#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b9p s ALA 2 N 0.00 2.84 -0.73 0.00 0.00 -1.26 -4.98 121.76 117.62 1b9p s ALA 2 Ca 0.00 0.84 0.04 0.00 0.00 0.00 0.00 51.96 52.83 1b9p s ALA 2 Cb 0.00 -3.35 0.28 0.00 0.00 0.00 0.00 23.12 20.05 1b9p s ALA 2 CO 0.00 -0.65 1.00 1.33 0.00 0.00 0.00 175.76 177.44 1b9p n VAL 3 N -0.89 3.32 -1.11 0.00 0.24 -1.26 -4.83 118.33 113.80 1b9p n VAL 3 Ca 0.09 -5.49 -0.04 0.00 -2.04 0.00 0.00 64.34 56.87 1b9p n VAL 3 Cb 0.50 -1.91 -0.02 0.00 -1.47 0.00 0.00 33.84 30.94 1b9p n VAL 3 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1b9p n GLU 4 N 0.63 -1.77 -1.87 7.34 -0.58 -1.26 -3.13 120.64 120.00 1b9p n GLU 4 Ca 0.31 0.61 -0.17 0.00 -0.42 0.00 0.00 57.16 57.48 1b9p n GLU 4 Cb 0.38 -5.00 -0.05 0.00 -0.57 0.00 0.00 31.44 26.21 1b9p n GLU 4 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 1b9p n LEU 5 N -0.44 -1.40 0.01 -4.62 7.99 -1.26 -4.58 117.00 112.69 1b9p n LEU 5 Ca -0.04 0.28 0.00 0.00 -0.01 0.00 0.00 56.01 56.25 1b9p n LEU 5 Cb 0.50 -2.52 0.00 0.00 -0.11 0.00 0.00 43.42 41.29 1b9p n LEU 5 CO 0.06 -0.61 0.00 -1.14 -1.51 0.00 0.00 177.39 174.18 1b9p n ARG 6 N -2.46 0.00 -2.17 3.23 0.63 -1.19 -5.12 116.66 109.58 1b9p n ARG 6 Ca -0.19 0.00 -0.05 0.00 -0.92 0.00 0.00 57.85 56.69 1b9p n ARG 6 Cb 0.60 0.00 0.01 0.00 0.45 0.00 0.00 32.46 33.52 1b9p n ARG 6 CO 0.00 0.00 0.00 0.43 -2.51 0.00 0.00 177.63 175.55 1b9p n SER 7 N -2.54 -3.71 -3.26 6.15 7.64 -1.18 -4.76 113.62 111.95 1b9p n SER 7 Ca 0.00 0.16 -0.32 0.00 1.01 0.00 0.00 58.87 59.72 1b9p n SER 7 Cb 0.00 -0.92 -0.02 0.00 -1.01 0.00 0.00 64.21 62.25 1b9p n SER 7 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 1b9p n PRO 8 N 0.73 3.04 0.00 1.43 -0.04 -1.26 -4.44 135.00 134.46 1b9p n PRO 8 Ca -0.01 -1.90 0.00 0.00 -0.04 0.00 0.00 63.50 61.55 1b9p n PRO 8 Cb 0.32 -2.66 0.00 0.00 -0.04 0.00 0.00 33.50 31.12 1b9p n PRO 8 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1b9p n GLY 9 N 3.66 -0.31 0.17 0.55 0.00 -1.26 -4.22 105.19 103.78 1b9p n GLY 9 Ca 0.65 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.57 1b9p n GLY 9 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1b9p h ILE 10 N 0.00 1.39 0.30 -0.61 2.04 -1.97 -2.91 117.51 115.74 1b9p h ILE 10 Ca 0.00 -2.20 -0.01 0.00 1.00 0.00 0.00 64.86 63.65 1b9p h ILE 10 Cb 0.00 2.16 0.00 0.00 -0.74 0.00 0.00 36.82 38.25 1b9p h ILE 10 CO 0.00 0.66 -0.15 0.28 0.00 0.00 0.00 178.15 178.94 1b9p h SER 11 N 0.25 -0.35 0.42 1.72 0.02 -1.86 0.49 113.55 114.24 1b9p h SER 11 Ca -0.04 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.93 1b9p h SER 11 Cb 1.34 0.09 0.00 0.00 0.14 0.00 0.00 62.40 63.97 1b9p h SER 11 CO 0.13 -0.25 0.00 -1.14 -1.14 0.00 0.00 176.83 174.43 1b9p n ARG 12 N -5.27 0.07 -0.11 3.45 0.00 -1.23 -1.41 116.66 112.17 1b9p n ARG 12 Ca -0.10 0.39 -0.25 0.00 -0.00 0.00 0.00 57.85 57.89 1b9p n ARG 12 Cb 0.18 -1.65 -0.11 0.00 0.00 0.00 0.00 32.46 30.88 1b9p n ARG 12 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.63 177.97 1b9p n PHE 13 N -1.79 0.45 0.10 -0.14 -0.00 -0.72 -4.42 117.46 110.93 1b9p n PHE 13 Ca 0.02 0.16 -0.05 0.00 -0.00 0.00 0.00 57.45 57.58 1b9p n PHE 13 Cb 0.14 -1.05 0.12 0.00 -0.00 0.00 0.00 39.48 38.69 1b9p n PHE 13 CO 0.00 0.00 0.00 0.07 -0.00 0.00 0.00 176.76 176.83 1b9p h ARG 14 N -0.71 0.18 -0.94 -4.13 0.11 0.04 -3.20 114.38 105.73 1b9p h ARG 14 Ca -0.55 -0.13 0.04 0.00 0.10 0.00 0.00 59.98 59.44 1b9p h ARG 14 Cb 1.62 0.02 -0.06 0.00 1.11 0.00 0.00 29.97 32.67 1b9p h ARG 14 CO -0.25 0.76 0.61 0.00 0.10 0.00 0.00 179.97 181.19 1b9p h ARG 15 N 0.13 1.12 -0.38 0.08 3.08 -1.44 -1.27 114.38 115.70 1b9p h ARG 15 Ca -0.01 -0.07 -0.14 0.00 0.07 0.00 0.00 59.98 59.84 1b9p h ARG 15 Cb 1.15 -0.25 -0.01 0.00 0.08 0.00 0.00 29.97 30.94 1b9p h ARG 15 CO 0.10 0.74 -0.30 -0.22 -1.07 0.00 0.00 179.97 179.22 1b9p h LYS 16 N 1.16 0.88 -0.60 0.04 3.64 -1.77 -2.45 116.57 117.47 1b9p h LYS 16 Ca 0.38 -0.43 0.03 0.00 -1.27 0.00 0.00 60.65 59.36 1b9p h LYS 16 Cb 0.05 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 31.83 1b9p h LYS 16 CO -0.14 1.08 0.37 0.82 -2.27 0.00 0.00 179.45 179.31 1b9p h ILE 17 N 0.69 1.07 -0.56 2.00 2.04 -1.40 -2.35 117.51 119.00 1b9p h ILE 17 Ca 0.07 -0.25 -0.03 0.00 1.00 0.00 0.00 64.86 65.65 1b9p h ILE 17 Cb 0.88 0.29 -0.02 0.00 -0.74 0.00 0.00 36.82 37.22 1b9p h ILE 17 CO 0.08 0.13 0.23 0.00 0.00 0.00 0.00 178.15 178.59 1b9p h ALA 18 N 1.26 0.72 -0.58 1.87 0.00 -1.16 -2.81 119.26 118.55 1b9p h ALA 18 Ca 0.24 -0.16 0.10 0.00 0.00 0.00 0.00 54.91 55.09 1b9p h ALA 18 Cb 0.01 -0.22 -0.08 0.00 0.00 0.00 0.00 17.79 17.51 1b9p h ALA 18 CO -0.10 0.33 0.15 -0.22 0.00 0.00 0.00 179.25 179.42 1b9p h LYS 19 N 0.76 0.29 -0.63 0.00 3.64 -0.93 -0.83 116.57 118.87 1b9p h LYS 19 Ca 0.19 -0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 59.51 1b9p h LYS 19 Cb 0.19 -0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 31.92 1b9p h LYS 19 CO -0.02 0.19 0.25 -0.09 -2.27 0.00 0.00 179.45 177.52 1b9p h ARG 20 N 0.30 0.95 -0.29 1.90 2.43 -1.30 -2.65 114.38 115.71 1b9p h ARG 20 Ca 0.30 -0.17 -0.12 0.00 -0.81 0.00 0.00 59.98 59.18 1b9p h ARG 20 Cb 0.42 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.81 1b9p h ARG 20 CO -0.36 0.80 -0.32 1.03 -1.51 0.00 0.00 179.97 179.61 1b9p h SER 21 N 0.89 0.64 0.06 -3.80 0.87 -1.11 -3.11 113.55 107.99 1b9p h SER 21 Ca 0.21 -0.25 -0.00 0.00 -1.23 0.00 0.00 61.79 60.51 1b9p h SER 21 Cb 0.21 -0.18 0.00 0.00 -0.44 0.00 0.00 62.40 61.99 1b9p h SER 21 CO -0.02 0.92 -0.03 0.40 -0.53 0.00 0.00 176.83 177.57 1b9p h ILE 22 N 0.53 1.19 -0.71 2.23 2.04 -1.04 -2.71 117.51 119.04 1b9p h ILE 22 Ca 0.06 -0.87 0.12 0.00 1.00 0.00 0.00 64.86 65.17 1b9p h ILE 22 Cb 0.80 1.76 -0.08 0.00 -0.74 0.00 0.00 36.82 38.56 1b9p h ILE 22 CO 0.07 0.22 0.29 0.50 0.00 0.00 0.00 178.15 179.23 1b9p h LYS 23 N -0.47 0.46 -0.30 2.37 3.64 -1.53 -0.77 116.57 119.97 1b9p h LYS 23 Ca -0.01 -0.03 -0.08 0.00 -1.27 0.00 0.00 60.65 59.27 1b9p h LYS 23 Cb 0.41 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.11 1b9p h LYS 23 CO 0.01 0.30 -0.14 1.15 -2.27 0.00 0.00 179.45 178.50 1b9p h THR 24 N 0.47 1.24 -0.27 1.00 2.02 -1.56 -1.96 112.91 113.85 1b9p h THR 24 Ca 0.38 -1.07 -0.06 0.00 0.77 0.00 0.00 66.41 66.42 1b9p h THR 24 Cb 0.51 1.17 -0.01 0.00 -1.74 0.00 0.00 68.15 68.09 1b9p h THR 24 CO -0.35 0.35 -0.08 0.25 0.37 0.00 0.00 175.52 176.06 1b9p h LEU 25 N 0.47 0.53 -0.48 2.58 5.85 -0.84 -2.99 115.31 120.43 1b9p h LEU 25 Ca 0.08 -0.38 -0.06 0.00 0.84 0.00 0.00 57.88 58.37 1b9p h LEU 25 Cb 0.53 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.40 1b9p h LEU 25 CO 0.03 0.78 0.06 -0.33 -0.34 0.00 0.00 178.44 178.65 1b9p h GLU 26 N 0.27 0.81 0.00 1.25 5.08 -1.16 -1.20 114.58 119.63 1b9p h GLU 26 Ca 0.07 -0.23 -0.00 0.00 -1.00 0.00 0.00 59.36 58.20 1b9p h GLU 26 Cb 0.56 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.72 1b9p h GLU 26 CO 0.03 0.83 -0.00 1.25 -1.00 0.00 0.00 179.01 180.11 1b9p h HIS 27 N 0.68 0.00 0.00 4.33 2.76 -1.33 -1.27 115.15 120.32 1b9p h HIS 27 Ca 0.14 0.00 -0.24 0.00 -2.20 0.00 0.00 60.37 58.08 1b9p h HIS 27 Cb 0.42 0.00 -0.04 0.00 1.55 0.00 0.00 27.41 29.34 1b9p h HIS 27 CO 0.03 0.00 -2.22 0.36 -1.30 0.00 0.00 177.93 174.81 1b9p n LYS 28 N -3.32 0.73 -0.05 5.26 2.85 -1.01 -3.96 118.16 118.68 1b9p n LYS 28 Ca -0.03 -0.07 -0.02 0.00 -1.05 0.00 0.00 58.31 57.14 1b9p n LYS 28 Cb 0.09 -1.51 -0.01 0.00 -0.65 0.00 0.00 35.03 32.95 1b9p n LYS 28 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1b9p h ARG 29 N 0.00 0.00 -0.61 -1.58 3.08 -0.77 -3.25 114.38 111.25 1b9p h ARG 29 Ca -0.35 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 59.69 1b9p h ARG 29 Cb 1.78 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 31.81 1b9p h ARG 29 CO 0.02 0.00 0.35 0.93 -1.07 0.00 0.00 179.97 180.20 1b9p h GLU 30 N -0.84 0.84 0.00 0.04 4.39 -1.50 -2.49 114.58 115.02 1b9p h GLU 30 Ca 0.00 -0.09 0.00 0.00 0.34 0.00 0.00 59.36 59.61 1b9p h GLU 30 Cb 0.20 -0.17 0.00 0.00 -0.10 0.00 0.00 28.75 28.68 1b9p h GLU 30 CO 0.00 0.62 0.00 -1.71 -1.16 0.00 0.00 179.01 176.76 1b9p n ASN 31 N -4.59 0.68 -4.87 1.42 5.15 -1.25 -4.78 115.26 107.02 1b9p n ASN 31 Ca 0.04 0.70 -0.31 0.00 -0.60 0.00 0.00 54.58 54.41 1b9p n ASN 31 Cb 0.07 -0.83 0.03 0.00 -0.53 0.00 0.00 39.78 38.52 1b9p n ASN 31 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1b9p s ALA 32 N -3.39 2.96 0.06 5.20 0.00 -0.94 -4.99 121.76 120.66 1b9p s ALA 32 Ca 0.02 -0.18 -0.24 0.00 0.00 0.00 0.00 51.96 51.56 1b9p s ALA 32 Cb 0.09 -3.07 -0.17 0.00 0.00 0.00 0.00 23.12 19.97 1b9p s ALA 32 CO 0.35 -0.93 1.59 0.87 0.00 0.00 0.00 175.76 177.64 1b9p h LYS 33 N -0.50 -0.02 0.00 0.00 1.57 -1.86 -3.49 116.57 112.26 1b9p h LYS 33 Ca -0.44 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.34 1b9p h LYS 33 Cb 1.22 0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.53 1b9p h LYS 33 CO 0.62 0.13 0.00 0.39 -0.57 0.00 0.00 179.45 180.02