#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1aw6 s LYS 2 N 0.00 0.57 0.19 0.03 2.47 -1.26 -5.13 119.74 116.61 1aw6 s LYS 2 Ca 0.00 1.35 0.00 0.00 -1.56 0.00 0.00 55.97 55.76 1aw6 s LYS 2 Cb 0.00 0.81 0.00 0.00 -1.46 0.00 0.00 37.83 37.18 1aw6 s LYS 2 CO 0.00 -0.28 0.00 -0.11 0.16 0.00 0.00 175.35 175.12 1aw6 n LEU 3 N 5.43 -1.65 0.00 5.43 0.00 -1.26 -5.06 117.00 119.90 1aw6 n LEU 3 Ca -0.10 1.11 0.00 0.00 0.00 0.00 0.00 56.01 57.02 1aw6 n LEU 3 Cb 0.49 -0.44 0.00 0.00 0.00 0.00 0.00 43.42 43.47 1aw6 n LEU 3 CO -0.03 0.13 0.00 0.18 0.00 0.00 0.00 177.39 177.67 1aw6 n LEU 4 N -0.89 0.00 -4.99 -1.96 4.77 -1.26 -5.14 117.00 107.54 1aw6 n LEU 4 Ca 0.00 0.00 -0.25 0.00 -0.03 0.00 0.00 56.01 55.73 1aw6 n LEU 4 Cb 0.00 0.15 0.14 0.00 -2.33 0.00 0.00 43.42 41.38 1aw6 n LEU 4 CO 0.00 -0.43 0.63 -0.94 -1.33 0.00 0.00 177.39 175.32 1aw6 s SER 5 N -3.73 3.94 0.00 -1.43 1.04 -1.26 -5.10 113.70 107.16 1aw6 s SER 5 Ca 0.00 -0.36 0.00 0.00 0.48 0.00 0.00 55.95 56.07 1aw6 s SER 5 Cb 0.00 0.15 0.00 0.00 0.10 0.00 0.00 66.02 66.27 1aw6 s SER 5 CO 0.00 -2.16 0.00 -1.54 0.98 0.00 0.00 173.24 170.52 1aw6 n SER 6 N -3.08 0.00 -0.93 7.02 3.41 -1.26 -5.02 113.62 113.76 1aw6 n SER 6 Ca 0.17 0.00 -0.00 0.00 -0.26 0.00 0.00 58.87 58.77 1aw6 n SER 6 Cb 0.60 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.54 1aw6 n SER 6 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 1aw6 n ILE 7 N -0.42 0.00 -3.36 -1.33 -0.00 -1.26 -4.99 119.36 108.00 1aw6 n ILE 7 Ca 0.00 -0.31 -0.21 0.00 -0.00 0.00 0.00 62.75 62.23 1aw6 n ILE 7 Cb 0.00 0.56 -0.09 0.00 -0.00 0.00 0.00 39.64 40.11 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 0.67 -0.05 6.28 2.12 -1.26 -5.12 118.70 121.34 1aw6 s GLU 8 Ca 0.11 -1.16 -0.30 0.00 0.36 0.00 0.00 54.97 53.97 1aw6 s GLU 8 Cb 0.12 -0.93 -0.03 0.00 0.26 0.00 0.00 34.13 33.54 1aw6 s GLU 8 CO -0.05 -1.23 1.21 -0.65 -0.54 0.00 0.00 175.26 174.00 1aw6 s GLN 9 N 1.12 4.35 0.00 4.30 1.11 -1.26 -4.96 119.66 124.32 1aw6 s GLN 9 Ca 0.20 1.69 0.00 0.00 0.01 0.00 0.00 55.36 57.26 1aw6 s GLN 9 Cb -0.14 -3.55 0.00 0.00 -1.01 0.00 0.00 33.01 28.31 1aw6 s GLN 9 CO -0.04 -0.44 0.00 0.00 0.01 0.00 0.00 175.29 174.82 1aw6 n ALA 10 N 5.15 0.00 -1.37 6.09 0.00 -1.26 -5.04 120.51 124.08 1aw6 n ALA 10 Ca 0.11 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.26 1aw6 n ALA 10 Cb 0.46 0.00 0.16 0.00 0.00 0.00 0.00 19.45 20.07 1aw6 n ALA 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1aw6 h ASP 12 N -1.71 0.78 0.31 0.00 3.58 -1.68 -2.80 116.42 114.90 1aw6 h ASP 12 Ca -0.52 0.00 -0.05 0.00 0.42 0.00 0.00 57.03 56.88 1aw6 h ASP 12 Cb 1.33 -0.17 -0.01 0.00 1.72 0.00 0.00 39.33 42.21 1aw6 h ASP 12 CO 0.60 0.54 -0.23 0.40 -2.88 0.00 0.00 179.24 177.66 1aw6 h ILE 13 N 0.92 1.03 0.03 2.25 1.08 -1.88 -1.80 117.51 119.15 1aw6 h ILE 13 Ca 0.31 -0.84 -0.22 0.00 -0.39 0.00 0.00 64.86 63.72 1aw6 h ILE 13 Cb 0.03 1.47 -0.01 0.00 -3.07 0.00 0.00 36.82 35.24 1aw6 h ILE 13 CO -0.12 0.23 -1.00 0.00 -0.69 0.00 0.00 178.15 176.57 1aw6 h ARG 15 N 0.08 -0.33 0.10 0.00 3.08 -1.11 -1.08 114.38 115.12 1aw6 h ARG 15 Ca -0.06 0.02 -0.00 0.00 0.07 0.00 0.00 59.98 60.01 1aw6 h ARG 15 Cb 1.68 0.07 0.00 0.00 0.08 0.00 0.00 29.97 31.80 1aw6 h ARG 15 CO 0.15 -0.22 -0.05 -0.07 -1.07 0.00 0.00 179.97 178.72 1aw6 h LEU 16 N -0.34 -0.11 -0.53 3.04 4.07 -1.58 -2.95 115.31 116.91 1aw6 h LEU 16 Ca 0.01 -0.27 0.00 0.00 0.08 0.00 0.00 57.88 57.70 1aw6 h LEU 16 Cb 0.38 0.03 0.00 0.00 1.08 0.00 0.00 40.66 42.15 1aw6 h LEU 16 CO -0.22 0.22 0.00 0.11 -1.08 0.00 0.00 178.44 177.47 1aw6 h LYS 17 N -0.45 0.00 -5.30 1.13 1.79 -1.58 -3.47 116.57 108.69 1aw6 h LYS 17 Ca -0.01 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.46 1aw6 h LYS 17 Cb 0.37 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.02 1aw6 h LYS 17 CO 0.02 0.00 -0.14 1.63 -1.08 0.00 0.00 179.45 179.88 1aw6 n LYS 18 N -2.85 -1.60 -4.30 3.15 5.02 -0.43 -5.05 118.16 112.10 1aw6 n LYS 18 Ca 0.03 1.66 -0.19 0.00 -2.02 0.00 0.00 58.31 57.79 1aw6 n LYS 18 Cb 0.41 -5.66 -0.11 0.00 -0.02 0.00 0.00 35.03 29.65 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 -3.56 2.46 0.39 -0.35 1.02 -1.05 -5.06 118.68 112.54 1aw6 s LEU 19 Ca 0.07 -0.89 -0.24 0.00 0.02 0.00 0.00 54.13 53.09 1aw6 s LEU 19 Cb -0.02 -0.66 -0.10 0.00 0.02 0.00 0.00 46.19 45.43 1aw6 s LEU 19 CO 0.74 -0.12 0.99 -0.54 0.02 0.00 0.00 176.35 177.44 1aw6 s LYS 20 N -3.02 4.27 -0.55 1.70 3.01 -1.26 -4.81 119.74 119.07 1aw6 s LYS 20 Ca 0.15 1.35 0.04 0.00 -1.01 0.00 0.00 55.97 56.51 1aw6 s LYS 20 Cb -0.04 -2.49 0.17 0.00 -1.01 0.00 0.00 37.83 34.46 1aw6 s LYS 20 CO 0.05 -0.02 0.41 0.00 0.51 0.00 0.00 175.35 176.30 1aw6 h SER 22 N 5.52 0.00 0.00 0.00 4.64 -1.99 -3.45 113.55 118.27 1aw6 h SER 22 Ca 0.21 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.53 1aw6 h SER 22 Cb 0.84 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.93 1aw6 h SER 22 CO 0.53 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.78 1aw6 n LYS 23 N -3.50 0.00 -1.25 4.77 5.02 -1.26 -5.03 118.16 116.91 1aw6 n LYS 23 Ca 0.30 0.00 -0.37 0.00 -2.02 0.00 0.00 58.31 56.22 1aw6 n LYS 23 Cb 1.68 -2.24 0.04 0.00 -0.02 0.00 0.00 35.03 34.50 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 -2.69 0.21 -4.16 1.97 0.28 -1.26 -4.89 120.64 110.09 1aw6 n GLU 24 Ca 0.00 0.09 -0.16 0.00 -0.16 0.00 0.00 57.16 56.93 1aw6 n GLU 24 Cb 0.00 -1.47 -0.12 0.00 1.43 0.00 0.00 31.44 31.28 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 -2.06 0.65 0.10 3.44 1.02 -1.26 -2.71 119.74 118.91 1aw6 s LYS 25 Ca 0.60 -0.70 -0.17 0.00 0.02 0.00 0.00 55.97 55.72 1aw6 s LYS 25 Cb -0.38 -0.54 -0.07 0.00 -0.52 0.00 0.00 37.83 36.31 1aw6 s LYS 25 CO 0.63 0.12 1.53 -1.00 -0.92 0.00 0.00 175.35 175.71 1aw6 h PRO 26 N 4.81 0.52 -5.62 -1.68 0.13 -1.98 -3.48 132.00 124.70 1aw6 h PRO 26 Ca -0.36 -0.17 -0.65 0.00 -0.87 0.00 0.00 66.00 63.96 1aw6 h PRO 26 Cb 1.19 -0.04 -0.08 0.00 0.13 0.00 0.00 31.00 32.20 1aw6 h PRO 26 CO 0.43 0.67 -0.44 0.15 -0.23 0.00 0.00 178.00 178.58 1aw6 s LYS 27 N -4.97 3.67 0.57 0.86 -0.14 -1.26 -4.92 119.74 113.56 1aw6 s LYS 27 Ca -0.13 -0.06 -0.09 0.00 -1.36 0.00 0.00 55.97 54.32 1aw6 s LYS 27 Cb 0.08 -3.25 0.14 0.00 -1.68 0.00 0.00 37.83 33.13 1aw6 s LYS 27 CO 0.76 0.66 0.32 0.00 -0.76 0.00 0.00 175.35 176.33 1aw6 h ALA 29 N -2.54 1.03 -0.49 0.00 0.00 -1.96 -3.11 119.26 112.19 1aw6 h ALA 29 Ca -0.15 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.57 1aw6 h ALA 29 Cb 0.49 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1aw6 h ALA 29 CO 0.09 0.65 0.00 1.17 0.00 0.00 0.00 179.25 181.16 1aw6 n LYS 30 N -4.29 0.00 -0.35 0.00 3.00 -1.26 -1.82 118.16 113.43 1aw6 n LYS 30 Ca 0.07 0.77 -0.03 0.00 -0.00 0.00 0.00 58.31 59.13 1aw6 n LYS 30 Cb 0.19 -1.42 0.11 0.00 0.00 0.00 0.00 35.03 33.91 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 1.31 0.76 -0.76 0.00 6.46 -1.52 0.56 115.31 122.12 1aw6 h LEU 32 Ca 0.34 0.00 -0.13 0.00 -0.12 0.00 0.00 57.88 57.97 1aw6 h LEU 32 Cb -0.08 -0.16 -0.02 0.00 -0.73 0.00 0.00 40.66 39.67 1aw6 h LEU 32 CO -0.07 0.50 -0.60 0.11 -0.62 0.00 0.00 178.44 177.77 1aw6 h LYS 33 N 0.87 0.08 -0.17 1.25 1.57 -0.44 -3.15 116.57 116.58 1aw6 h LYS 33 Ca 0.33 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 59.06 1aw6 h LYS 33 Cb 0.18 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.50 1aw6 h LYS 33 CO -0.11 0.65 0.00 0.09 -0.57 0.00 0.00 179.45 179.51 1aw6 n ASN 34 N -3.85 2.33 -3.09 0.86 3.02 -0.72 -5.03 115.26 108.79 1aw6 n ASN 34 Ca -0.02 -1.73 -0.17 0.00 -0.03 0.00 0.00 54.58 52.63 1aw6 n ASN 34 Cb 0.60 -0.11 0.02 0.00 -0.61 0.00 0.00 39.78 39.68 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 0.40 -7.02 -4.36 6.41 4.05 0.19 -5.04 115.26 109.89 1aw6 n ASN 35 Ca 0.08 0.42 -0.24 0.00 0.45 0.00 0.00 54.58 55.29 1aw6 n ASN 35 Cb 0.32 -3.77 -0.10 0.00 1.23 0.00 0.00 39.78 37.47 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 -1.94 1.90 -0.92 1.20 0.51 -0.61 -5.01 118.94 114.07 1aw6 s TRP 36 Ca 0.24 -1.07 0.00 0.00 -2.12 0.00 0.00 56.10 53.15 1aw6 s TRP 36 Cb -0.04 -1.26 0.31 0.00 -0.81 0.00 0.00 33.47 31.67 1aw6 s TRP 36 CO 0.73 -0.08 1.44 -1.91 -0.51 0.00 0.00 176.95 176.62 1aw6 n GLU 37 N -0.79 4.42 -1.51 4.98 2.13 -1.26 -4.82 120.64 123.78 1aw6 n GLU 37 Ca -0.04 -4.67 -0.36 0.00 0.66 0.00 0.00 57.16 52.74 1aw6 n GLU 37 Cb 0.66 -2.42 -0.13 0.00 0.27 0.00 0.00 31.44 29.82 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 8.56 1.82 -0.94 0.00 3.52 -1.26 -4.78 118.95 125.87 1aw6 s ARG 39 Ca 1.26 -2.27 -0.02 0.00 -0.13 0.00 0.00 55.73 54.57 1aw6 s ARG 39 Cb -0.93 -3.32 0.31 0.00 -1.56 0.00 0.00 34.95 29.45 1aw6 s ARG 39 CO 0.44 -1.04 1.99 2.48 -0.81 0.00 0.00 175.30 178.36 1aw6 n TYR 40 N 3.69 2.80 -3.03 5.12 4.11 -1.26 -1.76 117.16 126.83 1aw6 n TYR 40 Ca 0.04 -2.43 -0.09 0.00 -0.00 0.00 0.00 57.90 55.42 1aw6 n TYR 40 Cb 0.37 -1.24 -0.02 0.00 -0.00 0.00 0.00 39.34 38.45 1aw6 n TYR 40 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.86 177.31 1aw6 s SER 41 N -1.06 -0.60 0.00 9.48 0.15 -1.26 -4.86 113.70 115.55 1aw6 s SER 41 Ca 0.47 -1.81 0.00 0.00 0.70 0.00 0.00 55.95 55.31 1aw6 s SER 41 Cb 0.31 1.31 0.00 0.00 -1.71 0.00 0.00 66.02 65.93 1aw6 s SER 41 CO -0.26 -0.12 0.41 -2.65 1.20 0.00 0.00 173.24 171.82 1aw6 n PRO 42 N 3.34 0.00 0.00 5.44 -0.02 -1.26 -5.14 135.00 137.35 1aw6 n PRO 42 Ca 0.18 0.37 0.00 0.00 -2.02 0.00 0.00 63.50 62.03 1aw6 n PRO 42 Cb 0.53 -0.91 0.00 0.00 -0.02 0.00 0.00 33.50 33.10 1aw6 n PRO 42 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65