#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1k81 h ILE 109 N 0.00 0.96 -3.61 2.52 2.04 -2.09 -3.30 117.51 114.03 1k81 h ILE 109 Ca 0.00 -0.03 -0.79 0.00 1.00 0.00 0.00 64.86 65.04 1k81 h ILE 109 Cb 0.00 0.87 -0.28 0.00 -0.74 0.00 0.00 36.82 36.68 1k81 h ILE 109 CO 0.00 0.01 0.35 0.00 0.00 0.00 0.00 178.15 178.52 1k81 n ARG 111 N 2.93 1.66 0.00 0.00 0.63 -1.25 -4.64 116.66 116.00 1k81 n ARG 111 Ca 0.22 -3.06 0.00 0.00 -0.92 0.00 0.00 57.85 54.09 1k81 n ARG 111 Cb 0.41 -1.65 0.00 0.00 0.45 0.00 0.00 32.46 31.67 1k81 n ARG 111 CO 0.00 0.00 0.00 -0.85 -2.51 0.00 0.00 177.63 174.27 1k81 n GLU 112 N -1.16 0.00 0.37 -0.14 0.28 -1.26 -4.84 120.64 113.90 1k81 n GLU 112 Ca 0.21 0.00 -0.18 0.00 -0.16 0.00 0.00 57.16 57.03 1k81 n GLU 112 Cb 0.76 -0.68 -0.09 0.00 1.43 0.00 0.00 31.44 32.86 1k81 n GLU 112 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1k81 n GLY 114 N -1.47 -5.09 4.15 0.00 0.00 -1.26 -4.61 105.19 96.91 1k81 n GLY 114 Ca -0.14 -0.35 -0.39 0.00 0.00 0.00 0.00 46.02 45.14 1k81 n GLY 114 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1k81 n LYS 115 N 1.28 -0.73 0.00 1.61 0.00 -1.26 -4.96 118.16 114.10 1k81 n LYS 115 Ca 0.00 0.11 0.00 0.00 0.00 0.00 0.00 58.31 58.42 1k81 n LYS 115 Cb 0.00 -3.11 0.00 0.00 0.00 0.00 0.00 35.03 31.92 1k81 n LYS 115 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.40 177.05 1k81 n PRO 116 N -4.81 3.95 -4.65 1.64 -0.04 -1.26 -5.14 135.00 124.70 1k81 n PRO 116 Ca -0.21 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 62.95 1k81 n PRO 116 Cb 0.62 0.00 -0.13 0.00 -0.04 0.00 0.00 33.50 33.95 1k81 n PRO 116 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1k81 s ASP 117 N -0.66 3.56 -0.06 3.54 1.01 -1.00 -5.04 116.67 118.03 1k81 s ASP 117 Ca 0.00 -0.54 0.03 0.00 0.71 0.00 0.00 52.55 52.75 1k81 s ASP 117 Cb 0.00 -0.46 0.01 0.00 1.01 0.00 0.00 42.92 43.48 1k81 s ASP 117 CO 0.00 0.24 -0.14 0.42 0.21 0.00 0.00 175.17 175.90 1k81 s THR 118 N -0.94 1.23 -0.02 -1.27 -4.23 -1.26 -2.20 115.64 106.95 1k81 s THR 118 Ca 0.14 -0.56 0.02 0.00 -1.18 0.00 0.00 61.69 60.11 1k81 s THR 118 Cb -0.10 -1.10 -0.00 0.00 1.34 0.00 0.00 72.50 72.64 1k81 s THR 118 CO 0.05 0.37 -0.08 -0.75 -0.54 0.00 0.00 174.62 173.67 1k81 s LYS 119 N 0.42 0.79 -0.03 3.99 2.47 -0.92 -5.05 119.74 121.42 1k81 s LYS 119 Ca -0.11 -0.28 0.04 0.00 -1.56 0.00 0.00 55.97 54.06 1k81 s LYS 119 Cb -0.14 -0.76 -0.00 0.00 -1.46 0.00 0.00 37.83 35.47 1k81 s LYS 119 CO 0.03 0.13 -0.14 0.42 0.16 0.00 0.00 175.35 175.96 1k81 s ILE 120 N 0.05 1.13 -0.02 5.43 1.01 -1.26 -2.13 121.20 125.41 1k81 s ILE 120 Ca -0.01 -0.56 0.03 0.00 0.00 0.00 0.00 60.65 60.12 1k81 s ILE 120 Cb -0.06 -0.98 -0.00 0.00 0.01 0.00 0.00 42.46 41.43 1k81 s ILE 120 CO 0.00 0.33 -0.12 -0.63 0.00 0.00 0.00 174.94 174.52 1k81 s ILE 121 N 0.03 1.01 -0.03 2.92 -1.09 -0.92 -5.05 121.20 118.06 1k81 s ILE 121 Ca -0.02 -0.50 0.04 0.00 -2.23 0.00 0.00 60.65 57.94 1k81 s ILE 121 Cb -0.09 -0.87 -0.00 0.00 -1.58 0.00 0.00 42.46 39.91 1k81 s ILE 121 CO 0.01 0.30 -0.15 -0.54 -1.23 0.00 0.00 174.94 173.33 1k81 s LYS 122 N -0.00 1.49 -0.02 2.79 1.02 -1.26 -1.93 119.74 121.82 1k81 s LYS 122 Ca -0.01 -0.52 0.03 0.00 0.02 0.00 0.00 55.97 55.49 1k81 s LYS 122 Cb -0.08 -1.33 -0.00 0.00 -0.52 0.00 0.00 37.83 35.90 1k81 s LYS 122 CO 0.01 0.23 -0.12 -1.21 -0.92 0.00 0.00 175.35 173.33 1k81 s GLU 123 N 0.01 1.14 4.79 1.68 0.41 -0.93 -5.02 118.70 120.77 1k81 s GLU 123 Ca -0.02 -0.41 0.00 0.00 -0.41 0.00 0.00 54.97 54.13 1k81 s GLU 123 Cb -0.10 -1.05 0.00 0.00 -1.78 0.00 0.00 34.13 31.20 1k81 s GLU 123 CO 0.01 0.19 0.00 0.41 -0.49 0.00 0.00 175.26 175.38 1k81 n GLY 124 N 3.10 0.93 1.04 -1.39 0.00 -1.26 -1.97 105.19 105.64 1k81 n GLY 124 Ca -0.17 0.52 0.04 0.00 0.00 0.00 0.00 46.02 46.42 1k81 n GLY 124 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1k81 n ARG 125 N 0.00 0.48 -4.40 1.61 0.00 -1.26 -5.05 116.66 108.04 1k81 n ARG 125 Ca 0.00 -2.22 -0.20 0.00 -0.00 0.00 0.00 57.85 55.42 1k81 n ARG 125 Cb 0.00 -0.57 -0.15 0.00 -0.00 0.00 0.00 32.46 31.73 1k81 n ARG 125 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.63 177.77 1k81 s VAL 126 N -1.00 0.79 -0.09 8.89 -7.23 -0.83 -4.67 120.40 116.26 1k81 s VAL 126 Ca 0.30 -0.38 -0.00 0.00 -1.81 0.00 0.00 61.98 60.09 1k81 s VAL 126 Cb 0.32 -0.69 -0.03 0.00 0.56 0.00 0.00 36.38 36.54 1k81 s VAL 126 CO -0.11 0.24 -0.05 -1.00 -0.31 0.00 0.00 175.10 173.87 1k81 s HIS 127 N 0.10 2.99 -0.03 2.82 3.76 -0.86 -2.18 115.29 121.89 1k81 s HIS 127 Ca -0.02 -0.02 0.04 0.00 -0.15 0.00 0.00 55.06 54.92 1k81 s HIS 127 Cb -0.08 -1.77 -0.01 0.00 1.11 0.00 0.00 32.58 31.84 1k81 s HIS 127 CO 0.00 0.28 -0.16 -0.51 -0.85 0.00 0.00 174.74 173.50 1k81 s LEU 128 N -0.59 1.94 -0.06 0.89 1.43 -0.81 -1.82 118.68 119.67 1k81 s LEU 128 Ca 0.09 -0.31 0.05 0.00 -1.03 0.00 0.00 54.13 52.93 1k81 s LEU 128 Cb -0.12 -0.88 -0.02 0.00 0.03 0.00 0.00 46.19 45.21 1k81 s LEU 128 CO 0.02 0.16 -0.21 -0.76 0.23 0.00 0.00 176.35 175.79 1k81 s LEU 129 N -0.10 2.31 -0.03 1.79 1.43 -0.98 -2.16 118.68 120.93 1k81 s LEU 129 Ca 0.00 -0.40 0.04 0.00 -1.03 0.00 0.00 54.13 52.74 1k81 s LEU 129 Cb -0.09 -1.44 -0.00 0.00 0.03 0.00 0.00 46.19 44.68 1k81 s LEU 129 CO 0.01 0.28 -0.14 -0.54 0.23 0.00 0.00 176.35 176.19 1k81 s LYS 130 N -0.35 1.31 -0.04 1.70 -0.14 -0.91 -2.00 119.74 119.32 1k81 s LYS 130 Ca 0.02 -0.48 0.05 0.00 -1.36 0.00 0.00 55.97 54.20 1k81 s LYS 130 Cb -0.12 -1.20 -0.01 0.00 -1.68 0.00 0.00 37.83 34.82 1k81 s LYS 130 CO 0.02 0.23 -0.21 0.00 -0.76 0.00 0.00 175.35 174.63 1k81 s MET 132 N -0.14 3.60 0.00 0.00 -1.94 -0.94 -2.60 119.30 117.28 1k81 s MET 132 Ca -0.01 -0.53 0.00 0.00 -1.71 0.00 0.00 55.69 53.44 1k81 s MET 132 Cb -0.12 -2.88 0.00 0.00 2.01 0.00 0.00 34.83 33.84 1k81 s MET 132 CO 0.02 0.28 0.00 0.00 -0.01 0.00 0.00 175.02 175.31 1k81 n ALA 133 N 3.42 0.00 0.44 3.03 0.00 -1.26 -2.38 120.51 123.77 1k81 n ALA 133 Ca -0.17 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.32 1k81 n ALA 133 Cb 0.53 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.90 1k81 n ALA 133 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1k81 n GLY 135 N 1.38 -1.20 3.06 0.00 0.00 -1.18 -5.03 105.19 102.24 1k81 n GLY 135 Ca 0.01 0.52 -0.22 0.00 0.00 0.00 0.00 46.02 46.34 1k81 n GLY 135 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k81 s ALA 136 N -3.19 1.07 -0.04 4.61 0.00 -1.07 -5.02 121.76 118.12 1k81 s ALA 136 Ca 0.22 -0.48 0.04 0.00 0.00 0.00 0.00 51.96 51.74 1k81 s ALA 136 Cb -0.04 -0.34 -0.00 0.00 0.00 0.00 0.00 23.12 22.74 1k81 s ALA 136 CO 0.76 0.21 -0.15 -1.50 0.00 0.00 0.00 175.76 175.08 1k81 s ILE 137 N -0.01 1.29 -0.02 0.00 2.07 -1.26 -1.86 121.20 121.39 1k81 s ILE 137 Ca -0.00 -0.64 0.03 0.00 -1.41 0.00 0.00 60.65 58.63 1k81 s ILE 137 Cb -0.08 -1.11 -0.00 0.00 0.13 0.00 0.00 42.46 41.40 1k81 s ILE 137 CO 0.00 0.37 -0.12 0.00 -1.91 0.00 0.00 174.94 173.29 1k81 s ARG 138 N 0.02 1.14 0.07 3.50 1.70 -0.85 -5.02 118.95 119.52 1k81 s ARG 138 Ca -0.02 -0.41 -0.08 0.00 -0.47 0.00 0.00 55.73 54.74 1k81 s ARG 138 Cb -0.10 -1.06 -0.05 0.00 -0.57 0.00 0.00 34.95 33.16 1k81 s ARG 138 CO 0.01 0.19 0.37 -1.25 -1.08 0.00 0.00 175.30 173.54 1k81 s PRO 139 N 0.00 3.70 -0.05 3.89 0.04 -1.26 -2.33 135.00 138.99 1k81 s PRO 139 Ca -0.01 0.07 -0.15 0.00 0.04 0.00 0.00 61.00 60.96 1k81 s PRO 139 Cb -0.08 -2.99 0.03 0.00 0.04 0.00 0.00 34.50 31.50 1k81 s PRO 139 CO 0.00 0.56 0.34 0.96 0.04 0.00 0.00 177.00 178.91 1k81 s ILE 140 N -1.42 0.04 -0.72 0.56 -4.36 -0.75 -4.98 121.20 109.57 1k81 s ILE 140 Ca 0.33 -0.33 -0.01 0.00 -0.26 0.00 0.00 60.65 60.38 1k81 s ILE 140 Cb -0.13 -0.61 -0.02 0.00 1.25 0.00 0.00 42.46 42.95 1k81 s ILE 140 CO 0.19 -0.18 0.66 0.54 0.24 0.00 0.00 174.94 176.39 1k81 n ARG 141 N 1.67 -1.36 -3.93 0.37 5.12 -1.26 -2.02 116.66 115.24 1k81 n ARG 141 Ca -0.19 1.22 -0.32 0.00 -1.93 0.00 0.00 57.85 56.64 1k81 n ARG 141 Cb 0.56 -5.26 -0.14 0.00 -1.16 0.00 0.00 32.46 26.47 1k81 n ARG 141 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1k81 s MET 142 N -3.30 1.89 0.00 5.56 0.23 -1.26 -3.96 119.30 118.46 1k81 s MET 142 Ca 0.10 -2.31 0.00 0.00 -1.03 0.00 0.00 55.69 52.45 1k81 s MET 142 Cb -0.01 -3.35 0.00 0.00 -1.53 0.00 0.00 34.83 29.93 1k81 s MET 142 CO 0.66 -1.06 0.00 -0.89 -2.03 0.00 0.00 175.02 171.70