#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fdm s GLU 2 N 0.00 3.57 0.00 0.00 2.12 -1.26 -4.90 118.70 118.23 1fdm s GLU 2 Ca 0.00 0.04 0.00 0.00 0.36 0.00 0.00 54.97 55.37 1fdm s GLU 2 Cb 0.00 -3.87 0.00 0.00 0.26 0.00 0.00 34.13 30.52 1fdm s GLU 2 CO 0.00 -0.94 0.00 0.41 -0.54 0.00 0.00 175.26 174.19 1fdm n GLY 3 N 4.77 0.36 3.22 -1.50 0.00 -1.26 -5.14 105.19 105.65 1fdm n GLY 3 Ca 0.01 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.95 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 0.90 0.14 0.00 1.61 1.01 -1.26 -5.02 116.67 114.06 1fdm s ASP 4 Ca 0.00 -0.75 0.00 0.00 0.71 0.00 0.00 52.55 52.51 1fdm s ASP 4 Cb 0.00 0.35 0.00 0.00 1.01 0.00 0.00 42.92 44.28 1fdm s ASP 4 CO 0.00 -0.75 0.00 0.47 0.21 0.00 0.00 175.17 175.10 1fdm n ASP 5 N -0.08 0.00 -0.02 0.27 9.92 -1.26 -4.94 116.55 120.44 1fdm n ASP 5 Ca -0.13 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.13 1fdm n ASP 5 Cb 0.62 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 41.10 1fdm n ASP 5 CO 0.00 0.00 0.00 -0.81 0.13 0.00 0.00 177.20 176.52 1fdm n PRO 6 N 0.00 0.92 -0.04 -0.24 -0.04 -1.26 -2.58 135.00 131.76 1fdm n PRO 6 Ca 0.00 0.00 -0.07 0.00 -0.04 0.00 0.00 63.50 63.39 1fdm n PRO 6 Cb 0.00 -1.02 -0.03 0.00 -0.04 0.00 0.00 33.50 32.41 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 -0.48 2.19 0.08 0.55 0.00 -1.26 -4.57 120.51 117.02 1fdm n ALA 7 Ca 0.00 -0.30 -0.09 0.00 0.00 0.00 0.00 53.44 53.05 1fdm n ALA 7 Cb 0.01 0.37 -0.06 0.00 0.00 0.00 0.00 19.45 19.77 1fdm n ALA 7 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 1fdm h LYS 8 N -0.14 0.12 0.41 0.00 2.10 -1.96 -2.51 116.57 114.58 1fdm h LYS 8 Ca -0.17 -0.16 -0.01 0.00 -2.00 0.00 0.00 60.65 58.30 1fdm h LYS 8 Cb 1.20 0.05 -0.01 0.00 -0.90 0.00 0.00 32.23 32.58 1fdm h LYS 8 CO -0.07 0.99 -0.34 0.00 -2.00 0.00 0.00 179.45 178.03 1fdm h ALA 9 N 0.95 -1.07 -0.88 0.07 0.00 -1.77 -2.36 119.26 114.20 1fdm h ALA 9 Ca -0.04 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.71 1fdm h ALA 9 Cb 1.65 0.53 -0.04 0.00 0.00 0.00 0.00 17.79 19.94 1fdm h ALA 9 CO 0.14 -1.07 0.48 0.00 0.00 0.00 0.00 179.25 178.80 1fdm h ALA 10 N -1.26 1.20 -0.86 0.00 0.00 -1.81 -2.48 119.26 114.04 1fdm h ALA 10 Ca -0.05 -0.13 0.17 0.00 0.00 0.00 0.00 54.91 54.90 1fdm h ALA 10 Cb 0.61 -0.35 -0.16 0.00 0.00 0.00 0.00 17.79 17.89 1fdm h ALA 10 CO -0.00 0.65 -0.23 0.74 0.00 0.00 0.00 179.25 180.40 1fdm h PHE 11 N 1.23 -0.52 -0.62 0.00 -1.00 -1.11 1.19 116.94 116.11 1fdm h PHE 11 Ca 0.31 0.08 -0.08 0.00 2.81 0.00 0.00 57.97 61.09 1fdm h PHE 11 Cb 0.02 0.36 -0.02 0.00 3.61 0.00 0.00 35.95 39.92 1fdm h PHE 11 CO 0.01 -0.37 0.07 -0.44 -1.61 0.00 0.00 178.31 175.97 1fdm h ASP 12 N -0.01 1.00 0.00 2.17 3.32 -0.99 -1.72 116.42 120.19 1fdm h ASP 12 Ca 0.40 -0.27 0.00 0.00 0.02 0.00 0.00 57.03 57.18 1fdm h ASP 12 Cb 0.63 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 39.91 1fdm h ASP 12 CO -0.89 1.03 0.00 -0.24 -1.72 0.00 0.00 179.24 177.42 1fdm n SER 13 N -4.25 0.00 -0.19 6.45 2.88 0.34 -1.92 113.62 116.93 1fdm n SER 13 Ca 0.03 0.37 0.27 0.00 -1.33 0.00 0.00 58.87 58.21 1fdm n SER 13 Cb 0.30 -0.10 0.41 0.00 -0.75 0.00 0.00 64.21 64.07 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 -0.81 0.00 0.04 2.46 -0.00 0.25 0.11 117.00 119.04 1fdm n LEU 14 Ca 0.00 0.74 -0.11 0.00 -0.00 0.00 0.00 56.01 56.64 1fdm n LEU 14 Cb 0.00 -0.25 -0.08 0.00 -0.00 0.00 0.00 43.42 43.09 1fdm n LEU 14 CO 0.00 -0.74 0.44 1.56 -0.00 0.00 0.00 177.39 178.65 1fdm h GLN 15 N 0.00 -0.16 0.00 1.47 4.20 -1.27 -2.84 115.11 116.51 1fdm h GLN 15 Ca 0.47 0.01 0.00 0.00 0.06 0.00 0.00 58.65 59.19 1fdm h GLN 15 Cb 2.89 0.04 0.00 0.00 0.30 0.00 0.00 27.48 30.71 1fdm h GLN 15 CO -0.00 0.31 0.22 0.00 -0.67 0.00 0.00 178.83 178.69 1fdm h ALA 16 N -0.13 1.19 -0.05 3.87 0.00 0.14 0.30 119.26 124.58 1fdm h ALA 16 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1fdm h ALA 16 Cb 0.55 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.34 1fdm h ALA 16 CO 0.03 -0.19 0.00 0.43 0.00 0.00 0.00 179.25 179.52 1fdm n SER 17 N -2.55 1.25 -3.19 0.00 7.64 -0.89 -4.29 113.62 111.59 1fdm n SER 17 Ca -0.02 -2.07 -0.07 0.00 1.01 0.00 0.00 58.87 57.73 1fdm n SER 17 Cb 0.26 -0.45 0.02 0.00 -1.01 0.00 0.00 64.21 63.02 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 0.00 -2.53 0.04 -0.43 0.00 0.10 -4.95 120.51 112.75 1fdm n ALA 18 Ca 0.02 -0.01 0.06 0.00 0.00 0.00 0.00 53.44 53.51 1fdm n ALA 18 Cb 0.29 -2.38 -0.09 0.00 0.00 0.00 0.00 19.45 17.27 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 -2.25 0.00 0.00 0.00 5.66 -1.21 -4.81 114.28 111.67 1fdm n THR 19 Ca -0.05 -0.28 0.00 0.00 -3.05 0.00 0.00 64.05 60.67 1fdm n THR 19 Cb 0.54 0.28 0.00 0.00 -1.55 0.00 0.00 70.33 69.60 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 -1.88 0.00 0.00 1.09 0.28 -1.26 -5.03 120.64 113.84 1fdm n GLU 20 Ca -0.02 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.98 1fdm n GLU 20 Cb 0.31 -0.43 0.00 0.00 1.43 0.00 0.00 31.44 32.75 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 -2.53 0.00 -2.94 -1.84 0.18 -1.26 -5.02 117.16 103.76 1fdm n TYR 21 Ca 0.00 0.00 -0.43 0.00 1.88 0.00 0.00 57.90 59.35 1fdm n TYR 21 Cb 0.27 0.00 0.01 0.00 -0.38 0.00 0.00 39.34 39.23 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 5.05 0.72 -3.48 3.06 -1.26 -4.56 119.36 118.89 1fdm n ILE 22 Ca 0.00 -5.57 0.09 0.00 -2.50 0.00 0.00 62.75 54.76 1fdm n ILE 22 Cb 0.00 -2.20 0.07 0.00 0.54 0.00 0.00 39.64 38.04 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 1.83 0.29 0.33 4.50 0.00 -1.21 -3.86 105.19 107.08 1fdm n GLY 23 Ca 0.28 -0.50 0.15 0.00 0.00 0.00 0.00 46.02 45.96 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 3.32 0.00 0.00 1.61 0.05 -1.80 -3.37 116.97 116.77 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 0.71 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.45 1fdm h TYR 24 CO 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 178.16 177.11 1fdm n ALA 25 N -1.88 0.00 -1.38 3.88 0.00 -1.26 -4.99 120.51 114.87 1fdm n ALA 25 Ca -0.02 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.50 1fdm n ALA 25 Cb 0.37 0.00 0.15 0.00 0.00 0.00 0.00 19.45 19.96 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 -1.12 0.00 -0.24 0.00 2.14 -1.26 -4.68 117.44 112.28 1fdm n TRP 26 Ca 0.00 -1.06 -0.03 0.00 2.07 0.00 0.00 57.50 58.49 1fdm n TRP 26 Cb 0.00 -0.17 0.08 0.00 -0.81 0.00 0.00 31.31 30.41 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 0.37 0.89 0.00 -1.67 0.00 -1.88 0.44 119.26 117.41 1fdm h ALA 27 Ca -0.01 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 1fdm h ALA 27 Cb 1.07 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.68 1fdm h ALA 27 CO 0.00 0.13 -0.26 1.98 0.00 0.00 0.00 179.25 181.11 1fdm h MET 28 N 0.77 0.00 0.00 0.00 1.85 -1.89 -2.64 114.93 113.02 1fdm h MET 28 Ca 0.28 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 59.37 1fdm h MET 28 Cb 0.09 0.00 0.00 0.00 0.43 0.00 0.00 31.60 32.12 1fdm h MET 28 CO -0.14 0.26 0.00 0.28 -0.40 0.00 0.00 176.91 176.91 1fdm n VAL 29 N -3.37 0.00 -0.15 -5.77 0.31 0.15 -1.15 118.33 108.35 1fdm n VAL 29 Ca 0.00 1.20 -0.03 0.00 -0.01 0.00 0.00 64.34 65.50 1fdm n VAL 29 Cb 0.47 -2.15 0.04 0.00 -0.91 0.00 0.00 33.84 31.29 1fdm n VAL 29 CO 0.00 0.00 0.00 -0.37 -1.32 0.00 0.00 176.83 175.14 1fdm h VAL 30 N 0.00 0.57 -1.01 2.52 -1.51 -1.43 0.14 116.25 115.54 1fdm h VAL 30 Ca 0.00 -0.02 0.25 0.00 -1.23 0.00 0.00 66.70 65.70 1fdm h VAL 30 Cb 0.00 0.52 -0.09 0.00 -2.13 0.00 0.00 31.29 29.59 1fdm h VAL 30 CO 0.00 0.01 0.65 0.58 -1.23 0.00 0.00 177.57 177.58 1fdm h VAL 31 N 0.04 0.57 0.26 7.19 2.07 -1.51 -1.53 116.25 123.34 1fdm h VAL 31 Ca 0.23 -0.15 -0.01 0.00 0.82 0.00 0.00 66.70 67.59 1fdm h VAL 31 Cb 0.35 0.11 0.00 0.00 -1.52 0.00 0.00 31.29 30.23 1fdm h VAL 31 CO -0.45 0.08 -0.12 -0.29 0.02 0.00 0.00 177.57 176.81 1fdm h ILE 32 N 0.43 0.73 -0.91 4.57 -0.00 0.83 -2.40 117.51 120.76 1fdm h ILE 32 Ca 0.57 -0.77 0.26 0.00 -0.00 0.00 0.00 64.86 64.92 1fdm h ILE 32 Cb 1.39 1.12 -0.04 0.00 -0.00 0.00 0.00 36.82 39.29 1fdm h ILE 32 CO -0.27 0.15 0.90 0.58 -0.00 0.00 0.00 178.15 179.50 1fdm h VAL 33 N -0.79 0.20 0.07 2.19 2.07 -0.89 2.39 116.25 121.48 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 0.51 0.30 0.00 0.00 -1.52 0.00 0.00 31.29 30.58 1fdm h VAL 33 CO 0.06 0.00 -0.04 1.23 0.02 0.00 0.00 177.57 178.84 1fdm h GLY 34 N 0.00 -0.10 0.59 2.17 0.00 -1.01 -1.63 103.07 103.09 1fdm h GLY 34 Ca 0.43 0.04 -0.01 0.00 0.00 0.00 0.00 47.33 47.79 1fdm h GLY 34 CO -0.00 -0.04 -0.11 0.00 0.00 0.00 0.00 176.54 176.39 1fdm h ALA 35 N 0.46 -0.31 -0.10 3.60 0.00 0.40 0.42 119.26 123.73 1fdm h ALA 35 Ca -0.01 -0.19 0.03 0.00 0.00 0.00 0.00 54.91 54.73 1fdm h ALA 35 Cb 0.38 0.12 -0.06 0.00 0.00 0.00 0.00 17.79 18.23 1fdm h ALA 35 CO 0.02 -0.47 -0.52 1.15 0.00 0.00 0.00 179.25 179.43 1fdm h THR 36 N -0.72 0.00 0.00 0.00 2.02 0.16 0.17 112.91 114.54 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 0.49 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 66.90 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 -0.58 0.00 0.00 3.11 2.04 -1.37 -0.61 117.51 120.09 1fdm h ILE 37 Ca 0.03 -0.42 0.00 0.00 1.00 0.00 0.00 64.86 65.47 1fdm h ILE 37 Cb 0.66 1.38 0.00 0.00 -0.74 0.00 0.00 36.82 38.12 1fdm h ILE 37 CO -0.40 0.00 0.00 0.61 0.00 0.00 0.00 178.15 178.36 1fdm n GLY 38 N -0.09 -0.04 0.14 5.37 0.00 0.15 -2.77 105.19 107.95 1fdm n GLY 38 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.11 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 -1.16 1.04 0.10 -0.61 -0.00 0.34 -1.36 119.36 117.71 1fdm n ILE 39 Ca 0.00 0.70 -0.04 0.00 -0.00 0.00 0.00 62.75 63.41 1fdm n ILE 39 Cb 0.00 -1.70 -0.02 0.00 -0.00 0.00 0.00 39.64 37.92 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 -0.25 -0.08 0.38 3.64 -1.13 -0.34 116.57 118.79 1fdm h LYS 40 Ca 0.00 0.02 -0.15 0.00 -1.27 0.00 0.00 60.65 59.25 1fdm h LYS 40 Cb 0.17 0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.04 1fdm h LYS 40 CO 0.00 -0.17 -0.61 -0.07 -2.27 0.00 0.00 179.45 176.33 1fdm h LEU 41 N -0.40 0.33 -0.42 5.20 4.07 -1.32 -1.68 115.31 121.09 1fdm h LEU 41 Ca -0.03 -0.19 -0.15 0.00 0.08 0.00 0.00 57.88 57.60 1fdm h LEU 41 Cb 0.20 -0.10 -0.01 0.00 1.08 0.00 0.00 40.66 41.84 1fdm h LEU 41 CO 0.04 0.86 -0.32 -0.26 -1.08 0.00 0.00 178.44 177.69 1fdm h PHE 42 N 0.21 1.12 0.00 1.13 -1.00 -1.34 -1.21 116.94 115.85 1fdm h PHE 42 Ca -0.01 -0.31 0.00 0.00 2.81 0.00 0.00 57.97 60.46 1fdm h PHE 42 Cb 1.13 -0.24 0.00 0.00 3.61 0.00 0.00 35.95 40.44 1fdm h PHE 42 CO 0.03 1.14 0.00 -0.22 -1.61 0.00 0.00 178.31 177.64 1fdm h LYS 43 N 0.78 0.00 0.00 1.51 3.64 -1.02 0.19 116.57 121.67 1fdm h LYS 43 Ca 0.08 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.45 1fdm h LYS 43 Cb 0.90 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.72 1fdm h LYS 43 CO 0.08 0.00 -0.02 -0.22 -2.27 0.00 0.00 179.45 177.02 1fdm h LYS 44 N 0.00 0.00 0.00 1.90 1.63 -1.05 -3.43 116.57 115.62 1fdm h LYS 44 Ca 0.00 0.00 -0.02 0.00 -0.85 0.00 0.00 60.65 59.78 1fdm h LYS 44 Cb 0.84 0.00 -0.03 0.00 -0.60 0.00 0.00 32.23 32.44 1fdm h LYS 44 CO 0.00 0.76 -0.24 1.97 -3.45 0.00 0.00 179.45 178.49 1fdm n PHE 45 N -4.65 0.00 -0.99 1.91 1.16 -0.72 -4.83 117.46 109.34 1fdm n PHE 45 Ca -0.08 -0.06 0.00 0.00 -1.87 0.00 0.00 57.45 55.44 1fdm n PHE 45 Cb 0.37 0.15 0.00 0.00 -1.61 0.00 0.00 39.48 38.38 1fdm n PHE 45 CO 0.00 0.00 0.00 2.41 -1.87 0.00 0.00 176.76 177.30 1fdm n THR 46 N 0.02 0.00 0.00 1.97 -1.04 0.66 -0.17 114.28 115.73 1fdm n THR 46 Ca -0.02 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.99 1fdm n THR 46 Cb 0.61 -0.52 0.00 0.00 -1.82 0.00 0.00 70.33 68.61 1fdm n THR 46 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 1fdm n SER 47 N -0.51 0.00 0.00 8.00 2.88 -0.54 -4.17 113.62 119.27 1fdm n SER 47 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1fdm n SER 47 Cb 0.26 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.72 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 0.00 0.58 0.00 -1.46 5.02 -1.21 -4.95 118.16 116.14 1fdm n LYS 48 Ca 0.00 -0.12 0.00 0.00 -2.02 0.00 0.00 58.31 56.17 1fdm n LYS 48 Cb 0.00 -0.51 0.00 0.00 -0.02 0.00 0.00 35.03 34.50 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 -0.12 0.00 0.00 7.82 0.00 0.76 -5.15 120.51 123.83 1fdm n ALA 49 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1fdm n ALA 49 Cb 0.11 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.56 1fdm n ALA 49 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93