#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ic9 s LYS 2 N 0.00 0.20 -0.34 4.33 -2.85 -0.27 -3.66 119.74 117.15 1ic9 s LYS 2 Ca 0.00 0.24 -0.19 0.00 -1.00 0.00 0.00 55.97 55.01 1ic9 s LYS 2 Cb 0.00 0.10 -0.00 0.00 -2.06 0.00 0.00 37.83 35.86 1ic9 s LYS 2 CO 0.00 -0.02 0.59 1.52 0.10 0.00 0.00 175.35 177.53 1ic9 s TYR 3 N 0.09 3.18 -0.55 1.78 1.13 -0.26 -1.14 117.35 121.59 1ic9 s TYR 3 Ca -0.00 0.37 -0.13 0.00 -1.41 0.00 0.00 57.07 55.90 1ic9 s TYR 3 Cb -0.01 -3.01 0.14 0.00 -1.10 0.00 0.00 41.96 37.98 1ic9 s TYR 3 CO 0.00 -0.54 0.47 -2.00 -2.51 0.00 0.00 175.55 170.97 1ic9 s GLU 4 N 2.56 2.86 -0.30 -3.49 2.12 -0.70 -3.67 118.70 118.06 1ic9 s GLU 4 Ca 0.22 -1.84 0.00 0.00 0.36 0.00 0.00 54.97 53.72 1ic9 s GLU 4 Cb -0.15 -4.16 0.09 0.00 0.26 0.00 0.00 34.13 30.17 1ic9 s GLU 4 CO 0.13 -1.27 0.07 1.52 -0.54 0.00 0.00 175.26 175.17 1ic9 s TYR 5 N 1.31 2.14 -0.18 5.30 1.13 -1.04 -1.14 117.35 124.87 1ic9 s TYR 5 Ca 0.06 -1.94 -0.28 0.00 -1.41 0.00 0.00 57.07 53.51 1ic9 s TYR 5 Cb -0.26 -1.90 -0.00 0.00 -1.10 0.00 0.00 41.96 38.69 1ic9 s TYR 5 CO 0.00 -0.87 0.95 0.95 -2.51 0.00 0.00 175.55 174.08 1ic9 s THR 6 N 1.47 4.78 -2.33 -3.49 -4.23 -1.02 -2.63 115.64 108.18 1ic9 s THR 6 Ca 0.08 1.88 0.22 0.00 -1.18 0.00 0.00 61.69 62.68 1ic9 s THR 6 Cb -0.18 -4.24 0.46 0.00 1.34 0.00 0.00 72.50 69.88 1ic9 s THR 6 CO -0.19 -0.06 1.55 -0.38 -0.54 0.00 0.00 174.62 175.00 1ic9 n ILE 7 N 4.93 0.21 0.00 2.99 2.08 -1.26 -3.53 119.36 124.77 1ic9 n ILE 7 Ca 0.08 -0.37 0.00 0.00 0.56 0.00 0.00 62.75 63.02 1ic9 n ILE 7 Cb 0.48 0.46 0.00 0.00 -0.75 0.00 0.00 39.64 39.83 1ic9 n ILE 7 CO 0.00 0.00 0.00 -1.20 0.56 0.00 0.00 176.55 175.91 1ic9 n SER 9 N 0.43 0.00 -4.48 4.38 7.64 -1.26 -4.83 113.62 115.50 1ic9 n SER 9 Ca 0.17 0.00 -0.43 0.00 1.01 0.00 0.00 58.87 59.61 1ic9 n SER 9 Cb 0.36 0.00 -0.07 0.00 -1.01 0.00 0.00 64.21 63.49 1ic9 n SER 9 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 1ic9 s TYR 10 N -0.71 3.10 -0.19 1.43 6.14 -1.26 -5.03 117.35 120.83 1ic9 s TYR 10 Ca 0.00 -0.36 -0.27 0.00 0.64 0.00 0.00 57.07 57.08 1ic9 s TYR 10 Cb 0.00 -3.24 -0.01 0.00 0.42 0.00 0.00 41.96 39.14 1ic9 s TYR 10 CO 0.00 -0.86 0.91 0.99 0.64 0.00 0.00 175.55 177.23 1ic9 s THR 11 N 2.47 4.81 -0.04 4.34 2.01 -1.26 -4.26 115.64 123.71 1ic9 s THR 11 Ca 0.16 1.77 0.05 0.00 0.31 0.00 0.00 61.69 63.98 1ic9 s THR 11 Cb -0.17 -4.20 -0.03 0.00 0.01 0.00 0.00 72.50 68.11 1ic9 s THR 11 CO 0.14 -0.05 -0.17 -0.36 -0.69 0.00 0.00 174.62 173.49 1ic9 s PHE 12 N 2.57 2.63 -0.04 4.92 0.08 -1.08 -4.98 117.98 122.09 1ic9 s PHE 12 Ca 0.40 -0.21 -0.01 0.00 0.12 0.00 0.00 56.93 57.23 1ic9 s PHE 12 Cb -0.16 -1.59 0.03 0.00 -0.57 0.00 0.00 43.02 40.73 1ic9 s PHE 12 CO 0.10 0.16 0.07 1.03 -0.10 0.00 0.00 175.22 176.48 1ic9 s ARG 13 N -0.79 0.01 0.00 0.44 0.52 -1.26 -2.49 118.95 115.38 1ic9 s ARG 13 Ca 0.12 0.26 0.00 0.00 -0.52 0.00 0.00 55.73 55.58 1ic9 s ARG 13 Cb -0.10 -0.23 0.00 0.00 0.52 0.00 0.00 34.95 35.14 1ic9 s ARG 13 CO 0.01 -0.17 0.00 0.41 0.02 0.00 0.00 175.30 175.57 1ic9 n GLY 14 N 4.22 3.09 2.44 -3.53 0.00 -1.24 -5.07 105.19 105.09 1ic9 n GLY 14 Ca -0.27 -0.74 -0.32 0.00 0.00 0.00 0.00 46.02 44.69 1ic9 n GLY 14 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1ic9 n PRO 15 N 0.00 3.12 -3.67 1.61 -0.04 -1.26 -4.01 135.00 130.75 1ic9 n PRO 15 Ca 0.00 -3.87 -0.10 0.00 -0.04 0.00 0.00 63.50 59.49 1ic9 n PRO 15 Cb 0.00 -2.27 -0.05 0.00 -0.04 0.00 0.00 33.50 31.14 1ic9 n PRO 15 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1ic9 s GLY 16 N -2.50 -0.22 -0.38 0.55 0.00 -1.24 -4.82 107.32 98.71 1ic9 s GLY 16 Ca 0.54 -0.10 0.01 0.00 0.00 0.00 0.00 44.72 45.18 1ic9 s GLY 16 CO -0.14 -0.35 0.25 0.00 0.00 0.00 0.00 173.10 172.86 1ic9 s PRO 18 N 0.72 1.43 -0.04 0.00 0.04 -1.26 -5.03 135.00 130.87 1ic9 s PRO 18 Ca 0.22 -0.07 -0.30 0.00 0.04 0.00 0.00 61.00 60.90 1ic9 s PRO 18 Cb -0.15 -1.91 -0.03 0.00 0.04 0.00 0.00 34.50 32.45 1ic9 s PRO 18 CO -0.05 -1.93 1.12 0.95 0.04 0.00 0.00 177.00 177.13 1ic9 s THR 19 N -3.67 4.44 -0.01 1.26 -4.23 -1.26 -5.04 115.64 107.12 1ic9 s THR 19 Ca 0.66 1.74 0.05 0.00 -1.18 0.00 0.00 61.69 62.97 1ic9 s THR 19 Cb -0.09 -4.12 -0.01 0.00 1.34 0.00 0.00 72.50 69.62 1ic9 s THR 19 CO 0.51 0.04 -0.16 -0.76 -0.54 0.00 0.00 174.62 173.71 1ic9 s LEU 20 N 1.78 2.04 0.78 4.79 1.43 -1.26 -5.16 118.68 123.09 1ic9 s LEU 20 Ca 0.54 -0.30 -0.15 0.00 -1.03 0.00 0.00 54.13 53.19 1ic9 s LEU 20 Cb -0.23 -0.79 -0.01 0.00 0.03 0.00 0.00 46.19 45.19 1ic9 s LEU 20 CO 0.23 0.18 0.63 0.29 0.23 0.00 0.00 176.35 177.91 1ic9 n LYS 21 N 2.62 0.20 -1.98 1.70 4.76 -1.26 -4.95 118.16 119.26 1ic9 n LYS 21 Ca -0.15 0.12 -0.25 0.00 -2.87 0.00 0.00 58.31 55.16 1ic9 n LYS 21 Cb 0.55 -1.95 -0.06 0.00 -1.84 0.00 0.00 35.03 31.73 1ic9 n LYS 21 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 1ic9 s PRO 22 N -3.14 2.38 0.00 1.97 0.04 -1.26 -4.99 135.00 130.00 1ic9 s PRO 22 Ca 0.66 -0.33 0.00 0.00 0.04 0.00 0.00 61.00 61.36 1ic9 s PRO 22 Cb -0.32 -5.05 0.00 0.00 0.04 0.00 0.00 34.50 29.17 1ic9 s PRO 22 CO 0.58 -3.68 0.00 -0.89 0.04 0.00 0.00 177.00 173.05 1ic9 n ILE 24 N 8.02 0.00 -2.86 0.56 5.41 -1.26 -5.25 119.36 123.98 1ic9 n ILE 24 Ca 0.42 0.00 -0.43 0.00 1.00 0.00 0.00 62.75 63.74 1ic9 n ILE 24 Cb 0.46 0.00 -0.04 0.00 -0.71 0.00 0.00 39.64 39.35 1ic9 n ILE 24 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 176.55 176.83 1ic9 s THR 25 N -0.10 4.35 -0.22 1.39 -1.32 -1.23 -4.99 115.64 113.51 1ic9 s THR 25 Ca 0.00 -0.23 -0.06 0.00 -1.21 0.00 0.00 61.69 60.19 1ic9 s THR 25 Cb 0.00 -4.64 -0.03 0.00 -1.51 0.00 0.00 72.50 66.32 1ic9 s THR 25 CO 0.00 -1.36 0.03 -0.69 -2.21 0.00 0.00 174.62 170.39 1ic9 s VAL 26 N 4.00 4.10 -0.63 5.08 1.01 -1.26 -2.44 120.40 130.25 1ic9 s VAL 26 Ca 0.24 -0.25 -0.06 0.00 0.00 0.00 0.00 61.98 61.91 1ic9 s VAL 26 Cb -0.16 -2.88 0.16 0.00 0.00 0.00 0.00 36.38 33.50 1ic9 s VAL 26 CO 0.12 0.39 0.47 -0.13 0.00 0.00 0.00 175.10 175.95 1ic9 s ARG 27 N 1.29 2.70 0.01 2.72 0.52 -0.29 -4.97 118.95 120.92 1ic9 s ARG 27 Ca 0.04 -2.37 -0.30 0.00 -0.52 0.00 0.00 55.73 52.58 1ic9 s ARG 27 Cb -0.15 -3.87 -0.03 0.00 0.52 0.00 0.00 34.95 31.42 1ic9 s ARG 27 CO 0.02 -1.19 1.01 0.00 0.02 0.00 0.00 175.30 175.16