#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yiu s ALA 2 N 0.00 3.41 -0.13 4.61 0.00 -1.26 -5.09 121.76 123.30 1yiu s ALA 2 Ca 0.00 -0.94 -0.07 0.00 0.00 0.00 0.00 51.96 50.95 1yiu s ALA 2 Cb 0.00 -2.16 -0.04 0.00 0.00 0.00 0.00 23.12 20.92 1yiu s ALA 2 CO 0.00 -0.22 0.11 -1.64 0.00 0.00 0.00 175.76 174.02 1yiu s MET 3 N 1.11 3.54 0.00 0.00 1.00 -1.26 -4.93 119.30 118.77 1yiu s MET 3 Ca 0.06 -0.20 0.00 0.00 0.00 0.00 0.00 55.69 55.54 1yiu s MET 3 Cb -0.14 -3.17 0.00 0.00 0.00 0.00 0.00 34.83 31.52 1yiu s MET 3 CO 0.04 0.65 0.00 0.41 0.00 0.00 0.00 175.02 176.12 1yiu n GLY 4 N 2.39 0.15 0.00 -0.03 0.00 -1.26 -5.03 105.19 101.41 1yiu n GLY 4 Ca -0.19 -1.48 0.00 0.00 0.00 0.00 0.00 46.02 44.35 1yiu n GLY 4 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1yiu n PRO 5 N 0.00 1.42 -0.65 1.61 -0.02 -1.26 -5.02 135.00 131.09 1yiu n PRO 5 Ca 0.00 0.00 -0.31 0.00 -2.02 0.00 0.00 63.50 61.17 1yiu n PRO 5 Cb 0.00 0.00 0.18 0.00 -0.02 0.00 0.00 33.50 33.66 1yiu n PRO 5 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1yiu n LEU 6 N 0.00 0.12 -4.74 2.45 7.99 -1.26 -4.95 117.00 116.61 1yiu n LEU 6 Ca 0.00 0.14 -0.36 0.00 -0.01 0.00 0.00 56.01 55.78 1yiu n LEU 6 Cb 0.00 -1.26 0.06 0.00 -0.11 0.00 0.00 43.42 42.12 1yiu n LEU 6 CO 0.00 -3.00 0.86 -2.84 -1.51 0.00 0.00 177.39 170.90 1yiu s PRO 7 N -4.11 2.58 -0.98 3.23 0.02 -1.26 -4.69 135.00 129.78 1yiu s PRO 7 Ca 0.63 1.91 -0.27 0.00 0.02 0.00 0.00 61.00 63.29 1yiu s PRO 7 Cb -0.21 -1.87 -0.24 0.00 0.02 0.00 0.00 34.50 32.20 1yiu s PRO 7 CO 0.64 -1.54 2.56 -2.30 -0.33 0.00 0.00 177.00 176.03 1yiu n PRO 8 N -2.02 0.00 0.00 5.54 -0.02 -1.26 0.62 135.00 137.86 1yiu n PRO 8 Ca 0.15 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.63 1yiu n PRO 8 Cb 0.49 -1.39 0.00 0.00 -0.02 0.00 0.00 33.50 32.58 1yiu n PRO 8 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1yiu n GLY 9 N 6.23 2.16 3.94 -1.23 0.00 -1.26 -4.97 105.19 110.05 1yiu n GLY 9 Ca 0.65 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.42 1yiu n GLY 9 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1yiu s TRP 10 N -2.31 3.00 -0.04 1.61 0.52 0.20 0.66 118.94 122.59 1yiu s TRP 10 Ca 0.00 0.39 -0.30 0.00 0.02 0.00 0.00 56.10 56.22 1yiu s TRP 10 Cb 0.00 -2.96 0.08 0.00 -1.15 0.00 0.00 33.47 29.44 1yiu s TRP 10 CO 0.00 -1.12 0.74 -2.00 0.02 0.00 0.00 176.95 174.59 1yiu s GLU 11 N -5.06 0.99 -0.57 4.98 2.12 0.10 -4.63 118.70 116.62 1yiu s GLU 11 Ca 0.58 0.11 -0.19 0.00 0.36 0.00 0.00 54.97 55.83 1yiu s GLU 11 Cb -0.11 0.46 0.10 0.00 0.26 0.00 0.00 34.13 34.85 1yiu s GLU 11 CO 0.43 -0.33 0.67 0.15 -0.54 0.00 0.00 175.26 175.64 1yiu s LYS 12 N -1.62 3.04 0.27 4.30 1.02 -1.26 -0.36 119.74 125.14 1yiu s LYS 12 Ca -0.07 -1.32 0.07 0.00 0.02 0.00 0.00 55.97 54.68 1yiu s LYS 12 Cb -0.00 -4.25 -0.03 0.00 -0.52 0.00 0.00 37.83 33.02 1yiu s LYS 12 CO 0.04 -1.47 0.20 1.03 -0.92 0.00 0.00 175.35 174.23 1yiu s ARG 13 N 2.54 2.83 -0.11 1.68 0.52 0.67 -4.93 118.95 122.16 1yiu s ARG 13 Ca 0.11 -1.14 -0.04 0.00 -0.52 0.00 0.00 55.73 54.14 1yiu s ARG 13 Cb -0.24 -2.51 -0.04 0.00 0.52 0.00 0.00 34.95 32.68 1yiu s ARG 13 CO 0.06 0.34 0.05 0.95 0.02 0.00 0.00 175.30 176.72 1yiu s THR 14 N -2.19 4.72 0.43 0.02 -4.23 -1.26 -0.86 115.64 112.27 1yiu s THR 14 Ca 0.34 -0.08 0.04 0.00 -1.18 0.00 0.00 61.69 60.81 1yiu s THR 14 Cb -0.07 -3.03 0.08 0.00 1.34 0.00 0.00 72.50 70.81 1yiu s THR 14 CO 0.25 0.59 0.59 -0.67 -0.54 0.00 0.00 174.62 174.83 1yiu n ASP 15 N 2.31 1.23 0.30 3.99 2.03 0.95 -4.95 116.55 122.41 1yiu n ASP 15 Ca -0.19 -1.94 -0.17 0.00 0.52 0.00 0.00 54.79 53.02 1yiu n ASP 15 Cb 0.54 -0.34 -0.08 0.00 -0.72 0.00 0.00 41.12 40.52 1yiu n ASP 15 CO 0.00 0.00 0.00 0.77 -1.92 0.00 0.00 177.20 176.05 1yiu h SER 16 N -0.10 -0.93 -0.13 1.67 4.64 -2.00 -2.57 113.55 114.14 1yiu h SER 16 Ca -0.20 0.06 -0.00 0.00 -0.47 0.00 0.00 61.79 61.18 1yiu h SER 16 Cb 0.83 0.29 -0.00 0.00 -0.31 0.00 0.00 62.40 63.21 1yiu h SER 16 CO 0.25 -0.54 0.00 -0.46 -0.87 0.00 0.00 176.83 175.21 1yiu n ASN 17 N -5.49 2.05 0.00 4.97 0.23 -1.26 -4.77 115.26 110.99 1yiu n ASN 17 Ca -0.12 -2.20 0.00 0.00 -0.53 0.00 0.00 54.58 51.73 1yiu n ASN 17 Cb 0.38 -0.54 0.00 0.00 -2.08 0.00 0.00 39.78 37.54 1yiu n ASN 17 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1yiu n GLY 18 N 0.13 0.63 3.70 4.83 0.00 -0.97 -5.04 105.19 108.47 1yiu n GLY 18 Ca 0.06 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.78 1yiu n GLY 18 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1yiu s ARG 19 N -0.22 1.34 -0.07 1.61 0.52 -1.26 -4.74 118.95 116.14 1yiu s ARG 19 Ca 0.00 1.20 0.04 0.00 -0.52 0.00 0.00 55.73 56.44 1yiu s ARG 19 Cb 0.00 -1.79 0.00 0.00 0.52 0.00 0.00 34.95 33.68 1yiu s ARG 19 CO 0.00 -2.29 -0.18 0.14 0.02 0.00 0.00 175.30 172.99 1yiu s VAL 20 N -2.78 1.54 0.26 3.52 -7.23 -1.26 -0.04 120.40 114.41 1yiu s VAL 20 Ca 0.64 -0.74 0.03 0.00 -1.81 0.00 0.00 61.98 60.09 1yiu s VAL 20 Cb -0.20 -1.35 -0.04 0.00 0.56 0.00 0.00 36.38 35.36 1yiu s VAL 20 CO 0.58 0.44 0.20 -0.72 -0.31 0.00 0.00 175.10 175.29 1yiu s TYR 21 N 0.30 1.43 -0.19 2.82 -0.85 -0.04 -4.97 117.35 115.86 1yiu s TYR 21 Ca -0.11 -1.51 -0.01 0.00 -0.52 0.00 0.00 57.07 54.92 1yiu s TYR 21 Cb -0.15 -0.63 0.00 0.00 0.38 0.00 0.00 41.96 41.56 1yiu s TYR 21 CO 0.05 -0.74 -0.13 -0.06 -1.52 0.00 0.00 175.55 173.15 1yiu s PHE 22 N -3.84 2.85 -0.02 -3.49 0.40 0.66 -0.24 117.98 114.30 1yiu s PHE 22 Ca 0.40 -1.17 0.02 0.00 -0.60 0.00 0.00 56.93 55.58 1yiu s PHE 22 Cb 0.05 -1.97 -0.03 0.00 0.51 0.00 0.00 43.02 41.57 1yiu s PHE 22 CO 0.19 -0.59 -0.06 0.54 0.70 0.00 0.00 175.22 176.00 1yiu s VAL 23 N 1.18 3.72 -0.34 -0.44 0.11 0.51 -0.32 120.40 124.82 1yiu s VAL 23 Ca 0.02 -0.65 -0.09 0.00 -2.93 0.00 0.00 61.98 58.32 1yiu s VAL 23 Cb -0.14 -2.58 0.02 0.00 -1.53 0.00 0.00 36.38 32.14 1yiu s VAL 23 CO -0.05 0.47 0.16 0.21 -3.33 0.00 0.00 175.10 172.55 1yiu s ASN 24 N -1.21 5.52 0.27 3.54 3.84 0.92 0.01 114.94 127.83 1yiu s ASN 24 Ca 0.16 -0.90 -0.01 0.00 0.21 0.00 0.00 52.86 52.32 1yiu s ASN 24 Cb -0.11 -1.97 0.38 0.00 -0.55 0.00 0.00 41.25 39.00 1yiu s ASN 24 CO 0.06 -0.31 1.78 0.45 -2.79 0.00 0.00 177.10 176.28 1yiu h HIS 25 N 8.35 0.78 0.67 0.43 3.86 -0.09 0.21 115.15 129.37 1yiu h HIS 25 Ca -0.27 -0.11 -0.03 0.00 -1.16 0.00 0.00 60.37 58.80 1yiu h HIS 25 Cb 1.11 -0.22 0.01 0.00 1.06 0.00 0.00 27.41 29.37 1yiu h HIS 25 CO 0.59 0.74 -0.32 -0.91 0.86 0.00 0.00 177.93 178.89 1yiu h ASN 26 N 0.69 -0.77 -0.48 2.45 4.21 -1.94 -3.29 115.58 116.46 1yiu h ASN 26 Ca 0.14 0.03 0.00 0.00 1.21 0.00 0.00 56.30 57.67 1yiu h ASN 26 Cb 0.44 0.20 0.00 0.00 -1.12 0.00 0.00 38.32 37.84 1yiu h ASN 26 CO 0.02 -0.51 0.00 1.07 -1.29 0.00 0.00 177.43 176.72 1yiu n THR 27 N -4.65 0.81 -3.50 2.81 5.66 -1.25 -4.98 114.28 109.19 1yiu n THR 27 Ca -0.11 -0.91 -0.20 0.00 -3.05 0.00 0.00 64.05 59.78 1yiu n THR 27 Cb 0.36 0.67 0.09 0.00 -1.55 0.00 0.00 70.33 69.89 1yiu n THR 27 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 1yiu n ARG 28 N 1.19 -7.23 -3.62 1.09 5.12 0.71 -4.99 116.66 108.94 1yiu n ARG 28 Ca 0.18 0.84 -0.37 0.00 -1.93 0.00 0.00 57.85 56.57 1yiu n ARG 28 Cb 0.53 -5.87 -0.07 0.00 -1.16 0.00 0.00 32.46 25.90 1yiu n ARG 28 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 1yiu s ILE 29 N -3.34 5.30 -0.22 0.55 -1.09 -1.02 -4.87 121.20 116.51 1yiu s ILE 29 Ca 0.26 0.51 -0.05 0.00 -2.23 0.00 0.00 60.65 59.14 1yiu s ILE 29 Cb -0.11 -3.59 -0.02 0.00 -1.58 0.00 0.00 42.46 37.16 1yiu s ILE 29 CO 0.73 0.48 0.01 -0.89 -1.23 0.00 0.00 174.94 174.04 1yiu s THR 30 N -0.19 3.97 0.14 2.92 2.01 -1.26 -0.06 115.64 123.17 1yiu s THR 30 Ca 0.17 -0.30 0.07 0.00 0.31 0.00 0.00 61.69 61.94 1yiu s THR 30 Cb -0.13 -2.81 -0.04 0.00 0.01 0.00 0.00 72.50 69.52 1yiu s THR 30 CO 0.05 0.40 -0.17 -1.58 -0.69 0.00 0.00 174.62 172.64 1yiu s GLN 31 N 1.23 1.13 -0.22 4.92 0.74 0.57 -5.01 119.66 123.02 1yiu s GLN 31 Ca 0.04 -1.29 0.11 0.00 0.05 0.00 0.00 55.36 54.26 1yiu s GLN 31 Cb -0.15 -1.13 -0.22 0.00 1.10 0.00 0.00 33.01 32.61 1yiu s GLN 31 CO 0.01 0.23 -0.04 1.87 -0.55 0.00 0.00 175.29 176.82 1yiu n TRP 32 N 0.53 0.04 -3.15 1.67 -0.00 -1.26 -0.24 117.44 115.02 1yiu n TRP 32 Ca -0.15 0.01 -0.31 0.00 -0.00 0.00 0.00 57.50 57.05 1yiu n TRP 32 Cb 0.56 -1.01 -0.05 0.00 -0.00 0.00 0.00 31.31 30.82 1yiu n TRP 32 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 177.69 176.48 1yiu s GLU 33 N -2.51 3.83 -0.07 5.87 2.02 -1.26 -4.68 118.70 121.90 1yiu s GLU 33 Ca -0.20 0.41 -0.30 0.00 0.02 0.00 0.00 54.97 54.89 1yiu s GLU 33 Cb 0.07 -2.51 -0.04 0.00 0.10 0.00 0.00 34.13 31.75 1yiu s GLU 33 CO 0.73 0.15 1.45 0.34 0.02 0.00 0.00 175.26 177.95 1yiu s ASP 34 N -2.70 6.81 0.45 -0.19 -1.08 -1.26 -4.81 116.67 113.89 1yiu s ASP 34 Ca 0.50 2.03 0.30 0.00 -0.52 0.00 0.00 52.55 54.86 1yiu s ASP 34 Cb -0.11 -2.54 1.19 0.00 -1.46 0.00 0.00 42.92 40.01 1yiu s ASP 34 CO 0.24 -0.81 1.88 -0.65 0.52 0.00 0.00 175.17 176.36 1yiu h PRO 35 N 8.55 0.00 -3.02 4.34 0.11 -1.98 -3.37 132.00 136.63 1yiu h PRO 35 Ca -0.35 0.00 -0.77 0.00 0.11 0.00 0.00 66.00 64.99 1yiu h PRO 35 Cb 1.16 0.00 -0.19 0.00 0.11 0.00 0.00 31.00 32.08 1yiu h PRO 35 CO 0.94 0.00 1.73 0.54 -0.21 0.00 0.00 178.00 181.00 1yiu n ARG 36 N -2.83 4.25 0.00 1.05 1.74 -1.26 -5.00 116.66 114.61 1yiu n ARG 36 Ca 0.01 -3.87 0.08 0.00 -0.77 0.00 0.00 57.85 53.30 1yiu n ARG 36 Cb 0.30 -2.71 0.07 0.00 -1.02 0.00 0.00 32.46 29.09 1yiu n ARG 36 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98