#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2a1d s ASN 1 N 0.00 6.07 0.32 4.37 4.22 -1.26 -4.95 114.94 123.71 2a1d s ASN 1 Ca 0.00 -0.45 0.22 0.00 -2.14 0.00 0.00 52.86 50.49 2a1d s ASN 1 Cb 0.00 -2.14 1.12 0.00 1.28 0.00 0.00 41.25 41.50 2a1d s ASN 1 CO 0.00 -0.26 1.21 -0.62 -2.04 0.00 0.00 177.10 175.39 2a1d n GLU 1 N 5.13 -0.03 0.00 3.55 4.71 -1.26 0.13 120.64 132.86 2a1d n GLU 1 Ca -0.12 1.00 0.00 0.00 -0.01 0.00 0.00 57.16 58.03 2a1d n GLU 1 Cb 0.49 -1.91 0.00 0.00 -1.01 0.00 0.00 31.44 29.01 2a1d n GLU 1 CO 0.00 0.00 0.00 0.36 0.09 0.00 0.00 177.13 177.58 2a1d n LYS 1 N -4.39 0.00 0.00 3.49 2.85 -1.26 -0.38 118.16 118.46 2a1d n LYS 1 Ca 0.31 0.49 0.00 0.00 -1.05 0.00 0.00 58.31 58.05 2a1d n LYS 1 Cb 1.14 -1.50 0.00 0.00 -0.65 0.00 0.00 35.03 34.02 2a1d n LYS 1 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 177.40 177.60 2a1d n THR 1 N -1.49 0.00 0.49 0.58 -2.24 0.35 -4.82 114.28 107.15 2a1d n THR 1 Ca 0.00 0.00 0.10 0.00 -2.27 0.00 0.00 64.05 61.88 2a1d n THR 1 Cb 0.00 -0.37 -0.14 0.00 -2.10 0.00 0.00 70.33 67.72 2a1d n THR 1 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 2a1d n PHE 1 N -1.13 0.00 0.00 4.78 7.35 -0.84 -5.03 117.46 122.59 2a1d n PHE 1 Ca 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.69 2a1d n PHE 1 Cb 0.20 -0.24 0.00 0.00 0.35 0.00 0.00 39.48 39.80 2a1d n PHE 1 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 2a1d n GLY 1 N 1.39 -0.81 3.93 7.13 0.00 0.49 -4.96 105.19 112.37 2a1d n GLY 1 Ca 0.00 -1.68 -0.25 0.00 0.00 0.00 0.00 46.02 44.08 2a1d n GLY 1 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a1d s ALA 1 N -1.75 3.27 0.00 4.61 0.00 -1.26 -4.31 121.76 122.31 2a1d s ALA 1 Ca 0.00 -0.94 0.00 0.00 0.00 0.00 0.00 51.96 51.02 2a1d s ALA 1 Cb 0.00 -2.54 0.00 0.00 0.00 0.00 0.00 23.12 20.58 2a1d s ALA 1 CO 0.00 -1.15 0.00 0.41 0.00 0.00 0.00 175.76 175.02 2a1d n GLY 1 N -2.79 2.18 0.20 0.00 0.00 -1.26 -4.97 105.19 98.55 2a1d n GLY 1 Ca 0.07 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.03 2a1d n GLY 1 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2a1d h GLU 1 N 0.62 -0.07 -0.33 1.61 4.57 -1.95 0.32 114.58 119.36 2a1d h GLU 1 Ca 0.00 0.00 0.05 0.00 -1.18 0.00 0.00 59.36 58.24 2a1d h GLU 1 Cb 0.00 0.02 -0.05 0.00 -0.16 0.00 0.00 28.75 28.56 2a1d h GLU 1 CO 0.00 -0.05 0.03 0.00 -1.18 0.00 0.00 179.01 177.81 2a1d h ALA 1 N 1.22 0.32 0.00 2.92 0.00 -1.95 -2.95 119.26 118.82 2a1d h ALA 1 Ca 0.17 0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.16 2a1d h ALA 1 Cb 0.33 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.25 2a1d h ALA 1 CO -0.39 -0.38 -0.40 -0.25 0.00 0.00 0.00 179.25 177.83 2a1d n ASP 1 N -5.14 0.62 -1.96 0.00 10.43 -0.98 -4.99 116.55 114.54 2a1d n ASP 1 Ca 0.01 0.20 -0.18 0.00 2.57 0.00 0.00 54.79 57.39 2a1d n ASP 1 Cb 0.16 -0.11 0.01 0.00 1.84 0.00 0.00 41.12 43.03 2a1d n ASP 1 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 2a1d n GLY 2 N 1.47 0.86 3.40 0.00 0.00 -1.26 -4.97 105.19 104.69 2a1d n GLY 2 Ca 0.01 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.65 2a1d n GLY 2 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2a1d s LEU 3 N 0.00 4.15 -0.56 0.99 1.43 -1.14 -5.02 118.68 118.52 2a1d s LEU 3 Ca 0.00 -0.67 -0.28 0.00 -1.03 0.00 0.00 54.13 52.15 2a1d s LEU 3 Cb 0.00 -1.97 0.03 0.00 0.03 0.00 0.00 46.19 44.28 2a1d s LEU 3 CO 0.00 -0.23 1.19 -0.13 0.23 0.00 0.00 176.35 177.41 2a1d s ARG 4 N 1.57 3.54 0.46 1.70 0.52 -1.26 -4.79 118.95 120.69 2a1d s ARG 4 Ca 0.03 0.32 0.11 0.00 -0.52 0.00 0.00 55.73 55.67 2a1d s ARG 4 Cb -0.17 -4.00 0.58 0.00 0.52 0.00 0.00 34.95 31.88 2a1d s ARG 4 CO 0.05 -1.64 1.23 -1.35 0.02 0.00 0.00 175.30 173.61 2a1d h PRO 5 N 9.55 0.00 -0.22 3.54 0.11 -1.95 0.85 132.00 143.88 2a1d h PRO 5 Ca -0.25 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.86 2a1d h PRO 5 Cb 1.06 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.17 2a1d h PRO 5 CO 1.18 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 180.25 2a1d n LEU 6 N -2.23 2.57 0.00 2.35 4.77 -1.26 -4.71 117.00 118.49 2a1d n LEU 6 Ca -0.01 -1.95 0.00 0.00 -0.03 0.00 0.00 56.01 54.03 2a1d n LEU 6 Cb 0.57 -0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.52 2a1d n LEU 6 CO 0.05 0.64 0.00 0.49 -1.33 0.00 0.00 177.39 177.24 2a1d n PHE 7 N 0.19 -0.11 0.00 -1.77 3.72 0.26 -4.86 117.46 114.90 2a1d n PHE 7 Ca 0.08 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.48 2a1d n PHE 7 Cb 0.36 0.23 0.00 0.00 -0.94 0.00 0.00 39.48 39.13 2a1d n PHE 7 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 2a1d n GLU 8 N -1.70 0.00 -0.08 -1.08 4.71 0.71 0.59 120.64 123.79 2a1d n GLU 8 Ca 0.00 0.25 -0.01 0.00 -0.01 0.00 0.00 57.16 57.39 2a1d n GLU 8 Cb 0.00 -0.98 -0.01 0.00 -1.01 0.00 0.00 31.44 29.44 2a1d n GLU 8 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 2a1d n LYS 9 N -0.74 0.17 -0.00 3.49 5.02 -1.18 0.59 118.16 125.51 2a1d n LYS 9 Ca 0.00 -0.23 0.00 0.00 -2.02 0.00 0.00 58.31 56.06 2a1d n LYS 9 Cb 0.00 -1.69 0.00 0.00 -0.02 0.00 0.00 35.03 33.32 2a1d n LYS 9 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2a1d n LYS 10 N 3.55 0.00 -4.06 1.97 5.02 -1.11 -4.80 118.16 118.73 2a1d n LYS 10 Ca 0.04 0.00 -0.29 0.00 -2.02 0.00 0.00 58.31 56.04 2a1d n LYS 10 Cb 0.05 0.00 -0.03 0.00 -0.02 0.00 0.00 35.03 35.03 2a1d n LYS 10 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 2a1d n GLN 11 N 0.00 -3.01 -4.06 1.97 3.00 0.20 -4.93 117.38 110.55 2a1d n GLN 11 Ca 0.00 0.36 -0.32 0.00 -0.01 0.00 0.00 57.00 57.03 2a1d n GLN 11 Cb 0.02 -4.56 -0.15 0.00 0.00 0.00 0.00 30.24 25.55 2a1d n GLN 11 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.06 177.14 2a1d s VAL 12 N -3.85 2.22 0.37 5.09 1.01 0.20 -5.02 120.40 120.43 2a1d s VAL 12 Ca 0.18 -1.61 -0.18 0.00 0.00 0.00 0.00 61.98 60.37 2a1d s VAL 12 Cb -0.10 -2.30 -0.10 0.00 0.00 0.00 0.00 36.38 33.88 2a1d s VAL 12 CO 0.91 -0.03 0.84 0.00 0.00 0.00 0.00 175.10 176.83 2a1d s GLN 13 N 1.11 4.12 0.26 2.72 1.03 -1.26 -3.98 119.66 123.66 2a1d s GLN 13 Ca -0.09 0.90 -0.03 0.00 0.04 0.00 0.00 55.36 56.18 2a1d s GLN 13 Cb -0.20 -2.31 -0.05 0.00 0.03 0.00 0.00 33.01 30.48 2a1d s GLN 13 CO -0.05 0.07 0.50 0.16 -2.54 0.00 0.00 175.29 173.43 2a1d s ASP 14 N -2.22 6.42 0.52 12.60 1.47 -1.26 -4.96 116.67 129.23 2a1d s ASP 14 Ca 0.58 0.59 0.22 0.00 1.18 0.00 0.00 52.55 55.12 2a1d s ASP 14 Cb -0.10 -2.09 0.74 0.00 -0.34 0.00 0.00 42.92 41.13 2a1d s ASP 14 CO 0.15 -0.15 1.09 0.00 0.68 0.00 0.00 175.17 176.94 2a1d n GLN 14 N -0.89 0.01 -2.79 2.11 1.13 -1.26 -1.47 117.38 114.22 2a1d n GLN 14 Ca -0.03 0.86 -0.11 0.00 -1.94 0.00 0.00 57.00 55.79 2a1d n GLN 14 Cb 0.54 -2.15 0.03 0.00 0.11 0.00 0.00 30.24 28.76 2a1d n GLN 14 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 2a1d n THR 14 N -2.91 0.59 -0.11 5.09 -2.24 -1.26 -4.91 114.28 108.52 2a1d n THR 14 Ca 0.19 -3.20 -0.22 0.00 -2.27 0.00 0.00 64.05 58.56 2a1d n THR 14 Cb 1.29 0.52 -0.09 0.00 -2.10 0.00 0.00 70.33 69.95 2a1d n THR 14 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 2a1d n GLU 14 N -0.02 0.56 -0.07 -0.78 2.13 -0.54 -4.15 120.64 117.77 2a1d n GLU 14 Ca 0.11 0.38 0.24 0.00 0.66 0.00 0.00 57.16 58.56 2a1d n GLU 14 Cb 0.78 -1.58 0.72 0.00 0.27 0.00 0.00 31.44 31.62 2a1d n GLU 14 CO 0.00 0.00 0.00 1.57 -0.41 0.00 0.00 177.13 178.29 2a1d h LYS 14 N -1.00 0.00 -0.59 5.31 2.10 -1.91 0.21 116.57 120.69 2a1d h LYS 14 Ca -0.42 0.00 0.15 0.00 -2.00 0.00 0.00 60.65 58.38 2a1d h LYS 14 Cb 1.32 0.00 -0.03 0.00 -0.90 0.00 0.00 32.23 32.62 2a1d h LYS 14 CO -0.26 0.00 0.41 1.49 -2.00 0.00 0.00 179.45 179.10 2a1d h GLU 14 N 0.00 0.12 0.03 0.07 4.81 -1.93 0.46 114.58 118.14 2a1d h GLU 14 Ca 0.33 -0.01 -0.22 0.00 -0.13 0.00 0.00 59.36 59.33 2a1d h GLU 14 Cb 1.37 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.70 2a1d h GLU 14 CO -0.00 0.08 -1.03 -0.07 -0.73 0.00 0.00 179.01 177.26 2a1d h LEU 14 N 0.13 0.13 -0.25 1.64 4.07 -0.78 -3.04 115.31 117.20 2a1d h LEU 14 Ca 0.28 -0.13 0.00 0.00 0.08 0.00 0.00 57.88 58.11 2a1d h LEU 14 Cb 0.94 -0.04 0.00 0.00 1.08 0.00 0.00 40.66 42.64 2a1d h LEU 14 CO -0.04 1.07 0.00 0.49 -1.08 0.00 0.00 178.44 178.89 2a1d n PHE 14 N -3.44 0.73 0.16 1.13 3.72 0.13 -2.02 117.46 117.86 2a1d n PHE 14 Ca -0.02 0.24 0.05 0.00 -0.05 0.00 0.00 57.45 57.66 2a1d n PHE 14 Cb 0.93 -0.89 0.14 0.00 -0.94 0.00 0.00 39.48 38.72 2a1d n PHE 14 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 2a1d h GLU 14 N 0.00 0.00 0.00 -1.08 4.39 -0.59 -3.06 114.58 114.23 2a1d h GLU 14 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2a1d h GLU 14 Cb 0.54 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.19 2a1d h GLU 14 CO 0.00 0.41 -0.51 0.66 -1.16 0.00 0.00 179.01 178.40 2a1d h SER 14 N 0.00 0.00 0.03 1.42 4.64 -1.44 -3.36 113.55 114.84 2a1d h SER 14 Ca -0.00 -0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.16 2a1d h SER 14 Cb 1.20 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.31 2a1d h SER 14 CO 0.05 0.00 -0.60 1.88 -0.87 0.00 0.00 176.83 177.30 2a1d h TYR 14 N 0.00 0.55 -3.23 4.77 0.05 -1.42 -3.44 116.97 114.24 2a1d h TYR 14 Ca 0.00 -0.32 -0.49 0.00 0.05 0.00 0.00 58.73 57.97 2a1d h TYR 14 Cb 0.99 -0.05 -0.40 0.00 1.01 0.00 0.00 36.73 38.28 2a1d h TYR 14 CO 0.00 1.16 -0.76 -1.50 -1.05 0.00 0.00 178.16 176.01 2a1d s ILE 14 N -3.02 0.38 -1.07 -2.88 2.07 -1.22 -4.99 121.20 110.48 2a1d s ILE 14 Ca -0.14 -0.36 0.25 0.00 -1.41 0.00 0.00 60.65 58.99 2a1d s ILE 14 Cb 0.03 -0.86 0.02 0.00 0.13 0.00 0.00 42.46 41.78 2a1d s ILE 14 CO 0.81 -0.14 1.41 -1.84 -1.91 0.00 0.00 174.94 173.28 2a1d n GLU 14 N 5.11 0.08 -0.91 3.50 -0.00 -1.26 -4.80 120.64 122.36 2a1d n GLU 14 Ca -0.08 -0.05 0.00 0.00 -0.00 0.00 0.00 57.16 57.03 2a1d n GLU 14 Cb 0.48 -1.50 0.00 0.00 -0.00 0.00 0.00 31.44 30.42 2a1d n GLU 14 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2a1d n GLY 14 N 1.48 5.88 3.89 -1.84 0.00 -1.26 -5.19 105.19 108.15 2a1d n GLY 14 Ca 0.06 -1.99 0.00 0.00 0.00 0.00 0.00 46.02 44.09 2a1d n GLY 14 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86