#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 2.83 0.35 1.45 2.46 -1.26 -0.49 115.29 120.63 1wmt s HIS 2 Ca 0.00 0.98 0.08 0.00 0.47 0.00 0.00 55.06 56.59 1wmt s HIS 2 Cb 0.00 -3.52 -0.04 0.00 -0.13 0.00 0.00 32.58 28.90 1wmt s HIS 2 CO 0.00 -1.78 0.22 0.95 -2.47 0.00 0.00 174.74 171.66 1wmt s THR 3 N 3.45 3.08 -0.32 0.89 -4.23 0.10 -4.95 115.64 113.66 1wmt s THR 3 Ca 0.56 -1.54 0.08 0.00 -1.18 0.00 0.00 61.69 59.60 1wmt s THR 3 Cb -0.22 -3.05 0.53 0.00 1.34 0.00 0.00 72.50 71.10 1wmt s THR 3 CO 0.16 -0.14 1.53 -3.20 -0.54 0.00 0.00 174.62 172.43 1wmt n ASN 4 N -1.28 2.75 -4.69 3.99 5.15 -1.26 -3.52 115.26 116.40 1wmt n ASN 4 Ca -0.02 -3.78 -0.42 0.00 -0.60 0.00 0.00 54.58 49.76 1wmt n ASN 4 Cb 0.61 -0.67 -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 -3.32 3.98 -0.36 -1.44 1.01 -1.26 -4.79 121.20 115.01 1wmt s ILE 5 Ca 0.47 1.34 -0.29 0.00 0.00 0.00 0.00 60.65 62.17 1wmt s ILE 5 Cb 0.42 -3.86 -0.00 0.00 0.01 0.00 0.00 42.46 39.03 1wmt s ILE 5 CO 0.01 0.00 1.56 -2.16 0.00 0.00 0.00 174.94 174.35 1wmt s PRO 6 N 2.25 3.53 0.01 2.79 0.04 -1.26 -1.06 135.00 141.30 1wmt s PRO 6 Ca 0.60 1.18 -0.00 0.00 0.04 0.00 0.00 61.00 62.82 1wmt s PRO 6 Cb -0.28 -4.08 0.00 0.00 0.04 0.00 0.00 34.50 30.18 1wmt s PRO 6 CO 0.24 -1.62 0.02 0.00 0.04 0.00 0.00 177.00 175.68 1wmt n ARG 8 N -0.02 0.00 -5.17 0.00 0.00 -1.26 -4.31 116.66 105.90 1wmt n ARG 8 Ca 0.00 0.00 -0.32 0.00 -0.00 0.00 0.00 57.85 57.53 1wmt n ARG 8 Cb 0.02 -0.48 -0.16 0.00 0.00 0.00 0.00 32.46 31.85 1wmt n ARG 8 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.63 177.83 1wmt s GLY 9 N -2.28 1.35 0.13 5.14 0.00 -1.26 -4.86 107.32 105.54 1wmt s GLY 9 Ca 0.00 -1.00 -0.19 0.00 0.00 0.00 0.00 44.72 43.53 1wmt s GLY 9 CO 0.00 -0.49 1.73 -0.84 0.00 0.00 0.00 173.10 173.50 1wmt h THR 10 N 5.28 0.89 0.00 0.90 2.02 -1.90 -1.95 112.91 118.15 1wmt h THR 10 Ca -0.28 -0.04 0.00 0.00 0.77 0.00 0.00 66.41 66.87 1wmt h THR 10 Cb 1.20 0.77 0.00 0.00 -1.74 0.00 0.00 68.15 68.38 1wmt h THR 10 CO 0.48 0.02 0.00 -1.20 0.37 0.00 0.00 175.52 175.19 1wmt n SER 11 N -5.10 1.59 0.01 4.18 7.64 -1.26 -1.67 113.62 119.01 1wmt n SER 11 Ca -0.02 -1.26 0.00 0.00 1.01 0.00 0.00 58.87 58.59 1wmt n SER 11 Cb 0.10 -0.32 0.00 0.00 -1.01 0.00 0.00 64.21 62.98 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 1.58 -0.21 -0.39 6.43 -0.08 -0.77 -4.86 116.55 118.25 1wmt n ASP 12 Ca 0.00 0.06 0.14 0.00 -1.51 0.00 0.00 54.79 53.48 1wmt n ASP 12 Cb 0.17 0.51 0.60 0.00 2.34 0.00 0.00 41.12 44.75 1wmt n ASP 12 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1wmt n TYR 14 N -0.05 0.00 0.03 0.00 4.11 -0.67 -1.05 117.16 119.53 1wmt n TYR 14 Ca 0.20 0.00 -0.19 0.00 -0.00 0.00 0.00 57.90 57.91 1wmt n TYR 14 Cb 0.31 -0.05 -0.11 0.00 -0.00 0.00 0.00 39.34 39.49 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 0.37 0.58 -0.17 -3.48 5.08 -1.83 -2.84 114.58 112.30 1wmt h GLU 15 Ca 0.00 -0.63 0.05 0.00 -1.00 0.00 0.00 59.36 57.78 1wmt h GLU 15 Cb 0.13 0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.56 1wmt h GLU 15 CO 0.00 1.24 0.16 -1.00 -1.00 0.00 0.00 179.01 178.41 1wmt h PRO 16 N 0.18 0.00 0.03 2.33 0.13 -1.81 0.16 132.00 133.02 1wmt h PRO 16 Ca -0.11 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 64.80 1wmt h PRO 16 Cb 1.55 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.67 1wmt h PRO 16 CO 0.17 0.00 -0.98 0.00 -0.23 0.00 0.00 178.00 176.96 1wmt h GLU 18 N 0.06 -0.36 0.00 0.00 5.08 -0.52 0.28 114.58 119.12 1wmt h GLU 18 Ca -0.05 0.02 -0.07 0.00 -1.00 0.00 0.00 59.36 58.27 1wmt h GLU 18 Cb 1.67 0.08 -0.01 0.00 0.50 0.00 0.00 28.75 30.99 1wmt h GLU 18 CO 0.15 -0.01 -0.32 0.87 -1.00 0.00 0.00 179.01 178.70 1wmt h LYS 19 N -0.86 0.00 0.00 2.33 1.57 -1.18 0.66 116.57 119.09 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 0.51 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.82 1wmt h LYS 19 CO 0.06 0.32 0.00 1.63 -0.57 0.00 0.00 179.45 180.89 1wmt n LYS 20 N -4.07 0.00 0.00 3.15 5.02 0.17 -4.31 118.16 118.12 1wmt n LYS 20 Ca -0.02 0.16 0.08 0.00 -2.02 0.00 0.00 58.31 56.51 1wmt n LYS 20 Cb 0.37 -0.57 0.48 0.00 -0.02 0.00 0.00 35.03 35.28 1wmt n LYS 20 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1wmt n TYR 21 N -1.56 0.00 -2.13 2.13 4.01 0.86 -4.82 117.16 115.66 1wmt n TYR 21 Ca 0.00 0.00 -0.19 0.00 -0.16 0.00 0.00 57.90 57.55 1wmt n TYR 21 Cb 0.00 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.00 1wmt n TYR 21 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1wmt n ASN 22 N -0.81 -5.38 -3.63 7.72 4.13 0.23 -4.92 115.26 112.61 1wmt n ASN 22 Ca 0.12 0.12 -0.12 0.00 1.68 0.00 0.00 54.58 56.38 1wmt n ASN 22 Cb 0.06 -4.46 -0.11 0.00 -1.54 0.00 0.00 39.78 33.72 1wmt n ASN 22 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1wmt n ALA 24 N 5.37 0.00 -3.37 0.00 0.00 -1.26 -2.83 120.51 118.41 1wmt n ALA 24 Ca -0.07 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.13 1wmt n ALA 24 Cb 0.50 0.00 0.04 0.00 0.00 0.00 0.00 19.45 19.99 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 0.00 -5.69 -1.89 0.00 5.12 -1.26 -4.65 116.66 108.29 1wmt n ARG 25 Ca 0.00 0.78 -0.23 0.00 -1.93 0.00 0.00 57.85 56.47 1wmt n ARG 25 Cb 0.00 -5.69 0.15 0.00 -1.16 0.00 0.00 32.46 25.76 1wmt n ARG 25 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1wmt n ALA 26 N -4.15 -0.77 -3.68 7.54 0.00 -1.26 -4.61 120.51 113.59 1wmt n ALA 26 Ca -0.04 -1.57 -0.17 0.00 0.00 0.00 0.00 53.44 51.66 1wmt n ALA 26 Cb 0.58 0.06 -0.16 0.00 0.00 0.00 0.00 19.45 19.92 1wmt n ALA 26 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1wmt s LYS 27 N -5.23 0.30 -1.14 0.00 2.20 0.19 -4.61 119.74 111.45 1wmt s LYS 27 Ca 0.62 0.07 -0.17 0.00 -0.36 0.00 0.00 55.97 56.13 1wmt s LYS 27 Cb -0.02 -0.47 0.12 0.00 -1.51 0.00 0.00 37.83 35.95 1wmt s LYS 27 CO 0.43 -0.12 1.45 0.00 -0.36 0.00 0.00 175.35 176.74 1wmt s MET 29 N 3.08 2.72 -0.78 0.00 -1.94 0.62 -4.62 119.30 118.37 1wmt s MET 29 Ca 0.44 -0.71 -0.04 0.00 -1.71 0.00 0.00 55.69 53.68 1wmt s MET 29 Cb -0.01 -2.63 0.01 0.00 2.01 0.00 0.00 34.83 34.20 1wmt s MET 29 CO -0.02 0.58 0.62 0.27 -0.01 0.00 0.00 175.02 176.46 1wmt n ASN 30 N 0.91 -5.26 -2.35 3.03 0.23 -1.26 0.28 115.26 110.84 1wmt n ASN 30 Ca -0.12 -0.79 -0.06 0.00 -0.53 0.00 0.00 54.58 53.09 1wmt n ASN 30 Cb 0.52 -2.11 -0.01 0.00 -2.08 0.00 0.00 39.78 36.10 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 -2.30 -2.22 -3.79 -3.83 0.00 -1.26 -4.79 116.66 98.46 1wmt n ARG 31 Ca -0.26 0.02 -0.09 0.00 -0.00 0.00 0.00 57.85 57.51 1wmt n ARG 31 Cb 0.67 -3.48 -0.06 0.00 -0.00 0.00 0.00 32.46 29.59 1wmt n ARG 31 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.63 176.62 1wmt s HIS 32 N -1.74 0.04 0.44 2.89 3.76 0.14 -3.15 115.29 117.68 1wmt s HIS 32 Ca 0.11 -0.43 -0.13 0.00 -0.15 0.00 0.00 55.06 54.46 1wmt s HIS 32 Cb -0.07 0.06 -0.07 0.00 1.11 0.00 0.00 32.58 33.61 1wmt s HIS 32 CO 0.14 -0.62 0.85 0.00 -0.85 0.00 0.00 174.74 174.26 1wmt s ASN 34 N -3.02 2.45 0.00 0.00 3.84 1.22 0.03 114.94 119.46 1wmt s ASN 34 Ca 0.55 -1.76 0.00 0.00 0.21 0.00 0.00 52.86 51.86 1wmt s ASN 34 Cb -0.10 -0.05 0.00 0.00 -0.55 0.00 0.00 41.25 40.55 1wmt s ASN 34 CO 0.30 -0.32 0.00 0.00 -2.79 0.00 0.00 177.10 174.28 1wmt n TYR 36 N -0.62 0.00 -1.73 0.00 4.02 -1.26 -4.23 117.16 113.35 1wmt n TYR 36 Ca 0.00 0.00 -0.18 0.00 -0.01 0.00 0.00 57.90 57.71 1wmt n TYR 36 Cb 0.00 0.02 -0.06 0.00 -0.02 0.00 0.00 39.34 39.28 1wmt n TYR 36 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 1wmt n ASN 37 N 0.00 -4.91 -1.88 7.72 3.02 -1.26 -4.80 115.26 113.15 1wmt n ASN 37 Ca 0.00 0.36 0.04 0.00 -0.03 0.00 0.00 54.58 54.95 1wmt n ASN 37 Cb 0.35 -4.33 0.38 0.00 -0.61 0.00 0.00 39.78 35.57 1wmt n ASN 37 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 1wmt n ASN 38 N -1.27 5.44 -4.71 6.41 6.94 -1.26 -4.98 115.26 121.83 1wmt n ASN 38 Ca -0.19 -3.02 -0.42 0.00 -0.02 0.00 0.00 54.58 50.92 1wmt n ASN 38 Cb 0.61 -0.70 -0.03 0.00 -2.36 0.00 0.00 39.78 37.30 1wmt n ASN 38 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1wmt n PRO 40 N 4.25 0.00 -0.25 0.00 -0.02 -1.26 -4.99 135.00 132.73 1wmt n PRO 40 Ca 0.16 0.96 0.00 0.00 -2.02 0.00 0.00 63.50 62.60 1wmt n PRO 40 Cb 0.35 -1.49 0.00 0.00 -0.02 0.00 0.00 33.50 32.33 1wmt n PRO 40 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39