#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wr7 h SER 2 N 0.00 -0.68 0.00 1.61 0.02 -2.08 -1.58 113.55 110.84 1wr7 h SER 2 Ca 0.00 0.17 0.00 0.00 -0.84 0.00 0.00 61.79 61.12 1wr7 h SER 2 Cb 0.00 0.39 0.00 0.00 0.14 0.00 0.00 62.40 62.93 1wr7 h SER 2 CO 0.00 -0.23 0.13 -0.65 -1.14 0.00 0.00 176.83 174.95 1wr7 h PRO 3 N -0.08 0.00 0.00 3.45 0.11 -2.12 -3.44 132.00 129.92 1wr7 h PRO 3 Ca 0.24 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.35 1wr7 h PRO 3 Cb 0.45 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.56 1wr7 h PRO 3 CO -0.56 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 177.64 1wr7 n GLY 4 N -1.28 0.83 3.56 -0.55 0.00 -0.59 -5.02 105.19 102.13 1wr7 n GLY 4 Ca -0.01 -0.09 -0.40 0.00 0.00 0.00 0.00 46.02 45.52 1wr7 n GLY 4 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1wr7 s ILE 5 N -2.00 3.55 -0.17 -0.61 -4.36 -1.26 -4.95 121.20 111.40 1wr7 s ILE 5 Ca 0.00 0.36 -0.29 0.00 -0.26 0.00 0.00 60.65 60.46 1wr7 s ILE 5 Cb 0.00 -4.32 -0.04 0.00 1.25 0.00 0.00 42.46 39.36 1wr7 s ILE 5 CO 0.00 -1.23 1.65 -1.10 0.24 0.00 0.00 174.94 174.51 1wr7 s GLN 6 N 6.31 3.88 -1.23 0.37 1.11 -1.26 -4.46 119.66 124.38 1wr7 s GLN 6 Ca 0.55 1.83 -0.18 0.00 0.01 0.00 0.00 55.36 57.58 1wr7 s GLN 6 Cb -0.11 -4.04 -0.01 0.00 -1.01 0.00 0.00 33.01 27.84 1wr7 s GLN 6 CO 0.20 -1.20 2.02 0.43 0.01 0.00 0.00 175.29 176.75 1wr7 n SER 7 N 8.21 3.70 0.00 5.90 7.64 -1.26 -4.62 113.62 133.19 1wr7 n SER 7 Ca 0.19 -2.80 0.00 0.00 1.01 0.00 0.00 58.87 57.26 1wr7 n SER 7 Cb 0.44 -1.56 0.00 0.00 -1.01 0.00 0.00 64.21 62.08 1wr7 n SER 7 CO 0.00 0.00 0.00 0.33 -3.01 0.00 0.00 175.04 172.36 1wr7 n PHE 8 N 7.86 0.00 -3.51 1.43 7.35 -1.26 -5.00 117.46 124.32 1wr7 n PHE 8 Ca 0.50 0.00 -0.23 0.00 -0.76 0.00 0.00 57.45 56.96 1wr7 n PHE 8 Cb 0.42 -0.15 0.02 0.00 0.35 0.00 0.00 39.48 40.13 1wr7 n PHE 8 CO 0.00 0.00 0.00 -0.51 -0.76 0.00 0.00 176.76 175.49 1wr7 s LEU 9 N -2.32 2.87 0.53 -2.13 1.02 -1.26 -5.04 118.68 112.35 1wr7 s LEU 9 Ca 0.00 -1.07 -0.21 0.00 0.02 0.00 0.00 54.13 52.87 1wr7 s LEU 9 Cb 0.00 -1.38 -0.07 0.00 0.02 0.00 0.00 46.19 44.76 1wr7 s LEU 9 CO 0.00 -1.22 0.99 -2.65 0.02 0.00 0.00 176.35 173.49 1wr7 n PRO 10 N -1.98 1.12 0.00 1.29 -0.02 -1.26 -4.82 135.00 129.32 1wr7 n PRO 10 Ca 0.06 0.42 0.00 0.00 -2.02 0.00 0.00 63.50 61.96 1wr7 n PRO 10 Cb 0.63 -2.13 0.00 0.00 -0.02 0.00 0.00 33.50 31.98 1wr7 n PRO 10 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1wr7 n PRO 11 N -0.51 0.19 0.00 0.52 -0.02 -1.26 -0.48 135.00 133.44 1wr7 n PRO 11 Ca 0.12 0.00 0.05 0.00 -2.02 0.00 0.00 63.50 61.64 1wr7 n PRO 11 Cb 0.44 -1.00 0.04 0.00 -0.02 0.00 0.00 33.50 32.96 1wr7 n PRO 11 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1wr7 n GLY 12 N -0.31 -0.48 3.59 -1.23 0.00 -1.26 -4.97 105.19 100.53 1wr7 n GLY 12 Ca 0.00 -0.28 -0.35 0.00 0.00 0.00 0.00 46.02 45.40 1wr7 n GLY 12 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1wr7 s TRP 13 N -0.82 3.20 -0.29 1.61 0.52 0.37 -0.37 118.94 123.16 1wr7 s TRP 13 Ca 0.11 -0.03 -0.02 0.00 0.02 0.00 0.00 56.10 56.18 1wr7 s TRP 13 Cb 0.08 -2.08 0.04 0.00 -1.15 0.00 0.00 33.47 30.36 1wr7 s TRP 13 CO 0.12 0.07 -0.02 -2.00 0.02 0.00 0.00 176.95 175.14 1wr7 s GLU 14 N 0.52 2.53 -0.34 4.98 2.12 0.13 -4.85 118.70 123.78 1wr7 s GLU 14 Ca 0.02 -1.19 -0.25 0.00 0.36 0.00 0.00 54.97 53.91 1wr7 s GLU 14 Cb -0.13 -3.12 0.01 0.00 0.26 0.00 0.00 34.13 31.15 1wr7 s GLU 14 CO 0.01 -0.56 0.85 0.00 -0.54 0.00 0.00 175.26 175.02 1wr7 s MET 15 N 1.27 3.87 -0.01 4.30 0.23 -1.26 -0.40 119.30 127.30 1wr7 s MET 15 Ca -0.04 0.54 0.05 0.00 -1.03 0.00 0.00 55.69 55.21 1wr7 s MET 15 Cb -0.19 -3.78 -0.03 0.00 -1.53 0.00 0.00 34.83 29.30 1wr7 s MET 15 CO -0.02 -0.83 -0.13 1.03 -2.03 0.00 0.00 175.02 173.03 1wr7 s ARG 16 N 3.21 2.39 -0.58 3.16 0.52 0.79 -4.90 118.95 123.55 1wr7 s ARG 16 Ca 0.35 -0.79 -0.20 0.00 -0.52 0.00 0.00 55.73 54.57 1wr7 s ARG 16 Cb -0.13 -2.35 0.08 0.00 0.52 0.00 0.00 34.95 33.07 1wr7 s ARG 16 CO 0.16 0.59 0.74 0.42 0.02 0.00 0.00 175.30 177.23 1wr7 s ILE 17 N -0.86 4.73 0.73 1.52 -1.09 -1.26 0.26 121.20 125.23 1wr7 s ILE 17 Ca 0.14 -0.69 -0.15 0.00 -2.23 0.00 0.00 60.65 57.71 1wr7 s ILE 17 Cb -0.11 -4.48 0.04 0.00 -1.58 0.00 0.00 42.46 36.33 1wr7 s ILE 17 CO 0.04 -1.10 1.22 0.00 -1.23 0.00 0.00 174.94 173.87 1wr7 s ALA 18 N 2.97 2.12 0.23 9.38 0.00 -0.84 -4.86 121.76 130.76 1wr7 s ALA 18 Ca 0.15 0.92 0.25 0.00 0.00 0.00 0.00 51.96 53.27 1wr7 s ALA 18 Cb -0.21 -3.48 1.34 0.00 0.00 0.00 0.00 23.12 20.77 1wr7 s ALA 18 CO 0.09 -1.88 1.72 -1.35 0.00 0.00 0.00 175.76 174.34 1wr7 h PRO 19 N -0.25 0.00 0.00 0.00 0.11 -1.96 0.17 132.00 130.07 1wr7 h PRO 19 Ca -0.48 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.61 1wr7 h PRO 19 Cb 1.30 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.41 1wr7 h PRO 19 CO 0.50 0.00 -0.11 -0.91 -0.21 0.00 0.00 178.00 177.27 1wr7 h ASN 20 N 0.00 0.00 0.00 -2.05 4.21 -2.02 -3.46 115.58 112.27 1wr7 h ASN 20 Ca 0.00 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 1wr7 h ASN 20 Cb 0.37 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.57 1wr7 h ASN 20 CO 0.00 0.11 0.00 0.61 -1.29 0.00 0.00 177.43 176.86 1wr7 n GLY 21 N -0.89 0.59 3.49 2.83 0.00 0.59 -5.08 105.19 106.73 1wr7 n GLY 21 Ca -0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.65 1wr7 n GLY 21 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1wr7 s ARG 22 N -0.80 3.70 0.09 1.61 1.81 -1.24 -4.91 118.95 119.21 1wr7 s ARG 22 Ca 0.00 -0.48 -0.31 0.00 -1.72 0.00 0.00 55.73 53.22 1wr7 s ARG 22 Cb 0.00 -3.14 -0.10 0.00 -0.45 0.00 0.00 34.95 31.26 1wr7 s ARG 22 CO 0.00 0.05 1.87 -2.30 -0.68 0.00 0.00 175.30 174.24 1wr7 n PRO 23 N 4.16 2.76 -5.20 3.54 -0.02 -1.26 -1.99 135.00 136.99 1wr7 n PRO 23 Ca -0.17 1.01 -0.30 0.00 -2.02 0.00 0.00 63.50 62.02 1wr7 n PRO 23 Cb 0.52 -2.91 -0.16 0.00 -0.02 0.00 0.00 33.50 30.93 1wr7 n PRO 23 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 1wr7 s PHE 24 N 3.18 2.24 -0.37 6.00 -0.12 0.14 -4.73 117.98 124.32 1wr7 s PHE 24 Ca 0.84 -0.55 -0.13 0.00 -0.05 0.00 0.00 56.93 57.04 1wr7 s PHE 24 Cb -0.49 -1.46 0.01 0.00 -0.63 0.00 0.00 43.02 40.45 1wr7 s PHE 24 CO 0.39 -0.13 0.25 -0.06 -0.05 0.00 0.00 175.22 175.63 1wr7 s PHE 25 N -0.34 3.23 -0.29 3.49 0.08 0.23 -0.15 117.98 124.24 1wr7 s PHE 25 Ca 0.03 -0.52 -0.11 0.00 0.12 0.00 0.00 56.93 56.44 1wr7 s PHE 25 Cb -0.11 -2.50 -0.04 0.00 -0.57 0.00 0.00 43.02 39.79 1wr7 s PHE 25 CO 0.01 -0.51 0.19 -1.50 -0.10 0.00 0.00 175.22 173.31 1wr7 s ILE 26 N 1.67 5.22 0.02 0.64 -1.16 0.46 -1.42 121.20 126.63 1wr7 s ILE 26 Ca 0.05 0.07 -0.26 0.00 -0.51 0.00 0.00 60.65 60.00 1wr7 s ILE 26 Cb -0.18 -3.52 -0.05 0.00 0.61 0.00 0.00 42.46 39.32 1wr7 s ILE 26 CO 0.09 0.21 0.83 -0.62 -2.81 0.00 0.00 174.94 172.64 1wr7 s ASP 27 N 1.74 7.24 0.00 4.50 2.15 0.44 -0.69 116.67 132.04 1wr7 s ASP 27 Ca 0.07 1.48 0.22 0.00 0.43 0.00 0.00 52.55 54.75 1wr7 s ASP 27 Cb -0.16 -2.50 0.57 0.00 -0.30 0.00 0.00 42.92 40.53 1wr7 s ASP 27 CO 0.10 -0.09 1.49 1.41 -0.17 0.00 0.00 175.17 177.91 1wr7 n HIS 28 N 3.29 0.82 -0.07 -5.34 8.25 0.50 -2.02 115.22 120.65 1wr7 n HIS 28 Ca 0.00 -0.43 -0.07 0.00 -0.26 0.00 0.00 57.72 56.97 1wr7 n HIS 28 Cb 0.50 -0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.58 1wr7 n HIS 28 CO 0.00 0.00 0.00 -0.91 0.64 0.00 0.00 176.34 176.07 1wr7 h ASN 29 N 4.25 0.00 0.09 0.41 2.35 -1.93 -3.41 115.58 117.34 1wr7 h ASN 29 Ca 0.00 -0.10 -0.12 0.00 -0.55 0.00 0.00 56.30 55.52 1wr7 h ASN 29 Cb 0.98 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.32 1wr7 h ASN 29 CO 0.00 0.83 -2.04 0.35 -1.65 0.00 0.00 177.43 174.92 1wr7 n THR 30 N -4.61 0.53 -1.58 2.81 -2.24 -1.26 -5.04 114.28 102.89 1wr7 n THR 30 Ca -0.10 -0.63 -0.00 0.00 -2.27 0.00 0.00 64.05 61.06 1wr7 n THR 30 Cb 0.29 -0.20 0.00 0.00 -2.10 0.00 0.00 70.33 68.32 1wr7 n THR 30 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1wr7 n LYS 31 N -2.47 -0.07 -4.38 -0.78 4.01 -0.86 -5.10 118.16 108.51 1wr7 n LYS 31 Ca -0.13 0.55 -0.19 0.00 -0.51 0.00 0.00 58.31 58.03 1wr7 n LYS 31 Cb 0.77 -1.73 -0.10 0.00 -0.51 0.00 0.00 35.03 33.46 1wr7 n LYS 31 CO 0.00 0.00 0.00 -0.08 -1.11 0.00 0.00 177.40 176.21 1wr7 s THR 32 N -2.95 1.20 -0.22 -0.18 -1.32 -1.09 -4.94 115.64 106.14 1wr7 s THR 32 Ca 0.00 -2.05 -0.00 0.00 -1.21 0.00 0.00 61.69 58.43 1wr7 s THR 32 Cb -0.00 -2.49 0.06 0.00 -1.51 0.00 0.00 72.50 68.56 1wr7 s THR 32 CO 0.04 -0.23 -0.02 0.42 -2.21 0.00 0.00 174.62 172.62 1wr7 s THR 33 N -3.30 1.21 0.07 5.08 -4.23 -1.26 -0.42 115.64 112.78 1wr7 s THR 33 Ca 0.31 -1.02 0.08 0.00 -1.18 0.00 0.00 61.69 59.88 1wr7 s THR 33 Cb 0.06 -1.56 -0.03 0.00 1.34 0.00 0.00 72.50 72.31 1wr7 s THR 33 CO 0.11 -0.14 -0.22 0.28 -0.54 0.00 0.00 174.62 174.11 1wr7 s THR 34 N 1.54 1.77 -0.09 3.99 -1.32 -0.51 -4.98 115.64 116.03 1wr7 s THR 34 Ca -0.04 -1.37 0.01 0.00 -1.21 0.00 0.00 61.69 59.08 1wr7 s THR 34 Cb -0.18 -1.56 -0.25 0.00 -1.51 0.00 0.00 72.50 69.00 1wr7 s THR 34 CO -0.07 0.13 0.48 0.79 -2.21 0.00 0.00 174.62 173.74 1wr7 n TRP 35 N 1.53 1.17 -2.26 9.09 7.02 -1.26 0.77 117.44 133.49 1wr7 n TRP 35 Ca -0.18 0.30 -0.43 0.00 -1.02 0.00 0.00 57.50 56.18 1wr7 n TRP 35 Cb 0.53 -1.17 -0.02 0.00 -2.42 0.00 0.00 31.31 28.22 1wr7 n TRP 35 CO 0.00 0.00 0.00 -1.21 -2.02 0.00 0.00 177.69 174.46 1wr7 s GLU 36 N -2.57 4.24 -0.10 -0.99 0.41 -1.26 -4.61 118.70 113.82 1wr7 s GLU 36 Ca -0.16 1.88 -0.29 0.00 -0.41 0.00 0.00 54.97 55.99 1wr7 s GLU 36 Cb 0.07 -3.77 -0.07 0.00 -1.78 0.00 0.00 34.13 28.58 1wr7 s GLU 36 CO 0.79 -0.70 2.04 0.34 -0.49 0.00 0.00 175.26 177.25 1wr7 s ASP 37 N 2.31 6.01 0.13 -0.19 -1.08 -1.26 -4.85 116.67 117.73 1wr7 s ASP 37 Ca 0.62 2.23 0.16 0.00 -0.52 0.00 0.00 52.55 55.04 1wr7 s ASP 37 Cb -0.27 -2.52 0.70 0.00 -1.46 0.00 0.00 42.92 39.36 1wr7 s ASP 37 CO 0.22 -1.47 1.48 -0.81 0.52 0.00 0.00 175.17 175.11 1wr7 n PRO 38 N 8.08 0.08 -0.05 4.34 -0.04 -1.26 -1.52 135.00 144.63 1wr7 n PRO 38 Ca 0.24 0.41 0.12 0.00 -0.04 0.00 0.00 63.50 64.24 1wr7 n PRO 38 Cb 0.43 -1.69 0.38 0.00 -0.04 0.00 0.00 33.50 32.58 1wr7 n PRO 38 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1wr7 n ARG 39 N -1.85 1.87 0.03 0.54 1.74 -1.26 -3.54 116.66 114.20 1wr7 n ARG 39 Ca 0.02 -1.29 0.11 0.00 -0.77 0.00 0.00 57.85 55.92 1wr7 n ARG 39 Cb 0.13 -1.45 0.47 0.00 -1.02 0.00 0.00 32.46 30.59 1wr7 n ARG 39 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1wr7 n LEU 40 N 0.53 0.21 0.00 0.55 4.77 -0.57 -5.22 117.00 117.27 1wr7 n LEU 40 Ca 0.17 0.53 0.00 0.00 -0.03 0.00 0.00 56.01 56.69 1wr7 n LEU 40 Cb 0.40 -0.48 0.00 0.00 -2.33 0.00 0.00 43.42 41.01 1wr7 n LEU 40 CO 0.15 -0.19 0.01 2.29 -1.33 0.00 0.00 177.39 178.32