#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bde s GLY 51 N 0.00 1.10 0.00 2.98 0.00 -1.26 -5.05 107.32 105.09 1bde s GLY 51 Ca 0.00 -0.98 0.00 0.00 0.00 0.00 0.00 44.72 43.74 1bde s GLY 51 CO 0.00 -0.83 0.00 1.34 0.00 0.00 0.00 173.10 173.61 1bde n ASP 52 N 2.43 0.00 -0.01 1.64 -0.08 -1.26 -4.85 116.55 114.42 1bde n ASP 52 Ca -0.16 0.00 -0.11 0.00 -1.51 0.00 0.00 54.79 53.02 1bde n ASP 52 Cb 0.52 0.00 -0.05 0.00 2.34 0.00 0.00 41.12 43.94 1bde n ASP 52 CO 0.00 0.00 0.00 0.71 0.12 0.00 0.00 177.20 178.03 1bde h THR 53 N 0.00 1.05 -0.13 5.18 1.35 -1.98 0.44 112.91 118.83 1bde h THR 53 Ca 0.00 -0.12 0.02 0.00 -0.55 0.00 0.00 66.41 65.76 1bde h THR 53 Cb 0.00 0.90 -0.04 0.00 -1.73 0.00 0.00 68.15 67.28 1bde h THR 53 CO 0.00 0.05 -0.35 -0.50 -0.25 0.00 0.00 175.52 174.46 1bde h TRP 54 N 0.15 -1.06 -0.67 4.73 -0.00 -1.98 0.53 115.95 117.65 1bde h TRP 54 Ca 0.05 0.04 -0.07 0.00 -0.00 0.00 0.00 58.89 58.91 1bde h TRP 54 Cb 0.01 0.48 -0.03 0.00 -0.00 0.00 0.00 29.16 29.62 1bde h TRP 54 CO -0.06 -0.35 0.14 0.00 -0.00 0.00 0.00 178.44 178.17 1bde h ALA 55 N -0.65 0.88 -0.95 1.49 0.00 -1.88 0.27 119.26 118.42 1bde h ALA 55 Ca 0.03 -0.25 0.18 0.00 0.00 0.00 0.00 54.91 54.86 1bde h ALA 55 Cb 0.43 -0.25 -0.08 0.00 0.00 0.00 0.00 17.79 17.88 1bde h ALA 55 CO -0.31 0.62 0.60 0.78 0.00 0.00 0.00 179.25 180.95 1bde h GLY 56 N 1.01 1.35 0.52 0.00 0.00 1.00 0.21 103.07 107.15 1bde h GLY 56 Ca 0.21 -0.30 -0.37 0.00 0.00 0.00 0.00 47.33 46.87 1bde h GLY 56 CO 0.01 0.01 -2.07 -0.62 0.00 0.00 0.00 176.54 173.86 1bde n VAL 57 N -4.62 1.73 0.24 4.60 0.31 0.18 -3.09 118.33 117.68 1bde n VAL 57 Ca 0.21 -0.65 0.10 0.00 -0.01 0.00 0.00 64.34 63.98 1bde n VAL 57 Cb 0.58 -1.66 0.67 0.00 -0.91 0.00 0.00 33.84 32.52 1bde n VAL 57 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 1bde h GLU 58 N 0.06 0.00 0.00 5.55 5.08 -0.03 0.50 114.58 125.74 1bde h GLU 58 Ca -0.45 0.00 -0.20 0.00 -1.00 0.00 0.00 59.36 57.72 1bde h GLU 58 Cb 2.01 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 31.24 1bde h GLU 58 CO 0.06 0.00 -0.93 0.00 -1.00 0.00 0.00 179.01 177.14 1bde h ALA 59 N 1.97 0.47 0.00 3.43 0.00 -0.72 0.15 119.26 124.57 1bde h ALA 59 Ca 0.02 -0.83 -0.17 0.00 0.00 0.00 0.00 54.91 53.93 1bde h ALA 59 Cb 0.09 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 1bde h ALA 59 CO -0.00 1.13 -1.41 0.44 0.00 0.00 0.00 179.25 179.40 1bde n ILE 60 N -3.46 1.20 0.02 0.00 -5.35 -0.08 -3.89 119.36 107.79 1bde n ILE 60 Ca -0.01 -0.69 -0.08 0.00 -0.27 0.00 0.00 62.75 61.70 1bde n ILE 60 Cb 0.87 -0.75 -0.13 0.00 -1.74 0.00 0.00 39.64 37.89 1bde n ILE 60 CO 0.00 0.00 0.00 0.40 -1.76 0.00 0.00 176.55 175.19 1bde h ILE 61 N 0.00 1.25 0.51 7.28 2.04 -0.16 -3.29 117.51 125.14 1bde h ILE 61 Ca -0.17 -3.03 -0.02 0.00 1.00 0.00 0.00 64.86 62.64 1bde h ILE 61 Cb 1.59 2.62 -0.02 0.00 -0.74 0.00 0.00 36.82 40.28 1bde h ILE 61 CO 0.05 0.72 -0.44 -0.09 0.00 0.00 0.00 178.15 178.38 1bde h ARG 62 N 0.00 -0.89 -0.10 2.37 2.43 -0.81 0.19 114.38 117.56 1bde h ARG 62 Ca -0.16 0.06 0.02 0.00 -0.81 0.00 0.00 59.98 59.09 1bde h ARG 62 Cb 1.90 0.20 -0.00 0.00 -0.42 0.00 0.00 29.97 31.65 1bde h ARG 62 CO 0.10 -0.60 0.07 -0.84 -1.51 0.00 0.00 179.97 177.20 1bde h ILE 63 N -0.93 0.99 -0.06 1.20 -0.00 -1.74 0.30 117.51 117.27 1bde h ILE 63 Ca -0.07 -0.02 -0.16 0.00 -0.00 0.00 0.00 64.86 64.61 1bde h ILE 63 Cb 0.79 0.91 -0.01 0.00 -0.00 0.00 0.00 36.82 38.51 1bde h ILE 63 CO -0.02 0.01 -0.65 0.25 -0.00 0.00 0.00 178.15 177.74 1bde h LEU 64 N 0.07 0.30 0.04 0.16 5.85 -1.53 0.10 115.31 120.31 1bde h LEU 64 Ca 0.04 -0.18 -0.09 0.00 0.84 0.00 0.00 57.88 58.49 1bde h LEU 64 Cb 0.10 -0.09 0.01 0.00 0.37 0.00 0.00 40.66 41.05 1bde h LEU 64 CO -0.01 0.87 -0.39 1.56 -0.34 0.00 0.00 178.44 180.14 1bde h GLN 65 N 0.18 0.19 -0.49 1.25 7.50 0.10 -1.53 115.11 122.31 1bde h GLN 65 Ca -0.01 -0.26 0.10 0.00 0.50 0.00 0.00 58.65 58.98 1bde h GLN 65 Cb 1.18 0.09 -0.09 0.00 0.05 0.00 0.00 27.48 28.71 1bde h GLN 65 CO 0.10 1.06 -0.14 1.96 -1.50 0.00 0.00 178.83 180.31 1bde h GLN 66 N -0.56 -0.02 0.00 1.46 4.20 -0.32 0.57 115.11 120.44 1bde h GLN 66 Ca -0.06 0.00 -0.15 0.00 0.06 0.00 0.00 58.65 58.50 1bde h GLN 66 Cb 1.23 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.99 1bde h GLN 66 CO 0.07 -0.01 -0.71 1.37 -0.67 0.00 0.00 178.83 178.88 1bde h LEU 67 N -0.02 0.00 -1.22 1.46 8.10 -0.88 -1.83 115.31 120.93 1bde h LEU 67 Ca 0.24 0.00 -0.03 0.00 0.11 0.00 0.00 57.88 58.20 1bde h LEU 67 Cb 0.37 0.00 -0.00 0.00 -0.44 0.00 0.00 40.66 40.59 1bde h LEU 67 CO -0.51 0.71 -0.14 0.25 -4.11 0.00 0.00 178.44 174.64 1bde h LEU 68 N 0.00 0.00 -0.01 0.17 5.85 -0.02 -2.30 115.31 119.00 1bde h LEU 68 Ca -0.01 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.71 1bde h LEU 68 Cb 1.30 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.33 1bde h LEU 68 CO 0.09 0.14 -0.01 -0.26 -0.34 0.00 0.00 178.44 178.06 1bde h PHE 69 N 0.00 0.04 -0.92 1.25 0.04 0.89 -3.10 116.94 115.14 1bde h PHE 69 Ca -0.00 -0.01 0.26 0.00 2.80 0.00 0.00 57.97 61.02 1bde h PHE 69 Cb 0.66 -0.01 -0.16 0.00 2.20 0.00 0.00 35.95 38.64 1bde h PHE 69 CO 0.00 0.48 0.19 0.82 -0.60 0.00 0.00 178.31 179.20 1bde h ILE 70 N -0.42 0.19 -0.67 -0.55 5.03 -0.96 0.19 117.51 120.31 1bde h ILE 70 Ca 0.00 -0.04 0.14 0.00 -0.12 0.00 0.00 64.86 64.84 1bde h ILE 70 Cb 0.48 0.06 -0.10 0.00 -3.03 0.00 0.00 36.82 34.22 1bde h ILE 70 CO 0.00 0.02 0.14 -0.74 -0.68 0.00 0.00 178.15 176.89 1bde h HIS 71 N 0.12 0.21 -0.15 1.37 -0.00 -1.45 0.33 115.15 115.58 1bde h HIS 71 Ca 0.59 0.04 -0.01 0.00 -0.00 0.00 0.00 60.37 60.99 1bde h HIS 71 Cb 1.25 0.01 -0.01 0.00 -0.00 0.00 0.00 27.41 28.67 1bde h HIS 71 CO -0.32 -0.07 0.03 0.35 -0.00 0.00 0.00 177.93 177.91 1bde h PHE 72 N 0.25 0.21 0.01 5.26 3.57 -0.71 0.16 116.94 125.70 1bde h PHE 72 Ca 0.37 -0.00 -0.11 0.00 3.53 0.00 0.00 57.97 61.75 1bde h PHE 72 Cb 0.59 -0.07 0.01 0.00 2.79 0.00 0.00 35.95 39.27 1bde h PHE 72 CO -0.27 0.20 -0.44 0.00 -2.23 0.00 0.00 178.31 175.58 1bde h ARG 73 N 0.21 0.27 -0.01 1.11 3.08 -0.79 -2.70 114.38 115.56 1bde h ARG 73 Ca 0.05 -0.31 0.03 0.00 0.07 0.00 0.00 59.98 59.82 1bde h ARG 73 Cb 0.11 0.09 -0.03 0.00 0.08 0.00 0.00 29.97 30.21 1bde h ARG 73 CO -0.00 1.03 -0.17 0.82 -1.07 0.00 0.00 179.97 180.58 1bde h ILE 74 N -0.35 0.58 0.61 2.04 2.04 0.45 0.11 117.51 122.99 1bde h ILE 74 Ca -0.06 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.78 1bde h ILE 74 Cb 1.19 0.58 -0.01 0.00 -0.74 0.00 0.00 36.82 37.85 1bde h ILE 74 CO 0.09 0.00 -0.41 1.23 0.00 0.00 0.00 178.15 179.06 1bde h GLY 75 N -0.28 -1.08 0.55 5.37 0.00 -0.77 0.52 103.07 107.38 1bde h GLY 75 Ca 0.06 0.46 0.04 0.00 0.00 0.00 0.00 47.33 47.88 1bde h GLY 75 CO -0.17 -0.37 -0.11 0.00 0.00 0.00 0.00 176.54 175.89 1bde h ARG 77 N -0.12 0.00 0.00 0.00 2.43 -0.65 -0.42 114.38 115.62 1bde h ARG 77 Ca 0.09 0.00 -0.06 0.00 -0.81 0.00 0.00 59.98 59.20 1bde h ARG 77 Cb 0.25 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.79 1bde h ARG 77 CO -0.21 0.04 -0.29 1.25 -1.51 0.00 0.00 179.97 179.24 1bde h HIS 78 N 0.00 0.00 -2.55 2.20 2.76 0.17 -3.48 115.15 114.25 1bde h HIS 78 Ca -0.00 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.17 1bde h HIS 78 Cb 0.08 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.04 1bde h HIS 78 CO 0.00 0.29 0.00 0.45 -1.30 0.00 0.00 177.93 177.37 1bde n SER 79 N -3.60 -1.70 -3.98 3.26 2.88 -0.17 -5.03 113.62 105.29 1bde n SER 79 Ca -0.01 0.00 -0.36 0.00 -1.33 0.00 0.00 58.87 57.18 1bde n SER 79 Cb 0.43 -0.85 -0.05 0.00 -0.75 0.00 0.00 64.21 62.98 1bde n SER 79 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1bde n ARG 80 N -0.66 2.94 -4.19 -1.46 1.74 -1.24 -5.02 116.66 108.76 1bde n ARG 80 Ca 0.00 -4.53 -0.11 0.00 -0.77 0.00 0.00 57.85 52.44 1bde n ARG 80 Cb 0.24 -2.40 -0.10 0.00 -1.02 0.00 0.00 32.46 29.17 1bde n ARG 80 CO 0.00 0.00 0.00 0.96 -1.52 0.00 0.00 177.63 177.07 1bde s ILE 81 N -1.81 0.14 0.00 0.55 -4.36 -1.26 -5.03 121.20 109.43 1bde s ILE 81 Ca 0.30 -1.96 0.00 0.00 -0.26 0.00 0.00 60.65 58.73 1bde s ILE 81 Cb -0.01 -2.28 0.00 0.00 1.25 0.00 0.00 42.46 41.41 1bde s ILE 81 CO -0.07 -0.24 0.00 0.61 0.24 0.00 0.00 174.94 175.48