#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wmt s HIS 2 N 0.00 2.27 0.53 1.45 2.46 -1.25 0.11 115.29 120.87 1wmt s HIS 2 Ca 0.00 -0.05 -0.03 0.00 0.47 0.00 0.00 55.06 55.46 1wmt s HIS 2 Cb 0.00 -4.62 0.01 0.00 -0.13 0.00 0.00 32.58 27.83 1wmt s HIS 2 CO 0.00 -2.08 0.80 0.95 -2.47 0.00 0.00 174.74 171.94 1wmt s THR 3 N 5.77 3.64 -0.28 0.89 -4.23 0.11 -4.95 115.64 116.59 1wmt s THR 3 Ca 0.35 -0.28 0.10 0.00 -1.18 0.00 0.00 61.69 60.68 1wmt s THR 3 Cb -0.08 -3.40 0.51 0.00 1.34 0.00 0.00 72.50 70.88 1wmt s THR 3 CO 0.15 -0.35 1.48 -3.20 -0.54 0.00 0.00 174.62 172.16 1wmt n ASN 4 N -2.37 2.68 -4.69 3.99 5.15 -1.26 -3.57 115.26 115.20 1wmt n ASN 4 Ca 0.04 -3.68 -0.42 0.00 -0.60 0.00 0.00 54.58 49.92 1wmt n ASN 4 Cb 0.58 -0.63 -0.03 0.00 -0.53 0.00 0.00 39.78 39.17 1wmt n ASN 4 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 1wmt s ILE 5 N -3.20 3.76 -0.35 -1.44 1.01 -1.26 -4.76 121.20 114.96 1wmt s ILE 5 Ca 0.45 1.12 -0.29 0.00 0.00 0.00 0.00 60.65 61.93 1wmt s ILE 5 Cb 0.40 -3.72 0.00 0.00 0.01 0.00 0.00 42.46 39.15 1wmt s ILE 5 CO 0.01 -0.01 1.43 -2.16 0.00 0.00 0.00 174.94 174.21 1wmt s PRO 6 N 2.52 3.69 0.00 2.79 0.04 -1.26 -0.75 135.00 142.03 1wmt s PRO 6 Ca 0.63 1.16 0.00 0.00 0.04 0.00 0.00 61.00 62.83 1wmt s PRO 6 Cb -0.31 -3.99 0.00 0.00 0.04 0.00 0.00 34.50 30.24 1wmt s PRO 6 CO 0.26 -1.41 0.00 0.00 0.04 0.00 0.00 177.00 175.88 1wmt n ARG 8 N 0.00 0.00 -4.83 0.00 1.85 -1.26 -4.39 116.66 108.03 1wmt n ARG 8 Ca 0.00 0.00 -0.29 0.00 -1.00 0.00 0.00 57.85 56.56 1wmt n ARG 8 Cb 0.00 -0.41 -0.15 0.00 -1.05 0.00 0.00 32.46 30.86 1wmt n ARG 8 CO 0.00 0.00 0.00 0.20 -0.01 0.00 0.00 177.63 177.82 1wmt s GLY 9 N -4.18 1.32 0.10 2.89 0.00 -1.26 -4.92 107.32 101.26 1wmt s GLY 9 Ca 0.00 -1.21 -0.25 0.00 0.00 0.00 0.00 44.72 43.27 1wmt s GLY 9 CO 0.00 -1.10 1.69 -0.84 0.00 0.00 0.00 173.10 172.85 1wmt h THR 10 N 4.27 0.70 0.00 0.90 2.02 -1.87 -2.43 112.91 116.51 1wmt h THR 10 Ca -0.45 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 66.70 1wmt h THR 10 Cb 1.15 0.70 -0.01 0.00 -1.74 0.00 0.00 68.15 68.25 1wmt h THR 10 CO 0.44 0.00 0.07 -1.20 0.37 0.00 0.00 175.52 175.20 1wmt n SER 11 N -5.25 1.88 0.08 4.18 7.64 -1.26 -1.74 113.62 119.15 1wmt n SER 11 Ca -0.07 -1.63 0.00 0.00 1.01 0.00 0.00 58.87 58.18 1wmt n SER 11 Cb 0.17 -0.44 0.00 0.00 -1.01 0.00 0.00 64.21 62.93 1wmt n SER 11 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 1wmt n ASP 12 N 2.21 -1.25 -0.43 6.43 2.03 -0.94 -4.87 116.55 119.73 1wmt n ASP 12 Ca 0.06 0.30 0.14 0.00 0.52 0.00 0.00 54.79 55.81 1wmt n ASP 12 Cb 0.23 1.43 0.55 0.00 -0.72 0.00 0.00 41.12 42.61 1wmt n ASP 12 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1wmt n TYR 14 N 0.05 0.00 -0.01 0.00 4.11 -0.71 -2.18 117.16 118.42 1wmt n TYR 14 Ca 0.19 -0.00 -0.17 0.00 -0.00 0.00 0.00 57.90 57.92 1wmt n TYR 14 Cb 0.34 0.00 -0.10 0.00 -0.00 0.00 0.00 39.34 39.58 1wmt n TYR 14 CO 0.00 0.00 0.00 0.93 -0.00 0.00 0.00 176.86 177.79 1wmt h GLU 15 N 0.38 0.45 0.00 -3.48 4.39 -1.82 -2.65 114.58 111.85 1wmt h GLU 15 Ca 0.00 -0.43 -0.01 0.00 0.34 0.00 0.00 59.36 59.26 1wmt h GLU 15 Cb 0.08 0.11 -0.00 0.00 -0.10 0.00 0.00 28.75 28.84 1wmt h GLU 15 CO 0.00 1.08 -0.03 -1.00 -1.16 0.00 0.00 179.01 177.90 1wmt h PRO 16 N -0.01 0.00 0.00 2.33 0.13 -1.80 -0.97 132.00 131.67 1wmt h PRO 16 Ca -0.06 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 64.89 1wmt h PRO 16 Cb 1.24 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.34 1wmt h PRO 16 CO 0.11 0.03 -0.88 0.00 -0.23 0.00 0.00 178.00 177.03 1wmt h GLU 18 N 0.00 -0.39 0.00 0.00 5.08 -0.85 0.56 114.58 118.99 1wmt h GLU 18 Ca -0.01 0.03 -0.06 0.00 -1.00 0.00 0.00 59.36 58.31 1wmt h GLU 18 Cb 1.59 0.09 -0.01 0.00 0.50 0.00 0.00 28.75 30.92 1wmt h GLU 18 CO 0.11 -0.05 -0.30 0.87 -1.00 0.00 0.00 179.01 178.64 1wmt h LYS 19 N -0.84 0.00 0.00 2.33 1.57 -1.51 0.34 116.57 118.46 1wmt h LYS 19 Ca -0.04 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 1wmt h LYS 19 Cb 0.52 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.83 1wmt h LYS 19 CO 0.07 0.30 0.00 1.17 -0.57 0.00 0.00 179.45 180.42 1wmt n LYS 20 N -3.55 0.00 0.00 3.15 4.81 0.32 -4.39 118.16 118.49 1wmt n LYS 20 Ca -0.00 0.19 0.10 0.00 -0.87 0.00 0.00 58.31 57.73 1wmt n LYS 20 Cb 0.45 -0.66 0.51 0.00 0.02 0.00 0.00 35.03 35.34 1wmt n LYS 20 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 1wmt n TYR 21 N -2.18 0.00 -3.66 5.64 4.02 0.17 -4.87 117.16 116.28 1wmt n TYR 21 Ca 0.00 0.00 -0.25 0.00 -0.01 0.00 0.00 57.90 57.64 1wmt n TYR 21 Cb 0.00 -0.36 0.06 0.00 -0.02 0.00 0.00 39.34 39.03 1wmt n TYR 21 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 1wmt n ASN 22 N -1.36 -6.01 0.00 7.72 5.15 0.12 -4.77 115.26 116.11 1wmt n ASN 22 Ca 0.08 -0.59 0.00 0.00 -0.60 0.00 0.00 54.58 53.48 1wmt n ASN 22 Cb 0.20 -4.74 0.00 0.00 -0.53 0.00 0.00 39.78 34.70 1wmt n ASN 22 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1wmt n ALA 24 N -0.52 0.00 -4.11 0.00 0.00 -1.20 -4.71 120.51 109.97 1wmt n ALA 24 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.10 1wmt n ALA 24 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.44 1wmt n ALA 24 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1wmt n ARG 25 N 10.32 -3.94 -3.30 0.00 5.12 -1.26 -4.51 116.66 119.10 1wmt n ARG 25 Ca 0.00 0.45 -0.34 0.00 -1.93 0.00 0.00 57.85 56.03 1wmt n ARG 25 Cb 0.00 -5.20 -0.06 0.00 -1.16 0.00 0.00 32.46 26.05 1wmt n ARG 25 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1wmt s ALA 26 N -3.33 3.50 -0.12 7.54 0.00 -1.26 -4.35 121.76 123.75 1wmt s ALA 26 Ca 0.67 -0.09 -0.03 0.00 0.00 0.00 0.00 51.96 52.51 1wmt s ALA 26 Cb -0.36 -2.59 -0.03 0.00 0.00 0.00 0.00 23.12 20.14 1wmt s ALA 26 CO 0.89 0.43 -0.02 0.21 0.00 0.00 0.00 175.76 177.28 1wmt s LYS 27 N -2.37 3.35 -1.12 0.00 2.20 0.39 -4.15 119.74 118.04 1wmt s LYS 27 Ca 0.44 -0.46 -0.16 0.00 -0.36 0.00 0.00 55.97 55.43 1wmt s LYS 27 Cb -0.13 -2.86 0.15 0.00 -1.51 0.00 0.00 37.83 33.47 1wmt s LYS 27 CO 0.20 0.46 1.35 0.00 -0.36 0.00 0.00 175.35 177.00 1wmt s MET 29 N 2.08 2.56 -1.16 0.00 -1.94 0.29 -4.62 119.30 116.49 1wmt s MET 29 Ca 0.40 -0.85 -0.27 0.00 -1.71 0.00 0.00 55.69 53.26 1wmt s MET 29 Cb -0.03 -2.54 0.02 0.00 2.01 0.00 0.00 34.83 34.29 1wmt s MET 29 CO -0.03 0.53 0.74 0.27 -0.01 0.00 0.00 175.02 176.53 1wmt n ASN 30 N 0.50 -4.83 -3.19 3.03 0.23 -1.26 0.53 115.26 110.27 1wmt n ASN 30 Ca -0.11 -1.14 -0.15 0.00 -0.53 0.00 0.00 54.58 52.66 1wmt n ASN 30 Cb 0.52 -2.60 -0.03 0.00 -2.08 0.00 0.00 39.78 35.59 1wmt n ASN 30 CO 0.00 0.00 0.00 -2.11 -0.93 0.00 0.00 177.26 174.22 1wmt n ARG 31 N -4.55 -2.24 -3.83 -3.83 1.85 -1.26 -4.83 116.66 97.97 1wmt n ARG 31 Ca -0.10 0.06 -0.09 0.00 -1.00 0.00 0.00 57.85 56.71 1wmt n ARG 31 Cb 0.58 -4.58 -0.07 0.00 -1.05 0.00 0.00 32.46 27.34 1wmt n ARG 31 CO 0.00 0.00 0.00 -1.01 -0.01 0.00 0.00 177.63 176.61 1wmt s HIS 32 N -2.43 0.11 0.34 2.89 3.76 0.19 -2.49 115.29 117.66 1wmt s HIS 32 Ca 0.28 -0.52 -0.16 0.00 -0.15 0.00 0.00 55.06 54.51 1wmt s HIS 32 Cb -0.17 -0.00 -0.09 0.00 1.11 0.00 0.00 32.58 33.43 1wmt s HIS 32 CO 0.35 -0.59 0.78 0.00 -0.85 0.00 0.00 174.74 174.42 1wmt s ASN 34 N -2.25 1.95 0.38 0.00 3.84 0.87 0.10 114.94 119.82 1wmt s ASN 34 Ca 0.56 -2.48 0.02 0.00 0.21 0.00 0.00 52.86 51.17 1wmt s ASN 34 Cb -0.10 -0.22 0.05 0.00 -0.55 0.00 0.00 41.25 40.43 1wmt s ASN 34 CO 0.17 -0.24 0.37 0.00 -2.79 0.00 0.00 177.10 174.61 1wmt n TYR 36 N -1.75 0.00 -2.53 0.00 4.11 -1.26 -3.88 117.16 111.86 1wmt n TYR 36 Ca 0.07 0.00 -0.16 0.00 -0.00 0.00 0.00 57.90 57.80 1wmt n TYR 36 Cb 0.24 0.00 -0.00 0.00 -0.00 0.00 0.00 39.34 39.58 1wmt n TYR 36 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 176.86 175.15 1wmt n ASN 37 N -0.48 -4.69 -0.13 9.48 2.85 -1.26 -4.80 115.26 116.23 1wmt n ASN 37 Ca 0.00 0.06 0.13 0.00 -0.11 0.00 0.00 54.58 54.66 1wmt n ASN 37 Cb 0.01 -3.93 0.43 0.00 1.24 0.00 0.00 39.78 37.53 1wmt n ASN 37 CO 0.00 0.00 0.00 -3.20 -2.11 0.00 0.00 177.26 171.95 1wmt n ASN 38 N -1.95 0.65 -4.77 1.20 2.85 -1.26 -4.87 115.26 107.11 1wmt n ASN 38 Ca -0.17 -0.52 -0.39 0.00 -0.11 0.00 0.00 54.58 53.39 1wmt n ASN 38 Cb 0.63 0.05 -0.00 0.00 1.24 0.00 0.00 39.78 41.70 1wmt n ASN 38 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1wmt n PRO 40 N -0.00 1.22 0.00 0.00 -0.02 -1.26 -4.92 135.00 130.02 1wmt n PRO 40 Ca 0.04 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.52 1wmt n PRO 40 Cb 0.44 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.92 1wmt n PRO 40 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39