#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qeb n GLU 1 N 0.00 1.61 -3.66 0.03 2.13 -1.26 -5.02 120.64 114.47 2qeb n GLU 1 Ca 0.00 0.56 -0.21 0.00 0.66 0.00 0.00 57.16 58.17 2qeb n GLU 1 Cb 0.00 -2.02 -0.04 0.00 0.27 0.00 0.00 31.44 29.65 2qeb n GLU 1 CO 0.00 0.00 0.00 0.95 -0.41 0.00 0.00 177.13 177.67 2qeb s THR 2 N -1.09 2.83 0.26 6.31 -4.23 -1.26 -4.56 115.64 113.89 2qeb s THR 2 Ca 0.58 -1.38 -0.03 0.00 -1.18 0.00 0.00 61.69 59.68 2qeb s THR 2 Cb -0.64 -3.04 0.26 0.00 1.34 0.00 0.00 72.50 70.43 2qeb s THR 2 CO 0.60 -0.04 1.88 0.58 -0.54 0.00 0.00 174.62 177.11 2qeb h VAL 3 N 1.11 1.10 -0.80 2.29 2.07 -1.90 -1.71 116.25 118.42 2qeb h VAL 3 Ca -0.42 -0.40 0.01 0.00 0.82 0.00 0.00 66.70 66.70 2qeb h VAL 3 Cb 1.26 -0.18 -0.04 0.00 -1.52 0.00 0.00 31.29 30.81 2qeb h VAL 3 CO 0.58 0.21 0.53 -0.61 0.02 0.00 0.00 177.57 178.31 2qeb h GLN 4 N 1.18 1.04 -0.54 1.57 4.15 -1.99 -1.13 115.11 119.39 2qeb h GLN 4 Ca 0.42 -0.06 -0.02 0.00 0.77 0.00 0.00 58.65 59.76 2qeb h GLN 4 Cb 0.14 -0.24 -0.03 0.00 0.21 0.00 0.00 27.48 27.56 2qeb h GLN 4 CO -0.16 0.69 0.27 -0.44 -1.93 0.00 0.00 178.83 177.25 2qeb h ASP 5 N 1.08 0.71 -0.55 -0.69 3.32 -1.83 -0.74 116.42 117.71 2qeb h ASP 5 Ca 0.29 -0.12 0.07 0.00 0.02 0.00 0.00 57.03 57.29 2qeb h ASP 5 Cb -0.12 -0.18 -0.06 0.00 0.22 0.00 0.00 39.33 39.19 2qeb h ASP 5 CO -0.07 0.63 0.24 0.00 -1.72 0.00 0.00 179.24 178.33 2qeb h GLU 7 N 0.45 0.78 -0.30 0.00 5.08 -0.92 -2.63 114.58 117.04 2qeb h GLU 7 Ca 0.26 -0.34 0.09 0.00 -1.00 0.00 0.00 59.36 58.37 2qeb h GLU 7 Cb 0.24 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.46 2qeb h GLU 7 CO -0.23 0.96 0.26 -0.91 -1.00 0.00 0.00 179.01 178.10 2qeb h ASN 8 N 0.58 0.00 -0.35 1.42 2.35 -1.03 -2.27 115.58 116.28 2qeb h ASN 8 Ca 0.09 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.84 2qeb h ASN 8 Cb 0.72 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.09 2qeb h ASN 8 CO 0.05 0.00 0.00 2.29 -1.65 0.00 0.00 177.43 178.12 2qeb n LYS 9 N -4.06 2.45 -1.64 0.81 2.85 -1.01 -4.96 118.16 112.59 2qeb n LYS 9 Ca 0.04 -2.23 -0.43 0.00 -1.05 0.00 0.00 58.31 54.65 2qeb n LYS 9 Cb 0.42 -1.49 -0.00 0.00 -0.65 0.00 0.00 35.03 33.31 2qeb n LYS 9 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 177.40 178.63 2qeb n LEU 10 N 1.43 2.76 -4.76 -5.58 4.77 -0.86 -4.98 117.00 109.78 2qeb n LEU 10 Ca 0.18 1.14 -0.36 0.00 -0.03 0.00 0.00 56.01 56.94 2qeb n LEU 10 Cb 0.59 -1.39 0.01 0.00 -2.33 0.00 0.00 43.42 40.31 2qeb n LEU 10 CO 0.15 -1.07 0.83 -2.16 -1.33 0.00 0.00 177.39 173.82 2qeb s PRO 11 N -1.84 3.33 0.42 3.23 0.04 -1.26 -4.69 135.00 134.24 2qeb s PRO 11 Ca 0.59 1.79 0.27 0.00 0.04 0.00 0.00 61.00 63.69 2qeb s PRO 11 Cb -0.60 -2.12 1.36 0.00 0.04 0.00 0.00 34.50 33.18 2qeb s PRO 11 CO 0.60 -0.91 1.64 -1.35 0.04 0.00 0.00 177.00 177.02 2qeb h PRO 12 N 1.37 0.12 -0.01 0.56 0.11 -1.99 0.47 132.00 132.64 2qeb h PRO 12 Ca -0.50 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.58 2qeb h PRO 12 Cb 1.27 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 32.35 2qeb h PRO 12 CO 0.57 0.08 -0.11 0.66 -0.21 0.00 0.00 178.00 179.00 2qeb h SER 13 N 0.13 0.01 0.00 -2.05 4.64 -2.02 -3.10 113.55 111.16 2qeb h SER 13 Ca 0.79 -0.00 -0.34 0.00 -0.47 0.00 0.00 61.79 61.77 2qeb h SER 13 Cb 2.38 -0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 64.40 2qeb h SER 13 CO -0.44 0.12 -2.28 0.18 -0.87 0.00 0.00 176.83 173.54 2qeb n LEU 14 N -4.40 0.20 -0.31 5.97 4.77 0.16 -4.24 117.00 119.14 2qeb n LEU 14 Ca -0.03 -0.01 0.15 0.00 -0.03 0.00 0.00 56.01 56.10 2qeb n LEU 14 Cb 0.19 0.37 0.39 0.00 -2.33 0.00 0.00 43.42 42.04 2qeb n LEU 14 CO 0.36 0.49 1.21 0.11 -1.33 0.00 0.00 177.39 178.23 2qeb h LYS 15 N 0.00 0.62 0.00 3.23 1.57 -1.27 -0.30 116.57 120.43 2qeb h LYS 15 Ca -0.51 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.23 2qeb h LYS 15 Cb 2.13 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 34.30 2qeb h LYS 15 CO 0.02 0.41 0.00 -1.13 -0.57 0.00 0.00 179.45 178.18 2qeb n SER 16 N -4.64 0.00 -0.99 0.86 3.41 -1.18 -2.00 113.62 109.09 2qeb n SER 16 Ca 0.21 0.50 0.08 0.00 -0.26 0.00 0.00 58.87 59.40 2qeb n SER 16 Cb 0.60 -0.50 0.27 0.00 -0.26 0.00 0.00 64.21 64.33 2qeb n SER 16 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2qeb n ARG 17 N -1.50 3.07 -0.36 4.33 1.74 -0.15 -4.77 116.66 119.02 2qeb n ARG 17 Ca 0.06 -2.88 0.05 0.00 -0.77 0.00 0.00 57.85 54.30 2qeb n ARG 17 Cb 0.27 -1.89 0.21 0.00 -1.02 0.00 0.00 32.46 30.04 2qeb n ARG 17 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 2qeb h LEU 18 N 1.98 0.98 -0.84 0.55 5.85 -1.02 -1.55 115.31 121.25 2qeb h LEU 18 Ca 0.00 0.03 -0.11 0.00 0.84 0.00 0.00 57.88 58.64 2qeb h LEU 18 Cb 1.50 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 42.34 2qeb h LEU 18 CO 0.25 0.58 -0.29 0.00 -0.34 0.00 0.00 178.44 178.64 2qeb h GLU 20 N 0.46 -0.34 -0.65 0.00 5.08 -1.79 -2.08 114.58 115.26 2qeb h GLU 20 Ca 0.06 0.02 0.12 0.00 -1.00 0.00 0.00 59.36 58.57 2qeb h GLU 20 Cb 0.74 0.08 -0.09 0.00 0.50 0.00 0.00 28.75 29.97 2qeb h GLU 20 CO 0.06 -0.19 0.17 0.82 -1.00 0.00 0.00 179.01 178.87 2qeb h ILE 21 N -0.41 0.63 0.00 3.13 2.04 -0.87 -1.09 117.51 120.94 2qeb h ILE 21 Ca -0.04 -0.10 0.00 0.00 1.00 0.00 0.00 64.86 65.72 2qeb h ILE 21 Cb 0.31 0.30 0.00 0.00 -0.74 0.00 0.00 36.82 36.69 2qeb h ILE 21 CO 0.06 0.06 0.00 0.54 0.00 0.00 0.00 178.15 178.80 2qeb n ARG 22 N -5.10 0.08 -0.18 2.37 1.74 0.11 -0.93 116.66 114.75 2qeb n ARG 22 Ca 0.11 0.14 0.08 0.00 -0.77 0.00 0.00 57.85 57.40 2qeb n ARG 22 Cb 0.36 -1.60 0.23 0.00 -1.02 0.00 0.00 32.46 30.43 2qeb n ARG 22 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2qeb n ARG 23 N -1.74 1.92 -2.11 5.56 1.74 -0.47 -4.95 116.66 116.61 2qeb n ARG 23 Ca 0.06 -1.42 -0.17 0.00 -0.77 0.00 0.00 57.85 55.54 2qeb n ARG 23 Cb 0.32 -1.35 -0.03 0.00 -1.02 0.00 0.00 32.46 30.38 2qeb n ARG 23 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 2qeb n TYR 24 N 0.65 -0.61 -2.40 -1.55 4.01 -0.11 -4.99 117.16 112.17 2qeb n TYR 24 Ca 0.15 0.00 -0.41 0.00 -0.16 0.00 0.00 57.90 57.48 2qeb n TYR 24 Cb 0.35 -3.33 -0.04 0.00 -0.31 0.00 0.00 39.34 36.02 2qeb n TYR 24 CO 0.00 0.00 0.00 -1.21 -0.46 0.00 0.00 176.86 175.19 2qeb s GLU 25 N -4.50 4.52 -0.03 -0.72 2.02 -0.82 -4.99 118.70 114.18 2qeb s GLU 25 Ca 0.00 1.85 -0.30 0.00 0.02 0.00 0.00 54.97 56.54 2qeb s GLU 25 Cb 0.00 -3.23 -0.03 0.00 0.10 0.00 0.00 34.13 30.96 2qeb s GLU 25 CO 0.00 -0.03 1.08 0.42 0.02 0.00 0.00 175.26 176.75 2qeb s ILE 26 N -0.24 4.55 -0.06 -1.63 -1.09 -1.26 -4.55 121.20 116.92 2qeb s ILE 26 Ca 0.51 1.83 0.00 0.00 -2.23 0.00 0.00 60.65 60.77 2qeb s ILE 26 Cb -0.32 -4.18 0.02 0.00 -1.58 0.00 0.00 42.46 36.40 2qeb s ILE 26 CO 0.37 0.07 -0.04 -0.63 -1.23 0.00 0.00 174.94 173.49 2qeb s ILE 27 N 1.56 0.58 0.42 2.92 1.01 -1.26 -5.12 121.20 121.31 2qeb s ILE 27 Ca 0.53 -0.08 -0.01 0.00 0.00 0.00 0.00 60.65 61.09 2qeb s ILE 27 Cb -0.23 -0.64 -0.02 0.00 0.01 0.00 0.00 42.46 41.58 2qeb s ILE 27 CO 0.24 0.26 0.65 -1.61 0.00 0.00 0.00 174.94 174.48 2qeb s GLU 28 N 1.35 3.29 0.00 2.79 0.41 -1.26 -4.76 118.70 120.52 2qeb s GLU 28 Ca -0.04 -0.31 0.00 0.00 -0.41 0.00 0.00 54.97 54.21 2qeb s GLU 28 Cb -0.13 -2.56 0.00 0.00 -1.78 0.00 0.00 34.13 29.66 2qeb s GLU 28 CO -0.03 -0.12 0.00 0.41 -0.49 0.00 0.00 175.26 175.04 2qeb n GLY 29 N -2.01 2.42 0.20 -1.39 0.00 -1.26 -4.74 105.19 98.41 2qeb n GLY 29 Ca -0.01 -2.03 0.07 0.00 0.00 0.00 0.00 46.02 44.05 2qeb n GLY 29 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2qeb h PRO 30 N 0.00 0.00 -0.10 1.61 0.13 -1.98 -0.72 132.00 130.94 2qeb h PRO 30 Ca 0.00 0.00 -0.20 0.00 -0.87 0.00 0.00 66.00 64.93 2qeb h PRO 30 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 2qeb h PRO 30 CO 0.00 0.31 -0.76 0.93 -0.23 0.00 0.00 178.00 178.25 2qeb h GLU 31 N 0.00 0.54 -0.37 0.86 4.39 -1.98 -2.52 114.58 115.51 2qeb h GLU 31 Ca -0.00 -0.45 -0.14 0.00 0.34 0.00 0.00 59.36 59.11 2qeb h GLU 31 Cb 0.82 0.10 -0.01 0.00 -0.10 0.00 0.00 28.75 29.56 2qeb h GLU 31 CO 0.04 1.08 -0.32 0.52 -1.16 0.00 0.00 179.01 179.17 2qeb h MET 32 N 0.36 0.81 -1.00 2.33 2.86 -1.47 -0.73 114.93 118.09 2qeb h MET 32 Ca -0.04 -0.39 0.18 0.00 -2.06 0.00 0.00 59.70 57.39 2qeb h MET 32 Cb 1.36 -0.01 -0.10 0.00 0.06 0.00 0.00 31.60 32.91 2qeb h MET 32 CO 0.14 1.02 0.62 -0.44 1.06 0.00 0.00 176.91 179.30 2qeb h ASP 33 N 0.68 0.80 -0.04 1.22 3.32 -1.20 -0.50 116.42 120.71 2qeb h ASP 33 Ca 0.07 0.09 -0.04 0.00 0.02 0.00 0.00 57.03 57.17 2qeb h ASP 33 Cb 0.87 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.37 2qeb h ASP 33 CO 0.08 0.31 -0.15 0.11 -1.72 0.00 0.00 179.24 177.86 2qeb h LYS 34 N 0.79 0.16 -0.53 3.56 1.57 -1.11 -2.79 116.57 118.22 2qeb h LYS 34 Ca 0.57 -0.13 0.01 0.00 -1.87 0.00 0.00 60.65 59.22 2qeb h LYS 34 Cb 0.85 0.02 -0.03 0.00 0.08 0.00 0.00 32.23 33.16 2qeb h LYS 34 CO -0.36 0.77 0.35 1.25 -0.57 0.00 0.00 179.45 180.89 2qeb h HIS 35 N -0.41 0.66 -0.28 -1.35 2.76 -0.81 -1.52 115.15 114.22 2qeb h HIS 35 Ca -0.01 0.02 -0.13 0.00 -2.20 0.00 0.00 60.37 58.05 2qeb h HIS 35 Cb 0.80 -0.22 -0.01 0.00 1.55 0.00 0.00 27.41 29.52 2qeb h HIS 35 CO 0.14 0.41 -0.35 0.82 -1.30 0.00 0.00 177.93 177.65 2qeb h ILE 36 N 0.71 1.29 -0.53 6.26 1.08 -1.20 -0.75 117.51 124.37 2qeb h ILE 36 Ca 0.20 -1.48 0.04 0.00 -0.39 0.00 0.00 64.86 63.23 2qeb h ILE 36 Cb -0.07 1.45 -0.04 0.00 -3.07 0.00 0.00 36.82 35.09 2qeb h ILE 36 CO -0.05 0.47 0.28 -0.74 -0.69 0.00 0.00 178.15 177.42 2qeb h HIS 37 N 0.51 0.51 -0.20 1.37 2.76 -1.31 -0.74 115.15 118.05 2qeb h HIS 37 Ca 0.05 0.02 0.02 0.00 -2.20 0.00 0.00 60.37 58.27 2qeb h HIS 37 Cb 0.84 -0.15 -0.02 0.00 1.55 0.00 0.00 27.41 29.62 2qeb h HIS 37 CO 0.04 0.25 0.05 0.00 -1.30 0.00 0.00 177.93 176.97 2qeb h VAL 39 N 0.13 1.37 -0.15 0.00 -1.51 -1.05 -0.40 116.25 114.64 2qeb h VAL 39 Ca 0.09 -2.17 -0.12 0.00 -1.23 0.00 0.00 66.70 63.27 2qeb h VAL 39 Cb 0.07 2.14 -0.01 0.00 -2.13 0.00 0.00 31.29 31.37 2qeb h VAL 39 CO -0.11 0.66 -0.44 0.24 -1.23 0.00 0.00 177.57 176.68 2qeb h MET 40 N 0.30 0.35 -0.32 5.19 2.86 -0.97 -1.23 114.93 121.12 2qeb h MET 40 Ca -0.04 -0.18 -0.05 0.00 -2.06 0.00 0.00 59.70 57.36 2qeb h MET 40 Cb 1.36 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 33.02 2qeb h MET 40 CO 0.14 0.73 -0.00 0.00 1.06 0.00 0.00 176.91 178.84 2qeb h ARG 41 N 0.29 0.58 -0.59 1.72 2.47 -0.97 0.17 114.38 118.05 2qeb h ARG 41 Ca 0.02 -0.19 0.00 0.00 -1.26 0.00 0.00 59.98 58.56 2qeb h ARG 41 Cb 0.90 -0.05 -0.03 0.00 -1.65 0.00 0.00 29.97 29.14 2qeb h ARG 41 CO 0.07 0.71 0.39 0.00 0.56 0.00 0.00 179.97 181.70 2qeb h ALA 42 N 0.85 1.57 -0.02 0.04 0.00 -0.50 -0.84 119.26 120.35 2qeb h ALA 42 Ca 0.09 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2qeb h ALA 42 Cb 0.45 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2qeb h ALA 42 CO 0.02 0.39 -0.06 1.28 0.00 0.00 0.00 179.25 180.89 2qeb n LEU 43 N -4.44 2.44 -1.11 0.00 4.77 -0.52 -4.86 117.00 113.29 2qeb n LEU 43 Ca 0.06 -0.82 -0.06 0.00 -0.03 0.00 0.00 56.01 55.16 2qeb n LEU 43 Cb 0.05 -0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.15 2qeb n LEU 43 CO 0.36 0.41 0.04 -0.67 -1.33 0.00 0.00 177.39 176.20 2qeb n ASP 44 N 0.84 -2.88 0.01 -1.43 2.03 -0.32 -4.94 116.55 109.86 2qeb n ASP 44 Ca 0.15 -0.10 0.11 0.00 0.52 0.00 0.00 54.79 55.46 2qeb n ASP 44 Cb 0.51 -1.57 -0.12 0.00 -0.72 0.00 0.00 41.12 39.22 2qeb n ASP 44 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 2qeb n PHE 45 N -3.27 0.15 -4.20 -0.67 3.72 0.51 -4.89 117.46 108.82 2qeb n PHE 45 Ca -0.01 0.04 -0.15 0.00 -0.05 0.00 0.00 57.45 57.28 2qeb n PHE 45 Cb 0.52 -0.50 -0.11 0.00 -0.94 0.00 0.00 39.48 38.45 2qeb n PHE 45 CO 0.00 0.00 0.00 0.14 -0.05 0.00 0.00 176.76 176.85 2qeb s VAL 46 N -3.41 1.07 1.16 -4.37 -7.23 -1.21 -1.01 120.40 105.40 2qeb s VAL 46 Ca -0.04 -1.69 -0.19 0.00 -1.81 0.00 0.00 61.98 58.25 2qeb s VAL 46 Cb 0.14 -1.45 0.27 0.00 0.56 0.00 0.00 36.38 35.90 2qeb s VAL 46 CO 0.88 -0.53 1.15 -0.31 -0.31 0.00 0.00 175.10 175.98 2qeb s TYR 47 N -2.43 0.64 0.32 2.82 2.02 0.57 -4.71 117.35 116.58 2qeb s TYR 47 Ca 0.07 0.44 0.13 0.00 -0.37 0.00 0.00 57.07 57.35 2qeb s TYR 47 Cb -0.03 -3.59 0.63 0.00 -0.40 0.00 0.00 41.96 38.57 2qeb s TYR 47 CO 0.01 -3.68 1.76 0.93 -1.57 0.00 0.00 175.55 173.00 2qeb h GLU 48 N -2.43 0.00 -0.00 -0.62 5.08 -2.02 0.92 114.58 115.51 2qeb h GLU 48 Ca -0.44 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.92 2qeb h GLU 48 Cb 1.28 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.53 2qeb h GLU 48 CO 0.34 0.44 -0.07 -0.40 -1.00 0.00 0.00 179.01 178.32 2qeb n ASP 49 N -3.93 0.24 0.00 1.42 5.75 -1.26 -4.91 116.55 113.86 2qeb n ASP 49 Ca -0.01 -0.35 0.00 0.00 -0.01 0.00 0.00 54.79 54.41 2qeb n ASP 49 Cb 0.48 -0.17 0.00 0.00 -1.03 0.00 0.00 41.12 40.40 2qeb n ASP 49 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2qeb n GLY 50 N 1.29 0.47 3.72 6.12 0.00 0.32 -4.59 105.19 112.51 2qeb n GLY 50 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 2qeb n GLY 50 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2qeb s ARG 51 N -0.90 4.18 0.33 1.61 3.52 -1.26 -2.58 118.95 123.84 2qeb s ARG 51 Ca 0.00 2.46 -0.29 0.00 -0.13 0.00 0.00 55.73 57.77 2qeb s ARG 51 Cb 0.00 -3.16 -0.12 0.00 -1.56 0.00 0.00 34.95 30.11 2qeb s ARG 51 CO 0.00 -0.67 1.35 0.41 -0.81 0.00 0.00 175.30 175.57 2qeb n GLY 52 N 3.87 0.72 3.46 8.12 0.00 -1.26 -0.32 105.19 119.77 2qeb n GLY 52 Ca 0.15 0.35 -0.43 0.00 0.00 0.00 0.00 46.02 46.09 2qeb n GLY 52 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2qeb s ASP 53 N -0.15 6.16 0.31 1.61 -1.08 -0.18 -4.80 116.67 118.53 2qeb s ASP 53 Ca 0.58 -0.89 0.07 0.00 -0.52 0.00 0.00 52.55 51.79 2qeb s ASP 53 Cb -0.57 -2.20 0.83 0.00 -1.46 0.00 0.00 42.92 39.53 2qeb s ASP 53 CO 0.60 -0.57 1.71 0.22 0.52 0.00 0.00 175.17 177.65 2qeb h TYR 54 N 8.72 0.86 0.00 -5.34 3.20 -1.93 -2.52 116.97 119.95 2qeb h TYR 54 Ca -0.27 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.64 2qeb h TYR 54 Cb 1.11 -0.23 0.00 0.00 1.54 0.00 0.00 36.73 39.15 2qeb h TYR 54 CO 0.61 0.00 -0.26 0.72 -1.64 0.00 0.00 178.16 177.59 2qeb n HIS 55 N -4.96 0.73 0.97 -3.82 8.25 -1.26 -1.27 115.22 113.86 2qeb n HIS 55 Ca 0.25 0.21 0.14 0.00 -0.26 0.00 0.00 57.72 58.06 2qeb n HIS 55 Cb 0.72 -0.80 0.60 0.00 1.12 0.00 0.00 29.99 31.64 2qeb n HIS 55 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 2qeb n LYS 56 N -2.16 0.02 0.00 -0.41 5.02 -0.95 -4.40 118.16 115.28 2qeb n LYS 56 Ca 0.05 0.02 0.00 0.00 -2.02 0.00 0.00 58.31 56.35 2qeb n LYS 56 Cb 0.43 -1.52 0.00 0.00 -0.02 0.00 0.00 35.03 33.92 2qeb n LYS 56 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2qeb n LEU 57 N -1.55 0.91 -0.01 -0.35 4.77 -1.04 -4.71 117.00 115.02 2qeb n LEU 57 Ca 0.07 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 55.94 2qeb n LEU 57 Cb 0.34 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.39 2qeb n LEU 57 CO 0.27 0.15 0.64 0.22 -1.33 0.00 0.00 177.39 177.34 2qeb h TYR 58 N 0.00 -0.92 0.12 -1.77 3.20 -1.39 0.63 116.97 116.84 2qeb h TYR 58 Ca 0.00 0.04 -0.01 0.00 3.14 0.00 0.00 58.73 61.91 2qeb h TYR 58 Cb 0.71 0.43 0.00 0.00 1.54 0.00 0.00 36.73 39.41 2qeb h TYR 58 CO 0.00 -0.40 -0.06 -0.44 -1.64 0.00 0.00 178.16 175.62 2qeb h ASP 59 N -0.39 -0.13 -0.72 -2.11 3.32 -1.84 -2.28 116.42 112.25 2qeb h ASP 59 Ca 0.10 -0.34 0.12 0.00 0.02 0.00 0.00 57.03 56.93 2qeb h ASP 59 Cb 0.55 0.03 -0.08 0.00 0.22 0.00 0.00 39.33 40.05 2qeb h ASP 59 CO -0.37 0.29 0.32 -0.65 -1.72 0.00 0.00 179.24 177.11 2qeb h PRO 60 N -0.59 0.49 -0.10 3.56 0.11 -1.83 0.17 132.00 133.81 2qeb h PRO 60 Ca -0.02 -0.03 0.02 0.00 0.11 0.00 0.00 66.00 66.09 2qeb h PRO 60 Cb 0.46 -0.11 -0.02 0.00 0.11 0.00 0.00 31.00 31.44 2qeb h PRO 60 CO 0.03 0.32 -0.04 -0.07 -0.21 0.00 0.00 178.00 178.02 2qeb h LEU 61 N 0.50 -0.15 -1.20 2.35 3.38 -0.83 -2.43 115.31 116.93 2qeb h LEU 61 Ca 0.38 0.04 -0.08 0.00 0.09 0.00 0.00 57.88 58.30 2qeb h LEU 61 Cb 0.50 0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.32 2qeb h LEU 61 CO -0.34 -0.06 -0.39 0.78 0.09 0.00 0.00 178.44 178.52 2qeb h ASN 62 N -0.03 0.02 -0.13 -0.43 2.35 -0.94 -0.80 115.58 115.62 2qeb h ASN 62 Ca 0.06 -0.01 -0.14 0.00 -0.55 0.00 0.00 56.30 55.66 2qeb h ASN 62 Cb 0.12 -0.01 -0.01 0.00 0.05 0.00 0.00 38.32 38.47 2qeb h ASN 62 CO -0.12 0.41 -0.40 0.40 -1.65 0.00 0.00 177.43 176.07 2qeb h ILE 63 N 0.02 1.29 -0.01 2.81 2.04 -0.83 -2.27 117.51 120.56 2qeb h ILE 63 Ca -0.00 -1.57 -0.21 0.00 1.00 0.00 0.00 64.86 64.08 2qeb h ILE 63 Cb 0.69 1.50 0.02 0.00 -0.74 0.00 0.00 36.82 38.29 2qeb h ILE 63 CO 0.05 0.50 -0.83 0.40 0.00 0.00 0.00 178.15 178.27 2qeb h ILE 64 N 0.54 1.35 -1.45 -0.67 1.08 -1.21 -3.44 117.51 113.72 2qeb h ILE 64 Ca 0.05 -2.16 -0.08 0.00 -0.39 0.00 0.00 64.86 62.28 2qeb h ILE 64 Cb 0.92 2.47 -0.26 0.00 -3.07 0.00 0.00 36.82 36.88 2qeb h ILE 64 CO 0.08 0.65 -0.44 -0.70 -0.69 0.00 0.00 178.15 177.06 2qeb s GLU 65 N -3.28 0.46 0.13 2.37 2.12 -0.33 -5.06 118.70 115.11 2qeb s GLU 65 Ca -0.11 0.49 -0.31 0.00 0.36 0.00 0.00 54.97 55.39 2qeb s GLU 65 Cb 0.05 -0.05 -0.10 0.00 0.26 0.00 0.00 34.13 34.30 2qeb s GLU 65 CO 0.88 -0.87 1.65 -1.17 -0.54 0.00 0.00 175.26 175.21 2qeb s LEU 66 N 2.67 4.37 -0.30 2.70 2.96 -0.86 -4.27 118.68 125.96 2qeb s LEU 66 Ca 0.13 2.61 -0.13 0.00 -0.22 0.00 0.00 54.13 56.51 2qeb s LEU 66 Cb -0.13 -3.58 0.15 0.00 0.50 0.00 0.00 46.19 43.13 2qeb s LEU 66 CO -0.24 -0.89 0.86 -0.62 -1.32 0.00 0.00 176.35 174.15 2qeb s ASP 67 N 1.86 -0.79 0.54 3.68 -1.08 -1.26 -5.02 116.67 114.60 2qeb s ASP 67 Ca 0.73 1.08 0.36 0.00 -0.52 0.00 0.00 52.55 54.20 2qeb s ASP 67 Cb -0.43 1.89 1.86 0.00 -1.46 0.00 0.00 42.92 44.78 2qeb s ASP 67 CO 0.32 -0.15 2.10 0.07 0.52 0.00 0.00 175.17 178.03 2qeb h LYS 68 N 7.69 0.00 0.00 4.34 2.10 -2.02 -2.33 116.57 126.35 2qeb h LYS 68 Ca -0.16 0.00 -0.02 0.00 -2.00 0.00 0.00 60.65 58.46 2qeb h LYS 68 Cb 1.11 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.44 2qeb h LYS 68 CO 0.09 0.00 -0.10 0.00 -2.00 0.00 0.00 179.45 177.43 2qeb h ARG 69 N 0.00 0.00 -0.31 0.07 3.08 -1.98 -3.17 114.38 112.07 2qeb h ARG 69 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2qeb h ARG 69 Cb 0.12 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.15 2qeb h ARG 69 CO 0.00 0.10 0.20 0.45 -1.07 0.00 0.00 179.97 179.66 2qeb h HIS 70 N 0.00 0.39 -0.14 3.04 3.86 -1.81 0.14 115.15 120.62 2qeb h HIS 70 Ca -0.00 0.01 0.05 0.00 -1.16 0.00 0.00 60.37 59.26 2qeb h HIS 70 Cb 0.63 -0.13 -0.07 0.00 1.06 0.00 0.00 27.41 28.90 2qeb h HIS 70 CO 0.00 0.25 -0.36 0.22 0.86 0.00 0.00 177.93 178.90 2qeb h ASP 71 N 0.41 -1.12 -0.80 2.45 3.58 -1.75 0.18 116.42 119.37 2qeb h ASP 71 Ca 0.11 0.16 0.05 0.00 0.42 0.00 0.00 57.03 57.77 2qeb h ASP 71 Cb -0.04 0.47 -0.06 0.00 1.72 0.00 0.00 39.33 41.42 2qeb h ASP 71 CO -0.02 -0.38 0.49 0.58 -2.88 0.00 0.00 179.24 177.02 2qeb h VAL 72 N -0.43 1.05 -0.26 2.25 2.07 -1.52 -2.22 116.25 117.19 2qeb h VAL 72 Ca 0.09 -0.31 -0.15 0.00 0.82 0.00 0.00 66.70 67.15 2qeb h VAL 72 Cb 0.58 0.06 -0.00 0.00 -1.52 0.00 0.00 31.29 30.40 2qeb h VAL 72 CO -0.38 0.17 -0.41 0.78 0.02 0.00 0.00 177.57 177.75 2qeb h ASN 73 N 0.91 0.81 -0.36 0.57 2.35 -0.33 -1.91 115.58 117.62 2qeb h ASN 73 Ca 0.34 -0.52 0.05 0.00 -0.55 0.00 0.00 56.30 55.62 2qeb h ASN 73 Cb 0.13 -0.23 -0.04 0.00 0.05 0.00 0.00 38.32 38.23 2qeb h ASN 73 CO -0.16 1.17 0.10 -0.07 -1.65 0.00 0.00 177.43 176.82 2qeb h LEU 74 N 0.47 0.07 -0.72 1.61 3.38 -0.77 -0.77 115.31 118.58 2qeb h LEU 74 Ca 0.02 0.05 -0.03 0.00 0.09 0.00 0.00 57.88 58.02 2qeb h LEU 74 Cb 1.01 0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.78 2qeb h LEU 74 CO 0.09 0.08 0.35 -0.33 0.09 0.00 0.00 178.44 178.72 2qeb h GLU 75 N 0.23 1.04 -0.36 1.13 4.39 -1.32 -0.32 114.58 119.37 2qeb h GLU 75 Ca 0.17 -0.15 -0.00 0.00 0.34 0.00 0.00 59.36 59.72 2qeb h GLU 75 Cb 0.17 -0.19 -0.02 0.00 -0.10 0.00 0.00 28.75 28.62 2qeb h GLU 75 CO -0.20 0.81 0.22 -0.22 -1.16 0.00 0.00 179.01 178.46 2qeb h LYS 76 N 1.01 0.48 0.04 2.33 3.64 -1.01 -1.10 116.57 121.96 2qeb h LYS 76 Ca 0.25 -0.04 -0.24 0.00 -1.27 0.00 0.00 60.65 59.35 2qeb h LYS 76 Cb 0.11 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 31.81 2qeb h LYS 76 CO -0.03 0.36 -1.15 0.00 -2.27 0.00 0.00 179.45 176.36 2qeb h ILE 78 N 0.02 1.16 -0.93 0.00 2.04 -1.10 -1.53 117.51 117.17 2qeb h ILE 78 Ca -0.08 -0.47 0.17 0.00 1.00 0.00 0.00 64.86 65.49 2qeb h ILE 78 Cb 1.85 1.36 -0.10 0.00 -0.74 0.00 0.00 36.82 39.19 2qeb h ILE 78 CO 0.15 0.13 0.53 1.23 0.00 0.00 0.00 178.15 180.19 2qeb h GLY 79 N -0.08 1.60 0.96 5.37 0.00 -1.05 -1.95 103.07 107.93 2qeb h GLY 79 Ca 0.02 -0.31 -0.12 0.00 0.00 0.00 0.00 47.33 46.93 2qeb h GLY 79 CO -0.00 -0.06 -0.29 0.83 0.00 0.00 0.00 176.54 177.02 2qeb h GLU 80 N 0.69 0.68 -0.13 4.80 5.08 -1.03 -3.27 114.58 121.40 2qeb h GLU 80 Ca 0.53 -0.36 -0.15 0.00 -1.00 0.00 0.00 59.36 58.37 2qeb h GLU 80 Cb 0.80 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.06 2qeb h GLU 80 CO -0.38 0.97 -0.58 0.00 -1.00 0.00 0.00 179.01 178.02 2qeb h VAL 82 N 0.30 0.38 0.00 0.00 2.07 -1.45 -2.06 116.25 115.49 2qeb h VAL 82 Ca -0.00 -0.14 0.00 0.00 0.82 0.00 0.00 66.70 67.38 2qeb h VAL 82 Cb 1.11 1.10 0.00 0.00 -1.52 0.00 0.00 31.29 31.97 2qeb h VAL 82 CO 0.10 0.03 -0.12 0.00 0.02 0.00 0.00 177.57 177.60 2qeb n GLN 83 N -3.57 0.15 -3.89 1.57 6.02 -1.05 -4.87 117.38 111.75 2qeb n GLN 83 Ca -0.03 0.10 -0.29 0.00 -0.01 0.00 0.00 57.00 56.78 2qeb n GLN 83 Cb 0.12 -1.66 -0.04 0.00 1.02 0.00 0.00 30.24 29.69 2qeb n GLN 83 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 177.06 176.19 2qeb s VAL 84 N -3.06 5.33 0.50 5.09 -7.23 -0.78 -5.08 120.40 115.17 2qeb s VAL 84 Ca 0.11 -0.45 -0.20 0.00 -1.81 0.00 0.00 61.98 59.63 2qeb s VAL 84 Cb 0.15 -3.68 -0.10 0.00 0.56 0.00 0.00 36.38 33.31 2qeb s VAL 84 CO 0.60 0.03 0.59 -0.81 -0.31 0.00 0.00 175.10 175.19 2qeb n PRO 85 N -0.09 0.63 0.14 4.82 -0.04 -1.26 -4.75 135.00 134.45 2qeb n PRO 85 Ca -0.05 0.24 0.02 0.00 -0.04 0.00 0.00 63.50 63.66 2qeb n PRO 85 Cb 0.52 -1.67 0.35 0.00 -0.04 0.00 0.00 33.50 32.67 2qeb n PRO 85 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2qeb h THR 86 N 0.61 1.23 0.00 0.52 1.03 -1.92 -2.04 112.91 112.33 2qeb h THR 86 Ca -0.43 -1.07 0.00 0.00 -0.01 0.00 0.00 66.41 64.90 2qeb h THR 86 Cb 1.39 1.46 0.00 0.00 -1.07 0.00 0.00 68.15 69.94 2qeb h THR 86 CO 0.50 0.32 0.15 -1.54 -0.01 0.00 0.00 175.52 174.94 2qeb n SER 87 N -4.17 0.00 0.00 0.00 3.41 -1.26 -2.36 113.62 109.23 2qeb n SER 87 Ca -0.01 0.21 0.00 0.00 -0.26 0.00 0.00 58.87 58.81 2qeb n SER 87 Cb 0.35 -0.21 0.00 0.00 -0.26 0.00 0.00 64.21 64.09 2qeb n SER 87 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 2qeb n GLU 88 N -1.16 0.00 0.04 4.33 2.13 -0.79 -4.57 120.64 120.62 2qeb n GLU 88 Ca 0.00 -0.14 -0.16 0.00 0.66 0.00 0.00 57.16 57.52 2qeb n GLU 88 Cb 0.15 -0.28 -0.14 0.00 0.27 0.00 0.00 31.44 31.44 2qeb n GLU 88 CO 0.00 0.00 0.00 -0.09 -0.41 0.00 0.00 177.13 176.63 2qeb h ARG 89 N 0.00 0.20 -0.39 5.31 2.43 -1.23 -2.42 114.38 118.28 2qeb h ARG 89 Ca 0.00 -0.35 -0.00 0.00 -0.81 0.00 0.00 59.98 58.82 2qeb h ARG 89 Cb 0.75 0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 30.41 2qeb h ARG 89 CO 0.00 1.02 0.23 0.00 -1.51 0.00 0.00 179.97 179.72 2qeb h ALA 90 N 0.51 0.50 -0.33 2.80 0.00 -1.73 -2.56 119.26 118.45 2qeb h ALA 90 Ca -0.28 -0.06 -0.15 0.00 0.00 0.00 0.00 54.91 54.42 2qeb h ALA 90 Cb 2.01 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 19.64 2qeb h ALA 90 CO 0.13 -0.00 -0.41 1.25 0.00 0.00 0.00 179.25 180.22 2qeb h HIS 91 N 0.51 0.98 -0.38 0.00 -0.00 -1.81 -1.84 115.15 112.61 2qeb h HIS 91 Ca 0.14 -0.30 -0.03 0.00 -0.00 0.00 0.00 60.37 60.19 2qeb h HIS 91 Cb 0.01 -0.20 -0.02 0.00 -0.00 0.00 0.00 27.41 27.20 2qeb h HIS 91 CO -0.03 1.08 0.14 0.28 -0.00 0.00 0.00 177.93 179.40 2qeb h VAL 92 N 0.66 1.20 -0.16 5.26 2.07 -1.49 0.55 116.25 124.34 2qeb h VAL 92 Ca 0.05 -0.64 0.05 0.00 0.82 0.00 0.00 66.70 66.98 2qeb h VAL 92 Cb 0.98 0.91 -0.06 0.00 -1.52 0.00 0.00 31.29 31.60 2qeb h VAL 92 CO 0.09 0.23 -0.22 0.15 0.02 0.00 0.00 177.57 177.84 2qeb h PHE 93 N 0.47 -0.59 -0.08 1.57 3.57 -1.35 0.13 116.94 120.66 2qeb h PHE 93 Ca 0.12 0.03 0.03 0.00 3.53 0.00 0.00 57.97 61.68 2qeb h PHE 93 Cb 0.22 0.29 -0.03 0.00 2.79 0.00 0.00 35.95 39.22 2qeb h PHE 93 CO 0.00 -0.30 -0.09 -0.92 -2.23 0.00 0.00 178.31 174.77 2qeb h TYR 94 N -0.27 -0.22 -0.35 0.41 3.20 -1.21 0.73 116.97 119.25 2qeb h TYR 94 Ca 0.11 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.99 2qeb h TYR 94 Cb 0.43 0.11 -0.02 0.00 1.54 0.00 0.00 36.73 38.80 2qeb h TYR 94 CO -0.34 -0.14 0.22 0.87 -1.64 0.00 0.00 178.16 177.13 2qeb h LYS 95 N -0.12 0.46 -0.13 1.82 1.57 -0.74 -1.03 116.57 118.40 2qeb h LYS 95 Ca 0.06 -0.03 0.02 0.00 -1.87 0.00 0.00 60.65 58.83 2qeb h LYS 95 Cb 0.21 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.40 2qeb h LYS 95 CO -0.15 0.32 0.02 0.00 -0.57 0.00 0.00 179.45 179.06 2qeb h LEU 97 N 0.07 0.46 -1.37 0.00 3.38 -0.64 -1.82 115.31 115.38 2qeb h LEU 97 Ca 0.06 0.02 -0.07 0.00 0.09 0.00 0.00 57.88 57.99 2qeb h LEU 97 Cb 0.06 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 2qeb h LEU 97 CO -0.09 0.31 -0.31 -0.07 0.09 0.00 0.00 178.44 178.37 2qeb h LEU 98 N 0.59 0.00 0.00 1.67 3.38 -0.90 -2.37 115.31 117.68 2qeb h LEU 98 Ca 0.25 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.22 2qeb h LEU 98 Cb 0.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.88 2qeb h LEU 98 CO -0.15 0.31 -0.22 0.11 0.09 0.00 0.00 178.44 178.58 2qeb h LYS 99 N 0.00 0.00 -7.57 1.13 1.57 -0.71 -3.39 116.57 107.59 2qeb h LYS 99 Ca -0.00 0.00 -0.47 0.00 -1.87 0.00 0.00 60.65 58.30 2qeb h LYS 99 Cb 0.56 0.00 0.09 0.00 0.08 0.00 0.00 32.23 32.97 2qeb h LYS 99 CO 0.04 0.00 0.40 -1.54 -0.57 0.00 0.00 179.45 177.78 2qeb s SER 100 N -5.55 4.71 0.62 0.86 1.04 -0.74 -4.94 113.70 109.71 2qeb s SER 100 Ca 0.06 0.83 0.35 0.00 0.48 0.00 0.00 55.95 57.68 2qeb s SER 100 Cb 0.08 -1.39 2.03 0.00 0.10 0.00 0.00 66.02 66.83 2qeb s SER 100 CO 0.68 -1.78 2.27 0.71 0.98 0.00 0.00 173.24 176.11 2qeb h THR 101 N -0.95 0.31 0.00 2.02 1.35 -1.89 -0.64 112.91 113.12 2qeb h THR 101 Ca -0.46 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.40 2qeb h THR 101 Cb 1.31 0.97 0.00 0.00 -1.73 0.00 0.00 68.15 68.71 2qeb h THR 101 CO 0.65 0.00 0.00 0.41 -0.25 0.00 0.00 175.52 176.33 2qeb n THR 102 N -3.53 0.73 -0.20 6.82 -1.04 -1.26 -4.05 114.28 111.74 2qeb n THR 102 Ca -0.02 -0.01 -0.02 0.00 -2.04 0.00 0.00 64.05 61.96 2qeb n THR 102 Cb 0.11 -0.91 0.05 0.00 -1.82 0.00 0.00 70.33 67.76 2qeb n THR 102 CO 0.00 0.00 0.00 1.23 -0.64 0.00 0.00 175.07 175.66 2qeb h GLY 103 N 3.26 0.31 1.84 3.41 0.00 -0.61 0.59 103.07 111.87 2qeb h GLY 103 Ca 0.00 0.25 -0.04 0.00 0.00 0.00 0.00 47.33 47.54 2qeb h GLY 103 CO 0.00 -0.23 -0.11 0.07 0.00 0.00 0.00 176.54 176.27 2qeb h ARG 104 N -0.05 0.20 0.19 4.80 0.11 -1.80 -2.19 114.38 115.65 2qeb h ARG 104 Ca 0.28 -0.04 -0.31 0.00 0.10 0.00 0.00 59.98 60.00 2qeb h ARG 104 Cb 0.48 -0.03 0.02 0.00 1.11 0.00 0.00 29.97 31.55 2qeb h ARG 104 CO -0.63 0.33 -1.41 1.15 0.10 0.00 0.00 179.97 179.50 2qeb h THR 105 N 0.19 1.33 -0.88 0.08 2.02 -1.52 -3.23 112.91 110.90 2qeb h THR 105 Ca 0.04 -2.84 0.14 0.00 0.77 0.00 0.00 66.41 64.52 2qeb h THR 105 Cb 0.33 2.97 -0.09 0.00 -1.74 0.00 0.00 68.15 69.62 2qeb h THR 105 CO 0.02 0.85 0.49 0.15 0.37 0.00 0.00 175.52 177.39 2qeb h PHE 106 N 0.11 0.86 -0.52 3.16 3.57 -0.63 -1.58 116.94 121.90 2qeb h PHE 106 Ca -0.21 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.28 2qeb h PHE 106 Cb 2.08 -0.25 -0.03 0.00 2.79 0.00 0.00 35.95 40.54 2qeb h PHE 106 CO 0.10 0.25 0.19 0.87 -2.23 0.00 0.00 178.31 177.49 2qeb h LYS 107 N 0.72 0.76 -0.38 1.11 1.57 -1.47 0.24 116.57 119.13 2qeb h LYS 107 Ca 0.47 -0.12 -0.06 0.00 -1.87 0.00 0.00 60.65 59.07 2qeb h LYS 107 Cb 0.60 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.77 2qeb h LYS 107 CO -0.33 0.65 0.02 0.87 -0.57 0.00 0.00 179.45 180.09 2qeb h LYS 108 N 0.75 0.65 -0.59 3.15 1.57 -1.37 -1.17 116.57 119.56 2qeb h LYS 108 Ca 0.18 -0.20 -0.09 0.00 -1.87 0.00 0.00 60.65 58.67 2qeb h LYS 108 Cb 0.18 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.41 2qeb h LYS 108 CO -0.01 0.74 0.03 0.28 -0.57 0.00 0.00 179.45 179.91 2qeb h VAL 109 N 0.48 1.26 -0.13 0.50 2.07 -0.86 -0.20 116.25 119.36 2qeb h VAL 109 Ca 0.11 -1.09 -0.02 0.00 0.82 0.00 0.00 66.70 66.51 2qeb h VAL 109 Cb 0.43 0.78 -0.00 0.00 -1.52 0.00 0.00 31.29 30.98 2qeb h VAL 109 CO 0.02 0.40 -0.01 0.15 0.02 0.00 0.00 177.57 178.15 2qeb h PHE 110 N 0.93 0.26 -0.32 1.57 3.57 -0.94 -0.37 116.94 121.65 2qeb h PHE 110 Ca 0.17 -0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.63 2qeb h PHE 110 Cb 0.50 -0.07 -0.02 0.00 2.79 0.00 0.00 35.95 39.16 2qeb h PHE 110 CO 0.03 0.48 0.20 -0.44 -2.23 0.00 0.00 178.31 176.35 2qeb h ASP 111 N -0.04 0.37 -0.54 0.41 3.32 -1.01 -0.76 116.42 118.18 2qeb h ASP 111 Ca 0.04 -0.04 0.02 0.00 0.02 0.00 0.00 57.03 57.07 2qeb h ASP 111 Cb 0.38 -0.09 -0.03 0.00 0.22 0.00 0.00 39.33 39.80 2qeb h ASP 111 CO 0.01 0.30 0.33 -0.07 -1.72 0.00 0.00 179.24 178.09 2qeb h LEU 112 N 0.42 0.55 -0.70 1.55 3.38 -1.00 -2.38 115.31 117.13 2qeb h LEU 112 Ca 0.11 -0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.01 2qeb h LEU 112 Cb -0.01 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.59 2qeb h LEU 112 CO -0.02 0.39 0.15 -0.03 0.09 0.00 0.00 178.44 179.01 2qeb h MET 113 N 0.67 1.13 -0.31 1.13 4.05 -0.66 -0.07 114.93 120.86 2qeb h MET 113 Ca 0.21 -0.29 0.03 0.00 -0.28 0.00 0.00 59.70 59.38 2qeb h MET 113 Cb -0.01 -0.14 -0.03 0.00 -0.80 0.00 0.00 31.60 30.62 2qeb h MET 113 CO -0.08 1.01 0.12 1.49 0.23 0.00 0.00 176.91 179.68 2qeb h GLU 114 N 1.06 0.25 0.00 0.39 4.81 -1.03 -1.10 114.58 118.97 2qeb h GLU 114 Ca 0.22 -0.02 -0.16 0.00 -0.13 0.00 0.00 59.36 59.27 2qeb h GLU 114 Cb 0.41 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.71 2qeb h GLU 114 CO 0.01 0.17 -0.75 -0.07 -0.73 0.00 0.00 179.01 177.63 2qeb h LEU 115 N 0.26 0.00 -0.47 1.64 3.38 -1.30 -2.36 115.31 116.47 2qeb h LEU 115 Ca 0.14 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.99 2qeb h LEU 115 Cb 0.10 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 2qeb h LEU 115 CO -0.14 0.75 -0.17 0.11 0.09 0.00 0.00 178.44 179.09 2qeb h LYS 116 N 0.00 0.94 -0.10 1.13 1.57 -0.90 -0.13 116.57 119.08 2qeb h LYS 116 Ca -0.01 -0.39 -0.11 0.00 -1.87 0.00 0.00 60.65 58.27 2qeb h LYS 116 Cb 1.47 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 33.73 2qeb h LYS 116 CO 0.10 1.05 -0.45 0.87 -0.57 0.00 0.00 179.45 180.44 2qeb h LYS 117 N 0.78 0.23 -0.00 3.15 1.57 -1.20 -2.80 116.57 118.30 2qeb h LYS 117 Ca 0.11 -0.12 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 2qeb h LYS 117 Cb 0.74 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.05 2qeb h LYS 117 CO 0.06 0.64 -0.01 0.00 -0.57 0.00 0.00 179.45 179.56 2qeb n ALA 118 N -2.47 2.65 -1.18 3.86 0.00 -0.89 -4.90 120.51 117.58 2qeb n ALA 118 Ca -0.02 -0.22 -0.06 0.00 0.00 0.00 0.00 53.44 53.14 2qeb n ALA 118 Cb 0.51 -1.45 -0.03 0.00 0.00 0.00 0.00 19.45 18.48 2qeb n ALA 118 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qeb n GLY 119 N 1.11 0.85 0.17 0.00 0.00 -0.81 -4.90 105.19 101.60 2qeb n GLY 119 Ca 0.20 -0.54 0.09 0.00 0.00 0.00 0.00 46.02 45.78 2qeb n GLY 119 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2qeb h LYS 120 N 0.13 0.00 -4.10 1.61 1.79 -1.29 -3.46 116.57 111.24 2qeb h LYS 120 Ca -0.13 0.00 -0.14 0.00 -2.18 0.00 0.00 60.65 58.20 2qeb h LYS 120 Cb 0.49 0.00 -0.18 0.00 -1.58 0.00 0.00 32.23 30.96 2qeb h LYS 120 CO 0.19 0.11 -0.68 0.14 -1.08 0.00 0.00 179.45 178.12 2qeb s VAL 121 N -3.19 0.17 0.81 0.50 -7.23 -1.20 -5.02 120.40 105.24 2qeb s VAL 121 Ca 0.04 -1.36 -0.11 0.00 -1.81 0.00 0.00 61.98 58.73 2qeb s VAL 121 Cb 0.07 -0.91 0.08 0.00 0.56 0.00 0.00 36.38 36.18 2qeb s VAL 121 CO 0.73 -0.75 1.12 -2.16 -0.31 0.00 0.00 175.10 173.73 2qeb s PRO 122 N -2.72 1.86 0.59 4.82 0.04 -1.26 -4.51 135.00 133.82 2qeb s PRO 122 Ca -0.04 1.36 0.30 0.00 0.04 0.00 0.00 61.00 62.65 2qeb s PRO 122 Cb -0.01 -1.84 1.82 0.00 0.04 0.00 0.00 34.50 34.51 2qeb s PRO 122 CO -0.06 -1.97 2.25 1.96 0.04 0.00 0.00 177.00 179.22 2qeb h GLN 123 N -1.24 0.00 -0.32 4.56 1.08 -1.99 -1.54 115.11 115.66 2qeb h GLN 123 Ca -0.44 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.76 2qeb h GLN 123 Cb 1.25 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.68 2qeb h GLN 123 CO 0.48 0.00 0.00 -2.39 -0.95 0.00 0.00 178.83 175.97 2qeb n HIS 124 N -3.85 0.41 -1.60 2.96 1.44 -1.26 -4.97 115.22 108.35 2qeb n HIS 124 Ca -0.03 -0.20 -0.54 0.00 -2.01 0.00 0.00 57.72 54.94 2qeb n HIS 124 Cb 0.09 0.00 -0.07 0.00 0.12 0.00 0.00 29.99 30.13 2qeb n HIS 124 CO 0.00 0.00 0.00 0.94 -2.81 0.00 0.00 176.34 174.47 2qeb n GLN 125 N 0.96 0.95 -3.06 -1.40 -0.06 -0.58 -4.99 117.38 109.19 2qeb n GLN 125 Ca 0.18 0.34 -0.18 0.00 -2.00 0.00 0.00 57.00 55.34 2qeb n GLN 125 Cb 0.47 -1.97 0.01 0.00 -4.06 0.00 0.00 30.24 24.69 2qeb n GLN 125 CO 0.00 0.00 0.00 1.03 -0.20 0.00 0.00 177.06 177.89 2qeb s ARG 126 N 0.85 2.86 -1.10 3.69 0.52 -1.26 -5.03 118.95 119.48 2qeb s ARG 126 Ca 0.88 -1.15 -0.20 0.00 -0.52 0.00 0.00 55.73 54.73 2qeb s ARG 126 Cb -1.03 -2.75 0.07 0.00 0.52 0.00 0.00 34.95 31.77 2qeb s ARG 126 CO 0.51 -0.24 1.50 -0.47 0.02 0.00 0.00 175.30 176.62 2qeb s TYR 127 N -2.35 2.74 0.45 -0.53 5.04 -1.26 -4.76 117.35 116.68 2qeb s TYR 127 Ca 0.53 -1.22 0.07 0.00 -2.44 0.00 0.00 57.07 54.01 2qeb s TYR 127 Cb -0.10 -4.64 -0.02 0.00 0.35 0.00 0.00 41.96 37.55 2qeb s TYR 127 CO 0.33 -1.81 0.31 0.95 -1.34 0.00 0.00 175.55 173.99 2qeb s THR 128 N 4.26 2.22 0.20 4.34 -4.23 -1.26 -4.98 115.64 116.20 2qeb s THR 128 Ca 0.47 -1.52 -0.10 0.00 -1.18 0.00 0.00 61.69 59.35 2qeb s THR 128 Cb 0.00 -2.74 0.13 0.00 1.34 0.00 0.00 72.50 71.23 2qeb s THR 128 CO -0.04 0.00 1.77 0.00 -0.54 0.00 0.00 174.62 175.81 2qeb h ALA 129 N 1.10 0.78 -0.70 3.99 0.00 -2.00 -1.47 119.26 120.96 2qeb h ALA 129 Ca -0.41 0.05 0.03 0.00 0.00 0.00 0.00 54.91 54.58 2qeb h ALA 129 Cb 1.27 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 19.00 2qeb h ALA 129 CO 0.62 -0.11 0.44 1.49 0.00 0.00 0.00 179.25 181.69 2qeb h GLU 130 N 0.50 0.83 -0.66 0.00 4.81 -1.96 -2.44 114.58 115.66 2qeb h GLU 130 Ca 0.29 -0.05 0.01 0.00 -0.13 0.00 0.00 59.36 59.48 2qeb h GLU 130 Cb 0.28 -0.19 -0.04 0.00 0.63 0.00 0.00 28.75 29.43 2qeb h GLU 130 CO -0.24 0.55 0.43 0.35 -0.73 0.00 0.00 179.01 179.37 2qeb h PHE 131 N 0.86 0.80 -0.82 0.92 3.57 -1.63 0.66 116.94 121.30 2qeb h PHE 131 Ca 0.28 0.02 0.09 0.00 3.53 0.00 0.00 57.97 61.89 2qeb h PHE 131 Cb 0.02 -0.27 -0.07 0.00 2.79 0.00 0.00 35.95 38.41 2qeb h PHE 131 CO -0.04 0.49 0.48 0.28 -2.23 0.00 0.00 178.31 177.28 2qeb h VAL 132 N 0.86 0.92 -0.41 1.41 2.07 -0.93 -0.14 116.25 120.03 2qeb h VAL 132 Ca 0.25 -0.28 -0.15 0.00 0.82 0.00 0.00 66.70 67.34 2qeb h VAL 132 Cb -0.06 0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 29.75 2qeb h VAL 132 CO -0.07 0.15 -0.32 -0.61 0.02 0.00 0.00 177.57 176.73 2qeb h GLN 133 N 0.81 0.95 -0.56 1.57 5.75 -0.89 -1.42 115.11 121.31 2qeb h GLN 133 Ca 0.39 -0.47 0.05 0.00 -0.15 0.00 0.00 58.65 58.47 2qeb h GLN 133 Cb 0.34 0.00 -0.05 0.00 1.07 0.00 0.00 27.48 28.84 2qeb h GLN 133 CO -0.24 1.13 0.30 0.82 -2.65 0.00 0.00 178.83 178.19 2qeb h ILE 134 N 0.78 0.96 -0.36 2.39 2.04 -0.30 -1.02 117.51 122.01 2qeb h ILE 134 Ca 0.08 -0.19 -0.12 0.00 1.00 0.00 0.00 64.86 65.62 2qeb h ILE 134 Cb 0.92 0.34 -0.01 0.00 -0.74 0.00 0.00 36.82 37.33 2qeb h ILE 134 CO 0.09 0.10 -0.27 -0.03 0.00 0.00 0.00 178.15 178.03 2qeb h MET 135 N 0.57 0.75 -0.41 2.37 4.05 -0.83 -0.98 114.93 120.44 2qeb h MET 135 Ca 0.25 -0.32 0.02 0.00 -0.28 0.00 0.00 59.70 59.36 2qeb h MET 135 Cb 0.15 -0.02 -0.03 0.00 -0.80 0.00 0.00 31.60 30.90 2qeb h MET 135 CO -0.17 0.94 0.25 0.87 0.23 0.00 0.00 176.91 179.03 2qeb h LYS 136 N 0.64 0.49 -0.30 0.39 1.57 -0.89 -0.11 116.57 118.36 2qeb h LYS 136 Ca 0.08 -0.03 -0.07 0.00 -1.87 0.00 0.00 60.65 58.76 2qeb h LYS 136 Cb 0.79 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.97 2qeb h LYS 136 CO 0.07 0.32 -0.12 -0.44 -0.57 0.00 0.00 179.45 178.71 2qeb h ASP 137 N 0.50 0.49 -0.36 0.86 3.32 -1.02 -1.23 116.42 118.97 2qeb h ASP 137 Ca 0.16 -0.12 -0.04 0.00 0.02 0.00 0.00 57.03 57.04 2qeb h ASP 137 Cb -0.00 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.40 2qeb h ASP 137 CO -0.07 0.64 0.06 0.22 -1.72 0.00 0.00 179.24 178.37 2qeb h TYR 138 N 0.47 0.64 -0.16 4.55 3.20 -0.49 -2.66 116.97 122.51 2qeb h TYR 138 Ca 0.09 -0.09 -0.14 0.00 3.14 0.00 0.00 58.73 61.73 2qeb h TYR 138 Cb 0.49 -0.18 -0.01 0.00 1.54 0.00 0.00 36.73 38.57 2qeb h TYR 138 CO 0.02 0.66 -0.49 -0.44 -1.64 0.00 0.00 178.16 176.27 2qeb h ASP 139 N 0.44 0.46 -0.90 -2.11 3.32 -0.92 -3.02 116.42 113.69 2qeb h ASP 139 Ca 0.11 -0.23 0.05 0.00 0.02 0.00 0.00 57.03 56.99 2qeb h ASP 139 Cb 0.36 -0.13 -0.06 0.00 0.22 0.00 0.00 39.33 39.72 2qeb h ASP 139 CO 0.01 0.88 0.58 0.50 -1.72 0.00 0.00 179.24 179.48 2qeb h LYS 140 N 0.34 1.04 0.00 3.56 3.64 -1.03 0.28 116.57 124.41 2qeb h LYS 140 Ca 0.02 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 2qeb h LYS 140 Cb 0.98 -0.24 0.00 0.00 -0.41 0.00 0.00 32.23 32.56 2qeb h LYS 140 CO 0.09 0.69 0.00 0.00 -2.27 0.00 0.00 179.45 177.96 2qeb n ALA 141 N -2.35 1.67 0.63 5.00 0.00 -1.02 -1.14 120.51 123.30 2qeb n ALA 141 Ca 0.13 0.09 0.11 0.00 0.00 0.00 0.00 53.44 53.77 2qeb n ALA 141 Cb 0.15 -1.39 0.27 0.00 0.00 0.00 0.00 19.45 18.47 2qeb n ALA 141 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2qeb n LEU 142 N -2.25 2.82 -0.51 0.00 4.77 -0.39 -4.93 117.00 116.51 2qeb n LEU 142 Ca 0.02 -1.21 -0.06 0.00 -0.03 0.00 0.00 56.01 54.73 2qeb n LEU 142 Cb 0.23 -0.20 -0.02 0.00 -2.33 0.00 0.00 43.42 41.10 2qeb n LEU 142 CO 0.20 0.61 -0.06 -3.20 -1.33 0.00 0.00 177.39 173.61 2qeb n ASN 143 N 1.08 -3.19 -0.06 -1.43 5.15 -0.29 -5.04 115.26 111.48 2qeb n ASN 143 Ca 0.18 0.09 0.01 0.00 -0.60 0.00 0.00 54.58 54.26 2qeb n ASN 143 Cb 0.51 -1.69 0.01 0.00 -0.53 0.00 0.00 39.78 38.07 2qeb n ASN 143 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66