#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 1.46 0.00 0.00 0.00 -1.26 -4.77 120.64 116.07 1fdm n GLU 2 Ca 0.00 -3.19 0.00 0.00 0.00 0.00 0.00 57.16 53.97 1fdm n GLU 2 Cb 0.00 -1.50 0.00 0.00 0.00 0.00 0.00 31.44 29.94 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 -1.01 0.00 3.65 -1.84 0.00 -1.26 -5.07 105.19 99.66 1fdm n GLY 3 Ca 0.18 0.00 -0.58 0.00 0.00 0.00 0.00 46.02 45.62 1fdm n GLY 3 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1fdm n ASP 4 N 0.00 1.55 -4.12 1.61 2.03 -1.26 -4.93 116.55 111.43 1fdm n ASP 4 Ca 0.00 1.12 -0.08 0.00 0.52 0.00 0.00 54.79 56.35 1fdm n ASP 4 Cb 0.00 -1.06 -0.10 0.00 -0.72 0.00 0.00 41.12 39.24 1fdm n ASP 4 CO 0.00 0.00 0.00 -1.81 -1.92 0.00 0.00 177.20 173.47 1fdm s ASP 5 N 2.01 0.39 0.37 1.67 1.01 -1.26 -5.01 116.67 115.85 1fdm s ASP 5 Ca 0.95 -1.10 0.25 0.00 0.71 0.00 0.00 52.55 53.35 1fdm s ASP 5 Cb -1.16 0.25 0.59 0.00 1.01 0.00 0.00 42.92 43.61 1fdm s ASP 5 CO 0.62 -0.67 1.69 1.55 0.21 0.00 0.00 175.17 178.58 1fdm h PRO 6 N 2.99 0.00 0.19 8.23 0.13 -2.01 -3.27 132.00 138.26 1fdm h PRO 6 Ca -0.35 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.78 1fdm h PRO 6 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1fdm h PRO 6 CO 0.62 0.00 -0.09 0.00 -0.23 0.00 0.00 178.00 178.30 1fdm h ALA 7 N 2.16 -0.26 -0.02 -0.56 0.00 -1.98 -3.20 119.26 115.42 1fdm h ALA 7 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1fdm h ALA 7 Cb 0.86 0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.75 1fdm h ALA 7 CO 0.00 -0.25 0.31 0.87 0.00 0.00 0.00 179.25 180.18 1fdm h LYS 8 N -1.05 0.00 0.00 0.00 1.57 -1.97 -1.55 116.57 113.57 1fdm h LYS 8 Ca -0.03 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 1fdm h LYS 8 Cb 0.28 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.59 1fdm h LYS 8 CO 0.04 0.00 0.00 0.00 -0.57 0.00 0.00 179.45 178.92 1fdm n ALA 9 N -1.92 0.00 -0.15 3.86 0.00 -1.21 -1.77 120.51 119.32 1fdm n ALA 9 Ca -0.02 0.00 0.17 0.00 0.00 0.00 0.00 53.44 53.60 1fdm n ALA 9 Cb 0.37 0.00 0.54 0.00 0.00 0.00 0.00 19.45 20.36 1fdm n ALA 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1fdm h ALA 10 N -2.01 2.22 -0.46 0.00 0.00 -1.67 -1.23 119.26 116.11 1fdm h ALA 10 Ca 0.00 -0.00 0.09 0.00 0.00 0.00 0.00 54.91 55.00 1fdm h ALA 10 Cb 0.00 -0.03 -0.10 0.00 0.00 0.00 0.00 17.79 17.66 1fdm h ALA 10 CO 0.00 -0.44 -0.33 0.35 0.00 0.00 0.00 179.25 178.83 1fdm h PHE 11 N 0.33 -0.93 0.00 0.00 3.57 -1.25 1.00 116.94 119.66 1fdm h PHE 11 Ca 0.37 0.06 -0.04 0.00 3.53 0.00 0.00 57.97 61.89 1fdm h PHE 11 Cb 0.97 0.48 -0.01 0.00 2.79 0.00 0.00 35.95 40.18 1fdm h PHE 11 CO -0.00 -0.38 -0.21 0.22 -2.23 0.00 0.00 178.31 175.71 1fdm h ASP 12 N -0.23 0.00 0.00 0.41 3.58 -0.40 -2.03 116.42 117.76 1fdm h ASP 12 Ca 0.19 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.64 1fdm h ASP 12 Cb 0.54 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.59 1fdm h ASP 12 CO -0.59 0.21 0.00 -0.24 -2.88 0.00 0.00 179.24 175.74 1fdm n SER 13 N -4.26 0.00 -0.63 2.28 2.88 0.26 -1.41 113.62 112.75 1fdm n SER 13 Ca -0.02 0.01 0.48 0.00 -1.33 0.00 0.00 58.87 58.01 1fdm n SER 13 Cb 0.27 0.00 0.74 0.00 -0.75 0.00 0.00 64.21 64.47 1fdm n SER 13 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1fdm n LEU 14 N -0.46 0.00 -0.07 2.46 -0.00 0.27 0.61 117.00 119.82 1fdm n LEU 14 Ca 0.00 0.93 -0.10 0.00 -0.00 0.00 0.00 56.01 56.84 1fdm n LEU 14 Cb 0.00 -0.45 -0.09 0.00 -0.00 0.00 0.00 43.42 42.88 1fdm n LEU 14 CO 0.00 -0.93 0.22 1.56 -0.00 0.00 0.00 177.39 178.24 1fdm h GLN 15 N 0.00 0.00 -0.12 1.47 4.20 -1.46 -3.25 115.11 115.95 1fdm h GLN 15 Ca 0.85 0.00 0.03 0.00 0.06 0.00 0.00 58.65 59.60 1fdm h GLN 15 Cb 3.55 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 31.33 1fdm h GLN 15 CO -0.01 0.70 0.60 0.00 -0.67 0.00 0.00 178.83 179.45 1fdm h ALA 16 N -0.33 1.73 -0.06 3.87 0.00 0.14 0.46 119.26 125.08 1fdm h ALA 16 Ca -0.02 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1fdm h ALA 16 Cb 0.72 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 1fdm h ALA 16 CO -0.01 -0.67 0.02 0.43 0.00 0.00 0.00 179.25 179.02 1fdm n SER 17 N -2.89 1.87 -3.62 0.00 7.64 -0.71 -4.34 113.62 111.56 1fdm n SER 17 Ca 0.01 -2.09 -0.29 0.00 1.01 0.00 0.00 58.87 57.51 1fdm n SER 17 Cb 0.67 -0.52 0.05 0.00 -1.01 0.00 0.00 64.21 63.40 1fdm n SER 17 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1fdm n ALA 18 N 0.14 -2.55 1.03 -0.43 0.00 0.16 -4.87 120.51 113.99 1fdm n ALA 18 Ca 0.03 -0.19 0.11 0.00 0.00 0.00 0.00 53.44 53.40 1fdm n ALA 18 Cb 0.41 -4.34 0.06 0.00 0.00 0.00 0.00 19.45 15.58 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 -4.02 0.00 0.00 0.00 5.66 -1.19 -4.73 114.28 110.01 1fdm n THR 19 Ca -0.09 -0.29 0.00 0.00 -3.05 0.00 0.00 64.05 60.62 1fdm n THR 19 Cb 0.59 1.21 0.00 0.00 -1.55 0.00 0.00 70.33 70.58 1fdm n THR 19 CO 0.00 0.00 0.00 -1.84 -3.05 0.00 0.00 175.07 170.18 1fdm n GLU 20 N 0.18 0.00 0.00 1.09 0.28 -1.26 -5.03 120.64 115.90 1fdm n GLU 20 Ca 0.11 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.11 1fdm n GLU 20 Cb 0.48 -0.03 0.00 0.00 1.43 0.00 0.00 31.44 33.32 1fdm n GLU 20 CO 0.00 0.00 0.00 2.48 -0.16 0.00 0.00 177.13 179.45 1fdm n TYR 21 N -2.37 0.00 -3.00 -1.84 0.18 -1.26 -5.03 117.16 103.84 1fdm n TYR 21 Ca 0.00 0.00 -0.44 0.00 1.88 0.00 0.00 57.90 59.34 1fdm n TYR 21 Cb 0.00 0.00 0.01 0.00 -0.38 0.00 0.00 39.34 38.97 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 0.00 4.93 0.64 -3.48 3.06 -1.26 -4.59 119.36 118.66 1fdm n ILE 22 Ca 0.00 -5.50 0.10 0.00 -2.50 0.00 0.00 62.75 54.85 1fdm n ILE 22 Cb 0.00 -2.28 0.11 0.00 0.54 0.00 0.00 39.64 38.01 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 2.08 0.83 0.20 4.50 0.00 -1.20 -3.62 105.19 107.97 1fdm n GLY 23 Ca 0.28 -0.57 0.13 0.00 0.00 0.00 0.00 46.02 45.86 1fdm n GLY 23 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1fdm h TYR 24 N 3.77 0.00 -0.04 1.61 0.05 -1.81 -3.38 116.97 117.17 1fdm h TYR 24 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 1fdm h TYR 24 Cb 0.82 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.56 1fdm h TYR 24 CO 0.06 0.00 0.00 0.00 -1.05 0.00 0.00 178.16 177.17 1fdm n ALA 25 N -1.83 0.00 -1.63 3.88 0.00 -1.26 -4.98 120.51 114.68 1fdm n ALA 25 Ca -0.02 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.48 1fdm n ALA 25 Cb 0.06 -0.13 0.14 0.00 0.00 0.00 0.00 19.45 19.52 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 -1.58 0.00 -0.12 0.00 2.14 -1.26 -4.71 117.44 111.91 1fdm n TRP 26 Ca 0.00 -1.06 -0.09 0.00 2.07 0.00 0.00 57.50 58.42 1fdm n TRP 26 Cb 0.13 -0.19 -0.01 0.00 -0.81 0.00 0.00 31.31 30.43 1fdm n TRP 26 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 1fdm h ALA 27 N 0.62 0.46 0.00 -1.67 0.00 -1.86 0.73 119.26 117.55 1fdm h ALA 27 Ca -0.04 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1fdm h ALA 27 Cb 1.18 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.83 1fdm h ALA 27 CO 0.02 -0.00 0.00 1.98 0.00 0.00 0.00 179.25 181.25 1fdm h MET 28 N 0.45 0.00 0.53 0.00 1.85 -1.86 -2.07 114.93 113.84 1fdm h MET 28 Ca 0.13 0.00 -0.03 0.00 -0.61 0.00 0.00 59.70 59.19 1fdm h MET 28 Cb 0.08 0.00 0.01 0.00 0.43 0.00 0.00 31.60 32.11 1fdm h MET 28 CO -0.02 0.00 -0.25 0.28 -0.40 0.00 0.00 176.91 176.52 1fdm h VAL 29 N 0.00 0.00 -0.07 -5.77 2.07 -1.16 -1.87 116.25 109.45 1fdm h VAL 29 Ca 0.00 -0.17 -0.21 0.00 0.82 0.00 0.00 66.70 67.14 1fdm h VAL 29 Cb 0.64 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.41 1fdm h VAL 29 CO 0.00 0.00 -0.82 -0.37 0.02 0.00 0.00 177.57 176.40 1fdm h VAL 30 N -0.88 1.36 -0.12 2.57 -1.51 -1.52 -2.92 116.25 113.23 1fdm h VAL 30 Ca -0.07 -2.19 0.04 0.00 -1.23 0.00 0.00 66.70 63.25 1fdm h VAL 30 Cb 0.54 2.18 -0.06 0.00 -2.13 0.00 0.00 31.29 31.83 1fdm h VAL 30 CO 0.12 0.67 -0.24 0.58 -1.23 0.00 0.00 177.57 177.46 1fdm h VAL 31 N 0.33 0.42 0.25 7.19 2.07 -1.45 -1.39 116.25 123.67 1fdm h VAL 31 Ca -0.05 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.45 1fdm h VAL 31 Cb 1.42 0.42 0.00 0.00 -1.52 0.00 0.00 31.29 31.62 1fdm h VAL 31 CO 0.15 0.00 -0.12 -0.29 0.02 0.00 0.00 177.57 177.33 1fdm h ILE 32 N -0.31 0.80 -0.43 4.57 6.09 -1.38 -0.33 117.51 126.51 1fdm h ILE 32 Ca 0.10 -0.26 0.12 0.00 -1.37 0.00 0.00 64.86 63.45 1fdm h ILE 32 Cb 0.46 0.95 -0.02 0.00 0.47 0.00 0.00 36.82 38.68 1fdm h ILE 32 CO -0.30 0.06 0.71 0.58 -3.07 0.00 0.00 178.15 176.13 1fdm h VAL 33 N -0.46 0.14 -0.06 2.19 2.07 -1.28 1.37 116.25 120.21 1fdm h VAL 33 Ca -0.03 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.46 1fdm h VAL 33 Cb 0.35 0.39 -0.00 0.00 -1.52 0.00 0.00 31.29 30.51 1fdm h VAL 33 CO 0.06 0.00 -0.07 1.23 0.02 0.00 0.00 177.57 178.80 1fdm h GLY 34 N 0.00 0.17 0.93 2.17 0.00 0.06 -2.29 103.07 104.12 1fdm h GLY 34 Ca 0.20 -0.18 -0.15 0.00 0.00 0.00 0.00 47.33 47.20 1fdm h GLY 34 CO -0.00 0.16 -0.52 0.00 0.00 0.00 0.00 176.54 176.19 1fdm h ALA 35 N 0.54 0.24 0.24 3.60 0.00 0.19 0.28 119.26 124.35 1fdm h ALA 35 Ca 0.01 -0.51 -0.01 0.00 0.00 0.00 0.00 54.91 54.40 1fdm h ALA 35 Cb 0.60 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1fdm h ALA 35 CO 0.02 0.43 -0.12 1.15 0.00 0.00 0.00 179.25 180.73 1fdm h THR 36 N 0.22 0.00 0.00 0.00 2.02 -0.39 0.19 112.91 114.95 1fdm h THR 36 Ca -0.03 -0.02 -0.02 0.00 0.77 0.00 0.00 66.41 67.12 1fdm h THR 36 Cb 1.15 0.00 -0.00 0.00 -1.74 0.00 0.00 68.15 67.56 1fdm h THR 36 CO 0.11 0.00 -0.09 0.40 0.37 0.00 0.00 175.52 176.30 1fdm h ILE 37 N -0.35 0.21 0.00 3.11 2.04 -1.56 -1.14 117.51 119.83 1fdm h ILE 37 Ca -0.03 -0.89 0.00 0.00 1.00 0.00 0.00 64.86 64.94 1fdm h ILE 37 Cb 0.25 1.74 0.00 0.00 -0.74 0.00 0.00 36.82 38.07 1fdm h ILE 37 CO 0.06 0.09 -0.01 1.23 0.00 0.00 0.00 178.15 179.52 1fdm h GLY 38 N 2.54 0.00 1.77 5.37 0.00 -0.43 -2.88 103.07 109.44 1fdm h GLY 38 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1fdm h GLY 38 CO 0.01 0.00 0.10 -2.22 0.00 0.00 0.00 176.54 174.43 1fdm h ILE 39 N -0.26 0.00 0.00 2.60 2.04 -0.61 0.04 117.51 121.31 1fdm h ILE 39 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 1fdm h ILE 39 Cb 0.01 0.67 0.00 0.00 -0.74 0.00 0.00 36.82 36.76 1fdm h ILE 39 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 178.15 179.32 1fdm n LYS 40 N -2.64 0.00 0.18 2.37 0.00 -0.43 -1.17 118.16 116.47 1fdm n LYS 40 Ca -0.02 0.48 0.12 0.00 0.00 0.00 0.00 58.31 58.90 1fdm n LYS 40 Cb 0.15 -1.22 0.63 0.00 0.00 0.00 0.00 35.03 34.59 1fdm n LYS 40 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.40 178.65 1fdm h LEU 41 N 0.00 0.00 0.00 3.14 5.85 -1.28 0.93 115.31 123.95 1fdm h LEU 41 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1fdm h LEU 41 Cb 0.00 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.03 1fdm h LEU 41 CO 0.00 0.00 0.00 0.49 -0.34 0.00 0.00 178.44 178.59 1fdm n PHE 42 N -2.35 0.00 1.60 1.25 3.01 -0.02 -4.14 117.46 116.81 1fdm n PHE 42 Ca -0.01 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.45 1fdm n PHE 42 Cb 0.08 -0.34 0.01 0.00 -0.01 0.00 0.00 39.48 39.22 1fdm n PHE 42 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 1fdm n LYS 43 N -1.59 1.04 -0.06 -1.08 4.76 -0.31 -2.99 118.16 117.92 1fdm n LYS 43 Ca 0.00 -0.04 -0.06 0.00 -2.87 0.00 0.00 58.31 55.34 1fdm n LYS 43 Cb 0.00 -1.19 0.14 0.00 -1.84 0.00 0.00 35.03 32.13 1fdm n LYS 43 CO 0.00 0.00 0.00 0.87 -1.37 0.00 0.00 177.40 176.90 1fdm h LYS 44 N 0.06 0.69 0.00 1.97 1.79 -0.93 -3.36 116.57 116.79 1fdm h LYS 44 Ca 0.00 -0.25 0.00 0.00 -2.18 0.00 0.00 60.65 58.22 1fdm h LYS 44 Cb 0.20 -0.05 0.00 0.00 -1.58 0.00 0.00 32.23 30.81 1fdm h LYS 44 CO 0.00 0.83 -0.01 1.19 -1.08 0.00 0.00 179.45 180.39 1fdm n PHE 45 N -4.14 0.00 -1.40 -1.35 3.72 -1.25 -4.97 117.46 108.08 1fdm n PHE 45 Ca 0.00 0.00 -0.14 0.00 -0.05 0.00 0.00 57.45 57.27 1fdm n PHE 45 Cb 0.40 0.04 -0.06 0.00 -0.94 0.00 0.00 39.48 38.92 1fdm n PHE 45 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 176.76 179.12 1fdm n THR 46 N 0.00 0.00 -3.83 4.37 -1.04 -1.16 -4.90 114.28 107.72 1fdm n THR 46 Ca 0.00 0.00 -0.06 0.00 -2.04 0.00 0.00 64.05 61.95 1fdm n THR 46 Cb 0.50 -1.53 -0.00 0.00 -1.82 0.00 0.00 70.33 67.48 1fdm n THR 46 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 1fdm s SER 47 N -2.67 -0.13 0.42 8.00 0.15 -1.25 -5.03 113.70 113.19 1fdm s SER 47 Ca 0.00 -0.75 0.23 0.00 0.70 0.00 0.00 55.95 56.13 1fdm s SER 47 Cb 0.00 0.69 0.42 0.00 -1.71 0.00 0.00 66.02 65.42 1fdm s SER 47 CO 0.00 -1.32 1.63 0.07 1.20 0.00 0.00 173.24 174.81 1fdm h LYS 48 N 2.00 0.00 -0.72 5.44 2.10 -1.90 -3.21 116.57 120.28 1fdm h LYS 48 Ca -0.25 0.00 0.21 0.00 -2.00 0.00 0.00 60.65 58.61 1fdm h LYS 48 Cb 1.24 0.00 -0.03 0.00 -0.90 0.00 0.00 32.23 32.54 1fdm h LYS 48 CO 0.31 0.11 0.75 0.00 -2.00 0.00 0.00 179.45 178.62 1fdm h ALA 49 N 1.89 2.53 0.00 0.07 0.00 -1.94 -3.51 119.26 118.30 1fdm h ALA 49 Ca -0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1fdm h ALA 49 Cb 1.01 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.86 1fdm h ALA 49 CO 0.01 -1.13 0.00 -1.13 0.00 0.00 0.00 179.25 177.01