#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qba n LYS 2 N 0.00 0.00 0.00 0.00 0.00 -1.26 -4.94 118.16 111.96 2qba n LYS 2 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 2qba n LYS 2 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.03 2qba n LYS 2 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.40 177.65 2qba n THR 3 N 0.00 0.00 -1.44 0.58 -2.24 -1.26 -4.80 114.28 105.11 2qba n THR 3 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 2qba n THR 3 Cb 0.00 -0.33 0.00 0.00 -2.10 0.00 0.00 70.33 67.90 2qba n THR 3 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 2qba n ILE 4 N -2.09 -4.80 -4.36 2.28 2.08 -1.26 -2.83 119.36 108.38 2qba n ILE 4 Ca 0.00 2.11 -0.19 0.00 0.56 0.00 0.00 62.75 65.23 2qba n ILE 4 Cb 0.04 -2.93 -0.15 0.00 -0.75 0.00 0.00 39.64 35.86 2qba n ILE 4 CO 0.00 0.00 0.00 -0.54 0.56 0.00 0.00 176.55 176.57 2qba s LYS 5 N -3.25 0.83 0.07 0.38 1.02 0.26 -1.85 119.74 117.21 2qba s LYS 5 Ca 0.00 -0.30 0.06 0.00 0.02 0.00 0.00 55.97 55.76 2qba s LYS 5 Cb 0.00 -0.79 -0.03 0.00 -0.52 0.00 0.00 37.83 36.49 2qba s LYS 5 CO 0.00 0.14 -0.17 0.96 -0.92 0.00 0.00 175.35 175.36 2qba s ILE 6 N 0.04 1.36 0.24 2.17 -0.00 -0.25 0.57 121.20 125.33 2qba s ILE 6 Ca -0.00 -1.33 0.11 0.00 -0.00 0.00 0.00 60.65 59.43 2qba s ILE 6 Cb -0.06 -1.26 -0.05 0.00 -0.00 0.00 0.00 42.46 41.09 2qba s ILE 6 CO 0.00 -0.09 -0.16 -0.89 -0.00 0.00 0.00 174.94 173.80 2qba s THR 7 N -1.13 2.74 0.10 8.37 2.01 -0.59 0.12 115.64 127.27 2qba s THR 7 Ca 0.02 -2.09 -0.16 0.00 0.31 0.00 0.00 61.69 59.78 2qba s THR 7 Cb -0.10 -2.40 -0.07 0.00 0.01 0.00 0.00 72.50 69.95 2qba s THR 7 CO 0.03 -0.27 1.47 -0.61 -0.69 0.00 0.00 174.62 174.55 2qba h GLN 8 N 2.58 0.64 0.00 4.92 4.15 -1.81 0.46 115.11 126.04 2qba h GLN 8 Ca -0.44 -0.28 0.00 0.00 0.77 0.00 0.00 58.65 58.71 2qba h GLN 8 Cb 1.23 -0.02 0.00 0.00 0.21 0.00 0.00 27.48 28.90 2qba h GLN 8 CO 0.56 0.86 0.00 2.41 -1.93 0.00 0.00 178.83 180.72 2qba n THR 9 N -4.40 0.00 -4.16 2.39 -1.04 -0.63 -3.47 114.28 102.98 2qba n THR 9 Ca -0.03 0.00 -0.28 0.00 -2.04 0.00 0.00 64.05 61.70 2qba n THR 9 Cb 0.37 0.00 -0.08 0.00 -1.82 0.00 0.00 70.33 68.81 2qba n THR 9 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 2qba s ARG 10 N 0.00 2.50 0.36 -2.82 0.52 -1.25 -4.87 118.95 113.38 2qba s ARG 10 Ca 0.00 -0.96 -0.28 0.00 -0.52 0.00 0.00 55.73 53.97 2qba s ARG 10 Cb 0.00 -2.46 -0.10 0.00 0.52 0.00 0.00 34.95 32.91 2qba s ARG 10 CO 0.00 0.50 1.31 0.45 0.02 0.00 0.00 175.30 177.58 2qba s SER 11 N -2.66 6.62 -0.84 0.23 0.15 -1.26 -4.87 113.70 111.07 2qba s SER 11 Ca 0.27 2.68 0.01 0.00 0.70 0.00 0.00 55.95 59.61 2qba s SER 11 Cb -0.10 -2.65 0.34 0.00 -1.71 0.00 0.00 66.02 61.89 2qba s SER 11 CO 0.19 -0.64 1.56 0.00 1.20 0.00 0.00 173.24 175.55 2qba n ALA 12 N 0.58 5.68 -0.07 5.45 0.00 -1.26 -4.75 120.51 126.13 2qba n ALA 12 Ca 0.01 -4.56 -0.09 0.00 0.00 0.00 0.00 53.44 48.79 2qba n ALA 12 Cb 0.42 -1.65 -0.06 0.00 0.00 0.00 0.00 19.45 18.16 2qba n ALA 12 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 2qba h ILE 13 N 2.43 0.62 -0.80 0.00 2.04 -2.02 -3.39 117.51 116.38 2qba h ILE 13 Ca 0.41 -1.58 -0.47 0.00 1.00 0.00 0.00 64.86 64.23 2qba h ILE 13 Cb 0.37 1.28 -0.26 0.00 -0.74 0.00 0.00 36.82 37.48 2qba h ILE 13 CO 1.09 0.21 0.39 0.61 0.00 0.00 0.00 178.15 180.44 2qba n GLY 14 N 1.62 5.09 3.86 5.37 0.00 -1.26 -5.01 105.19 114.86 2qba n GLY 14 Ca -0.11 -1.54 -0.31 0.00 0.00 0.00 0.00 46.02 44.06 2qba n GLY 14 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2qba s ARG 15 N -3.44 3.84 0.61 1.61 3.00 -1.26 -5.03 118.95 118.28 2qba s ARG 15 Ca 0.55 0.63 -0.19 0.00 0.00 0.00 0.00 55.73 56.72 2qba s ARG 15 Cb 0.46 -2.31 -0.04 0.00 0.00 0.00 0.00 34.95 33.06 2qba s ARG 15 CO 0.04 -0.10 1.03 1.28 0.00 0.00 0.00 175.30 177.55 2qba n LEU 16 N -1.36 4.12 0.05 2.53 7.99 -1.26 -4.73 117.00 124.35 2qba n LEU 16 Ca 0.04 0.82 0.11 0.00 -0.01 0.00 0.00 56.01 56.97 2qba n LEU 16 Cb 0.54 -1.42 0.57 0.00 -0.11 0.00 0.00 43.42 42.99 2qba n LEU 16 CO 0.47 -1.67 1.15 -0.65 -1.51 0.00 0.00 177.39 175.17 2qba h PRO 17 N 0.53 0.22 0.00 3.23 0.11 -2.00 0.22 132.00 134.32 2qba h PRO 17 Ca -0.49 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2qba h PRO 17 Cb 1.36 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.42 2qba h PRO 17 CO 0.51 0.15 0.00 1.63 -0.21 0.00 0.00 178.00 180.08 2qba n LYS 18 N -4.47 0.78 -0.06 1.05 4.76 -1.26 -2.60 118.16 116.36 2qba n LYS 18 Ca 0.05 0.01 -0.06 0.00 -2.87 0.00 0.00 58.31 55.44 2qba n LYS 18 Cb 0.29 -1.50 -0.02 0.00 -1.84 0.00 0.00 35.03 31.96 2qba n LYS 18 CO 0.00 0.00 0.00 0.72 -1.37 0.00 0.00 177.40 176.75 2qba n HIS 19 N -1.05 0.02 -0.21 2.13 8.25 0.74 -3.94 115.22 121.16 2qba n HIS 19 Ca 0.19 0.01 0.31 0.00 -0.26 0.00 0.00 57.72 57.97 2qba n HIS 19 Cb 0.12 -0.32 0.72 0.00 1.12 0.00 0.00 29.99 31.62 2qba n HIS 19 CO 0.00 0.00 0.00 0.87 0.64 0.00 0.00 176.34 177.85 2qba h LYS 20 N -0.63 0.00 0.15 -0.41 1.57 -1.55 0.82 116.57 116.52 2qba h LYS 20 Ca 0.00 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 2qba h LYS 20 Cb 0.62 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.93 2qba h LYS 20 CO 0.00 0.00 -0.07 0.00 -0.57 0.00 0.00 179.45 178.81 2qba h ALA 21 N 1.35 -0.20 -0.47 3.86 0.00 -1.70 0.08 119.26 122.18 2qba h ALA 21 Ca 0.47 -0.12 -0.11 0.00 0.00 0.00 0.00 54.91 55.15 2qba h ALA 21 Cb 2.04 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.89 2qba h ALA 21 CO -0.00 -0.52 -0.12 1.79 0.00 0.00 0.00 179.25 180.40 2qba h THR 22 N -0.39 1.27 -0.88 0.00 1.35 0.04 -2.18 112.91 112.12 2qba h THR 22 Ca -0.02 -1.25 0.22 0.00 -0.55 0.00 0.00 66.41 64.81 2qba h THR 22 Cb 0.31 1.10 -0.05 0.00 -1.73 0.00 0.00 68.15 67.77 2qba h THR 22 CO 0.03 0.43 0.60 0.25 -0.25 0.00 0.00 175.52 176.59 2qba h LEU 23 N 0.77 0.24 -0.23 3.87 7.12 0.53 0.26 115.31 127.86 2qba h LEU 23 Ca 0.12 0.03 -0.10 0.00 0.13 0.00 0.00 57.88 58.05 2qba h LEU 23 Cb 0.67 -0.02 -0.00 0.00 -0.53 0.00 0.00 40.66 40.78 2qba h LEU 23 CO 0.05 0.09 -0.26 0.25 -0.13 0.00 0.00 178.44 178.43 2qba h LEU 24 N 0.23 0.63 -2.00 2.25 5.85 -0.33 -3.00 115.31 118.94 2qba h LEU 24 Ca 0.45 -0.49 0.21 0.00 0.84 0.00 0.00 57.88 58.88 2qba h LEU 24 Cb 1.37 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 42.20 2qba h LEU 24 CO -0.11 0.99 0.52 1.23 -0.34 0.00 0.00 178.44 180.73 2qba h GLY 25 N 0.28 0.00 -0.65 3.75 0.00 -0.27 0.95 103.07 107.13 2qba h GLY 25 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.36 2qba h GLY 25 CO 0.06 0.00 0.00 1.04 0.00 0.00 0.00 176.54 177.64 2qba n LEU 26 N -4.31 1.68 -0.17 3.11 4.77 -1.09 -4.91 117.00 116.07 2qba n LEU 26 Ca 0.14 -0.57 -0.02 0.00 -0.03 0.00 0.00 56.01 55.53 2qba n LEU 26 Cb 0.79 -0.01 -0.01 0.00 -2.33 0.00 0.00 43.42 41.86 2qba n LEU 26 CO 0.38 0.29 -0.02 0.61 -1.33 0.00 0.00 177.39 177.31 2qba n GLY 27 N 1.19 0.24 3.65 -0.72 0.00 0.33 -4.88 105.19 104.99 2qba n GLY 27 Ca 0.18 -0.01 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 2qba n GLY 27 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qba s LEU 28 N -0.52 4.14 0.00 0.99 1.43 -1.14 -4.92 118.68 118.65 2qba s LEU 28 Ca 0.00 2.12 0.00 0.00 -1.03 0.00 0.00 54.13 55.22 2qba s LEU 28 Cb 0.00 -3.53 0.00 0.00 0.03 0.00 0.00 46.19 42.69 2qba s LEU 28 CO 0.00 -1.15 0.00 0.54 0.23 0.00 0.00 176.35 175.97 2qba n ARG 29 N 7.54 0.00 -0.50 1.70 1.74 -1.26 -4.76 116.66 121.11 2qba n ARG 29 Ca 0.20 0.00 -0.30 0.00 -0.77 0.00 0.00 57.85 56.97 2qba n ARG 29 Cb 0.43 -0.00 0.28 0.00 -1.02 0.00 0.00 32.46 32.15 2qba n ARG 29 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 2qba s ARG 30 N 0.00 -2.39 0.00 5.56 3.00 -1.26 -4.89 118.95 118.97 2qba s ARG 30 Ca 0.00 0.22 0.32 0.00 0.00 0.00 0.00 55.73 56.26 2qba s ARG 30 Cb 0.00 -1.43 1.87 0.00 0.00 0.00 0.00 34.95 35.39 2qba s ARG 30 CO 0.00 -4.54 2.21 0.44 0.00 0.00 0.00 175.30 173.40 2qba n ILE 31 N -5.41 0.00 -2.09 1.52 -5.35 -1.26 -3.19 119.36 103.59 2qba n ILE 31 Ca 0.11 -0.01 0.02 0.00 -0.27 0.00 0.00 62.75 62.60 2qba n ILE 31 Cb 0.59 -0.46 0.02 0.00 -1.74 0.00 0.00 39.64 38.05 2qba n ILE 31 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2qba n GLY 32 N 1.00 1.13 0.20 3.28 0.00 -1.26 -1.61 105.19 107.94 2qba n GLY 32 Ca 0.24 -0.40 -0.07 0.00 0.00 0.00 0.00 46.02 45.78 2qba n GLY 32 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 2qba h HIS 33 N 0.36 -0.60 -3.78 1.61 2.76 -1.89 -3.46 115.15 110.15 2qba h HIS 33 Ca -0.07 0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.11 2qba h HIS 33 Cb 1.52 0.25 0.00 0.00 1.55 0.00 0.00 27.41 30.73 2qba h HIS 33 CO 0.14 -0.26 -0.75 2.41 -1.30 0.00 0.00 177.93 178.18 2qba n THR 34 N -3.64-10.98 -4.19 6.26 -1.04 -1.23 -4.97 114.28 94.50 2qba n THR 34 Ca -0.04 2.60 -0.12 0.00 -2.04 0.00 0.00 64.05 64.44 2qba n THR 34 Cb 0.18 -5.01 -0.10 0.00 -1.82 0.00 0.00 70.33 63.57 2qba n THR 34 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 2qba s VAL 35 N -0.42 0.86 -0.24 12.58 0.11 0.12 -4.93 120.40 128.48 2qba s VAL 35 Ca 0.00 -1.92 -0.05 0.00 -2.93 0.00 0.00 61.98 57.08 2qba s VAL 35 Cb 0.00 -1.67 -0.01 0.00 -1.53 0.00 0.00 36.38 33.17 2qba s VAL 35 CO 0.00 -0.79 0.01 -0.70 -3.33 0.00 0.00 175.10 170.29 2qba s GLU 36 N -3.64 3.35 0.00 1.54 2.12 -1.26 -1.09 118.70 119.73 2qba s GLU 36 Ca 0.12 -0.66 0.00 0.00 0.36 0.00 0.00 54.97 54.79 2qba s GLU 36 Cb 0.03 -3.15 0.00 0.00 0.26 0.00 0.00 34.13 31.27 2qba s GLU 36 CO -0.02 -0.26 0.00 -2.13 -0.54 0.00 0.00 175.26 172.31 2qba n ARG 37 N 4.83 2.17 0.00 4.30 3.00 -0.77 -5.02 116.66 125.17 2qba n ARG 37 Ca -0.17 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.68 2qba n ARG 37 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.96 2qba n ARG 37 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.63 178.02 2qba n GLU 38 N 0.00 3.85 -0.60 -0.14 4.71 -1.13 -4.42 120.64 122.91 2qba n GLU 38 Ca 0.00 0.00 0.03 0.00 -0.01 0.00 0.00 57.16 57.18 2qba n GLU 38 Cb 0.00 0.00 0.04 0.00 -1.01 0.00 0.00 31.44 30.47 2qba n GLU 38 CO 0.00 0.00 0.00 -3.47 0.09 0.00 0.00 177.13 173.75 2qba n ASP 39 N 0.00 0.71 -4.76 1.62 -0.08 -1.26 -4.43 116.55 108.35 2qba n ASP 39 Ca 0.00 -2.31 -0.40 0.00 -1.51 0.00 0.00 54.79 50.57 2qba n ASP 39 Cb 0.00 -0.28 0.02 0.00 2.34 0.00 0.00 41.12 43.20 2qba n ASP 39 CO 0.00 0.00 0.00 -0.89 0.12 0.00 0.00 177.20 176.43 2qba s THR 40 N -0.72 2.13 0.42 5.18 2.01 -1.26 -4.55 115.64 118.84 2qba s THR 40 Ca 0.14 0.11 0.23 0.00 0.31 0.00 0.00 61.69 62.48 2qba s THR 40 Cb 0.14 -3.07 0.43 0.00 0.01 0.00 0.00 72.50 70.01 2qba s THR 40 CO -0.03 0.01 1.73 -0.65 -0.69 0.00 0.00 174.62 175.00 2qba h PRO 41 N 2.27 0.27 0.20 4.92 0.11 -1.98 0.26 132.00 138.05 2qba h PRO 41 Ca -0.51 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.58 2qba h PRO 41 Cb 1.27 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.32 2qba h PRO 41 CO 0.61 0.18 -0.10 0.00 -0.21 0.00 0.00 178.00 178.48 2qba h ALA 42 N 1.60 -0.27 -0.07 -0.75 0.00 -1.98 0.38 119.26 118.17 2qba h ALA 42 Ca 0.65 -0.21 0.02 0.00 0.00 0.00 0.00 54.91 55.37 2qba h ALA 42 Cb 1.85 0.10 -0.00 0.00 0.00 0.00 0.00 17.79 19.74 2qba h ALA 42 CO -0.31 -0.39 0.11 0.97 0.00 0.00 0.00 179.25 179.64 2qba h ILE 43 N -0.80 0.31 0.10 0.00 6.09 -1.46 0.35 117.51 122.10 2qba h ILE 43 Ca -0.03 0.00 -0.30 0.00 -1.37 0.00 0.00 64.86 63.16 2qba h ILE 43 Cb 0.51 0.90 -0.01 0.00 0.47 0.00 0.00 36.82 38.69 2qba h ILE 43 CO 0.04 0.00 -1.53 -0.09 -3.07 0.00 0.00 178.15 173.51 2qba h ARG 44 N 0.00 0.21 -0.46 2.19 9.65 -0.39 -3.27 114.38 122.31 2qba h ARG 44 Ca 0.03 -0.37 -0.13 0.00 -1.10 0.00 0.00 59.98 58.42 2qba h ARG 44 Cb 0.26 0.14 -0.01 0.00 -1.39 0.00 0.00 29.97 28.96 2qba h ARG 44 CO -0.00 1.06 -0.21 0.78 2.80 0.00 0.00 179.97 184.40 2qba h GLY 45 N 1.88 1.02 0.55 2.80 0.00 0.34 -2.80 103.07 106.87 2qba h GLY 45 Ca -0.24 -0.89 0.08 0.00 0.00 0.00 0.00 47.33 46.29 2qba h GLY 45 CO 0.15 0.81 0.42 -0.33 0.00 0.00 0.00 176.54 177.59 2qba h MET 46 N 0.81 0.70 0.53 4.80 2.86 -0.77 -1.82 114.93 122.04 2qba h MET 46 Ca 0.11 -0.04 -0.02 0.00 -2.06 0.00 0.00 59.70 57.69 2qba h MET 46 Cb 0.77 -0.16 -0.01 0.00 0.06 0.00 0.00 31.60 32.26 2qba h MET 46 CO 0.06 0.46 -0.40 0.82 1.06 0.00 0.00 176.91 178.91 2qba h ILE 47 N 0.72 0.18 -0.74 -1.22 1.08 -1.56 -2.76 117.51 113.21 2qba h ILE 47 Ca 0.36 0.00 0.14 0.00 -0.39 0.00 0.00 64.86 64.97 2qba h ILE 47 Cb 0.31 0.18 -0.14 0.00 -3.07 0.00 0.00 36.82 34.11 2qba h ILE 47 CO -0.24 0.00 -0.27 -1.13 -0.69 0.00 0.00 178.15 175.82 2qba h ASN 48 N -0.91 -0.98 -0.38 1.72 -0.00 -1.17 0.74 115.58 114.60 2qba h ASN 48 Ca -0.06 0.24 0.06 0.00 -0.00 0.00 0.00 56.30 56.54 2qba h ASN 48 Cb 0.77 0.55 -0.08 0.00 -0.00 0.00 0.00 38.32 39.56 2qba h ASN 48 CO 0.01 -0.28 -0.49 0.00 -0.00 0.00 0.00 177.43 176.67 2qba h ALA 49 N 1.45 -0.61 -0.96 1.57 0.00 -1.08 -0.81 119.26 118.83 2qba h ALA 49 Ca 0.32 0.03 -0.59 0.00 0.00 0.00 0.00 54.91 54.66 2qba h ALA 49 Cb 0.57 0.99 -0.30 0.00 0.00 0.00 0.00 17.79 19.05 2qba h ALA 49 CO -0.79 -0.96 0.68 1.33 0.00 0.00 0.00 179.25 179.52 2qba n VAL 50 N -5.40 3.39 0.00 0.00 0.24 -0.48 -4.68 118.33 111.40 2qba n VAL 50 Ca -0.02 -2.63 -0.09 0.00 -2.04 0.00 0.00 64.34 59.56 2qba n VAL 50 Cb 0.35 -0.88 -0.03 0.00 -1.47 0.00 0.00 33.84 31.81 2qba n VAL 50 CO 0.00 0.00 0.00 0.77 -2.14 0.00 0.00 176.83 175.46 2qba h SER 51 N 1.61 -0.58 -0.55 -1.34 4.64 0.20 0.22 113.55 117.75 2qba h SER 51 Ca 0.59 0.10 0.16 0.00 -0.47 0.00 0.00 61.79 62.17 2qba h SER 51 Cb 1.61 0.26 -0.02 0.00 -0.31 0.00 0.00 62.40 63.94 2qba h SER 51 CO 1.33 -0.24 0.58 2.19 -0.87 0.00 0.00 176.83 179.82 2qba h PHE 52 N -0.24 0.00 0.00 4.77 -0.00 -1.83 -3.09 116.94 116.54 2qba h PHE 52 Ca 0.10 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 58.07 2qba h PHE 52 Cb 0.38 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 36.33 2qba h PHE 52 CO -0.29 0.00 0.00 -1.33 -0.00 0.00 0.00 178.31 176.69 2qba n MET 53 N -3.69 0.00 -0.70 6.09 2.81 0.33 -4.82 117.12 117.13 2qba n MET 53 Ca 0.11 0.19 -0.32 0.00 -1.81 0.00 0.00 57.70 55.86 2qba n MET 53 Cb 0.79 -0.61 0.16 0.00 -0.71 0.00 0.00 33.22 32.85 2qba n MET 53 CO 0.00 0.00 0.00 1.33 1.51 0.00 0.00 175.97 178.81 2qba n VAL 54 N -1.75 0.00 -3.81 2.03 0.24 0.50 -3.93 118.33 111.61 2qba n VAL 54 Ca 0.00 -0.24 -0.30 0.00 -2.04 0.00 0.00 64.34 61.76 2qba n VAL 54 Cb 0.00 -0.70 -0.15 0.00 -1.47 0.00 0.00 33.84 31.52 2qba n VAL 54 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 2qba s LYS 55 N -3.76 0.94 0.55 7.34 2.20 0.16 -4.83 119.74 122.35 2qba s LYS 55 Ca 0.59 -1.16 -0.21 0.00 -0.36 0.00 0.00 55.97 54.83 2qba s LYS 55 Cb -0.19 -2.28 -0.05 0.00 -1.51 0.00 0.00 37.83 33.81 2qba s LYS 55 CO 0.66 -0.91 1.24 0.08 -0.36 0.00 0.00 175.35 176.06 2qba s VAL 56 N 1.48 2.58 -0.33 4.02 1.01 -1.26 -1.53 120.40 126.38 2qba s VAL 56 Ca 0.07 0.40 0.06 0.00 0.00 0.00 0.00 61.98 62.52 2qba s VAL 56 Cb -0.18 -3.19 0.19 0.00 0.00 0.00 0.00 36.38 33.20 2qba s VAL 56 CO -0.19 -0.04 0.56 -0.70 0.00 0.00 0.00 175.10 174.73 2qba s GLU 57 N -3.05 0.61 0.00 2.72 -6.30 0.19 -4.93 118.70 107.94 2qba s GLU 57 Ca 0.72 0.20 0.00 0.00 -2.50 0.00 0.00 54.97 53.40 2qba s GLU 57 Cb -0.33 0.08 0.00 0.00 0.00 0.00 0.00 34.13 33.88 2qba s GLU 57 CO 0.38 -1.09 0.46 0.39 0.02 0.00 0.00 175.26 175.41