 s TRP 31 CO 0.00 0.49 0.23 0.00 -4.06 0.00 0.00 176.95 173.61 2fc6 n PRO 33 N 3.54 0.47 0.00 0.00 -0.04 -1.26 -1.81 135.00 135.91 2fc6 n PRO 33 Ca -0.19 0.01 0.03 0.00 -0.04 0.00 0.00 63.50 63.31 2fc6 n PRO 33 Cb 0.56 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.51 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 -1.02 0.80 0.00 1.53 4.77 -1.26 -5.06 117.00 116.76 2fc6 n LEU 34 Ca 0.11 -0.70 0.00 0.00 -0.03 0.00 0.00 56.01 55.39 2fc6 n LEU 34 Cb 0.06 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.15 2fc6 n LEU 34 CO 0.09 0.17 0.00 0.61 -1.33 0.00 0.00 177.39 176.93 2fc6 n GLY 35 N 0.84 2.12 0.19 -0.72 0.00 -0.75 -2.14 105.19 104.74 2fc6 n GLY 35 Ca 0.02 -0.40 -0.03 0.00 0.00 0.00 0.00 46.02 45.62 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 0.24 0.00 1.61 0.13 -1.99 -2.87 132.00 129.12 2fc6 h PRO 36 Ca 0.00 -0.12 -0.00 0.00 -0.87 0.00 0.00 66.00 65.00 2fc6 h PRO 36 Cb 0.00 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.13 2fc6 h PRO 36 CO 0.00 0.65 -0.01 1.96 -0.23 0.00 0.00 178.00 180.38 2fc6 h GLN 37 N 0.19 0.00 -6.21 0.86 4.20 -1.91 -3.44 115.11 108.80 2fc6 h GLN 37 Ca 0.01 0.00 -0.68 0.00 0.06 0.00 0.00 58.65 58.04 2fc6 h GLN 37 Cb 0.89 0.00 0.08 0.00 0.30 0.00 0.00 27.48 28.75 2fc6 h GLN 37 CO 0.07 0.01 0.08 0.00 -0.67 0.00 0.00 178.83 178.32 2fc6 h PRO 39 N 2.82 0.20 -7.15 0.00 0.13 -1.91 -3.44 132.00 122.65 2fc6 h PRO 39 Ca -0.42 -0.11 -0.48 0.00 -0.87 0.00 0.00 66.00 64.13 2fc6 h PRO 39 Cb 1.38 0.00 0.02 0.00 0.13 0.00 0.00 31.00 32.53 2fc6 h PRO 39 CO 0.66 0.63 0.33 -0.65 -0.23 0.00 0.00 178.00 178.75 2fc6 s GLN 40 N -4.02 3.88 0.69 0.86 -0.21 -1.26 -4.93 119.66 114.68 2fc6 s GLN 40 Ca -0.04 0.85 -0.11 0.00 0.02 0.00 0.00 55.36 56.08 2fc6 s GLN 40 Cb 0.13 -2.17 0.00 0.00 1.00 0.00 0.00 33.01 31.97 2fc6 s GLN 40 CO 0.77 -0.26 1.08 0.45 -2.12 0.00 0.00 175.29 175.21 2fc6 s SER 41 N -3.20 5.55 -0.55 5.90 0.15 -0.68 -4.65 113.70 116.22 2fc6 s SER 41 Ca 0.57 1.28 0.05 0.00 0.70 0.00 0.00 55.95 58.55 2fc6 s SER 41 Cb -0.10 -2.14 0.19 0.00 -1.71 0.00 0.00 66.02 62.26 2fc6 s SER 41 CO 0.34 -1.29 0.48 1.41 1.20 0.00 0.00 173.24 175.37 2fc6 n HIS 42 N -3.00 1.35 -3.23 3.44 8.25 -1.26 -0.68 115.22 120.09 2fc6 n HIS 42 Ca 0.07 -3.84 -0.40 0.00 -0.26 0.00 0.00 57.72 53.29 2fc6 n HIS 42 Cb 0.56 -0.26 -0.07 0.00 1.12 0.00 0.00 29.99 31.34 2fc6 n HIS 42 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 2fc6 s ASP 43 N -1.02 6.48 -0.34 0.41 2.15 -1.26 -4.99 116.67 118.10 2fc6 s ASP 43 Ca 0.31 0.58 -0.02 0.00 0.43 0.00 0.00 52.55 53.86 2fc6 s ASP 43 Cb 0.04 -2.29 0.08 0.00 -0.30 0.00 0.00 42.92 40.45 2fc6 s ASP 43 CO -0.15 -0.26 0.08 -0.63 -0.17 0.00 0.00 175.17 174.03 2fc6 s ILE 44 N 2.13 3.02 0.36 4.11 -1.09 -1.26 -4.73 121.20 123.74 2fc6 s ILE 44 Ca 0.22 -1.72 -0.06 0.00 -2.23 0.00 0.00 60.65 56.86 2fc6 s ILE 44 Cb -0.16 -2.91 0.02 0.00 -1.58 0.00 0.00 42.46 37.84 2fc6 s ILE 44 CO 0.09 -0.37 0.57 -0.94 -1.23 0.00 0.00 174.94 173.06 2fc6 s SER 45 N 1.42 0.73 0.31 3.58 1.04 -1.26 -5.18 113.70 114.34 2fc6 s SER 45 Ca 0.01 -1.42 0.08 0.00 0.48 0.00 0.00 55.95 55.10 2fc6 s SER 45 Cb -0.21 0.72 -0.03 0.00 0.10 0.00 0.00 66.02 66.60 2fc6 s SER 45 CO -0.03 -1.42 0.21 -0.83 0.98 0.00 0.00 173.24 172.15 2fc6 s GLY 46 N -3.20 1.71 -0.04 7.32 0.00 -1.26 -5.08 107.32 106.77 2fc6 s GLY 46 Ca 0.27 -1.63 -0.30 0.00 0.00 0.00 0.00 44.72 43.05 2fc6 s GLY 46 CO 0.19 -1.60 1.48 2.56 0.00 0.00 0.00 173.10 175.72 2fc6 s PRO 47 N -3.89 4.24 0.28 2.90 0.04 -1.26 -5.02 135.00 132.28 2fc6 s PRO 47 Ca 0.37 2.02 0.03 0.00 0.04 0.00 0.00 61.00 63.46 2fc6 s PRO 47 Cb -0.06 -3.73 -0.03 0.00 0.04 0.00 0.00 34.50 30.72 2fc6 s PRO 47 CO 0.25 -0.69 0.43 -1.12 0.04 0.00 0.00 177.00 175.90 2fc6 s SER 48 N 2.38 6.30 0.64 6.66 0.01 -1.26 -5.06 113.70 123.37 2fc6 s SER 48 Ca 0.66 0.20 -0.17 0.00 1.31 0.00 0.00 55.95 57.94 2fc6 s SER 48 Cb -0.31 -1.90 -0.05 0.00 0.21 0.00 0.00 66.02 63.96 2fc6 s SER 48 CO 0.26 -0.16 0.66 -0.24 0.41 0.00 0.00 173.24 174.17 2fc6 n SER 49 N -1.55 -0.57 0.00 2.44 2.88 -1.26 -5.34 113.62 110.22 2fc6 n SER 49 Ca -0.07 0.69 0.00 0.00 -1.33 0.00 0.00 58.87 58.16 2fc6 n SER 49 Cb 0.57 -1.26 0.00 0.00 -0.75 0.00 0.00 64.21 62.77 2fc6 n SER 49 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42