#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wr4 h SER 2 N 0.00 0.00 -2.74 1.61 0.02 -2.12 -3.44 113.55 106.88 1wr4 h SER 2 Ca 0.00 -0.71 -0.56 0.00 -0.84 0.00 0.00 61.79 59.68 1wr4 h SER 2 Cb 0.00 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.52 1wr4 h SER 2 CO 0.00 1.08 1.11 -2.84 -1.14 0.00 0.00 176.83 175.03 1wr4 s PRO 3 N -2.19 3.90 0.00 3.45 0.02 -1.26 -4.99 135.00 133.93 1wr4 s PRO 3 Ca -0.20 1.77 0.00 0.00 0.02 0.00 0.00 61.00 62.60 1wr4 s PRO 3 Cb 0.00 -4.01 0.00 0.00 0.02 0.00 0.00 34.50 30.51 1wr4 s PRO 3 CO 0.57 -1.17 0.00 0.41 -0.33 0.00 0.00 177.00 176.48 1wr4 n GLY 4 N 4.48 0.99 3.50 0.52 0.00 -1.26 -5.11 105.19 108.30 1wr4 n GLY 4 Ca 0.18 -1.05 -0.23 0.00 0.00 0.00 0.00 46.02 44.92 1wr4 n GLY 4 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wr4 s LEU 5 N 0.00 2.50 1.03 0.99 1.43 -1.26 -5.07 118.68 118.30 1wr4 s LEU 5 Ca 0.00 -1.30 -0.13 0.00 -1.03 0.00 0.00 54.13 51.67 1wr4 s LEU 5 Cb 0.00 -0.65 0.15 0.00 0.03 0.00 0.00 46.19 45.72 1wr4 s LEU 5 CO 0.00 -0.45 0.72 -2.65 0.23 0.00 0.00 176.35 174.20 1wr4 n PRO 6 N -0.74 -1.17 0.00 1.29 -0.02 -1.26 -4.87 135.00 128.24 1wr4 n PRO 6 Ca -0.04 -0.30 0.05 0.00 -2.02 0.00 0.00 63.50 61.19 1wr4 n PRO 6 Cb 0.65 -2.07 0.22 0.00 -0.02 0.00 0.00 33.50 32.28 1wr4 n PRO 6 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1wr4 n SER 7 N -3.26 0.00 -0.02 2.55 7.64 -1.26 -1.54 113.62 117.73 1wr4 n SER 7 Ca 0.06 0.40 0.08 0.00 1.01 0.00 0.00 58.87 60.42 1wr4 n SER 7 Cb 0.55 -0.44 -0.17 0.00 -1.01 0.00 0.00 64.21 63.14 1wr4 n SER 7 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wr4 n GLY 8 N -0.48 -1.01 3.87 0.23 0.00 -1.26 -4.98 105.19 101.57 1wr4 n GLY 8 Ca 0.03 -0.49 -0.35 0.00 0.00 0.00 0.00 46.02 45.21 1wr4 n GLY 8 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1wr4 s TRP 9 N -3.37 3.60 -0.03 1.61 0.52 -0.59 -0.75 118.94 119.93 1wr4 s TRP 9 Ca -0.08 0.68 0.01 0.00 0.02 0.00 0.00 56.10 56.73 1wr4 s TRP 9 Cb 0.13 -2.07 0.02 0.00 -1.15 0.00 0.00 33.47 30.40 1wr4 s TRP 9 CO 0.90 0.61 -0.02 -2.00 0.02 0.00 0.00 176.95 176.45 1wr4 s GLU 10 N -1.63 0.50 -0.12 4.98 2.12 -0.61 -4.60 118.70 119.32 1wr4 s GLU 10 Ca 0.27 -0.03 -0.26 0.00 0.36 0.00 0.00 54.97 55.31 1wr4 s GLU 10 Cb -0.14 -0.58 -0.02 0.00 0.26 0.00 0.00 34.13 33.65 1wr4 s GLU 10 CO 0.15 -0.07 0.87 -1.83 -0.54 0.00 0.00 175.26 173.84 1wr4 s GLU 11 N 0.77 4.37 0.00 4.30 1.03 -1.26 0.00 118.70 127.91 1wr4 s GLU 11 Ca -0.09 1.12 0.00 0.00 0.03 0.00 0.00 54.97 56.04 1wr4 s GLU 11 Cb -0.12 -3.54 0.00 0.00 -0.80 0.00 0.00 34.13 29.67 1wr4 s GLU 11 CO -0.01 -0.25 0.00 -2.13 -1.33 0.00 0.00 175.26 171.55 1wr4 n ARG 12 N 4.86 2.54 -4.07 -4.83 0.63 0.11 -4.96 116.66 110.93 1wr4 n ARG 12 Ca 0.05 0.00 -0.13 0.00 -0.92 0.00 0.00 57.85 56.84 1wr4 n ARG 12 Cb 0.49 0.00 -0.12 0.00 0.45 0.00 0.00 32.46 33.29 1wr4 n ARG 12 CO 0.00 0.00 0.00 0.15 -2.51 0.00 0.00 177.63 175.27 1wr4 s LYS 13 N -0.84 0.53 0.65 -0.14 1.02 -1.25 -2.38 119.74 117.32 1wr4 s LYS 13 Ca 0.00 -0.72 0.03 0.00 0.02 0.00 0.00 55.97 55.30 1wr4 s LYS 13 Cb 0.00 -0.32 0.10 0.00 -0.52 0.00 0.00 37.83 37.10 1wr4 s LYS 13 CO 0.00 0.06 0.89 0.16 -0.92 0.00 0.00 175.35 175.54 1wr4 s ASP 14 N -1.47 4.72 0.54 2.83 -4.77 -0.26 -4.91 116.67 113.35 1wr4 s ASP 14 Ca -0.09 -0.51 0.22 0.00 -3.30 0.00 0.00 52.55 48.87 1wr4 s ASP 14 Cb -0.09 0.01 1.47 0.00 -1.09 0.00 0.00 42.92 43.21 1wr4 s ASP 14 CO 0.00 -1.59 2.18 0.00 0.70 0.00 0.00 175.17 176.46 1wr4 h ALA 15 N -0.20 1.77 -0.00 2.11 0.00 -2.02 -0.39 119.26 120.53 1wr4 h ALA 15 Ca -0.35 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.55 1wr4 h ALA 15 Cb 1.28 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.06 1wr4 h ALA 15 CO 0.41 0.02 -0.38 1.63 0.00 0.00 0.00 179.25 180.93 1wr4 n LYS 16 N -4.23 0.08 0.00 0.00 5.02 -1.26 -4.93 118.16 112.84 1wr4 n LYS 16 Ca -0.03 -0.04 0.00 0.00 -2.02 0.00 0.00 58.31 56.22 1wr4 n LYS 16 Cb 0.10 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.61 1wr4 n LYS 16 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1wr4 n GLY 17 N 1.48 1.02 3.84 0.72 0.00 -0.16 -5.09 105.19 107.00 1wr4 n GLY 17 Ca 0.07 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.78 1wr4 n GLY 17 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1wr4 s ARG 18 N -0.77 3.00 -0.27 1.61 3.00 -1.26 -4.72 118.95 119.53 1wr4 s ARG 18 Ca 0.00 0.79 -0.06 0.00 0.00 0.00 0.00 55.73 56.46 1wr4 s ARG 18 Cb 0.00 -2.01 -0.00 0.00 0.00 0.00 0.00 34.95 32.94 1wr4 s ARG 18 CO 0.00 -1.01 0.06 0.99 0.00 0.00 0.00 175.30 175.33 1wr4 s THR 19 N -3.14 3.93 0.20 0.02 2.01 -1.26 -1.10 115.64 116.30 1wr4 s THR 19 Ca 0.58 -0.55 0.09 0.00 0.31 0.00 0.00 61.69 62.11 1wr4 s THR 19 Cb -0.13 -2.95 -0.04 0.00 0.01 0.00 0.00 72.50 69.39 1wr4 s THR 19 CO 0.54 0.20 -0.17 -0.72 -0.69 0.00 0.00 174.62 173.78 1wr4 s TYR 20 N 1.52 1.83 -0.26 4.92 1.13 -1.00 -4.88 117.35 120.60 1wr4 s TYR 20 Ca 0.04 -0.50 -0.07 0.00 -1.41 0.00 0.00 57.07 55.13 1wr4 s TYR 20 Cb -0.16 -0.87 -0.02 0.00 -1.10 0.00 0.00 41.96 39.81 1wr4 s TYR 20 CO 0.02 0.39 0.08 0.71 -2.51 0.00 0.00 175.55 174.24 1wr4 s TYR 21 N -2.52 3.10 -0.33 -3.49 2.02 0.15 0.09 117.35 116.36 1wr4 s TYR 21 Ca 0.20 -0.52 -0.07 0.00 -0.37 0.00 0.00 57.07 56.31 1wr4 s TYR 21 Cb -0.03 -2.25 0.03 0.00 -0.40 0.00 0.00 41.96 39.31 1wr4 s TYR 21 CO 0.08 -0.40 0.11 0.54 -1.57 0.00 0.00 175.55 174.30 1wr4 s VAL 22 N 1.60 3.89 -0.21 0.71 0.11 0.10 -0.77 120.40 125.83 1wr4 s VAL 22 Ca 0.06 -1.02 -0.25 0.00 -2.93 0.00 0.00 61.98 57.83 1wr4 s VAL 22 Cb -0.16 -3.16 -0.01 0.00 -1.53 0.00 0.00 36.38 31.52 1wr4 s VAL 22 CO 0.04 -0.13 0.85 0.21 -3.33 0.00 0.00 175.10 172.73 1wr4 s ASN 23 N 1.44 6.90 0.35 3.54 2.47 0.12 -1.57 114.94 128.19 1wr4 s ASN 23 Ca -0.00 1.12 0.21 0.00 0.42 0.00 0.00 52.86 54.60 1wr4 s ASN 23 Cb -0.19 -2.45 0.20 0.00 -1.45 0.00 0.00 41.25 37.36 1wr4 s ASN 23 CO 0.03 -0.48 1.44 0.45 -3.72 0.00 0.00 177.10 174.82 1wr4 h HIS 24 N 7.52 0.00 0.28 0.43 3.86 -1.24 -1.04 115.15 124.96 1wr4 h HIS 24 Ca -0.25 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 58.94 1wr4 h HIS 24 Cb 1.11 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.58 1wr4 h HIS 24 CO 0.74 0.15 -0.14 -0.97 0.86 0.00 0.00 177.93 178.57 1wr4 h ASN 25 N 0.00 -0.32 -0.15 2.45 -0.73 -1.92 -3.35 115.58 111.56 1wr4 h ASN 25 Ca -0.01 -0.12 0.00 0.00 1.87 0.00 0.00 56.30 58.04 1wr4 h ASN 25 Cb 1.12 0.08 0.00 0.00 0.27 0.00 0.00 38.32 39.80 1wr4 h ASN 25 CO 0.02 0.16 0.00 -3.20 -0.37 0.00 0.00 177.43 174.04 1wr4 n ASN 26 N -5.03 3.06 -2.09 1.15 5.15 -1.26 -4.95 115.26 111.29 1wr4 n ASN 26 Ca -0.07 -1.95 -0.19 0.00 -0.60 0.00 0.00 54.58 51.78 1wr4 n ASN 26 Cb 0.22 -0.09 -0.01 0.00 -0.53 0.00 0.00 39.78 39.37 1wr4 n ASN 26 CO 0.00 0.00 0.00 -1.14 1.40 0.00 0.00 177.26 177.52 1wr4 n ARG 27 N 1.32 -1.49 -2.84 1.20 0.00 -0.41 -4.97 116.66 109.47 1wr4 n ARG 27 Ca 0.15 0.93 -0.41 0.00 -0.00 0.00 0.00 57.85 58.52 1wr4 n ARG 27 Cb 0.57 -5.46 -0.04 0.00 0.00 0.00 0.00 32.46 27.54 1wr4 n ARG 27 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.63 178.62 1wr4 s THR 28 N -2.92 4.94 -0.29 5.15 2.01 -1.09 -4.84 115.64 118.60 1wr4 s THR 28 Ca 0.00 1.82 0.02 0.00 0.31 0.00 0.00 61.69 63.84 1wr4 s THR 28 Cb 0.00 -4.21 0.07 0.00 0.01 0.00 0.00 72.50 68.37 1wr4 s THR 28 CO 0.00 0.19 -0.04 -0.89 -0.69 0.00 0.00 174.62 173.18 1wr4 s THR 29 N 0.99 2.36 0.08 -0.82 2.01 -1.26 0.15 115.64 119.15 1wr4 s THR 29 Ca 0.46 -1.78 0.07 0.00 0.31 0.00 0.00 61.69 60.74 1wr4 s THR 29 Cb -0.20 -2.48 -0.03 0.00 0.01 0.00 0.00 72.50 69.81 1wr4 s THR 29 CO 0.24 -0.20 -0.18 0.28 -0.69 0.00 0.00 174.62 174.07 1wr4 s THR 30 N 1.08 1.43 -2.18 -0.82 -1.32 0.05 -4.98 115.64 108.90 1wr4 s THR 30 Ca -0.03 -1.38 0.21 0.00 -1.21 0.00 0.00 61.69 59.28 1wr4 s THR 30 Cb -0.20 -1.32 0.52 0.00 -1.51 0.00 0.00 72.50 69.99 1wr4 s THR 30 CO -0.05 -0.10 1.47 0.79 -2.21 0.00 0.00 174.62 174.52 1wr4 n TRP 31 N 1.29 0.71 -4.02 9.09 7.02 -1.26 0.29 117.44 130.56 1wr4 n TRP 31 Ca -0.20 -0.36 -0.30 0.00 -1.02 0.00 0.00 57.50 55.63 1wr4 n TRP 31 Cb 0.54 0.00 -0.06 0.00 -2.42 0.00 0.00 31.31 29.37 1wr4 n TRP 31 CO 0.00 0.00 0.00 0.99 -2.02 0.00 0.00 177.69 176.66 1wr4 s THR 32 N -1.29 4.77 -0.10 -0.99 2.01 -1.26 -4.91 115.64 113.88 1wr4 s THR 32 Ca 0.42 -0.71 -0.30 0.00 0.31 0.00 0.00 61.69 61.42 1wr4 s THR 32 Cb 0.23 -3.33 -0.03 0.00 0.01 0.00 0.00 72.50 69.38 1wr4 s THR 32 CO 0.31 0.09 1.37 -0.13 -0.69 0.00 0.00 174.62 175.56 1wr4 s ARG 33 N -2.54 4.24 0.00 4.92 1.81 -1.26 -4.83 118.95 121.29 1wr4 s ARG 33 Ca 0.31 1.83 -0.30 0.00 -1.72 0.00 0.00 55.73 55.85 1wr4 s ARG 33 Cb -0.12 -3.77 -0.07 0.00 -0.45 0.00 0.00 34.95 30.54 1wr4 s ARG 33 CO 0.24 -0.69 1.75 -2.14 -0.68 0.00 0.00 175.30 173.78 1wr4 s PRO 34 N 3.32 4.17 -1.07 3.54 0.02 -1.26 -4.93 135.00 138.80 1wr4 s PRO 34 Ca 0.60 2.36 -0.18 0.00 0.02 0.00 0.00 61.00 63.80 1wr4 s PRO 34 Cb -0.26 -3.95 0.12 0.00 0.02 0.00 0.00 34.50 30.43 1wr4 s PRO 34 CO 0.21 -0.85 1.35 0.96 -0.33 0.00 0.00 177.00 178.33 1wr4 s ILE 35 N 3.84 4.58 -2.97 2.83 -5.25 -1.26 -5.02 121.20 117.95 1wr4 s ILE 35 Ca 0.78 -1.76 0.24 0.00 -0.99 0.00 0.00 60.65 58.92 1wr4 s ILE 35 Cb -0.38 -4.92 0.21 0.00 2.95 0.00 0.00 42.46 40.32 1wr4 s ILE 35 CO 0.34 -1.69 1.29 0.80 -1.79 0.00 0.00 174.94 173.89