#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 3.46 0.09 1.45 1.03 -1.26 -5.07 119.66 119.36 1afo s GLN 63 Ca 0.00 0.80 0.10 0.00 0.04 0.00 0.00 55.36 56.30 1afo s GLN 63 Cb 0.00 -2.06 -0.04 0.00 0.03 0.00 0.00 33.01 30.94 1afo s GLN 63 CO 0.00 -0.68 -0.26 -0.51 -2.54 0.00 0.00 175.29 171.30 1afo s LEU 64 N -5.23 2.31 0.00 2.60 1.43 -1.26 -4.87 118.68 113.66 1afo s LEU 64 Ca 0.56 -0.66 0.00 0.00 -1.03 0.00 0.00 54.13 53.00 1afo s LEU 64 Cb -0.12 -1.29 0.00 0.00 0.03 0.00 0.00 46.19 44.81 1afo s LEU 64 CO 0.54 0.21 0.00 0.00 0.23 0.00 0.00 176.35 177.33 1afo n ALA 65 N 1.27 0.00 -2.62 4.21 0.00 -1.26 -5.13 120.51 116.97 1afo n ALA 65 Ca -0.17 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 52.95 1afo n ALA 65 Cb 0.52 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.82 1afo n ALA 65 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 1afo s HIS 66 N 0.00 2.53 -0.22 0.00 3.76 -1.26 -5.01 115.29 115.08 1afo s HIS 66 Ca 0.00 -0.51 0.14 0.00 -0.15 0.00 0.00 55.06 54.53 1afo s HIS 66 Cb 0.00 -1.61 0.45 0.00 1.11 0.00 0.00 32.58 32.53 1afo s HIS 66 CO 0.00 -0.08 1.18 0.72 -0.85 0.00 0.00 174.74 175.71 1afo n HIS 67 N 2.75 1.29 -3.35 1.40 -0.00 -1.26 -4.98 115.22 111.07 1afo n HIS 67 Ca -0.17 -1.76 -0.46 0.00 -0.00 0.00 0.00 57.72 55.34 1afo n HIS 67 Cb 0.52 -0.27 -0.04 0.00 -0.00 0.00 0.00 29.99 30.20 1afo n HIS 67 CO 0.00 0.00 0.00 -0.06 -0.00 0.00 0.00 176.34 176.28 1afo s PHE 68 N -3.03 3.46 0.00 4.41 0.08 -1.26 -4.98 117.98 116.66 1afo s PHE 68 Ca 0.40 -1.64 0.00 0.00 0.12 0.00 0.00 56.93 55.81 1afo s PHE 68 Cb 0.38 -3.77 0.00 0.00 -0.57 0.00 0.00 43.02 39.06 1afo s PHE 68 CO -0.04 -1.00 0.00 0.43 -0.10 0.00 0.00 175.22 174.51 1afo n SER 69 N 4.69 -2.29 -4.88 1.36 7.64 -1.26 -4.80 113.62 114.09 1afo n SER 69 Ca -0.03 0.00 -0.31 0.00 1.01 0.00 0.00 58.87 59.54 1afo n SER 69 Cb 0.43 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.58 1afo n SER 69 CO 0.00 0.00 0.00 -1.83 -3.01 0.00 0.00 175.04 170.20 1afo s GLU 70 N 0.00 3.79 -0.22 1.43 -1.05 -1.26 -4.92 118.70 116.48 1afo s GLU 70 Ca 0.00 0.30 -0.02 0.00 -0.15 0.00 0.00 54.97 55.11 1afo s GLU 70 Cb 0.00 -2.57 -0.03 0.00 -0.44 0.00 0.00 34.13 31.09 1afo s GLU 70 CO 0.00 0.21 1.30 -0.35 0.95 0.00 0.00 175.26 177.37 1afo n PRO 71 N -0.53 0.62 0.00 -4.83 -0.04 -1.26 -4.52 135.00 124.44 1afo n PRO 71 Ca 0.01 -0.63 0.00 0.00 -0.04 0.00 0.00 63.50 62.84 1afo n PRO 71 Cb 0.53 -1.97 0.00 0.00 -0.04 0.00 0.00 33.50 32.02 1afo n PRO 71 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1afo n GLU 72 N 4.12 0.00 0.16 0.54 2.13 -1.26 -1.25 120.64 125.08 1afo n GLU 72 Ca 0.13 0.36 0.18 0.00 0.66 0.00 0.00 57.16 58.49 1afo n GLU 72 Cb 0.09 -1.04 0.79 0.00 0.27 0.00 0.00 31.44 31.55 1afo n GLU 72 CO 0.00 0.00 0.00 0.97 -0.41 0.00 0.00 177.13 177.69 1afo h ILE 73 N 0.00 0.51 -0.18 6.31 6.09 -1.99 0.32 117.51 128.56 1afo h ILE 73 Ca 0.00 0.00 -0.03 0.00 -1.37 0.00 0.00 64.86 63.46 1afo h ILE 73 Cb 0.00 0.80 -0.01 0.00 0.47 0.00 0.00 36.82 38.08 1afo h ILE 73 CO 0.00 0.00 -0.00 0.74 -3.07 0.00 0.00 178.15 175.82 1afo h THR 74 N 0.00 1.26 -0.19 2.19 2.02 -1.87 0.13 112.91 116.44 1afo h THR 74 Ca 0.12 -0.87 -0.03 0.00 0.77 0.00 0.00 66.41 66.41 1afo h THR 74 Cb 0.64 1.47 -0.01 0.00 -1.74 0.00 0.00 68.15 68.51 1afo h THR 74 CO -0.00 0.26 0.02 -0.07 0.37 0.00 0.00 175.52 176.10 1afo h LEU 75 N 0.08 0.32 -0.36 2.58 3.38 0.43 0.13 115.31 121.87 1afo h LEU 75 Ca 0.05 -0.28 0.04 0.00 0.09 0.00 0.00 57.88 57.78 1afo h LEU 75 Cb 0.39 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 41.02 1afo h LEU 75 CO 0.01 0.53 0.12 0.40 0.09 0.00 0.00 178.44 179.59 1afo h ILE 76 N 0.11 0.89 -0.32 1.22 2.04 -1.16 0.22 117.51 120.51 1afo h ILE 76 Ca 0.06 -0.09 0.03 0.00 1.00 0.00 0.00 64.86 65.85 1afo h ILE 76 Cb 0.35 0.60 -0.03 0.00 -0.74 0.00 0.00 36.82 37.00 1afo h ILE 76 CO 0.01 0.05 0.14 0.40 0.00 0.00 0.00 178.15 178.74 1afo h ILE 77 N 0.27 0.95 -0.31 -0.67 1.08 -0.52 -0.74 117.51 117.56 1afo h ILE 77 Ca 0.16 -0.10 0.03 0.00 -0.39 0.00 0.00 64.86 64.56 1afo h ILE 77 Cb 0.14 0.63 -0.03 0.00 -3.07 0.00 0.00 36.82 34.49 1afo h ILE 77 CO -0.17 0.05 0.11 -0.26 -0.69 0.00 0.00 178.15 177.20 1afo h PHE 78 N 0.29 0.21 -0.35 1.37 -1.00 0.38 -0.08 116.94 117.76 1afo h PHE 78 Ca 0.14 0.02 0.03 0.00 2.81 0.00 0.00 57.97 60.97 1afo h PHE 78 Cb 0.08 -0.05 -0.03 0.00 3.61 0.00 0.00 35.95 39.56 1afo h PHE 78 CO -0.12 0.09 0.14 0.78 -1.61 0.00 0.00 178.31 177.60 1afo h GLY 79 N 0.25 0.46 0.74 -1.45 0.00 -0.14 0.49 103.07 103.41 1afo h GLY 79 Ca 0.14 -0.09 0.04 0.00 0.00 0.00 0.00 47.33 47.41 1afo h GLY 79 CO -0.13 0.05 0.15 -2.08 0.00 0.00 0.00 176.54 174.53 1afo h VAL 80 N 0.31 0.93 -0.37 4.60 2.07 -0.56 0.80 116.25 124.02 1afo h VAL 80 Ca 0.15 -0.11 0.04 0.00 0.82 0.00 0.00 66.70 67.60 1afo h VAL 80 Cb 0.10 0.59 -0.04 0.00 -1.52 0.00 0.00 31.29 30.42 1afo h VAL 80 CO -0.14 0.06 0.16 0.24 0.02 0.00 0.00 177.57 177.91 1afo h MET 81 N 0.31 0.32 -0.45 1.57 2.07 -0.35 -1.23 114.93 117.18 1afo h MET 81 Ca 0.16 -0.02 0.04 0.00 -2.07 0.00 0.00 59.70 57.81 1afo h MET 81 Cb 0.11 -0.07 -0.04 0.00 -1.87 0.00 0.00 31.60 29.73 1afo h MET 81 CO -0.15 0.21 0.21 0.00 1.07 0.00 0.00 176.91 178.26 1afo h ALA 82 N 1.22 0.56 -0.39 6.32 0.00 -0.08 -0.99 119.26 125.90 1afo h ALA 82 Ca 0.16 0.02 0.04 0.00 0.00 0.00 0.00 54.91 55.14 1afo h ALA 82 Cb 0.11 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.81 1afo h ALA 82 CO -0.14 -0.15 0.16 0.78 0.00 0.00 0.00 179.25 179.90 1afo h GLY 83 N 0.43 0.52 0.72 0.00 0.00 -0.12 0.34 103.07 104.96 1afo h GLY 83 Ca 0.20 -0.10 0.04 0.00 0.00 0.00 0.00 47.33 47.46 1afo h GLY 83 CO -0.15 0.05 0.13 -2.08 0.00 0.00 0.00 176.54 174.49 1afo h VAL 84 N 0.33 0.91 -0.38 4.60 2.07 -0.58 -0.59 116.25 122.62 1afo h VAL 84 Ca 0.18 -0.10 0.04 0.00 0.82 0.00 0.00 66.70 67.64 1afo h VAL 84 Cb 0.13 0.61 -0.04 0.00 -1.52 0.00 0.00 31.29 30.47 1afo h VAL 84 CO -0.16 0.05 0.16 0.40 0.02 0.00 0.00 177.57 178.05 1afo h ILE 85 N 0.28 0.94 -0.38 4.57 2.04 -0.45 -1.26 117.51 123.24 1afo h ILE 85 Ca 0.16 -0.12 0.04 0.00 1.00 0.00 0.00 64.86 65.94 1afo h ILE 85 Cb 0.12 0.57 -0.04 0.00 -0.74 0.00 0.00 36.82 36.73 1afo h ILE 85 CO -0.15 0.06 0.15 1.23 0.00 0.00 0.00 178.15 179.44 1afo h GLY 86 N 0.34 0.50 0.72 5.37 0.00 -0.23 0.34 103.07 110.11 1afo h GLY 86 Ca 0.17 -0.10 0.04 0.00 0.00 0.00 0.00 47.33 47.44 1afo h GLY 86 CO -0.14 0.05 0.14 -0.84 0.00 0.00 0.00 176.54 175.74 1afo h THR 87 N 0.32 0.92 -0.36 4.70 2.02 -0.58 0.36 112.91 120.30 1afo h THR 87 Ca 0.17 -0.10 0.03 0.00 0.77 0.00 0.00 66.41 67.28 1afo h THR 87 Cb 0.13 0.60 -0.04 0.00 -1.74 0.00 0.00 68.15 67.10 1afo h THR 87 CO -0.16 0.05 0.15 0.40 0.37 0.00 0.00 175.52 176.34 1afo h ILE 88 N 0.29 0.93 -0.40 3.11 2.04 -0.56 -1.24 117.51 121.70 1afo h ILE 88 Ca 0.16 -0.11 0.04 0.00 1.00 0.00 0.00 64.86 65.95 1afo h ILE 88 Cb 0.12 0.59 -0.04 0.00 -0.74 0.00 0.00 36.82 36.75 1afo h ILE 88 CO -0.15 0.06 0.17 0.25 0.00 0.00 0.00 178.15 178.48 1afo h LEU 89 N 0.32 0.23 -0.40 1.44 5.85 -0.17 -1.14 115.31 121.43 1afo h LEU 89 Ca 0.16 0.03 0.04 0.00 0.84 0.00 0.00 57.88 58.95 1afo h LEU 89 Cb 0.11 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.09 1afo h LEU 89 CO -0.14 0.17 0.17 -0.07 -0.34 0.00 0.00 178.44 178.22 1afo h LEU 90 N 0.35 0.21 -0.39 2.25 4.07 -0.33 -1.17 115.31 120.31 1afo h LEU 90 Ca 0.18 0.03 0.04 0.00 0.08 0.00 0.00 57.88 58.21 1afo h LEU 90 Cb 0.12 0.00 -0.04 0.00 1.08 0.00 0.00 40.66 41.82 1afo h LEU 90 CO -0.15 0.16 0.16 0.40 -1.08 0.00 0.00 178.44 177.93 1afo h ILE 91 N 0.34 0.92 -0.35 1.22 2.04 -0.60 0.38 117.51 121.47 1afo h ILE 91 Ca 0.18 -0.12 0.04 0.00 1.00 0.00 0.00 64.86 65.96 1afo h ILE 91 Cb 0.13 0.56 -0.04 0.00 -0.74 0.00 0.00 36.82 36.73 1afo h ILE 91 CO -0.16 0.06 0.13 0.28 0.00 0.00 0.00 178.15 178.46 1afo h SER 92 N 0.34 0.15 -0.28 1.72 0.02 -0.56 0.98 113.55 115.92 1afo h SER 92 Ca 0.17 0.04 0.03 0.00 -0.84 0.00 0.00 61.79 61.19 1afo h SER 92 Cb 0.13 0.02 -0.03 0.00 0.14 0.00 0.00 62.40 62.66 1afo h SER 92 CO -0.16 0.12 0.10 0.22 -1.14 0.00 0.00 176.83 175.98 1afo h TYR 93 N 0.28 0.19 -0.26 3.45 3.20 -0.50 -1.12 116.97 122.21 1afo h TYR 93 Ca 0.16 0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.07 1afo h TYR 93 Cb 0.13 -0.04 -0.03 0.00 1.54 0.00 0.00 36.73 38.33 1afo h TYR 93 CO -0.14 0.09 0.09 0.78 -1.64 0.00 0.00 178.16 177.35 1afo h GLY 94 N 0.23 0.32 0.77 1.82 0.00 -0.14 -0.96 103.07 105.11 1afo h GLY 94 Ca 0.12 -0.06 0.03 0.00 0.00 0.00 0.00 47.33 47.43 1afo h GLY 94 CO -0.12 0.04 0.18 1.19 0.00 0.00 0.00 176.54 177.83 1afo h ILE 95 N 0.22 0.95 -0.37 2.60 6.09 -0.49 -1.21 117.51 125.29 1afo h ILE 95 Ca 0.11 -0.13 0.04 0.00 -1.37 0.00 0.00 64.86 63.51 1afo h ILE 95 Cb 0.07 0.54 -0.04 0.00 0.47 0.00 0.00 36.82 37.87 1afo h ILE 95 CO -0.11 0.07 0.15 0.03 -3.07 0.00 0.00 178.15 175.22 1afo h ARG 96 N 0.38 0.31 -0.38 2.19 3.08 -0.75 -1.34 114.38 117.86 1afo h ARG 96 Ca 0.17 -0.02 0.04 0.00 0.07 0.00 0.00 59.98 60.24 1afo h ARG 96 Cb 0.10 -0.07 -0.04 0.00 0.08 0.00 0.00 29.97 30.04 1afo h ARG 96 CO -0.13 0.20 0.16 -0.09 -1.07 0.00 0.00 179.97 179.04 1afo h ARG 97 N 0.32 0.33 -0.40 0.04 2.43 -0.58 1.51 114.38 118.03 1afo h ARG 97 Ca 0.17 -0.02 0.04 0.00 -0.81 0.00 0.00 59.98 59.36 1afo h ARG 97 Cb 0.12 -0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 29.56 1afo h ARG 97 CO -0.15 0.22 0.17 1.25 -1.51 0.00 0.00 179.97 179.94 1afo h LEU 98 N 0.34 0.22 -0.42 3.80 5.85 -0.71 -2.01 115.31 122.37 1afo h LEU 98 Ca 0.17 0.03 -0.18 0.00 0.84 0.00 0.00 57.88 58.74 1afo h LEU 98 Cb 0.11 -0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.13 1afo h LEU 98 CO -0.14 0.16 -0.64 0.16 -0.34 0.00 0.00 178.44 177.64 1afo h ILE 99 N 0.35 1.33 -2.13 4.05 3.07 -0.64 -3.28 117.51 120.27 1afo h ILE 99 Ca 0.18 -1.93 -0.79 0.00 1.55 0.00 0.00 64.86 63.87 1afo h ILE 99 Cb 0.13 1.90 -0.23 0.00 -0.27 0.00 0.00 36.82 38.35 1afo h ILE 99 CO -0.16 0.60 1.33 1.17 -1.05 0.00 0.00 178.15 180.04 1afo n LYS 100 N -3.92 4.88 -0.24 0.16 0.00 0.51 -5.09 118.16 114.46 1afo n LYS 100 Ca -0.04 -4.31 0.00 0.00 0.00 0.00 0.00 58.31 53.96 1afo n LYS 100 Cb 0.66 -2.55 0.00 0.00 0.00 0.00 0.00 35.03 33.13 1afo n LYS 100 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03