#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qb0 s ILE 16 N 0.00 4.68 -0.53 2.46 -4.36 -1.26 -5.01 121.20 117.18 2qb0 s ILE 16 Ca 0.00 1.92 -0.02 0.00 -0.26 0.00 0.00 60.65 62.29 2qb0 s ILE 16 Cb 0.00 -4.30 0.14 0.00 1.25 0.00 0.00 42.46 39.55 2qb0 s ILE 16 CO 0.00 -0.21 0.33 -0.13 0.24 0.00 0.00 174.94 175.17 2qb0 s ARG 17 N 3.22 2.28 0.41 0.37 1.81 -1.26 -5.10 118.95 120.69 2qb0 s ARG 17 Ca 0.43 -2.25 -0.01 0.00 -1.72 0.00 0.00 55.73 52.18 2qb0 s ARG 17 Cb -0.15 -3.64 -0.03 0.00 -0.45 0.00 0.00 34.95 30.69 2qb0 s ARG 17 CO 0.08 -1.13 0.65 -0.48 -0.68 0.00 0.00 175.30 173.74 2qb0 s LEU 18 N 0.40 3.81 0.28 2.53 2.34 -1.26 -5.03 118.68 121.74 2qb0 s LEU 18 Ca 0.13 0.56 -0.29 0.00 0.06 0.00 0.00 54.13 54.60 2qb0 s LEU 18 Cb -0.22 -3.45 -0.14 0.00 -0.56 0.00 0.00 46.19 41.82 2qb0 s LEU 18 CO -0.04 -0.48 1.11 -2.65 -1.06 0.00 0.00 176.35 173.23 2qb0 n PRO 19 N -2.00 1.49 -0.27 1.48 -0.02 -1.26 -4.82 135.00 129.60 2qb0 n PRO 19 Ca -0.02 0.53 0.09 0.00 -2.02 0.00 0.00 63.50 62.07 2qb0 n PRO 19 Cb 0.56 -1.97 0.22 0.00 -0.02 0.00 0.00 33.50 32.30 2qb0 n PRO 19 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2qb0 h ALA 20 N 2.46 1.04 0.00 3.55 0.00 -1.96 -0.26 119.26 124.09 2qb0 h ALA 20 Ca -0.41 0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.71 2qb0 h ALA 20 Cb 1.33 0.33 0.00 0.00 0.00 0.00 0.00 17.79 19.45 2qb0 h ALA 20 CO 0.64 -0.42 0.00 1.12 0.00 0.00 0.00 179.25 180.58 2qb0 h HIS 21 N 0.19 0.00 -0.13 0.00 2.07 -1.81 -1.42 115.15 114.04 2qb0 h HIS 21 Ca 0.48 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 58.00 2qb0 h HIS 21 Cb 0.89 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.87 2qb0 h HIS 21 CO -0.32 0.00 0.00 1.28 -3.07 0.00 0.00 177.93 175.82 2qb0 n LEU 22 N -3.06 2.00 0.17 6.12 4.77 -0.12 -3.96 117.00 122.93 2qb0 n LEU 22 Ca -0.00 -0.77 0.13 0.00 -0.03 0.00 0.00 56.01 55.34 2qb0 n LEU 22 Cb 0.23 -0.08 0.49 0.00 -2.33 0.00 0.00 43.42 41.74 2qb0 n LEU 22 CO 0.25 0.38 0.89 0.03 -1.33 0.00 0.00 177.39 177.61 2qb0 h ARG 23 N 2.85 0.00 -6.95 3.23 3.08 -1.18 -3.44 114.38 111.97 2qb0 h ARG 23 Ca 0.00 0.00 -0.53 0.00 0.07 0.00 0.00 59.98 59.52 2qb0 h ARG 23 Cb 0.62 0.00 0.09 0.00 0.08 0.00 0.00 29.97 30.76 2qb0 h ARG 23 CO 0.00 0.00 0.67 -0.51 -1.07 0.00 0.00 179.97 179.06 2qb0 s LEU 24 N -5.07 4.24 0.29 3.04 1.02 -1.25 -4.93 118.68 116.01 2qb0 s LEU 24 Ca 0.05 2.81 -0.29 0.00 0.02 0.00 0.00 54.13 56.71 2qb0 s LEU 24 Cb 0.09 -3.82 -0.13 0.00 0.02 0.00 0.00 46.19 42.35 2qb0 s LEU 24 CO 0.50 -0.89 1.26 0.00 0.02 0.00 0.00 176.35 177.24 2qb0 n GLN 25 N 0.22 1.89 -0.42 1.70 0.00 -1.26 -4.82 117.38 114.69 2qb0 n GLN 25 Ca 0.03 0.66 0.40 0.00 0.00 0.00 0.00 57.00 58.09 2qb0 n GLN 25 Cb 0.42 -2.22 0.76 0.00 0.00 0.00 0.00 30.24 29.20 2qb0 n GLN 25 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.06 175.71 2qb0 h PRO 26 N 2.93 0.00 -0.06 2.61 0.11 -1.92 -0.87 132.00 134.81 2qb0 h PRO 26 Ca -0.44 0.00 0.02 0.00 0.11 0.00 0.00 66.00 65.69 2qb0 h PRO 26 Cb 1.30 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.40 2qb0 h PRO 26 CO 0.66 0.00 0.10 0.97 -0.21 0.00 0.00 178.00 179.52 2qb0 h ILE 27 N 0.00 0.33 -0.00 4.15 2.10 -1.88 0.80 117.51 123.01 2qb0 h ILE 27 Ca 0.66 0.00 0.00 0.00 1.08 0.00 0.00 64.86 66.60 2qb0 h ILE 27 Cb 2.68 0.91 0.00 0.00 -1.09 0.00 0.00 36.82 39.33 2qb0 h ILE 27 CO -0.01 0.00 -0.45 -1.22 -1.08 0.00 0.00 178.15 175.39 2qb0 n TYR 28 N -3.56 0.00 -2.02 2.19 4.02 -0.33 -4.24 117.16 113.22 2qb0 n TYR 28 Ca -0.01 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.46 2qb0 n TYR 28 Cb 0.19 -0.19 -0.03 0.00 -0.02 0.00 0.00 39.34 39.29 2qb0 n TYR 28 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 176.86 174.27 2qb0 s TRP 29 N -2.84 3.08 0.78 -0.72 0.52 0.27 -4.93 118.94 115.11 2qb0 s TRP 29 Ca 0.15 0.88 -0.08 0.00 0.02 0.00 0.00 56.10 57.07 2qb0 s TRP 29 Cb 0.18 -3.83 0.12 0.00 -1.15 0.00 0.00 33.47 28.79 2qb0 s TRP 29 CO 0.65 -2.86 1.09 -1.54 0.02 0.00 0.00 176.95 174.32 2qb0 s SER 30 N 0.77 4.22 0.29 2.95 1.04 -1.26 -0.61 113.70 121.11 2qb0 s SER 30 Ca 0.64 0.18 -0.02 0.00 0.48 0.00 0.00 55.95 57.23 2qb0 s SER 30 Cb -0.41 -0.59 0.43 0.00 0.10 0.00 0.00 66.02 65.55 2qb0 s SER 30 CO 0.36 -1.98 1.96 -0.09 0.98 0.00 0.00 173.24 174.48 2qb0 h ARG 31 N -0.87 1.11 -0.23 4.02 2.43 -1.91 -1.93 114.38 117.00 2qb0 h ARG 31 Ca -0.42 -0.07 -0.09 0.00 -0.81 0.00 0.00 59.98 58.59 2qb0 h ARG 31 Cb 1.28 -0.25 -0.01 0.00 -0.42 0.00 0.00 29.97 30.57 2qb0 h ARG 31 CO 0.49 0.73 -0.24 -0.44 -1.51 0.00 0.00 179.97 179.00 2qb0 h ASP 32 N 1.14 0.43 -0.58 -3.80 3.45 -1.94 -2.92 116.42 112.20 2qb0 h ASP 32 Ca 0.31 -0.14 -0.01 0.00 0.43 0.00 0.00 57.03 57.63 2qb0 h ASP 32 Cb -0.12 -0.12 -0.03 0.00 -0.56 0.00 0.00 39.33 38.51 2qb0 h ASP 32 CO -0.07 0.67 0.33 0.44 -1.57 0.00 0.00 179.24 179.04 2qb0 h ASP 33 N 0.39 0.71 0.03 6.45 3.32 -1.72 -1.35 116.42 124.24 2qb0 h ASP 33 Ca 0.06 -0.08 -0.12 0.00 0.02 0.00 0.00 57.03 56.92 2qb0 h ASP 33 Cb 0.63 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.99 2qb0 h ASP 33 CO 0.04 0.58 -0.37 -0.37 -1.72 0.00 0.00 179.24 177.40 2qb0 h VAL 34 N 0.78 1.30 -0.55 -1.35 -1.51 -1.39 -0.32 116.25 113.20 2qb0 h VAL 34 Ca 0.21 -1.50 -0.04 0.00 -1.23 0.00 0.00 66.70 64.14 2qb0 h VAL 34 Cb 0.01 1.55 -0.03 0.00 -2.13 0.00 0.00 31.29 30.69 2qb0 h VAL 34 CO -0.04 0.47 0.16 0.00 -1.23 0.00 0.00 177.57 176.93 2qb0 h ALA 35 N 1.22 1.25 -0.10 5.19 0.00 -1.31 -0.27 119.26 125.24 2qb0 h ALA 35 Ca 0.04 -0.19 -0.19 0.00 0.00 0.00 0.00 54.91 54.58 2qb0 h ALA 35 Cb 0.83 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.39 2qb0 h ALA 35 CO 0.07 0.53 -0.71 1.96 0.00 0.00 0.00 179.25 181.09 2qb0 h GLN 36 N 0.81 0.47 -0.46 0.00 4.20 -0.82 -2.36 115.11 116.95 2qb0 h GLN 36 Ca 0.18 -0.37 -0.02 0.00 0.06 0.00 0.00 58.65 58.50 2qb0 h GLN 36 Cb 0.25 0.07 -0.02 0.00 0.30 0.00 0.00 27.48 28.08 2qb0 h GLN 36 CO -0.01 1.00 0.20 2.35 -0.67 0.00 0.00 178.83 181.71 2qb0 h TRP 37 N 0.33 0.68 -0.35 2.96 7.01 -0.68 -1.36 115.95 124.54 2qb0 h TRP 37 Ca -0.03 -0.04 0.03 0.00 2.11 0.00 0.00 58.89 60.96 2qb0 h TRP 37 Cb 1.29 -0.21 -0.03 0.00 -2.10 0.00 0.00 29.16 28.11 2qb0 h TRP 37 CO 0.05 0.56 0.14 -0.07 -2.79 0.00 0.00 178.44 176.33 2qb0 h LEU 38 N 0.60 0.17 -0.84 0.65 4.07 -1.02 0.12 115.31 119.05 2qb0 h LEU 38 Ca 0.16 0.03 -0.05 0.00 0.08 0.00 0.00 57.88 58.10 2qb0 h LEU 38 Cb 0.15 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 41.86 2qb0 h LEU 38 CO -0.02 0.14 0.26 0.50 -1.08 0.00 0.00 178.44 178.24 2qb0 h LYS 39 N 0.30 1.12 -0.21 1.13 3.64 -1.25 -1.56 116.57 119.72 2qb0 h LYS 39 Ca 0.15 -0.22 -0.06 0.00 -1.27 0.00 0.00 60.65 59.26 2qb0 h LYS 39 Cb 0.11 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 31.75 2qb0 h LYS 39 CO -0.14 0.93 -0.10 2.35 -2.27 0.00 0.00 179.45 180.22 2qb0 h TRP 40 N 1.08 0.51 -0.85 1.91 7.01 -1.01 -3.20 115.95 121.41 2qb0 h TRP 40 Ca 0.24 -0.13 -0.02 0.00 2.11 0.00 0.00 58.89 61.10 2qb0 h TRP 40 Cb 0.26 -0.12 -0.04 0.00 -2.10 0.00 0.00 29.16 27.16 2qb0 h TRP 40 CO 0.02 0.72 0.46 0.00 -2.79 0.00 0.00 178.44 176.86 2qb0 h ALA 41 N 0.71 1.08 -0.84 2.65 0.00 -0.56 -0.57 119.26 121.73 2qb0 h ALA 41 Ca 0.05 -0.13 0.07 0.00 0.00 0.00 0.00 54.91 54.90 2qb0 h ALA 41 Cb 0.59 -0.34 -0.06 0.00 0.00 0.00 0.00 17.79 17.98 2qb0 h ALA 41 CO 0.03 0.60 0.51 1.49 0.00 0.00 0.00 179.25 181.88 2qb0 h GLU 42 N 1.18 0.89 0.18 0.00 4.81 -1.34 -1.07 114.58 119.24 2qb0 h GLU 42 Ca 0.30 -0.05 -0.25 0.00 -0.13 0.00 0.00 59.36 59.22 2qb0 h GLU 42 Cb 0.03 -0.20 0.03 0.00 0.63 0.00 0.00 28.75 29.24 2qb0 h GLU 42 CO -0.05 0.59 -1.08 -0.97 -0.73 0.00 0.00 179.01 176.77 2qb0 h ASN 43 N 0.92 0.65 -0.56 1.04 -1.24 -1.47 -1.05 115.58 113.87 2qb0 h ASN 43 Ca 0.37 -0.92 -0.02 0.00 0.71 0.00 0.00 56.30 56.43 2qb0 h ASN 43 Cb 0.20 -0.21 -0.03 0.00 0.73 0.00 0.00 38.32 39.01 2qb0 h ASN 43 CO -0.18 1.52 0.27 -0.08 -1.29 0.00 0.00 177.43 177.67 2qb0 h GLU 44 N -0.12 0.85 -0.34 6.67 4.57 -0.99 -3.17 114.58 122.05 2qb0 h GLU 44 Ca -0.19 -0.11 0.00 0.00 -1.18 0.00 0.00 59.36 57.88 2qb0 h GLU 44 Cb 1.85 -0.16 0.00 0.00 -0.16 0.00 0.00 28.75 30.28 2qb0 h GLU 44 CO 0.20 0.67 0.00 1.19 -1.18 0.00 0.00 179.01 179.89 2qb0 n PHE 45 N -4.35 0.60 -3.95 0.92 3.72 -0.42 -4.99 117.46 109.00 2qb0 n PHE 45 Ca 0.05 -0.58 -0.27 0.00 -0.05 0.00 0.00 57.45 56.60 2qb0 n PHE 45 Cb 0.14 -0.09 -0.00 0.00 -0.94 0.00 0.00 39.48 38.58 2qb0 n PHE 45 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 2qb0 n SER 46 N 0.34 -1.71 -4.90 4.37 7.64 -0.94 -4.96 113.62 113.47 2qb0 n SER 46 Ca 0.14 -0.94 -0.28 0.00 1.01 0.00 0.00 58.87 58.80 2qb0 n SER 46 Cb 0.54 -3.32 0.01 0.00 -1.01 0.00 0.00 64.21 60.43 2qb0 n SER 46 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2qb0 s LEU 47 N -7.02 3.45 0.49 -3.43 1.43 -0.44 -5.05 118.68 108.11 2qb0 s LEU 47 Ca 0.24 0.99 -0.24 0.00 -1.03 0.00 0.00 54.13 54.10 2qb0 s LEU 47 Cb -0.13 -3.94 -0.07 0.00 0.03 0.00 0.00 46.19 42.09 2qb0 s LEU 47 CO 0.87 -0.75 1.37 -0.60 0.23 0.00 0.00 176.35 177.47 2qb0 s ARG 48 N -4.90 3.48 0.16 1.70 6.06 -1.26 -4.86 118.95 119.34 2qb0 s ARG 48 Ca 0.50 2.27 -0.33 0.00 -2.50 0.00 0.00 55.73 55.67 2qb0 s ARG 48 Cb -0.10 -2.48 -0.16 0.00 0.06 0.00 0.00 34.95 32.27 2qb0 s ARG 48 CO 0.47 -0.93 1.09 -2.30 -2.50 0.00 0.00 175.30 171.13 2qb0 n PRO 49 N -0.54 0.95 -3.69 5.12 -0.02 -1.26 -4.94 135.00 130.62 2qb0 n PRO 49 Ca 0.07 0.34 -0.38 0.00 -2.02 0.00 0.00 63.50 61.52 2qb0 n PRO 49 Cb 0.44 -1.79 -0.12 0.00 -0.02 0.00 0.00 33.50 32.01 2qb0 n PRO 49 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2qb0 s ILE 50 N -0.27 4.55 0.30 4.25 -1.09 -1.26 -5.07 121.20 122.61 2qb0 s ILE 50 Ca 0.74 -0.28 -0.30 0.00 -2.23 0.00 0.00 60.65 58.57 2qb0 s ILE 50 Cb -0.90 -3.24 -0.12 0.00 -1.58 0.00 0.00 42.46 36.62 2qb0 s ILE 50 CO 0.53 0.18 1.52 -0.67 -1.23 0.00 0.00 174.94 175.27 2qb0 n ASP 51 N 4.97 3.56 0.25 3.58 2.03 -1.26 -4.88 116.55 124.80 2qb0 n ASP 51 Ca -0.15 1.16 0.17 0.00 0.52 0.00 0.00 54.79 56.50 2qb0 n ASP 51 Cb 0.50 -1.56 0.80 0.00 -0.72 0.00 0.00 41.12 40.14 2qb0 n ASP 51 CO 0.00 0.00 0.00 0.77 -1.92 0.00 0.00 177.20 176.05 2qb0 h SER 52 N 4.24 0.00 -0.51 1.67 4.64 -1.97 -2.62 113.55 119.00 2qb0 h SER 52 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 2qb0 h SER 52 Cb 1.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 2qb0 h SER 52 CO 0.75 0.00 0.00 0.59 -0.87 0.00 0.00 176.83 177.30 2qb0 n ASN 53 N -2.79 2.76 -0.26 4.97 3.02 -1.26 -4.48 115.26 117.23 2qb0 n ASN 53 Ca -0.01 -1.99 -0.06 0.00 -0.03 0.00 0.00 54.58 52.49 2qb0 n ASN 53 Cb 0.18 -0.34 0.05 0.00 -0.61 0.00 0.00 39.78 39.06 2qb0 n ASN 53 CO 0.00 0.00 0.00 0.74 -2.62 0.00 0.00 177.26 175.38 2qb0 h THR 54 N 3.05 1.24 -2.45 3.41 2.02 -1.84 -3.33 112.91 115.01 2qb0 h THR 54 Ca 0.00 -0.71 -0.60 0.00 0.77 0.00 0.00 66.41 65.87 2qb0 h THR 54 Cb 0.70 0.38 -0.41 0.00 -1.74 0.00 0.00 68.15 67.08 2qb0 h THR 54 CO 0.00 0.29 -0.76 0.49 0.37 0.00 0.00 175.52 175.91 2qb0 n PHE 55 N -4.40 1.89 -1.90 3.16 3.72 -1.26 -4.97 117.46 113.70 2qb0 n PHE 55 Ca 0.06 -3.93 -0.40 0.00 -0.05 0.00 0.00 57.45 53.13 2qb0 n PHE 55 Cb 0.15 -0.38 -0.03 0.00 -0.94 0.00 0.00 39.48 38.28 2qb0 n PHE 55 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 2qb0 n GLU 56 N 1.65 2.39 -3.63 -1.08 1.02 -1.25 -4.79 120.64 114.94 2qb0 n GLU 56 Ca 0.25 -2.59 -0.04 0.00 -0.02 0.00 0.00 57.16 54.76 2qb0 n GLU 56 Cb 0.43 -3.35 -0.01 0.00 -0.02 0.00 0.00 31.44 28.48 2qb0 n GLU 56 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2qb0 s MET 57 N 4.55 0.81 0.51 3.49 0.23 -1.26 -5.13 119.30 122.50 2qb0 s MET 57 Ca 0.56 -0.39 -0.04 0.00 -1.03 0.00 0.00 55.69 54.78 2qb0 s MET 57 Cb 0.08 0.31 0.11 0.00 -1.53 0.00 0.00 34.83 33.80 2qb0 s MET 57 CO 0.05 -0.36 0.70 0.27 -2.03 0.00 0.00 175.02 173.65 2qb0 n ASN 58 N -0.36 0.50 -0.20 -1.18 0.23 -1.26 -4.18 115.26 108.80 2qb0 n ASN 58 Ca -0.06 -1.52 -0.07 0.00 -0.53 0.00 0.00 54.58 52.39 2qb0 n ASN 58 Cb 0.61 -0.49 0.03 0.00 -2.08 0.00 0.00 39.78 37.84 2qb0 n ASN 58 CO 0.00 0.00 0.00 1.23 -0.93 0.00 0.00 177.26 177.56 2qb0 h GLY 59 N -0.67 0.90 0.60 4.83 0.00 -1.02 -1.86 103.07 105.86 2qb0 h GLY 59 Ca -0.23 -0.47 0.10 0.00 0.00 0.00 0.00 47.33 46.73 2qb0 h GLY 59 CO 0.20 0.44 0.63 0.50 0.00 0.00 0.00 176.54 178.32 2qb0 h LYS 60 N 0.79 1.02 -0.09 4.80 1.57 -1.74 -1.52 116.57 121.40 2qb0 h LYS 60 Ca 0.20 -0.06 -0.21 0.00 -1.87 0.00 0.00 60.65 58.70 2qb0 h LYS 60 Cb 0.15 -0.23 0.00 0.00 0.08 0.00 0.00 32.23 32.24 2qb0 h LYS 60 CO -0.02 0.68 -0.79 0.00 -0.57 0.00 0.00 179.45 178.74 2qb0 h ALA 61 N 1.51 0.43 -0.40 3.86 0.00 -1.89 -3.19 119.26 119.58 2qb0 h ALA 61 Ca 0.46 -0.62 -0.03 0.00 0.00 0.00 0.00 54.91 54.72 2qb0 h ALA 61 Cb 0.36 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 2qb0 h ALA 61 CO -0.22 0.74 0.12 1.25 0.00 0.00 0.00 179.25 181.14 2qb0 h LEU 62 N 0.38 0.52 -0.18 0.00 7.12 -0.59 -2.05 115.31 120.51 2qb0 h LEU 62 Ca -0.05 -0.07 0.00 0.00 0.13 0.00 0.00 57.88 57.89 2qb0 h LEU 62 Cb 1.40 -0.13 0.00 0.00 -0.53 0.00 0.00 40.66 41.40 2qb0 h LEU 62 CO 0.15 0.51 0.00 0.18 -0.13 0.00 0.00 178.44 179.15 2qb0 n LEU 63 N -4.35 0.35 0.11 2.25 4.77 -0.64 -3.03 117.00 116.46 2qb0 n LEU 63 Ca 0.03 0.56 0.11 0.00 -0.03 0.00 0.00 56.01 56.67 2qb0 n LEU 63 Cb 0.17 -0.48 0.01 0.00 -2.33 0.00 0.00 43.42 40.79 2qb0 n LEU 63 CO 0.38 -0.25 0.06 -0.07 -1.33 0.00 0.00 177.39 176.18 2qb0 h LEU 64 N 0.00 0.00-10.09 2.23 3.38 -1.41 -3.48 115.31 105.94 2qb0 h LEU 64 Ca 0.00 0.00 -0.50 0.00 0.09 0.00 0.00 57.88 57.47 2qb0 h LEU 64 Cb 0.45 0.00 0.07 0.00 0.09 0.00 0.00 40.66 41.27 2qb0 h LEU 64 CO 0.00 0.04 0.43 -0.76 0.09 0.00 0.00 178.44 178.24 2qb0 s LEU 65 N -5.46 3.73 0.58 1.67 1.43 -1.17 -5.06 118.68 114.41 2qb0 s LEU 65 Ca -0.00 2.16 0.01 0.00 -1.03 0.00 0.00 54.13 55.26 2qb0 s LEU 65 Cb 0.09 -4.58 0.05 0.00 0.03 0.00 0.00 46.19 41.78 2qb0 s LEU 65 CO 0.78 -1.23 0.82 -0.89 0.23 0.00 0.00 176.35 176.07 2qb0 s THR 66 N -1.81 2.55 0.30 5.49 2.01 -1.26 -4.98 115.64 117.94 2qb0 s THR 66 Ca 0.72 -0.64 0.04 0.00 0.31 0.00 0.00 61.69 62.11 2qb0 s THR 66 Cb -0.23 -2.91 0.09 0.00 0.01 0.00 0.00 72.50 69.46 2qb0 s THR 66 CO 0.28 0.00 1.77 0.50 -0.69 0.00 0.00 174.62 176.48 2qb0 h LYS 67 N -0.05 0.47 -0.66 4.92 3.64 -1.97 -2.43 116.57 120.48 2qb0 h LYS 67 Ca -0.41 -0.15 -0.02 0.00 -1.27 0.00 0.00 60.65 58.80 2qb0 h LYS 67 Cb 1.29 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 33.04 2qb0 h LYS 67 CO 0.50 0.64 0.32 1.49 -2.27 0.00 0.00 179.45 180.13 2qb0 h GLU 68 N 0.42 0.94 -0.52 1.90 4.81 -1.98 -1.43 114.58 118.73 2qb0 h GLU 68 Ca 0.07 -0.12 -0.05 0.00 -0.13 0.00 0.00 59.36 59.13 2qb0 h GLU 68 Cb 0.57 -0.18 -0.02 0.00 0.63 0.00 0.00 28.75 29.75 2qb0 h GLU 68 CO 0.04 0.72 0.13 -0.44 -0.73 0.00 0.00 179.01 178.73 2qb0 h ASP 69 N 0.94 0.78 -0.29 1.04 3.32 -1.83 -1.14 116.42 119.24 2qb0 h ASP 69 Ca 0.23 -0.23 0.01 0.00 0.02 0.00 0.00 57.03 57.06 2qb0 h ASP 69 Cb 0.09 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.41 2qb0 h ASP 69 CO -0.03 0.81 0.18 -0.26 -1.72 0.00 0.00 179.24 178.22 2qb0 h PHE 70 N 0.72 0.34 -0.88 4.55 0.04 -1.14 -1.39 116.94 119.18 2qb0 h PHE 70 Ca 0.16 0.01 -0.02 0.00 2.80 0.00 0.00 57.97 60.93 2qb0 h PHE 70 Cb 0.33 -0.11 -0.04 0.00 2.20 0.00 0.00 35.95 38.33 2qb0 h PHE 70 CO 0.02 0.20 0.48 0.00 -0.60 0.00 0.00 178.31 178.42 2qb0 h ARG 71 N 0.37 1.22 -0.57 1.51 3.08 -1.11 0.23 114.38 119.11 2qb0 h ARG 71 Ca 0.11 -0.14 -0.10 0.00 0.07 0.00 0.00 59.98 59.92 2qb0 h ARG 71 Cb -0.02 -0.24 -0.02 0.00 0.08 0.00 0.00 29.97 29.77 2qb0 h ARG 71 CO -0.04 0.89 -0.04 -0.92 -1.07 0.00 0.00 179.97 178.79 2qb0 h TYR 72 N 1.23 1.12 0.00 3.04 5.03 -1.02 -1.99 116.97 124.38 2qb0 h TYR 72 Ca 0.31 -0.20 -0.21 0.00 2.58 0.00 0.00 58.73 61.20 2qb0 h TYR 72 Cb 0.02 -0.29 -0.03 0.00 1.55 0.00 0.00 36.73 37.98 2qb0 h TYR 72 CO 0.01 1.01 -1.04 0.00 -1.32 0.00 0.00 178.16 176.82 2qb0 h ARG 73 N 0.93 0.00 -2.65 1.82 3.08 -0.99 -3.40 114.38 113.17 2qb0 h ARG 73 Ca 0.16 0.00 -0.59 0.00 0.07 0.00 0.00 59.98 59.62 2qb0 h ARG 73 Cb 0.59 0.00 -0.39 0.00 0.08 0.00 0.00 29.97 30.25 2qb0 h ARG 73 CO 0.04 0.95 -0.84 0.45 -1.07 0.00 0.00 179.97 179.50 2qb0 s SER 74 N -6.66 2.81 0.55 7.04 0.15 0.78 -4.96 113.70 113.42 2qb0 s SER 74 Ca 0.01 -2.66 0.22 0.00 0.70 0.00 0.00 55.95 54.22 2qb0 s SER 74 Cb 0.10 -0.64 1.52 0.00 -1.71 0.00 0.00 66.02 65.28 2qb0 s SER 74 CO 0.82 -0.24 2.19 -0.65 1.20 0.00 0.00 173.24 176.56 2qb0 h PRO 75 N 6.44 0.00 0.02 5.44 0.11 -1.58 0.48 132.00 142.91 2qb0 h PRO 75 Ca 0.11 0.00 -0.29 0.00 0.11 0.00 0.00 66.00 65.93 2qb0 h PRO 75 Cb 0.93 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.00 2qb0 h PRO 75 CO 0.38 0.01 -1.63 0.45 -0.21 0.00 0.00 178.00 176.99 2qb0 h HIS 76 N 0.00 0.09 0.00 0.65 3.86 -1.94 -3.43 115.15 114.38 2qb0 h HIS 76 Ca -0.00 -0.07 0.00 0.00 -1.16 0.00 0.00 60.37 59.14 2qb0 h HIS 76 Cb 0.01 -0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.48 2qb0 h HIS 76 CO 0.00 1.12 0.00 0.43 0.86 0.00 0.00 177.93 180.34 2qb0 n SER 77 N -3.17 0.24 -0.27 2.45 7.64 -1.11 -4.90 113.62 114.51 2qb0 n SER 77 Ca -0.16 -0.61 0.06 0.00 1.01 0.00 0.00 58.87 59.16 2qb0 n SER 77 Cb 1.04 0.25 0.16 0.00 -1.01 0.00 0.00 64.21 64.65 2qb0 n SER 77 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 2qb0 h GLY 78 N 0.00 0.84 1.16 0.23 0.00 -0.21 -0.32 103.07 104.77 2qb0 h GLY 78 Ca 0.00 0.13 -0.07 0.00 0.00 0.00 0.00 47.33 47.39 2qb0 h GLY 78 CO 0.00 -0.31 0.12 1.29 0.00 0.00 0.00 176.54 177.64 2qb0 h ASP 79 N 0.08 0.98 -0.11 0.19 3.04 -1.84 -0.87 116.42 117.90 2qb0 h ASP 79 Ca 0.43 -0.22 -0.01 0.00 -3.24 0.00 0.00 57.03 53.99 2qb0 h ASP 79 Cb 0.75 -0.26 -0.00 0.00 -1.04 0.00 0.00 39.33 38.78 2qb0 h ASP 79 CO -0.71 0.97 0.03 0.58 -2.04 0.00 0.00 179.24 178.07 2qb0 h VAL 80 N 0.98 1.18 -0.79 4.15 2.07 -1.56 -1.44 116.25 120.83 2qb0 h VAL 80 Ca 0.20 -0.54 0.04 0.00 0.82 0.00 0.00 66.70 67.22 2qb0 h VAL 80 Cb 0.40 1.34 -0.05 0.00 -1.52 0.00 0.00 31.29 31.46 2qb0 h VAL 80 CO 0.01 0.16 0.50 -0.07 0.02 0.00 0.00 177.57 178.18 2qb0 h LEU 81 N -0.02 0.80 -0.20 2.57 -0.00 -0.94 0.98 115.31 118.50 2qb0 h LEU 81 Ca 0.03 0.01 -0.01 0.00 -0.00 0.00 0.00 57.88 57.90 2qb0 h LEU 81 Cb 0.22 -0.17 -0.01 0.00 -0.00 0.00 0.00 40.66 40.70 2qb0 h LEU 81 CO -0.00 0.54 0.07 0.22 -0.00 0.00 0.00 178.44 179.27 2qb0 h TYR 82 N 0.94 0.32 -0.28 1.13 5.03 -1.01 -1.36 116.97 121.75 2qb0 h TYR 82 Ca 0.33 -0.03 -0.10 0.00 2.58 0.00 0.00 58.73 61.51 2qb0 h TYR 82 Cb 0.07 -0.09 -0.01 0.00 1.55 0.00 0.00 36.73 38.25 2qb0 h TYR 82 CO -0.04 0.39 -0.23 0.93 -1.32 0.00 0.00 178.16 177.89 2qb0 h GLU 83 N 0.16 0.52 -0.21 1.82 4.39 -1.04 -1.30 114.58 118.93 2qb0 h GLU 83 Ca 0.07 -0.19 0.02 0.00 0.34 0.00 0.00 59.36 59.60 2qb0 h GLU 83 Cb 0.21 -0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 28.80 2qb0 h GLU 83 CO -0.00 0.72 0.05 1.25 -1.16 0.00 0.00 179.01 179.87 2qb0 h LEU 84 N 0.46 0.04 -0.81 1.33 6.46 -0.65 -1.06 115.31 121.09 2qb0 h LEU 84 Ca 0.07 0.03 0.02 0.00 -0.12 0.00 0.00 57.88 57.88 2qb0 h LEU 84 Cb 0.66 0.03 -0.05 0.00 -0.73 0.00 0.00 40.66 40.57 2qb0 h LEU 84 CO 0.05 0.05 0.52 0.25 -0.62 0.00 0.00 178.44 178.69 2qb0 h LEU 85 N 0.14 0.88 -0.86 2.25 5.85 -0.80 -1.32 115.31 121.44 2qb0 h LEU 85 Ca 0.09 -0.01 -0.05 0.00 0.84 0.00 0.00 57.88 58.76 2qb0 h LEU 85 Cb 0.08 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 40.87 2qb0 h LEU 85 CO -0.11 0.61 0.29 1.56 -0.34 0.00 0.00 178.44 180.45 2qb0 h GLN 86 N 1.03 1.13 -0.37 1.25 1.08 -0.76 -1.61 115.11 116.86 2qb0 h GLN 86 Ca 0.31 -0.20 -0.11 0.00 -1.45 0.00 0.00 58.65 57.20 2qb0 h GLN 86 Cb -0.03 -0.18 -0.01 0.00 -0.05 0.00 0.00 27.48 27.20 2qb0 h GLN 86 CO -0.10 0.92 -0.23 0.45 -0.95 0.00 0.00 178.83 178.92 2qb0 h HIS 87 N 1.10 0.83 -0.69 2.96 3.86 -0.77 -0.20 115.15 122.24 2qb0 h HIS 87 Ca 0.25 -0.19 -0.04 0.00 -1.16 0.00 0.00 60.37 59.24 2qb0 h HIS 87 Cb 0.22 -0.20 -0.03 0.00 1.06 0.00 0.00 27.41 28.46 2qb0 h HIS 87 CO 0.02 0.89 0.28 0.82 0.86 0.00 0.00 177.93 180.80 2qb0 h ILE 88 N 0.64 1.24 -0.12 2.45 2.04 -0.91 -2.03 117.51 120.82 2qb0 h ILE 88 Ca 0.09 -0.75 -0.15 0.00 1.00 0.00 0.00 64.86 65.05 2qb0 h ILE 88 Cb 0.73 0.45 -0.01 0.00 -0.74 0.00 0.00 36.82 37.25 2qb0 h ILE 88 CO 0.06 0.30 -0.56 -0.07 0.00 0.00 0.00 178.15 177.88 2qb0 h LEU 89 N 0.98 0.40 -0.21 1.44 3.38 -1.11 -2.47 115.31 117.71 2qb0 h LEU 89 Ca 0.23 -0.21 -0.09 0.00 0.09 0.00 0.00 57.88 57.89 2qb0 h LEU 89 Cb 0.20 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 40.83 2qb0 h LEU 89 CO -0.02 0.87 -0.24 0.50 0.09 0.00 0.00 178.44 179.65 2qb0 h LYS 90 N 0.27 0.53 -1.67 1.13 3.11 -0.79 -3.02 116.57 116.13 2qb0 h LYS 90 Ca 0.00 -0.29 -0.58 0.00 -2.81 0.00 0.00 60.65 56.97 2qb0 h LYS 90 Cb 1.06 0.01 -0.42 0.00 -1.00 0.00 0.00 32.23 31.89 2qb0 h LYS 90 CO 0.09 0.88 -0.73 0.00 -2.81 0.00 0.00 179.45 176.89 2qb0 n GLN 91 N -4.39 3.32 -1.54 1.90 -0.00 -0.78 -4.88 117.38 111.00 2qb0 n GLN 91 Ca -0.05 -4.55 -0.34 0.00 -0.00 0.00 0.00 57.00 52.06 2qb0 n GLN 91 Cb 0.43 -2.22 0.08 0.00 -0.00 0.00 0.00 30.24 28.53 2qb0 n GLN 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2qb0 s ALA 92 N -3.51 2.22 0.00 2.61 0.00 -0.93 -5.04 121.76 117.11 2qb0 s ALA 92 Ca 0.48 0.80 0.00 0.00 0.00 0.00 0.00 51.96 53.23 2qb0 s ALA 92 Cb 0.38 -3.43 0.00 0.00 0.00 0.00 0.00 23.12 20.07 2qb0 s ALA 92 CO -0.17 -1.69 0.00 0.41 0.00 0.00 0.00 175.76 174.31 2qb0 n GLY 93 N 0.16 0.92 3.71 0.00 0.00 -1.26 -5.06 105.19 103.66 2qb0 n GLY 93 Ca 0.13 -0.95 -0.40 0.00 0.00 0.00 0.00 46.02 44.79 2qb0 n GLY 93 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2qb0 n PRO 94 N 2.15 1.86 -3.21 1.61 -0.02 -1.26 -4.93 135.00 131.20 2qb0 n PRO 94 Ca 0.00 0.67 -0.45 0.00 -2.02 0.00 0.00 63.50 61.69 2qb0 n PRO 94 Cb 0.00 -2.42 -0.04 0.00 -0.02 0.00 0.00 33.50 31.02 2qb0 n PRO 94 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 2qb0 s ASN 95 N -0.63 6.26 0.00 2.55 2.47 -1.26 -4.73 114.94 119.59 2qb0 s ASN 95 Ca 0.63 -1.72 0.00 0.00 0.42 0.00 0.00 52.86 52.19 2qb0 s ASN 95 Cb -0.48 -2.26 0.00 0.00 -1.45 0.00 0.00 41.25 37.06 2qb0 s ASN 95 CO 0.56 -0.96 0.12 0.00 -3.72 0.00 0.00 177.10 173.11 2qb0 n ILE 96 N 5.27 0.00 0.16 -5.21 3.06 -1.26 -4.78 119.36 116.60 2qb0 n ILE 96 Ca -0.08 -0.15 -0.14 0.00 -2.50 0.00 0.00 62.75 59.88 2qb0 n ILE 96 Cb 0.42 1.60 -0.08 0.00 0.54 0.00 0.00 39.64 42.12 2qb0 n ILE 96 CO 0.00 0.00 0.00 0.15 -2.50 0.00 0.00 176.55 174.20 2qb0 h PHE 97 N 0.00 -0.36 -0.08 9.51 3.04 -1.99 -1.67 116.94 125.39 2qb0 h PHE 97 Ca 0.00 -0.01 -0.12 0.00 3.98 0.00 0.00 57.97 61.83 2qb0 h PHE 97 Cb 0.30 0.12 -0.01 0.00 2.56 0.00 0.00 35.95 38.92 2qb0 h PHE 97 CO 0.00 -0.09 -0.47 1.49 -2.02 0.00 0.00 178.31 177.22 2qb0 h GLU 98 N -0.60 0.19 0.06 1.11 4.81 -1.98 0.26 114.58 118.43 2qb0 h GLU 98 Ca -0.04 -0.10 0.02 0.00 -0.13 0.00 0.00 59.36 59.11 2qb0 h GLU 98 Cb 0.43 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.78 2qb0 h GLU 98 CO 0.06 0.63 -0.20 1.98 -0.73 0.00 0.00 179.01 180.75 2qb0 h MET 99 N 0.16 -0.34 0.00 1.92 4.05 -1.85 -0.88 114.93 117.99 2qb0 h MET 99 Ca 0.01 0.02 -0.06 0.00 -0.28 0.00 0.00 59.70 59.40 2qb0 h MET 99 Cb 0.89 0.08 -0.01 0.00 -0.80 0.00 0.00 31.60 31.76 2qb0 h MET 99 CO 0.07 -0.23 -0.27 -0.07 0.23 0.00 0.00 176.91 176.65 2qb0 h LEU 100 N -0.35 0.00 -0.24 3.39 3.38 -1.20 -1.85 115.31 118.44 2qb0 h LEU 100 Ca 0.04 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.01 2qb0 h LEU 100 Cb 0.40 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 2qb0 h LEU 100 CO -0.14 0.27 0.14 -0.09 0.09 0.00 0.00 178.44 178.70 2qb0 h ARG 101 N 0.00 0.33 -0.25 1.13 1.12 -0.64 0.43 114.38 116.50 2qb0 h ARG 101 Ca -0.00 -0.03 -0.06 0.00 -1.11 0.00 0.00 59.98 58.78 2qb0 h ARG 101 Cb 1.08 -0.07 -0.01 0.00 -0.01 0.00 0.00 29.97 30.97 2qb0 h ARG 101 CO 0.03 0.28 -0.07 0.82 -3.11 0.00 0.00 179.97 177.93 2qb0 h ILE 102 N 0.29 1.28 -0.08 1.20 2.04 -1.07 0.21 117.51 121.38 2qb0 h ILE 102 Ca 0.09 -1.08 -0.21 0.00 1.00 0.00 0.00 64.86 64.66 2qb0 h ILE 102 Cb 0.04 1.48 0.00 0.00 -0.74 0.00 0.00 36.82 37.60 2qb0 h ILE 102 CO -0.02 0.34 -0.80 0.44 0.00 0.00 0.00 178.15 178.11 2qb0 h ASP 103 N 0.23 0.65 0.00 1.72 3.32 -1.24 -3.37 116.42 117.74 2qb0 h ASP 103 Ca 0.06 -0.45 -0.28 0.00 0.02 0.00 0.00 57.03 56.38 2qb0 h ASP 103 Cb 0.53 -0.19 -0.05 0.00 0.22 0.00 0.00 39.33 39.84 2qb0 h ASP 103 CO 0.03 1.22 -2.07 -0.62 -1.72 0.00 0.00 179.24 176.08 2qb0 n GLU 104 N -3.85 1.43 0.00 3.56 -0.58 0.15 -5.07 120.64 116.29 2qb0 n GLU 104 Ca -0.06 -0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.68 2qb0 n GLU 104 Cb 0.75 -1.40 0.00 0.00 -0.57 0.00 0.00 31.44 30.22 2qb0 n GLU 104 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2qb0 n GLY 105 N 2.05 -0.05 3.06 0.62 0.00 0.75 -4.45 105.19 107.17 2qb0 n GLY 105 Ca -0.26 -1.74 -0.32 0.00 0.00 0.00 0.00 46.02 43.71 2qb0 n GLY 105 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2qb0 s LEU 106 N -2.04 2.26 -0.06 0.99 0.20 -1.26 -4.03 118.68 114.74 2qb0 s LEU 106 Ca 0.00 -0.79 0.03 0.00 0.69 0.00 0.00 54.13 54.07 2qb0 s LEU 106 Cb 0.00 -1.36 0.01 0.00 -0.43 0.00 0.00 46.19 44.40 2qb0 s LEU 106 CO 0.00 -0.08 -0.15 -0.13 -0.29 0.00 0.00 176.35 175.70 2qb0 s ARG 107 N 1.33 1.90 0.18 1.98 1.81 -0.77 -4.99 118.95 120.39 2qb0 s ARG 107 Ca 0.01 -0.53 0.23 0.00 -1.72 0.00 0.00 55.73 53.72 2qb0 s ARG 107 Cb -0.15 -1.56 0.02 0.00 -0.45 0.00 0.00 34.95 32.81 2qb0 s ARG 107 CO -0.10 0.12 1.05 1.28 -0.68 0.00 0.00 175.30 176.97 2qb0 n LEU 108 N 3.55 0.80 -4.27 2.53 7.99 -1.26 -0.67 117.00 125.67 2qb0 n LEU 108 Ca -0.21 0.29 -0.28 0.00 -0.01 0.00 0.00 56.01 55.80 2qb0 n LEU 108 Cb 0.52 -0.07 -0.15 0.00 -0.11 0.00 0.00 43.42 43.61 2qb0 n LEU 108 CO 0.26 -0.16 -0.54 -0.75 -1.51 0.00 0.00 177.39 174.68 2qb0 s LYS 109 N -3.34 1.74 0.08 3.23 2.47 -1.26 -1.49 119.74 121.16 2qb0 s LYS 109 Ca 0.00 -0.91 -0.36 0.00 -1.56 0.00 0.00 55.97 53.15 2qb0 s LYS 109 Cb 0.10 -1.77 -0.18 0.00 -1.46 0.00 0.00 37.83 34.52 2qb0 s LYS 109 CO 0.79 0.47 0.93 -0.89 0.16 0.00 0.00 175.35 176.81 2qb0 n ILE 110 N 2.21 0.69 -4.15 5.43 -0.00 -1.12 -4.84 119.36 117.58 2qb0 n ILE 110 Ca -0.16 -0.17 -0.13 0.00 -0.00 0.00 0.00 62.75 62.29 2qb0 n ILE 110 Cb 0.52 -0.13 -0.08 0.00 -0.00 0.00 0.00 39.64 39.95 2qb0 n ILE 110 CO 0.00 0.00 0.00 -0.72 -0.00 0.00 0.00 176.55 175.83 2qb0 s TYR 111 N -0.29 1.06 -0.14 1.39 1.13 -0.29 -4.98 117.35 115.24 2qb0 s TYR 111 Ca 0.81 -1.26 -0.05 0.00 -1.41 0.00 0.00 57.07 55.16 2qb0 s TYR 111 Cb -1.11 -0.33 -0.04 0.00 -1.10 0.00 0.00 41.96 39.39 2qb0 s TYR 111 CO 0.56 -0.85 0.03 0.15 -2.51 0.00 0.00 175.55 172.93 2qb0 s LYS 112 N -3.80 3.51 0.00 -3.49 1.02 -1.26 -0.51 119.74 115.21 2qb0 s LYS 112 Ca 0.34 -0.38 0.00 0.00 0.02 0.00 0.00 55.97 55.95 2qb0 s LYS 112 Cb 0.03 -3.01 0.00 0.00 -0.52 0.00 0.00 37.83 34.34 2qb0 s LYS 112 CO 0.16 0.48 0.00 -0.40 -0.92 0.00 0.00 175.35 174.66 2qb0 n ASP 113 N 2.87 -0.19 0.20 2.83 5.75 -1.05 -4.92 116.55 122.03 2qb0 n ASP 113 Ca -0.18 -0.72 0.04 0.00 -0.01 0.00 0.00 54.79 53.93 2qb0 n ASP 113 Cb 0.53 0.00 0.44 0.00 -1.03 0.00 0.00 41.12 41.06 2qb0 n ASP 113 CO 0.00 0.00 0.00 0.71 -0.11 0.00 0.00 177.20 177.80 2qb0 h THR 114 N -0.93 1.18 0.14 2.12 1.35 -2.00 -3.27 112.91 111.51 2qb0 h THR 114 Ca 0.00 -0.86 -0.01 0.00 -0.55 0.00 0.00 66.41 65.00 2qb0 h THR 114 Cb 0.00 1.44 0.00 0.00 -1.73 0.00 0.00 68.15 67.86 2qb0 h THR 114 CO 0.00 0.25 -0.07 -0.33 -0.25 0.00 0.00 175.52 175.12 2qb0 h GLU 115 N 0.02 -0.18 0.00 4.72 4.39 -2.04 -3.48 114.58 118.01 2qb0 h GLU 115 Ca 0.00 0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.71 2qb0 h GLU 115 Cb 0.44 0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.13 2qb0 h GLU 115 CO 0.03 -0.12 0.00 0.41 -1.16 0.00 0.00 179.01 178.17 2qb0 n GLY 116 N 0.84 -0.60 3.82 -3.84 0.00 -1.23 -5.15 105.19 99.02 2qb0 n GLY 116 Ca -0.02 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.62 2qb0 n GLY 116 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2qb0 s TYR 117 N 0.00 3.75 0.06 1.61 2.02 -1.26 -4.79 117.35 118.74 2qb0 s TYR 117 Ca 0.00 1.22 -0.31 0.00 -0.37 0.00 0.00 57.07 57.62 2qb0 s TYR 117 Cb 0.00 -2.47 -0.07 0.00 -0.40 0.00 0.00 41.96 39.02 2qb0 s TYR 117 CO 0.00 0.54 1.45 0.71 -1.57 0.00 0.00 175.55 176.68 2qb0 s TYR 118 N -1.22 2.92 0.10 2.71 2.02 -1.23 -2.54 117.35 120.11 2qb0 s TYR 118 Ca 0.32 0.77 0.03 0.00 -0.37 0.00 0.00 57.07 57.82 2qb0 s TYR 118 Cb -0.18 -3.74 -0.04 0.00 -0.40 0.00 0.00 41.96 37.60 2qb0 s TYR 118 CO 0.19 -2.73 -0.09 0.99 -1.57 0.00 0.00 175.55 172.34 2qb0 s THR 119 N 1.92 0.88 0.18 -0.71 2.01 0.33 -1.87 115.64 118.38 2qb0 s THR 119 Ca 0.66 -1.67 -0.12 0.00 0.31 0.00 0.00 61.69 60.87 2qb0 s THR 119 Cb -0.35 -1.39 0.00 0.00 0.01 0.00 0.00 72.50 70.77 2qb0 s THR 119 CO 0.29 -0.61 0.37 -0.51 -0.69 0.00 0.00 174.62 173.47 2qb0 s ILE 120 N -2.62 0.05 0.00 1.82 2.07 -1.03 -1.13 121.20 120.36 2qb0 s ILE 120 Ca 0.06 -1.19 0.00 0.00 -1.41 0.00 0.00 60.65 58.11 2qb0 s ILE 120 Cb -0.02 -1.78 0.00 0.00 0.13 0.00 0.00 42.46 40.79 2qb0 s ILE 120 CO -0.01 -0.22 0.00 0.61 -1.91 0.00 0.00 174.94 173.41 2qb0 n GLY 121 N -0.27 2.77 3.32 1.50 0.00 0.16 -1.93 105.19 110.74 2qb0 n GLY 121 Ca -0.08 -0.30 -0.45 0.00 0.00 0.00 0.00 46.02 45.19 2qb0 n GLY 121 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qb0 s ILE 122 N 0.00 5.82 -1.46 -0.61 1.01 -1.26 -1.84 121.20 122.86 2qb0 s ILE 122 Ca 0.00 -3.25 -0.08 0.00 0.00 0.00 0.00 60.65 57.33 2qb0 s ILE 122 Cb 0.00 -4.52 0.04 0.00 0.01 0.00 0.00 42.46 37.99 2qb0 s ILE 122 CO 0.00 -1.14 0.70 0.61 0.00 0.00 0.00 174.94 175.10 2qb0 n GLY 123 N 2.96 -0.51 3.58 6.18 0.00 -1.25 -4.92 105.19 111.23 2qb0 n GLY 123 Ca 0.21 0.14 -0.42 0.00 0.00 0.00 0.00 46.02 45.96 2qb0 n GLY 123 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2qb0 s HIS 124 N -3.14 3.12 0.07 1.61 5.04 -0.81 -4.96 115.29 116.22 2qb0 s HIS 124 Ca 0.42 0.48 -0.31 0.00 -1.54 0.00 0.00 55.06 54.11 2qb0 s HIS 124 Cb -0.20 -3.32 -0.06 0.00 0.04 0.00 0.00 32.58 29.04 2qb0 s HIS 124 CO 0.52 -0.70 1.31 -1.17 -2.34 0.00 0.00 174.74 172.35 2qb0 s LEU 125 N 2.97 4.36 -0.21 8.88 2.96 -1.26 -2.46 118.68 133.91 2qb0 s LEU 125 Ca 0.29 2.14 -0.17 0.00 -0.22 0.00 0.00 54.13 56.17 2qb0 s LEU 125 Cb -0.14 -3.58 -0.13 0.00 0.50 0.00 0.00 46.19 42.84 2qb0 s LEU 125 CO 0.16 -0.59 -0.05 0.18 -1.32 0.00 0.00 176.35 174.74 2qb0 n LEU 126 N 4.24 1.88 -3.53 -0.68 4.77 -0.78 -5.01 117.00 117.89 2qb0 n LEU 126 Ca 0.11 0.43 -0.07 0.00 -0.03 0.00 0.00 56.01 56.45 2qb0 n LEU 126 Cb 0.44 -0.89 -0.02 0.00 -2.33 0.00 0.00 43.42 40.62 2qb0 n LEU 126 CO 0.57 0.16 0.73 0.28 -1.33 0.00 0.00 177.39 177.81 2qb0 s THR 127 N -2.42 0.00 -2.11 -5.08 -1.32 -1.25 -4.83 115.64 98.63 2qb0 s THR 127 Ca -0.29 -0.05 0.17 0.00 -1.21 0.00 0.00 61.69 60.31 2qb0 s THR 127 Cb 0.07 -1.08 0.42 0.00 -1.51 0.00 0.00 72.50 70.40 2qb0 s THR 127 CO 0.48 0.00 1.39 0.29 -2.21 0.00 0.00 174.62 174.58 2qb0 n LYS 128 N -0.25 2.05 -2.44 7.08 5.02 -1.26 -3.54 118.16 124.83 2qb0 n LYS 128 Ca -0.08 -1.62 -0.41 0.00 -2.02 0.00 0.00 58.31 54.19 2qb0 n LYS 128 Cb 0.61 -1.38 -0.04 0.00 -0.02 0.00 0.00 35.03 34.20 2qb0 n LYS 128 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2qb0 s SER 129 N -1.17 7.19 0.00 4.39 0.15 -1.26 -4.95 113.70 118.04 2qb0 s SER 129 Ca 0.32 2.23 0.00 0.00 0.70 0.00 0.00 55.95 59.20 2qb0 s SER 129 Cb 0.17 -2.62 0.00 0.00 -1.71 0.00 0.00 66.02 61.87 2qb0 s SER 129 CO 0.23 -0.26 0.00 -0.81 1.20 0.00 0.00 173.24 173.61 2qb0 n PRO 130 N 1.91 3.13 -0.06 5.44 -0.04 -1.26 -4.65 135.00 139.48 2qb0 n PRO 130 Ca 0.02 0.00 0.01 0.00 -0.04 0.00 0.00 63.50 63.48 2qb0 n PRO 130 Cb 0.45 0.00 -0.00 0.00 -0.04 0.00 0.00 33.50 33.91 2qb0 n PRO 130 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2qb0 n SER 131 N 0.00 -0.55 -0.72 3.54 2.88 -1.26 -4.68 113.62 112.82 2qb0 n SER 131 Ca 0.00 0.06 0.06 0.00 -1.33 0.00 0.00 58.87 57.66 2qb0 n SER 131 Cb 0.00 -0.40 0.16 0.00 -0.75 0.00 0.00 64.21 63.22 2qb0 n SER 131 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2qb0 n LEU 132 N 0.00 2.22 -2.36 2.46 -0.00 -1.26 -4.84 117.00 113.22 2qb0 n LEU 132 Ca 0.00 -3.32 -0.35 0.00 -0.00 0.00 0.00 56.01 52.34 2qb0 n LEU 132 Cb 0.03 -0.39 0.07 0.00 -0.00 0.00 0.00 43.42 43.13 2qb0 n LEU 132 CO 0.00 1.10 1.39 0.59 -0.00 0.00 0.00 177.39 180.48 2qb0 n ASN 133 N -0.78 7.54 -3.14 1.45 5.03 -1.26 -4.94 115.26 119.16 2qb0 n ASN 133 Ca 0.15 -3.79 -0.18 0.00 0.87 0.00 0.00 54.58 51.64 2qb0 n ASN 133 Cb 0.78 -0.95 0.02 0.00 -1.02 0.00 0.00 39.78 38.61 2qb0 n ASN 133 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2qb0 n ALA 134 N -0.88 -2.64 -3.13 5.41 0.00 -1.26 -4.98 120.51 113.03 2qb0 n ALA 134 Ca 0.61 0.57 -0.06 0.00 0.00 0.00 0.00 53.44 54.56 2qb0 n ALA 134 Cb 0.64 -2.28 0.00 0.00 0.00 0.00 0.00 19.45 17.82 2qb0 n ALA 134 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qb0 n ALA 135 N 0.15 -2.64 -0.07 0.00 0.00 -1.26 -4.10 120.51 112.60 2qb0 n ALA 135 Ca 0.00 0.22 -0.22 0.00 0.00 0.00 0.00 53.44 53.44 2qb0 n ALA 135 Cb 0.49 -1.89 -0.12 0.00 0.00 0.00 0.00 19.45 17.93 2qb0 n ALA 135 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2qb0 h LYS 136 N 0.74 0.09 0.00 0.00 1.79 -1.93 -3.48 116.57 113.77 2qb0 h LYS 136 Ca -0.11 -0.15 -0.01 0.00 -2.18 0.00 0.00 60.65 58.21 2qb0 h LYS 136 Cb 1.07 0.05 -0.00 0.00 -1.58 0.00 0.00 32.23 31.77 2qb0 h LYS 136 CO 0.29 1.07 -1.28 0.45 -1.08 0.00 0.00 179.45 178.90 2qb0 n SER 137 N -4.16 0.64 -4.80 0.86 2.88 -1.26 -5.03 113.62 102.75 2qb0 n SER 137 Ca -0.31 0.25 -0.34 0.00 -1.33 0.00 0.00 58.87 57.14 2qb0 n SER 137 Cb 0.79 0.82 -0.02 0.00 -0.75 0.00 0.00 64.21 65.06 2qb0 n SER 137 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 2qb0 s GLU 138 N -3.38 3.61 -0.07 -1.46 8.01 -1.26 -4.48 118.70 119.68 2qb0 s GLU 138 Ca -0.03 1.33 0.04 0.00 0.01 0.00 0.00 54.97 56.33 2qb0 s GLU 138 Cb 0.11 -2.07 -0.02 0.00 -4.31 0.00 0.00 34.13 27.84 2qb0 s GLU 138 CO 0.82 -0.58 -0.18 -0.51 0.01 0.00 0.00 175.26 174.82 2qb0 s LEU 139 N -3.83 2.48 -0.86 1.80 1.43 -1.26 -4.87 118.68 113.58 2qb0 s LEU 139 Ca 0.67 -0.34 -0.04 0.00 -1.03 0.00 0.00 54.13 53.39 2qb0 s LEU 139 Cb -0.17 -1.50 -0.01 0.00 0.03 0.00 0.00 46.19 44.54 2qb0 s LEU 139 CO 0.26 0.28 0.73 -0.67 0.23 0.00 0.00 176.35 177.18 2qb0 n ASP 140 N 2.76 -6.77 -2.58 2.29 -0.08 -1.26 -4.62 116.55 106.29 2qb0 n ASP 140 Ca -0.17 -0.46 -0.01 0.00 -1.51 0.00 0.00 54.79 52.63 2qb0 n ASP 140 Cb 0.52 -4.40 -0.01 0.00 2.34 0.00 0.00 41.12 39.57 2qb0 n ASP 140 CO 0.00 0.00 0.00 2.29 0.12 0.00 0.00 177.20 179.61 2qb0 n LYS 141 N -2.50 -3.51 0.00 -0.67 2.85 -1.26 -4.66 118.16 108.41 2qb0 n LYS 141 Ca -0.08 2.79 0.00 0.00 -1.05 0.00 0.00 58.31 59.97 2qb0 n LYS 141 Cb 0.57 -4.96 0.00 0.00 -0.65 0.00 0.00 35.03 29.98 2qb0 n LYS 141 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2qb0 n ALA 142 N 0.90 0.00 0.00 0.58 0.00 -1.26 -5.02 120.51 115.71 2qb0 n ALA 142 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.33 2qb0 n ALA 142 Cb 0.17 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.62 2qb0 n ALA 142 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 2qb0 n ILE 143 N 0.00 0.00 0.00 0.00 -6.64 -1.26 -4.82 119.36 106.63 2qb0 n ILE 143 Ca 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 62.75 60.98 2qb0 n ILE 143 Cb 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 39.64 38.20 2qb0 n ILE 143 CO 0.00 0.00 0.00 0.61 -1.77 0.00 0.00 176.55 175.39 2qb0 n GLY 144 N 0.00 4.18 1.07 3.28 0.00 -1.26 -5.02 105.19 107.45 2qb0 n GLY 144 Ca 0.00 -1.11 0.00 0.00 0.00 0.00 0.00 46.02 44.91 2qb0 n GLY 144 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2qb0 n ARG 145 N -0.47 -2.81 -2.69 1.61 -4.01 -1.26 -4.04 116.66 102.99 2qb0 n ARG 145 Ca 0.00 2.18 -0.42 0.00 -1.04 0.00 0.00 57.85 58.57 2qb0 n ARG 145 Cb 0.00 -2.73 -0.03 0.00 -3.04 0.00 0.00 32.46 26.66 2qb0 n ARG 145 CO 0.00 0.00 0.00 1.21 -3.04 0.00 0.00 177.63 175.80 2qb0 s ASN 146 N -4.64 6.42 0.26 2.89 3.04 -1.26 -4.09 114.94 117.56 2qb0 s ASN 146 Ca 0.00 -1.34 0.11 0.00 0.04 0.00 0.00 52.86 51.67 2qb0 s ASN 146 Cb 0.00 -2.50 0.32 0.00 -1.54 0.00 0.00 41.25 37.52 2qb0 s ASN 146 CO 0.00 -1.45 1.58 0.71 -3.04 0.00 0.00 177.10 174.90 2qb0 h THR 147 N 6.30 1.43 -3.79 -5.21 1.35 -1.96 -3.47 112.91 107.55 2qb0 h THR 147 Ca 0.03 -2.22 -0.39 0.00 -0.55 0.00 0.00 66.41 63.28 2qb0 h THR 147 Cb 1.03 2.21 0.00 0.00 -1.73 0.00 0.00 68.15 69.66 2qb0 h THR 147 CO 1.29 0.63 -0.53 -3.20 -0.25 0.00 0.00 175.52 173.45 2qb0 n ASN 148 N -3.73 -5.58 0.00 5.36 4.05 -1.26 -2.45 115.26 111.65 2qb0 n ASN 148 Ca -0.01 -0.11 0.00 0.00 0.45 0.00 0.00 54.58 54.91 2qb0 n ASN 148 Cb 0.64 -4.60 0.00 0.00 1.23 0.00 0.00 39.78 37.05 2qb0 n ASN 148 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2qb0 n GLY 149 N -1.17 0.53 3.19 8.20 0.00 -1.26 -5.07 105.19 109.61 2qb0 n GLY 149 Ca -0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.54 2qb0 n GLY 149 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qb0 s VAL 150 N -2.15 1.92 0.38 1.61 1.01 -1.02 -2.79 120.40 119.34 2qb0 s VAL 150 Ca 0.00 -0.93 0.08 0.00 0.00 0.00 0.00 61.98 61.13 2qb0 s VAL 150 Cb 0.00 -1.67 -0.07 0.00 0.00 0.00 0.00 36.38 34.64 2qb0 s VAL 150 CO 0.00 0.53 -0.03 0.27 0.00 0.00 0.00 175.10 175.86 2qb0 s ILE 151 N 0.43 2.16 0.77 2.22 -4.36 -0.55 -4.70 121.20 117.16 2qb0 s ILE 151 Ca -0.17 -2.09 -0.05 0.00 -0.26 0.00 0.00 60.65 58.08 2qb0 s ILE 151 Cb -0.17 -2.82 0.16 0.00 1.25 0.00 0.00 42.46 40.88 2qb0 s ILE 151 CO 0.07 -0.11 1.06 0.35 0.24 0.00 0.00 174.94 176.56 2qb0 n THR 152 N -0.89 0.00 -0.08 8.37 -2.24 -1.26 -4.82 114.28 113.36 2qb0 n THR 152 Ca -0.05 -1.36 -0.15 0.00 -2.27 0.00 0.00 64.05 60.23 2qb0 n THR 152 Cb 0.65 -1.09 -0.04 0.00 -2.10 0.00 0.00 70.33 67.75 2qb0 n THR 152 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 2qb0 h LYS 153 N 0.00 0.88 -0.44 -0.78 3.64 -1.99 -2.34 116.57 115.54 2qb0 h LYS 153 Ca -0.35 -0.55 -0.09 0.00 -1.27 0.00 0.00 60.65 58.39 2qb0 h LYS 153 Cb 1.17 0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 33.03 2qb0 h LYS 153 CO 0.33 1.19 -0.09 -0.44 -2.27 0.00 0.00 179.45 178.16 2qb0 h ASP 154 N 0.67 0.76 0.91 4.20 5.19 -1.96 -1.10 116.42 125.08 2qb0 h ASP 154 Ca 0.02 -0.22 -0.16 0.00 -0.62 0.00 0.00 57.03 56.05 2qb0 h ASP 154 Cb 1.13 -0.20 -0.02 0.00 0.18 0.00 0.00 39.33 40.41 2qb0 h ASP 154 CO 0.12 0.88 -0.76 -0.33 -3.12 0.00 0.00 179.24 176.03 2qb0 h GLU 155 N 0.71 0.00 -0.19 3.56 5.08 -1.92 -0.57 114.58 121.26 2qb0 h GLU 155 Ca 0.12 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.32 2qb0 h GLU 155 Cb 0.56 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.81 2qb0 h GLU 155 CO 0.03 0.76 -0.55 0.00 -1.00 0.00 0.00 179.01 178.26 2qb0 h ALA 156 N 1.24 0.70 -0.23 3.43 0.00 -1.30 -1.88 119.26 121.22 2qb0 h ALA 156 Ca -0.01 -0.51 -0.13 0.00 0.00 0.00 0.00 54.91 54.26 2qb0 h ALA 156 Cb 1.42 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.12 2qb0 h ALA 156 CO 0.10 0.69 -0.40 0.93 0.00 0.00 0.00 179.25 180.57 2qb0 h GLU 157 N 0.43 0.52 0.10 0.00 5.08 -1.08 -1.05 114.58 118.57 2qb0 h GLU 157 Ca 0.01 -0.26 -0.00 0.00 -1.00 0.00 0.00 59.36 58.11 2qb0 h GLU 157 Cb 1.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.34 2qb0 h GLU 157 CO 0.10 0.83 -0.05 -0.22 -1.00 0.00 0.00 179.01 178.68 2qb0 h LYS 158 N 0.43 -0.12 -0.83 2.33 3.64 -0.97 -1.07 116.57 119.98 2qb0 h LYS 158 Ca 0.04 0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.42 2qb0 h LYS 158 Cb 0.88 0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 32.69 2qb0 h LYS 158 CO 0.07 0.06 0.50 -0.07 -2.27 0.00 0.00 179.45 177.75 2qb0 h LEU 159 N -0.29 0.99 -0.29 5.20 3.38 -1.30 -1.27 115.31 121.73 2qb0 h LEU 159 Ca -0.01 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.89 2qb0 h LEU 159 Cb 0.24 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 2qb0 h LEU 159 CO 0.02 0.76 0.18 0.15 0.09 0.00 0.00 178.44 179.64 2qb0 h PHE 160 N 1.13 0.38 -0.47 1.13 3.57 -1.08 -0.86 116.94 120.74 2qb0 h PHE 160 Ca 0.30 0.00 -0.10 0.00 3.53 0.00 0.00 57.97 61.70 2qb0 h PHE 160 Cb -0.05 -0.12 -0.02 0.00 2.79 0.00 0.00 35.95 38.55 2qb0 h PHE 160 CO -0.00 0.26 -0.12 0.00 -2.23 0.00 0.00 178.31 176.22 2qb0 h GLN 162 N 0.78 0.18 0.02 0.00 4.20 -1.02 -0.48 115.11 118.80 2qb0 h GLN 162 Ca 0.13 -0.04 -0.24 0.00 0.06 0.00 0.00 58.65 58.55 2qb0 h GLN 162 Cb 0.64 -0.02 0.02 0.00 0.30 0.00 0.00 27.48 28.42 2qb0 h GLN 162 CO 0.04 0.34 -0.97 -0.44 -0.67 0.00 0.00 178.83 177.14 2qb0 h ASP 163 N 0.17 0.81 -0.68 1.46 3.32 -0.77 -2.12 116.42 118.61 2qb0 h ASP 163 Ca 0.03 -0.76 -0.02 0.00 0.02 0.00 0.00 57.03 56.31 2qb0 h ASP 163 Cb 0.38 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 39.65 2qb0 h ASP 163 CO 0.02 1.48 0.36 0.58 -1.72 0.00 0.00 179.24 179.96 2qb0 h VAL 164 N 0.24 1.22 -0.16 -1.35 2.07 -0.84 0.17 116.25 117.60 2qb0 h VAL 164 Ca -0.13 -0.56 -0.07 0.00 0.82 0.00 0.00 66.70 66.76 2qb0 h VAL 164 Cb 1.64 0.34 -0.01 0.00 -1.52 0.00 0.00 31.29 31.74 2qb0 h VAL 164 CO 0.19 0.24 -0.19 0.44 0.02 0.00 0.00 177.57 178.27 2qb0 h ASP 165 N 0.94 0.27 0.26 0.57 3.32 -1.14 0.15 116.42 120.79 2qb0 h ASP 165 Ca 0.24 -0.07 -0.18 0.00 0.02 0.00 0.00 57.03 57.04 2qb0 h ASP 165 Cb 0.06 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 39.53 2qb0 h ASP 165 CO -0.04 0.48 -0.72 0.00 -1.72 0.00 0.00 179.24 177.24 2qb0 h ALA 166 N 1.55 0.61 -0.13 3.45 0.00 -0.73 -1.97 119.26 122.04 2qb0 h ALA 166 Ca 0.05 -0.60 -0.09 0.00 0.00 0.00 0.00 54.91 54.26 2qb0 h ALA 166 Cb 0.49 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.22 2qb0 h ALA 166 CO 0.03 0.76 -0.28 0.00 0.00 0.00 0.00 179.25 179.76 2qb0 h ALA 167 N 0.95 0.21 -0.01 0.00 0.00 -0.26 -1.11 119.26 119.04 2qb0 h ALA 167 Ca -0.03 -0.41 -0.00 0.00 0.00 0.00 0.00 54.91 54.48 2qb0 h ALA 167 Cb 1.29 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.05 2qb0 h ALA 167 CO 0.12 0.22 0.01 0.28 0.00 0.00 0.00 179.25 179.88 2qb0 h VAL 168 N 0.01 1.08 0.00 0.00 2.07 -0.76 0.98 116.25 119.63 2qb0 h VAL 168 Ca 0.00 -0.23 -0.04 0.00 0.82 0.00 0.00 66.70 67.25 2qb0 h VAL 168 Cb 0.88 1.21 -0.01 0.00 -1.52 0.00 0.00 31.29 31.85 2qb0 h VAL 168 CO 0.06 0.06 -0.20 0.03 0.02 0.00 0.00 177.57 177.54 2qb0 h ARG 169 N -0.07 0.00 -0.48 1.57 3.08 -1.43 0.26 114.38 117.30 2qb0 h ARG 169 Ca 0.00 0.00 -0.12 0.00 0.07 0.00 0.00 59.98 59.93 2qb0 h ARG 169 Cb 0.09 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.13 2qb0 h ARG 169 CO -0.00 0.20 -0.18 0.78 -1.07 0.00 0.00 179.97 179.70 2qb0 h GLY 170 N 0.70 1.05 0.83 0.04 0.00 -0.70 -1.66 103.07 103.33 2qb0 h GLY 170 Ca -0.00 -0.91 -0.08 0.00 0.00 0.00 0.00 47.33 46.33 2qb0 h GLY 170 CO 0.03 0.83 -0.20 -2.22 0.00 0.00 0.00 176.54 174.98 2qb0 h ILE 171 N 0.82 1.33 0.00 2.60 2.04 -0.01 -3.19 117.51 121.10 2qb0 h ILE 171 Ca 0.11 -1.36 0.00 0.00 1.00 0.00 0.00 64.86 64.61 2qb0 h ILE 171 Cb 0.75 1.76 0.00 0.00 -0.74 0.00 0.00 36.82 38.59 2qb0 h ILE 171 CO 0.06 0.41 0.00 -0.07 0.00 0.00 0.00 178.15 178.56 2qb0 h LEU 172 N 0.17 0.00 -2.54 1.44 3.38 -0.50 -2.23 115.31 115.02 2qb0 h LEU 172 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 2qb0 h LEU 172 Cb 0.74 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.49 2qb0 h LEU 172 CO 0.05 0.00 0.00 0.54 0.09 0.00 0.00 178.44 179.12 2qb0 n ARG 173 N -2.92 2.82 -4.37 1.13 1.74 -0.63 -4.86 116.66 109.57 2qb0 n ARG 173 Ca 0.01 -2.42 -0.32 0.00 -0.77 0.00 0.00 57.85 54.34 2qb0 n ARG 173 Cb 0.27 -1.61 -0.16 0.00 -1.02 0.00 0.00 32.46 29.93 2qb0 n ARG 173 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 2qb0 s ASN 174 N -0.95 3.07 0.34 0.55 3.84 -0.86 -5.01 114.94 115.92 2qb0 s ASN 174 Ca 0.44 -0.61 0.26 0.00 0.21 0.00 0.00 52.86 53.16 2qb0 s ASN 174 Cb 0.25 -1.43 1.12 0.00 -0.55 0.00 0.00 41.25 40.64 2qb0 s ASN 174 CO 0.27 0.03 1.78 0.00 -2.79 0.00 0.00 177.10 176.40 2qb0 h ALA 175 N 7.66 1.00 0.00 1.71 0.00 -1.90 0.13 119.26 127.86 2qb0 h ALA 175 Ca -0.39 0.00 -0.17 0.00 0.00 0.00 0.00 54.91 54.35 2qb0 h ALA 175 Cb 1.16 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.92 2qb0 h ALA 175 CO 0.59 0.00 -1.58 1.17 0.00 0.00 0.00 179.25 179.43 2qb0 n LYS 176 N -2.43 0.63 -0.11 0.00 3.00 -1.26 -4.51 118.16 113.47 2qb0 n LYS 176 Ca 0.01 0.14 -0.13 0.00 -0.00 0.00 0.00 58.31 58.33 2qb0 n LYS 176 Cb 0.22 -1.74 -0.14 0.00 0.00 0.00 0.00 35.03 33.37 2qb0 n LYS 176 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 2qb0 n LEU 177 N -2.79 1.39 -0.00 3.14 4.77 -0.94 -4.45 117.00 118.12 2qb0 n LEU 177 Ca -0.11 -0.06 -0.11 0.00 -0.03 0.00 0.00 56.01 55.69 2qb0 n LEU 177 Cb 0.83 -0.16 -0.06 0.00 -2.33 0.00 0.00 43.42 41.71 2qb0 n LEU 177 CO 0.43 0.70 0.89 0.50 -1.33 0.00 0.00 177.39 178.58 2qb0 h LYS 178 N 0.00 0.12 0.00 3.23 3.64 -0.54 -0.17 116.57 122.85 2qb0 h LYS 178 Ca -0.55 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 58.80 2qb0 h LYS 178 Cb 2.06 -0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 33.86 2qb0 h LYS 178 CO -0.03 0.11 -0.07 -1.35 -2.27 0.00 0.00 179.45 175.84 2qb0 h PRO 179 N 0.10 0.00 0.05 1.90 0.11 -1.81 -1.00 132.00 131.34 2qb0 h PRO 179 Ca 0.03 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 66.05 2qb0 h PRO 179 Cb 0.02 0.00 0.01 0.00 0.11 0.00 0.00 31.00 31.14 2qb0 h PRO 179 CO -0.01 0.07 -0.39 0.28 -0.21 0.00 0.00 178.00 177.75 2qb0 h VAL 180 N 0.00 1.60 -0.42 3.15 2.07 -1.71 -3.18 116.25 117.76 2qb0 h VAL 180 Ca -0.00 -2.27 -0.03 0.00 0.82 0.00 0.00 66.70 65.22 2qb0 h VAL 180 Cb 0.47 3.08 -0.02 0.00 -1.52 0.00 0.00 31.29 33.30 2qb0 h VAL 180 CO 0.01 0.62 0.12 0.22 0.02 0.00 0.00 177.57 178.56 2qb0 h TYR 181 N -0.58 0.62 -0.50 1.57 3.20 -0.85 -2.56 116.97 117.87 2qb0 h TYR 181 Ca -0.06 -0.04 -0.09 0.00 3.14 0.00 0.00 58.73 61.68 2qb0 h TYR 181 Cb 1.24 -0.19 -0.02 0.00 1.54 0.00 0.00 36.73 39.30 2qb0 h TYR 181 CO 0.21 0.52 -0.06 -0.44 -1.64 0.00 0.00 178.16 176.75 2qb0 h ASP 182 N 0.61 0.87 1.28 -2.11 3.32 -1.29 -3.14 116.42 115.95 2qb0 h ASP 182 Ca 0.14 -0.25 -0.12 0.00 0.02 0.00 0.00 57.03 56.82 2qb0 h ASP 182 Cb 0.20 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.50 2qb0 h ASP 182 CO -0.01 0.96 -0.57 0.77 -1.72 0.00 0.00 179.24 178.68 2qb0 h SER 183 N 0.80 0.00 -4.00 6.45 4.64 -1.48 -3.46 113.55 116.50 2qb0 h SER 183 Ca 0.14 0.00 -0.51 0.00 -0.47 0.00 0.00 61.79 60.95 2qb0 h SER 183 Cb 0.57 0.00 0.07 0.00 -0.31 0.00 0.00 62.40 62.72 2qb0 h SER 183 CO 0.03 0.57 0.49 -0.76 -0.87 0.00 0.00 176.83 176.29 2qb0 s LEU 184 N -6.63 4.00 0.75 5.97 1.43 -0.99 -5.04 118.68 118.18 2qb0 s LEU 184 Ca 0.03 2.34 -0.11 0.00 -1.03 0.00 0.00 54.13 55.35 2qb0 s LEU 184 Cb 0.09 -4.24 0.04 0.00 0.03 0.00 0.00 46.19 42.10 2qb0 s LEU 184 CO 0.75 -0.96 1.08 1.51 0.23 0.00 0.00 176.35 178.96 2qb0 s ASP 185 N -1.33 4.97 0.28 2.29 -4.77 -1.26 -4.78 116.67 112.07 2qb0 s ASP 185 Ca 0.64 1.36 0.02 0.00 -3.30 0.00 0.00 52.55 51.28 2qb0 s ASP 185 Cb -0.29 -2.16 0.67 0.00 -1.09 0.00 0.00 42.92 40.04 2qb0 s ASP 185 CO 0.36 -1.67 1.71 0.00 0.70 0.00 0.00 175.17 176.27 2qb0 h VAL 187 N 0.45 1.32 0.00 0.00 2.07 -1.93 -3.16 116.25 115.00 2qb0 h VAL 187 Ca 0.53 -0.97 -0.03 0.00 0.82 0.00 0.00 66.70 67.05 2qb0 h VAL 187 Cb 0.95 1.90 -0.00 0.00 -1.52 0.00 0.00 31.29 32.62 2qb0 h VAL 187 CO -0.49 0.26 -0.13 0.03 0.02 0.00 0.00 177.57 177.26 2qb0 h ARG 188 N -0.31 0.00 -0.57 1.57 3.08 -1.68 -2.16 114.38 114.31 2qb0 h ARG 188 Ca 0.01 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 60.00 2qb0 h ARG 188 Cb 0.43 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.45 2qb0 h ARG 188 CO 0.00 0.13 0.10 0.00 -1.07 0.00 0.00 179.97 179.14 2qb0 h ARG 189 N 0.00 0.89 -0.76 0.04 3.08 -1.17 -2.23 114.38 114.24 2qb0 h ARG 189 Ca -0.00 -0.21 -0.06 0.00 0.07 0.00 0.00 59.98 59.78 2qb0 h ARG 189 Cb 0.36 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 30.25 2qb0 h ARG 189 CO 0.02 0.82 0.24 0.00 -1.07 0.00 0.00 179.97 179.99 2qb0 h ALA 190 N 1.26 0.99 -0.34 0.04 0.00 -1.38 -0.98 119.26 118.85 2qb0 h ALA 190 Ca 0.18 -0.23 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 2qb0 h ALA 190 Cb 0.36 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 2qb0 h ALA 190 CO 0.01 0.67 0.01 0.00 0.00 0.00 0.00 179.25 179.94 2qb0 h ALA 191 N 1.13 1.39 -0.14 0.00 0.00 -1.40 0.16 119.26 120.40 2qb0 h ALA 191 Ca 0.25 -0.19 -0.17 0.00 0.00 0.00 0.00 54.91 54.79 2qb0 h ALA 191 Cb 0.30 -0.15 0.01 0.00 0.00 0.00 0.00 17.79 17.95 2qb0 h ALA 191 CO -0.01 0.43 -0.58 1.25 0.00 0.00 0.00 179.25 180.34 2qb0 h LEU 192 N 0.50 0.74 -1.08 0.00 5.85 -1.04 -2.95 115.31 117.33 2qb0 h LEU 192 Ca 0.11 -0.62 -0.06 0.00 0.84 0.00 0.00 57.88 58.15 2qb0 h LEU 192 Cb 0.31 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.10 2qb0 h LEU 192 CO 0.01 1.24 0.03 0.40 -0.34 0.00 0.00 178.44 179.78 2qb0 h ILE 193 N 0.29 1.22 -0.39 4.05 2.04 -0.91 -2.18 117.51 121.63 2qb0 h ILE 193 Ca -0.03 -0.87 0.05 0.00 1.00 0.00 0.00 64.86 65.01 2qb0 h ILE 193 Cb 1.21 0.87 -0.04 0.00 -0.74 0.00 0.00 36.82 38.11 2qb0 h ILE 193 CO 0.12 0.30 0.13 -1.13 0.00 0.00 0.00 178.15 177.58 2qb0 h ASN 194 N 0.64 0.13 -0.45 1.72 -0.73 -0.65 0.37 115.58 116.60 2qb0 h ASN 194 Ca 0.13 0.05 -0.04 0.00 1.87 0.00 0.00 56.30 58.31 2qb0 h ASN 194 Cb 0.36 0.04 -0.02 0.00 0.27 0.00 0.00 38.32 38.97 2qb0 h ASN 194 CO 0.01 0.11 0.13 0.24 -0.37 0.00 0.00 177.43 177.55 2qb0 h MET 195 N 0.29 0.72 -0.22 6.67 2.86 -1.31 -1.62 114.93 122.31 2qb0 h MET 195 Ca 0.18 -0.16 -0.06 0.00 -2.06 0.00 0.00 59.70 57.60 2qb0 h MET 195 Cb 0.17 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 31.72 2qb0 h MET 195 CO -0.19 0.70 -0.13 0.28 1.06 0.00 0.00 176.91 178.63 2qb0 h VAL 196 N 0.60 1.20 -0.40 -2.22 2.07 -0.95 0.48 116.25 117.03 2qb0 h VAL 196 Ca 0.14 -0.89 -0.11 0.00 0.82 0.00 0.00 66.70 66.66 2qb0 h VAL 196 Cb 0.29 1.18 -0.02 0.00 -1.52 0.00 0.00 31.29 31.23 2qb0 h VAL 196 CO -0.00 0.29 -0.20 0.15 0.02 0.00 0.00 177.57 177.83 2qb0 h PHE 197 N 0.33 0.87 0.06 1.57 3.04 -0.01 -1.16 116.94 121.64 2qb0 h PHE 197 Ca 0.06 -0.19 -0.09 0.00 3.98 0.00 0.00 57.97 61.73 2qb0 h PHE 197 Cb 0.43 -0.21 0.01 0.00 2.56 0.00 0.00 35.95 38.74 2qb0 h PHE 197 CO 0.01 0.91 -0.40 0.37 -2.02 0.00 0.00 178.31 177.18 2qb0 h GLN 198 N 0.68 0.17 0.00 1.11 4.15 -0.55 -3.41 115.11 117.26 2qb0 h GLN 198 Ca 0.10 -0.26 0.00 0.00 0.77 0.00 0.00 58.65 59.26 2qb0 h GLN 198 Cb 0.70 0.09 0.00 0.00 0.21 0.00 0.00 27.48 28.49 2qb0 h GLN 198 CO 0.05 1.09 0.00 0.00 -1.93 0.00 0.00 178.83 178.05 2qb0 n MET 199 N -4.38 0.88 0.00 1.69 0.00 0.09 -5.10 117.12 110.30 2qb0 n MET 199 Ca -0.12 -0.94 0.00 0.00 0.00 0.00 0.00 57.70 56.64 2qb0 n MET 199 Cb 0.63 -0.97 0.00 0.00 0.00 0.00 0.00 33.22 32.88 2qb0 n MET 199 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2qb0 n GLY 200 N -0.23 -1.29 0.24 3.17 0.00 -0.44 -3.94 105.19 102.70 2qb0 n GLY 200 Ca 0.00 -1.60 -0.15 0.00 0.00 0.00 0.00 46.02 44.27 2qb0 n GLY 200 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2qb0 h GLU 201 N 0.00 -0.50 -0.30 1.61 4.81 -1.93 -2.73 114.58 115.54 2qb0 h GLU 201 Ca 0.00 0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 59.24 2qb0 h GLU 201 Cb 0.00 0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.48 2qb0 h GLU 201 CO 0.00 -0.33 0.06 1.15 -0.73 0.00 0.00 179.01 179.16 2qb0 h THR 202 N -0.52 1.15 -0.16 0.32 2.02 -1.97 -1.69 112.91 112.07 2qb0 h THR 202 Ca -0.04 -0.52 -0.03 0.00 0.77 0.00 0.00 66.41 66.59 2qb0 h THR 202 Cb 0.41 0.86 -0.01 0.00 -1.74 0.00 0.00 68.15 67.67 2qb0 h THR 202 CO 0.06 0.19 -0.00 1.23 0.37 0.00 0.00 175.52 177.37 2qb0 h GLY 203 N 0.66 0.31 1.84 2.16 0.00 -1.66 -3.06 103.07 103.30 2qb0 h GLY 203 Ca 0.10 -0.23 -0.13 0.00 0.00 0.00 0.00 47.33 47.08 2qb0 h GLY 203 CO -0.00 0.21 -0.54 -2.08 0.00 0.00 0.00 176.54 174.13 2qb0 h VAL 204 N 0.03 1.37 0.00 4.60 2.07 -1.31 -2.75 116.25 120.25 2qb0 h VAL 204 Ca 0.05 -1.83 0.00 0.00 0.82 0.00 0.00 66.70 65.74 2qb0 h VAL 204 Cb 0.38 1.92 0.00 0.00 -1.52 0.00 0.00 31.29 32.07 2qb0 h VAL 204 CO 0.01 0.54 0.00 0.00 0.02 0.00 0.00 177.57 178.14 2qb0 h ALA 205 N 1.31 1.00 0.00 1.67 0.00 -1.29 -2.24 119.26 119.72 2qb0 h ALA 205 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2qb0 h ALA 205 Cb 0.99 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.78 2qb0 h ALA 205 CO 0.08 0.00 0.00 0.78 0.00 0.00 0.00 179.25 180.11 2qb0 h GLY 206 N 0.82 0.00 -4.85 0.00 0.00 -1.39 -3.31 103.07 94.34 2qb0 h GLY 206 Ca 0.00 0.00 -0.54 0.00 0.00 0.00 0.00 47.33 46.79 2qb0 h GLY 206 CO 0.00 0.00 1.61 0.69 0.00 0.00 0.00 176.54 178.84 2qb0 n PHE 207 N -2.44 1.73 -0.00 5.60 3.01 -0.84 -4.78 117.46 119.74 2qb0 n PHE 207 Ca 0.03 -2.37 -0.12 0.00 1.01 0.00 0.00 57.45 56.00 2qb0 n PHE 207 Cb 0.29 -1.82 -0.06 0.00 -0.01 0.00 0.00 39.48 37.89 2qb0 n PHE 207 CO 0.00 0.00 0.00 1.15 1.01 0.00 0.00 176.76 178.92 2qb0 h THR 208 N 2.40 0.16 -0.60 4.37 2.02 -1.84 -1.36 112.91 118.06 2qb0 h THR 208 Ca 0.55 0.00 -0.10 0.00 0.77 0.00 0.00 66.41 67.63 2qb0 h THR 208 Cb 0.67 0.16 -0.02 0.00 -1.74 0.00 0.00 68.15 67.21 2qb0 h THR 208 CO 1.12 0.00 -0.01 0.78 0.37 0.00 0.00 175.52 177.78 2qb0 h ASN 209 N -0.48 1.04 -0.38 4.18 4.21 -1.95 -2.91 115.58 119.28 2qb0 h ASN 209 Ca 0.08 -0.30 -0.09 0.00 1.21 0.00 0.00 56.30 57.19 2qb0 h ASN 209 Cb 0.62 -0.28 -0.02 0.00 -1.12 0.00 0.00 38.32 37.52 2qb0 h ASN 209 CO -0.39 1.09 -0.09 0.28 -1.29 0.00 0.00 177.43 177.03 2qb0 h SER 210 N 0.96 0.81 0.28 5.81 0.02 -1.91 -2.76 113.55 116.76 2qb0 h SER 210 Ca 0.17 -0.24 -0.07 0.00 -0.84 0.00 0.00 61.79 60.81 2qb0 h SER 210 Cb 0.57 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.88 2qb0 h SER 210 CO 0.03 0.93 -0.31 -0.07 -1.14 0.00 0.00 176.83 176.27 2qb0 h LEU 211 N 0.75 0.05 -0.70 5.07 3.38 -1.16 -2.34 115.31 120.35 2qb0 h LEU 211 Ca 0.13 -0.01 -0.14 0.00 0.09 0.00 0.00 57.88 57.94 2qb0 h LEU 211 Cb 0.58 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.30 2qb0 h LEU 211 CO 0.04 0.36 -0.62 -0.09 0.09 0.00 0.00 178.44 178.21 2qb0 h ARG 212 N 0.04 0.10 -0.28 1.13 2.43 -1.31 -2.86 114.38 113.64 2qb0 h ARG 212 Ca 0.00 -0.07 -0.18 0.00 -0.81 0.00 0.00 59.98 58.92 2qb0 h ARG 212 Cb 0.57 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.13 2qb0 h ARG 212 CO 0.04 0.69 -0.54 0.52 -1.51 0.00 0.00 179.97 179.17 2qb0 h MET 213 N 0.07 0.86 -0.31 0.20 2.86 -1.16 -2.85 114.93 114.61 2qb0 h MET 213 Ca -0.01 -0.55 -0.10 0.00 -2.06 0.00 0.00 59.70 56.98 2qb0 h MET 213 Cb 1.12 0.07 -0.01 0.00 0.06 0.00 0.00 31.60 32.83 2qb0 h MET 213 CO 0.09 1.19 -0.22 -0.07 1.06 0.00 0.00 176.91 178.95 2qb0 h LEU 214 N 0.64 0.58 -0.99 1.22 3.38 -1.45 -0.73 115.31 117.97 2qb0 h LEU 214 Ca 0.01 -0.19 -0.10 0.00 0.09 0.00 0.00 57.88 57.69 2qb0 h LEU 214 Cb 1.15 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.73 2qb0 h LEU 214 CO 0.12 0.80 -0.30 -0.61 0.09 0.00 0.00 178.44 178.54 2qb0 h GLN 215 N 0.52 0.36 -0.60 1.13 4.15 -1.51 -2.64 115.11 116.52 2qb0 h GLN 215 Ca 0.08 -0.14 0.00 0.00 0.77 0.00 0.00 58.65 59.36 2qb0 h GLN 215 Cb 0.66 -0.02 0.00 0.00 0.21 0.00 0.00 27.48 28.33 2qb0 h GLN 215 CO 0.05 0.63 0.00 1.04 -1.93 0.00 0.00 178.83 178.62 2qb0 n GLN 216 N -4.10 2.82 -1.75 1.69 6.02 -1.08 -4.93 117.38 116.04 2qb0 n GLN 216 Ca -0.01 -1.91 -0.19 0.00 -0.01 0.00 0.00 57.00 54.88 2qb0 n GLN 216 Cb 0.42 -1.68 -0.07 0.00 1.02 0.00 0.00 30.24 29.94 2qb0 n GLN 216 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 2qb0 n LYS 217 N 0.68 -1.51 -2.50 -1.09 5.02 -0.99 -4.91 118.16 112.87 2qb0 n LYS 217 Ca 0.17 1.10 -0.43 0.00 -2.02 0.00 0.00 58.31 57.13 2qb0 n LYS 217 Cb 0.63 -5.52 0.00 0.00 -0.02 0.00 0.00 35.03 30.12 2qb0 n LYS 217 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2qb0 n ARG 218 N -2.44 3.21 0.00 1.97 1.74 -0.31 -4.82 116.66 116.01 2qb0 n ARG 218 Ca -0.20 -3.31 -0.12 0.00 -0.77 0.00 0.00 57.85 53.45 2qb0 n ARG 218 Cb 0.64 -3.31 -0.07 0.00 -1.02 0.00 0.00 32.46 28.70 2qb0 n ARG 218 CO 0.00 0.00 0.00 -1.49 -1.52 0.00 0.00 177.63 174.62 2qb0 h TRP 219 N 7.05 0.08 -0.59 -1.55 -0.00 -1.89 -1.28 115.95 117.77 2qb0 h TRP 219 Ca 0.44 -0.00 -0.05 0.00 -0.00 0.00 0.00 58.89 59.27 2qb0 h TRP 219 Cb 0.81 -0.02 -0.02 0.00 -0.00 0.00 0.00 29.16 29.92 2qb0 h TRP 219 CO 1.35 0.17 0.16 -0.44 -0.00 0.00 0.00 178.44 179.67 2qb0 h ASP 220 N -0.03 0.87 -0.50 -3.49 3.32 -1.87 -1.72 116.42 113.00 2qb0 h ASP 220 Ca 0.02 -0.22 -0.08 0.00 0.02 0.00 0.00 57.03 56.77 2qb0 h ASP 220 Cb 0.12 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.42 2qb0 h ASP 220 CO -0.00 0.87 -0.01 -0.33 -1.72 0.00 0.00 179.24 178.05 2qb0 h GLU 221 N 0.84 0.88 -0.37 3.56 5.08 -1.95 -2.46 114.58 120.16 2qb0 h GLU 221 Ca 0.19 -0.29 -0.08 0.00 -1.00 0.00 0.00 59.36 58.18 2qb0 h GLU 221 Cb 0.32 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.48 2qb0 h GLU 221 CO -0.00 0.92 -0.11 0.00 -1.00 0.00 0.00 179.01 178.82 2qb0 h ALA 222 N 0.93 1.11 -0.20 3.43 0.00 -1.16 -2.05 119.26 121.32 2qb0 h ALA 222 Ca 0.14 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 2qb0 h ALA 222 Cb 0.53 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 2qb0 h ALA 222 CO 0.03 0.56 0.06 0.00 0.00 0.00 0.00 179.25 179.89 2qb0 h ALA 223 N 1.28 0.26 -0.64 0.00 0.00 -1.16 -1.36 119.26 117.64 2qb0 h ALA 223 Ca 0.11 -0.14 -0.09 0.00 0.00 0.00 0.00 54.91 54.79 2qb0 h ALA 223 Cb 0.54 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 2qb0 h ALA 223 CO 0.03 -0.11 0.06 0.28 0.00 0.00 0.00 179.25 179.52 2qb0 h VAL 224 N 0.15 1.26 -0.49 0.00 2.07 -1.39 -2.60 116.25 115.25 2qb0 h VAL 224 Ca 0.06 -1.08 -0.09 0.00 0.82 0.00 0.00 66.70 66.41 2qb0 h VAL 224 Cb 0.24 0.71 -0.02 0.00 -1.52 0.00 0.00 31.29 30.71 2qb0 h VAL 224 CO -0.00 0.40 -0.04 -1.13 0.02 0.00 0.00 177.57 176.82 2qb0 h ASN 225 N 1.00 0.88 0.57 0.57 -0.00 -1.29 -3.05 115.58 114.26 2qb0 h ASN 225 Ca 0.19 -0.33 -0.10 0.00 -0.00 0.00 0.00 56.30 56.06 2qb0 h ASN 225 Cb 0.49 -0.24 -0.01 0.00 -0.00 0.00 0.00 38.32 38.56 2qb0 h ASN 225 CO 0.02 0.99 -0.47 -0.07 -0.00 0.00 0.00 177.43 177.90 2qb0 h LEU 226 N 0.74 0.00 -0.43 0.34 3.38 -1.22 -3.13 115.31 114.99 2qb0 h LEU 226 Ca 0.13 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.10 2qb0 h LEU 226 Cb 0.57 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.32 2qb0 h LEU 226 CO 0.03 0.47 0.00 0.00 0.09 0.00 0.00 178.44 179.03 2qb0 n ALA 227 N -2.41 1.86 1.42 1.53 0.00 -0.98 -2.57 120.51 119.35 2qb0 n ALA 227 Ca -0.01 0.04 0.12 0.00 0.00 0.00 0.00 53.44 53.59 2qb0 n ALA 227 Cb 0.51 -1.40 0.48 0.00 0.00 0.00 0.00 19.45 19.04 2qb0 n ALA 227 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2qb0 n LYS 228 N -2.17 1.65 -2.38 0.00 5.02 -1.18 -4.80 118.16 114.30 2qb0 n LYS 228 Ca 0.03 -0.96 -0.28 0.00 -2.02 0.00 0.00 58.31 55.08 2qb0 n LYS 228 Cb 0.29 -1.44 0.01 0.00 -0.02 0.00 0.00 35.03 33.86 2qb0 n LYS 228 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 2qb0 s SER 229 N -1.81 6.14 0.32 4.39 1.04 -1.06 -4.98 113.70 117.74 2qb0 s SER 229 Ca 0.36 1.04 0.01 0.00 0.48 0.00 0.00 55.95 57.83 2qb0 s SER 229 Cb 0.19 -2.23 0.54 0.00 0.10 0.00 0.00 66.02 64.63 2qb0 s SER 229 CO 0.30 -0.74 1.95 -0.09 0.98 0.00 0.00 173.24 175.64 2qb0 h ARG 230 N 0.00 0.97 -0.93 4.02 2.43 -1.93 -1.91 114.38 117.03 2qb0 h ARG 230 Ca -0.46 -0.06 0.04 0.00 -0.81 0.00 0.00 59.98 58.69 2qb0 h ARG 230 Cb 1.21 -0.22 -0.06 0.00 -0.42 0.00 0.00 29.97 30.48 2qb0 h ARG 230 CO 0.62 0.64 0.60 2.35 -1.51 0.00 0.00 179.97 182.67 2qb0 h TRP 231 N 1.00 1.12 -0.44 2.20 7.01 -1.93 -1.39 115.95 123.52 2qb0 h TRP 231 Ca 0.33 0.03 -0.11 0.00 2.11 0.00 0.00 58.89 61.24 2qb0 h TRP 231 Cb 0.06 -0.37 -0.01 0.00 -2.10 0.00 0.00 29.16 26.74 2qb0 h TRP 231 CO -0.00 0.63 -0.17 -0.92 -2.79 0.00 0.00 178.44 175.19 2qb0 h TYR 232 N 1.15 1.01 -0.67 2.65 3.20 -1.61 -2.77 116.97 119.93 2qb0 h TYR 232 Ca 0.38 -0.24 -0.07 0.00 3.14 0.00 0.00 58.73 61.94 2qb0 h TYR 232 Cb 0.04 -0.24 -0.03 0.00 1.54 0.00 0.00 36.73 38.04 2qb0 h TYR 232 CO -0.01 1.02 0.16 -0.91 -1.64 0.00 0.00 178.16 176.77 2qb0 h ASN 233 N 0.71 1.00 -0.18 -2.11 -0.26 -1.05 -1.92 115.58 111.77 2qb0 h ASN 233 Ca 0.10 -0.21 -0.08 0.00 -0.56 0.00 0.00 56.30 55.56 2qb0 h ASN 233 Cb 0.73 -0.26 -0.00 0.00 -1.06 0.00 0.00 38.32 37.73 2qb0 h ASN 233 CO 0.06 0.96 -0.19 1.56 -1.06 0.00 0.00 177.43 178.76 2qb0 h GLN 234 N 1.00 0.45 -2.31 0.81 1.08 -1.26 -3.38 115.11 111.51 2qb0 h GLN 234 Ca 0.21 -0.24 -0.59 0.00 -1.45 0.00 0.00 58.65 56.58 2qb0 h GLN 234 Cb 0.36 0.01 -0.40 0.00 -0.05 0.00 0.00 27.48 27.40 2qb0 h GLN 234 CO 0.00 0.81 -0.86 0.25 -0.95 0.00 0.00 178.83 178.09 2qb0 n THR 235 N -4.47 0.35 0.08 -0.54 -2.24 -1.05 -5.01 114.28 101.40 2qb0 n THR 235 Ca -0.06 -4.33 -0.12 0.00 -2.27 0.00 0.00 64.05 57.27 2qb0 n THR 235 Cb 0.40 -1.96 -0.05 0.00 -2.10 0.00 0.00 70.33 66.61 2qb0 n THR 235 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 2qb0 h PRO 236 N 4.64 -0.48 -0.52 -0.78 0.13 -1.54 -1.46 132.00 132.01 2qb0 h PRO 236 Ca 0.16 0.03 0.09 0.00 -0.87 0.00 0.00 66.00 65.41 2qb0 h PRO 236 Cb 0.81 0.11 -0.07 0.00 0.13 0.00 0.00 31.00 31.97 2qb0 h PRO 236 CO 0.58 -0.32 0.10 -0.91 -0.23 0.00 0.00 178.00 177.22 2qb0 h ASN 237 N -0.49 -0.01 -0.17 1.44 2.35 -1.95 0.35 115.58 117.10 2qb0 h ASN 237 Ca 0.05 0.09 -0.10 0.00 -0.55 0.00 0.00 56.30 55.79 2qb0 h ASN 237 Cb 0.56 0.13 0.00 0.00 0.05 0.00 0.00 38.32 39.06 2qb0 h ASN 237 CO -0.24 0.02 -0.30 -0.09 -1.65 0.00 0.00 177.43 175.17 2qb0 h ARG 238 N 0.24 0.50 -0.74 0.81 2.43 -1.95 -3.05 114.38 112.62 2qb0 h ARG 238 Ca 0.26 -0.31 0.03 0.00 -0.81 0.00 0.00 59.98 59.15 2qb0 h ARG 238 Cb 0.36 0.03 -0.05 0.00 -0.42 0.00 0.00 29.97 29.90 2qb0 h ARG 238 CO -0.34 0.92 0.46 0.00 -1.51 0.00 0.00 179.97 179.50 2qb0 h ALA 239 N 0.58 0.97 -0.42 2.80 0.00 -0.91 -1.69 119.26 120.59 2qb0 h ALA 239 Ca 0.01 -0.02 0.07 0.00 0.00 0.00 0.00 54.91 54.96 2qb0 h ALA 239 Cb 0.89 -0.24 -0.06 0.00 0.00 0.00 0.00 17.79 18.38 2qb0 h ALA 239 CO 0.07 0.25 0.08 0.87 0.00 0.00 0.00 179.25 180.52 2qb0 h LYS 240 N 0.90 0.20 -0.41 0.00 1.57 -0.96 0.60 116.57 118.47 2qb0 h LYS 240 Ca 0.30 -0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 59.04 2qb0 h LYS 240 Cb 0.02 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.27 2qb0 h LYS 240 CO -0.11 0.13 0.15 0.00 -0.57 0.00 0.00 179.45 179.05 2qb0 h ARG 241 N 0.21 0.62 -0.46 3.15 3.08 -1.33 0.63 114.38 120.27 2qb0 h ARG 241 Ca 0.21 -0.12 -0.02 0.00 0.07 0.00 0.00 59.98 60.12 2qb0 h ARG 241 Cb 0.26 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.19 2qb0 h ARG 241 CO -0.27 0.59 0.21 0.28 -1.07 0.00 0.00 179.97 179.71 2qb0 h VAL 242 N 0.51 1.19 -0.40 2.04 2.07 -1.03 -1.85 116.25 118.78 2qb0 h VAL 242 Ca 0.13 -0.55 -0.02 0.00 0.82 0.00 0.00 66.70 67.09 2qb0 h VAL 242 Cb 0.21 0.70 -0.02 0.00 -1.52 0.00 0.00 31.29 30.67 2qb0 h VAL 242 CO -0.01 0.21 0.17 0.40 0.02 0.00 0.00 177.57 178.37 2qb0 h ILE 243 N 0.60 1.18 -0.85 4.57 2.04 -0.70 -1.78 117.51 122.58 2qb0 h ILE 243 Ca 0.16 -0.55 0.05 0.00 1.00 0.00 0.00 64.86 65.52 2qb0 h ILE 243 Cb 0.13 0.81 -0.05 0.00 -0.74 0.00 0.00 36.82 36.97 2qb0 h ILE 243 CO -0.02 0.20 0.55 0.74 0.00 0.00 0.00 178.15 179.63 2qb0 h THR 244 N 0.50 1.09 -0.57 -0.27 2.02 -0.75 0.83 112.91 115.76 2qb0 h THR 244 Ca 0.13 -0.34 -0.04 0.00 0.77 0.00 0.00 66.41 66.94 2qb0 h THR 244 Cb 0.15 0.01 -0.03 0.00 -1.74 0.00 0.00 68.15 66.55 2qb0 h THR 244 CO -0.01 0.18 0.22 0.74 0.37 0.00 0.00 175.52 177.01 2qb0 h THR 245 N 0.99 1.23 -0.23 3.16 2.02 -0.95 -0.35 112.91 118.78 2qb0 h THR 245 Ca 0.35 -0.73 -0.08 0.00 0.77 0.00 0.00 66.41 66.73 2qb0 h THR 245 Cb 0.14 0.63 -0.01 0.00 -1.74 0.00 0.00 68.15 67.16 2qb0 h THR 245 CO -0.12 0.28 -0.20 -0.26 0.37 0.00 0.00 175.52 175.59 2qb0 h PHE 246 N 0.79 0.45 0.05 3.16 0.04 -0.39 -0.69 116.94 120.35 2qb0 h PHE 246 Ca 0.19 -0.08 -0.13 0.00 2.80 0.00 0.00 57.97 60.75 2qb0 h PHE 246 Cb 0.22 -0.12 0.01 0.00 2.20 0.00 0.00 35.95 38.27 2qb0 h PHE 246 CO 0.01 0.59 -0.54 -0.09 -0.60 0.00 0.00 178.31 177.68 2qb0 h ARG 247 N 0.37 0.27 0.03 1.51 2.43 -0.56 -3.40 114.38 115.03 2qb0 h ARG 247 Ca 0.06 -0.36 -0.35 0.00 -0.81 0.00 0.00 59.98 58.52 2qb0 h ARG 247 Cb 0.57 0.12 -0.05 0.00 -0.42 0.00 0.00 29.97 30.18 2qb0 h ARG 247 CO 0.04 1.11 -2.12 0.25 -1.51 0.00 0.00 179.97 177.73 2qb0 n THR 248 N -4.29 1.56 -1.95 0.20 -2.24 -0.17 -4.79 114.28 102.60 2qb0 n THR 248 Ca -0.12 -0.74 -0.01 0.00 -2.27 0.00 0.00 64.05 60.91 2qb0 n THR 248 Cb 0.67 -1.08 -0.00 0.00 -2.10 0.00 0.00 70.33 67.82 2qb0 n THR 248 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2qb0 n GLY 249 N 1.84 0.34 2.09 3.38 0.00 -0.26 -5.05 105.19 107.53 2qb0 n GLY 249 Ca -0.30 -0.87 -0.14 0.00 0.00 0.00 0.00 46.02 44.70 2qb0 n GLY 249 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2qb0 n THR 250 N -3.94 0.00 -1.48 2.61 -2.24 -1.26 -4.87 114.28 103.11 2qb0 n THR 250 Ca -0.01 -1.54 -0.19 0.00 -2.27 0.00 0.00 64.05 60.04 2qb0 n THR 250 Cb 0.48 0.68 0.14 0.00 -2.10 0.00 0.00 70.33 69.53 2qb0 n THR 250 CO 0.00 0.00 0.00 0.79 -0.57 0.00 0.00 175.07 175.29 2qb0 n TRP 251 N -0.48 2.28 -0.17 4.78 7.02 -1.26 -4.58 117.44 125.03 2qb0 n TRP 251 Ca 0.01 -2.10 -0.03 0.00 -1.02 0.00 0.00 57.50 54.37 2qb0 n TRP 251 Cb 0.39 -0.79 0.18 0.00 -2.42 0.00 0.00 31.31 28.67 2qb0 n TRP 251 CO 0.00 0.00 0.00 -0.44 -2.02 0.00 0.00 177.69 175.23 2qb0 h ASP 252 N 1.42 0.84 1.45 -0.99 3.32 -1.97 -2.72 116.42 117.77 2qb0 h ASP 252 Ca 0.43 -0.13 -0.00 0.00 0.02 0.00 0.00 57.03 57.35 2qb0 h ASP 252 Cb 1.71 -0.22 -0.00 0.00 0.22 0.00 0.00 39.33 41.04 2qb0 h ASP 252 CO 0.88 0.77 -0.01 0.00 -1.72 0.00 0.00 179.24 179.17 2qb0 h ALA 253 N 1.35 1.00 -0.23 3.45 0.00 -1.89 -3.21 119.26 119.72 2qb0 h ALA 253 Ca 0.20 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.11 2qb0 h ALA 253 Cb 0.22 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.01 2qb0 h ALA 253 CO -0.01 0.01 0.00 0.66 0.00 0.00 0.00 179.25 179.90 2qb0 n TYR 254 N -3.10 0.29 1.25 0.00 4.02 -1.05 -4.98 117.16 113.59 2qb0 n TYR 254 Ca 0.02 -0.19 0.13 0.00 -0.01 0.00 0.00 57.90 57.85 2qb0 n TYR 254 Cb 0.41 -0.00 0.31 0.00 -0.02 0.00 0.00 39.34 40.04 2qb0 n TYR 254 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 176.86 177.48