#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1cix n SER 2 N 0.00 -1.58 -1.89 7.72 2.88 -1.26 -4.94 113.62 114.55 1cix n SER 2 Ca 0.00 -2.67 -0.03 0.00 -1.33 0.00 0.00 58.87 54.83 1cix n SER 2 Cb 0.00 0.39 0.05 0.00 -0.75 0.00 0.00 64.21 63.90 1cix n SER 2 CO 0.00 0.00 0.00 -2.11 -1.23 0.00 0.00 175.04 171.70 1cix n ARG 3 N 2.57 0.72 -3.04 -1.46 1.85 -1.26 -5.14 116.66 110.90 1cix n ARG 3 Ca 0.23 -0.95 -0.06 0.00 -1.00 0.00 0.00 57.85 56.07 1cix n ARG 3 Cb 0.53 0.41 0.02 0.00 -1.05 0.00 0.00 32.46 32.37 1cix n ARG 3 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1cix s GLN 5 N -2.06 2.24 0.82 0.00 -1.52 -1.26 -4.96 119.66 112.92 1cix s GLN 5 Ca 0.12 -1.86 -0.11 0.00 -1.95 0.00 0.00 55.36 51.56 1cix s GLN 5 Cb -0.04 -2.40 0.12 0.00 -0.22 0.00 0.00 33.01 30.47 1cix s GLN 5 CO 0.08 -0.83 1.16 -0.48 -0.25 0.00 0.00 175.29 174.98 1cix s LEU 6 N -4.54 2.69 0.17 2.90 2.34 -1.26 -4.49 118.68 116.49 1cix s LEU 6 Ca 0.50 0.44 -0.28 0.00 0.06 0.00 0.00 54.13 54.84 1cix s LEU 6 Cb -0.04 -2.82 -0.08 0.00 -0.56 0.00 0.00 46.19 42.69 1cix s LEU 6 CO 0.31 -2.08 0.88 -1.58 -1.06 0.00 0.00 176.35 172.83 1cix s GLN 7 N -5.55 4.71 0.00 1.48 -0.44 -1.26 -4.57 119.66 114.03 1cix s GLN 7 Ca 0.66 1.34 0.00 0.00 -2.50 0.00 0.00 55.36 54.86 1cix s GLN 7 Cb -0.08 -3.30 0.00 0.00 -1.64 0.00 0.00 33.01 27.99 1cix s GLN 7 CO 0.49 0.45 0.00 0.41 0.50 0.00 0.00 175.29 177.14 1cix n GLY 8 N 1.76 0.57 0.00 2.59 0.00 -0.74 -4.99 105.19 104.39 1cix n GLY 8 Ca -0.02 -0.61 0.00 0.00 0.00 0.00 0.00 46.02 45.38 1cix n GLY 8 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1cix n PHE 9 N -0.13 0.00 -4.14 1.61 -0.00 -1.23 -4.92 117.46 108.65 1cix n PHE 9 Ca 0.00 0.00 -0.35 0.00 -0.00 0.00 0.00 57.45 57.10 1cix n PHE 9 Cb 0.05 0.00 -0.09 0.00 -0.00 0.00 0.00 39.48 39.43 1cix n PHE 9 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.76 177.30 1cix s ASN 10 N 1.81 5.55 0.08 -2.13 2.20 -1.26 -1.77 114.94 119.41 1cix s ASN 10 Ca 0.00 0.14 0.04 0.00 -0.94 0.00 0.00 52.86 52.11 1cix s ASN 10 Cb 0.00 -1.81 -0.03 0.00 -2.00 0.00 0.00 41.25 37.41 1cix s ASN 10 CO 0.00 0.28 -0.12 0.00 -2.94 0.00 0.00 177.10 174.31 1cix s VAL 12 N -1.57 5.15 -0.86 0.00 1.01 -1.26 -1.55 120.40 121.32 1cix s VAL 12 Ca -0.01 0.32 0.17 0.00 0.00 0.00 0.00 61.98 62.45 1cix s VAL 12 Cb -0.08 -3.62 0.71 0.00 0.00 0.00 0.00 36.38 33.39 1cix s VAL 12 CO 0.02 0.26 1.63 1.33 0.00 0.00 0.00 175.10 178.33 1cix n VAL 13 N 0.79 2.04 -1.76 2.92 0.24 -1.26 -4.19 118.33 117.11 1cix n VAL 13 Ca -0.08 -1.29 0.00 0.00 -2.04 0.00 0.00 64.34 60.93 1cix n VAL 13 Cb 0.52 0.03 0.00 0.00 -1.47 0.00 0.00 33.84 32.92 1cix n VAL 13 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1cix n ARG 14 N 0.87 0.00 -0.46 7.34 1.74 -1.26 -4.86 116.66 120.03 1cix n ARG 14 Ca 0.25 -0.85 0.42 0.00 -0.77 0.00 0.00 57.85 56.91 1cix n ARG 14 Cb 0.94 -0.48 0.77 0.00 -1.02 0.00 0.00 32.46 32.67 1cix n ARG 14 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1cix h SER 15 N 0.00 0.00 -0.58 0.55 4.64 -1.91 -3.38 113.55 112.87 1cix h SER 15 Ca 0.00 0.00 -0.43 0.00 -0.47 0.00 0.00 61.79 60.89 1cix h SER 15 Cb 1.29 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.33 1cix h SER 15 CO 0.00 0.00 1.62 -1.22 -0.87 0.00 0.00 176.83 176.36 1cix n TYR 16 N -4.03 0.85 0.00 4.77 4.02 -1.26 -1.00 117.16 120.51 1cix n TYR 16 Ca 0.32 0.22 0.00 0.00 -0.01 0.00 0.00 57.90 58.43 1cix n TYR 16 Cb 1.54 -2.29 0.00 0.00 -0.02 0.00 0.00 39.34 38.57 1cix n TYR 16 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1cix n GLY 17 N 6.25 3.71 3.87 2.72 0.00 -1.26 -5.10 105.19 115.37 1cix n GLY 17 Ca 0.55 -0.59 -0.30 0.00 0.00 0.00 0.00 46.02 45.68 1cix n GLY 17 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1cix s LEU 18 N 0.00 4.14 -0.35 0.99 1.02 -0.17 -5.05 118.68 119.26 1cix s LEU 18 Ca 0.00 0.14 -0.29 0.00 0.02 0.00 0.00 54.13 54.00 1cix s LEU 18 Cb 0.00 -2.77 0.01 0.00 0.02 0.00 0.00 46.19 43.45 1cix s LEU 18 CO 0.00 0.15 1.25 -2.16 0.02 0.00 0.00 176.35 175.61 1cix s PRO 19 N -2.58 3.87 0.06 1.29 0.04 -1.26 -4.89 135.00 131.52 1cix s PRO 19 Ca 0.33 1.06 -0.01 0.00 0.04 0.00 0.00 61.00 62.42 1cix s PRO 19 Cb -0.12 -3.88 -0.04 0.00 0.04 0.00 0.00 34.50 30.50 1cix s PRO 19 CO 0.26 -1.18 -0.01 0.99 0.04 0.00 0.00 177.00 177.09 1cix s THR 20 N 4.39 0.20 -0.42 1.26 2.01 -1.26 -5.12 115.64 116.70 1cix s THR 20 Ca 0.53 -1.82 -0.16 0.00 0.31 0.00 0.00 61.69 60.55 1cix s THR 20 Cb -0.14 -1.60 0.02 0.00 0.01 0.00 0.00 72.50 70.80 1cix s THR 20 CO 0.24 -0.92 0.38 -0.63 -0.69 0.00 0.00 174.62 173.01 1cix s ILE 21 N -3.94 5.16 0.66 1.82 1.09 -1.26 -5.06 121.20 119.67 1cix s ILE 21 Ca 0.10 -0.50 -0.11 0.00 -1.10 0.00 0.00 60.65 59.03 1cix s ILE 21 Cb 0.08 -4.00 -0.01 0.00 -1.06 0.00 0.00 42.46 37.47 1cix s ILE 21 CO -0.08 -0.39 1.05 -2.16 -0.10 0.00 0.00 174.94 173.26 1cix s PRO 22 N 1.94 3.24 0.64 2.79 0.04 -1.26 -4.87 135.00 137.52 1cix s PRO 22 Ca 0.09 0.84 -0.09 0.00 0.04 0.00 0.00 61.00 61.89 1cix s PRO 22 Cb -0.18 -2.03 0.14 0.00 0.04 0.00 0.00 34.50 32.46 1cix s PRO 22 CO 0.12 -0.85 0.31 0.00 0.04 0.00 0.00 177.00 176.61 1cix n ARG 25 N -2.94 2.71 0.00 0.00 0.63 -1.26 -2.28 116.66 113.52 1cix n ARG 25 Ca 0.07 0.96 0.00 0.00 -0.92 0.00 0.00 57.85 57.97 1cix n ARG 25 Cb 0.60 -2.75 0.00 0.00 0.45 0.00 0.00 32.46 30.76 1cix n ARG 25 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1cix n GLY 26 N 2.11 0.53 3.73 5.14 0.00 -1.26 -5.08 105.19 110.36 1cix n GLY 26 Ca 0.08 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.85 1cix n GLY 26 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1cix s LEU 27 N 0.00 3.05 0.17 0.99 1.02 -0.97 -3.83 118.68 119.11 1cix s LEU 27 Ca 0.00 -1.13 -0.14 0.00 0.02 0.00 0.00 54.13 52.88 1cix s LEU 27 Cb 0.00 -1.35 0.02 0.00 0.02 0.00 0.00 46.19 44.87 1cix s LEU 27 CO 0.00 -0.56 0.41 -0.89 0.02 0.00 0.00 176.35 175.33 1cix s THR 28 N -2.63 0.05 -0.12 5.49 2.01 -0.89 -4.72 115.64 114.84 1cix s THR 28 Ca 0.39 -0.94 -0.03 0.00 0.31 0.00 0.00 61.69 61.42 1cix s THR 28 Cb 0.04 -1.56 -0.03 0.00 0.01 0.00 0.00 72.50 70.96 1cix s THR 28 CO 0.21 -0.24 0.00 0.00 -0.69 0.00 0.00 174.62 173.91 1cix s ARG 30 N -0.34 1.66 0.35 0.00 0.52 -0.80 -4.90 118.95 115.44 1cix s ARG 30 Ca 0.07 -0.92 -0.28 0.00 -0.52 0.00 0.00 55.73 54.07 1cix s ARG 30 Cb -0.12 -2.51 -0.10 0.00 0.52 0.00 0.00 34.95 32.73 1cix s ARG 30 CO 0.02 -0.56 1.32 -1.54 0.02 0.00 0.00 175.30 174.56 1cix s SER 31 N 1.42 6.67 0.04 0.23 1.04 -1.26 -1.23 113.70 120.60 1cix s SER 31 Ca -0.05 2.71 -0.21 0.00 0.48 0.00 0.00 55.95 58.89 1cix s SER 31 Cb -0.18 -2.65 -0.11 0.00 0.10 0.00 0.00 66.02 63.18 1cix s SER 31 CO -0.07 -0.61 1.32 1.88 0.98 0.00 0.00 173.24 176.74 1cix h TYR 32 N 3.24 -0.76 -2.24 5.02 0.05 -1.78 -3.44 116.97 117.05 1cix h TYR 32 Ca -0.49 -0.01 -0.53 0.00 0.05 0.00 0.00 58.73 57.76 1cix h TYR 32 Cb 1.23 0.27 -0.06 0.00 1.01 0.00 0.00 36.73 39.18 1cix h TYR 32 CO 0.55 -0.42 -0.57 -0.06 -1.05 0.00 0.00 178.16 176.62 1cix s PHE 33 N -4.66 2.98 -1.29 4.88 0.08 -1.26 -5.03 117.98 113.69 1cix s PHE 33 Ca -0.11 -0.14 -0.18 0.00 0.12 0.00 0.00 56.93 56.62 1cix s PHE 33 Cb 0.02 -1.34 0.04 0.00 -0.57 0.00 0.00 43.02 41.16 1cix s PHE 33 CO 0.34 0.55 1.81 -0.35 -0.10 0.00 0.00 175.22 177.47 1cix n PRO 34 N -1.02 2.92 0.00 0.24 -0.04 -1.26 -3.12 135.00 132.71 1cix n PRO 34 Ca -0.08 -3.08 0.00 0.00 -0.04 0.00 0.00 63.50 60.30 1cix n PRO 34 Cb 0.58 -3.50 0.00 0.00 -0.04 0.00 0.00 33.50 30.54 1cix n PRO 34 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1cix n GLY 35 N 5.32 0.65 3.04 0.55 0.00 -1.26 -5.14 105.19 108.35 1cix n GLY 35 Ca 0.49 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 46.24 1cix n GLY 35 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1cix n SER 36 N 0.00 -2.35 -1.96 1.61 2.88 -1.18 -4.98 113.62 107.63 1cix n SER 36 Ca 0.00 -1.03 -0.14 0.00 -1.33 0.00 0.00 58.87 56.37 1cix n SER 36 Cb 0.00 -0.89 0.05 0.00 -0.75 0.00 0.00 64.21 62.63 1cix n SER 36 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 1cix n THR 37 N -4.77 2.14 -3.64 2.46 -1.04 -1.26 -4.98 114.28 103.19 1cix n THR 37 Ca 0.13 -3.70 -0.15 0.00 -2.04 0.00 0.00 64.05 58.29 1cix n THR 37 Cb 0.52 -0.45 -0.08 0.00 -1.82 0.00 0.00 70.33 68.50 1cix n THR 37 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 1cix s TYR 38 N -3.44 -0.55 0.00 -1.42 2.02 -1.26 -4.43 117.35 108.27 1cix s TYR 38 Ca 0.44 1.13 0.00 0.00 -0.37 0.00 0.00 57.07 58.27 1cix s TYR 38 Cb 0.39 0.26 0.00 0.00 -0.40 0.00 0.00 41.96 42.21 1cix s TYR 38 CO 0.00 -0.43 0.00 0.41 -1.57 0.00 0.00 175.55 173.96 1cix n GLY 39 N 1.78 4.64 2.90 0.71 0.00 -0.60 -2.27 105.19 112.35 1cix n GLY 39 Ca -0.17 -1.04 -0.11 0.00 0.00 0.00 0.00 46.02 44.70 1cix n GLY 39 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1cix s ARG 40 N 1.59 0.10 0.20 1.61 3.52 -0.37 -2.90 118.95 122.69 1cix s ARG 40 Ca 0.00 -0.17 -0.25 0.00 -0.13 0.00 0.00 55.73 55.18 1cix s ARG 40 Cb 0.00 0.02 -0.08 0.00 -1.56 0.00 0.00 34.95 33.33 1cix s ARG 40 CO 0.00 -0.01 0.80 0.00 -0.81 0.00 0.00 175.30 175.28 1cix n GLN 42 N 1.34 0.31 -1.56 0.00 7.27 -0.81 -1.79 117.38 122.14 1cix n GLN 42 Ca -0.04 -1.24 -0.30 0.00 0.07 0.00 0.00 57.00 55.49 1cix n GLN 42 Cb 0.49 1.20 -0.03 0.00 2.41 0.00 0.00 30.24 34.31 1cix n GLN 42 CO 0.00 0.00 0.00 -2.13 0.07 0.00 0.00 177.06 175.00 1cix n ARG 43 N -0.26 2.46 -0.31 3.69 0.63 -1.26 -2.10 116.66 119.51 1cix n ARG 43 Ca 0.00 -2.62 0.00 0.00 -0.92 0.00 0.00 57.85 54.31 1cix n ARG 43 Cb 0.26 -2.15 0.00 0.00 0.45 0.00 0.00 32.46 31.02 1cix n ARG 43 CO 0.00 0.00 0.00 0.98 -2.51 0.00 0.00 177.63 176.10