#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qbi n LYS 2 N 0.00 1.33 -0.05 2.12 4.81 -1.08 -4.76 118.16 120.53 2qbi n LYS 2 Ca 0.00 0.49 -0.07 0.00 -0.87 0.00 0.00 58.31 57.86 2qbi n LYS 2 Cb 0.00 -2.30 -0.02 0.00 0.02 0.00 0.00 35.03 32.73 2qbi n LYS 2 CO 0.00 0.00 0.00 1.33 1.17 0.00 0.00 177.40 179.90 2qbi n VAL 3 N -1.13 1.36 -1.30 3.15 0.24 -1.26 0.37 118.33 119.76 2qbi n VAL 3 Ca 0.11 0.18 0.00 0.00 -2.04 0.00 0.00 64.34 62.59 2qbi n VAL 3 Cb 0.44 -2.05 0.00 0.00 -1.47 0.00 0.00 33.84 30.77 2qbi n VAL 3 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 2qbi n ARG 4 N -4.09 0.00 0.00 7.34 1.74 -1.26 -3.86 116.66 116.53 2qbi n ARG 4 Ca -0.12 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.96 2qbi n ARG 4 Cb 0.39 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.83 2qbi n ARG 4 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2qbi n ALA 5 N 0.08 1.34 -2.88 7.54 0.00 -1.26 -4.74 120.51 120.58 2qbi n ALA 5 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.20 2qbi n ALA 5 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 2qbi n ALA 5 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2qbi n SER 6 N -0.67 3.65 0.00 0.00 7.64 -1.26 -4.66 113.62 118.31 2qbi n SER 6 Ca 0.00 -3.50 0.00 0.00 1.01 0.00 0.00 58.87 56.38 2qbi n SER 6 Cb 0.00 -0.55 0.00 0.00 -1.01 0.00 0.00 64.21 62.65 2qbi n SER 6 CO 0.00 0.00 0.00 0.55 -3.01 0.00 0.00 175.04 172.58 2qbi n VAL 7 N -0.18 0.00 -1.58 0.44 3.14 -1.26 -4.93 118.33 113.95 2qbi n VAL 7 Ca 0.30 1.05 0.00 0.00 -2.96 0.00 0.00 64.34 62.73 2qbi n VAL 7 Cb 0.52 -1.47 0.00 0.00 -1.06 0.00 0.00 33.84 31.83 2qbi n VAL 7 CO 0.00 0.00 0.00 1.17 -6.46 0.00 0.00 176.83 171.54 2qbi n LYS 8 N -1.86 -3.97 -0.06 1.45 4.81 -1.26 -4.93 118.16 112.34 2qbi n LYS 8 Ca 0.00 3.04 -0.06 0.00 -0.87 0.00 0.00 58.31 60.41 2qbi n LYS 8 Cb 0.00 -3.72 0.06 0.00 0.02 0.00 0.00 35.03 31.39 2qbi n LYS 8 CO 0.00 0.00 0.00 0.36 1.17 0.00 0.00 177.40 178.93 2qbi n LYS 9 N -1.99 -2.54 0.00 1.64 -0.00 -1.26 -4.96 118.16 109.05 2qbi n LYS 9 Ca 0.00 -0.31 0.00 0.00 -0.00 0.00 0.00 58.31 58.00 2qbi n LYS 9 Cb 0.29 -0.40 0.00 0.00 -0.00 0.00 0.00 35.03 34.92 2qbi n LYS 9 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 2qbi n LEU 10 N 0.00 0.00 0.00 -5.58 4.77 -1.26 -5.12 117.00 109.81 2qbi n LEU 10 Ca 0.03 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.01 2qbi n LEU 10 Cb 0.13 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.22 2qbi n LEU 10 CO 0.08 0.00 0.00 0.00 -1.33 0.00 0.00 177.39 176.14 2qbi n ARG 12 N 0.00 0.65 -0.31 0.00 1.85 -1.26 -4.18 116.66 113.41 2qbi n ARG 12 Ca 0.00 -0.03 -0.02 0.00 -1.00 0.00 0.00 57.85 56.80 2qbi n ARG 12 Cb 0.00 -1.62 0.09 0.00 -1.05 0.00 0.00 32.46 29.89 2qbi n ARG 12 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 2qbi n ASN 13 N -2.56 2.78 -4.60 2.89 5.03 -1.26 -4.82 115.26 112.72 2qbi n ASN 13 Ca -0.12 -2.37 -0.37 0.00 0.87 0.00 0.00 54.58 52.59 2qbi n ASN 13 Cb 0.77 -0.58 -0.11 0.00 -1.02 0.00 0.00 39.78 38.85 2qbi n ASN 13 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2qbi n LYS 15 N 4.69 0.45 -0.03 0.00 3.00 -1.09 -4.91 118.16 120.27 2qbi n LYS 15 Ca -0.15 0.18 0.00 0.00 -0.00 0.00 0.00 58.31 58.34 2qbi n LYS 15 Cb 0.52 -1.29 0.00 0.00 0.00 0.00 0.00 35.03 34.25 2qbi n LYS 15 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.40 176.51 2qbi n ILE 16 N -4.29 -0.05 -0.88 3.15 5.41 -1.26 -4.96 119.36 116.48 2qbi n ILE 16 Ca -0.15 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.60 2qbi n ILE 16 Cb 0.47 -0.08 0.00 0.00 -0.71 0.00 0.00 39.64 39.33 2qbi n ILE 16 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 176.55 177.07 2qbi n VAL 17 N 0.42 0.00 -2.61 1.39 0.31 -0.79 -4.88 118.33 112.17 2qbi n VAL 17 Ca 0.00 0.00 -0.02 0.00 -0.01 0.00 0.00 64.34 64.31 2qbi n VAL 17 Cb 0.00 -1.50 0.05 0.00 -0.91 0.00 0.00 33.84 31.48 2qbi n VAL 17 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 2qbi n LYS 18 N 0.00 0.60 -2.41 5.55 4.81 -1.25 -3.03 118.16 122.43 2qbi n LYS 18 Ca 0.00 -0.75 -0.36 0.00 -0.87 0.00 0.00 58.31 56.33 2qbi n LYS 18 Cb 0.00 0.12 -0.02 0.00 0.02 0.00 0.00 35.03 35.14 2qbi n LYS 18 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 2qbi s ARG 19 N 0.07 3.93 0.00 1.64 0.52 -1.25 -2.41 118.95 121.45 2qbi s ARG 19 Ca 0.06 1.62 0.00 0.00 -0.52 0.00 0.00 55.73 56.89 2qbi s ARG 19 Cb 0.20 -2.43 0.00 0.00 0.52 0.00 0.00 34.95 33.24 2qbi s ARG 19 CO -0.05 -0.37 0.00 -0.25 0.02 0.00 0.00 175.30 174.65 2qbi n ASP 20 N -0.37 0.00 -0.01 0.23 8.00 -1.26 -0.69 116.55 122.45 2qbi n ASP 20 Ca 0.07 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.57 2qbi n ASP 20 Cb 0.49 -1.62 0.00 0.00 -0.02 0.00 0.00 41.12 39.97 2qbi n ASP 20 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2qbi n GLY 21 N -2.00 1.49 3.13 0.44 0.00 -1.01 -5.07 105.19 102.17 2qbi n GLY 21 Ca 0.00 -0.24 -0.34 0.00 0.00 0.00 0.00 46.02 45.43 2qbi n GLY 21 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qbi s VAL 22 N -2.03 2.89 -0.82 1.61 1.01 0.13 -5.03 120.40 118.17 2qbi s VAL 22 Ca 0.00 -1.69 -0.24 0.00 0.00 0.00 0.00 61.98 60.04 2qbi s VAL 22 Cb 0.00 -2.80 -0.16 0.00 0.00 0.00 0.00 36.38 33.41 2qbi s VAL 22 CO 0.00 -0.30 2.37 -0.38 0.00 0.00 0.00 175.10 176.79 2qbi n ILE 23 N 4.55 0.00 -3.23 2.22 5.41 -1.26 -3.88 119.36 123.17 2qbi n ILE 23 Ca -0.08 -0.47 -0.21 0.00 1.00 0.00 0.00 62.75 62.98 2qbi n ILE 23 Cb 0.43 -1.82 0.05 0.00 -0.71 0.00 0.00 39.64 37.59 2qbi n ILE 23 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 176.55 176.42 2qbi s ARG 24 N 8.73 2.25 -0.02 0.38 0.52 -1.17 -3.26 118.95 126.38 2qbi s ARG 24 Ca 0.95 -1.77 0.02 0.00 -0.52 0.00 0.00 55.73 54.41 2qbi s ARG 24 Cb -0.19 -2.51 0.01 0.00 0.52 0.00 0.00 34.95 32.78 2qbi s ARG 24 CO 0.13 -0.87 -0.05 0.08 0.02 0.00 0.00 175.30 174.61 2qbi s VAL 25 N -2.72 0.47 -0.02 3.52 1.01 -1.26 -1.89 120.40 119.51 2qbi s VAL 25 Ca 0.56 -0.19 0.02 0.00 0.00 0.00 0.00 61.98 62.37 2qbi s VAL 25 Cb -0.05 -0.45 0.00 0.00 0.00 0.00 0.00 36.38 35.89 2qbi s VAL 25 CO 0.35 0.17 -0.07 -0.63 0.00 0.00 0.00 175.10 174.91 2qbi s ILE 26 N 0.28 0.64 -0.12 2.22 -1.09 -1.26 -3.50 121.20 118.36 2qbi s ILE 26 Ca -0.03 -0.29 0.01 0.00 -2.23 0.00 0.00 60.65 58.11 2qbi s ILE 26 Cb -0.07 -0.57 0.02 0.00 -1.58 0.00 0.00 42.46 40.25 2qbi s ILE 26 CO -0.00 0.20 -0.15 0.00 -1.23 0.00 0.00 174.94 173.77 2qbi n SER 28 N 4.44 1.39 0.06 0.00 3.41 -1.14 -3.98 113.62 117.80 2qbi n SER 28 Ca -0.18 -2.08 0.00 0.00 -0.26 0.00 0.00 58.87 56.35 2qbi n SER 28 Cb 0.51 -0.49 0.00 0.00 -0.26 0.00 0.00 64.21 63.97 2qbi n SER 28 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2qbi n ALA 29 N 0.04 3.00 -3.62 7.33 0.00 -1.26 -5.08 120.51 120.92 2qbi n ALA 29 Ca 0.03 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.15 2qbi n ALA 29 Cb 0.32 0.19 -0.17 0.00 0.00 0.00 0.00 19.45 19.79 2qbi n ALA 29 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2qbi s GLU 30 N -2.00 2.82 0.35 0.00 0.41 -1.26 -5.01 118.70 114.02 2qbi s GLU 30 Ca 0.00 -0.78 0.09 0.00 -0.41 0.00 0.00 54.97 53.87 2qbi s GLU 30 Cb 0.00 -2.28 0.66 0.00 -1.78 0.00 0.00 34.13 30.73 2qbi s GLU 30 CO 0.00 -0.00 1.82 -1.35 -0.49 0.00 0.00 175.26 175.24 2qbi h PRO 31 N 7.28 0.19 0.00 0.39 0.11 -1.98 -2.65 132.00 135.33 2qbi h PRO 31 Ca -0.31 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.74 2qbi h PRO 31 Cb 1.19 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2qbi h PRO 31 CO 0.53 0.45 0.18 1.63 -0.21 0.00 0.00 178.00 180.58 2qbi n LYS 32 N -4.15 0.09 0.11 1.05 5.02 -1.26 0.78 118.16 119.79 2qbi n LYS 32 Ca -0.01 0.55 0.05 0.00 -2.02 0.00 0.00 58.31 56.87 2qbi n LYS 32 Cb 0.37 -1.96 0.01 0.00 -0.02 0.00 0.00 35.03 33.43 2qbi n LYS 32 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2qbi h HIS 33 N 0.00 0.00 -0.10 2.13 3.86 -1.85 -3.44 115.15 115.75 2qbi h HIS 33 Ca 0.00 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.20 2qbi h HIS 33 Cb 0.35 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.82 2qbi h HIS 33 CO 0.00 0.36 0.12 1.17 0.86 0.00 0.00 177.93 180.44 2qbi n LYS 34 N -3.00 0.14 -0.23 2.45 4.81 0.23 -4.72 118.16 117.84 2qbi n LYS 34 Ca -0.02 -1.43 0.00 0.00 -0.87 0.00 0.00 58.31 55.99 2qbi n LYS 34 Cb 0.70 -3.62 0.00 0.00 0.02 0.00 0.00 35.03 32.13 2qbi n LYS 34 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 2qbi n GLN 35 N 7.86 0.25 0.00 1.64 6.02 -1.23 -2.63 117.38 129.29 2qbi n GLN 35 Ca 0.38 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.37 2qbi n GLN 35 Cb 0.46 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.72 2qbi n GLN 35 CO 0.00 0.00 0.00 -2.13 -1.01 0.00 0.00 177.06 173.92 2qbi n ARG 36 N -0.99 1.05 -0.98 -1.09 0.63 0.16 -4.15 116.66 111.30 2qbi n ARG 36 Ca 0.00 0.00 -0.31 0.00 -0.92 0.00 0.00 57.85 56.62 2qbi n ARG 36 Cb 0.00 0.00 0.01 0.00 0.45 0.00 0.00 32.46 32.92 2qbi n ARG 36 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2qbi n GLN 37 N 0.00 0.00 0.00 -0.14 0.00 -1.26 -4.39 117.38 111.59 2qbi n GLN 37 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.00 57.00 2qbi n GLN 37 Cb 0.00 -0.82 0.00 0.00 0.00 0.00 0.00 30.24 29.42 2qbi n GLN 37 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47