#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wr3 s SER 2 N 0.00 6.42 0.25 1.61 1.04 -1.26 -4.89 113.70 116.87 1wr3 s SER 2 Ca 0.00 -0.00 -0.17 0.00 0.48 0.00 0.00 55.95 56.25 1wr3 s SER 2 Cb 0.00 -2.52 -0.08 0.00 0.10 0.00 0.00 66.02 63.51 1wr3 s SER 2 CO 0.00 -1.41 0.71 -2.16 0.98 0.00 0.00 173.24 171.35 1wr3 s PRO 3 N 4.69 4.13 0.00 4.02 0.05 -1.26 -5.06 135.00 141.57 1wr3 s PRO 3 Ca 0.40 0.75 0.00 0.00 0.05 0.00 0.00 61.00 62.20 1wr3 s PRO 3 Cb -0.09 -2.73 0.00 0.00 0.05 0.00 0.00 34.50 31.73 1wr3 s PRO 3 CO 0.24 0.32 0.00 -0.35 0.05 0.00 0.00 177.00 177.26 1wr3 n PRO 4 N 0.36 0.00 -3.64 0.56 -0.04 -1.26 -4.94 135.00 126.04 1wr3 n PRO 4 Ca -0.01 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.36 1wr3 n PRO 4 Cb 0.52 -0.33 -0.07 0.00 -0.04 0.00 0.00 33.50 33.58 1wr3 n PRO 4 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1wr3 s LEU 5 N 0.00 -0.80 0.78 1.53 2.96 -1.26 -5.04 118.68 116.84 1wr3 s LEU 5 Ca 0.00 1.39 -0.11 0.00 -0.22 0.00 0.00 54.13 55.19 1wr3 s LEU 5 Cb 0.00 2.33 0.06 0.00 0.50 0.00 0.00 46.19 49.08 1wr3 s LEU 5 CO 0.00 -0.23 1.10 -2.84 -1.32 0.00 0.00 176.35 173.06 1wr3 s PRO 6 N 1.04 2.16 -0.14 0.98 0.02 -1.26 -4.90 135.00 132.90 1wr3 s PRO 6 Ca -0.05 1.24 -0.35 0.00 0.02 0.00 0.00 61.00 61.86 1wr3 s PRO 6 Cb -0.05 -1.88 -0.12 0.00 0.02 0.00 0.00 34.50 32.47 1wr3 s PRO 6 CO -0.11 -1.72 1.89 -2.30 -0.33 0.00 0.00 177.00 174.42 1wr3 n PRO 7 N -3.50 1.96 0.00 5.54 -0.02 -1.26 -2.09 135.00 135.63 1wr3 n PRO 7 Ca 0.10 0.71 0.00 0.00 -2.02 0.00 0.00 63.50 62.28 1wr3 n PRO 7 Cb 0.53 -2.56 0.00 0.00 -0.02 0.00 0.00 33.50 31.45 1wr3 n PRO 7 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1wr3 n GLY 8 N 4.51 2.65 3.75 -1.23 0.00 -1.26 -4.76 105.19 108.85 1wr3 n GLY 8 Ca 0.24 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.86 1wr3 n GLY 8 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1wr3 s TRP 9 N -2.55 3.93 -0.02 1.61 0.52 -0.89 -0.08 118.94 121.46 1wr3 s TRP 9 Ca 0.00 1.89 0.03 0.00 0.02 0.00 0.00 56.10 58.04 1wr3 s TRP 9 Cb 0.00 -3.02 0.00 0.00 -1.15 0.00 0.00 33.47 29.30 1wr3 s TRP 9 CO 0.00 0.33 -0.10 -1.21 0.02 0.00 0.00 176.95 175.99 1wr3 s GLU 10 N -1.14 1.02 -0.33 4.98 2.02 0.71 -4.90 118.70 121.05 1wr3 s GLU 10 Ca 0.42 -0.35 -0.24 0.00 0.02 0.00 0.00 54.97 54.82 1wr3 s GLU 10 Cb -0.27 -0.95 0.01 0.00 0.10 0.00 0.00 34.13 33.02 1wr3 s GLU 10 CO 0.33 0.14 0.84 -2.00 0.02 0.00 0.00 175.26 174.60 1wr3 s GLU 11 N 0.11 3.92 0.33 1.61 2.12 -1.26 0.04 118.70 125.57 1wr3 s GLU 11 Ca -0.02 0.59 0.03 0.00 0.36 0.00 0.00 54.97 55.94 1wr3 s GLU 11 Cb -0.08 -3.75 -0.04 0.00 0.26 0.00 0.00 34.13 30.51 1wr3 s GLU 11 CO 0.00 -0.78 0.13 0.21 -0.54 0.00 0.00 175.26 174.28 1wr3 s LYS 12 N 3.14 1.66 -0.05 4.30 2.20 0.86 -4.98 119.74 126.89 1wr3 s LYS 12 Ca 0.35 -1.96 0.06 0.00 -0.36 0.00 0.00 55.97 54.06 1wr3 s LYS 12 Cb -0.13 -0.38 -0.01 0.00 -1.51 0.00 0.00 37.83 35.79 1wr3 s LYS 12 CO 0.15 -0.39 -0.24 0.08 -0.36 0.00 0.00 175.35 174.59 1wr3 s VAL 13 N -3.47 1.93 0.63 4.02 1.01 -1.26 0.46 120.40 123.72 1wr3 s VAL 13 Ca 0.33 -1.01 -0.11 0.00 0.00 0.00 0.00 61.98 61.20 1wr3 s VAL 13 Cb 0.05 -1.63 0.15 0.00 0.00 0.00 0.00 36.38 34.95 1wr3 s VAL 13 CO 0.16 0.54 0.85 -0.90 0.00 0.00 0.00 175.10 175.75 1wr3 n ASP 14 N 2.91 0.01 -0.15 3.32 5.75 -0.71 -4.89 116.55 122.80 1wr3 n ASP 14 Ca -0.17 -1.30 0.07 0.00 -0.01 0.00 0.00 54.79 53.38 1wr3 n ASP 14 Cb 0.52 -0.65 0.38 0.00 -1.03 0.00 0.00 41.12 40.34 1wr3 n ASP 14 CO 0.00 0.00 0.00 -1.13 -0.11 0.00 0.00 177.20 175.96 1wr3 h ASN 15 N -1.15 0.61 0.20 -1.12 -1.24 -2.01 -2.80 115.58 108.07 1wr3 h ASN 15 Ca -0.28 0.00 -0.33 0.00 0.71 0.00 0.00 56.30 56.41 1wr3 h ASN 15 Cb 0.76 -0.13 0.02 0.00 0.73 0.00 0.00 38.32 39.70 1wr3 h ASN 15 CO 0.19 0.39 -1.55 -0.07 -1.29 0.00 0.00 177.43 175.11 1wr3 h LEU 16 N 0.69 0.66 0.00 0.34 -0.00 -2.05 -3.48 115.31 111.47 1wr3 h LEU 16 Ca 0.29 -0.93 0.00 0.00 -0.00 0.00 0.00 57.88 57.25 1wr3 h LEU 16 Cb 0.26 -0.22 0.00 0.00 -0.00 0.00 0.00 40.66 40.71 1wr3 h LEU 16 CO -0.09 1.72 0.00 0.61 -0.00 0.00 0.00 178.44 180.67 1wr3 n GLY 17 N 1.79 1.02 3.70 0.83 0.00 -1.06 -5.12 105.19 106.35 1wr3 n GLY 17 Ca -0.21 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.43 1wr3 n GLY 17 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1wr3 s ARG 18 N 0.00 4.25 -0.81 1.61 3.00 -1.26 -4.80 118.95 120.94 1wr3 s ARG 18 Ca 0.00 0.23 -0.25 0.00 0.00 0.00 0.00 55.73 55.71 1wr3 s ARG 18 Cb 0.00 -3.48 0.01 0.00 0.00 0.00 0.00 34.95 31.48 1wr3 s ARG 18 CO 0.00 0.10 1.60 0.99 0.00 0.00 0.00 175.30 177.99 1wr3 s THR 19 N 0.86 3.62 0.34 0.02 2.01 -1.26 -1.74 115.64 119.50 1wr3 s THR 19 Ca 0.20 -0.07 0.07 0.00 0.31 0.00 0.00 61.69 62.20 1wr3 s THR 19 Cb -0.14 -4.53 -0.02 0.00 0.01 0.00 0.00 72.50 67.82 1wr3 s THR 19 CO 0.07 -1.46 0.35 -0.72 -0.69 0.00 0.00 174.62 172.17 1wr3 s TYR 20 N 7.24 2.96 -0.34 4.92 1.13 0.17 -4.76 117.35 128.67 1wr3 s TYR 20 Ca 0.52 -0.28 -0.03 0.00 -1.41 0.00 0.00 57.07 55.87 1wr3 s TYR 20 Cb -0.07 -1.88 0.07 0.00 -1.10 0.00 0.00 41.96 38.98 1wr3 s TYR 20 CO 0.07 0.11 0.09 0.71 -2.51 0.00 0.00 175.55 174.02 1wr3 s TYR 21 N -2.27 3.37 -0.30 -3.49 1.51 0.52 -0.10 117.35 116.60 1wr3 s TYR 21 Ca 0.43 -1.97 -0.16 0.00 -1.01 0.00 0.00 57.07 54.36 1wr3 s TYR 21 Cb -0.07 -2.52 -0.02 0.00 -0.11 0.00 0.00 41.96 39.24 1wr3 s TYR 21 CO 0.28 -0.85 0.44 0.54 -1.11 0.00 0.00 175.55 174.85 1wr3 s VAL 22 N 1.25 5.11 0.29 0.71 0.11 0.11 -3.14 120.40 124.83 1wr3 s VAL 22 Ca 0.00 0.49 -0.29 0.00 -2.93 0.00 0.00 61.98 59.25 1wr3 s VAL 22 Cb -0.21 -3.81 -0.09 0.00 -1.53 0.00 0.00 36.38 30.74 1wr3 s VAL 22 CO -0.01 0.01 1.04 0.21 -3.33 0.00 0.00 175.10 173.01 1wr3 s ASN 23 N 1.67 7.30 0.00 3.54 3.84 0.37 -0.21 114.94 131.45 1wr3 s ASN 23 Ca 0.17 2.11 0.17 0.00 0.21 0.00 0.00 52.86 55.52 1wr3 s ASN 23 Cb -0.16 -2.61 -0.02 0.00 -0.55 0.00 0.00 41.25 37.91 1wr3 s ASN 23 CO 0.11 -0.10 0.85 1.41 -2.79 0.00 0.00 177.10 176.58 1wr3 n HIS 24 N 1.04 0.00 -0.01 0.43 8.25 0.88 -3.01 115.22 122.81 1wr3 n HIS 24 Ca -0.00 0.00 -0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1wr3 n HIS 24 Cb 0.46 0.00 -0.00 0.00 1.12 0.00 0.00 29.99 31.57 1wr3 n HIS 24 CO 0.00 0.00 0.00 -0.97 0.64 0.00 0.00 176.34 176.01 1wr3 h ASN 25 N 1.65 0.00 -0.01 0.41 -0.73 -1.86 -3.41 115.58 111.64 1wr3 h ASN 25 Ca 0.00 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.17 1wr3 h ASN 25 Cb 0.55 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.14 1wr3 h ASN 25 CO 0.00 0.06 -0.74 -3.20 -0.37 0.00 0.00 177.43 173.18 1wr3 n ASN 26 N -2.37 1.39 -2.30 1.15 5.15 -1.26 -5.00 115.26 112.03 1wr3 n ASN 26 Ca -0.00 -1.20 -0.12 0.00 -0.60 0.00 0.00 54.58 52.66 1wr3 n ASN 26 Cb 0.01 0.77 0.05 0.00 -0.53 0.00 0.00 39.78 40.08 1wr3 n ASN 26 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1wr3 n ARG 27 N -0.85 -4.22 -2.34 1.20 5.12 -1.16 -5.00 116.66 109.40 1wr3 n ARG 27 Ca 0.06 0.47 -0.42 0.00 -1.93 0.00 0.00 57.85 56.03 1wr3 n ARG 27 Cb 0.37 -4.41 -0.03 0.00 -1.16 0.00 0.00 32.46 27.23 1wr3 n ARG 27 CO 0.00 0.00 0.00 -1.12 -1.93 0.00 0.00 177.63 174.58 1wr3 s SER 28 N -3.41 7.01 -0.70 0.55 0.01 -1.26 -4.75 113.70 111.16 1wr3 s SER 28 Ca 0.20 2.16 0.05 0.00 1.31 0.00 0.00 55.95 59.67 1wr3 s SER 28 Cb -0.09 -2.59 0.18 0.00 0.21 0.00 0.00 66.02 63.74 1wr3 s SER 28 CO 0.41 -0.49 0.54 0.35 0.41 0.00 0.00 173.24 174.46 1wr3 n THR 29 N 3.55 1.78 -4.07 1.44 -2.24 -1.26 -0.48 114.28 113.00 1wr3 n THR 29 Ca 0.08 -4.94 -0.30 0.00 -2.27 0.00 0.00 64.05 56.62 1wr3 n THR 29 Cb 0.45 -2.17 -0.07 0.00 -2.10 0.00 0.00 70.33 66.44 1wr3 n THR 29 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1wr3 s GLN 30 N -1.66 2.82 0.00 -0.78 -2.07 -1.19 -4.94 119.66 111.84 1wr3 s GLN 30 Ca 0.28 -0.72 0.11 0.00 -1.82 0.00 0.00 55.36 53.21 1wr3 s GLN 30 Cb -0.01 -2.69 0.46 0.00 -1.09 0.00 0.00 33.01 29.69 1wr3 s GLN 30 CO -0.14 0.56 1.33 0.91 -1.32 0.00 0.00 175.29 176.63 1wr3 n TRP 31 N 0.49 0.18 -4.85 9.60 7.02 -1.26 -0.35 117.44 128.27 1wr3 n TRP 31 Ca -0.09 -0.09 -0.27 0.00 -1.02 0.00 0.00 57.50 56.03 1wr3 n TRP 31 Cb 0.52 0.00 -0.15 0.00 -2.42 0.00 0.00 31.31 29.26 1wr3 n TRP 31 CO 0.00 0.00 0.00 -3.38 -2.02 0.00 0.00 177.69 172.29 1wr3 s HIS 32 N -1.82 1.96 0.11 -5.99 -3.43 -1.26 -4.60 115.29 100.26 1wr3 s HIS 32 Ca 0.19 -0.38 -0.31 0.00 -0.80 0.00 0.00 55.06 53.76 1wr3 s HIS 32 Cb 0.10 -1.20 -0.10 0.00 -1.43 0.00 0.00 32.58 29.94 1wr3 s HIS 32 CO 0.14 0.05 1.84 0.50 -2.00 0.00 0.00 174.74 175.27 1wr3 s ARG 33 N -0.95 4.14 -0.71 -0.38 3.52 -1.26 -4.75 118.95 118.57 1wr3 s ARG 33 Ca 0.09 2.59 -0.05 0.00 -0.13 0.00 0.00 55.73 58.22 1wr3 s ARG 33 Cb -0.09 -3.66 -0.09 0.00 -1.56 0.00 0.00 34.95 29.56 1wr3 s ARG 33 CO 0.01 -0.85 2.26 -0.35 -0.81 0.00 0.00 175.30 175.55 1wr3 n PRO 34 N 5.88 1.96 0.14 5.12 -0.04 -1.26 -3.43 135.00 143.37 1wr3 n PRO 34 Ca 0.18 -1.27 0.00 0.00 -0.04 0.00 0.00 63.50 62.37 1wr3 n PRO 34 Cb 0.39 -2.29 0.00 0.00 -0.04 0.00 0.00 33.50 31.55 1wr3 n PRO 34 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1wr3 n SER 35 N 3.72 -2.53 0.00 3.54 3.41 -1.26 -4.91 113.62 115.59 1wr3 n SER 35 Ca 0.42 0.71 0.00 0.00 -0.26 0.00 0.00 58.87 59.74 1wr3 n SER 35 Cb 0.26 2.53 0.00 0.00 -0.26 0.00 0.00 64.21 66.74 1wr3 n SER 35 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77