#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qbj n ARG 2 N 0.00 0.37 0.00 0.00 5.12 -1.26 -4.94 116.66 115.95 2qbj n ARG 2 Ca 0.00 -1.41 0.00 0.00 -1.93 0.00 0.00 57.85 54.51 2qbj n ARG 2 Cb 0.00 0.24 0.00 0.00 -1.16 0.00 0.00 32.46 31.54 2qbj n ARG 2 CO 0.00 0.00 0.00 0.98 -1.93 0.00 0.00 177.63 176.68 2qbj n TYR 3 N -0.23 0.00 -2.83 -1.55 9.36 -1.26 -4.76 117.16 115.90 2qbj n TYR 3 Ca -0.17 0.00 -0.11 0.00 3.32 0.00 0.00 57.90 60.94 2qbj n TYR 3 Cb 0.83 0.00 0.05 0.00 -0.63 0.00 0.00 39.34 39.60 2qbj n TYR 3 CO 0.00 0.00 0.00 1.28 0.22 0.00 0.00 176.86 178.36 2qbj n LEU 4 N 0.00 -3.92 0.00 2.98 4.32 -1.26 -5.04 117.00 114.08 2qbj n LEU 4 Ca 0.00 -0.45 -0.07 0.00 -0.02 0.00 0.00 56.01 55.47 2qbj n LEU 4 Cb 0.00 -2.31 -0.02 0.00 -1.62 0.00 0.00 43.42 39.47 2qbj n LEU 4 CO 0.00 0.16 0.00 0.61 -1.22 0.00 0.00 177.39 176.95 2qbj n GLY 5 N -1.20 3.26 3.56 -0.72 0.00 -1.26 -5.06 105.19 103.77 2qbj n GLY 5 Ca -0.12 -1.64 -0.19 0.00 0.00 0.00 0.00 46.02 44.06 2qbj n GLY 5 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2qbj s PRO 6 N -2.43 1.95 0.60 1.61 0.04 -1.26 -4.79 135.00 130.71 2qbj s PRO 6 Ca 0.14 -0.06 0.29 0.00 0.04 0.00 0.00 61.00 61.41 2qbj s PRO 6 Cb 0.00 -4.95 1.19 0.00 0.04 0.00 0.00 34.50 30.78 2qbj s PRO 6 CO 0.10 -4.19 1.54 0.87 0.04 0.00 0.00 177.00 175.35 2qbj h LYS 7 N 11.78 0.00 -0.87 4.56 1.57 -1.97 0.26 116.57 131.90 2qbj h LYS 7 Ca 0.06 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.83 2qbj h LYS 7 Cb 1.00 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 33.26 2qbj h LYS 7 CO 1.10 0.00 0.51 -0.07 -0.57 0.00 0.00 179.45 180.41 2qbj h LEU 8 N 0.00 1.06 -0.35 2.94 -0.00 -1.93 -3.14 115.31 113.89 2qbj h LEU 8 Ca 0.43 -0.08 0.04 0.00 -0.00 0.00 0.00 57.88 58.27 2qbj h LEU 8 Cb 2.36 -0.27 -0.06 0.00 -0.00 0.00 0.00 40.66 42.68 2qbj h LEU 8 CO -0.00 0.83 -0.43 0.50 -0.00 0.00 0.00 178.44 179.34 2qbj h LYS 9 N 1.20 -0.26 -0.28 1.13 3.64 -0.86 0.41 116.57 121.55 2qbj h LYS 9 Ca 0.31 0.02 0.04 0.00 -1.27 0.00 0.00 60.65 59.74 2qbj h LYS 9 Cb -0.02 0.06 -0.06 0.00 -0.41 0.00 0.00 32.23 31.80 2qbj h LYS 9 CO -0.06 -0.17 -0.47 -0.07 -2.27 0.00 0.00 179.45 176.41 2qbj h LEU 10 N -0.27 -1.54 -0.88 5.20 3.38 -1.71 0.55 115.31 120.04 2qbj h LEU 10 Ca 0.06 0.20 0.18 0.00 0.09 0.00 0.00 57.88 58.41 2qbj h LEU 10 Cb 0.44 0.62 -0.11 0.00 0.09 0.00 0.00 40.66 41.70 2qbj h LEU 10 CO -0.48 -0.36 0.44 0.28 0.09 0.00 0.00 178.44 178.41 2qbj h SER 11 N -0.38 0.47 -0.41 -0.43 0.02 -1.41 0.39 113.55 111.81 2qbj h SER 11 Ca 0.05 0.12 -0.07 0.00 -0.84 0.00 0.00 61.79 61.05 2qbj h SER 11 Cb 0.52 0.06 -0.01 0.00 0.14 0.00 0.00 62.40 63.10 2qbj h SER 11 CO -0.46 0.13 -0.02 0.03 -1.14 0.00 0.00 176.83 175.37 2qbj h ARG 12 N 0.54 0.73 0.69 3.45 3.08 0.17 -1.24 114.38 121.81 2qbj h ARG 12 Ca 0.51 -0.24 -0.03 0.00 0.07 0.00 0.00 59.98 60.29 2qbj h ARG 12 Cb 0.85 -0.06 0.01 0.00 0.08 0.00 0.00 29.97 30.85 2qbj h ARG 12 CO -0.43 0.83 -0.33 -0.09 -1.07 0.00 0.00 179.97 178.87 2qbj h ARG 13 N 0.56 -0.89 -0.55 0.04 9.65 0.17 -3.26 114.38 120.10 2qbj h ARG 13 Ca 0.11 0.06 0.11 0.00 -1.10 0.00 0.00 59.98 59.16 2qbj h ARG 13 Cb 0.50 0.20 -0.09 0.00 -1.39 0.00 0.00 29.97 29.20 2qbj h ARG 13 CO 0.02 -0.59 0.03 0.93 2.80 0.00 0.00 179.97 183.17 2qbj h GLU 14 N -1.24 0.15 0.00 0.20 4.39 -0.38 -3.47 114.58 114.22 2qbj h GLU 14 Ca -0.09 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.60 2qbj h GLU 14 Cb 0.72 -0.03 0.00 0.00 -0.10 0.00 0.00 28.75 29.34 2qbj h GLU 14 CO 0.16 0.10 0.00 0.41 -1.16 0.00 0.00 179.01 178.51 2qbj n GLY 15 N -1.33 3.17 3.94 -3.84 0.00 -0.47 -5.06 105.19 101.61 2qbj n GLY 15 Ca 0.07 -0.64 -0.24 0.00 0.00 0.00 0.00 46.02 45.20 2qbj n GLY 15 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2qbj s THR 16 N 0.00 3.05 -0.66 2.61 2.01 -1.24 -4.57 115.64 116.85 2qbj s THR 16 Ca 0.00 -0.32 -0.25 0.00 0.31 0.00 0.00 61.69 61.43 2qbj s THR 16 Cb 0.00 -3.21 0.05 0.00 0.01 0.00 0.00 72.50 69.35 2qbj s THR 16 CO 0.00 -0.19 1.08 -0.62 -0.69 0.00 0.00 174.62 174.20 2qbj s ASP 17 N -4.38 6.22 0.00 3.53 2.15 -1.26 -4.51 116.67 118.42 2qbj s ASP 17 Ca 0.56 -0.62 0.00 0.00 0.43 0.00 0.00 52.55 52.92 2qbj s ASP 17 Cb -0.10 -2.48 0.00 0.00 -0.30 0.00 0.00 42.92 40.04 2qbj s ASP 17 CO 0.42 -1.53 0.21 0.18 -0.17 0.00 0.00 175.17 174.28 2qbj n LEU 18 N 8.25 0.48 -0.57 -1.34 7.99 -1.26 -4.69 117.00 125.85 2qbj n LEU 18 Ca 0.00 -0.24 -0.06 0.00 -0.01 0.00 0.00 56.01 55.71 2qbj n LEU 18 Cb 0.47 -0.17 -0.02 0.00 -0.11 0.00 0.00 43.42 43.58 2qbj n LEU 18 CO 0.67 0.10 -0.05 0.49 -1.51 0.00 0.00 177.39 177.09 2qbj n PHE 19 N 0.42 -0.13 0.23 -1.77 3.72 -1.26 -4.73 117.46 113.94 2qbj n PHE 19 Ca 0.00 0.00 0.15 0.00 -0.05 0.00 0.00 57.45 57.55 2qbj n PHE 19 Cb 0.10 -2.00 0.80 0.00 -0.94 0.00 0.00 39.48 37.44 2qbj n PHE 19 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 176.76 176.64 2qbj h LEU 20 N 0.00 0.00 -5.29 4.37 3.38 -1.90 -1.83 115.31 114.04 2qbj h LEU 20 Ca -0.12 0.00 -0.51 0.00 0.09 0.00 0.00 57.88 57.34 2qbj h LEU 20 Cb 0.78 0.00 -0.41 0.00 0.09 0.00 0.00 40.66 41.12 2qbj h LEU 20 CO 0.17 0.00 -0.93 1.17 0.09 0.00 0.00 178.44 178.94 2qbj n LYS 21 N -2.53 2.22 0.00 1.13 3.00 -1.26 -4.91 118.16 115.81 2qbj n LYS 21 Ca -0.02 -4.06 0.00 0.00 -0.00 0.00 0.00 58.31 54.24 2qbj n LYS 21 Cb 0.05 -1.90 0.00 0.00 0.00 0.00 0.00 35.03 33.18 2qbj n LYS 21 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.40 177.83 2qbj n SER 22 N -0.10 0.45 -3.06 3.14 7.64 -0.69 -4.65 113.62 116.35 2qbj n SER 22 Ca 0.27 -0.57 -0.13 0.00 1.01 0.00 0.00 58.87 59.45 2qbj n SER 22 Cb 0.60 -0.14 0.12 0.00 -1.01 0.00 0.00 64.21 63.78 2qbj n SER 22 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2qbj n GLY 23 N 0.50 -3.51 0.00 0.23 0.00 -1.26 -4.69 105.19 96.46 2qbj n GLY 23 Ca 0.00 -1.31 0.00 0.00 0.00 0.00 0.00 46.02 44.71 2qbj n GLY 23 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2qbj n VAL 24 N -4.04 0.00 0.00 1.61 0.24 -1.26 -4.83 118.33 110.05 2qbj n VAL 24 Ca 0.06 0.13 0.00 0.00 -2.04 0.00 0.00 64.34 62.49 2qbj n VAL 24 Cb 0.26 -0.97 0.00 0.00 -1.47 0.00 0.00 33.84 31.66 2qbj n VAL 24 CO 0.00 0.00 0.00 -2.11 -2.14 0.00 0.00 176.83 172.58 2qbj n ARG 25 N 0.00 1.19 0.00 7.34 -4.01 -1.26 -4.86 116.66 115.06 2qbj n ARG 25 Ca 0.00 0.00 0.00 0.00 -1.04 0.00 0.00 57.85 56.81 2qbj n ARG 25 Cb 0.00 0.00 0.00 0.00 -3.04 0.00 0.00 32.46 29.42 2qbj n ARG 25 CO 0.00 0.00 0.00 0.00 -3.04 0.00 0.00 177.63 174.59 2qbj n ALA 26 N -3.00 0.00 -2.73 2.89 0.00 -1.26 -4.99 120.51 111.42 2qbj n ALA 26 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.42 2qbj n ALA 26 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 2qbj n ALA 26 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2qbj n ILE 27 N 0.00-11.24 -0.54 0.00 5.41 -1.26 -4.84 119.36 106.88 2qbj n ILE 27 Ca 0.00 2.04 0.03 0.00 1.00 0.00 0.00 62.75 65.82 2qbj n ILE 27 Cb 0.00 -6.34 -0.02 0.00 -0.71 0.00 0.00 39.64 32.57 2qbj n ILE 27 CO 0.00 0.00 0.00 -0.67 0.00 0.00 0.00 176.55 175.88 2qbj n ASP 28 N 1.20 -2.94 -1.44 4.38 -0.08 -1.26 -5.02 116.55 111.39 2qbj n ASP 28 Ca -0.16 0.61 0.18 0.00 -1.51 0.00 0.00 54.79 53.91 2qbj n ASP 28 Cb 0.28 -1.47 -0.08 0.00 2.34 0.00 0.00 41.12 42.18 2qbj n ASP 28 CO 0.00 0.00 0.00 0.41 0.12 0.00 0.00 177.20 177.73 2qbj n THR 29 N -2.34 -0.43 -2.11 5.18 -1.04 -1.26 -4.78 114.28 107.49 2qbj n THR 29 Ca -0.02 0.69 -0.20 0.00 -2.04 0.00 0.00 64.05 62.49 2qbj n THR 29 Cb 0.21 -1.17 -0.04 0.00 -1.82 0.00 0.00 70.33 67.51 2qbj n THR 29 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 2qbj n LYS 30 N -4.30 -1.53 0.00 -2.82 4.01 -1.26 -4.39 118.16 107.88 2qbj n LYS 30 Ca -0.06 1.05 0.00 0.00 -0.51 0.00 0.00 58.31 58.79 2qbj n LYS 30 Cb 0.68 -5.57 0.00 0.00 -0.51 0.00 0.00 35.03 29.62 2qbj n LYS 30 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2qbj n LYS 32 N 0.00 -4.11 -1.22 0.00 5.02 -1.26 -4.98 118.16 111.60 2qbj n LYS 32 Ca 0.00 0.43 -0.36 0.00 -2.02 0.00 0.00 58.31 56.37 2qbj n LYS 32 Cb 0.00 -4.27 0.08 0.00 -0.02 0.00 0.00 35.03 30.82 2qbj n LYS 32 CO 0.00 0.00 0.00 1.51 -0.52 0.00 0.00 177.40 178.39 2qbj n ILE 33 N -3.70 1.86 -3.49 -0.18 0.13 -1.26 -3.62 119.36 109.09 2qbj n ILE 33 Ca -0.01 -0.36 -0.27 0.00 -1.10 0.00 0.00 62.75 61.01 2qbj n ILE 33 Cb 0.54 -0.84 0.02 0.00 -0.84 0.00 0.00 39.64 38.51 2qbj n ILE 33 CO 0.00 0.00 0.00 1.21 2.80 0.00 0.00 176.55 180.56 2qbj n GLU 34 N -1.27 -1.80 0.06 9.51 4.07 -1.26 -4.82 120.64 125.13 2qbj n GLU 34 Ca 0.11 1.28 0.00 0.00 -0.06 0.00 0.00 57.16 58.49 2qbj n GLU 34 Cb 0.50 -2.90 0.00 0.00 -0.06 0.00 0.00 31.44 28.98 2qbj n GLU 34 CO 0.00 0.00 0.00 1.04 -0.06 0.00 0.00 177.13 178.11 2qbj n GLN 35 N -1.19 0.00 -3.22 5.31 3.00 -1.24 -5.11 117.38 114.94 2qbj n GLN 35 Ca -0.14 0.00 -0.01 0.00 -0.01 0.00 0.00 57.00 56.84 2qbj n GLN 35 Cb 0.65 0.00 -0.03 0.00 0.00 0.00 0.00 30.24 30.86 2qbj n GLN 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2qbj s ALA 36 N -1.26 -1.89 0.34 -1.58 0.00 -1.26 -4.29 121.76 111.81 2qbj s ALA 36 Ca 0.00 0.86 0.08 0.00 0.00 0.00 0.00 51.96 52.90 2qbj s ALA 36 Cb 0.00 -2.28 0.80 0.00 0.00 0.00 0.00 23.12 21.63 2qbj s ALA 36 CO 0.00 -1.70 1.85 -1.35 0.00 0.00 0.00 175.76 174.56 2qbj h PRO 37 N 8.07 0.70 0.00 0.00 0.11 -1.82 -3.44 132.00 135.61 2qbj h PRO 37 Ca -0.07 -0.04 -0.11 0.00 0.11 0.00 0.00 66.00 65.89 2qbj h PRO 37 Cb 1.16 -0.16 -0.02 0.00 0.11 0.00 0.00 31.00 32.09 2qbj h PRO 37 CO 0.21 0.46 -0.09 0.41 -0.21 0.00 0.00 178.00 178.78 2qbj n GLY 38 N -1.42 3.92 0.32 -0.55 0.00 -1.26 -4.81 105.19 101.39 2qbj n GLY 38 Ca 0.18 -1.92 0.07 0.00 0.00 0.00 0.00 46.02 44.36 2qbj n GLY 38 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 2qbj h GLN 39 N 0.00 0.71 -0.02 1.61 5.75 -2.04 -0.71 115.11 120.40 2qbj h GLN 39 Ca -0.06 -0.04 0.00 0.00 -0.15 0.00 0.00 58.65 58.40 2qbj h GLN 39 Cb 0.24 -0.16 0.00 0.00 1.07 0.00 0.00 27.48 28.63 2qbj h GLN 39 CO 0.09 0.47 -0.09 0.72 -2.65 0.00 0.00 178.83 177.38 2qbj n HIS 40 N -4.79 0.00 -0.05 3.99 8.25 -1.26 -4.40 115.22 116.95 2qbj n HIS 40 Ca 0.17 0.00 0.24 0.00 -0.26 0.00 0.00 57.72 57.88 2qbj n HIS 40 Cb 0.41 -0.01 0.62 0.00 1.12 0.00 0.00 29.99 32.13 2qbj n HIS 40 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 2qbj h GLY 41 N 4.77 0.00 0.66 -1.41 0.00 -1.42 -0.93 103.07 104.76 2qbj h GLY 41 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2qbj h GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.54 2qbj n ALA 42 N -2.31 1.03 -2.18 3.60 0.00 -1.26 -4.56 120.51 114.82 2qbj n ALA 42 Ca 0.15 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.39 2qbj n ALA 42 Cb 1.03 -0.69 -0.02 0.00 0.00 0.00 0.00 19.45 19.77 2qbj n ALA 42 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2qbj s ARG 43 N -1.68 2.62 -0.81 0.00 1.81 -0.35 -5.05 118.95 115.48 2qbj s ARG 43 Ca 0.00 -1.45 0.01 0.00 -1.72 0.00 0.00 55.73 52.57 2qbj s ARG 43 Cb 0.00 -2.48 0.20 0.00 -0.45 0.00 0.00 34.95 32.22 2qbj s ARG 43 CO 0.00 -0.20 0.66 0.21 -0.68 0.00 0.00 175.30 175.29 2qbj s LYS 44 N -4.18 2.93 0.55 3.54 2.20 -1.26 -5.05 119.74 118.46 2qbj s LYS 44 Ca 0.49 -3.33 -0.19 0.00 -0.36 0.00 0.00 55.97 52.59 2qbj s LYS 44 Cb -0.05 -3.72 -0.05 0.00 -1.51 0.00 0.00 37.83 32.49 2qbj s LYS 44 CO 0.29 -1.28 1.09 -1.25 -0.36 0.00 0.00 175.35 173.85 2qbj s PRO 45 N -1.43 3.39 -0.19 4.03 0.04 -1.26 -5.04 135.00 134.54 2qbj s PRO 45 Ca 0.26 1.47 -0.09 0.00 0.04 0.00 0.00 61.00 62.68 2qbj s PRO 45 Cb -0.06 -2.02 -0.05 0.00 0.04 0.00 0.00 34.50 32.41 2qbj s PRO 45 CO -0.15 -0.79 0.13 1.03 0.04 0.00 0.00 177.00 177.26 2qbj s ARG 46 N -3.48 4.08 -0.02 4.56 0.52 -1.26 -5.09 118.95 118.25 2qbj s ARG 46 Ca 0.69 -0.22 -0.01 0.00 -0.52 0.00 0.00 55.73 55.68 2qbj s ARG 46 Cb -0.20 -3.37 -0.04 0.00 0.52 0.00 0.00 34.95 31.85 2qbj s ARG 46 CO 0.28 0.36 0.07 -0.51 0.02 0.00 0.00 175.30 175.52 2qbj s LEU 47 N 0.19 3.86 0.35 2.53 1.02 -1.26 -5.08 118.68 120.29 2qbj s LEU 47 Ca 0.09 0.16 0.07 0.00 0.02 0.00 0.00 54.13 54.46 2qbj s LEU 47 Cb -0.11 -2.18 -0.01 0.00 0.02 0.00 0.00 46.19 43.91 2qbj s LEU 47 CO -0.01 0.30 0.45 -0.55 0.02 0.00 0.00 176.35 176.56 2qbj s SER 48 N -1.56 5.75 0.14 2.29 0.15 -1.26 -4.72 113.70 114.49 2qbj s SER 48 Ca 0.21 -0.31 -0.07 0.00 0.70 0.00 0.00 55.95 56.48 2qbj s SER 48 Cb -0.12 -1.05 0.19 0.00 -1.71 0.00 0.00 66.02 63.33 2qbj s SER 48 CO 0.11 -0.49 0.85 0.47 1.20 0.00 0.00 173.24 175.39 2qbj n ASP 49 N -1.63 -0.28 0.42 5.45 9.92 -1.26 0.11 116.55 129.29 2qbj n ASP 49 Ca 0.01 0.95 -0.19 0.00 -0.53 0.00 0.00 54.79 55.04 2qbj n ASP 49 Cb 0.59 -0.25 -0.09 0.00 -0.64 0.00 0.00 41.12 40.72 2qbj n ASP 49 CO 0.00 0.00 0.00 0.22 0.13 0.00 0.00 177.20 177.55 2qbj h TYR 50 N 0.00 -0.97 -0.65 1.24 3.20 -1.99 -1.29 116.97 116.52 2qbj h TYR 50 Ca 0.23 -0.02 0.13 0.00 3.14 0.00 0.00 58.73 62.20 2qbj h TYR 50 Cb 0.36 0.32 -0.12 0.00 1.54 0.00 0.00 36.73 38.83 2qbj h TYR 50 CO -0.45 -0.60 -0.19 0.78 -1.64 0.00 0.00 178.16 176.06 2qbj h GLY 51 N -1.07 0.38 0.66 1.82 0.00 0.45 0.14 103.07 105.45 2qbj h GLY 51 Ca -0.11 0.25 0.01 0.00 0.00 0.00 0.00 47.33 47.49 2qbj h GLY 51 CO 0.18 -0.25 -0.21 -2.08 0.00 0.00 0.00 176.54 174.18 2qbj h VAL 52 N -0.03 0.53 -0.79 4.60 2.07 -0.72 -1.80 116.25 120.11 2qbj h VAL 52 Ca 0.30 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.97 2qbj h VAL 52 Cb 0.50 0.53 -0.10 0.00 -1.52 0.00 0.00 31.29 30.70 2qbj h VAL 52 CO -0.68 0.00 0.35 1.56 0.02 0.00 0.00 177.57 178.82 2qbj h GLN 53 N -0.41 0.48 -0.14 1.57 4.20 0.07 -1.94 115.11 118.94 2qbj h GLN 53 Ca 0.02 -0.03 -0.00 0.00 0.06 0.00 0.00 58.65 58.70 2qbj h GLN 53 Cb 0.42 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.08 2qbj h GLN 53 CO -0.10 0.32 0.08 1.25 -0.67 0.00 0.00 178.83 179.71 2qbj h LEU 54 N 0.50 0.16 0.28 1.46 7.12 -0.22 -1.29 115.31 123.32 2qbj h LEU 54 Ca 0.44 -0.03 -0.00 0.00 0.13 0.00 0.00 57.88 58.41 2qbj h LEU 54 Cb 0.66 -0.04 -0.03 0.00 -0.53 0.00 0.00 40.66 40.72 2qbj h LEU 54 CO -0.40 0.15 -0.43 0.03 -0.13 0.00 0.00 178.44 177.66 2qbj h ARG 55 N 0.16 -0.72 -0.73 1.25 -0.00 -0.60 0.87 114.38 114.61 2qbj h ARG 55 Ca 0.05 0.05 0.14 0.00 -0.50 0.00 0.00 59.98 59.72 2qbj h ARG 55 Cb 0.01 0.16 -0.14 0.00 0.00 0.00 0.00 29.97 30.01 2qbj h ARG 55 CO -0.01 -0.48 -0.24 1.49 0.00 0.00 0.00 179.97 180.74 2qbj h GLU 56 N -0.75 -0.04 -0.44 0.04 4.57 -1.37 0.53 114.58 117.12 2qbj h GLU 56 Ca -0.03 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.15 2qbj h GLU 56 Cb 0.68 0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 29.26 2qbj h GLU 56 CO -0.13 -0.03 0.28 -0.22 -1.18 0.00 0.00 179.01 177.74 2qbj h LYS 57 N -0.04 0.60 -0.32 1.92 3.11 -0.62 -1.97 116.57 119.25 2qbj h LYS 57 Ca 0.33 -0.05 -0.02 0.00 -2.81 0.00 0.00 60.65 58.11 2qbj h LYS 57 Cb 0.56 -0.13 -0.01 0.00 -1.00 0.00 0.00 32.23 31.64 2qbj h LYS 57 CO -0.77 0.42 0.14 0.37 -2.81 0.00 0.00 179.45 176.80 2qbj h GLN 58 N 0.60 0.48 0.00 1.90 5.75 0.35 -2.56 115.11 121.62 2qbj h GLN 58 Ca 0.16 -0.08 0.00 0.00 -0.15 0.00 0.00 58.65 58.58 2qbj h GLN 58 Cb -0.03 -0.08 0.00 0.00 1.07 0.00 0.00 27.48 28.44 2qbj h GLN 58 CO -0.03 0.47 0.00 1.17 -2.65 0.00 0.00 178.83 177.79 2qbj n LYS 59 N -4.73 0.00 -0.57 1.69 4.81 0.16 -1.50 118.16 118.02 2qbj n LYS 59 Ca -0.02 0.40 0.45 0.00 -0.87 0.00 0.00 58.31 58.28 2qbj n LYS 59 Cb 0.13 -1.34 0.75 0.00 0.02 0.00 0.00 35.03 34.59 2qbj n LYS 59 CO 0.00 0.00 0.00 -0.24 1.17 0.00 0.00 177.40 178.33 2qbj h VAL 60 N 0.00 0.08 0.27 3.15 3.04 -1.45 -0.83 116.25 120.50 2qbj h VAL 60 Ca 0.00 -0.01 -0.01 0.00 -1.01 0.00 0.00 66.70 65.67 2qbj h VAL 60 Cb 0.00 0.05 0.00 0.00 -2.01 0.00 0.00 31.29 29.33 2qbj h VAL 60 CO 0.00 0.00 -0.13 -0.09 -1.01 0.00 0.00 177.57 176.35 2qbj h ARG 61 N 0.03 -0.34 0.00 4.17 2.43 -1.29 -3.26 114.38 116.11 2qbj h ARG 61 Ca 0.86 0.02 0.00 0.00 -0.81 0.00 0.00 59.98 60.06 2qbj h ARG 61 Cb 3.17 0.08 0.00 0.00 -0.42 0.00 0.00 29.97 32.79 2qbj h ARG 61 CO -0.19 -0.17 0.00 2.89 -1.51 0.00 0.00 179.97 180.98 2qbj n ARG 62 N -5.01 0.02 0.22 0.20 1.85 -0.41 -1.06 116.66 112.46 2qbj n ARG 62 Ca -0.05 0.37 0.11 0.00 -1.00 0.00 0.00 57.85 57.28 2qbj n ARG 62 Cb 0.17 -1.50 0.35 0.00 -1.05 0.00 0.00 32.46 30.43 2qbj n ARG 62 CO 0.00 0.00 0.00 0.82 -0.01 0.00 0.00 177.63 178.44 2qbj h ILE 63 N 0.00 0.30 -0.12 8.89 2.04 -1.33 -3.07 117.51 124.21 2qbj h ILE 63 Ca 0.00 -1.12 0.00 0.00 1.00 0.00 0.00 64.86 64.74 2qbj h ILE 63 Cb 0.04 1.89 0.00 0.00 -0.74 0.00 0.00 36.82 38.00 2qbj h ILE 63 CO 0.00 0.14 0.00 -1.22 0.00 0.00 0.00 178.15 177.07 2qbj n TYR 64 N -3.20 0.15 0.00 1.37 4.02 -0.23 -4.98 117.16 114.29 2qbj n TYR 64 Ca 0.02 -0.31 0.00 0.00 -0.01 0.00 0.00 57.90 57.59 2qbj n TYR 64 Cb 0.48 -0.02 0.00 0.00 -0.02 0.00 0.00 39.34 39.78 2qbj n TYR 64 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2qbj n GLY 65 N 0.14 2.50 3.60 2.72 0.00 -1.09 -4.97 105.19 108.08 2qbj n GLY 65 Ca 0.05 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.65 2qbj n GLY 65 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2qbj n VAL 66 N -1.34 2.21 -2.97 1.61 0.24 -1.23 -4.88 118.33 111.96 2qbj n VAL 66 Ca 0.00 -0.50 -0.19 0.00 -2.04 0.00 0.00 64.34 61.61 2qbj n VAL 66 Cb 0.00 -1.08 0.04 0.00 -1.47 0.00 0.00 33.84 31.32 2qbj n VAL 66 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 2qbj s LEU 67 N -0.05 3.38 0.00 1.34 1.43 -1.26 -4.36 118.68 119.16 2qbj s LEU 67 Ca 0.61 -0.56 0.00 0.00 -1.03 0.00 0.00 54.13 53.15 2qbj s LEU 67 Cb -0.61 -2.23 0.00 0.00 0.03 0.00 0.00 46.19 43.38 2qbj s LEU 67 CO 0.58 -1.07 0.74 1.21 0.23 0.00 0.00 176.35 178.04 2qbj n GLU 68 N -2.09 0.00 -0.25 1.70 4.07 -1.26 -0.33 120.64 122.48 2qbj n GLU 68 Ca 0.11 0.68 -0.07 0.00 -0.06 0.00 0.00 57.16 57.83 2qbj n GLU 68 Cb 0.60 -1.24 -0.06 0.00 -0.06 0.00 0.00 31.44 30.69 2qbj n GLU 68 CO 0.00 0.00 0.00 -2.13 -0.06 0.00 0.00 177.13 174.94 2qbj n ARG 69 N -1.86 -0.27 -0.17 5.31 3.00 -1.26 0.61 116.66 122.02 2qbj n ARG 69 Ca 0.00 1.28 -0.01 0.00 -0.00 0.00 0.00 57.85 59.11 2qbj n ARG 69 Cb 0.00 -1.89 0.07 0.00 0.00 0.00 0.00 32.46 30.64 2qbj n ARG 69 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.63 178.00 2qbj h GLN 70 N 0.00 0.09 -0.24 -0.14 4.15 -1.93 -1.26 115.11 115.77 2qbj h GLN 70 Ca 0.10 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.51 2qbj h GLN 70 Cb 0.25 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 27.91 2qbj h GLN 70 CO -0.57 0.06 0.16 0.35 -1.93 0.00 0.00 178.83 176.90 2qbj h PHE 71 N 0.09 0.31 -0.19 3.99 3.57 0.13 -2.81 116.94 122.03 2qbj h PHE 71 Ca 0.27 0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.80 2qbj h PHE 71 Cb 0.42 -0.10 -0.05 0.00 2.79 0.00 0.00 35.95 39.01 2qbj h PHE 71 CO -0.35 0.20 -0.37 -0.09 -2.23 0.00 0.00 178.31 175.47 2qbj h ARG 72 N 0.33 -0.31 -1.16 1.11 9.65 0.13 0.45 114.38 124.57 2qbj h ARG 72 Ca 0.09 0.02 0.35 0.00 -1.10 0.00 0.00 59.98 59.34 2qbj h ARG 72 Cb -0.03 0.07 -0.11 0.00 -1.39 0.00 0.00 29.97 28.50 2qbj h ARG 72 CO -0.02 -0.20 0.74 -0.91 2.80 0.00 0.00 179.97 182.38 2qbj h ASN 73 N -0.32 0.35 0.06 -3.80 -0.26 -1.26 0.26 115.58 110.61 2qbj h ASN 73 Ca 0.04 0.12 -0.00 0.00 -0.56 0.00 0.00 56.30 55.89 2qbj h ASN 73 Cb 0.42 0.07 0.00 0.00 -1.06 0.00 0.00 38.32 37.75 2qbj h ASN 73 CO -0.35 -0.06 -0.03 1.88 -1.06 0.00 0.00 177.43 177.82 2qbj h TYR 74 N 0.24 -0.07 -0.84 1.19 0.05 -0.66 -2.38 116.97 114.50 2qbj h TYR 74 Ca 0.71 -0.00 0.02 0.00 0.05 0.00 0.00 58.73 59.51 2qbj h TYR 74 Cb 2.01 0.02 -0.05 0.00 1.01 0.00 0.00 36.73 39.73 2qbj h TYR 74 CO -0.00 -0.02 0.55 -0.92 -1.05 0.00 0.00 178.16 176.71 2qbj h TYR 75 N -0.09 1.04 -1.10 4.88 3.20 -0.10 0.18 116.97 124.97 2qbj h TYR 75 Ca -0.01 0.03 0.30 0.00 3.14 0.00 0.00 58.73 62.19 2qbj h TYR 75 Cb 0.08 -0.35 -0.08 0.00 1.54 0.00 0.00 36.73 37.92 2qbj h TYR 75 CO -0.07 0.62 0.73 -0.22 -1.64 0.00 0.00 178.16 177.59 2qbj h LYS 76 N 1.10 0.24 0.17 1.82 3.64 -0.70 0.23 116.57 123.06 2qbj h LYS 76 Ca 0.32 -0.01 -0.35 0.00 -1.27 0.00 0.00 60.65 59.34 2qbj h LYS 76 Cb -0.06 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 31.71 2qbj h LYS 76 CO -0.09 0.16 -1.77 1.49 -2.27 0.00 0.00 179.45 176.97 2qbj h GLU 77 N 0.25 0.36 -1.14 1.90 4.57 -0.92 -3.22 114.58 116.37 2qbj h GLU 77 Ca 0.60 -0.61 0.33 0.00 -1.18 0.00 0.00 59.36 58.50 2qbj h GLU 77 Cb 1.80 0.23 -0.11 0.00 -0.16 0.00 0.00 28.75 30.51 2qbj h GLU 77 CO -0.22 1.29 0.74 0.00 -1.18 0.00 0.00 179.01 179.64 2qbj h ALA 78 N 0.08 2.43 0.16 2.92 0.00 0.14 0.13 119.26 125.11 2qbj h ALA 78 Ca -0.36 0.08 -0.35 0.00 0.00 0.00 0.00 54.91 54.28 2qbj h ALA 78 Cb 2.05 0.10 -0.00 0.00 0.00 0.00 0.00 17.79 19.94 2qbj h ALA 78 CO 0.15 -0.92 -1.81 0.00 0.00 0.00 0.00 179.25 176.66 2qbj h ALA 79 N 1.62 0.26 -0.25 0.00 0.00 -1.48 -3.27 119.26 116.14 2qbj h ALA 79 Ca 0.68 -1.23 -0.06 0.00 0.00 0.00 0.00 54.91 54.31 2qbj h ALA 79 Cb 1.93 0.52 -0.01 0.00 0.00 0.00 0.00 17.79 20.23 2qbj h ALA 79 CO -0.35 1.14 -0.10 0.07 0.00 0.00 0.00 179.25 180.01 2qbj h ARG 80 N 0.09 0.40 -6.91 0.00 0.11 -1.10 -3.44 114.38 103.54 2qbj h ARG 80 Ca -0.36 -0.10 -0.53 0.00 0.10 0.00 0.00 59.98 59.09 2qbj h ARG 80 Cb 2.07 -0.05 0.08 0.00 1.11 0.00 0.00 29.97 33.18 2qbj h ARG 80 CO 0.15 0.51 0.69 -0.51 0.10 0.00 0.00 179.97 180.91 2qbj s LEU 81 N -8.87 4.38 0.66 0.08 1.43 0.27 -4.87 118.68 111.77 2qbj s LEU 81 Ca -0.07 2.83 0.32 0.00 -1.03 0.00 0.00 54.13 56.18 2qbj s LEU 81 Cb 0.15 -3.66 1.73 0.00 0.03 0.00 0.00 46.19 44.45 2qbj s LEU 81 CO 0.76 -0.67 1.98 0.11 0.23 0.00 0.00 176.35 178.76 2qbj h LYS 82 N 3.23 0.00 -7.60 1.70 1.57 -1.91 -3.43 116.57 110.13 2qbj h LYS 82 Ca -0.50 0.00 -0.46 0.00 -1.87 0.00 0.00 60.65 57.82 2qbj h LYS 82 Cb 1.23 0.00 0.11 0.00 0.08 0.00 0.00 32.23 33.66 2qbj h LYS 82 CO 0.65 0.00 0.36 0.20 -0.57 0.00 0.00 179.45 180.09 2qbj s GLY 83 N -3.82 1.68 0.00 3.86 0.00 -1.26 -4.98 107.32 102.80 2qbj s GLY 83 Ca -0.04 -0.93 -0.30 0.00 0.00 0.00 0.00 44.72 43.46 2qbj s GLY 83 CO 0.31 -0.36 1.75 0.21 0.00 0.00 0.00 173.10 175.00 2qbj s ASN 84 N -4.67 6.59 0.41 1.64 3.84 -1.26 -4.86 114.94 116.62 2qbj s ASN 84 Ca 0.66 2.43 0.23 0.00 0.21 0.00 0.00 52.86 56.39 2qbj s ASN 84 Cb -0.08 -2.54 1.26 0.00 -0.55 0.00 0.00 41.25 39.33 2qbj s ASN 84 CO 0.49 -0.95 1.68 0.74 -2.79 0.00 0.00 177.10 176.27 2qbj h THR 85 N 5.40 0.29 0.00 -5.21 2.02 -1.87 -1.69 112.91 111.84 2qbj h THR 85 Ca -0.43 -0.08 0.00 0.00 0.77 0.00 0.00 66.41 66.67 2qbj h THR 85 Cb 1.20 0.04 0.00 0.00 -1.74 0.00 0.00 68.15 67.65 2qbj h THR 85 CO 0.94 0.04 0.00 0.61 0.37 0.00 0.00 175.52 177.49 2qbj n GLY 86 N -1.46 -2.45 0.26 2.16 0.00 -1.26 -2.08 105.19 100.36 2qbj n GLY 86 Ca 0.32 0.22 0.02 0.00 0.00 0.00 0.00 46.02 46.58 2qbj n GLY 86 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2qbj h GLU 87 N 0.00 0.05 -0.70 1.61 4.22 -1.94 -2.14 114.58 115.68 2qbj h GLU 87 Ca 0.00 -0.00 0.10 0.00 0.08 0.00 0.00 59.36 59.54 2qbj h GLU 87 Cb 0.00 -0.01 -0.11 0.00 0.50 0.00 0.00 28.75 29.13 2qbj h GLU 87 CO 0.00 0.04 -0.30 0.09 -2.18 0.00 0.00 179.01 176.65 2qbj n ASN 88 N -5.38 -0.52 0.21 1.04 4.13 -0.65 -0.78 115.26 113.30 2qbj n ASN 88 Ca 0.10 1.23 -0.12 0.00 1.68 0.00 0.00 54.58 57.48 2qbj n ASN 88 Cb 0.40 -0.26 -0.06 0.00 -1.54 0.00 0.00 39.78 38.32 2qbj n ASN 88 CO 0.00 0.00 0.00 0.25 0.28 0.00 0.00 177.26 177.79 2qbj h LEU 89 N 0.00 -0.86 -0.70 3.41 5.85 -0.81 -2.13 115.31 120.07 2qbj h LEU 89 Ca 0.22 0.06 0.15 0.00 0.84 0.00 0.00 57.88 59.15 2qbj h LEU 89 Cb 0.39 0.28 -0.12 0.00 0.37 0.00 0.00 40.66 41.58 2qbj h LEU 89 CO -0.69 -0.44 -0.02 -0.07 -0.34 0.00 0.00 178.44 176.88 2qbj h LEU 90 N -0.67 -0.36 -0.64 2.25 -0.00 -1.29 0.11 115.31 114.71 2qbj h LEU 90 Ca -0.05 0.18 0.14 0.00 -0.00 0.00 0.00 57.88 58.15 2qbj h LEU 90 Cb 0.57 0.33 -0.11 0.00 -0.00 0.00 0.00 40.66 41.45 2qbj h LEU 90 CO -0.02 -0.16 0.01 0.00 -0.00 0.00 0.00 178.44 178.27 2qbj h ALA 91 N 1.66 0.65 -0.13 1.53 0.00 -0.73 0.45 119.26 122.68 2qbj h ALA 91 Ca 0.37 0.19 -0.01 0.00 0.00 0.00 0.00 54.91 55.47 2qbj h ALA 91 Cb 0.63 0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.74 2qbj h ALA 91 CO -0.62 -0.39 0.06 -0.07 0.00 0.00 0.00 179.25 178.23 2qbj h LEU 92 N 0.13 0.18 -0.52 0.00 -0.00 -0.16 0.33 115.31 115.26 2qbj h LEU 92 Ca 0.34 -0.12 0.06 0.00 -0.00 0.00 0.00 57.88 58.16 2qbj h LEU 92 Cb 0.56 -0.05 -0.06 0.00 -0.00 0.00 0.00 40.66 41.12 2qbj h LEU 92 CO -0.54 0.25 0.22 -0.07 -0.00 0.00 0.00 178.44 178.29 2qbj h LEU 93 N 0.09 0.26 -0.84 1.67 3.38 0.22 -1.15 115.31 118.93 2qbj h LEU 93 Ca 0.05 0.05 -0.11 0.00 0.09 0.00 0.00 57.88 57.96 2qbj h LEU 93 Cb 0.12 0.02 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 2qbj h LEU 93 CO -0.01 0.18 -0.51 -0.08 0.09 0.00 0.00 178.44 178.11 2qbj h GLU 94 N 0.42 0.00 0.00 1.13 4.57 0.02 -2.75 114.58 117.96 2qbj h GLU 94 Ca 0.25 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.43 2qbj h GLU 94 Cb 0.23 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.82 2qbj h GLU 94 CO -0.22 0.51 0.00 0.41 -1.18 0.00 0.00 179.01 178.52 2qbj n GLY 95 N 0.25 -1.22 3.71 1.92 0.00 0.11 -4.24 105.19 105.72 2qbj n GLY 95 Ca -0.01 0.07 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 2qbj n GLY 95 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2qbj s ARG 96 N -3.28 4.15 0.15 1.61 0.52 -0.92 -0.01 118.95 121.17 2qbj s ARG 96 Ca 0.04 2.55 -0.25 0.00 -0.52 0.00 0.00 55.73 57.56 2qbj s ARG 96 Cb 0.09 -3.22 0.02 0.00 0.52 0.00 0.00 34.95 32.36 2qbj s ARG 96 CO 0.37 -0.74 1.60 1.25 0.02 0.00 0.00 175.30 177.79 2qbj h LEU 97 N 7.27 -1.09 -0.82 2.53 5.85 0.74 0.43 115.31 130.23 2qbj h LEU 97 Ca -0.44 0.18 0.17 0.00 0.84 0.00 0.00 57.88 58.63 2qbj h LEU 97 Cb 1.20 0.49 -0.15 0.00 0.37 0.00 0.00 40.66 42.57 2qbj h LEU 97 CO 0.95 -0.34 -0.17 -2.24 -0.34 0.00 0.00 178.44 176.30 2qbj h ASP 98 N -0.32 -0.69 -0.07 1.25 -0.00 -1.69 0.43 116.42 115.33 2qbj h ASP 98 Ca 0.14 0.24 -0.00 0.00 -0.00 0.00 0.00 57.03 57.41 2qbj h ASP 98 Cb 0.55 0.49 -0.00 0.00 -0.00 0.00 0.00 39.33 40.36 2qbj h ASP 98 CO -0.47 -0.26 0.04 -1.13 -0.00 0.00 0.00 179.24 177.42 2qbj h ASN 99 N 0.01 0.09 -0.56 4.15 -1.24 -1.43 -2.26 115.58 114.34 2qbj h ASN 99 Ca 0.41 -0.06 0.11 0.00 0.71 0.00 0.00 56.30 57.47 2qbj h ASN 99 Cb 0.65 -0.02 -0.11 0.00 0.73 0.00 0.00 38.32 39.57 2qbj h ASN 99 CO -0.82 0.12 -0.12 0.58 -1.29 0.00 0.00 177.43 175.89 2qbj h VAL 100 N 0.05 0.45 -0.17 2.57 2.07 0.18 0.16 116.25 121.56 2qbj h VAL 100 Ca 0.03 -0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.59 2qbj h VAL 100 Cb 0.05 0.44 -0.05 0.00 -1.52 0.00 0.00 31.29 30.21 2qbj h VAL 100 CO -0.00 0.00 -0.12 0.58 0.02 0.00 0.00 177.57 178.04 2qbj h VAL 101 N 0.01 0.64 -0.57 2.57 2.07 -0.39 -1.34 116.25 119.25 2qbj h VAL 101 Ca 0.27 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.83 2qbj h VAL 101 Cb 0.42 0.64 -0.03 0.00 -1.52 0.00 0.00 31.29 30.80 2qbj h VAL 101 CO -0.57 0.00 0.37 0.22 0.02 0.00 0.00 177.57 177.62 2qbj h TYR 102 N -0.13 0.62 0.00 1.57 3.20 -0.58 -1.82 116.97 119.82 2qbj h TYR 102 Ca 0.10 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.99 2qbj h TYR 102 Cb 0.28 -0.21 0.00 0.00 1.54 0.00 0.00 36.73 38.35 2qbj h TYR 102 CO -0.26 0.36 0.00 0.54 -1.64 0.00 0.00 178.16 177.16 2qbj n ARG 103 N -4.47 0.23 -0.80 1.82 5.12 0.42 -3.03 116.66 115.95 2qbj n ARG 103 Ca 0.07 0.31 0.03 0.00 -1.93 0.00 0.00 57.85 56.33 2qbj n ARG 103 Cb 0.15 -1.83 0.32 0.00 -1.16 0.00 0.00 32.46 29.94 2qbj n ARG 103 CO 0.00 0.00 0.00 -1.33 -1.93 0.00 0.00 177.63 174.37 2qbj n MET 104 N -2.24 3.77 0.00 5.56 2.81 -0.69 -4.73 117.12 121.60 2qbj n MET 104 Ca 0.04 -3.05 0.00 0.00 -1.81 0.00 0.00 57.70 52.87 2qbj n MET 104 Cb 0.33 -2.10 0.00 0.00 -0.71 0.00 0.00 33.22 30.74 2qbj n MET 104 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2qbj n GLY 105 N -0.07 1.78 3.54 3.03 0.00 -1.17 -4.97 105.19 107.33 2qbj n GLY 105 Ca 0.30 -0.26 -0.49 0.00 0.00 0.00 0.00 46.02 45.57 2qbj n GLY 105 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2qbj n PHE 106 N 0.00 0.94 -0.90 1.61 3.72 -1.21 -3.35 117.46 118.27 2qbj n PHE 106 Ca 0.00 0.77 0.00 0.00 -0.05 0.00 0.00 57.45 58.17 2qbj n PHE 106 Cb 0.00 -2.20 0.00 0.00 -0.94 0.00 0.00 39.48 36.34 2qbj n PHE 106 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2qbj n GLY 107 N 1.86 -3.90 0.00 1.37 0.00 -1.26 -3.89 105.19 99.37 2qbj n GLY 107 Ca 0.15 -0.91 0.00 0.00 0.00 0.00 0.00 46.02 45.27 2qbj n GLY 107 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qbj n ALA 108 N -0.99 0.00 -2.62 4.61 0.00 -1.26 -4.78 120.51 115.46 2qbj n ALA 108 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.22 2qbj n ALA 108 Cb 0.01 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.46 2qbj n ALA 108 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2qbj s THR 109 N -0.52 4.66 0.27 0.00 -4.23 -1.26 -4.83 115.64 109.73 2qbj s THR 109 Ca 0.00 -0.74 0.01 0.00 -1.18 0.00 0.00 61.69 59.78 2qbj s THR 109 Cb 0.00 -3.67 0.26 0.00 1.34 0.00 0.00 72.50 70.43 2qbj s THR 109 CO 0.00 -0.35 1.74 0.03 -0.54 0.00 0.00 174.62 175.50 2qbj h ARG 110 N 0.82 0.56 -0.95 3.99 3.08 -1.90 0.30 114.38 120.27 2qbj h ARG 110 Ca -0.49 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 59.53 2qbj h ARG 110 Cb 1.24 -0.13 -0.05 0.00 0.08 0.00 0.00 29.97 31.12 2qbj h ARG 110 CO 0.58 0.37 0.61 0.00 -1.07 0.00 0.00 179.97 180.45 2qbj h ALA 111 N 1.61 1.21 -0.32 0.04 0.00 -1.94 0.21 119.26 120.06 2qbj h ALA 111 Ca 0.50 -0.08 -0.10 0.00 0.00 0.00 0.00 54.91 55.23 2qbj h ALA 111 Cb 0.79 -0.38 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 2qbj h ALA 111 CO -0.41 0.63 -0.20 1.49 0.00 0.00 0.00 179.25 180.76 2qbj h GLU 112 N 1.30 0.61 -0.10 0.00 4.81 -0.93 -2.46 114.58 117.81 2qbj h GLU 112 Ca 0.35 -0.22 -0.13 0.00 -0.13 0.00 0.00 59.36 59.23 2qbj h GLU 112 Cb -0.11 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.22 2qbj h GLU 112 CO -0.07 0.77 -0.50 0.00 -0.73 0.00 0.00 179.01 178.48 2qbj h ALA 113 N 1.24 0.97 0.09 2.92 0.00 0.32 -3.22 119.26 121.58 2qbj h ALA 113 Ca 0.08 -0.48 0.01 0.00 0.00 0.00 0.00 54.91 54.53 2qbj h ALA 113 Cb 0.64 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.30 2qbj h ALA 113 CO 0.05 0.66 -0.48 -0.09 0.00 0.00 0.00 179.25 179.39 2qbj h ARG 114 N 0.21 -0.64 -0.82 0.00 2.43 -0.13 -1.83 114.38 113.60 2qbj h ARG 114 Ca 0.01 0.04 0.17 0.00 -0.81 0.00 0.00 59.98 59.39 2qbj h ARG 114 Cb 0.96 0.14 -0.11 0.00 -0.42 0.00 0.00 29.97 30.55 2qbj h ARG 114 CO 0.08 -0.42 0.35 0.37 -1.51 0.00 0.00 179.97 178.83 2qbj h GLN 115 N -0.66 0.44 -0.34 0.20 4.15 -1.57 0.51 115.11 117.84 2qbj h GLN 115 Ca -0.00 -0.03 0.06 0.00 0.77 0.00 0.00 58.65 59.45 2qbj h GLN 115 Cb 0.67 -0.10 -0.02 0.00 0.21 0.00 0.00 27.48 28.25 2qbj h GLN 115 CO -0.27 0.29 0.23 -0.07 -1.93 0.00 0.00 178.83 177.08 2qbj h LEU 116 N 0.45 0.16 0.17 -2.39 3.38 -1.39 0.81 115.31 116.50 2qbj h LEU 116 Ca 0.48 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.44 2qbj h LEU 116 Cb 0.79 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.51 2qbj h LEU 116 CO -0.45 0.11 -0.08 0.58 0.09 0.00 0.00 178.44 178.68 2qbj h VAL 117 N 0.18 0.56 -0.51 1.22 2.07 0.74 -1.77 116.25 118.74 2qbj h VAL 117 Ca 0.15 -1.10 0.08 0.00 0.82 0.00 0.00 66.70 66.66 2qbj h VAL 117 Cb 0.37 0.98 -0.07 0.00 -1.52 0.00 0.00 31.29 31.05 2qbj h VAL 117 CO -0.02 0.16 0.13 -1.28 0.02 0.00 0.00 177.57 176.58 2qbj h SER 118 N -0.97 0.07 0.00 0.57 0.87 -0.72 -2.71 113.55 110.66 2qbj h SER 118 Ca -0.02 0.08 0.00 0.00 -1.23 0.00 0.00 61.79 60.62 2qbj h SER 118 Cb 0.44 0.10 0.00 0.00 -0.44 0.00 0.00 62.40 62.49 2qbj h SER 118 CO 0.04 0.06 0.00 1.41 -0.53 0.00 0.00 176.83 177.81 2qbj n HIS 119 N -5.08 0.00 -2.33 2.24 8.25 0.24 -4.75 115.22 113.79 2qbj n HIS 119 Ca 0.06 -0.49 -0.08 0.00 -0.26 0.00 0.00 57.72 56.95 2qbj n HIS 119 Cb 0.24 -0.28 -0.01 0.00 1.12 0.00 0.00 29.99 31.06 2qbj n HIS 119 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 2qbj n LYS 120 N 0.94 -2.37 0.09 -0.41 5.02 -1.02 -4.80 118.16 115.61 2qbj n LYS 120 Ca 0.00 0.39 0.12 0.00 -2.02 0.00 0.00 58.31 56.79 2qbj n LYS 120 Cb 0.37 -4.91 0.07 0.00 -0.02 0.00 0.00 35.03 30.55 2qbj n LYS 120 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2qbj h ALA 121 N 1.03 0.54 -2.54 7.82 0.00 -1.48 -3.46 119.26 121.17 2qbj h ALA 121 Ca -0.18 0.00 -0.54 0.00 0.00 0.00 0.00 54.91 54.18 2qbj h ALA 121 Cb 1.07 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.81 2qbj h ALA 121 CO 0.22 0.00 -0.53 0.42 0.00 0.00 0.00 179.25 179.36 2qbj s ILE 122 N -3.27 4.69 -0.18 0.00 -1.09 -1.00 -2.24 121.20 118.12 2qbj s ILE 122 Ca 0.03 -1.06 -0.16 0.00 -2.23 0.00 0.00 60.65 57.22 2qbj s ILE 122 Cb 0.11 -3.44 0.05 0.00 -1.58 0.00 0.00 42.46 37.60 2qbj s ILE 122 CO 0.76 -0.17 0.47 -0.32 -1.23 0.00 0.00 174.94 174.45 2qbj s MET 123 N -3.34 0.54 -0.13 2.79 -2.45 -0.98 -0.86 119.30 114.87 2qbj s MET 123 Ca 0.32 0.67 0.02 0.00 -1.25 0.00 0.00 55.69 55.45 2qbj s MET 123 Cb -0.10 0.25 0.01 0.00 1.25 0.00 0.00 34.83 36.25 2qbj s MET 123 CO 0.25 -0.07 -0.18 0.08 1.05 0.00 0.00 175.02 176.15 2qbj s VAL 124 N 0.32 1.79 -1.21 10.11 1.01 0.32 -0.44 120.40 132.31 2qbj s VAL 124 Ca -0.01 -0.81 -0.00 0.00 0.00 0.00 0.00 61.98 61.16 2qbj s VAL 124 Cb -0.04 -1.61 0.00 0.00 0.00 0.00 0.00 36.38 34.73 2qbj s VAL 124 CO -0.00 0.50 1.00 0.59 0.00 0.00 0.00 175.10 177.19 2qbj n ASN 125 N 4.25 -2.23 -0.86 3.32 4.13 -0.10 -2.28 115.26 121.49 2qbj n ASN 125 Ca -0.19 -0.62 -0.11 0.00 1.68 0.00 0.00 54.58 55.33 2qbj n ASN 125 Cb 0.51 -5.11 -0.05 0.00 -1.54 0.00 0.00 39.78 33.60 2qbj n ASN 125 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2qbj n GLY 126 N -1.18 1.23 2.81 7.41 0.00 -1.26 -4.99 105.19 109.21 2qbj n GLY 126 Ca -0.28 -0.38 -0.20 0.00 0.00 0.00 0.00 46.02 45.17 2qbj n GLY 126 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2qbj s ARG 127 N -2.86 0.51 0.59 1.61 3.00 -0.97 -5.14 118.95 115.69 2qbj s ARG 127 Ca 0.00 0.07 -0.18 0.00 0.00 0.00 0.00 55.73 55.61 2qbj s ARG 127 Cb 0.00 -0.75 -0.04 0.00 0.00 0.00 0.00 34.95 34.17 2qbj s ARG 127 CO 0.00 -0.20 1.17 0.54 0.00 0.00 0.00 175.30 176.81 2qbj s VAL 128 N 1.42 2.89 0.02 3.52 0.11 -1.26 0.12 120.40 127.22 2qbj s VAL 128 Ca -0.04 0.53 -0.04 0.00 -2.93 0.00 0.00 61.98 59.50 2qbj s VAL 128 Cb -0.13 -3.17 -0.01 0.00 -1.53 0.00 0.00 36.38 31.53 2qbj s VAL 128 CO -0.03 -0.15 0.06 -0.69 -3.33 0.00 0.00 175.10 170.96 2qbj s VAL 129 N -1.78 0.11 -0.00 2.04 1.01 -0.04 -4.78 120.40 116.97 2qbj s VAL 129 Ca 0.74 -0.95 0.23 0.00 0.00 0.00 0.00 61.98 62.00 2qbj s VAL 129 Cb -0.27 -0.56 0.37 0.00 0.00 0.00 0.00 36.38 35.93 2qbj s VAL 129 CO 0.32 -0.52 1.15 -0.46 0.00 0.00 0.00 175.10 175.59 2qbj n ASN 130 N 1.24 0.74 -3.92 3.32 6.94 -1.24 -4.19 115.26 118.15 2qbj n ASN 130 Ca -0.22 -2.00 -0.30 0.00 -0.02 0.00 0.00 54.58 52.04 2qbj n ASN 130 Cb 0.56 -0.22 -0.14 0.00 -2.36 0.00 0.00 39.78 37.62 2qbj n ASN 130 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 2qbj s ILE 131 N -0.04 2.25 0.45 1.53 1.01 -1.26 -4.24 121.20 120.90 2qbj s ILE 131 Ca 0.29 -2.89 0.28 0.00 0.00 0.00 0.00 60.65 58.33 2qbj s ILE 131 Cb 0.34 -2.59 0.47 0.00 0.01 0.00 0.00 42.46 40.69 2qbj s ILE 131 CO -0.15 -0.76 1.72 0.00 0.00 0.00 0.00 174.94 175.75 2qbj h ALA 132 N 6.87 2.66 0.00 9.38 0.00 -1.92 0.83 119.26 137.07 2qbj h ALA 132 Ca -0.06 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2qbj h ALA 132 Cb 0.93 0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.83 2qbj h ALA 132 CO 0.61 -1.14 0.00 -1.13 0.00 0.00 0.00 179.25 177.59 2qbj n SER 133 N -4.53 0.00 -4.67 0.00 3.41 -1.26 -2.06 113.62 104.51 2qbj n SER 133 Ca 0.30 -0.92 -0.45 0.00 -0.26 0.00 0.00 58.87 57.55 2qbj n SER 133 Cb 1.20 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 65.12 2qbj n SER 133 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2qbj n TYR 134 N -0.92 2.16 -3.13 7.33 9.36 0.29 -4.68 117.16 127.56 2qbj n TYR 134 Ca 0.16 0.45 -0.45 0.00 3.32 0.00 0.00 57.90 61.38 2qbj n TYR 134 Cb 0.07 -2.45 -0.05 0.00 -0.63 0.00 0.00 39.34 36.29 2qbj n TYR 134 CO 0.00 0.00 0.00 -1.14 0.22 0.00 0.00 176.86 175.94 2qbj s GLN 135 N -0.57 3.04 -0.26 2.98 2.00 -1.26 0.83 119.66 126.42 2qbj s GLN 135 Ca 0.67 -1.34 -0.29 0.00 -2.00 0.00 0.00 55.36 52.40 2qbj s GLN 135 Cb -0.64 -4.26 -0.01 0.00 0.80 0.00 0.00 33.01 28.90 2qbj s GLN 135 CO 0.51 -1.51 1.38 0.08 -0.50 0.00 0.00 175.29 175.25 2qbj s VAL 136 N 2.58 4.04 0.73 1.34 1.01 0.99 -4.97 120.40 126.12 2qbj s VAL 136 Ca 0.11 1.19 -0.08 0.00 0.00 0.00 0.00 61.98 63.20 2qbj s VAL 136 Cb -0.25 -4.02 0.07 0.00 0.00 0.00 0.00 36.38 32.19 2qbj s VAL 136 CO 0.06 -0.38 1.05 -0.44 0.00 0.00 0.00 175.10 175.39 2qbj s SER 137 N 3.04 4.71 1.06 3.32 0.01 -1.26 -4.83 113.70 119.75 2qbj s SER 137 Ca 0.60 0.50 -0.13 0.00 1.31 0.00 0.00 55.95 58.23 2qbj s SER 137 Cb -0.19 -1.10 0.22 0.00 0.21 0.00 0.00 66.02 65.16 2qbj s SER 137 CO 0.24 -1.68 1.08 -2.16 0.41 0.00 0.00 173.24 171.12 2qbj s PRO 138 N -5.32 -0.04 0.00 12.44 0.04 -1.26 -3.31 135.00 137.54 2qbj s PRO 138 Ca 0.61 0.52 0.00 0.00 0.04 0.00 0.00 61.00 62.17 2qbj s PRO 138 Cb -0.11 -1.68 0.00 0.00 0.04 0.00 0.00 34.50 32.75 2qbj s PRO 138 CO 0.46 -3.05 0.00 0.09 0.04 0.00 0.00 177.00 174.53 2qbj n ASN 139 N -4.40 0.00 -4.79 6.66 3.02 0.14 -4.92 115.26 110.97 2qbj n ASN 139 Ca 0.05 0.00 -0.35 0.00 -0.03 0.00 0.00 54.58 54.25 2qbj n ASN 139 Cb 0.57 -1.19 -0.03 0.00 -0.61 0.00 0.00 39.78 38.52 2qbj n ASN 139 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 2qbj s ASP 140 N -2.24 6.39 -0.15 6.41 1.01 -1.21 -4.68 116.67 122.21 2qbj s ASP 140 Ca 0.00 2.01 -0.04 0.00 0.71 0.00 0.00 52.55 55.23 2qbj s ASP 140 Cb 0.00 -2.57 -0.03 0.00 1.01 0.00 0.00 42.92 41.33 2qbj s ASP 140 CO 0.00 -0.75 -0.01 0.68 0.21 0.00 0.00 175.17 175.31 2qbj s VAL 141 N -1.84 4.20 -0.80 -1.27 -7.23 -1.26 -0.03 120.40 112.17 2qbj s VAL 141 Ca 0.65 -0.25 -0.06 0.00 -1.81 0.00 0.00 61.98 60.50 2qbj s VAL 141 Cb -0.20 -2.84 0.20 0.00 0.56 0.00 0.00 36.38 34.11 2qbj s VAL 141 CO 0.24 0.50 0.68 -0.69 -0.31 0.00 0.00 175.10 175.52 2qbj s VAL 142 N 0.16 4.64 0.75 1.32 1.01 0.55 -0.92 120.40 127.90 2qbj s VAL 142 Ca 0.01 -3.10 -0.03 0.00 0.00 0.00 0.00 61.98 58.86 2qbj s VAL 142 Cb -0.13 -3.91 0.13 0.00 0.00 0.00 0.00 36.38 32.48 2qbj s VAL 142 CO 0.02 -1.00 1.03 -0.94 0.00 0.00 0.00 175.10 174.21 2qbj s SER 143 N 0.95 4.21 0.02 3.32 1.04 0.42 -2.65 113.70 121.01 2qbj s SER 143 Ca 0.21 -0.27 0.06 0.00 0.48 0.00 0.00 55.95 56.43 2qbj s SER 143 Cb -0.13 -0.07 -0.02 0.00 0.10 0.00 0.00 66.02 65.89 2qbj s SER 143 CO -0.08 -1.96 -0.17 -0.63 0.98 0.00 0.00 173.24 171.38 2qbj s ILE 144 N -3.23 1.39 -0.29 -1.02 1.01 -1.24 -2.33 121.20 115.49 2qbj s ILE 144 Ca 0.67 -0.97 -0.28 0.00 0.00 0.00 0.00 60.65 60.07 2qbj s ILE 144 Cb -0.05 -1.20 -0.03 0.00 0.01 0.00 0.00 42.46 41.19 2qbj s ILE 144 CO 0.45 0.21 1.89 -0.13 0.00 0.00 0.00 174.94 177.36 2qbj s ARG 145 N -0.89 3.34 0.34 2.79 1.81 -0.95 -4.75 118.95 120.64 2qbj s ARG 145 Ca 0.05 1.62 0.14 0.00 -1.72 0.00 0.00 55.73 55.82 2qbj s ARG 145 Cb -0.08 -4.23 1.07 0.00 -0.45 0.00 0.00 34.95 31.27 2qbj s ARG 145 CO 0.01 -1.85 1.65 1.05 -0.68 0.00 0.00 175.30 175.48 2qbj h GLU 146 N 13.19 0.27 0.00 3.54 -0.00 -1.95 1.78 114.58 131.41 2qbj h GLU 146 Ca -0.36 -0.02 0.00 0.00 -0.00 0.00 0.00 59.36 58.99 2qbj h GLU 146 Cb 1.19 -0.06 0.00 0.00 -0.00 0.00 0.00 28.75 29.87 2qbj h GLU 146 CO 1.01 0.18 0.03 1.57 -0.00 0.00 0.00 179.01 181.79 2qbj h LYS 147 N 0.28 0.00 0.00 1.06 5.09 -1.98 -1.11 116.57 119.91 2qbj h LYS 147 Ca 0.73 0.00 0.00 0.00 0.09 0.00 0.00 60.65 61.47 2qbj h LYS 147 Cb 1.66 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.99 2qbj h LYS 147 CO -0.63 0.00 0.00 0.00 -2.09 0.00 0.00 179.45 176.73 2qbj n ALA 148 N -1.80 1.60 0.20 0.07 0.00 0.52 -4.66 120.51 116.44 2qbj n ALA 148 Ca -0.02 -0.13 0.09 0.00 0.00 0.00 0.00 53.44 53.39 2qbj n ALA 148 Cb 0.06 0.00 0.15 0.00 0.00 0.00 0.00 19.45 19.66 2qbj n ALA 148 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 2qbj h LYS 149 N 0.00 0.00 -0.30 0.00 2.10 0.22 -2.78 116.57 115.81 2qbj h LYS 149 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2qbj h LYS 149 Cb 0.05 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.38 2qbj h LYS 149 CO 0.00 0.17 0.00 1.17 -2.00 0.00 0.00 179.45 178.79 2qbj n LYS 150 N -3.15 1.73 -2.27 0.07 3.00 -1.08 -4.73 118.16 111.73 2qbj n LYS 150 Ca 0.03 -1.13 -0.41 0.00 -0.00 0.00 0.00 58.31 56.81 2qbj n LYS 150 Cb 0.59 -1.26 -0.03 0.00 0.00 0.00 0.00 35.03 34.32 2qbj n LYS 150 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.40 176.26 2qbj s GLN 151 N -1.60 4.46 0.11 1.64 0.74 -1.05 -4.95 119.66 119.01 2qbj s GLN 151 Ca 0.23 2.03 -0.28 0.00 0.05 0.00 0.00 55.36 57.38 2qbj s GLN 151 Cb 0.12 -3.15 -0.08 0.00 1.10 0.00 0.00 33.01 31.00 2qbj s GLN 151 CO 0.16 -0.08 1.62 1.03 -0.55 0.00 0.00 175.29 177.47 2qbj h SER 152 N 4.17 -0.87 -0.93 6.67 0.87 -1.89 -2.89 113.55 118.68 2qbj h SER 152 Ca -0.47 0.10 0.20 0.00 -1.23 0.00 0.00 61.79 60.40 2qbj h SER 152 Cb 1.22 0.33 -0.18 0.00 -0.44 0.00 0.00 62.40 63.34 2qbj h SER 152 CO 0.70 -0.39 -0.17 0.08 -0.53 0.00 0.00 176.83 176.52 2qbj h ARG 153 N -0.51 0.01 -0.03 2.24 0.11 -1.96 -1.66 114.38 112.58 2qbj h ARG 153 Ca 0.03 -0.00 0.01 0.00 0.10 0.00 0.00 59.98 60.12 2qbj h ARG 153 Cb 0.55 -0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.62 2qbj h ARG 153 CO -0.19 0.01 -0.08 0.28 0.10 0.00 0.00 179.97 180.09 2qbj h VAL 154 N 0.01 0.00 -0.57 0.08 2.07 -1.84 0.80 116.25 116.81 2qbj h VAL 154 Ca 0.47 0.00 0.06 0.00 0.82 0.00 0.00 66.70 68.05 2qbj h VAL 154 Cb 0.79 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 30.51 2qbj h VAL 154 CO -0.94 0.00 0.28 0.07 0.02 0.00 0.00 177.57 177.01 2qbj h LYS 155 N -0.08 0.52 -0.78 1.57 2.10 -1.57 -1.21 116.57 117.12 2qbj h LYS 155 Ca 0.01 -0.03 0.16 0.00 -2.00 0.00 0.00 60.65 58.78 2qbj h LYS 155 Cb 0.10 -0.12 -0.05 0.00 -0.90 0.00 0.00 32.23 31.26 2qbj h LYS 155 CO -0.07 0.34 0.52 0.00 -2.00 0.00 0.00 179.45 178.24 2qbj h ALA 156 N 1.32 2.14 0.13 0.07 0.00 -0.99 -0.35 119.26 121.57 2qbj h ALA 156 Ca 0.26 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.16 2qbj h ALA 156 Cb 0.18 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2qbj h ALA 156 CO -0.19 -0.35 -0.06 0.00 0.00 0.00 0.00 179.25 178.65 2qbj h ALA 157 N 1.64 -0.17 -0.02 0.00 0.00 0.37 -3.02 119.26 118.06 2qbj h ALA 157 Ca 0.38 -0.22 0.01 0.00 0.00 0.00 0.00 54.91 55.08 2qbj h ALA 157 Cb 0.91 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.76 2qbj h ALA 157 CO -0.13 -0.36 0.05 -0.07 0.00 0.00 0.00 179.25 178.75 2qbj h LEU 158 N -0.64 0.00 0.07 0.00 3.38 -0.83 -2.34 115.31 114.95 2qbj h LEU 158 Ca -0.02 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 2qbj h LEU 158 Cb 0.49 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.24 2qbj h LEU 158 CO 0.03 0.00 -0.10 -0.08 0.09 0.00 0.00 178.44 178.38 2qbj h GLU 159 N 0.00 -0.17 0.00 1.13 4.81 -0.96 0.19 114.58 119.59 2qbj h GLU 159 Ca 0.01 0.01 -0.07 0.00 -0.13 0.00 0.00 59.36 59.18 2qbj h GLU 159 Cb 0.12 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.53 2qbj h GLU 159 CO -0.00 -0.11 -0.33 1.37 -0.73 0.00 0.00 179.01 179.21 2qbj h LEU 160 N -0.17 0.00 -1.15 1.64 -0.00 -1.66 -2.68 115.31 111.30 2qbj h LEU 160 Ca -0.01 0.00 -0.04 0.00 -0.00 0.00 0.00 57.88 57.83 2qbj h LEU 160 Cb 0.16 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 40.79 2qbj h LEU 160 CO -0.03 0.33 0.16 0.00 -0.00 0.00 0.00 178.44 178.91 2qbj h ALA 161 N 1.67 1.32 -0.56 0.17 0.00 -1.24 0.64 119.26 121.26 2qbj h ALA 161 Ca -0.00 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 2qbj h ALA 161 Cb 0.84 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.39 2qbj h ALA 161 CO 0.04 0.49 0.30 1.49 0.00 0.00 0.00 179.25 181.58 2qbj h GLU 162 N 0.74 0.78 0.00 0.00 4.81 -0.26 -1.62 114.58 119.04 2qbj h GLU 162 Ca 0.17 -0.09 -0.12 0.00 -0.13 0.00 0.00 59.36 59.19 2qbj h GLU 162 Cb 0.22 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.43 2qbj h GLU 162 CO -0.01 0.61 -0.55 1.96 -0.73 0.00 0.00 179.01 180.28 2qbj h GLN 163 N 0.75 0.00 -7.34 1.92 4.20 -1.25 -3.44 115.11 109.95 2qbj h GLN 163 Ca 0.20 0.00 -0.51 0.00 0.06 0.00 0.00 58.65 58.40 2qbj h GLN 163 Cb 0.05 0.00 0.07 0.00 0.30 0.00 0.00 27.48 27.90 2qbj h GLN 163 CO -0.03 0.55 0.40 0.50 -0.67 0.00 0.00 178.83 179.58 2qbj s ARG 164 N -3.65 3.42 0.80 1.46 3.52 0.22 -5.00 118.95 119.72 2qbj s ARG 164 Ca -0.01 0.84 -0.16 0.00 -0.13 0.00 0.00 55.73 56.26 2qbj s ARG 164 Cb 0.12 -2.06 -0.08 0.00 -1.56 0.00 0.00 34.95 31.38 2qbj s ARG 164 CO 0.75 -0.71 -0.00 -1.91 -0.81 0.00 0.00 175.30 172.61 2qbj n GLU 165 N -2.76 0.05 -4.97 5.12 4.07 -1.26 -4.86 120.64 116.03 2qbj n GLU 165 Ca 0.07 0.04 -0.29 0.00 -0.06 0.00 0.00 57.16 56.91 2qbj n GLU 165 Cb 0.54 -1.44 -0.15 0.00 -0.06 0.00 0.00 31.44 30.33 2qbj n GLU 165 CO 0.00 0.00 0.00 0.15 -0.06 0.00 0.00 177.13 177.22 2qbj s LYS 166 N -2.36 1.79 0.70 5.31 1.02 -1.26 -4.91 119.74 120.03 2qbj s LYS 166 Ca 0.55 -1.00 -0.11 0.00 0.02 0.00 0.00 55.97 55.43 2qbj s LYS 166 Cb -0.30 -1.88 0.01 0.00 -0.52 0.00 0.00 37.83 35.14 2qbj s LYS 166 CO 0.68 0.50 1.06 -1.25 -0.92 0.00 0.00 175.35 175.42 2qbj s PRO 167 N -1.01 2.91 -0.19 -1.68 0.04 -1.26 -5.00 135.00 128.81 2qbj s PRO 167 Ca 0.10 0.92 0.16 0.00 0.04 0.00 0.00 61.00 62.21 2qbj s PRO 167 Cb -0.10 -1.99 0.44 0.00 0.04 0.00 0.00 34.50 32.89 2qbj s PRO 167 CO 0.01 -1.11 1.32 0.25 0.04 0.00 0.00 177.00 177.51 2qbj n THR 168 N -3.13 2.20 -2.53 1.26 -2.24 -1.26 -4.62 114.28 103.96 2qbj n THR 168 Ca 0.07 -2.30 0.01 0.00 -2.27 0.00 0.00 64.05 59.57 2qbj n THR 168 Cb 0.54 -0.26 0.04 0.00 -2.10 0.00 0.00 70.33 68.55 2qbj n THR 168 CO 0.00 0.00 0.00 -2.67 -0.57 0.00 0.00 175.07 171.83 2qbj n TRP 169 N -0.99 0.59 -3.62 4.78 2.14 -1.26 -4.98 117.44 114.10 2qbj n TRP 169 Ca 0.22 -1.25 -0.06 0.00 2.07 0.00 0.00 57.50 58.47 2qbj n TRP 169 Cb 0.82 -0.20 -0.05 0.00 -0.81 0.00 0.00 31.31 31.07 2qbj n TRP 169 CO 0.00 0.00 0.00 -0.48 2.07 0.00 0.00 177.69 179.28 2qbj s LEU 170 N -1.79 -0.23 -0.15 5.67 2.34 -1.26 -1.93 118.68 121.34 2qbj s LEU 170 Ca 0.33 0.30 -0.03 0.00 0.06 0.00 0.00 54.13 54.78 2qbj s LEU 170 Cb 0.36 1.50 -0.03 0.00 -0.56 0.00 0.00 46.19 47.47 2qbj s LEU 170 CO -0.11 -0.17 -0.05 -1.61 -1.06 0.00 0.00 176.35 173.35 2qbj s GLU 171 N -0.77 3.58 -0.22 1.48 2.02 0.13 -4.86 118.70 120.06 2qbj s GLU 171 Ca 0.04 -0.54 0.01 0.00 0.02 0.00 0.00 54.97 54.50 2qbj s GLU 171 Cb -0.02 -2.86 0.05 0.00 0.10 0.00 0.00 34.13 31.40 2qbj s GLU 171 CO -0.05 0.27 -0.08 0.54 0.02 0.00 0.00 175.26 175.96 2qbj s VAL 172 N 0.27 1.63 -1.18 2.63 0.11 -1.26 0.85 120.40 123.45 2qbj s VAL 172 Ca -0.04 -1.14 -0.08 0.00 -2.93 0.00 0.00 61.98 57.79 2qbj s VAL 172 Cb -0.14 -1.79 0.23 0.00 -1.53 0.00 0.00 36.38 33.15 2qbj s VAL 172 CO 0.03 0.04 1.61 -0.67 -3.33 0.00 0.00 175.10 172.79 2qbj n ASP 173 N 4.66 5.64 -0.37 3.54 -0.08 -0.21 -4.82 116.55 124.92 2qbj n ASP 173 Ca -0.13 -3.20 0.38 0.00 -1.51 0.00 0.00 54.79 50.32 2qbj n ASP 173 Cb 0.45 -1.40 0.74 0.00 2.34 0.00 0.00 41.12 43.25 2qbj n ASP 173 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2qbj h ALA 174 N 5.87 3.21 -0.70 -1.67 0.00 -1.94 -0.92 119.26 123.11 2qbj h ALA 174 Ca 0.29 -0.05 0.15 0.00 0.00 0.00 0.00 54.91 55.31 2qbj h ALA 174 Cb 0.67 0.10 -0.11 0.00 0.00 0.00 0.00 17.79 18.45 2qbj h ALA 174 CO 1.42 -1.64 0.12 0.78 0.00 0.00 0.00 179.25 179.92 2qbj h GLY 175 N 0.00 0.91 -0.01 0.00 0.00 -1.95 -2.78 103.07 99.24 2qbj h GLY 175 Ca 0.61 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.95 2qbj h GLY 175 CO -0.01 -0.21 0.00 0.58 0.00 0.00 0.00 176.54 176.91 2qbj n LYS 176 N -5.20 2.39 -2.55 4.80 2.85 -0.45 -5.05 118.16 114.95 2qbj n LYS 176 Ca 0.13 -1.89 -0.06 0.00 -1.05 0.00 0.00 58.31 55.43 2qbj n LYS 176 Cb 0.43 -1.18 0.01 0.00 -0.65 0.00 0.00 35.03 33.64 2qbj n LYS 176 CO 0.00 0.00 0.00 -1.33 -0.05 0.00 0.00 177.40 176.02 2qbj n MET 177 N -0.83 -1.85 -3.73 -1.58 2.81 -0.60 -4.90 117.12 106.44 2qbj n MET 177 Ca 0.06 1.76 -0.10 0.00 -1.81 0.00 0.00 57.70 57.61 2qbj n MET 177 Cb 0.39 -4.75 -0.05 0.00 -0.71 0.00 0.00 33.22 28.10 2qbj n MET 177 CO 0.00 0.00 0.00 -1.21 1.51 0.00 0.00 175.97 176.27 2qbj s GLU 178 N -2.25 1.11 -0.26 0.03 2.02 -1.17 -3.68 118.70 114.51 2qbj s GLU 178 Ca 0.19 -0.84 -0.19 0.00 0.02 0.00 0.00 54.97 54.15 2qbj s GLU 178 Cb -0.05 0.45 0.07 0.00 0.10 0.00 0.00 34.13 34.70 2qbj s GLU 178 CO 0.60 -0.43 0.66 0.20 0.02 0.00 0.00 175.26 176.31 2qbj s GLY 179 N -2.85 -0.55 -0.14 -1.39 0.00 -1.08 -1.04 107.32 100.27 2qbj s GLY 179 Ca 0.06 2.11 0.01 0.00 0.00 0.00 0.00 44.72 46.91 2qbj s GLY 179 CO -0.08 1.98 -0.17 -1.59 0.00 0.00 0.00 173.10 173.23 2qbj s THR 180 N 0.99 2.54 -1.20 0.90 2.01 0.25 0.20 115.64 121.34 2qbj s THR 180 Ca -0.05 -0.83 -0.21 0.00 0.31 0.00 0.00 61.69 60.92 2qbj s THR 180 Cb -0.05 -2.05 0.01 0.00 0.01 0.00 0.00 72.50 70.42 2qbj s THR 180 CO -0.09 0.53 1.77 0.12 -0.69 0.00 0.00 174.62 176.26 2qbj s PHE 181 N 0.63 2.44 0.22 4.92 5.36 0.96 -0.70 117.98 131.81 2qbj s PHE 181 Ca -0.09 -0.75 -0.17 0.00 -0.96 0.00 0.00 56.93 54.96 2qbj s PHE 181 Cb -0.16 -4.48 0.23 0.00 -0.34 0.00 0.00 43.02 38.27 2qbj s PHE 181 CO 0.03 -1.65 1.57 0.87 -1.46 0.00 0.00 175.22 174.57 2qbj h LYS 182 N 8.79 -0.05 -1.10 10.12 1.57 -1.70 0.39 116.57 134.59 2qbj h LYS 182 Ca 0.32 0.00 0.35 0.00 -1.87 0.00 0.00 60.65 59.46 2qbj h LYS 182 Cb 0.92 0.01 -0.17 0.00 0.08 0.00 0.00 32.23 33.07 2qbj h LYS 182 CO 1.37 -0.04 0.96 -0.98 -0.57 0.00 0.00 179.45 180.20 2qbj s ARG 183 N -6.03 0.08 0.17 3.15 1.04 -1.03 -4.29 118.95 112.03 2qbj s ARG 183 Ca -0.14 -0.04 -0.33 0.00 -1.04 0.00 0.00 55.73 54.18 2qbj s ARG 183 Cb 0.20 0.03 -0.16 0.00 -2.04 0.00 0.00 34.95 32.98 2qbj s ARG 183 CO 0.72 -0.03 1.11 1.63 -0.04 0.00 0.00 175.30 178.69 2qbj n LYS 184 N -0.27 1.03 -2.21 3.89 4.76 -1.26 -4.76 118.16 119.34 2qbj n LYS 184 Ca -0.03 0.37 -0.39 0.00 -2.87 0.00 0.00 58.31 55.39 2qbj n LYS 184 Cb 0.60 -1.83 -0.03 0.00 -1.84 0.00 0.00 35.03 31.93 2qbj n LYS 184 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 2qbj s PRO 185 N -0.44 2.82 0.67 1.97 0.04 -1.26 -4.97 135.00 133.82 2qbj s PRO 185 Ca 0.73 0.30 -0.17 0.00 0.04 0.00 0.00 61.00 61.90 2qbj s PRO 185 Cb -0.88 -4.34 -0.03 0.00 0.04 0.00 0.00 34.50 29.30 2qbj s PRO 185 CO 0.53 -2.55 0.89 -1.91 0.04 0.00 0.00 177.00 174.00 2qbj n GLU 186 N 9.25 0.64 0.08 4.56 0.00 -1.26 -4.52 120.64 129.38 2qbj n GLU 186 Ca 0.15 0.26 0.19 0.00 0.00 0.00 0.00 57.16 57.76 2qbj n GLU 186 Cb 0.51 -2.13 0.73 0.00 0.00 0.00 0.00 31.44 30.55 2qbj n GLU 186 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.13 177.04 2qbj h ARG 187 N 0.05 0.00 0.05 5.31 9.65 -1.94 0.31 114.38 127.81 2qbj h ARG 187 Ca -0.48 0.00 -0.00 0.00 -1.10 0.00 0.00 59.98 58.40 2qbj h ARG 187 Cb 1.35 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.93 2qbj h ARG 187 CO 0.48 0.00 -0.02 0.77 2.80 0.00 0.00 179.97 184.00 2qbj h SER 188 N 0.00 -0.06 0.30 -3.80 0.02 -1.97 0.19 113.55 108.24 2qbj h SER 188 Ca 0.19 -0.04 -0.33 0.00 -0.84 0.00 0.00 61.79 60.77 2qbj h SER 188 Cb 0.84 0.01 0.02 0.00 0.14 0.00 0.00 62.40 63.41 2qbj h SER 188 CO -0.00 0.00 -1.55 -2.24 -1.14 0.00 0.00 176.83 171.90 2qbj h ASP 189 N -0.11 0.68 0.35 3.07 3.04 -1.69 -3.23 116.42 118.52 2qbj h ASP 189 Ca -0.01 -0.83 0.00 0.00 -3.24 0.00 0.00 57.03 52.96 2qbj h ASP 189 Cb 0.09 -0.22 0.00 0.00 -1.04 0.00 0.00 39.33 38.16 2qbj h ASP 189 CO 0.01 1.67 0.00 -0.11 -2.04 0.00 0.00 179.24 178.77 2qbj n LEU 190 N -3.63 0.00 -4.04 0.15 0.00 0.02 -4.86 117.00 104.65 2qbj n LEU 190 Ca -0.18 0.20 -0.19 0.00 0.00 0.00 0.00 56.01 55.84 2qbj n LEU 190 Cb 1.08 -0.20 0.18 0.00 0.00 0.00 0.00 43.42 44.48 2qbj n LEU 190 CO 0.56 -0.03 0.20 -1.54 0.00 0.00 0.00 177.39 176.58 2qbj n SER 191 N -1.20 -3.35 0.00 1.96 3.41 0.67 -4.99 113.62 110.11 2qbj n SER 191 Ca 0.15 -0.53 0.00 0.00 -0.26 0.00 0.00 58.87 58.22 2qbj n SER 191 Cb 0.17 -0.81 0.00 0.00 -0.26 0.00 0.00 64.21 63.32 2qbj n SER 191 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2qbj n ALA 192 N -4.75 0.00 -0.72 7.33 0.00 -1.26 -4.96 120.51 116.15 2qbj n ALA 192 Ca 0.08 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.44 2qbj n ALA 192 Cb 0.37 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.83 2qbj n ALA 192 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2qbj n ASP 193 N 2.20 5.91 -3.79 0.00 8.00 -1.26 -4.65 116.55 122.96 2qbj n ASP 193 Ca 0.00 -2.74 -0.29 0.00 0.71 0.00 0.00 54.79 52.46 2qbj n ASP 193 Cb 0.00 -1.10 -0.13 0.00 -0.02 0.00 0.00 41.12 39.86 2qbj n ASP 193 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 2qbj s ILE 194 N -1.13 1.84 -0.35 0.53 2.07 -1.26 -5.08 121.20 117.82 2qbj s ILE 194 Ca 0.18 -2.91 -0.29 0.00 -1.41 0.00 0.00 60.65 56.22 2qbj s ILE 194 Cb 0.13 -2.28 0.00 0.00 0.13 0.00 0.00 42.46 40.45 2qbj s ILE 194 CO -0.01 -0.88 1.36 0.54 -1.91 0.00 0.00 174.94 174.05 2qbj s ASN 195 N 0.02 6.51 0.21 4.50 2.20 -1.26 -4.92 114.94 122.20 2qbj s ASN 195 Ca 0.18 1.05 -0.05 0.00 -0.94 0.00 0.00 52.86 53.10 2qbj s ASN 195 Cb -0.23 -2.54 0.16 0.00 -2.00 0.00 0.00 41.25 36.65 2qbj s ASN 195 CO -0.01 -1.25 1.62 1.05 -2.94 0.00 0.00 177.10 175.57 2qbj h GLU 196 N 9.99 0.81 -0.99 3.55 9.09 -1.98 -3.28 114.58 131.77 2qbj h GLU 196 Ca -0.27 -0.33 0.32 0.00 0.05 0.00 0.00 59.36 59.13 2qbj h GLU 196 Cb 1.10 -0.04 -0.18 0.00 -1.65 0.00 0.00 28.75 27.99 2qbj h GLU 196 CO 1.06 0.95 0.21 1.12 0.05 0.00 0.00 179.01 182.39 2qbj h HIS 197 N 0.70 0.26 -0.99 2.06 2.07 -1.94 0.59 115.15 117.90 2qbj h HIS 197 Ca 0.10 0.06 0.29 0.00 -2.85 0.00 0.00 60.37 57.97 2qbj h HIS 197 Cb 0.74 0.05 -0.14 0.00 2.57 0.00 0.00 27.41 30.63 2qbj h HIS 197 CO 0.04 -0.43 0.55 1.25 -3.07 0.00 0.00 177.93 176.27 2qbj h LEU 198 N 0.02 0.52 0.11 6.12 5.85 -1.96 0.13 115.31 126.10 2qbj h LEU 198 Ca 0.68 0.18 -0.30 0.00 0.84 0.00 0.00 57.88 59.27 2qbj h LEU 198 Cb 1.55 0.12 -0.01 0.00 0.37 0.00 0.00 40.66 42.69 2qbj h LEU 198 CO -0.86 -0.07 -1.51 0.16 -0.34 0.00 0.00 178.44 175.82 2qbj h ILE 199 N 0.39 1.17 -0.00 4.05 3.07 -0.08 -2.93 117.51 123.18 2qbj h ILE 199 Ca 0.69 -2.82 0.00 0.00 1.55 0.00 0.00 64.86 64.29 2qbj h ILE 199 Cb 1.50 2.76 -0.00 0.00 -0.27 0.00 0.00 36.82 40.81 2qbj h ILE 199 CO -0.57 0.81 0.11 -0.37 -1.05 0.00 0.00 178.15 177.08 2qbj h VAL 200 N 0.06 0.00 0.04 0.16 -1.51 -0.16 -0.82 116.25 114.03 2qbj h VAL 200 Ca -0.23 0.00 -0.29 0.00 -1.23 0.00 0.00 66.70 64.94 2qbj h VAL 200 Cb 2.01 0.89 -0.03 0.00 -2.13 0.00 0.00 31.29 32.03 2qbj h VAL 200 CO 0.16 0.00 -1.60 -0.62 -1.23 0.00 0.00 177.57 174.28 2qbj n GLU 201 N -3.02 0.64 0.24 5.19 1.02 -0.53 -3.99 120.64 120.19 2qbj n GLU 201 Ca -0.03 0.45 0.16 0.00 -0.02 0.00 0.00 57.16 57.72 2qbj n GLU 201 Cb 0.17 -1.72 0.68 0.00 -0.02 0.00 0.00 31.44 30.55 2qbj n GLU 201 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 2qbj h LEU 202 N -0.61 0.00 -3.12 -4.62 5.85 -0.98 0.75 115.31 112.58 2qbj h LEU 202 Ca -0.40 0.00 -0.22 0.00 0.84 0.00 0.00 57.88 58.10 2qbj h LEU 202 Cb 1.59 0.00 -0.13 0.00 0.37 0.00 0.00 40.66 42.48 2qbj h LEU 202 CO -0.12 0.00 0.28 -1.22 -0.34 0.00 0.00 178.44 177.05 2qbj n TYR 203 N -3.08 1.83 -1.38 1.25 0.53 -0.82 -3.59 117.16 111.90 2qbj n TYR 203 Ca 0.02 -1.07 0.00 0.00 -1.02 0.00 0.00 57.90 55.83 2qbj n TYR 203 Cb 0.58 -0.60 0.00 0.00 -1.03 0.00 0.00 39.34 38.29 2qbj n TYR 203 CO 0.00 0.00 0.00 0.43 -1.02 0.00 0.00 176.86 176.27 2qbj n SER 204 N -0.23 0.00 0.00 7.72 7.64 0.26 -5.08 113.62 123.92 2qbj n SER 204 Ca 0.33 -1.00 0.00 0.00 1.01 0.00 0.00 58.87 59.21 2qbj n SER 204 Cb 1.15 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 64.35 2qbj n SER 204 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20