#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1aw6 n LYS 2 N 0.00 0.09 -1.83 0.03 2.85 -1.26 -5.14 118.16 112.90 1aw6 n LYS 2 Ca 0.00 -0.83 -0.40 0.00 -1.05 0.00 0.00 58.31 56.03 1aw6 n LYS 2 Cb 0.00 0.49 0.01 0.00 -0.65 0.00 0.00 35.03 34.88 1aw6 n LYS 2 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 1aw6 s LEU 3 N -0.27 4.21 0.00 -5.58 1.43 -1.26 -4.18 118.68 113.03 1aw6 s LEU 3 Ca 0.01 2.94 0.00 0.00 -1.03 0.00 0.00 54.13 56.04 1aw6 s LEU 3 Cb 0.03 -3.83 0.00 0.00 0.03 0.00 0.00 46.19 42.42 1aw6 s LEU 3 CO -0.01 -1.02 0.00 0.18 0.23 0.00 0.00 176.35 175.73 1aw6 n LEU 4 N 0.10 0.00 0.00 1.79 4.32 -1.26 -4.89 117.00 117.06 1aw6 n LEU 4 Ca 0.03 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 56.02 1aw6 n LEU 4 Cb 0.41 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.21 1aw6 n LEU 4 CO 0.60 0.00 0.00 -1.20 -1.22 0.00 0.00 177.39 175.57 1aw6 n SER 5 N 4.76 -0.29 -3.70 -1.43 7.64 -1.26 -4.17 113.62 115.17 1aw6 n SER 5 Ca 0.00 0.00 -0.30 0.00 1.01 0.00 0.00 58.87 59.58 1aw6 n SER 5 Cb 0.00 0.00 -0.14 0.00 -1.01 0.00 0.00 64.21 63.06 1aw6 n SER 5 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1aw6 s SER 6 N -4.00 3.77 0.00 6.43 0.15 -1.26 -4.80 113.70 113.99 1aw6 s SER 6 Ca 0.00 -2.13 0.00 0.00 0.70 0.00 0.00 55.95 54.52 1aw6 s SER 6 Cb 0.00 -0.90 0.00 0.00 -1.71 0.00 0.00 66.02 63.41 1aw6 s SER 6 CO 0.00 -0.34 0.00 0.00 1.20 0.00 0.00 173.24 174.10 1aw6 n ILE 7 N 4.19 0.00 -2.96 6.45 0.00 -1.26 -5.07 119.36 120.71 1aw6 n ILE 7 Ca 0.04 0.00 -0.44 0.00 0.00 0.00 0.00 62.75 62.35 1aw6 n ILE 7 Cb 0.38 0.00 -0.01 0.00 0.00 0.00 0.00 39.64 40.01 1aw6 n ILE 7 CO 0.00 0.00 0.00 -0.70 0.00 0.00 0.00 176.55 175.85 1aw6 s GLU 8 N 0.00 3.91 0.64 9.51 2.56 -1.26 -5.00 118.70 129.06 1aw6 s GLU 8 Ca 0.00 -2.30 -0.18 0.00 0.00 0.00 0.00 54.97 52.49 1aw6 s GLU 8 Cb 0.00 -4.98 -0.01 0.00 2.00 0.00 0.00 34.13 31.14 1aw6 s GLU 8 CO 0.00 -1.74 1.26 -1.14 -0.56 0.00 0.00 175.26 173.08 1aw6 s GLN 9 N 1.86 2.61 -0.02 4.30 2.00 -1.26 -4.83 119.66 124.32 1aw6 s GLN 9 Ca 0.38 1.97 -0.09 0.00 -2.00 0.00 0.00 55.36 55.63 1aw6 s GLN 9 Cb -0.04 -1.86 0.01 0.00 0.80 0.00 0.00 33.01 31.92 1aw6 s GLN 9 CO -0.04 -1.53 0.19 0.00 -0.50 0.00 0.00 175.29 173.41 1aw6 s ALA 10 N -1.51 -0.47 1.23 1.58 0.00 -1.26 -5.06 121.76 116.27 1aw6 s ALA 10 Ca 0.80 0.14 -0.15 0.00 0.00 0.00 0.00 51.96 52.76 1aw6 s ALA 10 Cb -0.35 -0.01 0.29 0.00 0.00 0.00 0.00 23.12 23.05 1aw6 s ALA 10 CO 0.39 -0.19 0.86 0.00 0.00 0.00 0.00 175.76 176.82 1aw6 h ASP 12 N -2.82 -1.03 0.72 0.00 1.82 -1.60 -3.12 116.42 110.40 1aw6 h ASP 12 Ca -0.59 0.05 0.00 0.00 -0.39 0.00 0.00 57.03 56.10 1aw6 h ASP 12 Cb 1.33 0.29 0.00 0.00 0.68 0.00 0.00 39.33 41.63 1aw6 h ASP 12 CO 0.45 -0.66 0.00 -0.38 -1.61 0.00 0.00 179.24 177.04 1aw6 n ILE 13 N -5.56 0.63 0.12 2.25 5.41 -1.26 -0.41 119.36 120.53 1aw6 n ILE 13 Ca -0.14 0.14 -0.01 0.00 1.00 0.00 0.00 62.75 63.74 1aw6 n ILE 13 Cb 0.45 -0.82 0.06 0.00 -0.71 0.00 0.00 39.64 38.61 1aw6 n ILE 13 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1aw6 h ARG 15 N 0.00 -0.98 -0.37 0.00 2.43 -0.68 -2.65 114.38 112.13 1aw6 h ARG 15 Ca -0.01 0.07 -0.11 0.00 -0.81 0.00 0.00 59.98 59.12 1aw6 h ARG 15 Cb 1.38 0.22 -0.01 0.00 -0.42 0.00 0.00 29.97 31.14 1aw6 h ARG 15 CO 0.09 -0.66 -0.20 1.37 -1.51 0.00 0.00 179.97 179.06 1aw6 h LEU 16 N -1.16 0.82 -0.21 3.80 8.10 -1.56 -2.87 115.31 122.23 1aw6 h LEU 16 Ca -0.10 -0.41 -0.11 0.00 0.11 0.00 0.00 57.88 57.36 1aw6 h LEU 16 Cb 0.78 -0.23 -0.02 0.00 -0.44 0.00 0.00 40.66 40.76 1aw6 h LEU 16 CO 0.17 1.05 -0.52 0.50 -4.11 0.00 0.00 178.44 175.54 1aw6 h LYS 17 N 0.59 0.00 -5.25 0.17 1.63 -1.59 -3.48 116.57 108.63 1aw6 h LYS 17 Ca 0.08 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.88 1aw6 h LYS 17 Cb 0.76 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.39 1aw6 h LYS 17 CO 0.06 0.52 -0.08 1.63 -3.45 0.00 0.00 179.45 178.12 1aw6 n LYS 18 N -3.30 -1.44 -4.03 1.90 5.02 -1.02 -5.05 118.16 110.25 1aw6 n LYS 18 Ca 0.01 1.56 -0.23 0.00 -2.02 0.00 0.00 58.31 57.63 1aw6 n LYS 18 Cb 0.70 -5.57 -0.06 0.00 -0.02 0.00 0.00 35.03 30.09 1aw6 n LYS 18 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1aw6 n LEU 19 N -1.49 0.00 -4.85 -0.35 4.32 -1.08 -5.06 117.00 108.48 1aw6 n LEU 19 Ca 0.02 -2.53 -0.33 0.00 -0.02 0.00 0.00 56.01 53.14 1aw6 n LEU 19 Cb 0.49 0.58 -0.06 0.00 -1.62 0.00 0.00 43.42 42.82 1aw6 n LEU 19 CO 0.50 -0.38 0.29 -0.54 -1.22 0.00 0.00 177.39 176.04 1aw6 s LYS 20 N -3.35 3.95 -0.42 3.23 -0.14 -1.26 -4.91 119.74 116.84 1aw6 s LYS 20 Ca 0.09 0.49 0.08 0.00 -1.36 0.00 0.00 55.97 55.27 1aw6 s LYS 20 Cb 0.00 -2.71 0.26 0.00 -1.68 0.00 0.00 37.83 33.71 1aw6 s LYS 20 CO 0.06 0.34 0.57 0.00 -0.76 0.00 0.00 175.35 175.56 1aw6 n SER 22 N 1.21 0.00 0.00 0.00 3.41 -1.26 -4.77 113.62 112.21 1aw6 n SER 22 Ca 0.23 0.71 0.00 0.00 -0.26 0.00 0.00 58.87 59.54 1aw6 n SER 22 Cb 0.53 -0.22 0.00 0.00 -0.26 0.00 0.00 64.21 64.26 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 -3.09 0.00 -1.14 4.33 5.02 -1.26 -5.03 118.16 116.99 1aw6 n LYS 23 Ca 0.20 0.00 -0.36 0.00 -2.02 0.00 0.00 58.31 56.13 1aw6 n LYS 23 Cb 1.43 -1.94 0.06 0.00 -0.02 0.00 0.00 35.03 34.56 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 -2.57 0.10 -4.07 1.97 0.28 -1.26 -4.87 120.64 110.21 1aw6 n GLU 24 Ca 0.00 0.06 -0.11 0.00 -0.16 0.00 0.00 57.16 56.95 1aw6 n GLU 24 Cb 0.00 -1.49 -0.11 0.00 1.43 0.00 0.00 31.44 31.27 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 -2.38 0.55 0.22 3.44 1.02 -1.26 -2.49 119.74 118.84 1aw6 s LYS 25 Ca 0.57 -0.89 -0.06 0.00 0.02 0.00 0.00 55.97 55.61 1aw6 s LYS 25 Cb -0.32 -0.14 0.18 0.00 -0.52 0.00 0.00 37.83 37.03 1aw6 s LYS 25 CO 0.66 -0.00 1.71 -1.00 -0.92 0.00 0.00 175.35 175.80 1aw6 h PRO 26 N 4.09 1.00 -5.85 -1.68 0.13 -1.98 -3.48 132.00 124.23 1aw6 h PRO 26 Ca -0.35 -0.27 -0.68 0.00 -0.87 0.00 0.00 66.00 63.83 1aw6 h PRO 26 Cb 1.19 -0.11 -0.12 0.00 0.13 0.00 0.00 31.00 32.09 1aw6 h PRO 26 CO 0.48 0.95 -0.57 0.15 -0.23 0.00 0.00 178.00 178.78 1aw6 s LYS 27 N -5.10 3.15 0.42 0.86 1.02 -1.26 -4.87 119.74 113.97 1aw6 s LYS 27 Ca -0.11 -0.31 -0.07 0.00 0.02 0.00 0.00 55.97 55.51 1aw6 s LYS 27 Cb 0.14 -2.94 0.10 0.00 -0.52 0.00 0.00 37.83 34.62 1aw6 s LYS 27 CO 0.84 0.73 0.23 0.00 -0.92 0.00 0.00 175.35 176.23 1aw6 h ALA 29 N -2.34 0.74 -0.33 0.00 0.00 -1.94 -3.09 119.26 112.30 1aw6 h ALA 29 Ca -0.11 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1aw6 h ALA 29 Cb 0.36 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1aw6 h ALA 29 CO 0.06 0.29 0.00 1.17 0.00 0.00 0.00 179.25 180.78 1aw6 n LYS 30 N -4.56 0.00 -0.32 0.00 3.00 -1.26 -1.80 118.16 113.22 1aw6 n LYS 30 Ca 0.03 0.78 -0.03 0.00 -0.00 0.00 0.00 58.31 59.10 1aw6 n LYS 30 Cb 0.11 -1.44 0.09 0.00 0.00 0.00 0.00 35.03 33.79 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 1.16 0.53 -0.53 0.00 6.46 -1.50 0.75 115.31 122.17 1aw6 h LEU 32 Ca 0.33 -0.01 -0.16 0.00 -0.12 0.00 0.00 57.88 57.91 1aw6 h LEU 32 Cb -0.10 -0.13 -0.01 0.00 -0.73 0.00 0.00 40.66 39.69 1aw6 h LEU 32 CO -0.08 0.38 -0.69 0.11 -0.62 0.00 0.00 178.44 177.54 1aw6 h LYS 33 N 0.62 0.24 -0.23 1.25 1.79 -0.46 -3.14 116.57 116.64 1aw6 h LYS 33 Ca 0.18 -0.19 0.00 0.00 -2.18 0.00 0.00 60.65 58.45 1aw6 h LYS 33 Cb -0.03 0.04 0.00 0.00 -1.58 0.00 0.00 32.23 30.65 1aw6 h LYS 33 CO -0.04 0.84 0.00 0.09 -1.08 0.00 0.00 179.45 179.26 1aw6 n ASN 34 N -3.81 2.63 -3.06 0.86 3.02 -0.77 -5.03 115.26 109.11 1aw6 n ASN 34 Ca -0.03 -1.80 -0.12 0.00 -0.03 0.00 0.00 54.58 52.61 1aw6 n ASN 34 Cb 0.68 -0.15 0.01 0.00 -0.61 0.00 0.00 39.78 39.71 1aw6 n ASN 34 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1aw6 n ASN 35 N 0.68 -7.06 -4.39 6.41 4.05 0.25 -5.04 115.26 110.16 1aw6 n ASN 35 Ca 0.11 0.58 -0.22 0.00 0.45 0.00 0.00 54.58 55.50 1aw6 n ASN 35 Cb 0.39 -3.57 -0.10 0.00 1.23 0.00 0.00 39.78 37.74 1aw6 n ASN 35 CO 0.00 0.00 0.00 0.26 -3.05 0.00 0.00 177.26 174.47 1aw6 s TRP 36 N -1.69 1.89 -1.03 1.20 0.51 -0.45 -5.00 118.94 114.37 1aw6 s TRP 36 Ca 0.16 -1.03 -0.02 0.00 -2.12 0.00 0.00 56.10 53.08 1aw6 s TRP 36 Cb -0.03 -1.23 0.31 0.00 -0.81 0.00 0.00 33.47 31.72 1aw6 s TRP 36 CO 0.62 -0.08 1.65 -1.91 -0.51 0.00 0.00 176.95 176.72 1aw6 n GLU 37 N -0.71 4.95 -1.51 4.98 4.07 -1.26 -4.80 120.64 126.36 1aw6 n GLU 37 Ca -0.03 -4.63 -0.28 0.00 -0.06 0.00 0.00 57.16 52.16 1aw6 n GLU 37 Cb 0.66 -2.48 -0.16 0.00 -0.06 0.00 0.00 31.44 29.40 1aw6 n GLU 37 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1aw6 s ARG 39 N 8.01 2.64 -0.26 0.00 3.52 -1.26 -4.80 118.95 126.80 1aw6 s ARG 39 Ca 1.25 -1.72 -0.12 0.00 -0.13 0.00 0.00 55.73 55.00 1aw6 s ARG 39 Cb -0.81 -4.02 -0.05 0.00 -1.56 0.00 0.00 34.95 28.51 1aw6 s ARG 39 CO 0.45 -1.21 0.24 0.71 -0.81 0.00 0.00 175.30 174.68 1aw6 s TYR 40 N 1.44 3.27 -0.40 5.12 2.02 -1.26 -1.56 117.35 125.97 1aw6 s TYR 40 Ca 0.05 0.26 -0.32 0.00 -0.37 0.00 0.00 57.07 56.69 1aw6 s TYR 40 Cb -0.27 -2.41 0.05 0.00 -0.40 0.00 0.00 41.96 38.93 1aw6 s TYR 40 CO 0.01 -0.10 0.59 -1.13 -1.57 0.00 0.00 175.55 173.35 1aw6 n SER 41 N 4.85 -6.02 0.00 2.29 3.41 -1.26 -4.96 113.62 111.93 1aw6 n SER 41 Ca -0.12 0.03 0.00 0.00 -0.26 0.00 0.00 58.87 58.51 1aw6 n SER 41 Cb 0.52 -2.28 0.00 0.00 -0.26 0.00 0.00 64.21 62.18 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 -0.05 0.00 -0.17 4.33 -0.02 -1.26 -5.21 135.00 132.62 1aw6 n PRO 42 Ca -0.05 0.12 0.00 0.00 -2.02 0.00 0.00 63.50 61.56 1aw6 n PRO 42 Cb 0.62 -1.05 0.00 0.00 -0.02 0.00 0.00 33.50 33.06 1aw6 n PRO 42 CO 0.00 0.00 0.00 0.36 1.98 0.00 0.00 175.50 177.84