#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3abk s TYR 3 N 0.00 3.50 0.47 1.57 2.02 -1.26 -5.03 117.35 118.62 3abk s TYR 3 Ca 0.00 1.07 -0.23 0.00 -0.37 0.00 0.00 57.07 57.54 3abk s TYR 3 Cb 0.00 -2.47 -0.07 0.00 -0.40 0.00 0.00 41.96 39.02 3abk s TYR 3 CO 0.00 -0.20 1.22 -1.21 -1.57 0.00 0.00 175.55 173.78 3abk s GLU 4 N -4.12 3.64 0.20 -0.62 0.41 -1.26 -5.04 118.70 111.91 3abk s GLU 4 Ca 0.52 1.90 0.04 0.00 -0.41 0.00 0.00 54.97 57.02 3abk s GLU 4 Cb -0.10 -2.40 -0.05 0.00 -1.78 0.00 0.00 34.13 29.79 3abk s GLU 4 CO 0.35 -0.68 -0.04 -1.21 -0.49 0.00 0.00 175.26 173.19 3abk s GLU 5 N -2.70 1.23 0.00 1.61 2.02 -1.26 -4.59 118.70 115.01 3abk s GLU 5 Ca 0.65 -1.59 0.00 0.00 0.02 0.00 0.00 54.97 54.05 3abk s GLU 5 Cb -0.32 -0.61 0.00 0.00 0.10 0.00 0.00 34.13 33.30 3abk s GLU 5 CO 0.39 -0.03 0.00 0.41 0.02 0.00 0.00 175.26 176.04 3abk n GLY 6 N -0.33 1.95 3.67 -1.39 0.00 -1.26 -4.75 105.19 103.08 3abk n GLY 6 Ca -0.07 -2.04 -0.45 0.00 0.00 0.00 0.00 46.02 43.46 3abk n GLY 6 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3abk n PRO 7 N 0.80 2.06 -0.85 1.61 -0.02 -1.26 -1.71 135.00 135.63 3abk n PRO 7 Ca 0.00 0.74 0.00 0.00 -2.02 0.00 0.00 63.50 62.22 3abk n PRO 7 Cb 0.00 -2.44 0.00 0.00 -0.02 0.00 0.00 33.50 31.04 3abk n PRO 7 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3abk n GLY 8 N 2.59 0.89 0.00 -1.23 0.00 -1.26 -4.83 105.19 101.35 3abk n GLY 8 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 3abk n GLY 8 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3abk n LYS 9 N -2.08 4.80 -1.14 1.61 4.76 -0.70 -4.54 118.16 120.87 3abk n LYS 9 Ca 0.00 0.00 -0.26 0.00 -2.87 0.00 0.00 58.31 55.18 3abk n LYS 9 Cb 0.00 -0.46 0.10 0.00 -1.84 0.00 0.00 35.03 32.83 3abk n LYS 9 CO 0.00 0.00 0.00 0.27 -1.37 0.00 0.00 177.40 176.30 3abk n ASN 10 N -0.83 5.89 -4.08 4.39 6.94 -1.23 -4.65 115.26 121.70 3abk n ASN 10 Ca 0.00 -3.50 -0.11 0.00 -0.02 0.00 0.00 54.58 50.95 3abk n ASN 10 Cb 0.00 -0.92 -0.11 0.00 -2.36 0.00 0.00 39.78 36.39 3abk n ASN 10 CO 0.00 0.00 0.00 0.27 -1.03 0.00 0.00 177.26 176.50 3abk s ILE 11 N -3.60 0.45 -2.16 1.53 -4.36 -1.26 -5.05 121.20 106.75 3abk s ILE 11 Ca 0.53 -1.37 0.18 0.00 -0.26 0.00 0.00 60.65 59.73 3abk s ILE 11 Cb 0.42 -0.95 0.44 0.00 1.25 0.00 0.00 42.46 43.63 3abk s ILE 11 CO 0.03 -0.62 1.54 -0.81 0.24 0.00 0.00 174.94 175.33 3abk n PRO 12 N 0.91 1.50 -4.38 0.37 -0.04 -1.26 -4.83 135.00 127.26 3abk n PRO 12 Ca -0.19 -0.75 -0.27 0.00 -0.04 0.00 0.00 63.50 62.25 3abk n PRO 12 Cb 0.57 -1.34 -0.11 0.00 -0.04 0.00 0.00 33.50 32.59 3abk n PRO 12 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 3abk s PHE 13 N -1.84 2.41 0.10 0.54 -0.12 -1.26 -5.13 117.98 112.67 3abk s PHE 13 Ca 0.29 -0.32 -0.30 0.00 -0.05 0.00 0.00 56.93 56.55 3abk s PHE 13 Cb 0.15 -1.19 -0.06 0.00 -0.63 0.00 0.00 43.02 41.29 3abk s PHE 13 CO 0.23 0.50 1.10 0.45 -0.05 0.00 0.00 175.22 177.45 3abk s SER 14 N -2.71 7.25 -0.18 1.98 0.15 -1.26 -4.96 113.70 113.97 3abk s SER 14 Ca 0.22 1.95 0.17 0.00 0.70 0.00 0.00 55.95 58.99 3abk s SER 14 Cb -0.08 -2.59 0.48 0.00 -1.71 0.00 0.00 66.02 62.12 3abk s SER 14 CO 0.11 -0.30 1.37 1.33 1.20 0.00 0.00 173.24 176.96 3abk n VAL 15 N 3.22 2.24 -0.20 4.45 0.24 -1.26 -4.59 118.33 122.43 3abk n VAL 15 Ca 0.05 -2.02 -0.08 0.00 -2.04 0.00 0.00 64.34 60.26 3abk n VAL 15 Cb 0.47 -0.26 0.02 0.00 -1.47 0.00 0.00 33.84 32.61 3abk n VAL 15 CO 0.00 0.00 0.00 -0.08 -2.14 0.00 0.00 176.83 174.61 3abk h GLU 16 N 1.41 0.83 -5.10 7.34 4.57 -1.92 -3.40 114.58 118.30 3abk h GLU 16 Ca 0.02 -0.15 -0.66 0.00 -1.18 0.00 0.00 59.36 57.38 3abk h GLU 16 Cb 1.38 -0.13 -0.34 0.00 -0.16 0.00 0.00 28.75 29.49 3abk h GLU 16 CO 0.19 0.72 -0.86 1.21 -1.18 0.00 0.00 179.01 179.09 3abk s ASN 17 N -6.05 3.05 0.33 1.04 3.84 -1.26 -5.03 114.94 110.86 3abk s ASN 17 Ca -0.13 -0.60 0.26 0.00 0.21 0.00 0.00 52.86 52.60 3abk s ASN 17 Cb 0.12 -1.42 1.07 0.00 -0.55 0.00 0.00 41.25 40.48 3abk s ASN 17 CO 0.79 0.04 1.78 0.07 -2.79 0.00 0.00 177.10 176.99 3abk h LYS 18 N 7.55 0.00 0.10 0.43 2.10 -1.96 -0.50 116.57 124.30 3abk h LYS 18 Ca -0.37 0.00 -0.37 0.00 -2.00 0.00 0.00 60.65 57.91 3abk h LYS 18 Cb 1.17 0.00 -0.03 0.00 -0.90 0.00 0.00 32.23 32.47 3abk h LYS 18 CO 0.58 0.00 -2.09 0.91 -2.00 0.00 0.00 179.45 176.85 3abk n TRP 19 N -2.43 1.00 -0.15 0.07 7.02 -1.26 -1.69 117.44 120.01 3abk n TRP 19 Ca 0.02 0.21 -0.08 0.00 -1.02 0.00 0.00 57.50 56.63 3abk n TRP 19 Cb 0.25 -1.13 0.07 0.00 -2.42 0.00 0.00 31.31 28.08 3abk n TRP 19 CO 0.00 0.00 0.00 -0.09 -2.02 0.00 0.00 177.69 175.58 3abk h ARG 20 N 0.06 0.92 -0.47 -0.99 2.43 -1.89 -1.57 114.38 112.86 3abk h ARG 20 Ca -0.45 -0.31 -0.01 0.00 -0.81 0.00 0.00 59.98 58.40 3abk h ARG 20 Cb 2.01 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 31.46 3abk h ARG 20 CO 0.05 0.96 0.27 1.25 -1.51 0.00 0.00 179.97 180.99 3abk h LEU 21 N 0.83 0.58 -0.36 3.80 5.85 -1.19 -0.62 115.31 124.20 3abk h LEU 21 Ca 0.14 -0.08 0.08 0.00 0.84 0.00 0.00 57.88 58.86 3abk h LEU 21 Cb 0.60 -0.15 -0.08 0.00 0.37 0.00 0.00 40.66 41.41 3abk h LEU 21 CO 0.04 0.49 -0.16 0.25 -0.34 0.00 0.00 178.44 178.71 3abk h LEU 22 N 0.63 -0.56 -0.44 2.25 5.85 -1.06 0.36 115.31 122.33 3abk h LEU 22 Ca 0.17 0.13 0.04 0.00 0.84 0.00 0.00 57.88 59.06 3abk h LEU 22 Cb 0.03 0.31 -0.04 0.00 0.37 0.00 0.00 40.66 41.33 3abk h LEU 22 CO -0.03 -0.20 0.21 0.00 -0.34 0.00 0.00 178.44 178.08 3abk h ALA 23 N 1.17 0.55 -0.16 1.25 0.00 -1.01 -0.69 119.26 120.37 3abk h ALA 23 Ca 0.18 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.11 3abk h ALA 23 Cb 0.38 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 3abk h ALA 23 CO -0.42 -0.16 0.09 0.52 0.00 0.00 0.00 179.25 179.28 3abk h MET 24 N 0.41 0.21 -0.80 0.00 2.86 0.32 -1.86 114.93 116.08 3abk h MET 24 Ca 0.19 -0.02 -0.04 0.00 -2.06 0.00 0.00 59.70 57.77 3abk h MET 24 Cb 0.12 -0.04 -0.04 0.00 0.06 0.00 0.00 31.60 31.70 3abk h MET 24 CO -0.15 0.20 0.35 0.52 1.06 0.00 0.00 176.91 178.88 3abk h MET 25 N 0.17 1.18 -0.05 1.72 2.07 -0.86 -0.59 114.93 118.56 3abk h MET 25 Ca 0.06 -0.20 0.03 0.00 -2.07 0.00 0.00 59.70 57.52 3abk h MET 25 Cb 0.04 -0.20 -0.06 0.00 -1.87 0.00 0.00 31.60 29.51 3abk h MET 25 CO -0.01 0.94 -0.46 1.15 1.07 0.00 0.00 176.91 179.59 3abk h THR 26 N 1.15 0.09 -0.71 2.22 2.02 -1.04 -0.71 112.91 115.93 3abk h THR 26 Ca 0.27 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.46 3abk h THR 26 Cb 0.18 0.09 -0.04 0.00 -1.74 0.00 0.00 68.15 66.64 3abk h THR 26 CO -0.03 0.00 0.47 -0.07 0.37 0.00 0.00 175.52 176.26 3abk h LEU 27 N -0.58 0.81 0.19 2.58 3.38 -1.23 -0.23 115.31 120.23 3abk h LEU 27 Ca 0.05 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 3abk h LEU 27 Cb 0.67 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.22 3abk h LEU 27 CO -0.36 0.58 -0.09 0.15 0.09 0.00 0.00 178.44 178.80 3abk h PHE 28 N 0.95 -0.24 -0.80 1.13 3.57 -0.74 -1.07 116.94 119.75 3abk h PHE 28 Ca 0.26 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.74 3abk h PHE 28 Cb -0.09 0.08 -0.04 0.00 2.79 0.00 0.00 35.95 38.69 3abk h PHE 28 CO -0.00 -0.15 0.45 0.74 -2.23 0.00 0.00 178.31 177.12 3abk h PHE 29 N -0.60 1.08 -1.00 0.41 -1.00 -1.28 -2.82 116.94 111.73 3abk h PHE 29 Ca -0.03 -0.02 0.06 0.00 2.81 0.00 0.00 57.97 60.80 3abk h PHE 29 Cb 0.20 -0.35 -0.07 0.00 3.61 0.00 0.00 35.95 39.35 3abk h PHE 29 CO 0.04 0.75 0.65 0.78 -1.61 0.00 0.00 178.31 178.92 3abk h GLY 30 N 1.10 1.51 1.54 -1.45 0.00 -1.12 -1.31 103.07 103.34 3abk h GLY 30 Ca 0.28 -0.48 -0.19 0.00 0.00 0.00 0.00 47.33 46.95 3abk h GLY 30 CO -0.05 0.35 -0.72 1.48 0.00 0.00 0.00 176.54 177.60 3abk h SER 31 N 1.18 0.53 0.20 0.19 4.64 -0.95 -1.17 113.55 118.18 3abk h SER 31 Ca 0.43 -0.34 -0.01 0.00 -0.47 0.00 0.00 61.79 61.39 3abk h SER 31 Cb 0.15 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3abk h SER 31 CO -0.17 1.09 -0.09 1.23 -0.87 0.00 0.00 176.83 178.02 3abk h GLY 32 N 1.20 -0.28 0.72 -0.77 0.00 -1.41 -1.90 103.07 100.64 3abk h GLY 32 Ca -0.03 0.10 0.10 0.00 0.00 0.00 0.00 47.33 47.50 3abk h GLY 32 CO 0.13 -0.10 0.57 -2.75 0.00 0.00 0.00 176.54 174.39 3abk h PHE 33 N -0.54 0.95 0.00 5.60 3.57 -1.23 -2.90 116.94 122.38 3abk h PHE 33 Ca -0.03 0.03 -0.15 0.00 3.53 0.00 0.00 57.97 61.35 3abk h PHE 33 Cb 0.41 -0.31 -0.02 0.00 2.79 0.00 0.00 35.95 38.82 3abk h PHE 33 CO 0.02 0.44 -0.73 0.00 -2.23 0.00 0.00 178.31 175.80 3abk h ALA 34 N 1.55 0.60 -0.49 2.41 0.00 -1.19 -3.37 119.26 118.76 3abk h ALA 34 Ca 0.41 -0.67 0.09 0.00 0.00 0.00 0.00 54.91 54.74 3abk h ALA 34 Cb 0.41 -0.12 -0.07 0.00 0.00 0.00 0.00 17.79 18.01 3abk h ALA 34 CO -0.18 0.91 0.09 0.00 0.00 0.00 0.00 179.25 180.07 3abk h ALA 35 N 1.27 0.54 -0.08 0.00 0.00 -1.12 -1.37 119.26 118.50 3abk h ALA 35 Ca -0.01 0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 3abk h ALA 35 Cb 1.48 0.15 -0.00 0.00 0.00 0.00 0.00 17.79 19.41 3abk h ALA 35 CO 0.10 -0.32 0.02 -1.35 0.00 0.00 0.00 179.25 177.70 3abk h PRO 36 N 0.22 0.10 -0.53 0.00 0.11 -1.74 -0.49 132.00 129.67 3abk h PRO 36 Ca 0.25 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 66.33 3abk h PRO 36 Cb 0.34 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 31.40 3abk h PRO 36 CO -0.33 0.10 0.27 0.74 -0.21 0.00 0.00 178.00 178.56 3abk h PHE 37 N 0.11 0.74 0.00 0.65 -1.00 -1.49 -0.54 116.94 115.41 3abk h PHE 37 Ca 0.03 -0.03 -0.08 0.00 2.81 0.00 0.00 57.97 60.70 3abk h PHE 37 Cb 0.04 -0.23 -0.01 0.00 3.61 0.00 0.00 35.95 39.35 3abk h PHE 37 CO 0.00 0.57 -0.39 0.74 -1.61 0.00 0.00 178.31 177.62 3abk h PHE 38 N 0.70 0.00 -0.28 -0.55 -1.00 -1.01 -1.04 116.94 113.76 3abk h PHE 38 Ca 0.18 0.00 -0.10 0.00 2.81 0.00 0.00 57.97 60.87 3abk h PHE 38 Cb 0.09 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.65 3abk h PHE 38 CO -0.01 0.39 -0.20 0.82 -1.61 0.00 0.00 178.31 177.70 3abk h ILE 39 N 0.00 1.30 -0.42 -0.55 2.04 -0.79 0.43 117.51 119.53 3abk h ILE 39 Ca -0.00 -1.33 0.02 0.00 1.00 0.00 0.00 64.86 64.54 3abk h ILE 39 Cb 1.13 1.56 -0.03 0.00 -0.74 0.00 0.00 36.82 38.74 3abk h ILE 39 CO 0.05 0.42 0.25 0.58 0.00 0.00 0.00 178.15 179.45 3abk h VAL 40 N 0.36 1.05 -0.12 1.67 2.07 -0.98 -0.78 116.25 119.52 3abk h VAL 40 Ca 0.05 -0.17 -0.00 0.00 0.82 0.00 0.00 66.70 67.40 3abk h VAL 40 Cb 0.74 0.50 -0.01 0.00 -1.52 0.00 0.00 31.29 31.01 3abk h VAL 40 CO 0.05 0.09 0.07 -0.09 0.02 0.00 0.00 177.57 177.72 3abk h ARG 41 N 0.50 0.16 -0.42 1.57 2.43 -1.16 -0.25 114.38 117.21 3abk h ARG 41 Ca 0.16 -0.01 0.09 0.00 -0.81 0.00 0.00 59.98 59.41 3abk h ARG 41 Cb 0.00 -0.03 -0.09 0.00 -0.42 0.00 0.00 29.97 29.43 3abk h ARG 41 CO -0.07 0.14 -0.20 1.25 -1.51 0.00 0.00 179.97 179.58 3abk h HIS 42 N 0.13 -0.50 -0.55 2.20 2.76 -0.74 0.24 115.15 118.69 3abk h HIS 42 Ca 0.04 0.05 -0.05 0.00 -2.20 0.00 0.00 60.37 58.21 3abk h HIS 42 Cb 0.02 0.28 -0.02 0.00 1.55 0.00 0.00 27.41 29.24 3abk h HIS 42 CO -0.06 -0.28 0.16 1.96 -1.30 0.00 0.00 177.93 178.41 3abk h GLN 43 N -0.11 0.86 -0.45 5.26 1.08 -0.87 -2.73 115.11 118.16 3abk h GLN 43 Ca 0.21 -0.19 -0.07 0.00 -1.45 0.00 0.00 58.65 57.14 3abk h GLN 43 Cb 0.43 -0.12 -0.02 0.00 -0.05 0.00 0.00 27.48 27.72 3abk h GLN 43 CO -0.50 0.79 -0.01 -0.07 -0.95 0.00 0.00 178.83 178.10 3abk h LEU 44 N 0.77 0.70 -1.31 1.46 3.38 -0.65 -2.91 115.31 116.75 3abk h LEU 44 Ca 0.18 -0.17 -0.03 0.00 0.09 0.00 0.00 57.88 57.95 3abk h LEU 44 Cb 0.30 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.86 3abk h LEU 44 CO -0.00 0.78 -0.13 -0.07 0.09 0.00 0.00 178.44 179.10 3abk h LEU 45 N 0.69 0.00 0.00 1.67 3.38 -0.36 -3.09 115.31 117.59 3abk h LEU 45 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 3abk h LEU 45 Cb 0.44 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.19 3abk h LEU 45 CO 0.02 0.13 0.00 0.29 0.09 0.00 0.00 178.44 178.97 3abk n LYS 46 N -3.30 0.03 0.00 1.13 5.02 -1.05 -5.10 118.16 114.90 3abk n LYS 46 Ca 0.00 0.21 0.00 0.00 -2.02 0.00 0.00 58.31 56.50 3abk n LYS 46 Cb 0.37 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.88 3abk n LYS 46 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05