#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qbi s LYS 2 N 0.00 4.15 0.20 0.54 1.02 -1.26 -4.93 119.74 119.47 2qbi s LYS 2 Ca 0.00 2.51 -0.31 0.00 0.02 0.00 0.00 55.97 58.19 2qbi s LYS 2 Cb 0.00 -2.99 -0.10 0.00 -0.52 0.00 0.00 37.83 34.22 2qbi s LYS 2 CO 0.00 -0.48 1.46 0.42 -0.92 0.00 0.00 175.35 175.83 2qbi s ILE 3 N -1.03 2.77 -0.13 2.17 1.01 -1.26 -4.99 121.20 119.73 2qbi s ILE 3 Ca 0.53 0.60 -0.20 0.00 0.00 0.00 0.00 60.65 61.58 2qbi s ILE 3 Cb -0.45 -3.38 -0.04 0.00 0.01 0.00 0.00 42.46 38.60 2qbi s ILE 3 CO 0.60 0.08 0.56 -0.54 0.00 0.00 0.00 174.94 175.63 2qbi s LYS 4 N 0.26 4.32 0.25 2.79 1.02 -1.26 -4.97 119.74 122.14 2qbi s LYS 4 Ca 0.63 0.57 -0.30 0.00 0.02 0.00 0.00 55.97 56.89 2qbi s LYS 4 Cb -0.41 -3.48 -0.09 0.00 -0.52 0.00 0.00 37.83 33.33 2qbi s LYS 4 CO 0.38 0.03 0.99 0.95 -0.92 0.00 0.00 175.35 176.78 2qbi s THR 5 N 1.02 3.89 -0.94 2.17 -4.23 -1.26 -4.93 115.64 111.35 2qbi s THR 5 Ca 0.29 1.89 -0.25 0.00 -1.18 0.00 0.00 61.69 62.44 2qbi s THR 5 Cb -0.16 -4.20 -0.08 0.00 1.34 0.00 0.00 72.50 69.40 2qbi s THR 5 CO 0.12 0.45 2.04 -0.69 -0.54 0.00 0.00 174.62 176.00 2qbi s VAL 6 N -1.13 3.36 0.00 2.29 1.01 0.30 -4.85 120.40 121.38 2qbi s VAL 6 Ca 0.42 -0.38 0.00 0.00 0.00 0.00 0.00 61.98 62.02 2qbi s VAL 6 Cb -0.28 -3.92 0.00 0.00 0.00 0.00 0.00 36.38 32.18 2qbi s VAL 6 CO 0.35 -0.73 0.67 0.54 0.00 0.00 0.00 175.10 175.93 2qbi n ARG 7 N 8.71 0.00 -0.24 2.72 3.00 -1.26 -0.53 116.66 129.05 2qbi n ARG 7 Ca 0.42 0.67 0.21 0.00 -0.01 0.00 0.00 57.85 59.14 2qbi n ARG 7 Cb 0.46 -1.05 0.39 0.00 0.00 0.00 0.00 32.46 32.26 2qbi n ARG 7 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2qbi n GLY 8 N -0.97 -0.68 0.14 -0.13 0.00 -1.26 0.94 105.19 103.23 2qbi n GLY 8 Ca 0.00 0.64 -0.13 0.00 0.00 0.00 0.00 46.02 46.53 2qbi n GLY 8 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qbi h ALA 9 N 1.50 0.23 0.00 4.61 0.00 -1.17 -3.02 119.26 121.40 2qbi h ALA 9 Ca 0.59 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 55.17 2qbi h ALA 9 Cb 1.50 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.25 2qbi h ALA 9 CO -0.61 0.12 0.00 0.00 0.00 0.00 0.00 179.25 178.76 2qbi n ALA 10 N -2.43 1.51 -0.18 0.00 0.00 0.27 -1.22 120.51 118.46 2qbi n ALA 10 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.38 2qbi n ALA 10 Cb 0.37 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.82 2qbi n ALA 10 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2qbi n LYS 11 N 0.10 2.35 0.00 0.00 5.02 -1.14 -4.66 118.16 119.83 2qbi n LYS 11 Ca 0.00 -1.29 0.00 0.00 -2.02 0.00 0.00 58.31 55.00 2qbi n LYS 11 Cb 0.05 -0.91 0.00 0.00 -0.02 0.00 0.00 35.03 34.15 2qbi n LYS 11 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2qbi n ARG 12 N -0.40 0.36 -4.20 1.97 1.74 -0.36 -5.10 116.66 110.68 2qbi n ARG 12 Ca 0.00 -0.53 -0.14 0.00 -0.77 0.00 0.00 57.85 56.41 2qbi n ARG 12 Cb 0.29 -0.59 -0.09 0.00 -1.02 0.00 0.00 32.46 31.05 2qbi n ARG 12 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 2qbi s PHE 13 N -0.14 1.26 -0.30 -1.55 0.08 -1.23 -4.51 117.98 111.60 2qbi s PHE 13 Ca 0.00 -1.41 -0.11 0.00 0.12 0.00 0.00 56.93 55.54 2qbi s PHE 13 Cb 0.00 -0.52 0.18 0.00 -0.57 0.00 0.00 43.02 42.12 2qbi s PHE 13 CO 0.00 -0.76 1.03 0.21 -0.10 0.00 0.00 175.22 175.59 2qbi s LYS 14 N -3.88 0.17 0.46 0.44 2.36 -1.14 -4.95 119.74 113.20 2qbi s LYS 14 Ca 0.38 0.19 -0.19 0.00 -2.55 0.00 0.00 55.97 53.80 2qbi s LYS 14 Cb 0.05 0.09 -0.15 0.00 -1.05 0.00 0.00 37.83 36.77 2qbi s LYS 14 CO 0.17 -0.29 -0.04 1.17 1.55 0.00 0.00 175.35 177.90 2qbi n LYS 15 N 5.19 0.00 0.00 4.03 4.81 -1.26 -4.30 118.16 126.63 2qbi n LYS 15 Ca 0.06 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.50 2qbi n LYS 15 Cb 0.57 -1.00 0.00 0.00 0.02 0.00 0.00 35.03 34.62 2qbi n LYS 15 CO 0.00 0.00 0.00 0.25 1.17 0.00 0.00 177.40 178.82 2qbi n THR 16 N -1.31 0.00 0.14 3.15 -2.24 0.49 -4.85 114.28 109.66 2qbi n THR 16 Ca 0.09 0.00 0.08 0.00 -2.27 0.00 0.00 64.05 61.95 2qbi n THR 16 Cb 0.44 -0.16 0.41 0.00 -2.10 0.00 0.00 70.33 68.92 2qbi n THR 16 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2qbi n GLY 17 N 5.00 -0.69 0.00 3.38 0.00 -1.26 -4.70 105.19 106.92 2qbi n GLY 17 Ca 0.00 0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.16 2qbi n GLY 17 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2qbi n LYS 18 N -2.05 0.00 -0.27 1.61 -0.00 -1.26 -5.03 118.16 111.16 2qbi n LYS 18 Ca -0.01 0.00 0.24 0.00 -0.00 0.00 0.00 58.31 58.54 2qbi n LYS 18 Cb 0.17 0.00 0.57 0.00 -0.00 0.00 0.00 35.03 35.77 2qbi n LYS 18 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.40 178.18 2qbi h GLY 19 N 0.00 0.76 -1.78 2.58 0.00 -2.00 -3.44 103.07 99.19 2qbi h GLY 19 Ca 0.00 -0.14 -0.49 0.00 0.00 0.00 0.00 47.33 46.69 2qbi h GLY 19 CO 0.00 -0.05 -1.03 0.61 0.00 0.00 0.00 176.54 176.06 2qbi n GLY 20 N -1.56 -2.47 0.00 4.60 0.00 -1.26 -4.68 105.19 99.82 2qbi n GLY 20 Ca 0.22 -0.73 0.00 0.00 0.00 0.00 0.00 46.02 45.51 2qbi n GLY 20 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2qbi n PHE 21 N -3.93 0.00 -1.20 1.61 3.01 -1.26 -0.38 117.46 115.31 2qbi n PHE 21 Ca 0.03 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.49 2qbi n PHE 21 Cb 0.59 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.06 2qbi n PHE 21 CO 0.00 0.00 0.00 1.17 1.01 0.00 0.00 176.76 178.94 2qbi n LYS 22 N -1.96 -3.35 0.00 -1.08 4.81 -1.26 -2.88 118.16 112.44 2qbi n LYS 22 Ca 0.00 2.53 0.00 0.00 -0.87 0.00 0.00 58.31 59.97 2qbi n LYS 22 Cb 0.30 -2.96 0.00 0.00 0.02 0.00 0.00 35.03 32.39 2qbi n LYS 22 CO 0.00 0.00 0.00 -2.39 1.17 0.00 0.00 177.40 176.18 2qbi n HIS 23 N -1.42 0.00 -4.45 5.64 1.44 0.18 -3.69 115.22 112.92 2qbi n HIS 23 Ca 0.00 0.00 -0.26 0.00 -2.01 0.00 0.00 57.72 55.45 2qbi n HIS 23 Cb 0.13 0.00 -0.13 0.00 0.12 0.00 0.00 29.99 30.11 2qbi n HIS 23 CO 0.00 0.00 0.00 0.21 -2.81 0.00 0.00 176.34 173.74 2qbi s LYS 24 N 1.92 1.29 0.32 -1.40 2.36 -1.26 -2.69 119.74 120.28 2qbi s LYS 24 Ca 0.00 -1.11 -0.21 0.00 -2.55 0.00 0.00 55.97 52.10 2qbi s LYS 24 Cb 0.00 -1.53 -0.10 0.00 -1.05 0.00 0.00 37.83 35.15 2qbi s LYS 24 CO 0.00 0.37 0.85 -1.01 1.55 0.00 0.00 175.35 177.11 2qbi s HIS 25 N -1.01 3.52 0.00 4.03 3.76 -1.26 -5.00 115.29 119.34 2qbi s HIS 25 Ca 0.08 1.52 0.00 0.00 -0.15 0.00 0.00 55.06 56.51 2qbi s HIS 25 Cb -0.10 -2.75 0.00 0.00 1.11 0.00 0.00 32.58 30.85 2qbi s HIS 25 CO 0.04 0.14 0.00 0.00 -0.85 0.00 0.00 174.74 174.07 2qbi n ALA 26 N 0.12 0.00 -4.23 -1.40 0.00 -1.26 -4.36 120.51 109.38 2qbi n ALA 26 Ca 0.02 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.16 2qbi n ALA 26 Cb 0.52 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.88 2qbi n ALA 26 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2qbi n ASN 27 N -2.93 0.62 -2.40 0.00 0.23 -1.26 -4.84 115.26 104.69 2qbi n ASN 27 Ca 0.00 -1.23 0.01 0.00 -0.53 0.00 0.00 54.58 52.83 2qbi n ASN 27 Cb 0.00 -1.52 0.04 0.00 -2.08 0.00 0.00 39.78 36.22 2qbi n ASN 27 CO 0.00 0.00 0.00 -0.11 -0.93 0.00 0.00 177.26 176.22 2qbi n LEU 28 N -4.46 1.11 0.00 -4.53 7.94 -1.26 -4.84 117.00 110.96 2qbi n LEU 28 Ca -0.30 -2.72 0.00 0.00 -1.11 0.00 0.00 56.01 51.88 2qbi n LEU 28 Cb 0.66 0.30 0.00 0.00 0.53 0.00 0.00 43.42 44.91 2qbi n LEU 28 CO 0.81 0.95 0.00 -2.11 -1.11 0.00 0.00 177.39 175.92 2qbi n ARG 29 N -0.34 0.00 -3.89 1.96 1.85 -1.26 -5.11 116.66 109.86 2qbi n ARG 29 Ca 0.04 0.00 -0.11 0.00 -1.00 0.00 0.00 57.85 56.78 2qbi n ARG 29 Cb 0.90 0.00 -0.12 0.00 -1.05 0.00 0.00 32.46 32.19 2qbi n ARG 29 CO 0.00 0.00 0.00 -1.58 -0.01 0.00 0.00 177.63 176.04 2qbi s HIS 30 N 0.00 0.04 -0.03 2.89 2.46 -1.26 -4.99 115.29 114.40 2qbi s HIS 30 Ca 0.00 -0.07 -0.03 0.00 0.47 0.00 0.00 55.06 55.44 2qbi s HIS 30 Cb 0.00 -0.05 0.00 0.00 -0.13 0.00 0.00 32.58 32.41 2qbi s HIS 30 CO 0.00 -0.12 0.04 1.51 -2.47 0.00 0.00 174.74 173.70 2qbi n ILE 31 N 2.38 -1.92 0.00 0.89 3.06 -1.26 -4.94 119.36 117.57 2qbi n ILE 31 Ca -0.17 0.42 0.00 0.00 -2.50 0.00 0.00 62.75 60.50 2qbi n ILE 31 Cb 0.58 -2.74 0.00 0.00 0.54 0.00 0.00 39.64 38.02 2qbi n ILE 31 CO 0.00 0.00 0.00 0.18 -2.50 0.00 0.00 176.55 174.23 2qbi n LEU 32 N 1.12 0.00 -0.34 9.51 4.77 -1.26 -4.75 117.00 126.04 2qbi n LEU 32 Ca -0.01 0.00 0.14 0.00 -0.03 0.00 0.00 56.01 56.11 2qbi n LEU 32 Cb 0.46 0.00 0.33 0.00 -2.33 0.00 0.00 43.42 41.88 2qbi n LEU 32 CO 0.04 0.00 1.17 0.00 -1.33 0.00 0.00 177.39 177.26 2qbi h THR 33 N 0.00 0.65 -0.68 -5.08 1.03 -2.03 -0.66 112.91 106.14 2qbi h THR 33 Ca 0.00 -0.23 -0.45 0.00 -0.01 0.00 0.00 66.41 65.72 2qbi h THR 33 Cb 0.39 -0.09 -0.20 0.00 -1.07 0.00 0.00 68.15 67.18 2qbi h THR 33 CO 0.00 0.12 0.58 2.29 -0.01 0.00 0.00 175.52 178.51 2qbi n LYS 34 N -4.83 2.12 -4.26 0.00 2.85 -1.26 -4.90 118.16 107.88 2qbi n LYS 34 Ca 0.24 -2.22 -0.19 0.00 -1.05 0.00 0.00 58.31 55.09 2qbi n LYS 34 Cb 0.61 -1.87 -0.13 0.00 -0.65 0.00 0.00 35.03 32.99 2qbi n LYS 34 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 2qbi s LYS 35 N -2.57 0.83 -0.05 -1.58 1.02 -0.25 -5.11 119.74 112.03 2qbi s LYS 35 Ca 0.44 -0.77 -0.30 0.00 0.02 0.00 0.00 55.97 55.36 2qbi s LYS 35 Cb 0.35 -0.81 -0.06 0.00 -0.52 0.00 0.00 37.83 36.79 2qbi s LYS 35 CO 0.00 0.19 1.66 0.00 -0.92 0.00 0.00 175.35 176.28 2qbi s ALA 36 N -0.97 3.62 0.44 5.17 0.00 -1.26 -4.85 121.76 123.91 2qbi s ALA 36 Ca -0.01 0.96 0.27 0.00 0.00 0.00 0.00 51.96 53.19 2qbi s ALA 36 Cb -0.08 -3.74 1.33 0.00 0.00 0.00 0.00 23.12 20.63 2qbi s ALA 36 CO 0.01 -1.38 1.70 1.79 0.00 0.00 0.00 175.76 177.88 2qbi h THR 37 N 5.53 0.30 0.38 0.00 1.35 -1.96 0.81 112.91 119.32 2qbi h THR 37 Ca -0.40 -0.06 -0.02 0.00 -0.55 0.00 0.00 66.41 65.38 2qbi h THR 37 Cb 1.18 0.10 0.00 0.00 -1.73 0.00 0.00 68.15 67.70 2qbi h THR 37 CO 0.95 0.03 -0.18 0.50 -0.25 0.00 0.00 175.52 176.57 2qbi h LYS 38 N 0.19 -0.50 -0.73 4.72 3.64 -1.96 0.46 116.57 122.39 2qbi h LYS 38 Ca 0.71 0.03 0.11 0.00 -1.27 0.00 0.00 60.65 60.24 2qbi h LYS 38 Cb 2.19 0.11 -0.12 0.00 -0.41 0.00 0.00 32.23 34.01 2qbi h LYS 38 CO -0.31 -0.33 -0.29 -2.13 -2.27 0.00 0.00 179.45 174.12 2qbi n ARG 39 N -3.48 -0.18 0.07 1.90 0.63 0.22 0.91 116.66 116.74 2qbi n ARG 39 Ca -0.06 1.13 -0.13 0.00 -0.92 0.00 0.00 57.85 57.86 2qbi n ARG 39 Cb 0.20 -1.67 -0.09 0.00 0.45 0.00 0.00 32.46 31.36 2qbi n ARG 39 CO 0.00 0.00 0.00 0.87 -2.51 0.00 0.00 177.63 175.99 2qbi h LYS 40 N 0.00 -0.18 0.00 -0.14 1.57 -1.37 -0.67 116.57 115.78 2qbi h LYS 40 Ca 0.25 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 59.04 2qbi h LYS 40 Cb 0.43 0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.78 2qbi h LYS 40 CO -0.73 0.18 0.16 -2.13 -0.57 0.00 0.00 179.45 176.36 2qbi n ARG 41 N -5.00 0.11 -0.04 3.15 0.63 0.16 0.56 116.66 116.23 2qbi n ARG 41 Ca -0.09 0.60 -0.13 0.00 -0.92 0.00 0.00 57.85 57.31 2qbi n ARG 41 Cb 0.23 -2.03 -0.14 0.00 0.45 0.00 0.00 32.46 30.97 2qbi n ARG 41 CO 0.00 0.00 0.00 0.72 -2.51 0.00 0.00 177.63 175.84 2qbi n HIS 42 N -2.15 0.77 1.01 -0.14 8.25 0.26 -4.11 115.22 119.10 2qbi n HIS 42 Ca -0.01 0.23 0.13 0.00 -0.26 0.00 0.00 57.72 57.81 2qbi n HIS 42 Cb 0.19 -1.12 0.50 0.00 1.12 0.00 0.00 29.99 30.67 2qbi n HIS 42 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2qbi n LEU 43 N -3.13 0.16 0.07 2.41 4.77 0.19 -4.11 117.00 117.36 2qbi n LEU 43 Ca -0.27 0.33 -0.11 0.00 -0.03 0.00 0.00 56.01 55.93 2qbi n LEU 43 Cb 1.06 -0.42 -0.05 0.00 -2.33 0.00 0.00 43.42 41.69 2qbi n LEU 43 CO 0.42 0.04 0.78 0.03 -1.33 0.00 0.00 177.39 177.33 2qbi h ARG 44 N 0.01 -0.22 -7.26 3.23 3.08 -0.96 -3.37 114.38 108.89 2qbi h ARG 44 Ca 0.00 0.01 -0.47 0.00 0.07 0.00 0.00 59.98 59.59 2qbi h ARG 44 Cb 0.50 0.05 0.18 0.00 0.08 0.00 0.00 29.97 30.78 2qbi h ARG 44 CO 0.00 -0.14 0.16 -1.25 -1.07 0.00 0.00 179.97 177.66 2qbi s PRO 45 N -6.15 0.38 0.67 0.04 0.04 -1.26 -4.88 135.00 123.85 2qbi s PRO 45 Ca -0.14 0.95 -0.06 0.00 0.04 0.00 0.00 61.00 61.78 2qbi s PRO 45 Cb 0.08 -1.70 0.15 0.00 0.04 0.00 0.00 34.50 33.07 2qbi s PRO 45 CO 0.66 -2.87 0.92 1.63 0.04 0.00 0.00 177.00 177.38 2qbi n LYS 46 N -4.34 -0.48 -3.64 4.56 4.76 -1.26 -4.57 118.16 113.19 2qbi n LYS 46 Ca 0.06 -1.90 -0.07 0.00 -2.87 0.00 0.00 58.31 53.53 2qbi n LYS 46 Cb 0.54 -0.80 -0.07 0.00 -1.84 0.00 0.00 35.03 32.87 2qbi n LYS 46 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2qbi s ALA 47 N -3.52 -2.05 1.04 7.82 0.00 -1.10 -4.92 121.76 119.03 2qbi s ALA 47 Ca 0.56 1.87 -0.13 0.00 0.00 0.00 0.00 51.96 54.26 2qbi s ALA 47 Cb -0.02 -1.53 0.15 0.00 0.00 0.00 0.00 23.12 21.72 2qbi s ALA 47 CO 0.38 -0.22 0.69 -1.33 0.00 0.00 0.00 175.76 175.28 2qbi n MET 48 N 2.24 -1.20 -2.61 0.00 2.81 -1.26 0.50 117.12 117.60 2qbi n MET 48 Ca -0.13 -0.31 -0.35 0.00 -1.81 0.00 0.00 57.70 55.10 2qbi n MET 48 Cb 0.56 -2.05 -0.05 0.00 -0.71 0.00 0.00 33.22 30.97 2qbi n MET 48 CO 0.00 0.00 0.00 0.14 1.51 0.00 0.00 175.97 177.62 2qbi s VAL 49 N -2.43 3.90 -0.79 2.03 -7.23 -1.26 -4.68 120.40 109.94 2qbi s VAL 49 Ca 0.63 1.35 0.00 0.00 -1.81 0.00 0.00 61.98 62.14 2qbi s VAL 49 Cb -0.21 -3.64 0.00 0.00 0.56 0.00 0.00 36.38 33.09 2qbi s VAL 49 CO 0.64 -0.10 0.27 -1.54 -0.31 0.00 0.00 175.10 174.06 2qbi n SER 50 N -0.33 0.00 0.00 4.85 3.41 -1.26 -4.74 113.62 115.55 2qbi n SER 50 Ca 0.06 0.02 0.00 0.00 -0.26 0.00 0.00 58.87 58.70 2qbi n SER 50 Cb 0.51 -0.02 0.00 0.00 -0.26 0.00 0.00 64.21 64.44 2qbi n SER 50 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 2qbi n LYS 51 N -0.77 0.00 0.11 4.33 3.00 -1.26 -4.43 118.16 119.14 2qbi n LYS 51 Ca 0.00 0.00 -0.23 0.00 -0.00 0.00 0.00 58.31 58.08 2qbi n LYS 51 Cb 0.03 -1.24 -0.15 0.00 0.00 0.00 0.00 35.03 33.68 2qbi n LYS 51 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.40 178.18 2qbi h GLY 52 N 0.00 0.61 -0.87 3.14 0.00 -2.03 -3.27 103.07 100.66 2qbi h GLY 52 Ca 0.00 -1.43 0.00 0.00 0.00 0.00 0.00 47.33 45.90 2qbi h GLY 52 CO 0.00 1.26 -0.28 1.22 0.00 0.00 0.00 176.54 178.74 2qbi n ASP 53 N -3.82 1.96 -0.26 0.19 8.00 -1.26 -4.38 116.55 116.98 2qbi n ASP 53 Ca -0.15 -1.48 0.01 0.00 0.71 0.00 0.00 54.79 53.88 2qbi n ASP 53 Cb 1.01 0.26 0.08 0.00 -0.02 0.00 0.00 41.12 42.45 2qbi n ASP 53 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 2qbi h LEU 54 N 2.64 -0.72 -0.89 0.64 5.85 -1.87 -0.17 115.31 120.79 2qbi h LEU 54 Ca 0.00 0.22 0.15 0.00 0.84 0.00 0.00 57.88 59.09 2qbi h LEU 54 Cb 0.73 0.47 -0.15 0.00 0.37 0.00 0.00 40.66 42.07 2qbi h LEU 54 CO 0.00 -0.25 -0.35 1.23 -0.34 0.00 0.00 178.44 178.73 2qbi h GLY 55 N -0.01 0.13 0.36 3.75 0.00 -1.78 0.22 103.07 105.75 2qbi h GLY 55 Ca 0.35 0.47 0.06 0.00 0.00 0.00 0.00 47.33 48.21 2qbi h GLY 55 CO -0.77 -0.23 -0.10 1.41 0.00 0.00 0.00 176.54 176.85 2qbi h LEU 56 N -0.04 -0.35 -0.23 3.11 4.07 -1.35 -2.25 115.31 118.28 2qbi h LEU 56 Ca 0.34 0.10 0.06 0.00 0.08 0.00 0.00 57.88 58.45 2qbi h LEU 56 Cb 0.60 0.21 -0.07 0.00 1.08 0.00 0.00 40.66 42.48 2qbi h LEU 56 CO -0.91 -0.13 -0.26 0.58 -1.08 0.00 0.00 178.44 176.63 2qbi h VAL 57 N -0.04 0.36 0.00 1.22 2.07 -0.45 -2.04 116.25 117.37 2qbi h VAL 57 Ca 0.15 0.00 -0.28 0.00 0.82 0.00 0.00 66.70 67.38 2qbi h VAL 57 Cb 0.26 0.36 -0.01 0.00 -1.52 0.00 0.00 31.29 30.38 2qbi h VAL 57 CO -0.32 0.00 1.53 -0.38 0.02 0.00 0.00 177.57 178.42 2qbi n ILE 58 N -5.39 2.30 0.00 4.57 5.41 -0.32 -1.66 119.36 124.27 2qbi n ILE 58 Ca -0.01 -1.30 0.00 0.00 1.00 0.00 0.00 62.75 62.44 2qbi n ILE 58 Cb 0.30 -2.02 0.00 0.00 -0.71 0.00 0.00 39.64 37.21 2qbi n ILE 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2qbi n ALA 59 N 3.50 0.05 0.17 -1.39 0.00 -0.78 -4.87 120.51 117.19 2qbi n ALA 59 Ca 0.39 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.93 2qbi n ALA 59 Cb 0.33 0.00 0.09 0.00 0.00 0.00 0.00 19.45 19.87 2qbi n ALA 59 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qbi n LEU 61 N -3.01 3.48 -0.21 0.00 4.77 -1.12 -0.54 117.00 120.37 2qbi n LEU 61 Ca 0.02 -5.40 0.00 0.00 -0.03 0.00 0.00 56.01 50.60 2qbi n LEU 61 Cb 0.58 -0.50 0.11 0.00 -2.33 0.00 0.00 43.42 41.29 2qbi n LEU 61 CO 0.37 2.11 1.00 -0.65 -1.33 0.00 0.00 177.39 178.89 2qbi h PRO 62 N 3.95 0.42 -0.98 3.23 0.11 -1.88 -1.66 132.00 135.20 2qbi h PRO 62 Ca 0.18 -0.03 -0.21 0.00 0.11 0.00 0.00 66.00 66.05 2qbi h PRO 62 Cb 0.66 -0.09 -0.12 0.00 0.11 0.00 0.00 31.00 31.56 2qbi h PRO 62 CO 0.79 0.28 0.26 0.66 -0.21 0.00 0.00 178.00 179.78 2qbi n TYR 63 N -4.98 1.32 0.79 0.65 4.01 -1.26 -5.04 117.16 112.65 2qbi n TYR 63 Ca 0.09 -1.01 0.06 0.00 -0.16 0.00 0.00 57.90 56.88 2qbi n TYR 63 Cb 0.27 -0.53 0.37 0.00 -0.31 0.00 0.00 39.34 39.15 2qbi n TYR 63 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40