#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qbg s ARG 2 N 0.00 3.69 -0.29 0.00 3.52 -1.26 -4.96 118.95 119.65 2qbg s ARG 2 Ca 0.00 1.39 -0.29 0.00 -0.13 0.00 0.00 55.73 56.70 2qbg s ARG 2 Cb 0.00 -4.03 0.01 0.00 -1.56 0.00 0.00 34.95 29.37 2qbg s ARG 2 CO 0.00 -1.42 1.11 0.08 -0.81 0.00 0.00 175.30 174.27 2qbg s VAL 3 N 5.39 4.47 0.15 7.11 1.01 -1.26 -4.93 120.40 132.33 2qbg s VAL 3 Ca 0.68 1.71 -0.13 0.00 0.00 0.00 0.00 61.98 64.24 2qbg s VAL 3 Cb -0.21 -4.34 0.14 0.00 0.00 0.00 0.00 36.38 31.97 2qbg s VAL 3 CO 0.30 -0.41 1.03 2.29 0.00 0.00 0.00 175.10 178.30 2qbg n LYS 4 N 6.82 -0.17 -3.07 2.72 2.85 -1.26 -4.88 118.16 121.18 2qbg n LYS 4 Ca 0.12 1.02 -0.17 0.00 -1.05 0.00 0.00 58.31 58.23 2qbg n LYS 4 Cb 0.47 -1.51 0.02 0.00 -0.65 0.00 0.00 35.03 33.36 2qbg n LYS 4 CO 0.00 0.00 0.00 -2.13 -0.05 0.00 0.00 177.40 175.22 2qbg n ARG 5 N -4.96 -2.24 0.00 -1.58 0.63 -1.26 -4.97 116.66 102.28 2qbg n ARG 5 Ca 0.06 1.90 0.00 0.00 -0.92 0.00 0.00 57.85 58.89 2qbg n ARG 5 Cb 0.25 -4.35 0.00 0.00 0.45 0.00 0.00 32.46 28.81 2qbg n ARG 5 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2qbg n GLY 6 N -0.15 -1.28 0.31 5.14 0.00 -1.26 -4.90 105.19 103.05 2qbg n GLY 6 Ca 0.04 0.34 0.11 0.00 0.00 0.00 0.00 46.02 46.52 2qbg n GLY 6 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 2qbg h VAL 7 N 0.00 0.58 -0.84 1.61 -1.51 -1.96 0.03 116.25 114.15 2qbg h VAL 7 Ca 0.00 -0.17 0.01 0.00 -1.23 0.00 0.00 66.70 65.31 2qbg h VAL 7 Cb 0.00 0.04 -0.04 0.00 -2.13 0.00 0.00 31.29 29.15 2qbg h VAL 7 CO 0.00 0.09 0.56 0.40 -1.23 0.00 0.00 177.57 177.39 2qbg h ILE 8 N 0.50 1.20 0.00 7.19 5.03 -1.99 -2.51 117.51 126.93 2qbg h ILE 8 Ca 0.52 -0.38 0.00 0.00 -0.12 0.00 0.00 64.86 64.88 2qbg h ILE 8 Cb 0.90 -0.02 0.00 0.00 -3.03 0.00 0.00 36.82 34.67 2qbg h ILE 8 CO -0.46 0.20 0.00 0.00 -0.68 0.00 0.00 178.15 177.22 2qbg n ALA 9 N -2.33 -0.45 0.27 1.87 0.00 -0.04 -1.77 120.51 118.06 2qbg n ALA 9 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.53 2qbg n ALA 9 Cb 0.03 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.48 2qbg n ALA 9 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 2qbg n ARG 10 N -1.95 0.20 -0.04 0.00 1.85 -0.99 -1.36 116.66 114.37 2qbg n ARG 10 Ca 0.00 0.00 -0.05 0.00 -1.00 0.00 0.00 57.85 56.80 2qbg n ARG 10 Cb 0.00 -1.07 -0.02 0.00 -1.05 0.00 0.00 32.46 30.33 2qbg n ARG 10 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2qbg n ALA 11 N 0.09 1.32 0.27 2.89 0.00 -0.95 -3.73 120.51 120.41 2qbg n ALA 11 Ca 0.00 -0.53 0.15 0.00 0.00 0.00 0.00 53.44 53.06 2qbg n ALA 11 Cb 0.03 0.07 0.71 0.00 0.00 0.00 0.00 19.45 20.26 2qbg n ALA 11 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.50 177.57 2qbg h ARG 12 N -0.60 0.00 0.03 0.00 0.11 -0.84 0.19 114.38 113.28 2qbg h ARG 12 Ca 0.00 0.00 -0.27 0.00 0.10 0.00 0.00 59.98 59.81 2qbg h ARG 12 Cb 0.60 0.00 0.02 0.00 1.11 0.00 0.00 29.97 31.71 2qbg h ARG 12 CO 0.00 0.00 -1.10 0.45 0.10 0.00 0.00 179.97 179.42 2qbg h HIS 13 N 0.00 1.01 -0.36 4.08 3.86 -1.42 -3.06 115.15 119.26 2qbg h HIS 13 Ca 0.00 -0.58 -0.14 0.00 -1.16 0.00 0.00 60.37 58.49 2qbg h HIS 13 Cb 0.16 -0.11 -0.01 0.00 1.06 0.00 0.00 27.41 28.51 2qbg h HIS 13 CO 0.00 1.41 -0.35 -0.22 0.86 0.00 0.00 177.93 179.63 2qbg h LYS 14 N 0.35 0.82 0.20 2.45 3.64 -0.77 0.28 116.57 123.55 2qbg h LYS 14 Ca -0.14 -0.41 -0.00 0.00 -1.27 0.00 0.00 60.65 58.83 2qbg h LYS 14 Cb 1.76 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 33.56 2qbg h LYS 14 CO 0.21 1.04 -0.27 -0.22 -2.27 0.00 0.00 179.45 177.94 2qbg h LYS 15 N 0.68 -0.47 -0.04 1.90 3.64 -1.21 -2.61 116.57 118.46 2qbg h LYS 15 Ca 0.07 0.03 0.04 0.00 -1.27 0.00 0.00 60.65 59.51 2qbg h LYS 15 Cb 0.91 0.11 -0.06 0.00 -0.41 0.00 0.00 32.23 32.78 2qbg h LYS 15 CO 0.08 -0.32 -0.34 0.82 -2.27 0.00 0.00 179.45 177.42 2qbg h ILE 16 N -0.49 0.26 -0.11 2.00 5.03 -1.54 -3.10 117.51 119.56 2qbg h ILE 16 Ca -0.02 0.00 -0.59 0.00 -0.12 0.00 0.00 64.86 64.13 2qbg h ILE 16 Cb 0.45 0.26 0.03 0.00 -3.03 0.00 0.00 36.82 34.52 2qbg h ILE 16 CO -0.07 0.00 2.06 -0.11 -0.68 0.00 0.00 178.15 179.35 2qbg n LEU 17 N -5.42 3.95 0.00 1.44 7.94 1.00 -2.23 117.00 123.67 2qbg n LEU 17 Ca -0.05 -3.00 0.00 0.00 -1.11 0.00 0.00 56.01 51.86 2qbg n LEU 17 Cb 0.34 -1.27 0.00 0.00 0.53 0.00 0.00 43.42 43.02 2qbg n LEU 17 CO 0.17 -0.63 0.00 1.17 -1.11 0.00 0.00 177.39 176.99 2qbg n LYS 18 N 7.28 0.00 0.08 1.96 4.81 -1.17 -4.66 118.16 126.44 2qbg n LYS 18 Ca 0.49 0.00 0.07 0.00 -0.87 0.00 0.00 58.31 57.99 2qbg n LYS 18 Cb 0.42 0.00 0.32 0.00 0.02 0.00 0.00 35.03 35.79 2qbg n LYS 18 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 2qbg n GLN 19 N -1.87 0.08 -0.72 1.64 6.02 -0.95 -0.27 117.38 121.30 2qbg n GLN 19 Ca 0.00 0.49 0.07 0.00 -0.01 0.00 0.00 57.00 57.55 2qbg n GLN 19 Cb 0.00 -1.71 0.35 0.00 1.02 0.00 0.00 30.24 29.89 2qbg n GLN 19 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2qbg n ALA 20 N -1.64 3.52 -1.94 -1.58 0.00 -1.23 -4.93 120.51 112.72 2qbg n ALA 20 Ca 0.00 -1.60 -0.41 0.00 0.00 0.00 0.00 53.44 51.43 2qbg n ALA 20 Cb 0.07 -1.09 -0.03 0.00 0.00 0.00 0.00 19.45 18.41 2qbg n ALA 20 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2qbg s LYS 21 N -2.33 4.40 0.00 0.00 -0.14 0.62 -2.81 119.74 119.49 2qbg s LYS 21 Ca 0.47 2.06 0.00 0.00 -1.36 0.00 0.00 55.97 57.15 2qbg s LYS 21 Cb 0.34 -3.17 0.00 0.00 -1.68 0.00 0.00 37.83 33.32 2qbg s LYS 21 CO 0.17 -0.20 0.00 0.41 -0.76 0.00 0.00 175.35 174.96 2qbg n GLY 22 N 1.97 0.52 3.85 -3.33 0.00 -1.26 -5.06 105.19 101.88 2qbg n GLY 22 Ca 0.04 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.74 2qbg n GLY 22 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2qbg s TYR 23 N -2.23 3.40 0.56 1.61 4.12 -1.12 -5.07 117.35 118.61 2qbg s TYR 23 Ca 0.00 1.32 -0.07 0.00 0.02 0.00 0.00 57.07 58.34 2qbg s TYR 23 Cb 0.00 -2.64 -0.02 0.00 -1.52 0.00 0.00 41.96 37.78 2qbg s TYR 23 CO 0.00 -0.10 0.89 -0.47 0.02 0.00 0.00 175.55 175.89 2qbg s TYR 24 N -2.27 3.48 0.00 2.71 5.04 -1.26 -4.07 117.35 120.97 2qbg s TYR 24 Ca 0.56 0.88 0.00 0.00 -2.44 0.00 0.00 57.07 56.08 2qbg s TYR 24 Cb -0.10 -2.56 0.00 0.00 0.35 0.00 0.00 41.96 39.65 2qbg s TYR 24 CO 0.23 -0.58 0.00 0.41 -1.34 0.00 0.00 175.55 174.27 2qbg n GLY 25 N -2.51 1.02 0.31 8.97 0.00 -1.26 -2.26 105.19 109.47 2qbg n GLY 25 Ca 0.03 -0.60 0.21 0.00 0.00 0.00 0.00 46.02 45.66 2qbg n GLY 25 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qbg h ALA 26 N -0.87 1.00 -0.05 4.61 0.00 -1.92 -2.94 119.26 119.10 2qbg h ALA 26 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 54.91 54.93 2qbg h ALA 26 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 2qbg h ALA 26 CO 0.00 0.00 0.62 0.00 0.00 0.00 0.00 179.25 179.87 2qbg h ARG 27 N 0.00 0.00 0.00 0.00 3.08 -1.75 0.26 114.38 115.97 2qbg h ARG 27 Ca 0.00 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 2qbg h ARG 27 Cb 0.21 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.25 2qbg h ARG 27 CO 0.00 0.00 -1.24 0.43 -1.07 0.00 0.00 179.97 178.09 2qbg n SER 28 N -2.79 3.83 -3.69 7.04 7.64 -1.11 -4.41 113.62 120.14 2qbg n SER 28 Ca 0.00 0.00 -0.28 0.00 1.01 0.00 0.00 58.87 59.60 2qbg n SER 28 Cb 0.66 1.18 -0.11 0.00 -1.01 0.00 0.00 64.21 64.93 2qbg n SER 28 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2qbg s ARG 29 N -2.33 1.73 0.00 1.43 1.70 0.90 -4.89 118.95 117.49 2qbg s ARG 29 Ca -0.02 -2.72 0.00 0.00 -0.47 0.00 0.00 55.73 52.52 2qbg s ARG 29 Cb 0.03 -2.53 0.00 0.00 -0.57 0.00 0.00 34.95 31.88 2qbg s ARG 29 CO 0.21 -1.31 0.00 1.55 -1.08 0.00 0.00 175.30 174.67 2qbg n VAL 30 N 2.49 0.00 0.05 4.99 3.14 -1.13 -4.58 118.33 123.28 2qbg n VAL 30 Ca 0.22 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.60 2qbg n VAL 30 Cb 0.40 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.18 2qbg n VAL 30 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2qbg n TYR 31 N 6.74 -0.80 -0.28 1.45 9.36 -1.26 -4.41 117.16 127.96 2qbg n TYR 31 Ca 0.00 0.14 0.25 0.00 3.32 0.00 0.00 57.90 61.61 2qbg n TYR 31 Cb 0.00 0.46 0.59 0.00 -0.63 0.00 0.00 39.34 39.76 2qbg n TYR 31 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2qbg h ARG 32 N 0.00 0.25 0.00 2.98 3.08 -1.99 -1.88 114.38 116.82 2qbg h ARG 32 Ca 0.00 -0.01 -0.33 0.00 0.07 0.00 0.00 59.98 59.71 2qbg h ARG 32 Cb 0.09 -0.06 -0.06 0.00 0.08 0.00 0.00 29.97 30.03 2qbg h ARG 32 CO 0.00 0.16 -2.24 1.33 -1.07 0.00 0.00 179.97 178.16 2qbg n VAL 33 N -4.45 1.24 0.62 2.04 0.24 -1.26 -4.05 118.33 112.71 2qbg n VAL 33 Ca 0.23 -0.54 0.00 0.00 -2.04 0.00 0.00 64.34 61.99 2qbg n VAL 33 Cb 0.92 -1.11 0.00 0.00 -1.47 0.00 0.00 33.84 32.18 2qbg n VAL 33 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2qbg n ALA 34 N -3.03 2.10 0.04 2.33 0.00 -0.86 -2.32 120.51 118.78 2qbg n ALA 34 Ca -0.36 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.08 2qbg n ALA 34 Cb 0.95 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 19.40 2qbg n ALA 34 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2qbg n PHE 35 N 0.65 -0.58 0.07 0.00 -0.00 -0.76 -4.44 117.46 112.40 2qbg n PHE 35 Ca 0.00 0.10 0.04 0.00 -0.00 0.00 0.00 57.45 57.59 2qbg n PHE 35 Cb 0.30 0.34 0.22 0.00 -0.00 0.00 0.00 39.48 40.34 2qbg n PHE 35 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 176.76 177.80 2qbg n GLN 36 N -2.96 0.05 -0.06 -4.13 6.02 -0.99 -1.62 117.38 113.70 2qbg n GLN 36 Ca 0.00 0.55 -0.05 0.00 -0.01 0.00 0.00 57.00 57.49 2qbg n GLN 36 Cb 0.12 -1.67 -0.04 0.00 1.02 0.00 0.00 30.24 29.67 2qbg n GLN 36 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2qbg h ALA 37 N 2.01 0.01 -0.14 -1.58 0.00 -1.74 -3.13 119.26 114.69 2qbg h ALA 37 Ca 0.00 -0.23 0.05 0.00 0.00 0.00 0.00 54.91 54.72 2qbg h ALA 37 Cb 0.01 0.10 -0.06 0.00 0.00 0.00 0.00 17.79 17.84 2qbg h ALA 37 CO 0.00 0.10 -0.27 0.28 0.00 0.00 0.00 179.25 179.36 2qbg h VAL 38 N -1.00 0.37 -0.56 0.00 2.07 -1.56 -0.32 116.25 115.25 2qbg h VAL 38 Ca -0.02 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.56 2qbg h VAL 38 Cb 0.35 0.37 -0.08 0.00 -1.52 0.00 0.00 31.29 30.40 2qbg h VAL 38 CO -0.01 0.00 -0.46 0.40 0.02 0.00 0.00 177.57 177.52 2qbg h ILE 39 N -0.33 0.00 -0.40 4.57 1.08 -1.47 0.30 117.51 121.25 2qbg h ILE 39 Ca 0.10 0.00 0.08 0.00 -0.39 0.00 0.00 64.86 64.66 2qbg h ILE 39 Cb 0.49 0.00 -0.09 0.00 -3.07 0.00 0.00 36.82 34.15 2qbg h ILE 39 CO -0.33 0.00 -0.28 0.11 -0.69 0.00 0.00 178.15 176.96 2qbg h LYS 40 N -0.16 -0.20 -0.79 2.37 1.79 -1.35 0.70 116.57 118.94 2qbg h LYS 40 Ca 0.09 0.01 0.15 0.00 -2.18 0.00 0.00 60.65 58.72 2qbg h LYS 40 Cb 0.40 0.04 -0.10 0.00 -1.58 0.00 0.00 32.23 31.00 2qbg h LYS 40 CO -0.61 -0.13 0.35 0.00 -1.08 0.00 0.00 179.45 177.98 2qbg h ALA 41 N 0.92 1.15 -0.21 3.86 0.00 0.67 1.01 119.26 126.66 2qbg h ALA 41 Ca 0.19 0.11 -0.03 0.00 0.00 0.00 0.00 54.91 55.17 2qbg h ALA 41 Cb 0.50 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 2qbg h ALA 41 CO -0.52 -0.18 -0.01 0.78 0.00 0.00 0.00 179.25 179.32 2qbg h GLY 42 N 0.50 0.33 0.61 0.00 0.00 0.17 0.75 103.07 105.43 2qbg h GLY 42 Ca 0.44 -0.17 -0.15 0.00 0.00 0.00 0.00 47.33 47.44 2qbg h GLY 42 CO -0.40 0.16 -0.65 1.46 0.00 0.00 0.00 176.54 177.11 2qbg h GLN 43 N 0.30 0.28 -0.68 4.80 4.20 0.12 -2.50 115.11 121.62 2qbg h GLN 43 Ca 0.07 -0.42 0.03 0.00 0.06 0.00 0.00 58.65 58.39 2qbg h GLN 43 Cb 0.22 0.15 -0.04 0.00 0.30 0.00 0.00 27.48 28.12 2qbg h GLN 43 CO 0.01 1.18 0.45 1.88 -0.67 0.00 0.00 178.83 181.67 2qbg h TYR 44 N -0.41 0.79 0.37 2.96 0.99 0.11 0.16 116.97 121.94 2qbg h TYR 44 Ca -0.11 0.02 -0.02 0.00 2.00 0.00 0.00 58.73 60.62 2qbg h TYR 44 Cb 1.48 -0.26 0.00 0.00 1.00 0.00 0.00 36.73 38.95 2qbg h TYR 44 CO 0.20 0.46 -0.18 0.00 -0.00 0.00 0.00 178.16 178.64 2qbg h ALA 45 N 1.60 -0.50 -0.31 3.88 0.00 -0.92 0.35 119.26 123.37 2qbg h ALA 45 Ca 0.27 -0.18 0.09 0.00 0.00 0.00 0.00 54.91 55.10 2qbg h ALA 45 Cb 0.07 0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 2qbg h ALA 45 CO -0.08 -0.53 0.32 -0.92 0.00 0.00 0.00 179.25 178.05 2qbg h TYR 46 N -1.00 0.00 0.10 0.00 3.20 -1.23 1.48 116.97 119.52 2qbg h TYR 46 Ca -0.05 0.00 -0.27 0.00 3.14 0.00 0.00 58.73 61.55 2qbg h TYR 46 Cb 0.51 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.78 2qbg h TYR 46 CO 0.03 0.00 -1.27 -0.09 -1.64 0.00 0.00 178.16 175.19 2qbg h ARG 47 N 0.00 0.21 0.00 1.82 2.43 -0.55 -3.32 114.38 114.98 2qbg h ARG 47 Ca 0.15 -0.36 -0.02 0.00 -0.81 0.00 0.00 59.98 58.93 2qbg h ARG 47 Cb 0.78 0.14 -0.00 0.00 -0.42 0.00 0.00 29.97 30.47 2qbg h ARG 47 CO -0.00 1.14 -1.00 -0.44 -1.51 0.00 0.00 179.97 178.16 2qbg h ASP 48 N 0.06 0.00 0.00 -3.80 3.45 0.16 -3.29 116.42 113.00 2qbg h ASP 48 Ca -0.14 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.32 2qbg h ASP 48 Cb 1.95 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.72 2qbg h ASP 48 CO 0.18 0.06 0.00 -0.09 -1.57 0.00 0.00 179.24 177.82 2qbg h ARG 49 N 0.00 0.00 0.00 3.56 9.65 0.18 0.20 114.38 127.97 2qbg h ARG 49 Ca -0.02 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.86 2qbg h ARG 49 Cb 1.06 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.64 2qbg h ARG 49 CO 0.01 0.00 -1.41 0.54 2.80 0.00 0.00 179.97 181.91 2qbg n ARG 50 N -2.45 0.94 0.03 0.20 3.00 -1.24 -4.44 116.66 112.71 2qbg n ARG 50 Ca -0.02 -0.10 -0.03 0.00 -0.01 0.00 0.00 57.85 57.69 2qbg n ARG 50 Cb 0.04 -1.31 -0.09 0.00 0.00 0.00 0.00 32.46 31.10 2qbg n ARG 50 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.63 179.59 2qbg h GLN 51 N 0.00 0.00 0.00 5.56 4.20 -0.81 -3.30 115.11 120.75 2qbg h GLN 51 Ca 0.00 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.69 2qbg h GLN 51 Cb 0.59 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.37 2qbg h GLN 51 CO 0.00 0.48 -0.07 -0.09 -0.67 0.00 0.00 178.83 178.47 2qbg h ARG 52 N 0.00 0.00 0.00 1.46 2.43 -1.03 0.44 114.38 117.69 2qbg h ARG 52 Ca -0.16 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.01 2qbg h ARG 52 Cb 1.72 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 31.27 2qbg h ARG 52 CO 0.07 0.07 0.00 1.63 -1.51 0.00 0.00 179.97 180.23 2qbg n LYS 53 N -4.13 0.37 -0.09 0.20 5.02 -1.24 -3.54 118.16 114.75 2qbg n LYS 53 Ca -0.03 0.02 -0.18 0.00 -2.02 0.00 0.00 58.31 56.10 2qbg n LYS 53 Cb 0.16 -1.50 -0.06 0.00 -0.02 0.00 0.00 35.03 33.61 2qbg n LYS 53 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2qbg n ARG 54 N -1.30 0.42 0.23 1.97 1.74 0.13 -4.17 116.66 115.67 2qbg n ARG 54 Ca 0.13 0.18 0.10 0.00 -0.77 0.00 0.00 57.85 57.49 2qbg n ARG 54 Cb 0.24 -1.20 0.55 0.00 -1.02 0.00 0.00 32.46 31.02 2qbg n ARG 54 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 2qbg h GLN 55 N -0.72 0.00 0.00 5.56 4.20 -0.81 -1.66 115.11 121.69 2qbg h GLN 55 Ca -0.40 0.00 -0.34 0.00 0.06 0.00 0.00 58.65 57.97 2qbg h GLN 55 Cb 1.28 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 29.01 2qbg h GLN 55 CO -0.24 0.00 -1.86 1.19 -0.67 0.00 0.00 178.83 177.24 2qbg n PHE 56 N -2.38 0.57 0.18 2.96 0.99 -1.23 -3.20 117.46 115.35 2qbg n PHE 56 Ca -0.01 0.24 -0.16 0.00 -0.00 0.00 0.00 57.45 57.51 2qbg n PHE 56 Cb 0.32 -1.06 -0.09 0.00 -1.00 0.00 0.00 39.48 37.65 2qbg n PHE 56 CO 0.00 0.00 0.00 -0.09 -0.00 0.00 0.00 176.76 176.67 2qbg h ARG 57 N -0.94 -0.77 -0.71 -1.08 2.43 -1.51 1.95 114.38 113.74 2qbg h ARG 57 Ca -0.51 0.05 0.13 0.00 -0.81 0.00 0.00 59.98 58.85 2qbg h ARG 57 Cb 1.48 0.18 -0.09 0.00 -0.42 0.00 0.00 29.97 31.11 2qbg h ARG 57 CO -0.29 -0.52 0.26 1.96 -1.51 0.00 0.00 179.97 179.87 2qbg h GLN 58 N -0.80 0.39 0.38 0.20 4.20 -1.56 0.38 115.11 118.29 2qbg h GLN 58 Ca -0.02 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 58.66 2qbg h GLN 58 Cb 0.77 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 28.45 2qbg h GLN 58 CO -0.19 0.26 -0.31 1.25 -0.67 0.00 0.00 178.83 179.16 2qbg h LEU 59 N 0.40 -0.81 0.12 1.46 7.12 -1.01 0.67 115.31 123.26 2qbg h LEU 59 Ca 0.39 0.06 0.00 0.00 0.13 0.00 0.00 57.88 58.46 2qbg h LEU 59 Cb 0.58 0.26 -0.02 0.00 -0.53 0.00 0.00 40.66 40.95 2qbg h LEU 59 CO -0.40 -0.46 -0.25 -0.50 -0.13 0.00 0.00 178.44 176.71 2qbg h TRP 60 N -0.69 -0.71 -0.96 1.25 6.55 0.44 -0.95 115.95 120.87 2qbg h TRP 60 Ca -0.03 0.01 0.36 0.00 0.95 0.00 0.00 58.89 60.18 2qbg h TRP 60 Cb 0.60 0.29 -0.18 0.00 -0.86 0.00 0.00 29.16 29.02 2qbg h TRP 60 CO -0.15 -0.30 0.35 -0.89 -1.05 0.00 0.00 178.44 176.40 2qbg n ILE 61 N -3.85 -0.40 -0.17 1.49 5.41 0.12 0.12 119.36 122.07 2qbg n ILE 61 Ca -0.05 2.01 -0.01 0.00 1.00 0.00 0.00 62.75 65.70 2qbg n ILE 61 Cb 0.20 -3.15 0.08 0.00 -0.71 0.00 0.00 39.64 36.06 2qbg n ILE 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2qbg h ALA 62 N 1.93 0.62 0.31 -1.39 0.00 0.53 0.14 119.26 121.40 2qbg h ALA 62 Ca 0.74 0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.74 2qbg h ALA 62 Cb 1.84 0.13 0.00 0.00 0.00 0.00 0.00 17.79 19.76 2qbg h ALA 62 CO -0.80 -0.29 -0.15 0.00 0.00 0.00 0.00 179.25 178.01 2qbg h ARG 63 N 0.27 -0.41 -0.92 0.00 3.08 0.14 -2.01 114.38 114.53 2qbg h ARG 63 Ca 0.27 0.03 0.26 0.00 0.07 0.00 0.00 59.98 60.61 2qbg h ARG 63 Cb 0.36 0.09 -0.16 0.00 0.08 0.00 0.00 29.97 30.35 2qbg h ARG 63 CO -0.33 -0.09 0.21 0.82 -1.07 0.00 0.00 179.97 179.50 2qbg h ILE 64 N -0.97 0.20 -0.63 2.04 1.08 -1.01 1.83 117.51 120.05 2qbg h ILE 64 Ca -0.04 -0.04 -0.07 0.00 -0.39 0.00 0.00 64.86 64.31 2qbg h ILE 64 Cb 0.50 0.06 -0.03 0.00 -3.07 0.00 0.00 36.82 34.28 2qbg h ILE 64 CO 0.07 0.02 0.09 -1.13 -0.69 0.00 0.00 178.15 176.52 2qbg h ASN 65 N 0.13 0.98 -0.21 1.72 -1.24 -0.73 0.46 115.58 116.69 2qbg h ASN 65 Ca 0.60 -0.23 -0.08 0.00 0.71 0.00 0.00 56.30 57.30 2qbg h ASN 65 Cb 1.26 -0.26 -0.00 0.00 0.73 0.00 0.00 38.32 40.05 2qbg h ASN 65 CO -0.74 0.98 -0.19 0.00 -1.29 0.00 0.00 177.43 176.19 2qbg h ALA 66 N 1.13 0.30 0.15 1.57 0.00 0.29 0.87 119.26 123.57 2qbg h ALA 66 Ca 0.19 -0.35 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 2qbg h ALA 66 Cb 0.43 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.15 2qbg h ALA 66 CO 0.01 0.22 -0.07 0.00 0.00 0.00 0.00 179.25 179.41 2qbg h ALA 67 N 0.66 -0.21 -0.70 0.00 0.00 0.21 0.19 119.26 119.42 2qbg h ALA 67 Ca 0.03 -0.13 0.04 0.00 0.00 0.00 0.00 54.91 54.85 2qbg h ALA 67 Cb 0.73 0.08 -0.05 0.00 0.00 0.00 0.00 17.79 18.55 2qbg h ALA 67 CO 0.05 -0.51 0.42 0.00 0.00 0.00 0.00 179.25 179.21 2qbg h ALA 68 N 0.38 0.93 -0.87 0.00 0.00 -0.12 -0.30 119.26 119.28 2qbg h ALA 68 Ca -0.02 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.90 2qbg h ALA 68 Cb 0.33 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.89 2qbg h ALA 68 CO 0.03 0.16 0.58 -0.09 0.00 0.00 0.00 179.25 179.93 2qbg h ARG 69 N 0.80 1.12 -0.64 0.00 9.65 -0.53 -1.62 114.38 123.16 2qbg h ARG 69 Ca 0.29 -0.07 0.08 0.00 -1.10 0.00 0.00 59.98 59.18 2qbg h ARG 69 Cb 0.09 -0.25 -0.06 0.00 -1.39 0.00 0.00 29.97 28.35 2qbg h ARG 69 CO -0.14 0.74 0.31 0.37 2.80 0.00 0.00 179.97 184.05 2qbg h GLN 70 N 1.16 0.54 0.00 0.20 5.75 0.11 -3.38 115.11 119.49 2qbg h GLN 70 Ca 0.32 -0.03 0.00 0.00 -0.15 0.00 0.00 58.65 58.79 2qbg h GLN 70 Cb -0.10 -0.12 0.00 0.00 1.07 0.00 0.00 27.48 28.33 2qbg h GLN 70 CO -0.08 0.36 0.00 0.09 -2.65 0.00 0.00 178.83 176.55 2qbg n ASN 71 N -4.88 0.00 -0.07 -0.69 4.13 -0.62 -4.99 115.26 108.14 2qbg n ASN 71 Ca 0.09 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.35 2qbg n ASN 71 Cb 0.22 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.46 2qbg n ASN 71 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2qbg n GLY 72 N 2.43 -1.24 3.18 7.41 0.00 -1.15 -5.09 105.19 110.73 2qbg n GLY 72 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 2qbg n GLY 72 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2qbg s ILE 73 N 0.00 0.80 0.31 -0.61 1.10 -1.14 -5.05 121.20 116.60 2qbg s ILE 73 Ca 0.00 -1.86 -0.02 0.00 -0.51 0.00 0.00 60.65 58.27 2qbg s ILE 73 Cb 0.00 -1.59 -0.04 0.00 0.15 0.00 0.00 42.46 40.98 2qbg s ILE 73 CO 0.00 -0.78 0.54 -0.94 -2.11 0.00 0.00 174.94 171.65 2qbg s SER 74 N -2.88 6.35 0.26 4.50 1.04 -1.26 -2.55 113.70 119.16 2qbg s SER 74 Ca 0.10 0.55 -0.02 0.00 0.48 0.00 0.00 55.95 57.06 2qbg s SER 74 Cb 0.03 -2.07 0.49 0.00 0.10 0.00 0.00 66.02 64.57 2qbg s SER 74 CO -0.03 -0.24 1.77 0.22 0.98 0.00 0.00 173.24 175.95 2qbg h TYR 75 N 1.21 0.77 -0.87 5.02 3.20 -1.87 0.60 116.97 125.03 2qbg h TYR 75 Ca -0.49 0.03 0.18 0.00 3.14 0.00 0.00 58.73 61.59 2qbg h TYR 75 Cb 1.20 -0.22 -0.11 0.00 1.54 0.00 0.00 36.73 39.15 2qbg h TYR 75 CO 0.54 0.22 0.43 0.77 -1.64 0.00 0.00 178.16 178.48 2qbg h SER 76 N 0.65 0.47 0.13 -2.11 0.02 -1.97 0.62 113.55 111.36 2qbg h SER 76 Ca 0.44 0.12 -0.36 0.00 -0.84 0.00 0.00 61.79 61.15 2qbg h SER 76 Cb 0.58 0.05 -0.05 0.00 0.14 0.00 0.00 62.40 63.12 2qbg h SER 76 CO -0.33 0.14 -2.16 0.29 -1.14 0.00 0.00 176.83 173.63 2qbg n LYS 77 N -4.93 0.69 -0.26 3.45 5.02 -0.56 -3.42 118.16 118.15 2qbg n LYS 77 Ca 0.19 0.19 -0.02 0.00 -2.02 0.00 0.00 58.31 56.65 2qbg n LYS 77 Cb 0.53 -1.63 0.10 0.00 -0.02 0.00 0.00 35.03 34.00 2qbg n LYS 77 CO 0.00 0.00 0.00 0.35 -0.52 0.00 0.00 177.40 177.23 2qbg h PHE 78 N 0.02 0.83 -0.00 2.13 -0.00 0.38 1.02 116.94 121.32 2qbg h PHE 78 Ca -0.47 0.02 0.00 0.00 -0.00 0.00 0.00 57.97 57.53 2qbg h PHE 78 Cb 2.03 -0.27 0.00 0.00 -0.00 0.00 0.00 35.95 37.71 2qbg h PHE 78 CO 0.04 0.45 -0.00 1.51 -0.00 0.00 0.00 178.31 180.30 2qbg n ILE 79 N -4.68 0.00 0.20 1.41 0.00 0.19 -2.17 119.36 114.31 2qbg n ILE 79 Ca 0.09 -0.00 0.11 0.00 0.00 0.00 0.00 62.75 62.95 2qbg n ILE 79 Cb 0.13 -0.49 -0.13 0.00 0.00 0.00 0.00 39.64 39.14 2qbg n ILE 79 CO 0.00 0.00 0.00 -3.20 0.00 0.00 0.00 176.55 173.35 2qbg n ASN 80 N -1.29 0.27 -0.07 9.51 4.05 0.13 -3.65 115.26 124.21 2qbg n ASN 80 Ca 0.14 -0.14 -0.19 0.00 0.45 0.00 0.00 54.58 54.84 2qbg n ASN 80 Cb 0.25 1.63 -0.12 0.00 1.23 0.00 0.00 39.78 42.76 2qbg n ASN 80 CO 0.00 0.00 0.00 1.23 -3.05 0.00 0.00 177.26 175.44 2qbg h GLY 81 N 4.19 0.04 0.94 8.20 0.00 0.11 -1.97 103.07 114.58 2qbg h GLY 81 Ca 0.00 -0.10 0.14 0.00 0.00 0.00 0.00 47.33 47.37 2qbg h GLY 81 CO 0.00 0.09 0.39 1.41 0.00 0.00 0.00 176.54 178.43 2qbg h LEU 82 N -0.91 0.00 0.01 3.11 3.38 -1.63 1.04 115.31 120.31 2qbg h LEU 82 Ca -0.20 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.77 2qbg h LEU 82 Cb 1.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.99 2qbg h LEU 82 CO -0.09 0.00 -0.00 0.50 0.09 0.00 0.00 178.44 178.94 2qbg h LYS 83 N 0.00 -0.01 -0.69 1.13 1.63 -1.62 -3.30 116.57 113.71 2qbg h LYS 83 Ca 0.24 0.00 0.14 0.00 -0.85 0.00 0.00 60.65 60.17 2qbg h LYS 83 Cb 1.02 0.00 -0.13 0.00 -0.60 0.00 0.00 32.23 32.52 2qbg h LYS 83 CO -0.00 -0.01 -0.20 0.87 -3.45 0.00 0.00 179.45 176.66 2qbg h LYS 84 N -0.02 -0.02 -5.17 1.90 1.57 -0.60 -2.73 116.57 111.49 2qbg h LYS 84 Ca -0.00 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.75 2qbg h LYS 84 Cb 0.01 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.31 2qbg h LYS 84 CO 0.00 -0.01 0.28 0.00 -0.57 0.00 0.00 179.45 179.14 2qbg n ALA 85 N -3.17 0.36 -0.52 3.86 0.00 0.35 -4.28 120.51 117.12 2qbg n ALA 85 Ca 0.09 -1.65 0.00 0.00 0.00 0.00 0.00 53.44 51.88 2qbg n ALA 85 Cb 0.36 -2.99 0.00 0.00 0.00 0.00 0.00 19.45 16.83 2qbg n ALA 85 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2qbg n SER 86 N 16.86 0.00 0.00 0.00 2.88 -1.24 -3.32 113.62 128.80 2qbg n SER 86 Ca 0.42 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.96 2qbg n SER 86 Cb 0.43 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.89 2qbg n SER 86 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 2qbg n VAL 87 N 0.43 0.00 -2.42 2.46 0.31 -1.03 -4.82 118.33 113.25 2qbg n VAL 87 Ca 0.00 0.00 -0.01 0.00 -0.01 0.00 0.00 64.34 64.32 2qbg n VAL 87 Cb 0.00 0.00 -0.01 0.00 -0.91 0.00 0.00 33.84 32.92 2qbg n VAL 87 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 2qbg n GLU 88 N 0.00 -3.92 0.00 5.55 0.00 -1.21 -4.01 120.64 117.05 2qbg n GLU 88 Ca 0.00 2.89 0.00 0.00 0.00 0.00 0.00 57.16 60.05 2qbg n GLU 88 Cb 0.00 -3.82 0.00 0.00 0.00 0.00 0.00 31.44 27.62 2qbg n GLU 88 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.13 176.24 2qbg n ILE 89 N 1.91 0.00 -1.00 6.31 2.08 -1.26 -4.71 119.36 122.69 2qbg n ILE 89 Ca -0.10 0.00 -0.06 0.00 0.56 0.00 0.00 62.75 63.15 2qbg n ILE 89 Cb 0.16 -0.18 -0.02 0.00 -0.75 0.00 0.00 39.64 38.85 2qbg n ILE 89 CO 0.00 0.00 0.00 0.47 0.56 0.00 0.00 176.55 177.58 2qbg n ASP 90 N -0.22 -4.30 0.00 4.38 9.92 -1.26 -4.76 116.55 120.32 2qbg n ASP 90 Ca 0.00 0.14 0.00 0.00 -0.53 0.00 0.00 54.79 54.40 2qbg n ASP 90 Cb 0.00 -3.09 0.00 0.00 -0.64 0.00 0.00 41.12 37.39 2qbg n ASP 90 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 2qbg n ARG 91 N -0.28 0.00 0.00 -1.24 1.74 -1.26 -3.47 116.66 112.15 2qbg n ARG 91 Ca -0.06 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.02 2qbg n ARG 91 Cb 0.42 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.86 2qbg n ARG 91 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2qbg n LYS 92 N 4.80 3.22 0.02 5.56 5.02 -1.26 -4.58 118.16 130.94 2qbg n LYS 92 Ca 0.00 0.00 -0.19 0.00 -2.02 0.00 0.00 58.31 56.10 2qbg n LYS 92 Cb 0.00 -0.64 -0.14 0.00 -0.02 0.00 0.00 35.03 34.23 2qbg n LYS 92 CO 0.00 0.00 0.00 0.97 -0.52 0.00 0.00 177.40 177.85 2qbg h ILE 93 N 0.00 1.51 0.00 -0.18 2.10 -1.98 -3.13 117.51 115.83 2qbg h ILE 93 Ca 0.00 -2.48 -0.01 0.00 1.08 0.00 0.00 64.86 63.46 2qbg h ILE 93 Cb 0.00 3.17 -0.00 0.00 -1.09 0.00 0.00 36.82 38.90 2qbg h ILE 93 CO 0.00 0.68 -0.03 -0.07 -1.08 0.00 0.00 178.15 177.66 2qbg h LEU 94 N -0.51 0.00 -1.16 2.19 -0.00 -1.85 -1.27 115.31 112.70 2qbg h LEU 94 Ca -0.14 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.74 2qbg h LEU 94 Cb 1.52 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 42.18 2qbg h LEU 94 CO 0.10 0.03 0.00 0.00 -0.00 0.00 0.00 178.44 178.57 2qbg n ALA 95 N -2.18 1.57 1.28 1.53 0.00 -1.18 -1.90 120.51 119.63 2qbg n ALA 95 Ca -0.02 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.55 2qbg n ALA 95 Cb 0.14 -1.00 0.43 0.00 0.00 0.00 0.00 19.45 19.01 2qbg n ALA 95 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2qbg n ASP 96 N 0.41 0.92 0.00 0.00 5.68 -0.48 -3.66 116.55 119.41 2qbg n ASP 96 Ca 0.00 -0.83 0.02 0.00 -0.50 0.00 0.00 54.79 53.48 2qbg n ASP 96 Cb 0.10 0.09 0.10 0.00 -1.14 0.00 0.00 41.12 40.27 2qbg n ASP 96 CO 0.00 0.00 0.00 2.30 -1.33 0.00 0.00 177.20 178.17 2qbg n ILE 97 N -0.70 0.00 1.16 2.12 -5.35 -0.80 0.59 119.36 116.39 2qbg n ILE 97 Ca 0.13 0.00 0.12 0.00 -0.27 0.00 0.00 62.75 62.73 2qbg n ILE 97 Cb 0.33 -0.67 0.23 0.00 -1.74 0.00 0.00 39.64 37.80 2qbg n ILE 97 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2qbg n ALA 98 N -0.77 2.76 -0.07 -1.28 0.00 -1.24 -3.58 120.51 116.33 2qbg n ALA 98 Ca 0.03 -0.58 -0.10 0.00 0.00 0.00 0.00 53.44 52.78 2qbg n ALA 98 Cb 0.01 -0.94 -0.03 0.00 0.00 0.00 0.00 19.45 18.49 2qbg n ALA 98 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2qbg n VAL 99 N 0.55 1.42 -4.15 0.00 0.31 0.20 -4.79 118.33 111.87 2qbg n VAL 99 Ca 0.14 0.10 -0.27 0.00 -0.01 0.00 0.00 64.34 64.31 2qbg n VAL 99 Cb 0.48 -2.15 -0.07 0.00 -0.91 0.00 0.00 33.84 31.20 2qbg n VAL 99 CO 0.00 0.00 0.00 -0.36 -1.32 0.00 0.00 176.83 175.15 2qbg s PHE 100 N -2.69 2.98 -1.27 3.52 2.99 -1.19 -4.47 117.98 117.85 2qbg s PHE 100 Ca -0.25 -0.08 -0.01 0.00 0.00 0.00 0.00 56.93 56.59 2qbg s PHE 100 Cb 0.05 -1.44 0.00 0.00 0.00 0.00 0.00 43.02 41.63 2qbg s PHE 100 CO 0.36 0.52 0.86 -3.47 -0.00 0.00 0.00 175.22 173.49 2qbg n ASP 101 N -0.19 -1.87 0.30 1.36 4.64 -1.26 -4.29 116.55 115.23 2qbg n ASP 101 Ca -0.09 -0.72 0.16 0.00 -1.38 0.00 0.00 54.79 52.76 2qbg n ASP 101 Cb 0.55 -4.58 0.93 0.00 -1.04 0.00 0.00 41.12 36.98 2qbg n ASP 101 CO 0.00 0.00 0.00 0.50 -0.82 0.00 0.00 177.20 176.88 2qbg h LYS 102 N -1.92 0.00 -0.75 -0.67 3.64 -1.78 0.90 116.57 115.98 2qbg h LYS 102 Ca -0.60 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 58.78 2qbg h LYS 102 Cb 1.35 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 33.13 2qbg h LYS 102 CO 0.54 0.02 0.45 0.28 -2.27 0.00 0.00 179.45 178.47 2qbg h VAL 103 N 0.00 1.21 -2.32 2.00 2.07 -1.88 -3.40 116.25 113.94 2qbg h VAL 103 Ca -0.00 -0.48 -0.21 0.00 0.82 0.00 0.00 66.70 66.83 2qbg h VAL 103 Cb 0.06 0.17 0.11 0.00 -1.52 0.00 0.00 31.29 30.10 2qbg h VAL 103 CO 0.00 0.22 0.00 0.00 0.02 0.00 0.00 177.57 177.82 2qbg n ALA 104 N -2.34 -2.25 0.00 1.67 0.00 0.31 -3.34 120.51 114.56 2qbg n ALA 104 Ca 0.07 -0.86 0.00 0.00 0.00 0.00 0.00 53.44 52.65 2qbg n ALA 104 Cb 0.06 -0.07 0.00 0.00 0.00 0.00 0.00 19.45 19.44 2qbg n ALA 104 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2qbg n PHE 105 N -4.08 0.00 -0.14 0.00 -0.00 -1.26 -4.47 117.46 107.50 2qbg n PHE 105 Ca 0.08 0.00 -0.01 0.00 -0.00 0.00 0.00 57.45 57.52 2qbg n PHE 105 Cb 0.32 0.00 0.24 0.00 -0.00 0.00 0.00 39.48 40.04 2qbg n PHE 105 CO 0.00 0.00 0.00 1.15 -0.00 0.00 0.00 176.76 177.91 2qbg h THR 106 N 0.00 1.20 -0.40 -2.13 2.02 -1.75 0.33 112.91 112.17 2qbg h THR 106 Ca 0.00 -0.57 -0.07 0.00 0.77 0.00 0.00 66.41 66.54 2qbg h THR 106 Cb 0.00 0.44 -0.01 0.00 -1.74 0.00 0.00 68.15 66.83 2qbg h THR 106 CO 0.00 0.24 -0.03 0.00 0.37 0.00 0.00 175.52 176.10 2qbg h ALA 107 N 1.46 0.54 -0.40 6.16 0.00 -1.78 0.22 119.26 125.46 2qbg h ALA 107 Ca 0.21 -0.28 0.05 0.00 0.00 0.00 0.00 54.91 54.90 2qbg h ALA 107 Cb 0.10 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 17.69 2qbg h ALA 107 CO -0.03 0.35 0.12 -0.07 0.00 0.00 0.00 179.25 179.62 2qbg h LEU 108 N 0.55 0.10 0.64 0.00 3.38 -1.56 1.42 115.31 119.83 2qbg h LEU 108 Ca 0.11 0.05 -0.02 0.00 0.09 0.00 0.00 57.88 58.11 2qbg h LEU 108 Cb 0.52 0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.31 2qbg h LEU 108 CO 0.03 0.09 -0.49 0.58 0.09 0.00 0.00 178.44 178.74 2qbg h VAL 109 N 0.27 0.00 -0.56 1.22 2.07 0.04 0.29 116.25 119.59 2qbg h VAL 109 Ca 0.19 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.78 2qbg h VAL 109 Cb 0.20 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 29.91 2qbg h VAL 109 CO -0.21 0.00 0.23 -0.08 0.02 0.00 0.00 177.57 177.53 2qbg h GLU 110 N -1.09 0.42 -0.91 1.57 4.57 -0.18 0.34 114.58 119.30 2qbg h GLU 110 Ca -0.08 -0.03 0.08 0.00 -1.18 0.00 0.00 59.36 58.15 2qbg h GLU 110 Cb 0.90 -0.10 -0.07 0.00 -0.16 0.00 0.00 28.75 29.33 2qbg h GLU 110 CO 0.02 0.28 0.57 -0.22 -1.18 0.00 0.00 179.01 178.48 2qbg h LYS 111 N 0.44 0.98 0.01 1.92 1.63 0.22 -1.12 116.57 120.64 2qbg h LYS 111 Ca 0.27 -0.06 -0.00 0.00 -0.85 0.00 0.00 60.65 60.01 2qbg h LYS 111 Cb 0.27 -0.22 0.00 0.00 -0.60 0.00 0.00 32.23 31.68 2qbg h LYS 111 CO -0.24 0.65 -0.00 0.00 -3.45 0.00 0.00 179.45 176.40 2qbg h ALA 112 N 1.44 -0.01 -0.82 5.00 0.00 0.10 -2.84 119.26 122.14 2qbg h ALA 112 Ca 0.41 -0.23 0.20 0.00 0.00 0.00 0.00 54.91 55.29 2qbg h ALA 112 Cb 0.24 0.00 -0.13 0.00 0.00 0.00 0.00 17.79 17.90 2qbg h ALA 112 CO -0.20 -0.27 0.16 0.87 0.00 0.00 0.00 179.25 179.82 2qbg h LYS 113 N -0.48 0.19 0.43 0.00 1.57 0.18 -0.12 116.57 118.34 2qbg h LYS 113 Ca -0.00 -0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.75 2qbg h LYS 113 Cb 0.47 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.74 2qbg h LYS 113 CO 0.00 0.13 -0.21 0.00 -0.57 0.00 0.00 179.45 178.80 2qbg h ALA 114 N 1.72 -0.58 -1.01 3.86 0.00 -1.20 0.30 119.26 122.36 2qbg h ALA 114 Ca 0.48 -0.13 0.23 0.00 0.00 0.00 0.00 54.91 55.49 2qbg h ALA 114 Cb 0.91 0.22 -0.10 0.00 0.00 0.00 0.00 17.79 18.83 2qbg h ALA 114 CO -0.63 -0.82 0.62 0.00 0.00 0.00 0.00 179.25 178.42 2qbg h ALA 115 N -0.02 1.92 0.02 0.00 0.00 -0.84 0.09 119.26 120.42 2qbg h ALA 115 Ca -0.06 0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 2qbg h ALA 115 Cb 0.45 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.22 2qbg h ALA 115 CO 0.10 -0.32 -0.01 -0.07 0.00 0.00 0.00 179.25 178.95 2qbg h LEU 116 N 0.58 -0.03 0.00 0.00 4.07 -0.53 -3.47 115.31 115.93 2qbg h LEU 116 Ca 0.59 -0.52 0.00 0.00 0.08 0.00 0.00 57.88 58.03 2qbg h LEU 116 Cb 1.19 0.01 0.00 0.00 1.08 0.00 0.00 40.66 42.93 2qbg h LEU 116 CO -0.36 0.52 0.00 0.00 -1.08 0.00 0.00 178.44 177.52