#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1k81 n ILE 109 N 0.00 0.00 -3.64 2.52 2.08 -1.26 -4.91 119.36 114.15 1k81 n ILE 109 Ca 0.00 1.49 -0.06 0.00 0.56 0.00 0.00 62.75 64.73 1k81 n ILE 109 Cb 0.00 -2.38 -0.07 0.00 -0.75 0.00 0.00 39.64 36.44 1k81 n ILE 109 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1k81 n ARG 111 N 2.83 0.65 -2.81 0.00 0.63 -1.26 -4.54 116.66 112.17 1k81 n ARG 111 Ca -0.15 -0.04 -0.21 0.00 -0.92 0.00 0.00 57.85 56.53 1k81 n ARG 111 Cb 0.57 -1.61 -0.01 0.00 0.45 0.00 0.00 32.46 31.86 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 -2.55 2.32 0.02 -0.14 0.28 -1.26 -4.82 120.64 114.49 1k81 n GLU 112 Ca -0.12 -4.08 0.00 0.00 -0.16 0.00 0.00 57.16 52.80 1k81 n GLU 112 Cb 0.77 -1.90 0.00 0.00 1.43 0.00 0.00 31.44 31.74 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 2.86 0.89 3.14 0.00 0.00 -1.26 -4.80 105.19 106.02 1k81 n GLY 114 Ca 0.00 -0.78 -0.14 0.00 0.00 0.00 0.00 46.02 45.10 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 -0.11 -1.93 0.00 1.61 4.81 -1.26 -5.04 118.16 116.23 1k81 n LYS 115 Ca 0.00 1.67 0.00 0.00 -0.87 0.00 0.00 58.31 59.11 1k81 n LYS 115 Cb 0.04 -4.61 0.00 0.00 0.02 0.00 0.00 35.03 30.48 1k81 n LYS 115 CO 0.00 0.00 0.00 -0.35 1.17 0.00 0.00 177.40 178.22 1k81 n PRO 116 N -0.92 3.59 -4.22 1.64 -0.04 -1.26 -5.12 135.00 128.67 1k81 n PRO 116 Ca -0.00 0.00 -0.19 0.00 -0.04 0.00 0.00 63.50 63.27 1k81 n PRO 116 Cb 0.54 0.00 -0.12 0.00 -0.04 0.00 0.00 33.50 33.89 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 -1.00 1.92 -0.08 3.54 1.11 -1.01 -5.02 116.67 116.13 1k81 s ASP 117 Ca 0.00 -0.71 0.05 0.00 0.18 0.00 0.00 52.55 52.07 1k81 s ASP 117 Cb 0.00 -0.07 -0.00 0.00 1.07 0.00 0.00 42.92 43.92 1k81 s ASP 117 CO 0.00 -0.09 -0.24 -0.89 1.18 0.00 0.00 175.17 175.13 1k81 s THR 118 N -1.64 2.00 -0.02 -1.27 2.01 -1.26 -2.27 115.64 113.19 1k81 s THR 118 Ca 0.04 -1.00 0.02 0.00 0.31 0.00 0.00 61.69 61.06 1k81 s THR 118 Cb -0.08 -1.72 -0.00 0.00 0.01 0.00 0.00 72.50 70.72 1k81 s THR 118 CO 0.03 0.55 -0.08 -0.54 -0.69 0.00 0.00 174.62 173.89 1k81 s LYS 119 N 0.17 0.78 -0.03 4.92 1.02 -0.66 -5.04 119.74 120.90 1k81 s LYS 119 Ca -0.13 -0.28 0.04 0.00 0.02 0.00 0.00 55.97 55.62 1k81 s LYS 119 Cb -0.16 -0.75 -0.00 0.00 -0.52 0.00 0.00 37.83 36.39 1k81 s LYS 119 CO 0.07 0.13 -0.15 -1.50 -0.92 0.00 0.00 175.35 172.98 1k81 s ILE 120 N 0.05 1.23 -0.02 2.17 2.07 -1.26 -1.61 121.20 123.83 1k81 s ILE 120 Ca -0.01 -0.61 0.03 0.00 -1.41 0.00 0.00 60.65 58.65 1k81 s ILE 120 Cb -0.06 -1.06 -0.00 0.00 0.13 0.00 0.00 42.46 41.46 1k81 s ILE 120 CO 0.00 0.36 -0.12 -0.51 -1.91 0.00 0.00 174.94 172.76 1k81 s ILE 121 N 0.03 0.98 -0.03 2.00 1.10 -0.92 -5.05 121.20 119.31 1k81 s ILE 121 Ca -0.02 -0.49 0.04 0.00 -0.51 0.00 0.00 60.65 59.66 1k81 s ILE 121 Cb -0.10 -0.85 -0.00 0.00 0.15 0.00 0.00 42.46 41.66 1k81 s ILE 121 CO 0.01 0.29 -0.15 -0.75 -2.11 0.00 0.00 174.94 172.23 1k81 s LYS 122 N -0.02 1.51 -0.03 3.50 2.36 -1.26 -1.94 119.74 123.86 1k81 s LYS 122 Ca -0.00 -0.54 0.03 0.00 -2.55 0.00 0.00 55.97 52.91 1k81 s LYS 122 Cb -0.08 -1.36 -0.00 0.00 -1.05 0.00 0.00 37.83 35.35 1k81 s LYS 122 CO 0.00 0.24 -0.12 -1.21 1.55 0.00 0.00 175.35 175.82 1k81 s GLU 123 N -0.02 1.14 3.53 4.03 2.02 -0.95 -5.01 118.70 123.44 1k81 s GLU 123 Ca -0.02 -0.40 0.00 0.00 0.02 0.00 0.00 54.97 54.57 1k81 s GLU 123 Cb -0.10 -1.05 0.00 0.00 0.10 0.00 0.00 34.13 33.08 1k81 s GLU 123 CO 0.01 0.18 0.00 0.41 0.02 0.00 0.00 175.26 175.88 1k81 n GLY 124 N 3.13 0.34 2.04 -1.39 0.00 -1.26 -1.92 105.19 106.13 1k81 n GLY 124 Ca -0.17 0.67 0.02 0.00 0.00 0.00 0.00 46.02 46.54 1k81 n GLY 124 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1k81 n ARG 125 N 0.00 0.71 -4.31 1.61 5.12 -1.26 -5.07 116.66 113.46 1k81 n ARG 125 Ca 0.00 -2.57 -0.19 0.00 -1.93 0.00 0.00 57.85 53.16 1k81 n ARG 125 Cb 0.00 -0.63 -0.15 0.00 -1.16 0.00 0.00 32.46 30.52 1k81 n ARG 125 CO 0.00 0.00 0.00 0.14 -1.93 0.00 0.00 177.63 175.84 1k81 s VAL 126 N -1.52 0.65 -0.09 1.55 -7.23 -0.81 -4.76 120.40 108.19 1k81 s VAL 126 Ca 0.30 -0.31 -0.01 0.00 -1.81 0.00 0.00 61.98 60.16 1k81 s VAL 126 Cb 0.36 -0.58 -0.03 0.00 0.56 0.00 0.00 36.38 36.69 1k81 s VAL 126 CO -0.11 0.20 -0.05 -1.00 -0.31 0.00 0.00 175.10 173.83 1k81 s HIS 127 N 0.10 3.01 -0.02 2.82 3.76 -0.79 -2.25 115.29 121.92 1k81 s HIS 127 Ca -0.01 -0.02 0.04 0.00 -0.15 0.00 0.00 55.06 54.91 1k81 s HIS 127 Cb -0.07 -1.79 -0.00 0.00 1.11 0.00 0.00 32.58 31.83 1k81 s HIS 127 CO 0.00 0.27 -0.13 -0.51 -0.85 0.00 0.00 174.74 173.52 1k81 s LEU 128 N -0.53 1.92 -0.08 0.89 1.43 -0.82 -1.88 118.68 119.61 1k81 s LEU 128 Ca 0.08 -0.25 0.01 0.00 -1.03 0.00 0.00 54.13 52.94 1k81 s LEU 128 Cb -0.12 -0.72 -0.02 0.00 0.03 0.00 0.00 46.19 45.36 1k81 s LEU 128 CO 0.02 0.13 -0.12 -0.76 0.23 0.00 0.00 176.35 175.86 1k81 s LEU 129 N -0.06 2.86 -0.02 1.79 2.01 -0.97 -2.17 118.68 122.11 1k81 s LEU 129 Ca 0.00 -0.19 0.03 0.00 0.01 0.00 0.00 54.13 53.99 1k81 s LEU 129 Cb -0.08 -1.62 -0.00 0.00 0.01 0.00 0.00 46.19 44.50 1k81 s LEU 129 CO 0.00 0.29 -0.12 -0.54 1.01 0.00 0.00 176.35 176.99 1k81 s LYS 130 N -0.37 1.14 -0.05 1.70 1.02 -0.64 -2.01 119.74 120.53 1k81 s LYS 130 Ca 0.04 -0.43 0.06 0.00 0.02 0.00 0.00 55.97 55.66 1k81 s LYS 130 Cb -0.12 -1.06 -0.02 0.00 -0.52 0.00 0.00 37.83 36.11 1k81 s LYS 130 CO 0.02 0.21 -0.23 0.00 -0.92 0.00 0.00 175.35 174.44 1k81 s MET 132 N -0.31 3.64 0.00 0.00 -1.94 -0.96 -2.63 119.30 117.10 1k81 s MET 132 Ca 0.01 -0.51 0.00 0.00 -1.71 0.00 0.00 55.69 53.48 1k81 s MET 132 Cb -0.13 -2.91 0.00 0.00 2.01 0.00 0.00 34.83 33.81 1k81 s MET 132 CO 0.02 0.27 0.00 0.00 -0.01 0.00 0.00 175.02 175.30 1k81 n ALA 133 N 3.46 0.00 0.18 3.03 0.00 -1.26 -2.40 120.51 123.52 1k81 n ALA 133 Ca -0.17 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.29 1k81 n ALA 133 Cb 0.52 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.94 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 1.35 -1.22 3.21 0.00 0.00 -1.15 -5.03 105.19 102.35 1k81 n GLY 135 Ca 0.01 0.50 -0.28 0.00 0.00 0.00 0.00 46.02 46.24 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 -3.10 1.77 -0.04 4.61 0.00 -1.08 -5.00 121.76 118.93 1k81 s ALA 136 Ca 0.11 -0.87 0.04 0.00 0.00 0.00 0.00 51.96 51.24 1k81 s ALA 136 Cb -0.01 -0.51 -0.00 0.00 0.00 0.00 0.00 23.12 22.59 1k81 s ALA 136 CO 0.74 0.38 -0.16 0.96 0.00 0.00 0.00 175.76 177.69 1k81 s ILE 137 N -0.26 1.32 -0.02 0.00 -5.25 -1.26 -1.92 121.20 113.81 1k81 s ILE 137 Ca 0.02 -0.66 0.03 0.00 -0.99 0.00 0.00 60.65 59.05 1k81 s ILE 137 Cb -0.10 -1.13 -0.00 0.00 2.95 0.00 0.00 42.46 44.17 1k81 s ILE 137 CO 0.01 0.38 -0.12 -0.13 -1.79 0.00 0.00 174.94 173.29 1k81 s ARG 138 N 0.02 1.14 0.01 0.37 0.52 -0.85 -5.02 118.95 115.14 1k81 s ARG 138 Ca -0.03 -0.41 -0.16 0.00 -0.52 0.00 0.00 55.73 54.61 1k81 s ARG 138 Cb -0.10 -1.05 -0.06 0.00 0.52 0.00 0.00 34.95 34.25 1k81 s ARG 138 CO 0.02 0.19 0.44 -1.25 0.02 0.00 0.00 175.30 174.72 1k81 s PRO 139 N -0.01 4.00 -0.24 3.54 0.04 -1.26 -2.30 135.00 138.77 1k81 s PRO 139 Ca -0.00 0.48 -0.20 0.00 0.04 0.00 0.00 61.00 61.32 1k81 s PRO 139 Cb -0.08 -3.24 0.06 0.00 0.04 0.00 0.00 34.50 31.29 1k81 s PRO 139 CO 0.00 0.65 0.63 -1.50 0.04 0.00 0.00 177.00 176.83 1k81 s ILE 140 N -0.99 -0.00 0.03 0.56 2.07 -0.79 -5.03 121.20 117.05 1k81 s ILE 140 Ca 0.25 0.01 0.03 0.00 -1.41 0.00 0.00 60.65 59.52 1k81 s ILE 140 Cb -0.17 -0.88 -0.02 0.00 0.13 0.00 0.00 42.46 41.52 1k81 s ILE 140 CO 0.14 0.00 -0.08 0.00 -1.91 0.00 0.00 174.94 173.09 1k81 s ARG 141 N 0.64 0.58 0.36 3.50 1.70 -1.26 -1.89 118.95 122.57 1k81 s ARG 141 Ca -0.02 -0.62 0.00 0.00 -0.47 0.00 0.00 55.73 54.62 1k81 s ARG 141 Cb -0.05 -0.45 0.00 0.00 -0.57 0.00 0.00 34.95 33.88 1k81 s ARG 141 CO -0.04 0.10 0.00 -1.33 -1.08 0.00 0.00 175.30 172.95 1k81 n MET 142 N 1.91 -2.99 0.00 3.89 2.81 -1.26 -5.05 117.12 116.44 1k81 n MET 142 Ca -0.19 2.01 0.00 0.00 -1.81 0.00 0.00 57.70 57.70 1k81 n MET 142 Cb 0.56 -3.63 0.00 0.00 -0.71 0.00 0.00 33.22 29.43 1k81 n MET 142 CO 0.00 0.00 0.00 1.51 1.51 0.00 0.00 175.97 178.99