#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fdm n GLU 2 N 0.00 -2.41 0.00 0.00 0.00 -1.26 -4.95 120.64 112.01 1fdm n GLU 2 Ca 0.00 1.59 0.00 0.00 0.00 0.00 0.00 57.16 58.75 1fdm n GLU 2 Cb 0.00 -2.94 0.00 0.00 0.00 0.00 0.00 31.44 28.50 1fdm n GLU 2 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1fdm n GLY 3 N -3.57 1.15 2.84 8.31 0.00 -1.26 -4.99 105.19 107.68 1fdm n GLY 3 Ca 0.01 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.01 1fdm n GLY 3 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1fdm s ASP 4 N -0.93 -0.98 0.16 1.61 1.11 -1.26 -5.16 116.67 111.21 1fdm s ASP 4 Ca 0.00 -0.90 -0.25 0.00 0.18 0.00 0.00 52.55 51.59 1fdm s ASP 4 Cb 0.00 1.28 0.07 0.00 1.07 0.00 0.00 42.92 45.33 1fdm s ASP 4 CO 0.00 -0.06 0.98 -1.81 1.18 0.00 0.00 175.17 175.46 1fdm s ASP 5 N 1.31 -0.14 -1.35 0.27 1.11 -1.26 -5.05 116.67 111.55 1fdm s ASP 5 Ca 0.23 -0.44 -0.16 0.00 0.18 0.00 0.00 52.55 52.35 1fdm s ASP 5 Cb 0.03 0.48 0.02 0.00 1.07 0.00 0.00 42.92 44.52 1fdm s ASP 5 CO -0.09 -0.90 2.11 -0.81 1.18 0.00 0.00 175.17 176.66 1fdm n PRO 6 N -0.50 2.72 -3.77 8.23 -0.04 -1.26 -4.39 135.00 135.99 1fdm n PRO 6 Ca -0.06 -2.61 -0.23 0.00 -0.04 0.00 0.00 63.50 60.55 1fdm n PRO 6 Cb 0.61 -3.29 0.03 0.00 -0.04 0.00 0.00 33.50 30.80 1fdm n PRO 6 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1fdm n ALA 7 N 6.79 -1.87 0.17 0.55 0.00 -1.26 -4.78 120.51 120.11 1fdm n ALA 7 Ca 0.51 -0.11 0.11 0.00 0.00 0.00 0.00 53.44 53.96 1fdm n ALA 7 Cb 0.40 -2.39 0.59 0.00 0.00 0.00 0.00 19.45 18.05 1fdm n ALA 7 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1fdm n LYS 8 N -4.37 0.14 0.10 0.00 4.81 -1.26 -2.43 118.16 115.15 1fdm n LYS 8 Ca -0.23 0.64 -0.04 0.00 -0.87 0.00 0.00 58.31 57.80 1fdm n LYS 8 Cb 0.65 -1.97 -0.02 0.00 0.02 0.00 0.00 35.03 33.71 1fdm n LYS 8 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1fdm h ALA 9 N 1.97 -0.94 -0.33 3.14 0.00 -1.95 -2.57 119.26 118.58 1fdm h ALA 9 Ca 0.00 -0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.77 1fdm h ALA 9 Cb 0.02 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1fdm h ALA 9 CO 0.00 -0.92 -0.10 0.00 0.00 0.00 0.00 179.25 178.22 1fdm h ALA 10 N -1.85 0.46 -0.92 0.00 0.00 -1.91 -2.56 119.26 112.47 1fdm h ALA 10 Ca -0.03 -0.31 0.27 0.00 0.00 0.00 0.00 54.91 54.84 1fdm h ALA 10 Cb 0.20 -0.12 -0.15 0.00 0.00 0.00 0.00 17.79 17.73 1fdm h ALA 10 CO 0.04 0.32 0.33 0.35 0.00 0.00 0.00 179.25 180.30 1fdm h PHE 11 N 0.44 0.52 -0.30 0.00 3.57 -1.57 1.41 116.94 121.00 1fdm h PHE 11 Ca 0.08 0.05 -0.14 0.00 3.53 0.00 0.00 57.97 61.49 1fdm h PHE 11 Cb 0.61 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 39.26 1fdm h PHE 11 CO 0.05 -0.21 -0.39 0.22 -2.23 0.00 0.00 178.31 175.75 1fdm h ASP 12 N 0.23 0.76 0.00 0.41 1.82 -1.25 -2.00 116.42 116.40 1fdm h ASP 12 Ca 0.61 -0.34 0.00 0.00 -0.39 0.00 0.00 57.03 56.91 1fdm h ASP 12 Cb 1.30 -0.21 0.00 0.00 0.68 0.00 0.00 39.33 41.10 1fdm h ASP 12 CO -0.65 1.06 0.00 -0.24 -1.61 0.00 0.00 179.24 177.80 1fdm n SER 13 N -4.04 0.00 -0.33 2.28 2.88 0.43 -0.49 113.62 114.35 1fdm n SER 13 Ca -0.02 0.28 0.22 0.00 -1.33 0.00 0.00 58.87 58.03 1fdm n SER 13 Cb 0.52 -0.19 0.44 0.00 -0.75 0.00 0.00 64.21 64.24 1fdm n SER 13 CO 0.00 0.00 0.00 0.17 -1.23 0.00 0.00 175.04 173.98 1fdm h LEU 14 N 0.00 0.34 -0.10 2.46 8.10 0.02 0.62 115.31 126.76 1fdm h LEU 14 Ca 0.00 0.21 -0.24 0.00 0.11 0.00 0.00 57.88 57.95 1fdm h LEU 14 Cb 0.00 0.20 0.01 0.00 -0.44 0.00 0.00 40.66 40.43 1fdm h LEU 14 CO 0.00 -0.19 -0.90 -0.61 -4.11 0.00 0.00 178.44 172.64 1fdm h GLN 15 N 0.25 0.75 0.00 0.17 5.75 -1.44 -3.24 115.11 117.35 1fdm h GLN 15 Ca 0.71 -0.69 0.00 0.00 -0.15 0.00 0.00 58.65 58.51 1fdm h GLN 15 Cb 1.61 0.17 0.00 0.00 1.07 0.00 0.00 27.48 30.33 1fdm h GLN 15 CO -0.65 1.29 0.00 0.00 -2.65 0.00 0.00 178.83 176.81 1fdm n ALA 16 N -2.62 0.00 -2.22 3.38 0.00 0.21 -0.15 120.51 119.11 1fdm n ALA 16 Ca -0.09 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 52.92 1fdm n ALA 16 Cb 0.81 0.10 0.00 0.00 0.00 0.00 0.00 19.45 20.36 1fdm n ALA 16 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1fdm n SER 17 N -0.58 4.49 0.00 0.00 2.88 -0.87 -2.87 113.62 116.67 1fdm n SER 17 Ca 0.00 -2.90 0.00 0.00 -1.33 0.00 0.00 58.87 54.64 1fdm n SER 17 Cb 0.00 -1.69 0.00 0.00 -0.75 0.00 0.00 64.21 61.77 1fdm n SER 17 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1fdm n ALA 18 N 7.05 0.34 0.00 -1.46 0.00 -1.13 -4.84 120.51 120.48 1fdm n ALA 18 Ca 0.49 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.93 1fdm n ALA 18 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.87 1fdm n ALA 18 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 1fdm n THR 19 N 0.00 0.00 0.00 0.00 5.66 -1.26 -4.89 114.28 113.79 1fdm n THR 19 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 1fdm n THR 19 Cb 0.00 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.78 1fdm n THR 19 CO 0.00 0.00 0.00 1.21 -3.05 0.00 0.00 175.07 173.23 1fdm n GLU 20 N 0.00 0.00 -0.31 1.09 4.07 -1.26 -3.62 120.64 120.61 1fdm n GLU 20 Ca 0.00 0.00 0.06 0.00 -0.06 0.00 0.00 57.16 57.16 1fdm n GLU 20 Cb 0.00 0.00 0.20 0.00 -0.06 0.00 0.00 31.44 31.58 1fdm n GLU 20 CO 0.00 0.00 0.00 2.48 -0.06 0.00 0.00 177.13 179.55 1fdm n TYR 21 N 0.00 0.76 -4.09 4.31 0.18 -1.26 -4.88 117.16 112.18 1fdm n TYR 21 Ca 0.00 -0.32 -0.34 0.00 1.88 0.00 0.00 57.90 59.12 1fdm n TYR 21 Cb 0.00 -0.11 -0.01 0.00 -0.38 0.00 0.00 39.34 38.85 1fdm n TYR 21 CO 0.00 0.00 0.00 1.51 -2.08 0.00 0.00 176.86 176.29 1fdm n ILE 22 N 0.61 -1.52 -2.18 -3.48 3.06 -1.24 -1.17 119.36 113.44 1fdm n ILE 22 Ca 0.15 -0.03 0.00 0.00 -2.50 0.00 0.00 62.75 60.37 1fdm n ILE 22 Cb 0.49 -2.18 0.00 0.00 0.54 0.00 0.00 39.64 38.49 1fdm n ILE 22 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 1fdm n GLY 23 N -1.53 -0.42 4.07 4.50 0.00 0.78 -0.73 105.19 111.85 1fdm n GLY 23 Ca 0.05 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.78 1fdm n GLY 23 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1fdm n TYR 24 N -2.12 -1.10 0.00 1.61 4.19 -0.31 -4.41 117.16 115.02 1fdm n TYR 24 Ca 0.00 0.48 0.00 0.00 3.31 0.00 0.00 57.90 61.69 1fdm n TYR 24 Cb 0.42 -2.41 0.00 0.00 0.49 0.00 0.00 39.34 37.84 1fdm n TYR 24 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 1fdm n ALA 25 N -4.14 1.87 -0.43 2.98 0.00 0.09 -4.27 120.51 116.60 1fdm n ALA 25 Ca -0.27 0.00 0.37 0.00 0.00 0.00 0.00 53.44 53.54 1fdm n ALA 25 Cb 0.59 0.24 0.57 0.00 0.00 0.00 0.00 19.45 20.85 1fdm n ALA 25 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 177.50 174.83 1fdm n TRP 26 N -1.86 0.00 0.04 0.00 2.14 -1.25 -1.15 117.44 115.36 1fdm n TRP 26 Ca 0.00 0.00 0.00 0.00 2.07 0.00 0.00 57.50 59.57 1fdm n TRP 26 Cb 0.43 -0.34 0.00 0.00 -0.81 0.00 0.00 31.31 30.58 1fdm n TRP 26 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 1fdm n ALA 27 N -2.50 3.00 0.18 -1.67 0.00 -1.26 -4.77 120.51 113.49 1fdm n ALA 27 Ca 0.31 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.83 1fdm n ALA 27 Cb 1.58 0.05 0.44 0.00 0.00 0.00 0.00 19.45 21.53 1fdm n ALA 27 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 177.50 179.48 1fdm h MET 28 N 0.00 0.00 -0.13 0.00 4.05 -1.76 -1.68 114.93 115.41 1fdm h MET 28 Ca 0.00 0.00 -0.02 0.00 -0.28 0.00 0.00 59.70 59.40 1fdm h MET 28 Cb 0.00 0.00 -0.00 0.00 -0.80 0.00 0.00 31.60 30.80 1fdm h MET 28 CO 0.00 0.00 -0.01 -0.24 0.23 0.00 0.00 176.91 176.89 1fdm h VAL 29 N 0.00 1.27 0.06 -5.77 3.04 -1.32 -1.60 116.25 111.93 1fdm h VAL 29 Ca 0.00 -0.89 -0.23 0.00 -1.01 0.00 0.00 66.70 64.57 1fdm h VAL 29 Cb 0.54 1.61 0.02 0.00 -2.01 0.00 0.00 31.29 31.45 1fdm h VAL 29 CO 0.00 0.26 -0.94 1.62 -1.01 0.00 0.00 177.57 177.50 1fdm h VAL 30 N -0.06 1.36 -0.31 1.51 3.04 -1.49 -2.76 116.25 117.55 1fdm h VAL 30 Ca 0.03 -2.31 0.05 0.00 -1.01 0.00 0.00 66.70 63.47 1fdm h VAL 30 Cb 0.40 2.68 -0.05 0.00 -2.01 0.00 0.00 31.29 32.32 1fdm h VAL 30 CO 0.01 0.69 0.01 0.58 -1.01 0.00 0.00 177.57 177.85 1fdm h VAL 31 N 0.08 0.78 0.32 1.51 2.07 -1.54 -1.95 116.25 117.52 1fdm h VAL 31 Ca -0.13 -0.04 -0.02 0.00 0.82 0.00 0.00 66.70 67.33 1fdm h VAL 31 Cb 1.64 0.67 0.00 0.00 -1.52 0.00 0.00 31.29 32.09 1fdm h VAL 31 CO 0.18 0.02 -0.15 -0.29 0.02 0.00 0.00 177.57 177.35 1fdm h ILE 32 N 0.10 0.70 -0.47 4.57 6.09 -1.37 -1.38 117.51 125.76 1fdm h ILE 32 Ca 0.15 -0.40 0.13 0.00 -1.37 0.00 0.00 64.86 63.37 1fdm h ILE 32 Cb 0.20 0.91 -0.02 0.00 0.47 0.00 0.00 36.82 38.38 1fdm h ILE 32 CO -0.24 0.08 0.71 0.58 -3.07 0.00 0.00 178.15 176.21 1fdm h VAL 33 N -0.66 0.15 0.06 2.19 2.07 -1.27 1.75 116.25 120.55 1fdm h VAL 33 Ca -0.04 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.47 1fdm h VAL 33 Cb 0.46 0.39 0.00 0.00 -1.52 0.00 0.00 31.29 30.63 1fdm h VAL 33 CO 0.07 0.00 -0.03 1.23 0.02 0.00 0.00 177.57 178.86 1fdm h GLY 34 N 0.00 -0.09 0.63 2.17 0.00 -0.47 -0.87 103.07 104.45 1fdm h GLY 34 Ca 0.22 0.03 -0.01 0.00 0.00 0.00 0.00 47.33 47.57 1fdm h GLY 34 CO -0.00 -0.03 -0.10 0.00 0.00 0.00 0.00 176.54 176.40 1fdm h ALA 35 N 0.43 -0.29 0.14 3.60 0.00 0.27 -0.39 119.26 123.02 1fdm h ALA 35 Ca -0.01 -0.19 0.01 0.00 0.00 0.00 0.00 54.91 54.72 1fdm h ALA 35 Cb 0.41 0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.27 1fdm h ALA 35 CO 0.01 -0.48 -0.44 1.15 0.00 0.00 0.00 179.25 179.50 1fdm h THR 36 N -0.66 0.00 0.00 0.00 2.02 -0.29 0.14 112.91 114.12 1fdm h THR 36 Ca -0.03 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.15 1fdm h THR 36 Cb 0.47 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 66.88 1fdm h THR 36 CO 0.05 0.00 0.00 0.40 0.37 0.00 0.00 175.52 176.34 1fdm h ILE 37 N -0.66 0.00 0.00 3.11 2.04 -1.23 0.42 117.51 121.19 1fdm h ILE 37 Ca -0.01 -0.01 0.00 0.00 1.00 0.00 0.00 64.86 65.83 1fdm h ILE 37 Cb 0.65 0.92 0.00 0.00 -0.74 0.00 0.00 36.82 37.64 1fdm h ILE 37 CO -0.22 0.00 0.00 0.61 0.00 0.00 0.00 178.15 178.54 1fdm n GLY 38 N -1.09 -0.49 0.00 5.37 0.00 0.31 -2.64 105.19 106.65 1fdm n GLY 38 Ca -0.03 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.04 1fdm n GLY 38 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1fdm n ILE 39 N -1.67 1.14 0.07 -0.61 -0.00 -0.22 -1.66 119.36 116.41 1fdm n ILE 39 Ca 0.00 0.28 -0.06 0.00 -0.00 0.00 0.00 62.75 62.98 1fdm n ILE 39 Cb 0.00 -1.13 -0.03 0.00 -0.00 0.00 0.00 39.64 38.48 1fdm n ILE 39 CO 0.00 0.00 0.00 0.50 -0.00 0.00 0.00 176.55 177.05 1fdm h LYS 40 N 0.00 -0.26 -0.19 0.38 3.64 -0.21 -0.48 116.57 119.45 1fdm h LYS 40 Ca 0.00 0.02 -0.17 0.00 -1.27 0.00 0.00 60.65 59.23 1fdm h LYS 40 Cb 0.13 0.06 -0.00 0.00 -0.41 0.00 0.00 32.23 32.00 1fdm h LYS 40 CO 0.00 -0.09 -0.57 -0.07 -2.27 0.00 0.00 179.45 176.45 1fdm h LEU 41 N -1.05 0.66 -0.15 5.20 3.38 -1.37 -2.76 115.31 119.22 1fdm h LEU 41 Ca -0.03 -0.36 -0.04 0.00 0.09 0.00 0.00 57.88 57.54 1fdm h LEU 41 Cb 0.29 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.85 1fdm h LEU 41 CO 0.05 1.09 -0.06 0.15 0.09 0.00 0.00 178.44 179.76 1fdm h PHE 42 N 0.45 0.35 -0.28 1.13 3.04 -1.45 -0.71 116.94 119.46 1fdm h PHE 42 Ca 0.00 -0.08 0.06 0.00 3.98 0.00 0.00 57.97 61.93 1fdm h PHE 42 Cb 1.13 -0.08 -0.06 0.00 2.56 0.00 0.00 35.95 39.50 1fdm h PHE 42 CO 0.05 0.61 -0.10 -0.22 -2.02 0.00 0.00 178.31 176.63 1fdm h LYS 43 N -0.02 -0.05 0.00 1.11 1.63 -1.08 0.38 116.57 118.54 1fdm h LYS 43 Ca 0.04 0.00 -0.02 0.00 -0.85 0.00 0.00 60.65 59.82 1fdm h LYS 43 Cb 0.52 0.01 -0.00 0.00 -0.60 0.00 0.00 32.23 32.15 1fdm h LYS 43 CO 0.02 -0.03 -0.10 0.87 -3.45 0.00 0.00 179.45 176.76 1fdm h LYS 44 N -0.05 0.00 -0.87 1.90 1.57 -1.44 0.11 116.57 117.80 1fdm h LYS 44 Ca 0.14 0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 58.77 1fdm h LYS 44 Cb 0.27 0.00 -0.09 0.00 0.08 0.00 0.00 32.23 32.48 1fdm h LYS 44 CO -0.32 0.10 0.20 0.34 -0.57 0.00 0.00 179.45 179.20 1fdm n PHE 45 N -3.52 1.57 0.00 -1.35 7.35 0.12 -2.43 117.46 119.21 1fdm n PHE 45 Ca -0.02 -0.87 0.00 0.00 -0.76 0.00 0.00 57.45 55.80 1fdm n PHE 45 Cb 0.24 -0.51 0.00 0.00 0.35 0.00 0.00 39.48 39.55 1fdm n PHE 45 CO 0.00 0.00 0.00 0.25 -0.76 0.00 0.00 176.76 176.25 1fdm n THR 46 N -0.05 0.00 0.00 -2.13 -2.24 -0.33 -4.39 114.28 105.14 1fdm n THR 46 Ca 0.27 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.05 1fdm n THR 46 Cb 1.02 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 69.25 1fdm n THR 46 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1fdm n SER 47 N 0.00 0.00 0.05 3.42 2.88 0.25 -4.86 113.62 115.36 1fdm n SER 47 Ca 0.00 0.00 0.12 0.00 -1.33 0.00 0.00 58.87 57.66 1fdm n SER 47 Cb 0.00 0.26 0.30 0.00 -0.75 0.00 0.00 64.21 64.01 1fdm n SER 47 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1fdm n LYS 48 N -1.86 0.20 0.00 -1.46 5.02 -1.24 -4.69 118.16 114.14 1fdm n LYS 48 Ca 0.00 0.09 0.00 0.00 -2.02 0.00 0.00 58.31 56.38 1fdm n LYS 48 Cb 0.00 -1.66 0.00 0.00 -0.02 0.00 0.00 35.03 33.35 1fdm n LYS 48 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1fdm n ALA 49 N -1.72 2.44 -0.20 7.82 0.00 -1.02 -5.07 120.51 122.77 1fdm n ALA 49 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.49 1fdm n ALA 49 Cb 0.41 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.86 1fdm n ALA 49 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37