#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qbe s ARG 2 N 0.00 3.67 -0.33 0.00 3.52 -1.26 -4.96 118.95 119.59 2qbe s ARG 2 Ca 0.00 1.39 -0.29 0.00 -0.13 0.00 0.00 55.73 56.70 2qbe s ARG 2 Cb 0.00 -4.04 0.02 0.00 -1.56 0.00 0.00 34.95 29.37 2qbe s ARG 2 CO 0.00 -1.44 1.14 0.08 -0.81 0.00 0.00 175.30 174.27 2qbe s VAL 3 N 5.45 4.38 0.14 7.11 1.01 -1.26 -4.93 120.40 132.30 2qbe s VAL 3 Ca 0.68 1.57 -0.11 0.00 0.00 0.00 0.00 61.98 64.13 2qbe s VAL 3 Cb -0.21 -4.38 0.14 0.00 0.00 0.00 0.00 36.38 31.93 2qbe s VAL 3 CO 0.30 -0.55 0.93 2.29 0.00 0.00 0.00 175.10 178.07 2qbe n LYS 4 N 7.10 -0.14 -3.08 2.72 2.85 -1.26 -4.87 118.16 121.48 2qbe n LYS 4 Ca 0.13 0.92 -0.18 0.00 -1.05 0.00 0.00 58.31 58.13 2qbe n LYS 4 Cb 0.47 -1.36 0.02 0.00 -0.65 0.00 0.00 35.03 33.51 2qbe n LYS 4 CO 0.00 0.00 0.00 -2.13 -0.05 0.00 0.00 177.40 175.22 2qbe n ARG 5 N -4.88 -2.22 0.00 -1.58 0.63 -1.26 -4.97 116.66 102.38 2qbe n ARG 5 Ca 0.06 1.88 0.00 0.00 -0.92 0.00 0.00 57.85 58.87 2qbe n ARG 5 Cb 0.24 -4.22 0.00 0.00 0.45 0.00 0.00 32.46 28.92 2qbe n ARG 5 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2qbe n GLY 6 N -0.12 -1.29 0.30 5.14 0.00 -1.26 -4.90 105.19 103.07 2qbe n GLY 6 Ca 0.04 0.35 0.10 0.00 0.00 0.00 0.00 46.02 46.50 2qbe n GLY 6 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 2qbe h VAL 7 N 0.00 0.56 -0.89 1.61 -1.51 -1.97 0.17 116.25 114.22 2qbe h VAL 7 Ca 0.00 -0.15 0.03 0.00 -1.23 0.00 0.00 66.70 65.35 2qbe h VAL 7 Cb 0.00 0.08 -0.05 0.00 -2.13 0.00 0.00 31.29 29.19 2qbe h VAL 7 CO 0.00 0.08 0.58 0.40 -1.23 0.00 0.00 177.57 177.40 2qbe h ILE 8 N 0.44 1.17 0.00 7.19 5.03 -1.99 -2.50 117.51 126.85 2qbe h ILE 8 Ca 0.50 -0.39 0.00 0.00 -0.12 0.00 0.00 64.86 64.85 2qbe h ILE 8 Cb 0.88 -0.07 0.00 0.00 -3.03 0.00 0.00 36.82 34.59 2qbe h ILE 8 CO -0.48 0.21 0.00 0.00 -0.68 0.00 0.00 178.15 177.20 2qbe n ALA 9 N -2.35 -0.40 0.22 1.87 0.00 0.02 -1.75 120.51 118.12 2qbe n ALA 9 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.55 2qbe n ALA 9 Cb 0.07 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.52 2qbe n ALA 9 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 2qbe n ARG 10 N -1.77 0.16 -0.05 0.00 1.85 -1.01 -1.36 116.66 114.48 2qbe n ARG 10 Ca 0.00 0.00 -0.05 0.00 -1.00 0.00 0.00 57.85 56.80 2qbe n ARG 10 Cb 0.00 -1.05 -0.02 0.00 -1.05 0.00 0.00 32.46 30.34 2qbe n ARG 10 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2qbe n ALA 11 N 0.06 1.18 0.26 2.89 0.00 -0.94 -3.67 120.51 120.28 2qbe n ALA 11 Ca 0.00 -0.54 0.13 0.00 0.00 0.00 0.00 53.44 53.03 2qbe n ALA 11 Cb 0.02 0.06 0.65 0.00 0.00 0.00 0.00 19.45 20.19 2qbe n ALA 11 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.50 177.57 2qbe h ARG 12 N -0.61 0.00 0.08 0.00 0.11 -0.79 0.23 114.38 113.40 2qbe h ARG 12 Ca 0.00 0.00 -0.28 0.00 0.10 0.00 0.00 59.98 59.80 2qbe h ARG 12 Cb 0.61 0.00 0.02 0.00 1.11 0.00 0.00 29.97 31.71 2qbe h ARG 12 CO 0.00 0.00 -1.16 0.45 0.10 0.00 0.00 179.97 179.36 2qbe h HIS 13 N 0.00 0.91 -0.31 4.08 3.86 -1.42 -3.10 115.15 119.17 2qbe h HIS 13 Ca 0.00 -0.56 -0.16 0.00 -1.16 0.00 0.00 60.37 58.50 2qbe h HIS 13 Cb 0.15 -0.08 -0.01 0.00 1.06 0.00 0.00 27.41 28.53 2qbe h HIS 13 CO 0.00 1.40 -0.43 -0.22 0.86 0.00 0.00 177.93 179.54 2qbe h LYS 14 N 0.28 0.79 0.17 2.45 3.64 -0.68 0.22 116.57 123.43 2qbe h LYS 14 Ca -0.16 -0.43 -0.00 0.00 -1.27 0.00 0.00 60.65 58.79 2qbe h LYS 14 Cb 1.83 0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 33.66 2qbe h LYS 14 CO 0.22 1.06 -0.26 -0.22 -2.27 0.00 0.00 179.45 177.98 2qbe h LYS 15 N 0.64 -0.43 0.01 1.90 3.64 -1.22 -2.65 116.57 118.45 2qbe h LYS 15 Ca 0.04 0.03 0.03 0.00 -1.27 0.00 0.00 60.65 59.48 2qbe h LYS 15 Cb 0.99 0.10 -0.05 0.00 -0.41 0.00 0.00 32.23 32.86 2qbe h LYS 15 CO 0.09 -0.29 -0.39 0.82 -2.27 0.00 0.00 179.45 177.41 2qbe h ILE 16 N -0.45 0.19 -0.08 2.00 5.03 -1.56 -3.09 117.51 119.56 2qbe h ILE 16 Ca -0.02 0.00 -0.59 0.00 -0.12 0.00 0.00 64.86 64.13 2qbe h ILE 16 Cb 0.41 0.19 0.04 0.00 -3.03 0.00 0.00 36.82 34.43 2qbe h ILE 16 CO -0.08 0.00 2.01 -0.11 -0.68 0.00 0.00 178.15 179.29 2qbe n LEU 17 N -5.44 3.64 0.00 1.44 7.94 0.78 -2.09 117.00 123.27 2qbe n LEU 17 Ca -0.06 -2.82 0.00 0.00 -1.11 0.00 0.00 56.01 52.03 2qbe n LEU 17 Cb 0.36 -1.16 0.00 0.00 0.53 0.00 0.00 43.42 43.15 2qbe n LEU 17 CO 0.17 -0.76 0.00 1.17 -1.11 0.00 0.00 177.39 176.86 2qbe n LYS 18 N 7.30 0.00 0.10 1.96 4.81 -1.17 -4.67 118.16 126.49 2qbe n LYS 18 Ca 0.49 0.00 0.08 0.00 -0.87 0.00 0.00 58.31 58.01 2qbe n LYS 18 Cb 0.42 0.00 0.40 0.00 0.02 0.00 0.00 35.03 35.87 2qbe n LYS 18 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 2qbe n GLN 19 N -1.90 0.10 -0.88 1.64 6.02 -0.89 -0.39 117.38 121.09 2qbe n GLN 19 Ca 0.00 0.53 -0.00 0.00 -0.01 0.00 0.00 57.00 57.52 2qbe n GLN 19 Cb 0.00 -1.79 0.32 0.00 1.02 0.00 0.00 30.24 29.79 2qbe n GLN 19 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2qbe n ALA 20 N -1.69 4.13 -2.01 -1.58 0.00 -1.23 -4.93 120.51 113.20 2qbe n ALA 20 Ca 0.00 -1.94 -0.41 0.00 0.00 0.00 0.00 53.44 51.09 2qbe n ALA 20 Cb 0.07 -1.18 -0.03 0.00 0.00 0.00 0.00 19.45 18.31 2qbe n ALA 20 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2qbe s LYS 21 N -2.68 4.51 0.00 0.00 -0.14 0.48 -3.02 119.74 118.88 2qbe s LYS 21 Ca 0.50 1.87 0.00 0.00 -1.36 0.00 0.00 55.97 56.98 2qbe s LYS 21 Cb 0.39 -3.23 0.00 0.00 -1.68 0.00 0.00 37.83 33.31 2qbe s LYS 21 CO 0.13 -0.05 0.00 0.41 -0.76 0.00 0.00 175.35 175.08 2qbe n GLY 22 N 2.02 0.45 3.85 -3.33 0.00 -1.26 -5.06 105.19 101.85 2qbe n GLY 22 Ca 0.03 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.74 2qbe n GLY 22 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2qbe s TYR 23 N -2.17 3.46 0.47 1.61 4.12 -1.17 -5.06 117.35 118.61 2qbe s TYR 23 Ca 0.00 1.42 -0.05 0.00 0.02 0.00 0.00 57.07 58.46 2qbe s TYR 23 Cb 0.00 -2.75 -0.04 0.00 -1.52 0.00 0.00 41.96 37.65 2qbe s TYR 23 CO 0.00 -0.35 0.77 -0.47 0.02 0.00 0.00 175.55 175.52 2qbe s TYR 24 N -2.62 3.56 0.00 2.71 5.04 -1.26 -4.15 117.35 120.63 2qbe s TYR 24 Ca 0.58 0.79 0.00 0.00 -2.44 0.00 0.00 57.07 56.00 2qbe s TYR 24 Cb -0.10 -2.28 0.00 0.00 0.35 0.00 0.00 41.96 39.93 2qbe s TYR 24 CO 0.32 -0.25 0.00 0.41 -1.34 0.00 0.00 175.55 174.69 2qbe n GLY 25 N -2.21 1.02 0.31 8.97 0.00 -1.26 -2.35 105.19 109.67 2qbe n GLY 25 Ca 0.00 -0.62 0.19 0.00 0.00 0.00 0.00 46.02 45.60 2qbe n GLY 25 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qbe h ALA 26 N -0.91 1.12 -0.06 4.61 0.00 -1.92 -2.81 119.26 119.28 2qbe h ALA 26 Ca 0.00 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.91 2qbe h ALA 26 Cb 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 2qbe h ALA 26 CO 0.00 0.02 0.65 0.00 0.00 0.00 0.00 179.25 179.92 2qbe h ARG 27 N 0.00 0.00 0.00 0.00 3.08 -1.78 0.28 114.38 115.96 2qbe h ARG 27 Ca -0.00 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.03 2qbe h ARG 27 Cb 0.12 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.17 2qbe h ARG 27 CO 0.00 0.00 -1.25 0.43 -1.07 0.00 0.00 179.97 178.08 2qbe n SER 28 N -2.78 3.81 -3.69 7.04 7.64 -1.06 -4.41 113.62 120.16 2qbe n SER 28 Ca 0.00 0.00 -0.28 0.00 1.01 0.00 0.00 58.87 59.61 2qbe n SER 28 Cb 0.69 1.13 -0.11 0.00 -1.01 0.00 0.00 64.21 64.91 2qbe n SER 28 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2qbe s ARG 29 N -2.32 1.79 0.00 1.43 1.70 0.97 -4.90 118.95 117.62 2qbe s ARG 29 Ca -0.02 -2.78 0.00 0.00 -0.47 0.00 0.00 55.73 52.46 2qbe s ARG 29 Cb 0.03 -2.59 0.00 0.00 -0.57 0.00 0.00 34.95 31.82 2qbe s ARG 29 CO 0.21 -1.31 0.00 1.55 -1.08 0.00 0.00 175.30 174.67 2qbe n VAL 30 N 2.42 0.00 0.06 4.99 3.14 -1.12 -4.58 118.33 123.24 2qbe n VAL 30 Ca 0.23 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.61 2qbe n VAL 30 Cb 0.40 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.18 2qbe n VAL 30 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2qbe n TYR 31 N 6.67 -1.02 -0.33 1.45 9.36 -1.26 -4.37 117.16 127.65 2qbe n TYR 31 Ca 0.00 0.18 0.30 0.00 3.32 0.00 0.00 57.90 61.70 2qbe n TYR 31 Cb 0.00 0.42 0.63 0.00 -0.63 0.00 0.00 39.34 39.76 2qbe n TYR 31 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2qbe h ARG 32 N 0.00 0.18 0.00 2.98 3.08 -1.99 -1.71 114.38 116.92 2qbe h ARG 32 Ca 0.00 -0.01 -0.33 0.00 0.07 0.00 0.00 59.98 59.71 2qbe h ARG 32 Cb 0.12 -0.04 -0.06 0.00 0.08 0.00 0.00 29.97 30.07 2qbe h ARG 32 CO 0.00 0.12 -2.24 1.33 -1.07 0.00 0.00 179.97 178.11 2qbe n VAL 33 N -4.43 1.25 0.53 2.04 0.24 -1.26 -4.05 118.33 112.65 2qbe n VAL 33 Ca 0.26 -0.49 0.00 0.00 -2.04 0.00 0.00 64.34 62.08 2qbe n VAL 33 Cb 1.10 -1.24 0.00 0.00 -1.47 0.00 0.00 33.84 32.22 2qbe n VAL 33 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2qbe n ALA 34 N -3.12 2.00 0.05 2.33 0.00 -0.79 -2.20 120.51 118.79 2qbe n ALA 34 Ca -0.38 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.06 2qbe n ALA 34 Cb 0.92 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 19.37 2qbe n ALA 34 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2qbe n PHE 35 N 0.68 -0.76 0.14 0.00 -0.00 -0.71 -4.43 117.46 112.36 2qbe n PHE 35 Ca 0.00 0.13 0.09 0.00 -0.00 0.00 0.00 57.45 57.67 2qbe n PHE 35 Cb 0.25 0.34 0.46 0.00 -0.00 0.00 0.00 39.48 40.52 2qbe n PHE 35 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 176.76 177.80 2qbe n GLN 36 N -3.07 0.11 -0.05 -4.13 6.02 -0.94 -1.49 117.38 113.84 2qbe n GLN 36 Ca 0.00 0.60 -0.02 0.00 -0.01 0.00 0.00 57.00 57.56 2qbe n GLN 36 Cb 0.10 -1.91 -0.02 0.00 1.02 0.00 0.00 30.24 29.43 2qbe n GLN 36 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2qbe h ALA 37 N 1.85 -0.02 -0.22 -1.58 0.00 -1.72 -3.06 119.26 114.52 2qbe h ALA 37 Ca 0.00 -0.08 0.06 0.00 0.00 0.00 0.00 54.91 54.89 2qbe h ALA 37 Cb 0.10 0.01 -0.07 0.00 0.00 0.00 0.00 17.79 17.83 2qbe h ALA 37 CO 0.00 -0.02 -0.29 0.28 0.00 0.00 0.00 179.25 179.22 2qbe h VAL 38 N -1.00 0.32 -0.60 0.00 2.07 -1.51 -0.19 116.25 115.33 2qbe h VAL 38 Ca -0.00 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.58 2qbe h VAL 38 Cb 0.17 0.32 -0.09 0.00 -1.52 0.00 0.00 31.29 30.17 2qbe h VAL 38 CO 0.00 0.00 -0.49 0.40 0.02 0.00 0.00 177.57 177.50 2qbe h ILE 39 N -0.31 0.00 -0.36 4.57 1.08 -1.44 0.28 117.51 121.33 2qbe h ILE 39 Ca 0.12 0.00 0.08 0.00 -0.39 0.00 0.00 64.86 64.67 2qbe h ILE 39 Cb 0.51 0.00 -0.09 0.00 -3.07 0.00 0.00 36.82 34.17 2qbe h ILE 39 CO -0.39 0.00 -0.29 0.11 -0.69 0.00 0.00 178.15 176.89 2qbe h LYS 40 N -0.17 -0.23 -0.86 2.37 1.79 -1.26 0.67 116.57 118.88 2qbe h LYS 40 Ca 0.10 0.02 0.16 0.00 -2.18 0.00 0.00 60.65 58.75 2qbe h LYS 40 Cb 0.43 0.05 -0.10 0.00 -1.58 0.00 0.00 32.23 31.03 2qbe h LYS 40 CO -0.66 -0.15 0.42 0.00 -1.08 0.00 0.00 179.45 177.98 2qbe h ALA 41 N 0.82 1.31 -0.15 3.86 0.00 0.68 0.98 119.26 126.76 2qbe h ALA 41 Ca 0.17 0.11 -0.04 0.00 0.00 0.00 0.00 54.91 55.14 2qbe h ALA 41 Cb 0.51 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 2qbe h ALA 41 CO -0.49 -0.16 -0.08 0.78 0.00 0.00 0.00 179.25 179.29 2qbe h GLY 42 N 0.56 0.25 0.72 0.00 0.00 0.17 0.57 103.07 105.33 2qbe h GLY 42 Ca 0.48 -0.14 -0.20 0.00 0.00 0.00 0.00 47.33 47.48 2qbe h GLY 42 CO -0.40 0.13 -0.86 1.46 0.00 0.00 0.00 176.54 176.87 2qbe h GLN 43 N 0.22 0.31 -0.66 4.80 4.20 0.12 -2.55 115.11 121.56 2qbe h GLN 43 Ca 0.05 -0.54 0.02 0.00 0.06 0.00 0.00 58.65 58.24 2qbe h GLN 43 Cb 0.30 0.20 -0.03 0.00 0.30 0.00 0.00 27.48 28.24 2qbe h GLN 43 CO 0.02 1.26 0.44 1.88 -0.67 0.00 0.00 178.83 181.75 2qbe h TYR 44 N -0.34 0.80 0.31 2.96 0.99 0.10 0.15 116.97 121.94 2qbe h TYR 44 Ca -0.15 0.02 -0.02 0.00 2.00 0.00 0.00 58.73 60.58 2qbe h TYR 44 Cb 1.68 -0.27 0.00 0.00 1.00 0.00 0.00 36.73 39.14 2qbe h TYR 44 CO 0.19 0.49 -0.15 0.00 -0.00 0.00 0.00 178.16 178.69 2qbe h ALA 45 N 1.60 -0.42 -0.24 3.88 0.00 -0.96 0.44 119.26 123.56 2qbe h ALA 45 Ca 0.25 -0.18 0.07 0.00 0.00 0.00 0.00 54.91 55.04 2qbe h ALA 45 Cb -0.04 0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 2qbe h ALA 45 CO -0.06 -0.47 0.27 -0.92 0.00 0.00 0.00 179.25 178.07 2qbe h TYR 46 N -0.95 0.00 0.07 0.00 3.20 -1.26 1.48 116.97 119.52 2qbe h TYR 46 Ca -0.04 0.00 -0.27 0.00 3.14 0.00 0.00 58.73 61.56 2qbe h TYR 46 Cb 0.51 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.76 2qbe h TYR 46 CO 0.04 0.00 -1.31 -0.09 -1.64 0.00 0.00 178.16 175.16 2qbe h ARG 47 N 0.00 0.16 0.00 1.82 2.43 -0.57 -3.32 114.38 114.90 2qbe h ARG 47 Ca 0.11 -0.27 0.00 0.00 -0.81 0.00 0.00 59.98 59.01 2qbe h ARG 47 Cb 0.66 0.10 0.00 0.00 -0.42 0.00 0.00 29.97 30.31 2qbe h ARG 47 CO -0.00 1.05 -1.00 -0.25 -1.51 0.00 0.00 179.97 178.26 2qbe n ASP 48 N -3.40 0.76 0.17 -3.80 10.43 0.59 -3.68 116.55 117.61 2qbe n ASP 48 Ca -0.09 0.22 0.12 0.00 2.57 0.00 0.00 54.79 57.61 2qbe n ASP 48 Cb 1.01 0.52 0.61 0.00 1.84 0.00 0.00 41.12 45.10 2qbe n ASP 48 CO 0.00 0.00 0.00 -0.09 -1.07 0.00 0.00 177.20 176.04 2qbe h ARG 49 N 0.00 0.00 0.00 -1.24 9.65 0.18 0.84 114.38 123.81 2qbe h ARG 49 Ca 0.00 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 2qbe h ARG 49 Cb 0.93 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.51 2qbe h ARG 49 CO 0.00 0.00 -1.48 0.54 2.80 0.00 0.00 179.97 181.83 2qbe n ARG 50 N -2.32 0.78 0.04 0.20 3.00 -1.24 -4.46 116.66 112.66 2qbe n ARG 50 Ca -0.01 -0.11 -0.04 0.00 -0.01 0.00 0.00 57.85 57.68 2qbe n ARG 50 Cb 0.08 -1.31 -0.09 0.00 0.00 0.00 0.00 32.46 31.14 2qbe n ARG 50 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.63 179.59 2qbe h GLN 51 N 0.00 0.00 0.00 5.56 4.20 -1.10 -3.29 115.11 120.48 2qbe h GLN 51 Ca 0.00 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.70 2qbe h GLN 51 Cb 0.60 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.38 2qbe h GLN 51 CO 0.00 0.57 -0.05 -0.09 -0.67 0.00 0.00 178.83 178.58 2qbe h ARG 52 N 0.00 0.00 0.00 1.46 2.43 -1.15 0.49 114.38 117.61 2qbe h ARG 52 Ca -0.14 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.03 2qbe h ARG 52 Cb 1.74 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 31.29 2qbe h ARG 52 CO 0.08 0.05 0.00 1.63 -1.51 0.00 0.00 179.97 180.22 2qbe n LYS 53 N -4.19 0.31 -0.09 0.20 5.02 -1.24 -3.53 118.16 114.64 2qbe n LYS 53 Ca -0.03 0.03 -0.17 0.00 -2.02 0.00 0.00 58.31 56.11 2qbe n LYS 53 Cb 0.14 -1.50 -0.06 0.00 -0.02 0.00 0.00 35.03 33.59 2qbe n LYS 53 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2qbe n ARG 54 N -1.33 0.43 0.23 1.97 1.74 0.14 -4.16 116.66 115.68 2qbe n ARG 54 Ca 0.12 0.18 0.10 0.00 -0.77 0.00 0.00 57.85 57.48 2qbe n ARG 54 Cb 0.24 -1.22 0.52 0.00 -1.02 0.00 0.00 32.46 30.97 2qbe n ARG 54 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 2qbe h GLN 55 N -0.75 0.00 0.00 5.56 4.20 -0.80 -1.58 115.11 121.75 2qbe h GLN 55 Ca -0.36 0.00 -0.34 0.00 0.06 0.00 0.00 58.65 58.01 2qbe h GLN 55 Cb 1.24 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 28.97 2qbe h GLN 55 CO -0.22 0.00 -1.85 1.19 -0.67 0.00 0.00 178.83 177.28 2qbe n PHE 56 N -2.37 0.56 0.15 2.96 0.99 -1.23 -3.20 117.46 115.33 2qbe n PHE 56 Ca -0.01 0.24 -0.16 0.00 -0.00 0.00 0.00 57.45 57.52 2qbe n PHE 56 Cb 0.35 -1.06 -0.09 0.00 -1.00 0.00 0.00 39.48 37.69 2qbe n PHE 56 CO 0.00 0.00 0.00 -0.09 -0.00 0.00 0.00 176.76 176.67 2qbe h ARG 57 N -0.99 -0.74 -0.74 -1.08 2.43 -1.48 1.95 114.38 113.72 2qbe h ARG 57 Ca -0.51 0.05 0.14 0.00 -0.81 0.00 0.00 59.98 58.85 2qbe h ARG 57 Cb 1.45 0.17 -0.09 0.00 -0.42 0.00 0.00 29.97 31.08 2qbe h ARG 57 CO -0.31 -0.50 0.30 1.96 -1.51 0.00 0.00 179.97 179.92 2qbe h GLN 58 N -0.77 0.43 0.35 0.20 4.20 -1.56 0.37 115.11 118.33 2qbe h GLN 58 Ca -0.01 -0.03 -0.01 0.00 0.06 0.00 0.00 58.65 58.67 2qbe h GLN 58 Cb 0.76 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.43 2qbe h GLN 58 CO -0.22 0.29 -0.27 1.25 -0.67 0.00 0.00 178.83 179.21 2qbe h LEU 59 N 0.45 -0.70 0.13 1.46 7.12 -0.94 0.60 115.31 123.43 2qbe h LEU 59 Ca 0.41 0.05 -0.00 0.00 0.13 0.00 0.00 57.88 58.47 2qbe h LEU 59 Cb 0.60 0.22 -0.01 0.00 -0.53 0.00 0.00 40.66 40.94 2qbe h LEU 59 CO -0.39 -0.41 -0.21 -0.50 -0.13 0.00 0.00 178.44 176.80 2qbe h TRP 60 N -0.62 -0.59 -0.96 1.25 6.55 0.44 -1.03 115.95 120.99 2qbe h TRP 60 Ca -0.03 0.01 0.39 0.00 0.95 0.00 0.00 58.89 60.21 2qbe h TRP 60 Cb 0.54 0.24 -0.17 0.00 -0.86 0.00 0.00 29.16 28.91 2qbe h TRP 60 CO -0.13 -0.26 0.47 -0.89 -1.05 0.00 0.00 178.44 176.58 2qbe n ILE 61 N -3.62 -0.40 -0.18 1.49 5.41 0.11 0.14 119.36 122.32 2qbe n ILE 61 Ca -0.04 1.96 -0.02 0.00 1.00 0.00 0.00 62.75 65.65 2qbe n ILE 61 Cb 0.18 -3.15 0.08 0.00 -0.71 0.00 0.00 39.64 36.04 2qbe n ILE 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2qbe h ALA 62 N 1.92 0.69 0.23 -1.39 0.00 0.47 0.95 119.26 122.13 2qbe h ALA 62 Ca 0.79 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.76 2qbe h ALA 62 Cb 2.06 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.88 2qbe h ALA 62 CO -0.75 -0.19 -0.11 0.00 0.00 0.00 0.00 179.25 178.19 2qbe h ARG 63 N 0.39 -0.30 -0.90 0.00 3.08 0.16 -2.16 114.38 114.66 2qbe h ARG 63 Ca 0.27 0.02 0.25 0.00 0.07 0.00 0.00 59.98 60.58 2qbe h ARG 63 Cb 0.30 0.07 -0.15 0.00 0.08 0.00 0.00 29.97 30.26 2qbe h ARG 63 CO -0.26 0.06 0.17 0.82 -1.07 0.00 0.00 179.97 179.69 2qbe h ILE 64 N -0.92 0.23 -0.71 2.04 1.08 -1.06 1.87 117.51 120.04 2qbe h ILE 64 Ca -0.03 -0.05 -0.07 0.00 -0.39 0.00 0.00 64.86 64.32 2qbe h ILE 64 Cb 0.50 0.08 -0.03 0.00 -3.07 0.00 0.00 36.82 34.30 2qbe h ILE 64 CO 0.05 0.02 0.18 -1.13 -0.69 0.00 0.00 178.15 176.59 2qbe h ASN 65 N 0.14 1.08 -0.29 1.72 -1.24 -0.84 0.53 115.58 116.68 2qbe h ASN 65 Ca 0.56 -0.23 -0.10 0.00 0.71 0.00 0.00 56.30 57.24 2qbe h ASN 65 Cb 1.15 -0.28 -0.01 0.00 0.73 0.00 0.00 38.32 39.91 2qbe h ASN 65 CO -0.73 1.03 -0.23 0.00 -1.29 0.00 0.00 177.43 176.21 2qbe h ALA 66 N 1.10 0.41 0.08 1.57 0.00 0.22 0.15 119.26 122.79 2qbe h ALA 66 Ca 0.23 -0.37 -0.00 0.00 0.00 0.00 0.00 54.91 54.76 2qbe h ALA 66 Cb 0.37 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.06 2qbe h ALA 66 CO 0.00 0.38 -0.04 0.00 0.00 0.00 0.00 179.25 179.59 2qbe h ALA 67 N 0.72 -0.10 -0.83 0.00 0.00 0.25 0.13 119.26 119.43 2qbe h ALA 67 Ca 0.05 -0.15 0.02 0.00 0.00 0.00 0.00 54.91 54.83 2qbe h ALA 67 Cb 0.78 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.57 2qbe h ALA 67 CO 0.06 -0.42 0.54 0.00 0.00 0.00 0.00 179.25 179.44 2qbe h ALA 68 N 0.51 1.06 -0.74 0.00 0.00 0.03 -0.75 119.26 119.38 2qbe h ALA 68 Ca -0.01 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 2qbe h ALA 68 Cb 0.33 -0.32 -0.04 0.00 0.00 0.00 0.00 17.79 17.77 2qbe h ALA 68 CO 0.02 0.43 0.45 -0.09 0.00 0.00 0.00 179.25 180.06 2qbe h ARG 69 N 1.10 0.99 -0.61 0.00 9.65 -0.43 -1.79 114.38 123.28 2qbe h ARG 69 Ca 0.31 -0.08 0.06 0.00 -1.10 0.00 0.00 59.98 59.17 2qbe h ARG 69 Cb -0.09 -0.21 -0.05 0.00 -1.39 0.00 0.00 29.97 28.23 2qbe h ARG 69 CO -0.08 0.69 0.31 0.37 2.80 0.00 0.00 179.97 184.06 2qbe h GLN 70 N 1.01 0.57 0.00 0.20 5.75 0.76 -3.39 115.11 120.01 2qbe h GLN 70 Ca 0.27 -0.03 0.00 0.00 -0.15 0.00 0.00 58.65 58.73 2qbe h GLN 70 Cb -0.06 -0.13 0.00 0.00 1.07 0.00 0.00 27.48 28.37 2qbe h GLN 70 CO -0.05 0.38 0.00 0.09 -2.65 0.00 0.00 178.83 176.59 2qbe n ASN 71 N -4.85 0.00 -0.06 -0.69 4.13 -0.69 -4.99 115.26 108.12 2qbe n ASN 71 Ca 0.07 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.33 2qbe n ASN 71 Cb 0.18 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.42 2qbe n ASN 71 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2qbe n GLY 72 N 2.41 -1.33 3.19 7.41 0.00 -1.15 -5.09 105.19 110.63 2qbe n GLY 72 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 2qbe n GLY 72 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2qbe s ILE 73 N 0.00 0.86 0.31 -0.61 1.10 -1.14 -5.05 121.20 116.67 2qbe s ILE 73 Ca 0.00 -1.89 -0.01 0.00 -0.51 0.00 0.00 60.65 58.24 2qbe s ILE 73 Cb 0.00 -1.64 -0.04 0.00 0.15 0.00 0.00 42.46 40.93 2qbe s ILE 73 CO 0.00 -0.77 0.53 -0.94 -2.11 0.00 0.00 174.94 171.65 2qbe s SER 74 N -2.93 6.34 0.24 4.50 1.04 -1.26 -2.59 113.70 119.04 2qbe s SER 74 Ca 0.11 0.51 -0.05 0.00 0.48 0.00 0.00 55.95 57.00 2qbe s SER 74 Cb 0.03 -2.06 0.41 0.00 0.10 0.00 0.00 66.02 64.50 2qbe s SER 74 CO -0.02 -0.24 1.76 0.22 0.98 0.00 0.00 173.24 175.94 2qbe h TYR 75 N 1.13 0.64 -0.95 5.02 3.20 -1.87 0.67 116.97 124.80 2qbe h TYR 75 Ca -0.49 0.03 0.20 0.00 3.14 0.00 0.00 58.73 61.61 2qbe h TYR 75 Cb 1.21 -0.17 -0.11 0.00 1.54 0.00 0.00 36.73 39.20 2qbe h TYR 75 CO 0.53 0.18 0.53 0.77 -1.64 0.00 0.00 178.16 178.54 2qbe h SER 76 N 0.57 0.63 0.11 -2.11 0.02 -1.97 0.89 113.55 111.69 2qbe h SER 76 Ca 0.39 0.12 -0.36 0.00 -0.84 0.00 0.00 61.79 61.09 2qbe h SER 76 Cb 0.49 0.02 -0.05 0.00 0.14 0.00 0.00 62.40 63.00 2qbe h SER 76 CO -0.32 0.18 -2.22 0.29 -1.14 0.00 0.00 176.83 173.61 2qbe n LYS 77 N -4.87 0.68 -0.25 3.45 5.02 -0.57 -3.48 118.16 118.15 2qbe n LYS 77 Ca 0.23 0.16 -0.04 0.00 -2.02 0.00 0.00 58.31 56.64 2qbe n LYS 77 Cb 0.60 -1.61 0.07 0.00 -0.02 0.00 0.00 35.03 34.07 2qbe n LYS 77 CO 0.00 0.00 0.00 0.35 -0.52 0.00 0.00 177.40 177.23 2qbe h PHE 78 N 0.02 0.82 0.00 2.13 -0.00 0.57 0.90 116.94 121.38 2qbe h PHE 78 Ca -0.49 0.02 0.00 0.00 -0.00 0.00 0.00 57.97 57.50 2qbe h PHE 78 Cb 2.04 -0.27 0.00 0.00 -0.00 0.00 0.00 35.95 37.72 2qbe h PHE 78 CO 0.03 0.48 0.00 1.51 -0.00 0.00 0.00 178.31 180.33 2qbe n ILE 79 N -4.66 0.02 0.18 1.41 0.00 0.28 -2.13 119.36 114.47 2qbe n ILE 79 Ca 0.07 0.01 0.11 0.00 0.00 0.00 0.00 62.75 62.94 2qbe n ILE 79 Cb 0.07 -0.52 -0.13 0.00 0.00 0.00 0.00 39.64 39.07 2qbe n ILE 79 CO 0.00 0.00 0.00 -3.20 0.00 0.00 0.00 176.55 173.35 2qbe n ASN 80 N -1.30 0.27 -0.06 9.51 4.05 0.91 -3.61 115.26 125.03 2qbe n ASN 80 Ca 0.13 -0.12 -0.19 0.00 0.45 0.00 0.00 54.58 54.86 2qbe n ASN 80 Cb 0.24 1.62 -0.13 0.00 1.23 0.00 0.00 39.78 42.74 2qbe n ASN 80 CO 0.00 0.00 0.00 1.23 -3.05 0.00 0.00 177.26 175.44 2qbe h GLY 81 N 4.17 0.08 1.05 8.20 0.00 0.94 -1.79 103.07 115.73 2qbe h GLY 81 Ca 0.00 -0.20 0.14 0.00 0.00 0.00 0.00 47.33 47.26 2qbe h GLY 81 CO 0.00 0.18 0.34 1.41 0.00 0.00 0.00 176.54 178.47 2qbe h LEU 82 N -0.81 0.00 0.09 3.11 3.38 -1.62 1.11 115.31 120.57 2qbe h LEU 82 Ca -0.21 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.76 2qbe h LEU 82 Cb 1.32 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.07 2qbe h LEU 82 CO -0.06 0.00 -0.04 0.50 0.09 0.00 0.00 178.44 178.93 2qbe h LYS 83 N 0.00 -0.12 -0.64 1.13 1.63 -1.61 -3.29 116.57 113.67 2qbe h LYS 83 Ca 0.22 0.01 0.13 0.00 -0.85 0.00 0.00 60.65 60.16 2qbe h LYS 83 Cb 0.91 0.03 -0.12 0.00 -0.60 0.00 0.00 32.23 32.44 2qbe h LYS 83 CO -0.00 -0.08 -0.17 0.87 -3.45 0.00 0.00 179.45 176.62 2qbe h LYS 84 N -0.20 -0.01 -5.21 1.90 1.57 -0.61 -2.79 116.57 111.22 2qbe h LYS 84 Ca -0.01 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.74 2qbe h LYS 84 Cb 0.09 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.40 2qbe h LYS 84 CO 0.02 -0.01 0.23 0.00 -0.57 0.00 0.00 179.45 179.12 2qbe n ALA 85 N -3.09 0.36 -0.48 3.86 0.00 0.38 -4.30 120.51 117.24 2qbe n ALA 85 Ca 0.08 -1.59 0.00 0.00 0.00 0.00 0.00 53.44 51.93 2qbe n ALA 85 Cb 0.34 -3.10 0.00 0.00 0.00 0.00 0.00 19.45 16.69 2qbe n ALA 85 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2qbe n SER 86 N 17.37 0.00 0.00 0.00 2.88 -1.24 -3.33 113.62 129.31 2qbe n SER 86 Ca 0.45 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.99 2qbe n SER 86 Cb 0.42 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.88 2qbe n SER 86 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 2qbe n VAL 87 N 0.44 0.00 -2.36 2.46 0.31 -1.05 -4.82 118.33 113.30 2qbe n VAL 87 Ca 0.00 0.00 -0.01 0.00 -0.01 0.00 0.00 64.34 64.32 2qbe n VAL 87 Cb 0.00 0.00 -0.01 0.00 -0.91 0.00 0.00 33.84 32.92 2qbe n VAL 87 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 2qbe n GLU 88 N 0.00 -3.80 0.00 5.55 0.00 -1.21 -4.01 120.64 117.16 2qbe n GLU 88 Ca 0.00 2.79 0.00 0.00 0.00 0.00 0.00 57.16 59.95 2qbe n GLU 88 Cb 0.00 -3.67 0.00 0.00 0.00 0.00 0.00 31.44 27.77 2qbe n GLU 88 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.13 176.24 2qbe n ILE 89 N 1.91 0.00 -1.05 6.31 2.08 -1.26 -4.71 119.36 122.64 2qbe n ILE 89 Ca -0.06 0.00 -0.06 0.00 0.56 0.00 0.00 62.75 63.18 2qbe n ILE 89 Cb 0.10 -0.20 -0.03 0.00 -0.75 0.00 0.00 39.64 38.76 2qbe n ILE 89 CO 0.00 0.00 0.00 0.47 0.56 0.00 0.00 176.55 177.58 2qbe n ASP 90 N -0.19 -4.54 0.00 4.38 9.92 -1.26 -4.76 116.55 120.09 2qbe n ASP 90 Ca 0.00 0.16 0.00 0.00 -0.53 0.00 0.00 54.79 54.42 2qbe n ASP 90 Cb 0.00 -3.26 0.00 0.00 -0.64 0.00 0.00 41.12 37.22 2qbe n ASP 90 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 2qbe n ARG 91 N -0.33 0.00 0.00 -1.24 1.74 -1.26 -3.44 116.66 112.13 2qbe n ARG 91 Ca -0.06 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.02 2qbe n ARG 91 Cb 0.45 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.89 2qbe n ARG 91 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2qbe n LYS 92 N 3.57 3.18 0.02 5.56 5.02 -1.26 -4.57 118.16 129.68 2qbe n LYS 92 Ca 0.00 0.00 -0.20 0.00 -2.02 0.00 0.00 58.31 56.09 2qbe n LYS 92 Cb 0.00 -0.57 -0.14 0.00 -0.02 0.00 0.00 35.03 34.30 2qbe n LYS 92 CO 0.00 0.00 0.00 0.97 -0.52 0.00 0.00 177.40 177.85 2qbe h ILE 93 N 0.00 1.31 0.00 -0.18 2.10 -1.98 -3.19 117.51 115.58 2qbe h ILE 93 Ca 0.00 -2.46 -0.01 0.00 1.08 0.00 0.00 64.86 63.47 2qbe h ILE 93 Cb 0.00 2.98 -0.00 0.00 -1.09 0.00 0.00 36.82 38.71 2qbe h ILE 93 CO 0.00 0.69 -0.04 -0.07 -1.08 0.00 0.00 178.15 177.65 2qbe h LEU 94 N -0.41 0.00 -1.15 2.19 -0.00 -1.85 -1.38 115.31 112.71 2qbe h LEU 94 Ca -0.21 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.67 2qbe h LEU 94 Cb 1.64 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 42.30 2qbe h LEU 94 CO 0.09 0.04 0.00 0.00 -0.00 0.00 0.00 178.44 178.57 2qbe n ALA 95 N -2.21 1.55 1.25 1.53 0.00 -1.20 -1.86 120.51 119.57 2qbe n ALA 95 Ca -0.02 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.55 2qbe n ALA 95 Cb 0.15 -1.00 0.41 0.00 0.00 0.00 0.00 19.45 19.01 2qbe n ALA 95 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2qbe n ASP 96 N 0.41 0.86 0.00 0.00 5.68 -0.52 -3.66 116.55 119.32 2qbe n ASP 96 Ca 0.00 -0.75 0.02 0.00 -0.50 0.00 0.00 54.79 53.56 2qbe n ASP 96 Cb 0.10 0.10 0.09 0.00 -1.14 0.00 0.00 41.12 40.27 2qbe n ASP 96 CO 0.00 0.00 0.00 2.30 -1.33 0.00 0.00 177.20 178.17 2qbe n ILE 97 N -0.80 0.00 1.18 2.12 -5.35 -0.77 0.67 119.36 116.40 2qbe n ILE 97 Ca 0.12 0.00 0.13 0.00 -0.27 0.00 0.00 62.75 62.72 2qbe n ILE 97 Cb 0.33 -0.68 0.24 0.00 -1.74 0.00 0.00 39.64 37.80 2qbe n ILE 97 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2qbe n ALA 98 N -0.77 2.59 -0.07 -1.28 0.00 -1.24 -3.57 120.51 116.17 2qbe n ALA 98 Ca 0.02 -0.60 -0.11 0.00 0.00 0.00 0.00 53.44 52.76 2qbe n ALA 98 Cb 0.01 -0.94 -0.04 0.00 0.00 0.00 0.00 19.45 18.48 2qbe n ALA 98 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2qbe n VAL 99 N 0.80 1.38 -4.17 0.00 0.31 0.21 -4.80 118.33 112.06 2qbe n VAL 99 Ca 0.15 0.08 -0.27 0.00 -0.01 0.00 0.00 64.34 64.29 2qbe n VAL 99 Cb 0.50 -2.08 -0.07 0.00 -0.91 0.00 0.00 33.84 31.27 2qbe n VAL 99 CO 0.00 0.00 0.00 -0.36 -1.32 0.00 0.00 176.83 175.15 2qbe s PHE 100 N -2.63 2.91 -1.26 3.52 2.99 -1.19 -4.49 117.98 117.84 2qbe s PHE 100 Ca -0.24 -0.10 -0.02 0.00 0.00 0.00 0.00 56.93 56.57 2qbe s PHE 100 Cb 0.05 -1.42 0.00 0.00 0.00 0.00 0.00 43.02 41.65 2qbe s PHE 100 CO 0.35 0.51 0.93 -3.47 -0.00 0.00 0.00 175.22 173.54 2qbe n ASP 101 N -0.03 -2.34 0.30 1.36 4.64 -1.26 -4.29 116.55 114.93 2qbe n ASP 101 Ca -0.10 -0.68 0.16 0.00 -1.38 0.00 0.00 54.79 52.80 2qbe n ASP 101 Cb 0.54 -4.75 0.95 0.00 -1.04 0.00 0.00 41.12 36.83 2qbe n ASP 101 CO 0.00 0.00 0.00 0.50 -0.82 0.00 0.00 177.20 176.88 2qbe h LYS 102 N -1.98 0.00 -0.85 -0.67 3.64 -1.78 0.16 116.57 115.08 2qbe h LYS 102 Ca -0.59 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 58.78 2qbe h LYS 102 Cb 1.35 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 33.13 2qbe h LYS 102 CO 0.53 0.01 0.50 0.28 -2.27 0.00 0.00 179.45 178.50 2qbe h VAL 103 N 0.00 1.24 -2.56 2.00 2.07 -1.88 -3.39 116.25 113.73 2qbe h VAL 103 Ca -0.00 -0.54 -0.25 0.00 0.82 0.00 0.00 66.70 66.73 2qbe h VAL 103 Cb 0.02 0.05 0.13 0.00 -1.52 0.00 0.00 31.29 29.97 2qbe h VAL 103 CO 0.00 0.25 0.02 0.00 0.02 0.00 0.00 177.57 177.86 2qbe n ALA 104 N -2.37 -2.56 0.00 1.67 0.00 0.56 -3.39 120.51 114.43 2qbe n ALA 104 Ca 0.09 -1.03 0.00 0.00 0.00 0.00 0.00 53.44 52.50 2qbe n ALA 104 Cb 0.06 -0.08 0.00 0.00 0.00 0.00 0.00 19.45 19.44 2qbe n ALA 104 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2qbe n PHE 105 N -4.26 0.00 -0.13 0.00 -0.00 -1.26 -4.48 117.46 107.32 2qbe n PHE 105 Ca 0.09 0.00 -0.00 0.00 -0.00 0.00 0.00 57.45 57.54 2qbe n PHE 105 Cb 0.38 0.00 0.26 0.00 -0.00 0.00 0.00 39.48 40.12 2qbe n PHE 105 CO 0.00 0.00 0.00 1.15 -0.00 0.00 0.00 176.76 177.91 2qbe h THR 106 N 0.00 1.19 -0.46 -2.13 2.02 -1.76 0.37 112.91 112.14 2qbe h THR 106 Ca 0.00 -0.53 -0.09 0.00 0.77 0.00 0.00 66.41 66.56 2qbe h THR 106 Cb 0.00 0.43 -0.02 0.00 -1.74 0.00 0.00 68.15 66.83 2qbe h THR 106 CO 0.00 0.22 -0.05 0.00 0.37 0.00 0.00 175.52 176.06 2qbe h ALA 107 N 1.49 0.63 -0.34 6.16 0.00 -1.78 0.21 119.26 125.63 2qbe h ALA 107 Ca 0.21 -0.30 0.04 0.00 0.00 0.00 0.00 54.91 54.85 2qbe h ALA 107 Cb 0.08 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.67 2qbe h ALA 107 CO -0.03 0.48 0.13 -0.07 0.00 0.00 0.00 179.25 179.75 2qbe h LEU 108 N 0.70 0.15 0.60 0.00 3.38 -1.51 1.19 115.31 119.82 2qbe h LEU 108 Ca 0.12 0.03 -0.02 0.00 0.09 0.00 0.00 57.88 58.11 2qbe h LEU 108 Cb 0.58 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.33 2qbe h LEU 108 CO 0.03 0.12 -0.49 0.58 0.09 0.00 0.00 178.44 178.78 2qbe h VAL 109 N 0.27 0.00 -0.58 1.22 2.07 0.10 0.31 116.25 119.64 2qbe h VAL 109 Ca 0.15 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.75 2qbe h VAL 109 Cb 0.11 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 29.82 2qbe h VAL 109 CO -0.15 0.00 0.24 -0.08 0.02 0.00 0.00 177.57 177.61 2qbe h GLU 110 N -1.06 0.44 -0.97 1.57 4.57 -0.30 0.34 114.58 119.17 2qbe h GLU 110 Ca -0.08 -0.03 0.07 0.00 -1.18 0.00 0.00 59.36 58.14 2qbe h GLU 110 Cb 0.88 -0.10 -0.07 0.00 -0.16 0.00 0.00 28.75 29.31 2qbe h GLU 110 CO 0.01 0.29 0.62 -0.22 -1.18 0.00 0.00 179.01 178.53 2qbe h LYS 111 N 0.45 1.09 -0.02 1.92 1.63 0.18 -1.16 116.57 120.66 2qbe h LYS 111 Ca 0.28 -0.07 -0.01 0.00 -0.85 0.00 0.00 60.65 60.01 2qbe h LYS 111 Cb 0.29 -0.25 -0.00 0.00 -0.60 0.00 0.00 32.23 31.68 2qbe h LYS 111 CO -0.25 0.72 -0.02 0.00 -3.45 0.00 0.00 179.45 176.44 2qbe h ALA 112 N 1.45 0.03 -0.79 5.00 0.00 0.12 -2.87 119.26 122.21 2qbe h ALA 112 Ca 0.43 -0.26 0.19 0.00 0.00 0.00 0.00 54.91 55.26 2qbe h ALA 112 Cb 0.20 -0.01 -0.13 0.00 0.00 0.00 0.00 17.79 17.85 2qbe h ALA 112 CO -0.18 -0.20 0.16 0.87 0.00 0.00 0.00 179.25 179.90 2qbe h LYS 113 N -0.42 0.21 0.48 0.00 1.57 0.20 -0.26 116.57 118.36 2qbe h LYS 113 Ca 0.00 -0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.75 2qbe h LYS 113 Cb 0.53 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.79 2qbe h LYS 113 CO 0.01 0.14 -0.24 0.00 -0.57 0.00 0.00 179.45 178.79 2qbe h ALA 114 N 1.69 -0.65 -1.01 3.86 0.00 -1.22 0.32 119.26 122.25 2qbe h ALA 114 Ca 0.46 -0.14 0.23 0.00 0.00 0.00 0.00 54.91 55.46 2qbe h ALA 114 Cb 0.85 0.26 -0.10 0.00 0.00 0.00 0.00 17.79 18.80 2qbe h ALA 114 CO -0.59 -0.87 0.63 0.00 0.00 0.00 0.00 179.25 178.42 2qbe h ALA 115 N -0.13 2.00 -0.00 0.00 0.00 -0.93 0.28 119.26 120.47 2qbe h ALA 115 Ca -0.06 0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 2qbe h ALA 115 Cb 0.51 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.28 2qbe h ALA 115 CO 0.10 -0.39 -0.00 -0.07 0.00 0.00 0.00 179.25 178.89 2qbe h LEU 116 N 0.53 0.00 0.00 0.00 4.07 -0.48 -3.47 115.31 115.96 2qbe h LEU 116 Ca 0.58 -0.57 0.00 0.00 0.08 0.00 0.00 57.88 57.97 2qbe h LEU 116 Cb 1.24 -0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.98 2qbe h LEU 116 CO -0.34 0.57 0.00 0.00 -1.08 0.00 0.00 178.44 177.59