#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 0.00 0.00 0.00 1.02 -1.26 -4.94 120.64 115.46 1fdm n GLU 2 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1fdm n GLU 2 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 1fdm n GLU 2 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1fdm n GLY 3 N 0.00 -1.22 2.76 0.62 0.00 -1.26 -5.13 105.19 100.96 1fdm n GLY 3 Ca 0.00 0.73 -0.03 0.00 0.00 0.00 0.00 46.02 46.72 1fdm n GLY 3 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1fdm s ASP 4 N 0.00 -1.01 0.17 1.61 -1.08 -1.26 -5.16 116.67 109.95 1fdm s ASP 4 Ca 0.00 -1.13 0.02 0.00 -0.52 0.00 0.00 52.55 50.92 1fdm s ASP 4 Cb 0.00 1.32 -0.05 0.00 -1.46 0.00 0.00 42.92 42.73 1fdm s ASP 4 CO 0.00 -0.04 -0.01 -1.81 0.52 0.00 0.00 175.17 173.82 1fdm s ASP 5 N 1.02 1.37 0.31 -0.34 1.01 -1.26 -5.04 116.67 113.74 1fdm s ASP 5 Ca 0.26 -1.15 0.17 0.00 0.71 0.00 0.00 52.55 52.54 1fdm s ASP 5 Cb 0.04 0.09 0.20 0.00 1.01 0.00 0.00 42.92 44.26 1fdm s ASP 5 CO -0.07 -0.53 1.51 1.55 0.21 0.00 0.00 175.17 177.84 1fdm h PRO 6 N 2.69 0.00 0.00 8.23 0.13 -2.03 -3.16 132.00 137.86 1fdm h PRO 6 Ca -0.37 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 1fdm h PRO 6 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1fdm h PRO 6 CO 0.63 0.43 0.00 0.00 -0.23 0.00 0.00 178.00 178.83 1fdm h ALA 7 N 1.57 1.00 -0.21 -0.56 0.00 -2.02 -2.98 119.26 116.07 1fdm h ALA 7 Ca -0.00 0.00 -0.13 0.00 0.00 0.00 0.00 54.91 54.77 1fdm h ALA 7 Cb 1.27 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.05 1fdm h ALA 7 CO 0.06 0.00 -0.43 0.87 0.00 0.00 0.00 179.25 179.74 1fdm h LYS 8 N 0.00 0.50 0.51 0.00 1.57 -1.97 -2.31 116.57 114.86 1fdm h LYS 8 Ca 0.00 -0.26 -0.02 0.00 -1.87 0.00 0.00 60.65 58.50 1fdm h LYS 8 Cb 0.60 0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.91 1fdm h LYS 8 CO 0.00 0.84 -0.32 0.00 -0.57 0.00 0.00 179.45 179.40 1fdm h ALA 9 N 1.13 -1.14 -0.93 3.86 0.00 -1.69 -2.57 119.26 117.91 1fdm h ALA 9 Ca 0.03 -0.16 0.09 0.00 0.00 0.00 0.00 54.91 54.87 1fdm h ALA 9 Cb 0.92 0.44 -0.07 0.00 0.00 0.00 0.00 17.79 19.09 1fdm h ALA 9 CO 0.08 -1.11 0.60 0.00 0.00 0.00 0.00 179.25 178.82 1fdm h ALA 10 N -1.42 1.56 -0.77 0.00 0.00 -1.69 -0.82 119.26 116.12 1fdm h ALA 10 Ca -0.07 -0.01 0.18 0.00 0.00 0.00 0.00 54.91 55.01 1fdm h ALA 10 Cb 0.63 -0.23 -0.12 0.00 0.00 0.00 0.00 17.79 18.06 1fdm h ALA 10 CO 0.06 0.26 0.13 0.35 0.00 0.00 0.00 179.25 180.06 1fdm h PHE 11 N 0.98 0.19 -0.01 0.00 3.57 -1.08 0.98 116.94 121.56 1fdm h PHE 11 Ca 0.43 0.05 -0.12 0.00 3.53 0.00 0.00 57.97 61.86 1fdm h PHE 11 Cb 0.35 0.04 -0.02 0.00 2.79 0.00 0.00 35.95 39.11 1fdm h PHE 11 CO -0.00 -0.16 -0.55 0.38 -2.23 0.00 0.00 178.31 175.75 1fdm h ASP 12 N 0.20 0.03 0.00 0.41 3.04 -0.79 -2.05 116.42 117.27 1fdm h ASP 12 Ca 0.44 -0.02 0.00 0.00 -3.24 0.00 0.00 57.03 54.21 1fdm h ASP 12 Cb 0.79 -0.01 0.00 0.00 -1.04 0.00 0.00 39.33 39.07 1fdm h ASP 12 CO -0.59 0.58 0.00 -0.24 -2.04 0.00 0.00 179.24 176.95 1fdm n SER 13 N -3.89 0.00 -0.38 4.15 2.88 0.27 -1.00 113.62 115.66 1fdm n SER 13 Ca -0.01 0.14 0.32 0.00 -1.33 0.00 0.00 58.87 57.99 1fdm n SER 13 Cb 0.56 -0.14 0.59 0.00 -0.75 0.00 0.00 64.21 64.47 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 0.33 -0.04 2.46 8.10 0.23 0.87 115.31 127.25 1fdm h LEU 14 Ca 0.00 0.20 -0.03 0.00 0.11 0.00 0.00 57.88 58.16 1fdm h LEU 14 Cb 0.00 0.19 0.00 0.00 -0.44 0.00 0.00 40.66 40.41 1fdm h LEU 14 CO 0.00 -0.28 -0.09 -0.61 -4.11 0.00 0.00 178.44 173.35 1fdm h GLN 15 N 0.10 0.14 0.00 0.17 5.75 -1.43 -3.28 115.11 116.56 1fdm h GLN 15 Ca 0.82 -0.09 0.00 0.00 -0.15 0.00 0.00 58.65 59.23 1fdm h GLN 15 Cb 2.28 0.01 0.00 0.00 1.07 0.00 0.00 27.48 30.84 1fdm h GLN 15 CO -0.60 0.68 0.00 0.00 -2.65 0.00 0.00 178.83 176.26 1fdm n ALA 16 N -2.42 -0.01 -2.39 3.38 0.00 0.30 0.33 120.51 119.70 1fdm n ALA 16 Ca -0.08 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 52.93 1fdm n ALA 16 Cb 0.35 0.28 -0.00 0.00 0.00 0.00 0.00 19.45 20.08 1fdm n ALA 16 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1fdm n SER 17 N -1.41 4.69 -2.55 0.00 7.64 -0.91 -2.42 113.62 118.65 1fdm n SER 17 Ca 0.00 -2.90 -0.23 0.00 1.01 0.00 0.00 58.87 56.75 1fdm n SER 17 Cb 0.00 -1.73 0.01 0.00 -1.01 0.00 0.00 64.21 61.48 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 7.94 4.62 0.00 -0.43 0.00 -0.87 -4.83 120.51 126.94 1fdm n ALA 18 Ca 0.50 -4.05 0.00 0.00 0.00 0.00 0.00 53.44 49.89 1fdm n ALA 18 Cb 0.44 -0.65 0.00 0.00 0.00 0.00 0.00 19.45 19.25 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 -0.36 0.00 0.00 0.00 5.66 -1.26 -2.62 114.28 115.70 1fdm n THR 19 Ca 0.31 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.31 1fdm n THR 19 Cb 0.69 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.47 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 0.00 0.00 0.00 1.09 0.00 -1.26 -1.20 120.64 119.27 1fdm n GLU 20 Ca 0.00 0.00 0.14 0.00 0.00 0.00 0.00 57.16 57.30 1fdm n GLU 20 Cb 0.00 0.00 0.78 0.00 0.00 0.00 0.00 31.44 32.22 1fdm n GLU 20 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.13 179.61 1fdm n TYR 21 N 0.00 0.00 -4.00 -1.84 0.18 -1.26 -4.88 117.16 105.36 1fdm n TYR 21 Ca 0.00 0.00 -0.27 0.00 1.88 0.00 0.00 57.90 59.51 1fdm n TYR 21 Cb 0.00 -0.11 -0.03 0.00 -0.38 0.00 0.00 39.34 38.83 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 -1.11 -2.92 -2.90 -3.48 3.06 -0.35 -1.18 119.36 110.49 1fdm n ILE 22 Ca 0.18 -0.54 -0.15 0.00 -2.50 0.00 0.00 62.75 59.75 1fdm n ILE 22 Cb 0.14 -2.50 -0.03 0.00 0.54 0.00 0.00 39.64 37.80 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 -2.07 -0.37 3.75 4.50 0.00 0.15 -0.93 105.19 110.23 1fdm n GLY 23 Ca -0.29 0.02 -0.32 0.00 0.00 0.00 0.00 46.02 45.43 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 -2.60 -0.86 -0.00 1.61 4.19 -0.33 -4.44 117.16 114.74 1fdm n TYR 24 Ca 0.04 0.51 0.01 0.00 3.31 0.00 0.00 57.90 61.77 1fdm n TYR 24 Cb 0.39 -1.38 -0.01 0.00 0.49 0.00 0.00 39.34 38.83 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 -3.13 2.05 -0.15 2.98 0.00 -0.10 -4.62 120.51 117.54 1fdm n ALA 25 Ca 0.09 -0.05 0.24 0.00 0.00 0.00 0.00 53.44 53.72 1fdm n ALA 25 Cb 0.33 -0.03 0.36 0.00 0.00 0.00 0.00 19.45 20.12 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 -1.61 0.00 0.00 0.00 -0.00 -1.22 -0.10 117.44 114.51 1fdm n TRP 26 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.49 1fdm n TRP 26 Cb 0.10 -0.22 0.00 0.00 -0.00 0.00 0.00 31.31 31.19 1fdm n TRP 26 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69 1fdm n ALA 27 N -2.10 1.72 -0.23 -1.67 0.00 -1.26 -4.50 120.51 112.47 1fdm n ALA 27 Ca 0.20 -0.09 0.03 0.00 0.00 0.00 0.00 53.44 53.57 1fdm n ALA 27 Cb 1.39 0.00 0.13 0.00 0.00 0.00 0.00 19.45 20.97 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 0.13 -0.79 0.00 4.05 -1.79 0.16 114.93 116.69 1fdm h MET 28 Ca 0.00 -0.01 0.19 0.00 -0.28 0.00 0.00 59.70 59.60 1fdm h MET 28 Cb 0.00 -0.03 -0.13 0.00 -0.80 0.00 0.00 31.60 30.64 1fdm h MET 28 CO 0.00 0.09 0.10 -0.24 0.23 0.00 0.00 176.91 177.09 1fdm h VAL 29 N 0.13 0.36 -0.02 -5.77 3.04 -0.79 0.17 116.25 113.37 1fdm h VAL 29 Ca 0.37 -0.06 -0.18 0.00 -1.01 0.00 0.00 66.70 65.82 1fdm h VAL 29 Cb 0.62 0.18 -0.01 0.00 -2.01 0.00 0.00 31.29 30.07 1fdm h VAL 29 CO -0.57 0.03 -0.80 -0.37 -1.01 0.00 0.00 177.57 174.84 1fdm h VAL 30 N 0.16 1.46 0.37 1.51 -1.51 -1.11 -2.72 116.25 114.42 1fdm h VAL 30 Ca 0.46 -2.44 -0.00 0.00 -1.23 0.00 0.00 66.70 63.49 1fdm h VAL 30 Cb 0.84 2.33 -0.02 0.00 -2.13 0.00 0.00 31.29 32.31 1fdm h VAL 30 CO -0.64 0.71 -0.37 0.58 -1.23 0.00 0.00 177.57 176.63 1fdm h VAL 31 N 0.13 0.25 0.27 7.19 2.07 0.43 -0.97 116.25 125.63 1fdm h VAL 31 Ca -0.03 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.47 1fdm h VAL 31 Cb 1.40 0.25 0.00 0.00 -1.52 0.00 0.00 31.29 31.42 1fdm h VAL 31 CO 0.12 0.00 -0.13 -0.29 0.02 0.00 0.00 177.57 177.29 1fdm h ILE 32 N -0.76 0.75 -0.44 4.57 6.09 -1.39 0.35 117.51 126.68 1fdm h ILE 32 Ca -0.03 -0.11 0.13 0.00 -1.37 0.00 0.00 64.86 63.48 1fdm h ILE 32 Cb 0.68 0.81 -0.02 0.00 0.47 0.00 0.00 36.82 38.77 1fdm h ILE 32 CO -0.06 0.02 0.71 0.58 -3.07 0.00 0.00 178.15 176.33 1fdm h VAL 33 N -0.42 0.14 -0.01 2.19 2.07 -1.31 1.88 116.25 120.79 1fdm h VAL 33 Ca -0.04 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.48 1fdm h VAL 33 Cb 0.32 0.39 -0.00 0.00 -1.52 0.00 0.00 31.29 30.47 1fdm h VAL 33 CO 0.06 0.00 -0.00 1.23 0.02 0.00 0.00 177.57 178.88 1fdm h GLY 34 N 0.00 0.01 0.65 2.17 0.00 0.48 -0.93 103.07 105.46 1fdm h GLY 34 Ca 0.21 -0.01 -0.01 0.00 0.00 0.00 0.00 47.33 47.52 1fdm h GLY 34 CO -0.00 0.01 -0.08 0.00 0.00 0.00 0.00 176.54 176.47 1fdm h ALA 35 N 0.58 -0.23 0.26 3.60 0.00 0.30 0.91 119.26 124.69 1fdm h ALA 35 Ca 0.00 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.73 1fdm h ALA 35 Cb 0.43 0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.27 1fdm h ALA 35 CO 0.00 -0.45 -0.44 1.15 0.00 0.00 0.00 179.25 179.50 1fdm h THR 36 N -0.58 0.00 0.00 0.00 2.02 -0.38 0.29 112.91 114.26 1fdm h THR 36 Ca -0.02 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.16 1fdm h THR 36 Cb 0.44 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 66.85 1fdm h THR 36 CO 0.04 0.00 0.00 0.40 0.37 0.00 0.00 175.52 176.33 1fdm h ILE 37 N -0.75 0.00 0.03 3.11 2.04 -1.24 0.15 117.51 120.85 1fdm h ILE 37 Ca -0.03 -0.11 -0.00 0.00 1.00 0.00 0.00 64.86 65.72 1fdm h ILE 37 Cb 0.69 0.86 0.00 0.00 -0.74 0.00 0.00 36.82 37.64 1fdm h ILE 37 CO -0.15 0.00 -0.02 1.23 0.00 0.00 0.00 178.15 179.21 1fdm h GLY 38 N 0.65 -0.04 2.00 5.37 0.00 0.11 -2.43 103.07 108.73 1fdm h GLY 38 Ca 0.00 0.02 0.00 0.00 0.00 0.00 0.00 47.33 47.35 1fdm h GLY 38 CO 0.00 -0.02 0.00 1.39 0.00 0.00 0.00 176.54 177.91 1fdm n ILE 39 N -2.33 1.47 0.00 2.60 5.41 -0.28 -1.45 119.36 124.78 1fdm n ILE 39 Ca -0.01 0.46 0.00 0.00 1.00 0.00 0.00 62.75 64.21 1fdm n ILE 39 Cb 0.02 -1.40 0.00 0.00 -0.71 0.00 0.00 39.64 37.55 1fdm n ILE 39 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 176.55 177.72 1fdm n LYS 40 N -1.72 0.00 -0.30 0.38 3.00 0.53 -0.48 118.16 119.57 1fdm n LYS 40 Ca 0.01 0.14 0.05 0.00 -0.00 0.00 0.00 58.31 58.51 1fdm n LYS 40 Cb 0.07 -0.77 0.20 0.00 0.00 0.00 0.00 35.03 34.52 1fdm n LYS 40 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.40 177.33 1fdm h LEU 41 N 0.00 0.66 0.64 3.14 3.38 -1.44 1.21 115.31 122.90 1fdm h LEU 41 Ca 0.00 0.06 -0.03 0.00 0.09 0.00 0.00 57.88 58.00 1fdm h LEU 41 Cb 0.00 -0.06 0.01 0.00 0.09 0.00 0.00 40.66 40.70 1fdm h LEU 41 CO 0.00 0.34 -0.31 0.15 0.09 0.00 0.00 178.44 178.71 1fdm h PHE 42 N 0.76 -0.80 -0.05 1.13 3.57 -1.40 -2.74 116.94 117.42 1fdm h PHE 42 Ca 0.43 -0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.91 1fdm h PHE 42 Cb 0.48 0.26 -0.00 0.00 2.79 0.00 0.00 35.95 39.49 1fdm h PHE 42 CO -0.06 -0.45 0.00 1.17 -2.23 0.00 0.00 178.31 176.74 1fdm n LYS 43 N -5.38 1.31 0.02 1.11 3.00 0.37 -3.98 118.16 114.61 1fdm n LYS 43 Ca -0.12 -0.26 0.04 0.00 -0.00 0.00 0.00 58.31 57.98 1fdm n LYS 43 Cb 0.36 -1.56 0.19 0.00 0.00 0.00 0.00 35.03 34.02 1fdm n LYS 43 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.40 178.57 1fdm n LYS 44 N 0.06 0.02 -2.51 1.64 0.00 0.41 -4.83 118.16 112.96 1fdm n LYS 44 Ca 0.02 0.41 -0.05 0.00 0.00 0.00 0.00 58.31 58.69 1fdm n LYS 44 Cb 0.33 -1.55 0.02 0.00 0.00 0.00 0.00 35.03 33.83 1fdm n LYS 44 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.40 178.59 1fdm n PHE 45 N -1.60 -0.59 -2.36 5.64 3.72 -1.26 -3.55 117.46 117.46 1fdm n PHE 45 Ca 0.01 0.23 -0.09 0.00 -0.05 0.00 0.00 57.45 57.56 1fdm n PHE 45 Cb 0.08 -2.45 0.01 0.00 -0.94 0.00 0.00 39.48 36.18 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 -2.28 -0.62 -0.01 4.37 -1.04 -1.09 -4.94 114.28 108.68 1fdm n THR 46 Ca -0.04 0.00 -0.19 0.00 -2.04 0.00 0.00 64.05 61.78 1fdm n THR 46 Cb 0.53 -1.78 -0.14 0.00 -1.82 0.00 0.00 70.33 67.13 1fdm n THR 46 CO 0.00 0.00 0.00 -1.28 -0.64 0.00 0.00 175.07 173.15 1fdm h SER 47 N -0.28 0.28 0.00 8.00 0.87 -1.83 -3.44 113.55 117.14 1fdm h SER 47 Ca -0.21 -0.91 0.00 0.00 -1.23 0.00 0.00 61.79 59.44 1fdm h SER 47 Cb 1.15 -0.09 0.00 0.00 -0.44 0.00 0.00 62.40 63.02 1fdm h SER 47 CO 0.24 1.33 -0.11 0.29 -0.53 0.00 0.00 176.83 178.05 1fdm n LYS 48 N -4.25 0.00 0.00 2.24 5.02 -1.26 -5.02 118.16 114.88 1fdm n LYS 48 Ca -0.16 -0.24 0.00 0.00 -2.02 0.00 0.00 58.31 55.88 1fdm n LYS 48 Cb 0.73 -0.13 0.00 0.00 -0.02 0.00 0.00 35.03 35.61 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 0.00 0.56 0.83 7.82 0.00 -1.26 -5.08 120.51 123.39 1fdm n ALA 49 Ca 0.00 0.00 0.07 0.00 0.00 0.00 0.00 53.44 53.51 1fdm n ALA 49 Cb 0.55 0.00 0.40 0.00 0.00 0.00 0.00 19.45 20.39 1fdm n ALA 49 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95