#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fc6 s SER 2 N 0.00 4.91 0.03 1.61 1.04 -1.26 -5.04 113.70 114.99 2fc6 s SER 2 Ca 0.00 -0.98 -0.33 0.00 0.48 0.00 0.00 55.95 55.12 2fc6 s SER 2 Cb 0.00 0.12 -0.12 0.00 0.10 0.00 0.00 66.02 66.13 2fc6 s SER 2 CO 0.00 -1.07 1.80 -1.54 0.98 0.00 0.00 173.24 173.41 2fc6 n SER 3 N -1.88 3.52 -0.84 7.02 3.41 -1.26 -3.82 113.62 119.78 2fc6 n SER 3 Ca 0.05 1.00 0.00 0.00 -0.26 0.00 0.00 58.87 59.66 2fc6 n SER 3 Cb 0.63 -1.43 0.00 0.00 -0.26 0.00 0.00 64.21 63.15 2fc6 n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2fc6 n GLY 4 N 4.12 0.17 3.65 5.00 0.00 -1.26 -5.03 105.19 111.84 2fc6 n GLY 4 Ca 0.20 -0.43 -0.42 0.00 0.00 0.00 0.00 46.02 45.37 2fc6 n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2fc6 s SER 5 N -1.85 6.98 -0.92 1.61 0.15 -1.25 -4.99 113.70 113.43 2fc6 s SER 5 Ca 0.00 1.23 -0.04 0.00 0.70 0.00 0.00 55.95 57.84 2fc6 s SER 5 Cb 0.00 -2.49 0.23 0.00 -1.71 0.00 0.00 66.02 62.05 2fc6 s SER 5 CO 0.00 -0.59 0.83 -0.44 1.20 0.00 0.00 173.24 174.24 2fc6 s SER 6 N 1.26 6.31 0.00 5.45 0.01 -1.26 -4.54 113.70 120.93 2fc6 s SER 6 Ca 0.40 -3.55 0.00 0.00 1.31 0.00 0.00 55.95 54.11 2fc6 s SER 6 Cb -0.15 -2.00 0.00 0.00 0.21 0.00 0.00 66.02 64.08 2fc6 s SER 6 CO 0.07 -0.25 0.00 0.61 0.41 0.00 0.00 173.24 174.08 2fc6 n GLY 7 N 2.62 0.00 3.67 3.44 0.00 -1.26 -5.12 105.19 108.53 2fc6 n GLY 7 Ca 0.20 0.00 -0.50 0.00 0.00 0.00 0.00 46.02 45.72 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 1.35 3.65 1.01 0.00 1.02 -1.26 -5.02 118.68 119.43 2fc6 s LEU 10 Ca 0.06 2.27 -0.12 0.00 0.02 0.00 0.00 54.13 56.35 2fc6 s LEU 10 Cb -0.15 -4.59 0.19 0.00 0.02 0.00 0.00 46.19 41.67 2fc6 s LEU 10 CO 0.06 -1.48 1.09 -2.16 0.02 0.00 0.00 176.35 173.88 2fc6 s PRO 11 N -3.42 0.37 0.92 1.29 0.04 -1.26 -5.03 135.00 127.91 2fc6 s PRO 11 Ca 0.74 0.51 -0.12 0.00 0.04 0.00 0.00 61.00 62.18 2fc6 s PRO 11 Cb -0.27 -1.73 0.14 0.00 0.04 0.00 0.00 34.50 32.68 2fc6 s PRO 11 CO 0.32 -2.77 1.09 -1.25 0.04 0.00 0.00 177.00 174.43 2fc6 s PRO 12 N -4.96 1.10 -0.08 0.56 0.04 -1.26 -5.01 135.00 125.39 2fc6 s PRO 12 Ca 0.65 0.76 -0.13 0.00 0.04 0.00 0.00 61.00 62.33 2fc6 s PRO 12 Cb -0.19 -1.79 -0.09 0.00 0.04 0.00 0.00 34.50 32.46 2fc6 s PRO 12 CO 0.58 -2.34 0.48 0.00 0.04 0.00 0.00 177.00 175.76 2fc6 h ALA 13 N -1.62 -0.19 -3.16 8.56 0.00 -2.06 -3.44 119.26 117.35 2fc6 h ALA 13 Ca -0.50 -0.15 -0.62 0.00 0.00 0.00 0.00 54.91 53.64 2fc6 h ALA 13 Cb 1.29 0.07 -0.15 0.00 0.00 0.00 0.00 17.79 19.01 2fc6 h ALA 13 CO 0.55 -0.21 -0.52 -0.08 0.00 0.00 0.00 179.25 178.99 2fc6 s THR 14 N -2.57 5.17 -0.97 0.00 -1.32 -1.26 -5.03 115.64 109.66 2fc6 s THR 14 Ca -0.08 0.11 -0.03 0.00 -1.21 0.00 0.00 61.69 60.48 2fc6 s THR 14 Cb -0.00 -3.38 0.27 0.00 -1.51 0.00 0.00 72.50 67.88 2fc6 s THR 14 CO 0.27 0.39 1.12 1.41 -2.21 0.00 0.00 174.62 175.60 2fc6 n HIS 15 N 4.00 3.56 -4.21 9.09 -0.00 -1.26 -5.01 115.22 121.39 2fc6 n HIS 15 Ca -0.16 -3.48 -0.17 0.00 -0.00 0.00 0.00 57.72 53.92 2fc6 n HIS 15 Cb 0.52 -1.20 -0.13 0.00 -0.00 0.00 0.00 29.99 29.18 2fc6 n HIS 15 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.34 177.37 2fc6 s ARG 16 N -2.12 0.67 0.17 -0.41 3.00 -1.26 -5.13 118.95 113.87 2fc6 s ARG 16 Ca 0.32 -0.62 -0.30 0.00 0.00 0.00 0.00 55.73 55.12 2fc6 s ARG 16 Cb 0.01 -0.59 -0.08 0.00 0.00 0.00 0.00 34.95 34.28 2fc6 s ARG 16 CO -0.01 0.14 1.33 -1.25 0.00 0.00 0.00 175.30 175.51 2fc6 s PRO 17 N -1.05 4.37 -0.10 3.54 0.04 -1.26 -5.03 135.00 135.51 2fc6 s PRO 17 Ca -0.02 2.04 -0.00 0.00 0.04 0.00 0.00 61.00 63.06 2fc6 s PRO 17 Cb -0.07 -3.22 -0.02 0.00 0.04 0.00 0.00 34.50 31.22 2fc6 s PRO 17 CO 0.01 -0.31 -0.09 -1.58 0.04 0.00 0.00 177.00 175.07 2fc6 s HIS 18 N 0.45 2.89 0.84 0.56 2.46 -1.26 -5.12 115.29 116.11 2fc6 s HIS 18 Ca 0.59 -0.25 -0.11 0.00 0.47 0.00 0.00 55.06 55.76 2fc6 s HIS 18 Cb -0.36 -1.79 0.09 0.00 -0.13 0.00 0.00 32.58 30.39 2fc6 s HIS 18 CO 0.35 0.08 1.09 -1.25 -2.47 0.00 0.00 174.74 172.55 2fc6 s PRO 19 N -0.22 1.74 0.00 2.88 0.04 -1.26 -5.00 135.00 133.18 2fc6 s PRO 19 Ca 0.02 0.99 0.00 0.00 0.04 0.00 0.00 61.00 62.05 2fc6 s PRO 19 Cb -0.13 -1.85 0.00 0.00 0.04 0.00 0.00 34.50 32.56 2fc6 s PRO 19 CO 0.03 -1.95 0.00 -2.37 0.04 0.00 0.00 177.00 172.75 2fc6 n THR 20 N -3.71 0.00 -3.18 1.26 5.66 -1.26 -5.06 114.28 107.99 2fc6 n THR 20 Ca 0.08 0.00 0.05 0.00 -3.05 0.00 0.00 64.05 61.13 2fc6 n THR 20 Cb 0.54 -0.55 -0.02 0.00 -1.55 0.00 0.00 70.33 68.76 2fc6 n THR 20 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 175.07 171.47 2fc6 s SER 21 N -2.45 -0.71 0.40 1.09 0.15 -1.26 -5.09 113.70 105.83 2fc6 s SER 21 Ca 0.00 0.50 -0.25 0.00 0.70 0.00 0.00 55.95 56.91 2fc6 s SER 21 Cb 0.00 1.62 -0.08 0.00 -1.71 0.00 0.00 66.02 65.85 2fc6 s SER 21 CO 0.00 -0.13 1.12 -0.63 1.20 0.00 0.00 173.24 174.80 2fc6 s ILE 22 N 2.87 3.35 1.15 6.45 1.09 -1.26 -1.63 121.20 133.22 2fc6 s ILE 22 Ca 0.04 1.09 -0.15 0.00 -1.10 0.00 0.00 60.65 60.53 2fc6 s ILE 22 Cb -0.11 -3.59 0.26 0.00 -1.06 0.00 0.00 42.46 37.96 2fc6 s ILE 22 CO -0.14 0.06 1.05 0.00 -0.10 0.00 0.00 174.94 175.81 2fc6 n ASP 24 N -4.72 1.14 -0.01 0.00 2.03 -1.26 -4.10 116.55 109.64 2fc6 n ASP 24 Ca 0.06 0.00 -0.00 0.00 0.52 0.00 0.00 54.79 55.37 2fc6 n ASP 24 Cb 0.57 1.39 -0.00 0.00 -0.72 0.00 0.00 41.12 42.36 2fc6 n ASP 24 CO 0.00 0.00 0.00 0.78 -1.92 0.00 0.00 177.20 176.06 2fc6 h ASN 25 N 0.00 0.00 -0.34 1.67 2.35 -1.94 -3.38 115.58 113.94 2fc6 h ASN 25 Ca -0.18 0.00 0.10 0.00 -0.55 0.00 0.00 56.30 55.67 2fc6 h ASN 25 Cb 1.29 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.64 2fc6 h ASN 25 CO 0.01 0.07 0.34 0.15 -1.65 0.00 0.00 177.43 176.35 2fc6 h PHE 26 N -0.09 0.00 0.09 1.19 3.04 -1.64 0.57 116.94 120.09 2fc6 h PHE 26 Ca 0.00 0.00 0.00 0.00 3.98 0.00 0.00 57.97 61.95 2fc6 h PHE 26 Cb 0.04 0.00 -0.02 0.00 2.56 0.00 0.00 35.95 38.52 2fc6 h PHE 26 CO -0.02 0.00 -0.29 1.03 -2.02 0.00 0.00 178.31 177.02 2fc6 h SER 27 N 0.00 -0.86 0.00 0.41 0.87 -1.75 -2.88 113.55 109.35 2fc6 h SER 27 Ca 0.16 0.09 -0.02 0.00 -1.23 0.00 0.00 61.79 60.79 2fc6 h SER 27 Cb 0.84 0.31 -0.00 0.00 -0.44 0.00 0.00 62.40 63.11 2fc6 h SER 27 CO -0.00 -0.31 -0.94 0.00 -0.53 0.00 0.00 176.83 175.05 2fc6 n ALA 28 N -2.69 0.79 -0.13 6.23 0.00 -1.04 -4.61 120.51 119.07 2fc6 n ALA 28 Ca -0.05 -0.73 -0.07 0.00 0.00 0.00 0.00 53.44 52.59 2fc6 n ALA 28 Cb 0.23 0.02 -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 -0.89 0.00 0.00 -1.99 -1.10 -3.46 116.97 108.53 2fc6 h TYR 29 Ca -0.03 0.06 0.00 0.00 2.00 0.00 0.00 58.73 60.76 2fc6 h TYR 29 Cb 0.91 0.45 0.00 0.00 2.00 0.00 0.00 36.73 40.09 2fc6 h TYR 29 CO -0.36 -0.38 0.00 0.41 -0.00 0.00 0.00 178.16 177.83 2fc6 n GLY 30 N -1.42 1.70 3.69 3.88 0.00 -0.93 -4.96 105.19 107.15 2fc6 n GLY 30 Ca 0.01 0.00 -0.24 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 -1.82 2.82 -0.09 1.61 1.48 -1.26 -4.65 118.94 117.03 2fc6 s TRP 31 Ca 0.00 -0.18 -0.06 0.00 -1.06 0.00 0.00 56.10 54.80 2fc6 s TRP 31 Cb 0.00 -1.29 0.03 0.00 -1.16 0.00 0.00 33.47 31.06 2fc6 s TRP 31 CO 0.00 0.57 0.23 0.00 -4.06 0.00 0.00 176.95 173.69 2fc6 n PRO 33 N 3.59 0.44 -0.00 0.00 -0.04 -1.26 -1.93 135.00 135.79 2fc6 n PRO 33 Ca -0.19 0.03 0.05 0.00 -0.04 0.00 0.00 63.50 63.34 2fc6 n PRO 33 Cb 0.56 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.45 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 -1.05 0.29 0.00 1.53 4.77 -1.26 -5.06 117.00 116.22 2fc6 n LEU 34 Ca 0.11 -0.32 0.00 0.00 -0.03 0.00 0.00 56.01 55.77 2fc6 n LEU 34 Cb 0.07 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.16 2fc6 n LEU 34 CO 0.09 0.07 0.00 0.61 -1.33 0.00 0.00 177.39 176.83 2fc6 n GLY 35 N 1.48 2.41 0.17 -0.72 0.00 -0.81 -2.70 105.19 105.01 2fc6 n GLY 35 Ca 0.01 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 45.59 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 0.03 0.00 1.61 0.13 -1.98 -2.85 132.00 128.93 2fc6 h PRO 36 Ca 0.00 -0.01 -0.02 0.00 -0.87 0.00 0.00 66.00 65.10 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 0.51 -0.08 1.96 -0.23 0.00 0.00 178.00 180.15 2fc6 h GLN 37 N 0.02 0.00 -6.08 0.86 7.50 -1.93 -3.45 115.11 112.03 2fc6 h GLN 37 Ca -0.00 0.00 -0.71 0.00 0.50 0.00 0.00 58.65 58.44 2fc6 h GLN 37 Cb 0.86 0.00 0.08 0.00 0.05 0.00 0.00 27.48 28.48 2fc6 h GLN 37 CO 0.06 0.08 -0.15 0.00 -1.50 0.00 0.00 178.83 177.33 2fc6 h PRO 39 N 2.19 0.00 -6.62 0.00 0.13 -1.91 -3.44 132.00 122.35 2fc6 h PRO 39 Ca -0.39 0.00 -0.51 0.00 -0.87 0.00 0.00 66.00 64.23 2fc6 h PRO 39 Cb 1.41 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.54 2fc6 h PRO 39 CO 0.62 0.29 -0.04 -0.65 -0.23 0.00 0.00 178.00 178.00 2fc6 s GLN 40 N -3.82 3.72 0.65 0.86 -0.21 -1.26 -4.90 119.66 114.69 2fc6 s GLN 40 Ca -0.01 0.23 -0.12 0.00 0.02 0.00 0.00 55.36 55.49 2fc6 s GLN 40 Cb 0.12 -2.55 -0.02 0.00 1.00 0.00 0.00 33.01 31.56 2fc6 s GLN 40 CO 0.66 0.14 1.04 0.45 -2.12 0.00 0.00 175.29 175.46 2fc6 s SER 41 N -3.01 5.82 -0.61 5.90 0.15 -0.64 -4.63 113.70 116.68 2fc6 s SER 41 Ca 0.47 1.56 0.05 0.00 0.70 0.00 0.00 55.95 58.73 2fc6 s SER 41 Cb -0.11 -2.49 0.19 0.00 -1.71 0.00 0.00 66.02 61.91 2fc6 s SER 41 CO 0.29 -1.14 0.52 1.41 1.20 0.00 0.00 173.24 175.52 2fc6 n HIS 42 N -2.78 2.23 -3.09 3.44 8.25 -1.26 -0.87 115.22 121.13 2fc6 n HIS 42 Ca 0.07 -4.02 -0.40 0.00 -0.26 0.00 0.00 57.72 53.11 2fc6 n HIS 42 Cb 0.54 -0.41 -0.05 0.00 1.12 0.00 0.00 29.99 31.18 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 -1.36 6.77 -0.64 0.41 2.15 -1.26 -5.00 116.67 117.73 2fc6 s ASP 43 Ca 0.31 0.93 -0.09 0.00 0.43 0.00 0.00 52.55 54.12 2fc6 s ASP 43 Cb 0.03 -2.37 0.17 0.00 -0.30 0.00 0.00 42.92 40.45 2fc6 s ASP 43 CO -0.14 -0.25 0.53 -0.63 -0.17 0.00 0.00 175.17 174.51 2fc6 s ILE 44 N 1.69 4.59 0.17 4.11 -1.09 -1.26 -4.72 121.20 124.69 2fc6 s ILE 44 Ca 0.31 -2.37 -0.32 0.00 -2.23 0.00 0.00 60.65 56.04 2fc6 s ILE 44 Cb -0.16 -3.94 -0.10 0.00 -1.58 0.00 0.00 42.46 36.68 2fc6 s ILE 44 CO 0.12 -0.90 1.60 -0.55 -1.23 0.00 0.00 174.94 173.97 2fc6 s SER 45 N 1.94 6.55 0.00 3.58 0.15 -1.26 -5.01 113.70 119.64 2fc6 s SER 45 Ca 0.13 2.66 0.00 0.00 0.70 0.00 0.00 55.95 59.44 2fc6 s SER 45 Cb -0.19 -2.59 0.00 0.00 -1.71 0.00 0.00 66.02 61.52 2fc6 s SER 45 CO -0.04 -0.85 0.00 0.61 1.20 0.00 0.00 173.24 174.16 2fc6 n GLY 46 N 3.80 1.08 0.78 9.45 0.00 -1.26 -5.11 105.19 113.93 2fc6 n GLY 46 Ca 0.14 -1.85 -0.07 0.00 0.00 0.00 0.00 46.02 44.25 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 0.00 -1.50 -3.37 1.61 -0.04 -1.26 -4.48 135.00 125.96 2fc6 n PRO 47 Ca 0.00 -0.39 -0.19 0.00 -0.04 0.00 0.00 63.50 62.88 2fc6 n PRO 47 Cb 0.00 -0.37 0.07 0.00 -0.04 0.00 0.00 33.50 33.16 2fc6 n PRO 47 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2fc6 n SER 48 N -3.42 -4.51 -0.23 3.54 2.88 -1.26 -4.91 113.62 105.71 2fc6 n SER 48 Ca 0.03 -0.49 -0.11 0.00 -1.33 0.00 0.00 58.87 56.98 2fc6 n SER 48 Cb 0.13 -4.44 -0.07 0.00 -0.75 0.00 0.00 64.21 59.08 2fc6 n SER 48 CO 0.00 0.00 0.00 0.77 -1.23 0.00 0.00 175.04 174.58 2fc6 h SER 49 N -2.10 -1.80 0.00 -3.46 4.64 -2.01 -3.55 113.55 105.27 2fc6 h SER 49 Ca -0.50 0.27 0.00 0.00 -0.47 0.00 0.00 61.79 61.09 2fc6 h SER 49 Cb 1.31 0.78 0.00 0.00 -0.31 0.00 0.00 62.40 64.18 2fc6 h SER 49 CO 0.46 -0.34 0.00 0.61 -0.87 0.00 0.00 176.83 176.70