#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kbw n GLU 77 N 0.00 0.90 -3.49 4.33 0.28 -1.26 -5.15 120.64 116.24 2kbw n GLU 77 Ca 0.00 0.00 -0.20 0.00 -0.16 0.00 0.00 57.16 56.80 2kbw n GLU 77 Cb 0.00 0.00 -0.13 0.00 1.43 0.00 0.00 31.44 32.74 2kbw n GLU 77 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 177.13 175.43 2kbw s SER 78 N 0.85 1.67 0.40 -1.84 1.04 -1.26 -5.02 113.70 109.54 2kbw s SER 78 Ca 0.00 -0.41 0.25 0.00 0.48 0.00 0.00 55.95 56.27 2kbw s SER 78 Cb 0.00 0.28 1.38 0.00 0.10 0.00 0.00 66.02 67.78 2kbw s SER 78 CO 0.00 -0.35 1.59 -0.61 0.98 0.00 0.00 173.24 174.86 2kbw h GLN 79 N 8.32 0.04 0.04 4.02 4.15 -2.01 0.72 115.11 130.39 2kbw h GLN 79 Ca -0.17 -0.00 0.01 0.00 0.77 0.00 0.00 58.65 59.26 2kbw h GLN 79 Cb 1.13 -0.01 -0.01 0.00 0.21 0.00 0.00 27.48 28.80 2kbw h GLN 79 CO 0.30 0.03 -0.06 1.05 -1.93 0.00 0.00 178.83 178.22 2kbw h GLU 80 N 0.04 -0.12 -0.80 1.69 4.11 -1.99 0.35 114.58 117.86 2kbw h GLU 80 Ca 0.85 0.01 -0.04 0.00 0.07 0.00 0.00 59.36 60.25 2kbw h GLU 80 Cb 2.41 0.03 -0.04 0.00 0.50 0.00 0.00 28.75 31.65 2kbw h GLU 80 CO -0.63 -0.08 0.35 0.22 0.07 0.00 0.00 179.01 178.94 2kbw h ASP 81 N -0.13 1.08 0.34 3.06 3.58 -0.08 -1.26 116.42 123.00 2kbw h ASP 81 Ca 0.01 -0.16 -0.01 0.00 0.42 0.00 0.00 57.03 57.29 2kbw h ASP 81 Cb 0.14 -0.28 -0.01 0.00 1.72 0.00 0.00 39.33 40.90 2kbw h ASP 81 CO -0.04 0.94 -0.28 0.40 -2.88 0.00 0.00 179.24 177.39 2kbw h ILE 82 N 1.15 0.00 -0.86 2.25 2.04 -0.30 0.10 117.51 121.89 2kbw h ILE 82 Ca 0.27 0.00 0.20 0.00 1.00 0.00 0.00 64.86 66.32 2kbw h ILE 82 Cb 0.18 0.00 -0.12 0.00 -0.74 0.00 0.00 36.82 36.14 2kbw h ILE 82 CO -0.03 0.00 0.35 0.40 0.00 0.00 0.00 178.15 178.88 2kbw h ILE 83 N -0.60 0.52 0.14 -0.67 2.04 -0.26 0.38 117.51 119.07 2kbw h ILE 83 Ca -0.04 -0.14 -0.01 0.00 1.00 0.00 0.00 64.86 65.67 2kbw h ILE 83 Cb 0.50 0.08 0.00 0.00 -0.74 0.00 0.00 36.82 36.66 2kbw h ILE 83 CO 0.00 0.07 -0.07 0.03 0.00 0.00 0.00 178.15 178.19 2kbw h ARG 84 N 0.41 -0.18 -0.48 2.37 3.08 -0.91 0.33 114.38 119.00 2kbw h ARG 84 Ca 0.51 0.01 -0.04 0.00 0.07 0.00 0.00 59.98 60.54 2kbw h ARG 84 Cb 0.92 0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.99 2kbw h ARG 84 CO -0.50 -0.09 0.15 -0.91 -1.07 0.00 0.00 179.97 177.55 2kbw h ASN 85 N -0.22 0.69 -0.35 7.04 -0.26 0.45 -1.59 115.58 121.33 2kbw h ASN 85 Ca -0.02 -0.20 0.00 0.00 -0.56 0.00 0.00 56.30 55.52 2kbw h ASN 85 Cb 0.17 -0.18 -0.02 0.00 -1.06 0.00 0.00 38.32 37.24 2kbw h ASN 85 CO 0.03 0.71 0.23 0.40 -1.06 0.00 0.00 177.43 177.74 2kbw h ILE 86 N 0.64 1.09 0.22 2.81 2.04 -0.17 -0.69 117.51 123.45 2kbw h ILE 86 Ca 0.15 -0.17 0.00 0.00 1.00 0.00 0.00 64.86 65.85 2kbw h ILE 86 Cb 0.26 0.58 -0.03 0.00 -0.74 0.00 0.00 36.82 36.89 2kbw h ILE 86 CO -0.01 0.09 -0.44 0.00 0.00 0.00 0.00 178.15 177.79 2kbw h ALA 87 N 1.13 -0.99 -0.99 1.87 0.00 -0.03 0.57 119.26 120.81 2kbw h ALA 87 Ca 0.13 -0.12 0.19 0.00 0.00 0.00 0.00 54.91 55.11 2kbw h ALA 87 Cb -0.05 0.77 -0.11 0.00 0.00 0.00 0.00 17.79 18.40 2kbw h ALA 87 CO -0.03 -1.07 0.59 0.07 0.00 0.00 0.00 179.25 178.81 2kbw h ARG 88 N -0.72 0.70 -0.70 0.00 0.11 -1.18 0.20 114.38 112.79 2kbw h ARG 88 Ca -0.02 -0.04 -0.07 0.00 0.10 0.00 0.00 59.98 59.94 2kbw h ARG 88 Cb 0.68 -0.16 -0.03 0.00 1.11 0.00 0.00 29.97 31.57 2kbw h ARG 88 CO -0.17 0.46 0.16 1.25 0.10 0.00 0.00 179.97 181.77 2kbw h HIS 89 N 0.72 1.18 0.36 4.08 2.76 -0.07 -1.32 115.15 122.86 2kbw h HIS 89 Ca 0.58 -0.14 -0.02 0.00 -2.20 0.00 0.00 60.37 58.58 2kbw h HIS 89 Cb 0.92 -0.33 0.00 0.00 1.55 0.00 0.00 27.41 29.55 2kbw h HIS 89 CO -0.02 0.97 -0.17 -0.07 -1.30 0.00 0.00 177.93 177.34 2kbw h LEU 90 N 1.06 -0.41 -0.99 0.26 3.38 0.32 0.27 115.31 119.20 2kbw h LEU 90 Ca 0.22 -0.07 0.08 0.00 0.09 0.00 0.00 57.88 58.20 2kbw h LEU 90 Cb 0.39 0.11 -0.07 0.00 0.09 0.00 0.00 40.66 41.17 2kbw h LEU 90 CO 0.00 -0.18 0.63 0.00 0.09 0.00 0.00 178.44 178.98 2kbw h ALA 91 N -0.03 1.40 0.10 1.53 0.00 -1.21 -0.98 119.26 120.08 2kbw h ALA 91 Ca -0.05 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 2kbw h ALA 91 Cb 0.45 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.97 2kbw h ALA 91 CO 0.08 0.36 -0.05 1.96 0.00 0.00 0.00 179.25 181.61 2kbw h GLN 92 N 1.10 -0.13 -0.93 0.00 1.08 -0.99 -0.57 115.11 114.68 2kbw h GLN 92 Ca 0.44 0.01 0.09 0.00 -1.45 0.00 0.00 58.65 57.75 2kbw h GLN 92 Cb 0.26 0.03 -0.07 0.00 -0.05 0.00 0.00 27.48 27.64 2kbw h GLN 92 CO -0.20 0.13 0.57 0.28 -0.95 0.00 0.00 178.83 178.65 2kbw h VAL 93 N -0.38 0.96 -0.09 -0.54 2.07 -0.04 -1.23 116.25 117.00 2kbw h VAL 93 Ca -0.01 -0.33 -0.03 0.00 0.82 0.00 0.00 66.70 67.15 2kbw h VAL 93 Cb 0.32 -0.08 -0.00 0.00 -1.52 0.00 0.00 31.29 30.01 2kbw h VAL 93 CO 0.02 0.17 -0.04 1.23 0.02 0.00 0.00 177.57 178.97 2kbw h GLY 94 N 0.96 0.21 0.51 2.17 0.00 -1.09 0.55 103.07 106.37 2kbw h GLY 94 Ca 0.44 -0.19 0.12 0.00 0.00 0.00 0.00 47.33 47.70 2kbw h GLY 94 CO -0.23 0.17 0.62 -1.80 0.00 0.00 0.00 176.54 175.30 2kbw h ASP 95 N -0.17 0.89 0.54 0.19 3.58 -0.58 -1.60 116.42 119.26 2kbw h ASP 95 Ca 0.02 0.04 -0.25 0.00 0.42 0.00 0.00 57.03 57.26 2kbw h ASP 95 Cb 0.49 -0.14 0.00 0.00 1.72 0.00 0.00 39.33 41.41 2kbw h ASP 95 CO 0.01 0.48 -1.11 -1.28 -2.88 0.00 0.00 179.24 174.46 2kbw h SER 96 N 0.96 0.44 -0.27 2.28 0.87 -1.18 -3.25 113.55 113.41 2kbw h SER 96 Ca 0.48 -0.42 0.08 0.00 -1.23 0.00 0.00 61.79 60.70 2kbw h SER 96 Cb 0.49 -0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 62.30 2kbw h SER 96 CO -0.25 1.28 0.36 0.00 -0.53 0.00 0.00 176.83 177.70 2kbw h MET 97 N 0.13 0.00 0.00 2.24 -0.00 0.14 0.26 114.93 117.69 2kbw h MET 97 Ca -0.11 0.00 -0.14 0.00 -0.00 0.00 0.00 59.70 59.46 2kbw h MET 97 Cb 1.80 0.00 -0.02 0.00 -0.00 0.00 0.00 31.60 33.38 2kbw h MET 97 CO 0.18 0.00 -0.79 0.22 -0.00 0.00 0.00 176.91 176.53 2kbw h ASP 98 N 0.00 0.00 0.09 -0.10 3.58 -1.55 -3.23 116.42 115.20 2kbw h ASP 98 Ca 0.13 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.58 2kbw h ASP 98 Cb 0.85 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.90 2kbw h ASP 98 CO -0.00 0.60 -0.00 0.54 -2.88 0.00 0.00 179.24 177.50 2kbw n ARG 99 N -3.17 0.92 -2.99 0.28 5.12 0.89 -4.56 116.66 113.15 2kbw n ARG 99 Ca -0.01 -0.01 0.03 0.00 -1.93 0.00 0.00 57.85 55.93 2kbw n ARG 99 Cb 0.79 -1.50 0.00 0.00 -1.16 0.00 0.00 32.46 30.59 2kbw n ARG 99 CO 0.00 0.00 0.00 -1.12 -1.93 0.00 0.00 177.63 174.58 2kbw s SER 100 N -2.09 -0.66 -0.41 0.55 0.01 -1.17 -5.13 113.70 104.80 2kbw s SER 100 Ca 0.45 -0.16 -0.26 0.00 1.31 0.00 0.00 55.95 57.29 2kbw s SER 100 Cb 0.22 1.07 0.02 0.00 0.21 0.00 0.00 66.02 67.54 2kbw s SER 100 CO 0.38 -0.09 0.93 -0.63 0.41 0.00 0.00 173.24 174.24 2kbw s ILE 101 N 2.34 4.53 0.17 1.44 -1.09 -1.24 -4.78 121.20 122.56 2kbw s ILE 101 Ca 0.19 1.01 -0.15 0.00 -2.23 0.00 0.00 60.65 59.47 2kbw s ILE 101 Cb -0.01 -4.38 0.05 0.00 -1.58 0.00 0.00 42.46 36.54 2kbw s ILE 101 CO -0.17 -0.67 1.74 -0.65 -1.23 0.00 0.00 174.94 173.96 2kbw h PRO 102 N 8.75 0.26 -3.43 2.79 0.11 -2.00 -3.05 132.00 135.42 2kbw h PRO 102 Ca -0.24 -0.02 -0.38 0.00 0.11 0.00 0.00 66.00 65.48 2kbw h PRO 102 Cb 1.08 -0.06 0.02 0.00 0.11 0.00 0.00 31.00 32.15 2kbw h PRO 102 CO 1.00 0.17 2.63 -0.35 -0.21 0.00 0.00 178.00 181.25 2kbw n PRO 103 N -5.05 2.11 -2.40 1.05 -0.04 -1.26 -4.53 135.00 124.88 2kbw n PRO 103 Ca 0.03 -1.47 -0.02 0.00 -0.04 0.00 0.00 63.50 62.00 2kbw n PRO 103 Cb 0.17 -2.45 -0.00 0.00 -0.04 0.00 0.00 33.50 31.17 2kbw n PRO 103 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2kbw n GLY 104 N 3.76 -0.46 3.91 0.55 0.00 -1.23 -0.00 105.19 111.72 2kbw n GLY 104 Ca 0.45 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.17 2kbw n GLY 104 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2kbw n LEU 105 N -2.45 -2.58 -0.78 0.99 0.00 -1.15 -5.08 117.00 105.94 2kbw n LEU 105 Ca -0.02 -0.78 0.10 0.00 0.00 0.00 0.00 56.01 55.31 2kbw n LEU 105 Cb 0.49 -2.56 0.08 0.00 0.00 0.00 0.00 43.42 41.42 2kbw n LEU 105 CO 0.03 0.47 0.56 0.52 0.00 0.00 0.00 177.39 178.97