#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r1f n PHE 2 N 0.00 -0.19 0.34 -1.42 7.35 -1.23 -4.68 117.46 117.63 1r1f n PHE 2 Ca 0.00 0.08 -0.13 0.00 -0.76 0.00 0.00 57.45 56.64 1r1f n PHE 2 Cb 0.00 -1.62 -0.06 0.00 0.35 0.00 0.00 39.48 38.15 1r1f n PHE 2 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1r1f n GLY 4 N -1.32 -0.44 0.00 0.00 0.00 -1.26 -4.85 105.19 97.32 1r1f n GLY 4 Ca -0.11 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.91 1r1f n GLY 4 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1r1f n GLU 5 N 0.00 1.17 -3.72 1.61 1.02 -1.26 -4.97 120.64 114.48 1r1f n GLU 5 Ca 0.00 0.00 -0.13 0.00 -0.02 0.00 0.00 57.16 57.01 1r1f n GLU 5 Cb 0.00 0.00 -0.09 0.00 -0.02 0.00 0.00 31.44 31.33 1r1f n GLU 5 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1r1f s THR 6 N 0.19 0.01 -0.45 2.62 2.01 -1.26 -3.15 115.64 115.61 1r1f s THR 6 Ca 0.00 -0.08 -0.16 0.00 0.31 0.00 0.00 61.69 61.76 1r1f s THR 6 Cb 0.00 -0.62 0.05 0.00 0.01 0.00 0.00 72.50 71.94 1r1f s THR 6 CO 0.00 -0.05 0.37 0.00 -0.69 0.00 0.00 174.62 174.25 1r1f n ARG 8 N 5.25 0.00 -0.49 0.00 5.12 -1.26 -2.94 116.66 122.34 1r1f n ARG 8 Ca -0.11 0.00 -0.05 0.00 -1.93 0.00 0.00 57.85 55.76 1r1f n ARG 8 Cb 0.45 0.00 0.12 0.00 -1.16 0.00 0.00 32.46 31.87 1r1f n ARG 8 CO 0.00 0.00 0.00 1.33 -1.93 0.00 0.00 177.63 177.03 1r1f n VAL 9 N 0.00 1.67 -2.77 1.55 0.24 -1.21 -3.59 118.33 114.22 1r1f n VAL 9 Ca 0.00 -0.76 -0.09 0.00 -2.04 0.00 0.00 64.34 61.46 1r1f n VAL 9 Cb 0.00 -0.62 0.05 0.00 -1.47 0.00 0.00 33.84 31.81 1r1f n VAL 9 CO 0.00 0.00 0.00 2.30 -2.14 0.00 0.00 176.83 176.99 1r1f n ILE 10 N -0.02 -0.03 -0.10 1.34 -5.35 -1.26 -5.15 119.36 108.79 1r1f n ILE 10 Ca 0.21 -1.62 0.00 0.00 -0.27 0.00 0.00 62.75 61.06 1r1f n ILE 10 Cb 0.88 1.36 0.00 0.00 -1.74 0.00 0.00 39.64 40.14 1r1f n ILE 10 CO 0.00 0.00 0.00 -2.65 -1.76 0.00 0.00 176.55 172.14 1r1f n PRO 11 N 1.31 0.27 -3.10 6.28 -0.02 -1.24 -4.78 135.00 133.72 1r1f n PRO 11 Ca 0.09 0.00 -0.02 0.00 -2.02 0.00 0.00 63.50 61.55 1r1f n PRO 11 Cb 0.64 0.00 0.01 0.00 -0.02 0.00 0.00 33.50 34.13 1r1f n PRO 11 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1r1f n VAL 12 N -1.31 -9.91 -1.44 -1.45 0.31 -1.26 -4.80 118.33 98.48 1r1f n VAL 12 Ca 0.00 -0.33 -0.55 0.00 -0.01 0.00 0.00 64.34 63.45 1r1f n VAL 12 Cb 0.00 -6.79 -0.09 0.00 -0.91 0.00 0.00 33.84 26.05 1r1f n VAL 12 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1r1f h THR 14 N 6.73 0.73 -0.06 0.00 2.02 -1.96 -2.15 112.91 118.22 1r1f h THR 14 Ca -0.26 -1.87 -0.04 0.00 0.77 0.00 0.00 66.41 65.01 1r1f h THR 14 Cb 1.35 2.24 -0.00 0.00 -1.74 0.00 0.00 68.15 70.00 1r1f h THR 14 CO 1.03 0.39 -0.10 0.22 0.37 0.00 0.00 175.52 177.43 1r1f h TYR 15 N 0.00 0.22 0.00 3.16 3.20 -2.01 -3.02 116.97 118.52 1r1f h TYR 15 Ca -0.00 -0.08 0.00 0.00 3.14 0.00 0.00 58.73 61.79 1r1f h TYR 15 Cb 1.21 -0.04 0.00 0.00 1.54 0.00 0.00 36.73 39.44 1r1f h TYR 15 CO 0.00 0.68 0.00 -1.13 -1.64 0.00 0.00 178.16 176.07 1r1f n SER 16 N -4.67 0.16 0.32 -2.11 3.41 -1.25 -3.44 113.62 106.04 1r1f n SER 16 Ca -0.08 0.52 0.19 0.00 -0.26 0.00 0.00 58.87 59.24 1r1f n SER 16 Cb 0.34 -0.56 1.06 0.00 -0.26 0.00 0.00 64.21 64.79 1r1f n SER 16 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1r1f h ALA 17 N 2.88 1.21 -0.81 7.33 0.00 -1.25 -1.97 119.26 126.65 1r1f h ALA 17 Ca 0.00 -0.01 0.07 0.00 0.00 0.00 0.00 54.91 54.98 1r1f h ALA 17 Cb 0.53 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.27 1r1f h ALA 17 CO 0.00 0.01 0.53 0.00 0.00 0.00 0.00 179.25 179.79 1r1f h ALA 18 N 1.99 1.65 0.00 0.00 0.00 -1.69 0.12 119.26 121.33 1r1f h ALA 18 Ca -0.00 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1r1f h ALA 18 Cb 0.04 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 1r1f h ALA 18 CO 0.00 0.21 -0.09 -0.07 0.00 0.00 0.00 179.25 179.31 1r1f h LEU 19 N 0.85 0.00 0.00 0.00 4.07 -1.64 -3.46 115.31 115.13 1r1f h LEU 19 Ca 0.36 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.32 1r1f h LEU 19 Cb 0.30 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.04 1r1f h LEU 19 CO -0.13 0.09 0.00 0.61 -1.08 0.00 0.00 178.44 177.92 1r1f n GLY 20 N 0.82 0.95 3.74 0.83 0.00 0.42 -4.92 105.19 107.04 1r1f n GLY 20 Ca 0.03 -0.06 -0.42 0.00 0.00 0.00 0.00 46.02 45.57 1r1f n GLY 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r1f s THR 22 N -0.49 1.17 0.50 0.00 -4.23 -1.04 -4.58 115.64 106.96 1r1f s THR 22 Ca 0.60 -0.59 -0.01 0.00 -1.18 0.00 0.00 61.69 60.52 1r1f s THR 22 Cb -0.52 -1.00 0.01 0.00 1.34 0.00 0.00 72.50 72.33 1r1f s THR 22 CO 0.55 0.34 0.73 0.00 -0.54 0.00 0.00 174.62 175.71 1r1f h ASP 24 N 0.23 0.35 -4.32 0.00 3.58 -1.96 -3.47 116.42 110.83 1r1f h ASP 24 Ca -0.45 -0.85 0.00 0.00 0.42 0.00 0.00 57.03 56.15 1r1f h ASP 24 Cb 1.26 -0.12 0.00 0.00 1.72 0.00 0.00 39.33 42.20 1r1f h ASP 24 CO 0.57 1.73 -0.89 -0.67 -2.88 0.00 0.00 179.24 177.10 1r1f n ASP 25 N -3.77 -8.57 -2.71 2.28 2.03 -1.26 -5.01 116.55 99.53 1r1f n ASP 25 Ca -0.30 1.28 -0.04 0.00 0.52 0.00 0.00 54.79 56.26 1r1f n ASP 25 Cb 0.95 -4.77 0.10 0.00 -0.72 0.00 0.00 41.12 36.68 1r1f n ASP 25 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1r1f n ARG 26 N 1.56 1.38 0.00 -0.67 5.12 -1.26 -4.87 116.66 117.92 1r1f n ARG 26 Ca 0.00 -2.15 0.00 0.00 -1.93 0.00 0.00 57.85 53.77 1r1f n ARG 26 Cb 0.00 -0.37 0.00 0.00 -1.16 0.00 0.00 32.46 30.93 1r1f n ARG 26 CO 0.00 0.00 0.00 0.43 -1.93 0.00 0.00 177.63 176.13 1r1f n SER 27 N -0.91 0.00 -3.65 0.55 7.64 -1.26 -4.78 113.62 111.20 1r1f n SER 27 Ca -0.05 0.00 -0.02 0.00 1.01 0.00 0.00 58.87 59.81 1r1f n SER 27 Cb 0.85 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 64.00 1r1f n SER 27 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1r1f s ASP 28 N -0.93 -0.03 0.00 6.43 2.15 -1.25 -3.36 116.67 119.69 1r1f s ASP 28 Ca 0.00 0.04 0.00 0.00 0.43 0.00 0.00 52.55 53.02 1r1f s ASP 28 Cb 0.00 0.03 0.00 0.00 -0.30 0.00 0.00 42.92 42.65 1r1f s ASP 28 CO 0.00 -0.02 0.00 0.61 -0.17 0.00 0.00 175.17 175.59 1r1f n GLY 29 N 0.84 -0.61 3.51 2.66 0.00 -1.15 -4.80 105.19 105.65 1r1f n GLY 29 Ca -0.03 0.61 0.01 0.00 0.00 0.00 0.00 46.02 46.61 1r1f n GLY 29 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1r1f s LEU 30 N 0.00 -0.32 0.26 0.99 2.96 -1.26 -4.74 118.68 116.57 1r1f s LEU 30 Ca 0.00 0.48 -0.30 0.00 -0.22 0.00 0.00 54.13 54.10 1r1f s LEU 30 Cb 0.00 1.43 -0.10 0.00 0.50 0.00 0.00 46.19 48.02 1r1f s LEU 30 CO 0.00 -0.07 1.31 0.00 -1.32 0.00 0.00 176.35 176.27 1r1f s LYS 32 N -0.84 3.48 0.00 0.00 3.01 -0.36 -0.19 119.74 124.84 1r1f s LYS 32 Ca 0.53 -0.46 0.00 0.00 -1.01 0.00 0.00 55.97 55.04 1r1f s LYS 32 Cb -0.38 -2.93 0.00 0.00 -1.01 0.00 0.00 37.83 33.51 1r1f s LYS 32 CO 0.44 0.50 0.00 -2.13 0.51 0.00 0.00 175.35 174.67 1r1f n ARG 33 N -0.39 2.86 -3.82 1.68 0.63 -1.26 -2.50 116.66 113.87 1r1f n ARG 33 Ca -0.06 0.00 -0.12 0.00 -0.92 0.00 0.00 57.85 56.75 1r1f n ARG 33 Cb 0.53 0.00 -0.10 0.00 0.45 0.00 0.00 32.46 33.34 1r1f n ARG 33 CO 0.00 0.00 0.00 -0.80 -2.51 0.00 0.00 177.63 174.32 1r1f s ASN 34 N -1.05 -0.11 0.00 6.15 -0.87 -1.26 -4.06 114.94 113.74 1r1f s ASN 34 Ca 0.00 0.07 0.00 0.00 -1.57 0.00 0.00 52.86 51.36 1r1f s ASN 34 Cb 0.00 0.31 0.00 0.00 -0.02 0.00 0.00 41.25 41.54 1r1f s ASN 34 CO 0.00 -0.30 0.00 0.61 -2.57 0.00 0.00 177.10 174.84 1r1f n GLY 35 N 1.86 1.63 2.63 0.66 0.00 -1.26 -4.17 105.19 106.53 1r1f n GLY 35 Ca -0.19 -0.18 -0.09 0.00 0.00 0.00 0.00 46.02 45.55 1r1f n GLY 35 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1r1f n ASP 36 N 2.23 0.68 0.00 1.61 5.75 -1.26 -5.08 116.55 120.47 1r1f n ASP 36 Ca 0.00 -2.71 0.00 0.00 -0.01 0.00 0.00 54.79 52.07 1r1f n ASP 36 Cb 0.00 -0.19 0.00 0.00 -1.03 0.00 0.00 41.12 39.90 1r1f n ASP 36 CO 0.00 0.00 0.00 -2.65 -0.11 0.00 0.00 177.20 174.44