#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1afo n GLN 63 N 0.00 2.91 0.00 1.45 -0.06 -1.26 -4.42 117.38 116.00 1afo n GLN 63 Ca 0.00 -2.95 0.12 0.00 -2.00 0.00 0.00 57.00 52.17 1afo n GLN 63 Cb 0.00 -1.91 0.18 0.00 -4.06 0.00 0.00 30.24 24.45 1afo n GLN 63 CO 0.00 0.00 0.00 1.28 -0.20 0.00 0.00 177.06 178.14 1afo n LEU 64 N -0.54 2.52 0.33 1.69 4.77 -1.26 -4.22 117.00 120.30 1afo n LEU 64 Ca 0.26 -0.85 0.21 0.00 -0.03 0.00 0.00 56.01 55.61 1afo n LEU 64 Cb 0.99 -0.00 1.14 0.00 -2.33 0.00 0.00 43.42 43.22 1afo n LEU 64 CO 0.20 0.43 1.17 0.00 -1.33 0.00 0.00 177.39 177.86 1afo h ALA 65 N 4.50 1.06 0.00 -1.18 0.00 -2.08 -3.44 119.26 118.11 1afo h ALA 65 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1afo h ALA 65 Cb 0.86 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.65 1afo h ALA 65 CO 0.00 -0.06 0.00 1.58 0.00 0.00 0.00 179.25 180.77 1afo n HIS 66 N -3.02 0.00 -3.64 0.00 -0.00 -1.26 -4.91 115.22 102.39 1afo n HIS 66 Ca -0.03 0.00 0.05 0.00 0.46 0.00 0.00 57.72 58.20 1afo n HIS 66 Cb 0.12 0.00 -0.01 0.00 -0.12 0.00 0.00 29.99 29.98 1afo n HIS 66 CO 0.00 0.00 0.00 1.58 0.46 0.00 0.00 176.34 178.38 1afo n HIS 67 N 0.00 -2.36 -4.47 1.57 -0.00 -1.26 -4.92 115.22 103.77 1afo n HIS 67 Ca 0.00 0.46 -0.21 0.00 0.46 0.00 0.00 57.72 58.44 1afo n HIS 67 Cb 0.00 -0.66 -0.04 0.00 -0.12 0.00 0.00 29.99 29.16 1afo n HIS 67 CO 0.00 0.00 0.00 1.19 0.46 0.00 0.00 176.34 177.99 1afo n PHE 68 N -2.41 0.73 -3.15 1.57 3.72 -1.26 -4.91 117.46 111.76 1afo n PHE 68 Ca 0.00 -1.58 -0.11 0.00 -0.05 0.00 0.00 57.45 55.71 1afo n PHE 68 Cb 0.17 -0.21 0.01 0.00 -0.94 0.00 0.00 39.48 38.50 1afo n PHE 68 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 1afo n SER 69 N -1.20 -7.14 -3.95 4.37 7.64 -1.26 -5.02 113.62 107.06 1afo n SER 69 Ca -0.13 -0.01 -0.10 0.00 1.01 0.00 0.00 58.87 59.64 1afo n SER 69 Cb 0.41 -4.36 -0.11 0.00 -1.01 0.00 0.00 64.21 59.14 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 -3.09 0.33 0.05 1.43 1.03 -1.26 -5.11 118.70 112.08 1afo s GLU 70 Ca 0.13 -0.51 -0.30 0.00 0.03 0.00 0.00 54.97 54.32 1afo s GLU 70 Cb -0.03 0.12 -0.09 0.00 -0.80 0.00 0.00 34.13 33.33 1afo s GLU 70 CO 0.79 -0.06 1.90 -1.25 -1.33 0.00 0.00 175.26 175.32 1afo s PRO 71 N -1.32 4.15 0.08 -4.83 0.04 -1.26 -4.91 135.00 126.94 1afo s PRO 71 Ca -0.14 2.57 -0.35 0.00 0.04 0.00 0.00 61.00 63.12 1afo s PRO 71 Cb -0.09 -4.00 -0.18 0.00 0.04 0.00 0.00 34.50 30.27 1afo s PRO 71 CO -0.00 -0.91 1.60 0.93 0.04 0.00 0.00 177.00 178.65 1afo h GLU 72 N 9.98 -0.99 -0.75 4.56 3.07 -1.99 -1.77 114.58 126.69 1afo h GLU 72 Ca -0.48 0.07 0.17 0.00 -0.50 0.00 0.00 59.36 58.62 1afo h GLU 72 Cb 1.23 0.22 -0.12 0.00 -0.84 0.00 0.00 28.75 29.24 1afo h GLU 72 CO 0.94 -0.66 0.10 0.97 -1.40 0.00 0.00 179.01 178.96 1afo h ILE 73 N -1.03 0.41 -0.40 3.13 6.09 -1.98 0.46 117.51 124.19 1afo h ILE 73 Ca -0.09 -0.06 0.03 0.00 -1.37 0.00 0.00 64.86 63.37 1afo h ILE 73 Cb 0.83 0.22 -0.03 0.00 0.47 0.00 0.00 36.82 38.31 1afo h ILE 73 CO 0.09 0.03 0.21 0.71 -3.07 0.00 0.00 178.15 176.13 1afo h THR 74 N 0.17 1.00 -0.07 2.19 1.35 -1.87 0.53 112.91 116.21 1afo h THR 74 Ca 0.42 -0.15 -0.05 0.00 -0.55 0.00 0.00 66.41 66.08 1afo h THR 74 Cb 0.75 0.53 0.00 0.00 -1.73 0.00 0.00 68.15 67.70 1afo h THR 74 CO -0.60 0.08 -0.16 0.25 -0.25 0.00 0.00 175.52 174.84 1afo h LEU 75 N 0.43 0.26 -0.29 3.87 6.46 -0.07 -1.80 115.31 124.16 1afo h LEU 75 Ca 0.17 -0.58 0.03 0.00 -0.12 0.00 0.00 57.88 57.38 1afo h LEU 75 Cb 0.05 -0.07 -0.03 0.00 -0.73 0.00 0.00 40.66 39.88 1afo h LEU 75 CO -0.10 0.79 0.10 0.40 -0.62 0.00 0.00 178.44 179.01 1afo h ILE 76 N -0.26 0.92 -0.36 4.05 2.04 -0.04 0.36 117.51 124.21 1afo h ILE 76 Ca -0.00 -0.08 0.03 0.00 1.00 0.00 0.00 64.86 65.81 1afo h ILE 76 Cb 0.75 0.67 -0.03 0.00 -0.74 0.00 0.00 36.82 37.47 1afo h ILE 76 CO 0.03 0.04 0.17 0.16 0.00 0.00 0.00 178.15 178.56 1afo h ILE 77 N 0.23 0.96 -0.41 -0.67 3.07 -0.93 -1.31 117.51 118.45 1afo h ILE 77 Ca 0.13 -0.12 0.04 0.00 1.55 0.00 0.00 64.86 66.46 1afo h ILE 77 Cb 0.10 0.58 -0.04 0.00 -0.27 0.00 0.00 36.82 37.20 1afo h ILE 77 CO -0.14 0.06 0.18 -0.26 -1.05 0.00 0.00 178.15 176.94 1afo h PHE 78 N 0.35 0.32 -0.38 0.16 -1.00 -0.43 -1.25 116.94 114.71 1afo h PHE 78 Ca 0.16 0.02 0.04 0.00 2.81 0.00 0.00 57.97 61.00 1afo h PHE 78 Cb 0.08 -0.08 -0.04 0.00 3.61 0.00 0.00 35.95 39.51 1afo h PHE 78 CO -0.11 0.15 0.14 0.78 -1.61 0.00 0.00 178.31 177.66 1afo h GLY 79 N 0.36 0.49 0.73 -1.45 0.00 0.38 0.35 103.07 103.94 1afo h GLY 79 Ca 0.18 -0.08 0.04 0.00 0.00 0.00 0.00 47.33 47.46 1afo h GLY 79 CO -0.16 0.04 0.13 -2.08 0.00 0.00 0.00 176.54 174.47 1afo h VAL 80 N 0.30 0.92 -0.38 4.60 2.07 -0.70 0.15 116.25 123.22 1afo h VAL 80 Ca 0.17 -0.10 0.03 0.00 0.82 0.00 0.00 66.70 67.63 1afo h VAL 80 Cb 0.14 0.61 -0.03 0.00 -1.52 0.00 0.00 31.29 30.49 1afo h VAL 80 CO -0.17 0.05 0.17 0.24 0.02 0.00 0.00 177.57 177.88 1afo h MET 81 N 0.28 0.34 -0.47 1.57 2.07 -0.41 -2.02 114.93 116.30 1afo h MET 81 Ca 0.15 -0.02 0.05 0.00 -2.07 0.00 0.00 59.70 57.81 1afo h MET 81 Cb 0.11 -0.08 -0.04 0.00 -1.87 0.00 0.00 31.60 29.72 1afo h MET 81 CO -0.15 0.23 0.22 0.00 1.07 0.00 0.00 176.91 178.28 1afo h ALA 82 N 1.21 0.59 -0.37 6.32 0.00 0.66 -0.99 119.26 126.68 1afo h ALA 82 Ca 0.16 0.03 0.04 0.00 0.00 0.00 0.00 54.91 55.14 1afo h ALA 82 Cb 0.09 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 17.80 1afo h ALA 82 CO -0.13 -0.14 0.14 0.78 0.00 0.00 0.00 179.25 179.89 1afo h GLY 83 N 0.43 0.48 0.73 0.00 0.00 -0.10 0.24 103.07 104.85 1afo h GLY 83 Ca 0.21 -0.08 0.04 0.00 0.00 0.00 0.00 47.33 47.49 1afo h GLY 83 CO -0.16 0.04 0.12 -2.08 0.00 0.00 0.00 176.54 174.45 1afo h VAL 84 N 0.29 0.91 -0.39 4.60 2.07 -0.77 -1.05 116.25 121.92 1afo h VAL 84 Ca 0.17 -0.09 0.04 0.00 0.82 0.00 0.00 66.70 67.63 1afo h VAL 84 Cb 0.14 0.62 -0.04 0.00 -1.52 0.00 0.00 31.29 30.50 1afo h VAL 84 CO -0.17 0.05 0.18 0.40 0.02 0.00 0.00 177.57 178.05 1afo h ILE 85 N 0.27 0.94 -0.41 4.57 2.04 -0.28 -1.78 117.51 122.86 1afo h ILE 85 Ca 0.15 -0.12 0.04 0.00 1.00 0.00 0.00 64.86 65.93 1afo h ILE 85 Cb 0.12 0.55 -0.04 0.00 -0.74 0.00 0.00 36.82 36.70 1afo h ILE 85 CO -0.15 0.07 0.16 1.23 0.00 0.00 0.00 178.15 179.46 1afo h GLY 86 N 0.36 0.54 0.69 5.37 0.00 0.11 0.65 103.07 110.79 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 0.15 -0.84 0.00 0.00 0.00 176.54 175.76 1afo h THR 87 N 0.34 0.90 -0.39 4.70 2.02 -0.72 0.27 112.91 120.03 1afo h THR 87 Ca 0.19 -0.11 0.04 0.00 0.77 0.00 0.00 66.41 67.29 1afo h THR 87 Cb 0.15 0.55 -0.04 0.00 -1.74 0.00 0.00 68.15 67.07 1afo h THR 87 CO -0.17 0.06 0.16 0.40 0.37 0.00 0.00 175.52 176.34 1afo h ILE 88 N 0.32 0.93 -0.43 3.11 2.04 -0.50 0.45 117.51 123.43 1afo h ILE 88 Ca 0.18 -0.12 0.04 0.00 1.00 0.00 0.00 64.86 65.96 1afo h ILE 88 Cb 0.14 0.56 -0.04 0.00 -0.74 0.00 0.00 36.82 36.74 1afo h ILE 88 CO -0.17 0.06 0.19 0.25 0.00 0.00 0.00 178.15 178.48 1afo h LEU 89 N 0.34 0.25 -0.43 1.44 5.85 0.16 -0.98 115.31 121.94 1afo h LEU 89 Ca 0.17 0.03 0.05 0.00 0.84 0.00 0.00 57.88 58.97 1afo h LEU 89 Cb 0.12 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.10 1afo h LEU 89 CO -0.15 0.18 0.18 0.25 -0.34 0.00 0.00 178.44 178.56 1afo h LEU 90 N 0.38 0.22 -0.43 2.25 6.46 0.52 -0.60 115.31 124.12 1afo h LEU 90 Ca 0.19 0.04 0.04 0.00 -0.12 0.00 0.00 57.88 58.03 1afo h LEU 90 Cb 0.13 0.01 -0.04 0.00 -0.73 0.00 0.00 40.66 40.03 1afo h LEU 90 CO -0.16 0.16 0.18 0.40 -0.62 0.00 0.00 178.44 178.40 1afo h ILE 91 N 0.36 0.91 -0.36 4.05 2.04 -0.11 0.22 117.51 124.62 1afo h ILE 91 Ca 0.19 -0.13 0.04 0.00 1.00 0.00 0.00 64.86 65.97 1afo h ILE 91 Cb 0.15 0.52 -0.04 0.00 -0.74 0.00 0.00 36.82 36.71 1afo h ILE 91 CO -0.17 0.07 0.13 0.28 0.00 0.00 0.00 178.15 178.45 1afo h SER 92 N 0.36 0.14 -0.32 1.72 0.02 -0.37 0.30 113.55 115.40 1afo h SER 92 Ca 0.19 0.04 0.03 0.00 -0.84 0.00 0.00 61.79 61.21 1afo h SER 92 Cb 0.15 0.02 -0.03 0.00 0.14 0.00 0.00 62.40 62.68 1afo h SER 92 CO -0.17 0.12 0.13 0.22 -1.14 0.00 0.00 176.83 175.98 1afo h TYR 93 N 0.28 0.23 -0.38 3.45 3.20 -0.10 -0.14 116.97 123.51 1afo h TYR 93 Ca 0.16 0.02 0.03 0.00 3.14 0.00 0.00 58.73 62.08 1afo h TYR 93 Cb 0.13 -0.05 -0.04 0.00 1.54 0.00 0.00 36.73 38.31 1afo h TYR 93 CO -0.14 0.11 0.17 0.78 -1.64 0.00 0.00 178.16 177.44 1afo h GLY 94 N 0.27 0.51 0.71 1.82 0.00 0.33 -1.02 103.07 105.69 1afo h GLY 94 Ca 0.14 -0.11 0.04 0.00 0.00 0.00 0.00 47.33 47.40 1afo h GLY 94 CO -0.13 0.07 0.16 -2.22 0.00 0.00 0.00 176.54 174.42 1afo h ILE 95 N 0.35 0.92 -0.39 2.60 1.08 0.24 -0.90 117.51 121.41 1afo h ILE 95 Ca 0.17 -0.11 0.04 0.00 -0.39 0.00 0.00 64.86 64.56 1afo h ILE 95 Cb 0.10 0.56 -0.04 0.00 -3.07 0.00 0.00 36.82 34.37 1afo h ILE 95 CO -0.14 0.06 0.16 0.03 -0.69 0.00 0.00 178.15 177.57 1afo h ARG 96 N 0.33 0.32 -0.39 2.37 3.08 -0.39 -1.37 114.38 118.34 1afo h ARG 96 Ca 0.18 -0.02 0.04 0.00 0.07 0.00 0.00 59.98 60.24 1afo h ARG 96 Cb 0.13 -0.07 -0.04 0.00 0.08 0.00 0.00 29.97 30.07 1afo h ARG 96 CO -0.16 0.21 0.16 -0.09 -1.07 0.00 0.00 179.97 179.03 1afo h ARG 97 N 0.33 0.33 -0.42 0.04 1.12 -0.50 0.36 114.38 115.64 1afo h ARG 97 Ca 0.17 -0.02 0.04 0.00 -1.11 0.00 0.00 59.98 59.07 1afo h ARG 97 Cb 0.13 -0.07 -0.04 0.00 -0.01 0.00 0.00 29.97 29.97 1afo h ARG 97 CO -0.16 0.22 0.17 -0.07 -3.11 0.00 0.00 179.97 177.03 1afo h LEU 98 N 0.34 0.21 -0.56 3.80 3.38 -0.58 0.66 115.31 122.56 1afo h LEU 98 Ca 0.17 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.18 1afo h LEU 98 Cb 0.12 0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.87 1afo h LEU 98 CO -0.15 0.16 0.00 0.16 0.09 0.00 0.00 178.44 178.70 1afo h ILE 99 N 0.35 0.00 -3.08 1.22 3.07 -0.64 -3.45 117.51 114.99 1afo h ILE 99 Ca 0.19 -0.35 0.00 0.00 1.55 0.00 0.00 64.86 66.25 1afo h ILE 99 Cb 0.15 1.18 0.00 0.00 -0.27 0.00 0.00 36.82 37.88 1afo h ILE 99 CO -0.17 0.00 0.00 0.29 -1.05 0.00 0.00 178.15 177.22 1afo n LYS 100 N -2.35 2.75 -0.17 0.16 5.02 0.12 -5.08 118.16 118.61 1afo n LYS 100 Ca 0.03 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.32 1afo n LYS 100 Cb 0.30 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.31 1afo n LYS 100 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51