#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1afo s GLN 63 N 0.00 0.42 0.52 7.34 -2.07 -1.26 -5.00 119.66 119.61 1afo s GLN 63 Ca 0.00 1.02 0.35 0.00 -1.82 0.00 0.00 55.36 54.91 1afo s GLN 63 Cb 0.00 0.61 1.81 0.00 -1.09 0.00 0.00 33.01 34.35 1afo s GLN 63 CO 0.00 -0.17 2.06 -0.07 -1.32 0.00 0.00 175.29 175.79 1afo h LEU 64 N 7.75 0.00 -1.43 2.60 4.07 -2.13 -1.66 115.31 124.50 1afo h LEU 64 Ca -0.17 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.79 1afo h LEU 64 Cb 1.11 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.85 1afo h LEU 64 CO 0.09 0.00 0.04 0.00 -1.08 0.00 0.00 178.44 177.50 1afo h ALA 65 N 2.02 1.03 -3.06 1.53 0.00 -2.12 -3.35 119.26 115.32 1afo h ALA 65 Ca 0.00 0.00 -0.70 0.00 0.00 0.00 0.00 54.91 54.21 1afo h ALA 65 Cb 0.10 0.00 -0.31 0.00 0.00 0.00 0.00 17.79 17.58 1afo h ALA 65 CO 0.00 -0.03 -0.55 -1.58 0.00 0.00 0.00 179.25 177.09 1afo s HIS 66 N -3.55 3.39 -0.30 0.00 5.65 -0.63 -5.03 115.29 114.83 1afo s HIS 66 Ca -0.02 -1.85 -0.14 0.00 0.25 0.00 0.00 55.06 53.30 1afo s HIS 66 Cb 0.06 -2.82 0.15 0.00 -1.18 0.00 0.00 32.58 28.79 1afo s HIS 66 CO 0.20 -0.87 0.89 -3.38 -0.65 0.00 0.00 174.74 170.92 1afo s HIS 67 N 1.31 -0.87 0.00 3.88 -0.00 -1.26 -4.95 115.29 113.40 1afo s HIS 67 Ca 0.03 1.52 0.00 0.00 -0.00 0.00 0.00 55.06 56.61 1afo s HIS 67 Cb -0.22 0.52 0.00 0.00 -0.00 0.00 0.00 32.58 32.88 1afo s HIS 67 CO -0.00 -0.43 0.54 1.97 -0.00 0.00 0.00 174.74 176.82 1afo n PHE 68 N 4.98 0.00 -1.95 0.38 1.16 -1.26 -4.88 117.46 115.89 1afo n PHE 68 Ca -0.11 0.00 0.05 0.00 -1.87 0.00 0.00 57.45 55.52 1afo n PHE 68 Cb 0.52 0.09 0.12 0.00 -1.61 0.00 0.00 39.48 38.61 1afo n PHE 68 CO 0.00 0.00 0.00 -1.13 -1.87 0.00 0.00 176.76 173.76 1afo n SER 69 N 0.00 1.40 -0.04 5.98 3.41 -1.26 -4.83 113.62 118.28 1afo n SER 69 Ca 0.00 -3.05 -0.10 0.00 -0.26 0.00 0.00 58.87 55.47 1afo n SER 69 Cb 0.56 -0.42 -0.09 0.00 -0.26 0.00 0.00 64.21 64.00 1afo n SER 69 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 1afo h GLU 70 N 0.92 -0.03 0.00 4.33 4.57 -2.02 -3.28 114.58 119.08 1afo h GLU 70 Ca -0.09 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.09 1afo h GLU 70 Cb 1.37 0.01 0.00 0.00 -0.16 0.00 0.00 28.75 29.97 1afo h GLU 70 CO 0.04 0.59 0.00 -2.30 -1.18 0.00 0.00 179.01 176.16 1afo n PRO 71 N -4.71 0.04 -0.07 0.92 -0.02 -1.26 -2.59 135.00 127.30 1afo n PRO 71 Ca -0.07 0.50 -0.10 0.00 -2.02 0.00 0.00 63.50 61.82 1afo n PRO 71 Cb 0.31 -1.61 -0.03 0.00 -0.02 0.00 0.00 33.50 32.15 1afo n PRO 71 CO 0.00 0.00 0.00 1.05 1.98 0.00 0.00 175.50 178.53 1afo h GLU 72 N 0.00 0.34 -0.43 -0.52 4.11 -1.91 -1.49 114.58 114.69 1afo h GLU 72 Ca 0.00 -0.03 -0.02 0.00 0.07 0.00 0.00 59.36 59.38 1afo h GLU 72 Cb 0.04 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.20 1afo h GLU 72 CO 0.00 0.26 0.17 0.97 0.07 0.00 0.00 179.01 180.48 1afo h ILE 73 N 0.32 1.20 -0.53 -1.06 6.09 -1.71 -0.57 117.51 121.25 1afo h ILE 73 Ca 0.09 -0.62 0.09 0.00 -1.37 0.00 0.00 64.86 63.05 1afo h ILE 73 Cb 0.00 0.81 -0.07 0.00 0.47 0.00 0.00 36.82 38.04 1afo h ILE 73 CO -0.02 0.23 0.14 0.74 -3.07 0.00 0.00 178.15 176.17 1afo h THR 74 N 0.54 0.74 -0.12 2.19 2.02 -1.60 0.31 112.91 116.99 1afo h THR 74 Ca 0.14 -0.10 -0.04 0.00 0.77 0.00 0.00 66.41 67.18 1afo h THR 74 Cb 0.19 0.42 -0.00 0.00 -1.74 0.00 0.00 68.15 67.02 1afo h THR 74 CO -0.01 0.05 -0.09 0.25 0.37 0.00 0.00 175.52 176.09 1afo h LEU 75 N 0.29 0.29 -0.34 2.58 6.46 -1.01 -0.39 115.31 123.19 1afo h LEU 75 Ca 0.27 -0.45 0.04 0.00 -0.12 0.00 0.00 57.88 57.62 1afo h LEU 75 Cb 0.35 -0.08 -0.04 0.00 -0.73 0.00 0.00 40.66 40.16 1afo h LEU 75 CO -0.32 0.68 0.12 0.40 -0.62 0.00 0.00 178.44 178.70 1afo h ILE 76 N -0.09 0.91 -0.37 4.05 2.04 -0.60 0.26 117.51 123.70 1afo h ILE 76 Ca 0.02 -0.09 0.03 0.00 1.00 0.00 0.00 64.86 65.82 1afo h ILE 76 Cb 0.58 0.61 -0.03 0.00 -0.74 0.00 0.00 36.82 37.24 1afo h ILE 76 CO 0.02 0.05 0.17 0.40 0.00 0.00 0.00 178.15 178.79 1afo h ILE 77 N 0.27 0.95 -0.37 -0.67 5.03 -0.36 -1.38 117.51 120.98 1afo h ILE 77 Ca 0.15 -0.12 0.04 0.00 -0.12 0.00 0.00 64.86 64.81 1afo h ILE 77 Cb 0.12 0.57 -0.04 0.00 -3.03 0.00 0.00 36.82 34.45 1afo h ILE 77 CO -0.16 0.06 0.15 -0.26 -0.68 0.00 0.00 178.15 177.27 1afo h PHE 78 N 0.35 0.28 -0.37 1.37 0.04 0.10 -0.33 116.94 118.37 1afo h PHE 78 Ca 0.16 0.02 0.04 0.00 2.80 0.00 0.00 57.97 60.99 1afo h PHE 78 Cb 0.10 -0.07 -0.04 0.00 2.20 0.00 0.00 35.95 38.14 1afo h PHE 78 CO -0.11 0.13 0.14 0.78 -0.60 0.00 0.00 178.31 178.65 1afo h GLY 79 N 0.32 0.48 0.76 -1.45 0.00 0.07 0.15 103.07 103.41 1afo h GLY 79 Ca 0.17 -0.09 0.03 0.00 0.00 0.00 0.00 47.33 47.44 1afo h GLY 79 CO -0.15 0.04 0.14 -2.08 0.00 0.00 0.00 176.54 174.49 1afo h VAL 80 N 0.31 0.94 -0.35 4.60 2.07 -0.64 -0.18 116.25 122.99 1afo h VAL 80 Ca 0.17 -0.10 0.03 0.00 0.82 0.00 0.00 66.70 67.62 1afo h VAL 80 Cb 0.13 0.61 -0.03 0.00 -1.52 0.00 0.00 31.29 30.48 1afo h VAL 80 CO -0.16 0.05 0.15 0.24 0.02 0.00 0.00 177.57 177.88 1afo h MET 81 N 0.30 0.31 -0.44 1.57 2.07 -0.28 -1.91 114.93 116.54 1afo h MET 81 Ca 0.15 -0.02 0.04 0.00 -2.07 0.00 0.00 59.70 57.80 1afo h MET 81 Cb 0.10 -0.07 -0.04 0.00 -1.87 0.00 0.00 31.60 29.72 1afo h MET 81 CO -0.13 0.21 0.20 0.00 1.07 0.00 0.00 176.91 178.26 1afo h ALA 82 N 1.21 0.55 -0.37 6.32 0.00 -0.01 -1.33 119.26 125.62 1afo h ALA 82 Ca 0.16 0.03 0.04 0.00 0.00 0.00 0.00 54.91 55.13 1afo h ALA 82 Cb 0.10 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 17.81 1afo h ALA 82 CO -0.13 -0.16 0.14 0.78 0.00 0.00 0.00 179.25 179.88 1afo h GLY 83 N 0.41 0.48 0.73 0.00 0.00 -0.48 -0.56 103.07 103.65 1afo h GLY 83 Ca 0.19 -0.09 0.04 0.00 0.00 0.00 0.00 47.33 47.48 1afo h GLY 83 CO -0.15 0.04 0.14 -2.08 0.00 0.00 0.00 176.54 174.49 1afo h VAL 84 N 0.30 0.92 -0.36 4.60 2.07 -0.81 -1.43 116.25 121.54 1afo h VAL 84 Ca 0.17 -0.10 0.04 0.00 0.82 0.00 0.00 66.70 67.62 1afo h VAL 84 Cb 0.13 0.60 -0.04 0.00 -1.52 0.00 0.00 31.29 30.46 1afo h VAL 84 CO -0.16 0.05 0.14 0.40 0.02 0.00 0.00 177.57 178.03 1afo h ILE 85 N 0.30 0.92 -0.38 4.57 1.08 -0.56 -1.37 117.51 122.07 1afo h ILE 85 Ca 0.16 -0.11 0.04 0.00 -0.39 0.00 0.00 64.86 64.56 1afo h ILE 85 Cb 0.12 0.59 -0.04 0.00 -3.07 0.00 0.00 36.82 34.42 1afo h ILE 85 CO -0.15 0.06 0.16 1.23 -0.69 0.00 0.00 178.15 178.76 1afo h GLY 86 N 0.31 0.50 0.72 5.37 0.00 -0.60 -1.22 103.07 108.15 1afo h GLY 86 Ca 0.16 -0.10 0.04 0.00 0.00 0.00 0.00 47.33 47.43 1afo h GLY 86 CO -0.15 0.06 0.16 -0.84 0.00 0.00 0.00 176.54 175.77 1afo h THR 87 N 0.33 0.92 -0.39 4.70 2.02 -0.76 -1.00 112.91 118.73 1afo h THR 87 Ca 0.17 -0.12 0.04 0.00 0.77 0.00 0.00 66.41 67.28 1afo h THR 87 Cb 0.12 0.56 -0.04 0.00 -1.74 0.00 0.00 68.15 67.05 1afo h THR 87 CO -0.15 0.06 0.15 0.40 0.37 0.00 0.00 175.52 176.35 1afo h ILE 88 N 0.34 0.91 -0.44 3.11 2.04 -0.62 -0.60 117.51 122.24 1afo h ILE 88 Ca 0.17 -0.11 0.04 0.00 1.00 0.00 0.00 64.86 65.97 1afo h ILE 88 Cb 0.13 0.56 -0.04 0.00 -0.74 0.00 0.00 36.82 36.72 1afo h ILE 88 CO -0.16 0.06 0.20 0.17 0.00 0.00 0.00 178.15 178.43 1afo h LEU 89 N 0.32 0.27 -0.40 1.44 8.10 -0.62 -1.34 115.31 123.08 1afo h LEU 89 Ca 0.18 0.03 0.04 0.00 0.11 0.00 0.00 57.88 58.24 1afo h LEU 89 Cb 0.14 -0.02 -0.04 0.00 -0.44 0.00 0.00 40.66 40.30 1afo h LEU 89 CO -0.16 0.20 0.17 -0.07 -4.11 0.00 0.00 178.44 174.46 1afo h LEU 90 N 0.41 0.22 -0.40 0.17 3.38 -0.40 -1.04 115.31 117.65 1afo h LEU 90 Ca 0.20 0.03 0.04 0.00 0.09 0.00 0.00 57.88 58.24 1afo h LEU 90 Cb 0.13 -0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.84 1afo h LEU 90 CO -0.16 0.16 0.16 0.40 0.09 0.00 0.00 178.44 179.09 1afo h ILE 91 N 0.35 0.91 -0.34 1.22 2.04 -0.41 0.21 117.51 121.48 1afo h ILE 91 Ca 0.18 -0.11 0.04 0.00 1.00 0.00 0.00 64.86 65.96 1afo h ILE 91 Cb 0.13 0.55 -0.04 0.00 -0.74 0.00 0.00 36.82 36.72 1afo h ILE 91 CO -0.16 0.06 0.12 0.28 0.00 0.00 0.00 178.15 178.46 1afo h SER 92 N 0.33 0.14 -0.34 1.72 0.02 -0.62 0.57 113.55 115.36 1afo h SER 92 Ca 0.18 0.04 0.03 0.00 -0.84 0.00 0.00 61.79 61.20 1afo h SER 92 Cb 0.14 0.02 -0.03 0.00 0.14 0.00 0.00 62.40 62.67 1afo h SER 92 CO -0.17 0.12 0.14 0.22 -1.14 0.00 0.00 176.83 176.00 1afo h TYR 93 N 0.27 0.26 -0.36 3.45 5.03 -0.27 -1.44 116.97 123.91 1afo h TYR 93 Ca 0.15 0.02 0.03 0.00 2.58 0.00 0.00 58.73 61.51 1afo h TYR 93 Cb 0.12 -0.07 -0.03 0.00 1.55 0.00 0.00 36.73 38.30 1afo h TYR 93 CO -0.14 0.12 0.15 0.78 -1.32 0.00 0.00 178.16 177.76 1afo h GLY 94 N 0.30 0.47 0.71 1.82 0.00 0.24 -0.78 103.07 105.83 1afo h GLY 94 Ca 0.15 -0.10 0.04 0.00 0.00 0.00 0.00 47.33 47.42 1afo h GLY 94 CO -0.13 0.06 0.17 1.19 0.00 0.00 0.00 176.54 177.83 1afo h ILE 95 N 0.32 0.92 -0.43 2.60 6.09 -0.47 -1.05 117.51 125.50 1afo h ILE 95 Ca 0.16 -0.12 0.04 0.00 -1.37 0.00 0.00 64.86 63.57 1afo h ILE 95 Cb 0.10 0.53 -0.04 0.00 0.47 0.00 0.00 36.82 37.89 1afo h ILE 95 CO -0.14 0.07 0.18 0.03 -3.07 0.00 0.00 178.15 175.22 1afo h ARG 96 N 0.36 0.36 -0.40 2.19 3.08 -0.63 -0.73 114.38 118.60 1afo h ARG 96 Ca 0.18 -0.02 0.04 0.00 0.07 0.00 0.00 59.98 60.25 1afo h ARG 96 Cb 0.13 -0.08 -0.04 0.00 0.08 0.00 0.00 29.97 30.06 1afo h ARG 96 CO -0.16 0.24 0.17 0.00 -1.07 0.00 0.00 179.97 179.15 1afo h ARG 97 N 0.37 0.35 -0.42 0.04 -0.00 -0.40 -1.12 114.38 113.20 1afo h ARG 97 Ca 0.19 -0.02 0.05 0.00 -0.50 0.00 0.00 59.98 59.70 1afo h ARG 97 Cb 0.15 -0.08 -0.04 0.00 0.00 0.00 0.00 29.97 30.00 1afo h ARG 97 CO -0.17 0.23 0.17 -0.07 0.00 0.00 0.00 179.97 180.13 1afo h LEU 98 N 0.36 0.21 0.00 3.04 3.38 -0.44 -3.39 115.31 118.47 1afo h LEU 98 Ca 0.18 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.19 1afo h LEU 98 Cb 0.12 0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.88 1afo h LEU 98 CO -0.15 0.16 0.00 2.30 0.09 0.00 0.00 178.44 180.84 1afo n ILE 99 N -4.98 0.00 -2.66 1.22 -5.35 -0.35 -4.79 119.36 102.45 1afo n ILE 99 Ca 0.03 0.00 -0.12 0.00 -0.27 0.00 0.00 62.75 62.39 1afo n ILE 99 Cb 0.14 0.00 -0.01 0.00 -1.74 0.00 0.00 39.64 38.03 1afo n ILE 99 CO 0.00 0.00 0.00 1.17 -1.76 0.00 0.00 176.55 175.96 1afo n LYS 100 N 0.00 -2.60 -0.62 6.28 3.00 -0.49 -5.04 118.16 118.69 1afo n LYS 100 Ca 0.00 0.42 0.00 0.00 -0.00 0.00 0.00 58.31 58.73 1afo n LYS 100 Cb 0.00 -5.02 0.00 0.00 0.00 0.00 0.00 35.03 30.01 1afo n LYS 100 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.40 178.57