#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1y74 h VAL 84 N 0.00 1.39 -0.43 0.00 2.07 -1.94 -1.78 116.25 115.56 1y74 h VAL 84 Ca 0.00 -1.57 -0.00 0.00 0.82 0.00 0.00 66.70 65.95 1y74 h VAL 84 Cb 0.00 2.14 -0.02 0.00 -1.52 0.00 0.00 31.29 31.89 1y74 h VAL 84 CO 0.00 0.46 0.26 -0.61 0.02 0.00 0.00 177.57 177.70 1y74 h GLN 85 N -0.07 0.58 -0.86 1.57 -0.00 -1.98 0.29 115.11 114.64 1y74 h GLN 85 Ca -0.00 -0.05 0.00 0.00 -0.00 0.00 0.00 58.65 58.60 1y74 h GLN 85 Cb 0.87 -0.12 -0.04 0.00 0.00 0.00 0.00 27.48 28.18 1y74 h GLN 85 CO 0.06 0.42 0.54 0.00 0.00 0.00 0.00 178.83 179.84 1y74 h ARG 86 N 0.57 1.15 -0.04 1.69 2.47 -1.99 0.26 114.38 118.49 1y74 h ARG 86 Ca 0.15 -0.09 -0.01 0.00 -1.26 0.00 0.00 59.98 58.78 1y74 h ARG 86 Cb -0.02 -0.25 -0.00 0.00 -1.65 0.00 0.00 29.97 28.05 1y74 h ARG 86 CO -0.03 0.79 0.01 0.00 0.56 0.00 0.00 179.97 181.29 1y74 h ALA 87 N 1.42 0.05 -0.68 0.04 0.00 -0.57 -1.96 119.26 117.56 1y74 h ALA 87 Ca 0.31 -0.14 0.05 0.00 0.00 0.00 0.00 54.91 55.13 1y74 h ALA 87 Cb -0.08 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 17.64 1y74 h ALA 87 CO -0.06 -0.30 0.39 0.87 0.00 0.00 0.00 179.25 180.15 1y74 h LYS 88 N -0.19 0.72 -0.58 0.00 1.57 0.08 -1.62 116.57 116.55 1y74 h LYS 88 Ca 0.01 -0.04 0.06 0.00 -1.87 0.00 0.00 60.65 58.81 1y74 h LYS 88 Cb 0.28 -0.16 -0.05 0.00 0.08 0.00 0.00 32.23 32.38 1y74 h LYS 88 CO 0.00 0.47 0.29 0.93 -0.57 0.00 0.00 179.45 180.58 1y74 h GLU 89 N 0.74 0.54 -0.78 3.15 4.39 -0.35 -1.56 114.58 120.70 1y74 h GLU 89 Ca 0.29 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.96 1y74 h GLU 89 Cb 0.13 -0.12 -0.04 0.00 -0.10 0.00 0.00 28.75 28.62 1y74 h GLU 89 CO -0.16 0.36 0.51 0.28 -1.16 0.00 0.00 179.01 178.83 1y74 h VAL 90 N 0.55 1.21 -0.71 3.13 2.07 -0.55 -2.05 116.25 119.90 1y74 h VAL 90 Ca 0.27 -0.40 0.10 0.00 0.82 0.00 0.00 66.70 67.49 1y74 h VAL 90 Cb 0.20 0.07 -0.08 0.00 -1.52 0.00 0.00 31.29 29.96 1y74 h VAL 90 CO -0.19 0.21 0.33 -0.07 0.02 0.00 0.00 177.57 177.86 1y74 h LEU 91 N 1.07 0.40 -0.32 2.57 3.38 -0.40 0.27 115.31 122.28 1y74 h LEU 91 Ca 0.29 0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.33 1y74 h LEU 91 Cb -0.10 0.01 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 1y74 h LEU 91 CO -0.06 0.21 0.21 -0.33 0.09 0.00 0.00 178.44 178.56 1y74 h GLU 92 N 0.54 0.41 0.41 1.13 5.08 -0.85 1.01 114.58 122.32 1y74 h GLU 92 Ca 0.36 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.68 1y74 h GLU 92 Cb 0.43 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.59 1y74 h GLU 92 CO -0.30 0.27 -0.20 0.93 -1.00 0.00 0.00 179.01 178.71 1y74 h GLU 93 N 0.43 -0.53 0.00 2.33 3.07 -0.78 -1.64 114.58 117.45 1y74 h GLU 93 Ca 0.12 0.04 -0.03 0.00 -0.50 0.00 0.00 59.36 58.98 1y74 h GLU 93 Cb -0.05 0.12 -0.00 0.00 -0.84 0.00 0.00 28.75 27.98 1y74 h GLU 93 CO -0.03 -0.26 -0.15 -0.84 -1.40 0.00 0.00 179.01 176.34 1y74 h ILE 94 N -0.76 0.99 -0.04 3.13 3.07 -0.43 -2.03 117.51 121.45 1y74 h ILE 94 Ca -0.06 -0.54 -0.12 0.00 1.55 0.00 0.00 64.86 65.69 1y74 h ILE 94 Cb 0.52 1.30 -0.01 0.00 -0.27 0.00 0.00 36.82 38.36 1y74 h ILE 94 CO 0.09 0.15 -0.54 0.77 -1.05 0.00 0.00 178.15 177.57 1y74 h SER 95 N 0.00 0.11 0.00 2.16 4.64 0.13 -2.51 113.55 118.08 1y74 h SER 95 Ca -0.00 -0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.26 1y74 h SER 95 Cb 0.29 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 62.35 1y74 h SER 95 CO 0.02 0.63 0.00 0.00 -0.87 0.00 0.00 176.83 176.61 1y74 s TYR 97 N -2.00 3.57 -0.29 0.00 1.51 -0.94 -4.95 117.35 114.25 1y74 s TYR 97 Ca 0.33 -2.61 0.02 0.00 -1.01 0.00 0.00 57.07 53.81 1y74 s TYR 97 Cb 0.15 -3.15 0.28 0.00 -0.11 0.00 0.00 41.96 39.13 1y74 s TYR 97 CO 0.26 -0.94 1.29 -0.35 -1.11 0.00 0.00 175.55 174.71 1y74 n PRO 98 N 4.27 1.73 0.00 -1.71 -0.04 -1.26 -3.90 135.00 134.08 1y74 n PRO 98 Ca 0.01 -1.22 0.00 0.00 -0.04 0.00 0.00 63.50 62.25 1y74 n PRO 98 Cb 0.40 -1.54 0.00 0.00 -0.04 0.00 0.00 33.50 32.32 1y74 n PRO 98 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 1y74 n GLU 99 N -0.08 0.00 -2.44 0.54 0.28 -1.26 -5.00 120.64 112.69 1y74 n GLU 99 Ca 0.21 0.00 -0.43 0.00 -0.16 0.00 0.00 57.16 56.79 1y74 n GLU 99 Cb 0.90 -0.91 -0.02 0.00 1.43 0.00 0.00 31.44 32.84 1y74 n GLU 99 CO 0.00 0.00 0.00 -0.80 -0.16 0.00 0.00 177.13 176.17 1y74 s ASN 100 N -3.93 6.68 0.49 -1.84 0.02 -1.25 -4.89 114.94 110.22 1y74 s ASN 100 Ca 0.00 1.17 0.25 0.00 -1.02 0.00 0.00 52.86 53.26 1y74 s ASN 100 Cb 0.00 -2.54 1.27 0.00 0.02 0.00 0.00 41.25 40.00 1y74 s ASN 100 CO 0.00 -1.08 2.01 0.78 0.02 0.00 0.00 177.10 178.82 1y74 h ASN 101 N 9.27 0.00 0.26 -1.22 2.35 -1.94 -2.25 115.58 122.05 1y74 h ASN 101 Ca -0.26 0.00 -0.21 0.00 -0.55 0.00 0.00 56.30 55.28 1y74 h ASN 101 Cb 1.09 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.46 1y74 h ASN 101 CO 1.04 0.17 -0.84 0.44 -1.65 0.00 0.00 177.43 176.58 1y74 h ASP 102 N 0.00 0.54 -0.10 5.81 3.32 -1.98 -2.70 116.42 121.32 1y74 h ASP 102 Ca -0.00 -0.39 -0.02 0.00 0.02 0.00 0.00 57.03 56.64 1y74 h ASP 102 Cb 0.43 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.81 1y74 h ASP 102 CO 0.02 1.17 0.02 0.00 -1.72 0.00 0.00 179.24 178.73 1y74 h ALA 103 N 0.81 1.74 0.19 3.45 0.00 -1.72 0.78 119.26 124.51 1y74 h ALA 103 Ca -0.06 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 1y74 h ALA 103 Cb 1.45 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.16 1y74 h ALA 103 CO 0.15 0.21 -0.09 0.87 0.00 0.00 0.00 179.25 180.38 1y74 h LYS 104 N 0.23 -0.24 0.00 0.00 1.57 -1.43 -1.55 116.57 115.15 1y74 h LYS 104 Ca 0.06 0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.83 1y74 h LYS 104 Cb 0.12 0.06 -0.00 0.00 0.08 0.00 0.00 32.23 32.48 1y74 h LYS 104 CO -0.00 0.04 -0.11 1.05 -0.57 0.00 0.00 179.45 179.86 1y74 h GLU 105 N -1.00 0.00 0.11 3.15 4.11 -1.36 -2.19 114.58 117.40 1y74 h GLU 105 Ca -0.03 0.00 -0.27 0.00 0.07 0.00 0.00 59.36 59.14 1y74 h GLU 105 Cb 0.40 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.66 1y74 h GLU 105 CO 0.04 0.11 -1.19 1.25 0.07 0.00 0.00 179.01 179.29 1y74 h LEU 106 N 0.00 0.50 -0.90 3.06 5.85 0.54 -2.66 115.31 121.70 1y74 h LEU 106 Ca -0.00 -0.50 -0.05 0.00 0.84 0.00 0.00 57.88 58.17 1y74 h LEU 106 Cb 0.32 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.16 1y74 h LEU 106 CO 0.01 1.36 0.23 0.50 -0.34 0.00 0.00 178.44 180.21 1y74 h LYS 107 N 0.12 1.03 0.21 1.25 3.11 -0.68 0.32 116.57 121.93 1y74 h LYS 107 Ca -0.13 -0.20 -0.01 0.00 -2.81 0.00 0.00 60.65 57.50 1y74 h LYS 107 Cb 1.89 -0.16 0.00 0.00 -1.00 0.00 0.00 32.23 32.96 1y74 h LYS 107 CO 0.20 0.87 -0.10 0.00 -2.81 0.00 0.00 179.45 177.61 1y74 h ARG 108 N 1.00 -0.27 -0.29 1.90 3.08 -1.47 -1.26 114.38 117.08 1y74 h ARG 108 Ca 0.23 0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.30 1y74 h ARG 108 Cb 0.26 0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.35 1y74 h ARG 108 CO -0.01 0.04 0.19 0.82 -1.07 0.00 0.00 179.97 179.94 1y74 h ILE 109 N -0.58 1.07 0.00 2.04 2.04 -1.35 -0.78 117.51 119.95 1y74 h ILE 109 Ca -0.03 -0.13 -0.03 0.00 1.00 0.00 0.00 64.86 65.67 1y74 h ILE 109 Cb 0.43 0.65 -0.00 0.00 -0.74 0.00 0.00 36.82 37.15 1y74 h ILE 109 CO 0.05 0.07 -0.15 -0.07 0.00 0.00 0.00 178.15 178.05 1y74 h LEU 110 N 0.39 0.00 0.00 1.44 3.38 -0.96 -1.98 115.31 117.58 1y74 h LEU 110 Ca 0.11 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 58.00 1y74 h LEU 110 Cb -0.04 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 1y74 h LEU 110 CO -0.02 0.15 -0.41 0.71 0.09 0.00 0.00 178.44 178.96 1y74 h THR 111 N 0.00 0.58 -1.59 0.22 1.35 -0.58 -3.43 112.91 109.47 1y74 h THR 111 Ca -0.00 -1.84 -0.73 0.00 -0.55 0.00 0.00 66.41 63.30 1y74 h THR 111 Cb 0.28 2.27 0.02 0.00 -1.73 0.00 0.00 68.15 68.98 1y74 h THR 111 CO 0.02 0.33 0.90 0.00 -0.25 0.00 0.00 175.52 176.52 1y74 n GLN 112 N -3.16 1.24 -0.32 4.72 6.02 -0.36 -4.82 117.38 120.69 1y74 n GLN 112 Ca 0.02 0.45 0.19 0.00 -0.01 0.00 0.00 57.00 57.65 1y74 n GLN 112 Cb 0.68 -2.15 0.43 0.00 1.02 0.00 0.00 30.24 30.22 1y74 n GLN 112 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.06 175.05 1y74 h PRO 113 N 7.26 0.52 0.20 -1.09 0.13 -1.89 -2.07 132.00 135.07 1y74 h PRO 113 Ca -0.47 -0.03 0.01 0.00 -0.87 0.00 0.00 66.00 64.64 1y74 h PRO 113 Cb 1.32 -0.12 -0.03 0.00 0.13 0.00 0.00 31.00 32.29 1y74 h PRO 113 CO 0.95 0.34 -0.35 0.45 -0.23 0.00 0.00 178.00 179.17 1y74 h HIS 114 N 0.54 -0.95 -0.27 1.56 3.86 -1.94 0.14 115.15 118.08 1y74 h HIS 114 Ca 0.58 0.02 0.08 0.00 -1.16 0.00 0.00 60.37 59.89 1y74 h HIS 114 Cb 1.24 0.39 -0.01 0.00 1.06 0.00 0.00 27.41 30.09 1y74 h HIS 114 CO -0.00 -0.47 0.20 0.35 0.86 0.00 0.00 177.93 178.87 1y74 h PHE 115 N -0.63 0.00 -0.28 2.45 3.04 -1.68 0.86 116.94 120.70 1y74 h PHE 115 Ca 0.01 0.00 -0.15 0.00 3.98 0.00 0.00 57.97 61.81 1y74 h PHE 115 Cb 0.62 0.00 -0.01 0.00 2.56 0.00 0.00 35.95 39.13 1y74 h PHE 115 CO -0.27 0.00 -0.43 0.52 -2.02 0.00 0.00 178.31 176.11 1y74 h MET 116 N 0.00 0.70 0.12 1.11 2.86 -0.71 -1.23 114.93 117.78 1y74 h MET 116 Ca 0.13 -0.38 -0.00 0.00 -2.06 0.00 0.00 59.70 57.38 1y74 h MET 116 Cb 0.53 0.02 -0.00 0.00 0.06 0.00 0.00 31.60 32.20 1y74 h MET 116 CO -0.00 1.00 -0.08 0.00 1.06 0.00 0.00 176.91 178.89 1y74 h ALA 117 N 0.95 -0.18 -0.41 6.32 0.00 0.17 0.80 119.26 126.90 1y74 h ALA 117 Ca 0.04 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1y74 h ALA 117 Cb 0.98 0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.85 1y74 h ALA 117 CO 0.09 -0.61 0.23 1.25 0.00 0.00 0.00 179.25 180.21 1y74 h LEU 118 N -0.19 0.52 -1.41 0.00 5.85 -1.44 -1.48 115.31 117.15 1y74 h LEU 118 Ca -0.01 -0.09 0.03 0.00 0.84 0.00 0.00 57.88 58.66 1y74 h LEU 118 Cb 0.17 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 41.03 1y74 h LEU 118 CO 0.00 0.45 0.43 -0.07 -0.34 0.00 0.00 178.44 178.92 1y74 h LEU 119 N 0.54 0.66 -0.91 2.25 3.38 -0.86 -0.05 115.31 120.32 1y74 h LEU 119 Ca 0.15 -0.01 0.02 0.00 0.09 0.00 0.00 57.88 58.13 1y74 h LEU 119 Cb 0.05 -0.15 -0.05 0.00 0.09 0.00 0.00 40.66 40.60 1y74 h LEU 119 CO -0.02 0.45 0.60 1.56 0.09 0.00 0.00 178.44 181.12 1y74 h GLN 120 N 0.77 1.16 -0.28 1.13 4.20 0.16 0.78 115.11 123.03 1y74 h GLN 120 Ca 0.26 -0.07 -0.04 0.00 0.06 0.00 0.00 58.65 58.86 1y74 h GLN 120 Cb 0.08 -0.26 -0.02 0.00 0.30 0.00 0.00 27.48 27.59 1y74 h GLN 120 CO -0.07 0.76 -0.01 1.15 -0.67 0.00 0.00 178.83 180.00 1y74 h THR 121 N 1.19 1.17 -0.51 -0.54 2.02 -0.36 0.10 112.91 115.98 1y74 h THR 121 Ca 0.35 -0.68 -0.01 0.00 0.77 0.00 0.00 66.41 66.85 1y74 h THR 121 Cb -0.06 0.97 -0.02 0.00 -1.74 0.00 0.00 68.15 67.30 1y74 h THR 121 CO -0.10 0.23 0.29 -0.74 0.37 0.00 0.00 175.52 175.57 1y74 h HIS 122 N 0.40 0.70 0.07 3.16 6.17 -0.00 -2.63 115.15 123.01 1y74 h HIS 122 Ca 0.09 -0.01 -0.28 0.00 0.71 0.00 0.00 60.37 60.87 1y74 h HIS 122 Cb 0.28 -0.22 0.03 0.00 2.52 0.00 0.00 27.41 30.01 1y74 h HIS 122 CO 0.01 0.51 -1.15 0.22 0.71 0.00 0.00 177.93 178.23 1y74 h ASP 123 N 0.69 0.89 -0.39 3.26 1.82 -0.80 -2.03 116.42 119.86 1y74 h ASP 123 Ca 0.18 -0.79 0.07 0.00 -0.39 0.00 0.00 57.03 56.11 1y74 h ASP 123 Cb 0.03 -0.28 -0.07 0.00 0.68 0.00 0.00 39.33 39.70 1y74 h ASP 123 CO -0.03 1.58 -0.04 1.62 -1.61 0.00 0.00 179.24 180.76 1y74 h VAL 124 N 0.32 0.67 0.14 2.25 3.04 -0.73 0.76 116.25 122.69 1y74 h VAL 124 Ca -0.16 -0.02 -0.01 0.00 -1.01 0.00 0.00 66.70 65.50 1y74 h VAL 124 Cb 1.81 0.60 0.00 0.00 -2.01 0.00 0.00 31.29 31.70 1y74 h VAL 124 CO 0.22 0.01 -0.07 0.58 -1.01 0.00 0.00 177.57 177.31 1y74 h VAL 125 N 0.06 0.77 -0.81 1.51 2.07 -1.58 -2.16 116.25 116.11 1y74 h VAL 125 Ca 0.19 -1.22 0.21 0.00 0.82 0.00 0.00 66.70 66.71 1y74 h VAL 125 Cb 0.28 1.34 -0.04 0.00 -1.52 0.00 0.00 31.29 31.35 1y74 h VAL 125 CO -0.35 0.22 0.57 0.00 0.02 0.00 0.00 177.57 178.02 1y74 h ALA 126 N -0.44 2.56 0.03 1.67 0.00 -1.27 0.23 119.26 122.04 1y74 h ALA 126 Ca -0.02 -0.01 -0.28 0.00 0.00 0.00 0.00 54.91 54.60 1y74 h ALA 126 Cb 0.50 0.03 0.02 0.00 0.00 0.00 0.00 17.79 18.34 1y74 h ALA 126 CO 0.03 -0.79 -1.10 1.25 0.00 0.00 0.00 179.25 178.64 1y74 h HIS 127 N 0.13 1.05 0.00 0.00 6.17 0.51 -2.20 115.15 120.81 1y74 h HIS 127 Ca 0.40 -0.59 0.00 0.00 0.71 0.00 0.00 60.37 60.88 1y74 h HIS 127 Cb 1.36 -0.11 0.00 0.00 2.52 0.00 0.00 27.41 31.18 1y74 h HIS 127 CO -0.00 1.43 0.00 0.39 0.71 0.00 0.00 177.93 180.46 1y74 n GLU 128 N -3.84 0.51 -0.10 5.26 -0.58 0.32 -4.03 120.64 118.18 1y74 n GLU 128 Ca -0.12 0.00 -0.19 0.00 -0.42 0.00 0.00 57.16 56.43 1y74 n GLU 128 Cb 0.91 -1.50 -0.06 0.00 -0.57 0.00 0.00 31.44 30.22 1y74 n GLU 128 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 1y74 n VAL 129 N -1.24 1.37 0.00 2.62 0.31 0.53 -5.02 118.33 116.91 1y74 n VAL 129 Ca 0.16 -0.15 0.00 0.00 -0.01 0.00 0.00 64.34 64.34 1y74 n VAL 129 Cb 0.22 -1.98 0.00 0.00 -0.91 0.00 0.00 33.84 31.17 1y74 n VAL 129 CO 0.00 0.00 0.00 -1.22 -1.32 0.00 0.00 176.83 174.29 1y74 n TYR 130 N -4.17 0.00 -3.14 3.52 4.01 -0.83 -4.94 117.16 111.62 1y74 n TYR 130 Ca -0.35 0.00 -0.19 0.00 -0.16 0.00 0.00 57.90 57.21 1y74 n TYR 130 Cb 0.70 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.69 1y74 n TYR 130 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 1y74 n SER 131 N -0.21 -1.19 0.00 7.72 2.88 -1.21 -4.96 113.62 116.66 1y74 n SER 131 Ca 0.00 -0.35 0.00 0.00 -1.33 0.00 0.00 58.87 57.19 1y74 n SER 131 Cb 0.00 -1.09 0.00 0.00 -0.75 0.00 0.00 64.21 62.37 1y74 n SER 131 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28