#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1aw6 h LYS 2 N 0.00 -0.26 0.00 0.03 1.63 -2.10 -3.44 116.57 112.43 1aw6 h LYS 2 Ca 0.00 0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.82 1aw6 h LYS 2 Cb 0.00 0.06 0.00 0.00 -0.60 0.00 0.00 32.23 31.69 1aw6 h LYS 2 CO 0.00 -0.17 0.00 -0.11 -3.45 0.00 0.00 179.45 175.72 1aw6 n LEU 3 N -5.35 0.00 0.00 5.20 7.94 -1.26 -4.78 117.00 118.76 1aw6 n LEU 3 Ca -0.03 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.87 1aw6 n LEU 3 Cb 0.26 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.21 1aw6 n LEU 3 CO 0.20 0.00 0.00 0.18 -1.11 0.00 0.00 177.39 176.66 1aw6 n LEU 4 N 0.00 0.00 0.00 -1.96 4.77 -1.26 -4.56 117.00 113.99 1aw6 n LEU 4 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1aw6 n LEU 4 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 1aw6 n LEU 4 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.39 174.86 1aw6 n SER 5 N 1.57 -0.38 -0.98 -1.43 7.64 -1.26 -4.90 113.62 113.86 1aw6 n SER 5 Ca 0.00 -0.03 0.00 0.00 1.01 0.00 0.00 58.87 59.85 1aw6 n SER 5 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1aw6 n SER 5 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1aw6 n SER 6 N -0.66 -1.31 0.00 6.43 2.88 -1.26 -5.09 113.62 114.61 1aw6 n SER 6 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1aw6 n SER 6 Cb 0.00 -0.66 0.00 0.00 -0.75 0.00 0.00 64.21 62.80 1aw6 n SER 6 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1aw6 n ILE 7 N -0.61 0.00 -0.32 2.46 3.06 -1.26 -5.10 119.36 117.59 1aw6 n ILE 7 Ca 0.00 0.00 -0.14 0.00 -2.50 0.00 0.00 62.75 60.11 1aw6 n ILE 7 Cb 0.28 0.00 -0.03 0.00 0.54 0.00 0.00 39.64 40.43 1aw6 n ILE 7 CO 0.00 0.00 0.00 1.21 -2.50 0.00 0.00 176.55 175.26 1aw6 n GLU 8 N 0.00 0.00 -0.77 9.51 4.07 -1.26 -4.81 120.64 127.38 1aw6 n GLU 8 Ca 0.00 0.00 -0.25 0.00 -0.06 0.00 0.00 57.16 56.85 1aw6 n GLU 8 Cb 0.00 -0.38 -0.01 0.00 -0.06 0.00 0.00 31.44 31.00 1aw6 n GLU 8 CO 0.00 0.00 0.00 0.94 -0.06 0.00 0.00 177.13 178.01 1aw6 n GLN 9 N 1.92 0.00 -3.64 5.31 7.27 -1.26 -5.00 117.38 121.97 1aw6 n GLN 9 Ca 0.14 0.00 -0.04 0.00 0.07 0.00 0.00 57.00 57.17 1aw6 n GLN 9 Cb -0.01 -0.58 -0.06 0.00 2.41 0.00 0.00 30.24 32.00 1aw6 n GLN 9 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1aw6 s ALA 10 N -0.87 -2.15 1.25 1.69 0.00 -1.26 -5.03 121.76 115.39 1aw6 s ALA 10 Ca 0.35 1.75 -0.17 0.00 0.00 0.00 0.00 51.96 53.89 1aw6 s ALA 10 Cb -0.42 -1.62 0.31 0.00 0.00 0.00 0.00 23.12 21.39 1aw6 s ALA 10 CO 0.36 -0.16 1.01 0.00 0.00 0.00 0.00 175.76 176.97 1aw6 h ASP 12 N -2.84 0.47 -0.08 0.00 1.82 -1.76 -3.10 116.42 110.93 1aw6 h ASP 12 Ca -0.53 -0.12 0.02 0.00 -0.39 0.00 0.00 57.03 56.02 1aw6 h ASP 12 Cb 1.33 -0.12 -0.00 0.00 0.68 0.00 0.00 39.33 41.22 1aw6 h ASP 12 CO 0.42 0.45 0.07 0.40 -1.61 0.00 0.00 179.24 178.96 1aw6 h ILE 13 N 0.45 0.84 0.02 2.25 1.08 -1.88 0.16 117.51 120.43 1aw6 h ILE 13 Ca 0.12 0.00 -0.20 0.00 -0.39 0.00 0.00 64.86 64.39 1aw6 h ILE 13 Cb 0.10 0.95 -0.01 0.00 -3.07 0.00 0.00 36.82 34.79 1aw6 h ILE 13 CO -0.02 0.00 -0.93 0.00 -0.69 0.00 0.00 178.15 176.52 1aw6 h ARG 15 N 0.07 -0.41 -0.02 0.00 3.08 -0.63 -1.13 114.38 115.33 1aw6 h ARG 15 Ca -0.04 0.03 -0.00 0.00 0.07 0.00 0.00 59.98 60.03 1aw6 h ARG 15 Cb 1.59 0.09 -0.00 0.00 0.08 0.00 0.00 29.97 31.73 1aw6 h ARG 15 CO 0.14 -0.27 -0.01 -0.07 -1.07 0.00 0.00 179.97 178.69 1aw6 h LEU 16 N -0.42 0.04 -0.70 3.04 -0.00 -1.56 -2.92 115.31 112.78 1aw6 h LEU 16 Ca 0.01 -0.39 0.00 0.00 -0.00 0.00 0.00 57.88 57.49 1aw6 h LEU 16 Cb 0.45 -0.01 0.00 0.00 -0.00 0.00 0.00 40.66 41.10 1aw6 h LEU 16 CO -0.21 0.42 0.00 0.11 -0.00 0.00 0.00 178.44 178.75 1aw6 h LYS 17 N -0.35 0.00 -5.36 1.13 1.57 -1.58 -3.47 116.57 108.51 1aw6 h LYS 17 Ca 0.00 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1aw6 h LYS 17 Cb 0.40 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.71 1aw6 h LYS 17 CO 0.00 0.00 -0.11 1.63 -0.57 0.00 0.00 179.45 180.41 1aw6 n LYS 18 N -3.01 -1.53 -4.32 3.15 5.02 -0.45 -5.05 118.16 111.97 1aw6 n LYS 18 Ca 0.02 1.62 -0.21 0.00 -2.02 0.00 0.00 58.31 57.72 1aw6 n LYS 18 Cb 0.41 -5.73 -0.11 0.00 -0.02 0.00 0.00 35.03 29.57 1aw6 n LYS 18 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1aw6 s LEU 19 N -3.73 2.43 0.12 -0.35 1.02 -1.05 -5.07 118.68 112.06 1aw6 s LEU 19 Ca 0.05 -0.86 -0.30 0.00 0.02 0.00 0.00 54.13 53.04 1aw6 s LEU 19 Cb -0.01 -0.78 -0.06 0.00 0.02 0.00 0.00 46.19 45.35 1aw6 s LEU 19 CO 0.75 -0.05 0.97 -0.54 0.02 0.00 0.00 176.35 177.51 1aw6 s LYS 20 N -2.79 4.70 -0.82 1.70 -0.14 -1.26 -4.82 119.74 116.30 1aw6 s LYS 20 Ca 0.15 1.48 0.01 0.00 -1.36 0.00 0.00 55.97 56.25 1aw6 s LYS 20 Cb -0.05 -3.36 0.20 0.00 -1.68 0.00 0.00 37.83 32.93 1aw6 s LYS 20 CO 0.06 0.21 0.67 0.00 -0.76 0.00 0.00 175.35 175.54 1aw6 n SER 22 N 2.20 0.00 0.00 0.00 3.41 -1.26 -4.79 113.62 113.19 1aw6 n SER 22 Ca 0.21 0.93 0.00 0.00 -0.26 0.00 0.00 58.87 59.75 1aw6 n SER 22 Cb 0.36 -0.46 0.00 0.00 -0.26 0.00 0.00 64.21 63.85 1aw6 n SER 22 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1aw6 n LYS 23 N -3.79 0.00 -1.19 4.33 5.02 -1.26 -5.04 118.16 116.23 1aw6 n LYS 23 Ca 0.42 0.00 -0.37 0.00 -2.02 0.00 0.00 58.31 56.34 1aw6 n LYS 23 Cb 1.90 -1.67 0.05 0.00 -0.02 0.00 0.00 35.03 35.28 1aw6 n LYS 23 CO 0.00 0.00 0.00 -0.85 -0.52 0.00 0.00 177.40 176.03 1aw6 n GLU 24 N -2.43 0.15 -4.02 1.97 0.28 -1.26 -4.89 120.64 110.44 1aw6 n GLU 24 Ca 0.00 0.08 -0.10 0.00 -0.16 0.00 0.00 57.16 56.97 1aw6 n GLU 24 Cb 0.00 -1.51 -0.11 0.00 1.43 0.00 0.00 31.44 31.25 1aw6 n GLU 24 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 177.13 177.12 1aw6 s LYS 25 N -2.28 0.42 0.18 3.44 1.02 -1.26 -2.72 119.74 118.54 1aw6 s LYS 25 Ca 0.59 -0.72 -0.10 0.00 0.02 0.00 0.00 55.97 55.76 1aw6 s LYS 25 Cb -0.35 -0.04 0.07 0.00 -0.52 0.00 0.00 37.83 36.99 1aw6 s LYS 25 CO 0.64 -0.02 1.66 -1.00 -0.92 0.00 0.00 175.35 175.72 1aw6 h PRO 26 N 4.45 1.06 -5.48 -1.68 0.13 -1.98 -3.48 132.00 125.02 1aw6 h PRO 26 Ca -0.34 -0.31 -0.64 0.00 -0.87 0.00 0.00 66.00 63.85 1aw6 h PRO 26 Cb 1.20 -0.11 -0.12 0.00 0.13 0.00 0.00 31.00 32.10 1aw6 h PRO 26 CO 0.43 1.01 -0.52 0.15 -0.23 0.00 0.00 178.00 178.84 1aw6 s LYS 27 N -5.13 3.73 0.50 0.86 1.02 -1.26 -4.86 119.74 114.61 1aw6 s LYS 27 Ca -0.12 -0.25 -0.08 0.00 0.02 0.00 0.00 55.97 55.54 1aw6 s LYS 27 Cb 0.14 -3.21 0.12 0.00 -0.52 0.00 0.00 37.83 34.36 1aw6 s LYS 27 CO 0.85 0.50 0.28 0.00 -0.92 0.00 0.00 175.35 176.06 1aw6 h ALA 29 N -2.43 0.93 -0.80 0.00 0.00 -1.96 -3.10 119.26 111.89 1aw6 h ALA 29 Ca -0.13 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.53 1aw6 h ALA 29 Cb 0.43 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1aw6 h ALA 29 CO 0.08 0.67 0.00 1.17 0.00 0.00 0.00 179.25 181.17 1aw6 n LYS 30 N -4.23 0.00 -0.27 0.00 3.00 -1.26 -1.96 118.16 113.44 1aw6 n LYS 30 Ca 0.05 0.73 -0.02 0.00 -0.00 0.00 0.00 58.31 59.07 1aw6 n LYS 30 Cb 0.27 -1.37 0.15 0.00 0.00 0.00 0.00 35.03 34.09 1aw6 n LYS 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1aw6 h LEU 32 N 1.14 1.00 -1.02 0.00 6.46 -1.55 0.57 115.31 121.90 1aw6 h LEU 32 Ca 0.29 0.01 -0.09 0.00 -0.12 0.00 0.00 57.88 57.98 1aw6 h LEU 32 Cb -0.00 -0.20 -0.01 0.00 -0.73 0.00 0.00 40.66 39.72 1aw6 h LEU 32 CO -0.05 0.63 -0.41 0.11 -0.62 0.00 0.00 178.44 178.10 1aw6 h LYS 33 N 1.13 0.00 -0.07 1.25 1.57 -0.52 -3.16 116.57 116.78 1aw6 h LYS 33 Ca 0.43 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 59.12 1aw6 h LYS 33 Cb 0.19 0.00 -0.13 0.00 0.08 0.00 0.00 32.23 32.37 1aw6 h LYS 33 CO -0.18 0.41 -0.66 0.09 -0.57 0.00 0.00 179.45 178.54 1aw6 n ASN 34 N -3.69 1.78 -3.64 0.86 3.02 -0.59 -5.03 115.26 107.98 1aw6 n ASN 34 Ca -0.01 -3.42 -0.23 0.00 -0.03 0.00 0.00 54.58 50.89 1aw6 n ASN 34 Cb 0.50 -0.46 0.00 0.00 -0.61 0.00 0.00 39.78 39.21 1aw6 n ASN 34 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 1aw6 n ASN 35 N -0.71 -3.70 -4.83 6.41 2.04 0.19 -4.91 115.26 109.75 1aw6 n ASN 35 Ca 0.18 -0.84 -0.31 0.00 -0.44 0.00 0.00 54.58 53.17 1aw6 n ASN 35 Cb 0.82 -1.26 -0.05 0.00 -2.53 0.00 0.00 39.78 36.76 1aw6 n ASN 35 CO 0.00 0.00 0.00 0.26 -0.44 0.00 0.00 177.26 177.08 1aw6 s TRP 36 N -2.99 1.71 -0.88 -2.53 0.51 -0.79 -5.04 118.94 108.93 1aw6 s TRP 36 Ca 0.08 -0.93 0.00 0.00 -2.12 0.00 0.00 56.10 53.13 1aw6 s TRP 36 Cb -0.04 -1.72 0.29 0.00 -0.81 0.00 0.00 33.47 31.19 1aw6 s TRP 36 CO 0.73 -0.08 1.24 -1.91 -0.51 0.00 0.00 176.95 176.42 1aw6 n GLU 37 N -1.49 3.86 -1.51 4.98 2.13 -1.26 -4.89 120.64 122.45 1aw6 n GLU 37 Ca -0.13 -4.64 -0.34 0.00 0.66 0.00 0.00 57.16 52.71 1aw6 n GLU 37 Cb 0.66 -2.40 -0.14 0.00 0.27 0.00 0.00 31.44 29.83 1aw6 n GLU 37 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1aw6 s ARG 39 N 8.43 3.49 -0.47 0.00 0.52 -1.26 -4.84 118.95 124.81 1aw6 s ARG 39 Ca 1.25 -2.35 -0.14 0.00 -0.52 0.00 0.00 55.73 53.96 1aw6 s ARG 39 Cb -0.88 -4.39 0.09 0.00 0.52 0.00 0.00 34.95 30.29 1aw6 s ARG 39 CO 0.43 -1.29 0.38 0.71 0.02 0.00 0.00 175.30 175.55 1aw6 s TYR 40 N 0.37 3.28 0.30 -0.53 2.02 -1.26 -2.23 117.35 119.30 1aw6 s TYR 40 Ca 0.16 -1.17 0.00 0.00 -0.37 0.00 0.00 57.07 55.69 1aw6 s TYR 40 Cb -0.13 -3.25 0.00 0.00 -0.40 0.00 0.00 41.96 38.18 1aw6 s TYR 40 CO -0.07 -0.86 0.00 -1.13 -1.57 0.00 0.00 175.55 171.92 1aw6 n SER 41 N 5.13 -1.90 0.00 2.29 3.41 -1.26 -5.04 113.62 116.25 1aw6 n SER 41 Ca -0.12 0.56 0.00 0.00 -0.26 0.00 0.00 58.87 59.05 1aw6 n SER 41 Cb 0.43 1.91 0.00 0.00 -0.26 0.00 0.00 64.21 66.29 1aw6 n SER 41 CO 0.00 0.00 0.00 -2.65 -0.16 0.00 0.00 175.04 172.23 1aw6 n PRO 42 N -3.23 0.00 -0.26 4.33 -0.02 -1.26 -5.26 135.00 129.30 1aw6 n PRO 42 Ca 0.00 0.49 0.00 0.00 -2.02 0.00 0.00 63.50 61.97 1aw6 n PRO 42 Cb 0.00 -0.83 0.00 0.00 -0.02 0.00 0.00 33.50 32.65 1aw6 n PRO 42 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65