#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bqc s THR 2 N 0.00 5.16 0.00 0.00 -4.23 -1.26 -4.74 115.64 110.57 1bqc s THR 2 Ca 0.00 -0.45 0.00 0.00 -1.18 0.00 0.00 61.69 60.06 1bqc s THR 2 Cb 0.00 -3.80 0.00 0.00 1.34 0.00 0.00 72.50 70.04 1bqc s THR 2 CO 0.00 -0.36 0.00 0.61 -0.54 0.00 0.00 174.62 174.33 1bqc n GLY 3 N -1.22 1.92 3.75 3.99 0.00 -1.26 -4.85 105.19 107.53 1bqc n GLY 3 Ca -0.05 -0.23 -0.42 0.00 0.00 0.00 0.00 46.02 45.32 1bqc n GLY 3 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1bqc n LEU 4 N 0.00 4.41 -3.87 0.99 4.77 -0.30 -3.10 117.00 119.89 1bqc n LEU 4 Ca 0.00 1.16 -0.09 0.00 -0.03 0.00 0.00 56.01 57.05 1bqc n LEU 4 Cb 0.00 -1.60 -0.04 0.00 -2.33 0.00 0.00 43.42 39.46 1bqc n LEU 4 CO 0.00 0.15 0.30 -1.38 -1.33 0.00 0.00 177.39 175.14 1bqc s HIS 5 N -0.13 0.03 -0.08 -1.77 -3.43 0.01 -3.84 115.29 106.08 1bqc s HIS 5 Ca 0.63 -0.42 0.01 0.00 -0.80 0.00 0.00 55.06 54.48 1bqc s HIS 5 Cb -0.49 0.42 -0.03 0.00 -1.43 0.00 0.00 32.58 31.05 1bqc s HIS 5 CO 0.50 -1.05 -0.09 0.08 -2.00 0.00 0.00 174.74 172.18 1bqc s VAL 6 N -3.94 3.46 -0.14 -5.38 1.01 -1.26 -0.30 120.40 113.86 1bqc s VAL 6 Ca 0.15 -0.56 -0.12 0.00 0.00 0.00 0.00 61.98 61.45 1bqc s VAL 6 Cb -0.02 -2.42 0.04 0.00 0.00 0.00 0.00 36.38 33.97 1bqc s VAL 6 CO 0.05 0.57 0.36 -1.59 0.00 0.00 0.00 175.10 174.49 1bqc s LYS 7 N -0.49 0.41 -1.53 2.72 -2.85 -0.48 -4.78 119.74 112.74 1bqc s LYS 7 Ca 0.07 0.52 -0.14 0.00 -1.00 0.00 0.00 55.97 55.42 1bqc s LYS 7 Cb -0.12 0.18 0.10 0.00 -2.06 0.00 0.00 37.83 35.93 1bqc s LYS 7 CO 0.02 -0.06 0.85 0.09 0.10 0.00 0.00 175.35 176.35 1bqc n ASN 8 N 3.02 -4.43 -0.03 0.03 3.02 -1.26 -1.18 115.26 114.43 1bqc n ASN 8 Ca -0.14 -0.74 -0.00 0.00 -0.03 0.00 0.00 54.58 53.66 1bqc n ASN 8 Cb 0.57 -3.57 -0.00 0.00 -0.61 0.00 0.00 39.78 36.17 1bqc n ASN 8 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1bqc n GLY 9 N -1.54 0.39 3.35 7.41 0.00 -1.25 -4.94 105.19 108.61 1bqc n GLY 9 Ca 0.04 -0.05 -0.18 0.00 0.00 0.00 0.00 46.02 45.83 1bqc n GLY 9 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1bqc s ARG 10 N -0.69 1.36 -0.20 1.61 0.52 -0.32 -3.82 118.95 117.40 1bqc s ARG 10 Ca 0.00 -1.64 -0.12 0.00 -0.52 0.00 0.00 55.73 53.45 1bqc s ARG 10 Cb 0.00 -1.00 -0.05 0.00 0.52 0.00 0.00 34.95 34.42 1bqc s ARG 10 CO 0.00 0.10 0.24 -1.17 0.02 0.00 0.00 175.30 174.48 1bqc s LEU 11 N -3.33 4.18 0.09 2.53 2.96 -1.26 -1.38 118.68 122.47 1bqc s LEU 11 Ca 0.24 0.33 0.06 0.00 -0.22 0.00 0.00 54.13 54.55 1bqc s LEU 11 Cb 0.02 -2.26 -0.03 0.00 0.50 0.00 0.00 46.19 44.42 1bqc s LEU 11 CO 0.08 0.07 -0.17 -0.31 -1.32 0.00 0.00 176.35 174.70 1bqc s TYR 12 N 0.79 1.46 0.76 5.38 1.51 0.59 -0.49 117.35 127.34 1bqc s TYR 12 Ca 0.12 -0.45 -0.11 0.00 -1.01 0.00 0.00 57.07 55.62 1bqc s TYR 12 Cb -0.13 -0.81 0.05 0.00 -0.11 0.00 0.00 41.96 40.96 1bqc s TYR 12 CO 0.03 0.12 1.10 -1.21 -1.11 0.00 0.00 175.55 174.49 1bqc s GLU 13 N -1.84 2.41 0.48 -0.62 2.02 0.25 -0.81 118.70 120.58 1bqc s GLU 13 Ca 0.02 0.54 0.17 0.00 0.02 0.00 0.00 54.97 55.71 1bqc s GLU 13 Cb -0.10 -1.96 1.18 0.00 0.10 0.00 0.00 34.13 33.35 1bqc s GLU 13 CO 0.03 -1.37 2.05 0.00 0.02 0.00 0.00 175.26 175.98 1bqc h ALA 14 N -0.90 2.11 0.00 5.21 0.00 -1.87 -0.43 119.26 123.38 1bqc h ALA 14 Ca -0.46 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1bqc h ALA 14 Cb 1.26 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1bqc h ALA 14 CO 0.62 -0.19 0.00 0.27 0.00 0.00 0.00 179.25 179.94 1bqc n ASN 15 N -4.47 0.00 0.00 0.00 6.94 -1.26 -4.87 115.26 111.60 1bqc n ASN 15 Ca 0.05 -1.07 0.00 0.00 -0.02 0.00 0.00 54.58 53.55 1bqc n ASN 15 Cb 0.31 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.73 1bqc n ASN 15 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1bqc n GLY 16 N 0.71 0.65 3.70 4.83 0.00 -0.17 -5.05 105.19 109.85 1bqc n GLY 16 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 1bqc n GLY 16 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1bqc s GLN 17 N -0.75 4.44 0.46 1.61 -1.52 -1.25 -4.82 119.66 117.82 1bqc s GLN 17 Ca 0.00 1.21 -0.24 0.00 -1.95 0.00 0.00 55.36 54.39 1bqc s GLN 17 Cb 0.00 -3.51 -0.07 0.00 -0.22 0.00 0.00 33.01 29.21 1bqc s GLN 17 CO 0.00 -0.17 1.30 -2.00 -0.25 0.00 0.00 175.29 174.18 1bqc s GLU 18 N 1.52 3.64 -0.17 2.91 2.12 -1.26 -0.59 118.70 126.86 1bqc s GLU 18 Ca 0.45 2.12 0.01 0.00 0.36 0.00 0.00 54.97 57.92 1bqc s GLU 18 Cb -0.19 -2.52 0.02 0.00 0.26 0.00 0.00 34.13 31.71 1bqc s GLU 18 CO 0.20 -0.75 -0.20 0.12 -0.54 0.00 0.00 175.26 174.08 1bqc s PHE 19 N -1.33 2.76 -0.37 5.30 5.36 0.35 -4.83 117.98 125.23 1bqc s PHE 19 Ca 0.63 -1.60 -0.07 0.00 -0.96 0.00 0.00 56.93 54.93 1bqc s PHE 19 Cb -0.37 -1.90 0.05 0.00 -0.34 0.00 0.00 43.02 40.46 1bqc s PHE 19 CO 0.46 -0.78 0.16 0.42 -1.46 0.00 0.00 175.22 174.02 1bqc s ILE 20 N 1.21 3.91 0.20 3.12 1.01 -1.26 -4.53 121.20 124.86 1bqc s ILE 20 Ca 0.03 -1.24 -0.31 0.00 0.00 0.00 0.00 60.65 59.13 1bqc s ILE 20 Cb -0.13 -3.29 -0.10 0.00 0.01 0.00 0.00 42.46 38.95 1bqc s ILE 20 CO -0.11 -0.30 1.51 -0.63 0.00 0.00 0.00 174.94 175.41 1bqc s ILE 21 N 1.40 2.65 -0.33 2.92 1.01 -1.26 -4.74 121.20 122.86 1bqc s ILE 21 Ca 0.00 0.50 -0.02 0.00 0.00 0.00 0.00 60.65 61.14 1bqc s ILE 21 Cb -0.21 -3.32 0.12 0.00 0.01 0.00 0.00 42.46 39.07 1bqc s ILE 21 CO 0.02 0.05 0.18 -0.13 0.00 0.00 0.00 174.94 175.07 1bqc s ARG 22 N 0.55 0.40 0.00 2.79 1.81 -1.25 -1.16 118.95 122.08 1bqc s ARG 22 Ca 0.66 -0.97 0.00 0.00 -1.72 0.00 0.00 55.73 53.70 1bqc s ARG 22 Cb -0.43 -1.21 0.00 0.00 -0.45 0.00 0.00 34.95 32.86 1bqc s ARG 22 CO 0.36 -1.13 0.00 0.41 -0.68 0.00 0.00 175.30 174.26 1bqc n GLY 23 N 4.56 3.45 3.16 -3.53 0.00 -0.90 -1.35 105.19 110.58 1bqc n GLY 23 Ca 0.04 -1.00 -0.09 0.00 0.00 0.00 0.00 46.02 44.98 1bqc n GLY 23 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1bqc s VAL 24 N -2.47 0.16 0.18 1.61 -7.23 -1.21 -1.31 120.40 110.12 1bqc s VAL 24 Ca 0.00 -1.29 -0.17 0.00 -1.81 0.00 0.00 61.98 58.71 1bqc s VAL 24 Cb 0.00 -1.26 -0.08 0.00 0.56 0.00 0.00 36.38 35.60 1bqc s VAL 24 CO 0.00 -0.71 0.64 -0.44 -0.31 0.00 0.00 175.10 174.28 1bqc s SER 25 N -2.68 6.97 -0.11 4.85 0.01 -0.49 -1.12 113.70 121.13 1bqc s SER 25 Ca 0.03 1.27 0.02 0.00 1.31 0.00 0.00 55.95 58.57 1bqc s SER 25 Cb 0.04 -2.36 0.01 0.00 0.21 0.00 0.00 66.02 63.92 1bqc s SER 25 CO -0.09 0.09 -0.15 -2.28 0.41 0.00 0.00 173.24 171.21 1bqc s HIS 26 N -1.46 1.97 -1.56 2.43 5.04 0.41 -0.93 115.29 121.20 1bqc s HIS 26 Ca 0.39 -0.92 -0.10 0.00 -1.54 0.00 0.00 55.06 52.90 1bqc s HIS 26 Cb -0.16 -1.42 -0.09 0.00 0.04 0.00 0.00 32.58 30.95 1bqc s HIS 26 CO 0.20 -0.47 2.90 -0.35 -2.34 0.00 0.00 174.74 174.67 1bqc n PRO 27 N 4.19 3.56 -0.22 2.88 -0.04 -1.26 -1.87 135.00 142.24 1bqc n PRO 27 Ca -0.19 -2.13 0.02 0.00 -0.04 0.00 0.00 63.50 61.16 1bqc n PRO 27 Cb 0.51 -2.77 0.13 0.00 -0.04 0.00 0.00 33.50 31.34 1bqc n PRO 27 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 1bqc h HIS 28 N 5.11 0.37 -0.89 0.54 2.76 -1.83 -1.40 115.15 119.81 1bqc h HIS 28 Ca 0.84 0.03 0.05 0.00 -2.20 0.00 0.00 60.37 59.10 1bqc h HIS 28 Cb 0.27 -0.06 -0.06 0.00 1.55 0.00 0.00 27.41 29.11 1bqc h HIS 28 CO 1.90 0.04 0.56 -0.97 -1.30 0.00 0.00 177.93 178.16 1bqc h ASN 29 N 0.37 0.90 0.94 3.26 -0.73 -1.32 -2.09 115.58 116.91 1bqc h ASN 29 Ca 0.35 0.01 0.00 0.00 1.87 0.00 0.00 56.30 58.52 1bqc h ASN 29 Cb 0.49 -0.18 0.00 0.00 0.27 0.00 0.00 38.32 38.90 1bqc h ASN 29 CO -0.37 0.59 -0.56 -0.50 -0.37 0.00 0.00 177.43 176.21 1bqc h TRP 30 N 1.04 0.00 -2.05 0.67 6.55 -1.68 -3.39 115.95 117.09 1bqc h TRP 30 Ca 0.38 0.00 -0.55 0.00 0.95 0.00 0.00 58.89 59.66 1bqc h TRP 30 Cb 0.12 0.00 -0.40 0.00 -0.86 0.00 0.00 29.16 28.03 1bqc h TRP 30 CO -0.02 0.00 -1.02 0.66 -1.05 0.00 0.00 178.44 177.01 1bqc n TYR 31 N -2.15 0.64 0.32 0.49 4.01 -0.59 -4.95 117.16 114.92 1bqc n TYR 31 Ca 0.03 -3.73 0.21 0.00 -0.16 0.00 0.00 57.90 54.25 1bqc n TYR 31 Cb 0.44 -0.41 1.03 0.00 -0.31 0.00 0.00 39.34 40.10 1bqc n TYR 31 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 1bqc h PRO 32 N 3.78 0.00 -0.00 -0.72 0.13 -1.62 -2.09 132.00 131.48 1bqc h PRO 32 Ca 0.10 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.23 1bqc h PRO 32 Cb 0.84 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.97 1bqc h PRO 32 CO 0.55 0.01 -0.07 0.00 -0.23 0.00 0.00 178.00 178.25 1bqc n GLN 33 N -3.12 0.07 -2.04 0.86 0.00 -1.26 -4.23 117.38 107.65 1bqc n GLN 33 Ca -0.02 -0.01 -0.36 0.00 0.00 0.00 0.00 57.00 56.62 1bqc n GLN 33 Cb 0.15 -1.50 0.03 0.00 0.00 0.00 0.00 30.24 28.92 1bqc n GLN 33 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.06 177.78 1bqc n HIS 34 N -1.46 3.11 1.27 2.61 8.25 -0.78 -4.68 115.22 123.53 1bqc n HIS 34 Ca 0.08 -2.59 0.11 0.00 -0.26 0.00 0.00 57.72 55.06 1bqc n HIS 34 Cb 0.33 -0.87 0.63 0.00 1.12 0.00 0.00 29.99 31.19 1bqc n HIS 34 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 1bqc n THR 35 N -0.55 0.14 0.34 1.59 -2.24 -1.26 -1.83 114.28 110.46 1bqc n THR 35 Ca 0.50 0.03 0.14 0.00 -2.27 0.00 0.00 64.05 62.46 1bqc n THR 35 Cb 0.40 -0.67 0.59 0.00 -2.10 0.00 0.00 70.33 68.55 1bqc n THR 35 CO 0.00 0.00 0.00 0.06 -0.57 0.00 0.00 175.07 174.56 1bqc h GLN 36 N 0.00 0.00 -0.71 -0.78 -0.00 -1.96 -3.05 115.11 108.61 1bqc h GLN 36 Ca 0.00 0.00 0.09 0.00 -0.00 0.00 0.00 58.65 58.74 1bqc h GLN 36 Cb 0.09 0.00 -0.05 0.00 -0.00 0.00 0.00 27.48 27.52 1bqc h GLN 36 CO 0.00 0.00 0.47 0.00 -0.00 0.00 0.00 178.83 179.30 1bqc h ALA 37 N 2.15 1.84 0.10 0.06 0.00 -1.71 -2.12 119.26 119.58 1bqc h ALA 37 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1bqc h ALA 37 Cb 0.38 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1bqc h ALA 37 CO 0.00 0.02 -0.09 0.74 0.00 0.00 0.00 179.25 179.92 1bqc h PHE 38 N 0.62 -0.23 -0.73 0.00 -1.00 -1.79 0.54 116.94 114.35 1bqc h PHE 38 Ca 0.32 0.00 -0.02 0.00 2.81 0.00 0.00 57.97 61.08 1bqc h PHE 38 Cb 0.44 0.09 -0.03 0.00 3.61 0.00 0.00 35.95 40.06 1bqc h PHE 38 CO -0.00 -0.14 0.36 0.00 -1.61 0.00 0.00 178.31 176.92 1bqc h ALA 39 N 0.69 0.94 -0.65 2.45 0.00 -1.75 -2.44 119.26 118.50 1bqc h ALA 39 Ca 0.00 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.73 1bqc h ALA 39 Cb 0.19 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 1bqc h ALA 39 CO -0.02 0.50 0.25 -0.44 0.00 0.00 0.00 179.25 179.54 1bqc h ASP 40 N 1.02 0.91 -0.56 0.00 3.32 -1.09 -0.27 116.42 119.75 1bqc h ASP 40 Ca 0.25 -0.18 -0.05 0.00 0.02 0.00 0.00 57.03 57.08 1bqc h ASP 40 Cb 0.10 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.39 1bqc h ASP 40 CO -0.03 0.84 0.16 0.40 -1.72 0.00 0.00 179.24 178.88 1bqc h ILE 41 N 0.92 1.24 -0.64 0.35 2.04 -0.77 -2.51 117.51 118.15 1bqc h ILE 41 Ca 0.22 -0.84 -0.06 0.00 1.00 0.00 0.00 64.86 65.18 1bqc h ILE 41 Cb 0.22 0.73 -0.03 0.00 -0.74 0.00 0.00 36.82 37.00 1bqc h ILE 41 CO -0.02 0.31 0.16 0.50 0.00 0.00 0.00 178.15 179.11 1bqc h LYS 42 N 0.79 0.99 -0.01 2.37 1.63 -1.23 -2.78 116.57 118.33 1bqc h LYS 42 Ca 0.18 -0.22 0.00 0.00 -0.85 0.00 0.00 60.65 59.76 1bqc h LYS 42 Cb 0.31 -0.14 -0.00 0.00 -0.60 0.00 0.00 32.23 31.80 1bqc h LYS 42 CO -0.00 0.87 0.01 0.66 -3.45 0.00 0.00 179.45 177.54 1bqc h SER 43 N 0.95 0.00 -0.32 4.20 4.64 -0.59 0.01 113.55 122.44 1bqc h SER 43 Ca 0.20 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.52 1bqc h SER 43 Cb 0.32 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.41 1bqc h SER 43 CO -0.00 0.00 0.00 1.41 -0.87 0.00 0.00 176.83 177.37 1bqc n HIS 44 N -3.85 0.41 0.00 4.77 8.25 -1.06 -4.94 115.22 118.81 1bqc n HIS 44 Ca -0.03 -0.21 0.00 0.00 -0.26 0.00 0.00 57.72 57.22 1bqc n HIS 44 Cb 0.09 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.20 1bqc n HIS 44 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1bqc n GLY 45 N 1.27 0.42 3.72 -1.41 0.00 -0.01 -4.01 105.19 105.16 1bqc n GLY 45 Ca 0.17 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.84 1bqc n GLY 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bqc s ALA 46 N -2.00 2.09 -0.69 4.61 0.00 -1.16 -4.69 121.76 119.93 1bqc s ALA 46 Ca 0.00 0.96 0.08 0.00 0.00 0.00 0.00 51.96 53.00 1bqc s ALA 46 Cb 0.00 -3.50 -0.01 0.00 0.00 0.00 0.00 23.12 19.61 1bqc s ALA 46 CO 0.00 -1.94 0.53 0.27 0.00 0.00 0.00 175.76 174.62 1bqc n ASN 47 N -2.69 0.99 -3.81 0.00 0.23 -0.45 -4.61 115.26 104.92 1bqc n ASN 47 Ca 0.14 -1.00 -0.12 0.00 -0.53 0.00 0.00 54.58 53.07 1bqc n ASN 47 Cb 0.50 0.53 -0.11 0.00 -2.08 0.00 0.00 39.78 38.62 1bqc n ASN 47 CO 0.00 0.00 0.00 -0.89 -0.93 0.00 0.00 177.26 175.44 1bqc s THR 48 N -1.24 0.03 -0.07 5.53 2.01 -1.24 -1.28 115.64 119.38 1bqc s THR 48 Ca 0.06 -0.23 0.04 0.00 0.31 0.00 0.00 61.69 61.86 1bqc s THR 48 Cb 0.06 -0.39 0.00 0.00 0.01 0.00 0.00 72.50 72.18 1bqc s THR 48 CO 0.21 -0.13 -0.17 0.54 -0.69 0.00 0.00 174.62 174.38 1bqc s VAL 49 N -0.44 1.52 -0.29 3.82 0.11 -0.49 -3.32 120.40 121.30 1bqc s VAL 49 Ca -0.05 -0.72 -0.17 0.00 -2.93 0.00 0.00 61.98 58.11 1bqc s VAL 49 Cb -0.04 -1.33 -0.02 0.00 -1.53 0.00 0.00 36.38 33.46 1bqc s VAL 49 CO 0.01 0.44 0.45 -0.60 -3.33 0.00 0.00 175.10 172.07 1bqc s ARG 50 N 0.35 3.92 -0.23 1.54 3.52 -0.28 -0.74 118.95 127.04 1bqc s ARG 50 Ca -0.12 0.06 -0.07 0.00 -0.13 0.00 0.00 55.73 55.47 1bqc s ARG 50 Cb -0.15 -3.70 -0.03 0.00 -1.56 0.00 0.00 34.95 29.51 1bqc s ARG 50 CO 0.05 -0.40 0.05 0.08 -0.81 0.00 0.00 175.30 174.27 1bqc s VAL 51 N 2.22 4.30 -0.28 7.11 1.01 0.59 -0.44 120.40 134.91 1bqc s VAL 51 Ca 0.18 -0.19 -0.29 0.00 0.00 0.00 0.00 61.98 61.68 1bqc s VAL 51 Cb -0.16 -2.98 -0.01 0.00 0.00 0.00 0.00 36.38 33.23 1bqc s VAL 51 CO 0.11 0.38 1.40 -0.69 0.00 0.00 0.00 175.10 176.30 1bqc s VAL 52 N 1.27 4.00 0.36 2.92 1.01 -0.78 -1.84 120.40 127.34 1bqc s VAL 52 Ca 0.04 1.12 0.09 0.00 0.00 0.00 0.00 61.98 63.23 1bqc s VAL 52 Cb -0.15 -4.02 -0.06 0.00 0.00 0.00 0.00 36.38 32.15 1bqc s VAL 52 CO 0.03 -0.42 -0.03 -0.76 0.00 0.00 0.00 175.10 173.92 1bqc s LEU 53 N 4.66 2.86 0.01 3.92 1.43 -0.42 -0.92 118.68 130.22 1bqc s LEU 53 Ca 0.61 -1.17 0.05 0.00 -1.03 0.00 0.00 54.13 52.59 1bqc s LEU 53 Cb -0.19 -1.10 -0.02 0.00 0.03 0.00 0.00 46.19 44.91 1bqc s LEU 53 CO 0.25 -0.29 -0.15 -0.55 0.23 0.00 0.00 176.35 175.84 1bqc s SER 54 N -3.68 1.82 0.00 2.29 0.15 -1.26 -1.15 113.70 111.87 1bqc s SER 54 Ca 0.34 -0.37 0.23 0.00 0.70 0.00 0.00 55.95 56.85 1bqc s SER 54 Cb 0.03 -0.16 0.80 0.00 -1.71 0.00 0.00 66.02 64.98 1bqc s SER 54 CO 0.18 0.13 1.59 -0.46 1.20 0.00 0.00 173.24 175.87 1bqc n ASN 55 N 2.29 1.77 0.00 5.45 6.94 -1.26 -1.83 115.26 128.61 1bqc n ASN 55 Ca -0.16 -1.67 0.00 0.00 -0.02 0.00 0.00 54.58 52.73 1bqc n ASN 55 Cb 0.55 -0.08 0.00 0.00 -2.36 0.00 0.00 39.78 37.89 1bqc n ASN 55 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1bqc n GLY 56 N 1.17 1.12 0.14 4.83 0.00 -1.25 -4.75 105.19 106.46 1bqc n GLY 56 Ca 0.17 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.08 1bqc n GLY 56 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1bqc h VAL 57 N 0.00 1.27 0.00 1.61 2.07 -1.93 -3.38 116.25 115.89 1bqc h VAL 57 Ca 0.00 -0.95 -0.23 0.00 0.82 0.00 0.00 66.70 66.34 1bqc h VAL 57 Cb 0.00 1.47 -0.04 0.00 -1.52 0.00 0.00 31.29 31.19 1bqc h VAL 57 CO 0.00 0.29 -1.89 0.54 0.02 0.00 0.00 177.57 176.53 1bqc n ARG 58 N -4.65 0.67 -1.47 1.57 1.74 -1.26 -4.97 116.66 108.28 1bqc n ARG 58 Ca -0.04 0.07 0.00 0.00 -0.77 0.00 0.00 57.85 57.11 1bqc n ARG 58 Cb 0.25 -1.31 0.00 0.00 -1.02 0.00 0.00 32.46 30.38 1bqc n ARG 58 CO 0.00 0.00 0.00 0.91 -1.52 0.00 0.00 177.63 177.02 1bqc n TRP 59 N -2.87 -0.46 -3.05 -1.55 8.01 -1.26 -5.10 117.44 111.16 1bqc n TRP 59 Ca -0.26 0.00 -0.40 0.00 -1.31 0.00 0.00 57.50 55.53 1bqc n TRP 59 Cb 0.81 0.00 -0.05 0.00 -2.01 0.00 0.00 31.31 30.07 1bqc n TRP 59 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.69 175.56 1bqc s SER 60 N -0.70 6.91 0.36 -0.99 0.01 -1.26 -3.76 113.70 114.28 1bqc s SER 60 Ca 0.00 1.10 -0.28 0.00 1.31 0.00 0.00 55.95 58.08 1bqc s SER 60 Cb 0.00 -2.40 -0.11 0.00 0.21 0.00 0.00 66.02 63.71 1bqc s SER 60 CO 0.00 -0.19 1.46 1.17 0.41 0.00 0.00 173.24 176.09 1bqc n LYS 61 N 4.25 2.55 -3.07 12.44 4.81 -1.26 -4.54 118.16 133.34 1bqc n LYS 61 Ca -0.01 0.90 -0.43 0.00 -0.87 0.00 0.00 58.31 57.90 1bqc n LYS 61 Cb 0.51 -2.60 -0.06 0.00 0.02 0.00 0.00 35.03 32.89 1bqc n LYS 61 CO 0.00 0.00 0.00 -0.80 1.17 0.00 0.00 177.40 177.77 1bqc s ASN 62 N -0.08 6.33 1.01 3.14 -0.87 -0.76 -4.92 114.94 118.79 1bqc s ASN 62 Ca 0.55 -0.35 -0.15 0.00 -1.57 0.00 0.00 52.86 51.34 1bqc s ASN 62 Cb -0.50 -2.33 0.20 0.00 -0.02 0.00 0.00 41.25 38.59 1bqc s ASN 62 CO 0.61 -0.84 1.15 -0.83 -2.57 0.00 0.00 177.10 174.62 1bqc s GLY 63 N 2.13 1.60 0.21 0.66 0.00 -1.26 -4.74 107.32 105.93 1bqc s GLY 63 Ca 0.24 -0.70 -0.08 0.00 0.00 0.00 0.00 44.72 44.18 1bqc s GLY 63 CO 0.19 -0.01 1.76 -2.55 0.00 0.00 0.00 173.10 172.49 1bqc h PRO 64 N -1.89 0.46 -0.27 2.90 0.11 -1.96 -0.64 132.00 130.72 1bqc h PRO 64 Ca -0.49 -0.03 -0.10 0.00 0.11 0.00 0.00 66.00 65.49 1bqc h PRO 64 Cb 1.31 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.30 1bqc h PRO 64 CO 0.51 0.31 -0.26 0.77 -0.21 0.00 0.00 178.00 179.12 1bqc h SER 65 N 0.48 0.52 -0.14 -2.05 0.02 -1.99 0.13 113.55 110.52 1bqc h SER 65 Ca 0.32 -0.18 -0.02 0.00 -0.84 0.00 0.00 61.79 61.08 1bqc h SER 65 Cb 0.38 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.77 1bqc h SER 65 CO -0.29 0.77 0.03 -0.78 -1.14 0.00 0.00 176.83 175.41 1bqc h ASP 66 N 0.45 0.22 -0.50 3.07 1.82 -1.77 -1.84 116.42 117.88 1bqc h ASP 66 Ca 0.07 -0.25 -0.05 0.00 -0.39 0.00 0.00 57.03 56.40 1bqc h ASP 66 Cb 0.69 -0.06 -0.02 0.00 0.68 0.00 0.00 39.33 40.61 1bqc h ASP 66 CO 0.05 0.42 0.12 0.58 -1.61 0.00 0.00 179.24 178.80 1bqc h VAL 67 N 0.02 1.23 -0.76 2.25 2.07 -0.86 -0.48 116.25 119.72 1bqc h VAL 67 Ca 0.04 -0.85 0.02 0.00 0.82 0.00 0.00 66.70 66.73 1bqc h VAL 67 Cb 0.29 0.68 -0.04 0.00 -1.52 0.00 0.00 31.29 30.70 1bqc h VAL 67 CO 0.00 0.31 0.50 0.00 0.02 0.00 0.00 177.57 178.40 1bqc h ALA 68 N 1.31 0.99 -0.23 1.67 0.00 -0.64 -0.55 119.26 121.80 1bqc h ALA 68 Ca 0.18 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 1bqc h ALA 68 Cb 0.32 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1bqc h ALA 68 CO 0.00 0.34 0.14 -0.97 0.00 0.00 0.00 179.25 178.76 1bqc h ASN 69 N 1.00 0.28 -0.39 0.00 -0.00 -0.43 -1.00 115.58 115.04 1bqc h ASN 69 Ca 0.29 -0.05 0.06 0.00 -0.00 0.00 0.00 56.30 56.60 1bqc h ASN 69 Cb -0.06 -0.07 -0.05 0.00 -0.00 0.00 0.00 38.32 38.14 1bqc h ASN 69 CO -0.08 0.24 0.09 0.58 -0.00 0.00 0.00 177.43 178.26 1bqc h VAL 70 N 0.29 0.82 -0.74 2.57 2.07 -0.51 -0.68 116.25 120.07 1bqc h VAL 70 Ca 0.08 -0.08 -0.03 0.00 0.82 0.00 0.00 66.70 67.50 1bqc h VAL 70 Cb 0.02 0.58 -0.03 0.00 -1.52 0.00 0.00 31.29 30.33 1bqc h VAL 70 CO -0.02 0.04 0.34 0.40 0.02 0.00 0.00 177.57 178.36 1bqc h ILE 71 N 0.22 1.24 -0.55 4.57 2.04 -0.92 -0.89 117.51 123.21 1bqc h ILE 71 Ca 0.18 -0.68 -0.05 0.00 1.00 0.00 0.00 64.86 65.31 1bqc h ILE 71 Cb 0.21 0.30 -0.03 0.00 -0.74 0.00 0.00 36.82 36.57 1bqc h ILE 71 CO -0.23 0.28 0.13 0.77 0.00 0.00 0.00 178.15 179.10 1bqc h SER 72 N 1.05 0.79 -0.08 1.72 4.64 -0.57 -0.60 113.55 120.51 1bqc h SER 72 Ca 0.25 -0.15 -0.15 0.00 -0.47 0.00 0.00 61.79 61.27 1bqc h SER 72 Cb 0.12 -0.21 -0.01 0.00 -0.31 0.00 0.00 62.40 62.00 1bqc h SER 72 CO -0.03 0.78 -0.48 -0.07 -0.87 0.00 0.00 176.83 176.16 1bqc h LEU 73 N 0.82 0.70 0.24 5.97 3.38 -0.41 0.80 115.31 126.80 1bqc h LEU 73 Ca 0.18 -0.35 -0.01 0.00 0.09 0.00 0.00 57.88 57.79 1bqc h LEU 73 Cb 0.31 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.86 1bqc h LEU 73 CO -0.00 1.06 -0.11 0.00 0.09 0.00 0.00 178.44 179.48 1bqc h LYS 75 N -0.37 0.88 0.00 0.00 1.57 -0.92 -0.19 116.57 117.54 1bqc h LYS 75 Ca -0.03 -0.18 -0.04 0.00 -1.87 0.00 0.00 60.65 58.53 1bqc h LYS 75 Cb 0.28 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.45 1bqc h LYS 75 CO 0.05 0.78 -0.18 1.96 -0.57 0.00 0.00 179.45 181.49 1bqc h GLN 76 N 0.80 0.00 -0.61 3.15 4.20 -0.87 -1.94 115.11 119.84 1bqc h GLN 76 Ca 0.19 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.90 1bqc h GLN 76 Cb 0.26 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.04 1bqc h GLN 76 CO -0.01 0.18 0.00 0.09 -0.67 0.00 0.00 178.83 178.42 1bqc n ASN 77 N -4.21 3.29 -3.56 1.46 3.02 -0.87 -4.96 115.26 109.43 1bqc n ASN 77 Ca -0.02 -2.00 -0.20 0.00 -0.03 0.00 0.00 54.58 52.33 1bqc n ASN 77 Cb 0.25 -0.41 0.07 0.00 -0.61 0.00 0.00 39.78 39.08 1bqc n ASN 77 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1bqc n ARG 78 N 1.30 -6.06 -5.14 3.52 1.74 -0.59 -4.84 116.66 106.60 1bqc n ARG 78 Ca 0.21 0.76 -0.29 0.00 -0.77 0.00 0.00 57.85 57.75 1bqc n ARG 78 Cb 0.52 -5.61 -0.16 0.00 -1.02 0.00 0.00 32.46 26.19 1bqc n ARG 78 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1bqc s LEU 79 N -6.57 2.03 0.18 0.55 1.43 -0.19 -4.72 118.68 111.40 1bqc s LEU 79 Ca 0.07 -0.43 -0.30 0.00 -1.03 0.00 0.00 54.13 52.43 1bqc s LEU 79 Cb -0.03 -1.21 -0.08 0.00 0.03 0.00 0.00 46.19 44.91 1bqc s LEU 79 CO 0.76 0.26 1.10 -0.63 0.23 0.00 0.00 176.35 178.08 1bqc s ILE 80 N -0.40 3.86 -0.35 -0.59 -1.09 -0.41 -4.15 121.20 118.08 1bqc s ILE 80 Ca 0.05 1.61 -0.10 0.00 -2.23 0.00 0.00 60.65 59.98 1bqc s ILE 80 Cb -0.10 -4.03 0.02 0.00 -1.58 0.00 0.00 42.46 36.77 1bqc s ILE 80 CO 0.00 0.28 0.17 0.00 -1.23 0.00 0.00 174.94 174.17 1bqc s MET 82 N 1.56 2.83 0.15 0.00 1.75 0.08 -0.94 119.30 124.73 1bqc s MET 82 Ca 0.03 -1.58 -0.24 0.00 -1.25 0.00 0.00 55.69 52.66 1bqc s MET 82 Cb -0.18 -4.09 -0.08 0.00 2.84 0.00 0.00 34.83 33.31 1bqc s MET 82 CO 0.06 -1.15 0.72 -0.51 -0.65 0.00 0.00 175.02 173.49 1bqc s LEU 83 N 1.54 4.56 -0.02 4.11 1.43 -0.47 -0.30 118.68 129.54 1bqc s LEU 83 Ca 0.04 1.54 -0.02 0.00 -1.03 0.00 0.00 54.13 54.66 1bqc s LEU 83 Cb -0.26 -3.22 0.00 0.00 0.03 0.00 0.00 46.19 42.74 1bqc s LEU 83 CO 0.03 0.21 0.05 -1.83 0.23 0.00 0.00 176.35 175.04 1bqc s GLU 84 N -1.20 0.10 -0.42 1.70 4.04 -0.76 -0.45 118.70 121.71 1bqc s GLU 84 Ca 0.35 -0.00 -0.21 0.00 0.04 0.00 0.00 54.97 55.14 1bqc s GLU 84 Cb -0.22 0.04 0.02 0.00 0.02 0.00 0.00 34.13 33.99 1bqc s GLU 84 CO 0.24 -0.01 0.69 0.08 -1.84 0.00 0.00 175.26 174.41 1bqc s VAL 85 N -0.15 4.79 -0.50 1.83 1.01 -1.21 -1.30 120.40 124.87 1bqc s VAL 85 Ca -0.02 0.36 0.25 0.00 0.00 0.00 0.00 61.98 62.57 1bqc s VAL 85 Cb -0.01 -4.20 0.32 0.00 0.00 0.00 0.00 36.38 32.49 1bqc s VAL 85 CO 0.00 -0.55 1.69 -0.74 0.00 0.00 0.00 175.10 175.51 1bqc h HIS 86 N 8.78 0.00 0.00 5.22 2.76 -1.50 -0.02 115.15 130.38 1bqc h HIS 86 Ca -0.25 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 57.92 1bqc h HIS 86 Cb 1.10 0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.06 1bqc h HIS 86 CO 0.76 0.00 0.00 -0.44 -1.30 0.00 0.00 177.93 176.95 1bqc h ASP 87 N 0.00 0.00 1.07 3.26 5.19 -1.91 -2.30 116.42 121.73 1bqc h ASP 87 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1bqc h ASP 87 Cb 0.86 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.37 1bqc h ASP 87 CO 0.00 0.00 0.00 0.35 -3.12 0.00 0.00 179.24 176.47 1bqc n THR 88 N -2.45 0.66 -1.70 0.35 -2.24 -1.26 -0.70 114.28 106.94 1bqc n THR 88 Ca -0.00 -0.02 -0.58 0.00 -2.27 0.00 0.00 64.05 61.18 1bqc n THR 88 Cb 0.14 -0.84 -0.07 0.00 -2.10 0.00 0.00 70.33 67.46 1bqc n THR 88 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 1bqc n THR 89 N -2.13 0.23 -1.15 4.28 -1.04 -0.87 -1.98 114.28 111.62 1bqc n THR 89 Ca 0.04 -0.04 -0.05 0.00 -2.04 0.00 0.00 64.05 61.96 1bqc n THR 89 Cb 0.32 -1.06 -0.02 0.00 -1.82 0.00 0.00 70.33 67.75 1bqc n THR 89 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1bqc n GLY 90 N 3.94 0.78 3.61 3.41 0.00 0.05 -4.69 105.19 112.28 1bqc n GLY 90 Ca 0.26 -0.54 -0.47 0.00 0.00 0.00 0.00 46.02 45.27 1bqc n GLY 90 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1bqc n TYR 91 N -2.76 1.55 0.00 1.61 9.36 -0.84 -0.51 117.16 125.58 1bqc n TYR 91 Ca -0.05 0.61 0.00 0.00 3.32 0.00 0.00 57.90 61.78 1bqc n TYR 91 Cb 0.22 -2.33 0.00 0.00 -0.63 0.00 0.00 39.34 36.60 1bqc n TYR 91 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1bqc n GLY 92 N 1.93 3.14 1.16 2.98 0.00 -1.26 -1.62 105.19 111.52 1bqc n GLY 92 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 1bqc n GLY 92 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1bqc n GLU 93 N -1.72 0.00 -2.37 1.61 2.13 -0.40 -4.63 120.64 115.26 1bqc n GLU 93 Ca 0.00 0.00 -0.42 0.00 0.66 0.00 0.00 57.16 57.40 1bqc n GLU 93 Cb 0.00 -0.39 -0.03 0.00 0.27 0.00 0.00 31.44 31.30 1bqc n GLU 93 CO 0.00 0.00 0.00 -1.14 -0.41 0.00 0.00 177.13 175.58 1bqc s GLN 94 N -1.94 4.29 0.28 5.31 2.00 0.34 -4.98 119.66 124.97 1bqc s GLN 94 Ca 0.00 1.77 -0.30 0.00 -2.00 0.00 0.00 55.36 54.83 1bqc s GLN 94 Cb 0.00 -3.64 -0.10 0.00 0.80 0.00 0.00 33.01 30.06 1bqc s GLN 94 CO 0.00 -0.57 1.46 0.45 -0.50 0.00 0.00 175.29 176.13 1bqc s SER 95 N 1.82 6.58 -0.33 6.67 0.15 -1.26 -2.93 113.70 124.40 1bqc s SER 95 Ca 0.58 2.77 0.00 0.00 0.70 0.00 0.00 55.95 60.01 1bqc s SER 95 Cb -0.26 -2.63 0.00 0.00 -1.71 0.00 0.00 66.02 61.42 1bqc s SER 95 CO 0.21 -0.74 0.00 0.61 1.20 0.00 0.00 173.24 174.52 1bqc n GLY 96 N 1.81 0.60 3.78 9.45 0.00 -1.26 -5.02 105.19 114.55 1bqc n GLY 96 Ca 0.05 -0.35 -0.34 0.00 0.00 0.00 0.00 46.02 45.39 1bqc n GLY 96 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bqc s ALA 97 N -1.94 2.70 0.51 4.61 0.00 -1.15 -4.51 121.76 121.98 1bqc s ALA 97 Ca 0.00 0.66 -0.18 0.00 0.00 0.00 0.00 51.96 52.44 1bqc s ALA 97 Cb 0.00 -3.31 -0.08 0.00 0.00 0.00 0.00 23.12 19.73 1bqc s ALA 97 CO 0.00 -0.76 1.00 0.45 0.00 0.00 0.00 175.76 176.45 1bqc s SER 98 N -2.12 6.50 0.69 0.00 0.15 0.12 -4.95 113.70 114.09 1bqc s SER 98 Ca 0.69 1.68 -0.07 0.00 0.70 0.00 0.00 55.95 58.95 1bqc s SER 98 Cb -0.20 -2.52 0.05 0.00 -1.71 0.00 0.00 66.02 61.63 1bqc s SER 98 CO 0.29 -0.67 1.01 0.42 1.20 0.00 0.00 173.24 175.50 1bqc s THR 99 N -2.44 2.60 0.29 6.45 -4.23 -1.26 -4.25 115.64 112.80 1bqc s THR 99 Ca 0.61 -0.14 0.05 0.00 -1.18 0.00 0.00 61.69 61.03 1bqc s THR 99 Cb -0.12 -3.12 0.05 0.00 1.34 0.00 0.00 72.50 70.65 1bqc s THR 99 CO 0.28 -0.14 1.71 -0.07 -0.54 0.00 0.00 174.62 175.86 1bqc h LEU 100 N -0.57 0.36 -1.05 4.79 3.38 -1.93 -2.14 115.31 118.15 1bqc h LEU 100 Ca -0.45 -0.14 -0.03 0.00 0.09 0.00 0.00 57.88 57.35 1bqc h LEU 100 Cb 1.30 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 41.92 1bqc h LEU 100 CO 0.61 0.68 0.29 -0.78 0.09 0.00 0.00 178.44 179.33 1bqc h ASP 101 N 0.30 0.88 0.15 -0.43 3.58 -1.94 0.02 116.42 118.99 1bqc h ASP 101 Ca 0.04 -0.11 -0.11 0.00 0.42 0.00 0.00 57.03 57.27 1bqc h ASP 101 Cb 0.75 -0.23 -0.01 0.00 1.72 0.00 0.00 39.33 41.56 1bqc h ASP 101 CO 0.06 0.77 -0.39 1.56 -2.88 0.00 0.00 179.24 178.36 1bqc h GLN 102 N 0.96 0.32 -0.32 0.28 4.20 -1.88 -1.07 115.11 117.60 1bqc h GLN 102 Ca 0.23 -0.15 -0.02 0.00 0.06 0.00 0.00 58.65 58.77 1bqc h GLN 102 Cb 0.15 -0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.91 1bqc h GLN 102 CO -0.02 0.67 0.11 0.00 -0.67 0.00 0.00 178.83 178.91 1bqc h ALA 103 N 1.32 0.41 -0.89 3.87 0.00 -0.70 -2.98 119.26 120.29 1bqc h ALA 103 Ca 0.03 -0.14 0.03 0.00 0.00 0.00 0.00 54.91 54.82 1bqc h ALA 103 Cb 0.81 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 18.43 1bqc h ALA 103 CO 0.06 0.03 0.58 0.28 0.00 0.00 0.00 179.25 180.20 1bqc h VAL 104 N 0.36 1.17 -0.80 0.00 2.07 -0.62 -0.67 116.25 117.76 1bqc h VAL 104 Ca 0.10 -0.39 0.13 0.00 0.82 0.00 0.00 66.70 67.36 1bqc h VAL 104 Cb 0.22 -0.07 -0.09 0.00 -1.52 0.00 0.00 31.29 29.83 1bqc h VAL 104 CO -0.01 0.21 0.40 0.44 0.02 0.00 0.00 177.57 178.63 1bqc h ASP 105 N 1.14 0.48 -0.24 0.57 3.32 -1.09 -0.06 116.42 120.54 1bqc h ASP 105 Ca 0.34 0.08 -0.09 0.00 0.02 0.00 0.00 57.03 57.39 1bqc h ASP 105 Cb -0.04 0.01 -0.00 0.00 0.22 0.00 0.00 39.33 39.51 1bqc h ASP 105 CO -0.10 0.22 -0.18 0.22 -1.72 0.00 0.00 179.24 177.68 1bqc h TYR 106 N 0.60 0.64 -0.66 4.55 3.20 -1.20 -1.74 116.97 122.36 1bqc h TYR 106 Ca 0.42 -0.18 0.04 0.00 3.14 0.00 0.00 58.73 62.15 1bqc h TYR 106 Cb 0.56 -0.14 -0.04 0.00 1.54 0.00 0.00 36.73 38.65 1bqc h TYR 106 CO -0.11 0.85 0.40 -1.49 -1.64 0.00 0.00 178.16 176.18 1bqc h TRP 107 N 0.25 0.75 -0.69 -3.82 4.06 -0.59 -1.18 115.95 114.72 1bqc h TRP 107 Ca 0.04 0.02 -0.01 0.00 2.06 0.00 0.00 58.89 61.01 1bqc h TRP 107 Cb 0.72 -0.24 -0.03 0.00 -1.00 0.00 0.00 29.16 28.61 1bqc h TRP 107 CO 0.07 0.41 0.39 0.82 -3.56 0.00 0.00 178.44 176.58 1bqc h ILE 108 N 0.78 1.20 -0.85 1.49 2.04 -0.89 -1.75 117.51 119.53 1bqc h ILE 108 Ca 0.27 -0.49 -0.00 0.00 1.00 0.00 0.00 64.86 65.64 1bqc h ILE 108 Cb 0.06 0.26 -0.04 0.00 -0.74 0.00 0.00 36.82 36.35 1bqc h ILE 108 CO -0.12 0.22 0.51 -0.08 0.00 0.00 0.00 178.15 178.68 1bqc h GLU 109 N 0.96 1.15 -0.01 2.37 4.81 -0.32 -2.01 114.58 121.51 1bqc h GLU 109 Ca 0.25 -0.10 0.00 0.00 -0.13 0.00 0.00 59.36 59.38 1bqc h GLU 109 Cb 0.00 -0.24 0.00 0.00 0.63 0.00 0.00 28.75 29.14 1bqc h GLU 109 CO -0.04 0.80 0.00 1.28 -0.73 0.00 0.00 179.01 180.32 1bqc n LEU 110 N -4.37 0.14 -0.22 1.64 4.77 -0.62 -4.51 117.00 113.83 1bqc n LEU 110 Ca 0.09 -0.06 -0.01 0.00 -0.03 0.00 0.00 56.01 56.01 1bqc n LEU 110 Cb 0.06 -0.01 0.06 0.00 -2.33 0.00 0.00 43.42 41.20 1bqc n LEU 110 CO 0.37 0.03 0.72 0.50 -1.33 0.00 0.00 177.39 177.68 1bqc h LYS 111 N 0.19 -0.03 -0.16 3.23 3.64 -0.89 -0.86 116.57 121.70 1bqc h LYS 111 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 1bqc h LYS 111 Cb 0.04 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 31.86 1bqc h LYS 111 CO 0.00 -0.02 0.11 0.66 -2.27 0.00 0.00 179.45 177.93 1bqc h SER 112 N -0.03 0.17 1.09 4.20 4.64 -1.83 0.72 113.55 122.51 1bqc h SER 112 Ca 0.31 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.62 1bqc h SER 112 Cb 0.50 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.54 1bqc h SER 112 CO -0.68 0.13 -0.50 -0.37 -0.87 0.00 0.00 176.83 174.53 1bqc h VAL 113 N 0.21 0.00 0.01 0.95 -1.51 -1.52 -3.37 116.25 111.01 1bqc h VAL 113 Ca 0.06 -0.59 -0.37 0.00 -1.23 0.00 0.00 66.70 64.57 1bqc h VAL 113 Cb -0.01 1.27 -0.07 0.00 -2.13 0.00 0.00 31.29 30.36 1bqc h VAL 113 CO -0.01 0.00 -2.37 0.18 -1.23 0.00 0.00 177.57 174.14 1bqc n LEU 114 N -2.29 1.63 -4.76 4.19 4.77 -0.62 -4.84 117.00 115.08 1bqc n LEU 114 Ca 0.03 -0.03 -0.41 0.00 -0.03 0.00 0.00 56.01 55.57 1bqc n LEU 114 Cb 0.46 -0.29 -0.01 0.00 -2.33 0.00 0.00 43.42 41.24 1bqc n LEU 114 CO 0.35 0.73 1.15 -1.10 -1.33 0.00 0.00 177.39 177.19 1bqc s GLN 115 N -2.51 4.18 0.00 3.23 -1.52 0.15 -1.77 119.66 121.40 1bqc s GLN 115 Ca -0.22 2.48 0.00 0.00 -1.95 0.00 0.00 55.36 55.66 1bqc s GLN 115 Cb 0.08 -3.03 0.00 0.00 -0.22 0.00 0.00 33.01 29.84 1bqc s GLN 115 CO 0.72 -0.50 0.00 0.41 -0.25 0.00 0.00 175.29 175.66 1bqc n GLY 116 N 1.46 0.93 1.23 3.09 0.00 -1.26 -4.92 105.19 105.73 1bqc n GLY 116 Ca 0.05 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.12 1bqc n GLY 116 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1bqc n GLU 117 N -2.00 3.24 0.29 1.61 -0.58 -0.73 -4.69 120.64 117.78 1bqc n GLU 117 Ca 0.00 -2.97 0.19 0.00 -0.42 0.00 0.00 57.16 53.97 1bqc n GLU 117 Cb 0.00 -1.96 0.95 0.00 -0.57 0.00 0.00 31.44 29.85 1bqc n GLU 117 CO 0.00 0.00 0.00 0.93 -0.48 0.00 0.00 177.13 177.58 1bqc h GLU 118 N 2.18 0.00 0.00 3.49 3.07 -1.84 -0.15 114.58 121.34 1bqc h GLU 118 Ca 0.06 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.92 1bqc h GLU 118 Cb 1.68 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.59 1bqc h GLU 118 CO 0.36 0.00 -0.13 -0.44 -1.40 0.00 0.00 179.01 177.39 1bqc h ASP 119 N 0.00 0.00 0.00 1.42 3.32 -1.89 -0.79 116.42 118.48 1bqc h ASP 119 Ca 0.00 -0.04 -0.00 0.00 0.02 0.00 0.00 57.03 57.01 1bqc h ASP 119 Cb 0.21 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.76 1bqc h ASP 119 CO 0.00 0.02 -1.09 -1.22 -1.72 0.00 0.00 179.24 175.23 1bqc n TYR 120 N -2.34 0.00 -4.79 4.55 4.01 -0.26 -4.69 117.16 113.64 1bqc n TYR 120 Ca 0.05 0.00 -0.27 0.00 -0.16 0.00 0.00 57.90 57.52 1bqc n TYR 120 Cb 0.45 -0.05 -0.17 0.00 -0.31 0.00 0.00 39.34 39.26 1bqc n TYR 120 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 1bqc s VAL 121 N -2.13 1.41 -0.10 -0.72 1.01 -0.23 -0.86 120.40 118.78 1bqc s VAL 121 Ca -0.01 -0.65 -0.02 0.00 0.00 0.00 0.00 61.98 61.30 1bqc s VAL 121 Cb 0.01 -1.25 -0.03 0.00 0.00 0.00 0.00 36.38 35.11 1bqc s VAL 121 CO 0.08 0.41 -0.02 -0.76 0.00 0.00 0.00 175.10 174.82 1bqc s LEU 122 N 0.45 3.45 -0.36 3.92 1.43 -0.12 -4.59 118.68 122.87 1bqc s LEU 122 Ca -0.13 0.05 -0.10 0.00 -1.03 0.00 0.00 54.13 52.92 1bqc s LEU 122 Cb -0.15 -1.79 0.02 0.00 0.03 0.00 0.00 46.19 44.29 1bqc s LEU 122 CO 0.05 0.32 0.19 -0.63 0.23 0.00 0.00 176.35 176.50 1bqc s ILE 123 N -0.53 4.49 -0.57 -0.59 1.01 -0.88 -1.37 121.20 122.76 1bqc s ILE 123 Ca 0.09 -0.81 -0.19 0.00 0.00 0.00 0.00 60.65 59.74 1bqc s ILE 123 Cb -0.12 -3.47 0.09 0.00 0.01 0.00 0.00 42.46 38.97 1bqc s ILE 123 CO 0.02 -0.17 0.70 0.21 0.00 0.00 0.00 174.94 175.69 1bqc s ASN 124 N 1.55 6.19 0.18 3.58 3.04 0.40 -0.26 114.94 129.62 1bqc s ASN 124 Ca 0.02 -1.28 -0.20 0.00 0.04 0.00 0.00 52.86 51.44 1bqc s ASN 124 Cb -0.19 -2.30 0.11 0.00 -1.54 0.00 0.00 41.25 37.33 1bqc s ASN 124 CO 0.06 -1.07 1.60 0.40 -3.04 0.00 0.00 177.10 175.05 1bqc h ILE 125 N 5.91 0.26 -2.26 -5.21 2.04 -1.46 -3.21 117.51 113.57 1bqc h ILE 125 Ca -0.29 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 65.52 1bqc h ILE 125 Cb 1.09 0.26 -0.23 0.00 -0.74 0.00 0.00 36.82 37.20 1bqc h ILE 125 CO 1.07 0.00 -0.06 -0.83 0.00 0.00 0.00 178.15 178.33 1bqc s GLY 126 N -3.08 -0.49 0.28 5.37 0.00 -1.26 -4.02 107.32 104.12 1bqc s GLY 126 Ca -0.15 1.90 -0.29 0.00 0.00 0.00 0.00 44.72 46.18 1bqc s GLY 126 CO 0.69 1.81 1.39 0.21 0.00 0.00 0.00 173.10 177.20 1bqc s ASN 127 N 0.96 6.69 -0.38 1.64 3.84 -0.02 -4.19 114.94 123.47 1bqc s ASN 127 Ca -0.05 2.68 -0.04 0.00 0.21 0.00 0.00 52.86 55.66 1bqc s ASN 127 Cb -0.05 -2.63 0.01 0.00 -0.55 0.00 0.00 41.25 38.02 1bqc s ASN 127 CO -0.09 -0.64 0.26 -0.62 -2.79 0.00 0.00 177.10 173.22 1bqc n GLU 128 N 1.72 -0.66 0.00 0.43 1.02 -1.26 -2.81 120.64 119.08 1bqc n GLU 128 Ca 0.04 0.16 0.10 0.00 -0.02 0.00 0.00 57.16 57.43 1bqc n GLU 128 Cb 0.41 -0.80 0.49 0.00 -0.02 0.00 0.00 31.44 31.52 1bqc n GLU 128 CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 1bqc n PRO 129 N -1.71 0.22 -4.12 3.49 -0.04 -1.24 -0.77 135.00 130.84 1bqc n PRO 129 Ca -0.11 0.11 -0.15 0.00 -0.04 0.00 0.00 63.50 63.31 1bqc n PRO 129 Cb 0.27 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.11 1bqc n PRO 129 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1bqc s TYR 130 N -2.67 0.71 0.00 0.54 1.51 -1.26 -3.34 117.35 112.84 1bqc s TYR 130 Ca 0.17 -0.39 0.00 0.00 -1.01 0.00 0.00 57.07 55.84 1bqc s TYR 130 Cb 0.13 -0.43 0.00 0.00 -0.11 0.00 0.00 41.96 41.56 1bqc s TYR 130 CO 0.32 -0.05 0.00 0.41 -1.11 0.00 0.00 175.55 175.12 1bqc n GLY 131 N 1.82 1.05 0.54 0.71 0.00 -0.64 -0.48 105.19 108.18 1bqc n GLY 131 Ca -0.20 -1.02 0.07 0.00 0.00 0.00 0.00 46.02 44.87 1bqc n GLY 131 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1bqc n ASN 132 N 0.00 2.12 -4.68 1.61 3.02 -1.26 -1.46 115.26 114.61 1bqc n ASN 132 Ca 0.00 -1.56 -0.44 0.00 -0.03 0.00 0.00 54.58 52.55 1bqc n ASN 132 Cb 0.00 0.00 -0.04 0.00 -0.61 0.00 0.00 39.78 39.14 1bqc n ASN 132 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1bqc n ASP 133 N 0.75 3.87 -0.12 6.41 2.03 -1.26 -4.88 116.55 123.35 1bqc n ASP 133 Ca 0.08 0.97 -0.08 0.00 0.52 0.00 0.00 54.79 56.28 1bqc n ASP 133 Cb 0.34 -1.49 0.00 0.00 -0.72 0.00 0.00 41.12 39.25 1bqc n ASP 133 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 1bqc h SER 134 N 9.09 0.43 -0.14 1.67 0.02 -1.95 -0.50 113.55 122.17 1bqc h SER 134 Ca -0.48 -0.01 -0.04 0.00 -0.84 0.00 0.00 61.79 60.43 1bqc h SER 134 Cb 1.24 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 63.66 1bqc h SER 134 CO 0.94 0.31 -0.00 0.00 -1.14 0.00 0.00 176.83 176.94 1bqc h ALA 135 N 1.15 1.54 0.06 3.77 0.00 -1.99 -1.54 119.26 122.25 1bqc h ALA 135 Ca 0.15 -0.15 -0.29 0.00 0.00 0.00 0.00 54.91 54.61 1bqc h ALA 135 Cb -0.04 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 1bqc h ALA 135 CO -0.04 0.33 -1.57 1.79 0.00 0.00 0.00 179.25 179.76 1bqc h THR 136 N 0.36 1.07 -0.65 0.00 1.35 -1.87 -3.27 112.91 109.89 1bqc h THR 136 Ca 0.08 -2.81 0.01 0.00 -0.55 0.00 0.00 66.41 63.15 1bqc h THR 136 Cb 0.25 2.62 -0.03 0.00 -1.73 0.00 0.00 68.15 69.25 1bqc h THR 136 CO 0.01 0.73 0.43 0.58 -0.25 0.00 0.00 175.52 177.02 1bqc h VAL 137 N 0.03 1.15 0.00 6.82 2.07 -0.90 -0.35 116.25 125.08 1bqc h VAL 137 Ca -0.24 -0.30 0.00 0.00 0.82 0.00 0.00 66.70 66.98 1bqc h VAL 137 Cb 1.98 0.21 0.00 0.00 -1.52 0.00 0.00 31.29 31.96 1bqc h VAL 137 CO 0.12 0.16 0.00 0.00 0.02 0.00 0.00 177.57 177.87 1bqc h ALA 138 N 1.60 1.00 -0.23 1.67 0.00 -1.33 -1.06 119.26 120.91 1bqc h ALA 138 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1bqc h ALA 138 Cb -0.07 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1bqc h ALA 138 CO -0.06 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.19 1bqc n ALA 139 N -2.07 2.48 -0.04 0.00 0.00 -0.15 -4.56 120.51 116.17 1bqc n ALA 139 Ca -0.02 -0.73 -0.08 0.00 0.00 0.00 0.00 53.44 52.61 1bqc n ALA 139 Cb 0.12 -0.97 -0.02 0.00 0.00 0.00 0.00 19.45 18.58 1bqc n ALA 139 CO 0.00 0.00 0.00 2.35 0.00 0.00 0.00 177.50 179.85 1bqc h TRP 140 N 3.49 -0.62 -0.24 0.00 7.01 -1.17 1.00 115.95 125.42 1bqc h TRP 140 Ca 0.00 0.04 -0.03 0.00 2.11 0.00 0.00 58.89 61.01 1bqc h TRP 140 Cb 0.76 0.31 -0.01 0.00 -2.10 0.00 0.00 29.16 28.12 1bqc h TRP 140 CO 0.14 -0.31 0.03 0.00 -2.79 0.00 0.00 178.44 175.51 1bqc h ALA 141 N 0.79 0.32 -0.42 2.65 0.00 -1.81 0.03 119.26 120.81 1bqc h ALA 141 Ca 0.13 -0.19 -0.15 0.00 0.00 0.00 0.00 54.91 54.70 1bqc h ALA 141 Cb 0.45 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 1bqc h ALA 141 CO -0.36 0.01 -0.32 0.00 0.00 0.00 0.00 179.25 178.58 1bqc h THR 142 N 0.20 1.27 -0.51 0.00 1.03 -1.83 -0.27 112.91 112.80 1bqc h THR 142 Ca 0.07 -1.49 -0.07 0.00 -0.01 0.00 0.00 66.41 64.91 1bqc h THR 142 Cb 0.35 1.28 -0.02 0.00 -1.07 0.00 0.00 68.15 68.68 1bqc h THR 142 CO 0.01 0.50 0.05 0.44 -0.01 0.00 0.00 175.52 176.51 1bqc h ASP 143 N 0.80 0.84 -0.36 0.00 3.32 -0.80 -0.76 116.42 119.46 1bqc h ASP 143 Ca 0.08 -0.28 -0.09 0.00 0.02 0.00 0.00 57.03 56.77 1bqc h ASP 143 Cb 0.91 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 40.22 1bqc h ASP 143 CO 0.08 0.91 -0.11 0.74 -1.72 0.00 0.00 179.24 179.14 1bqc h THR 144 N 0.75 1.28 -0.63 0.35 2.02 -0.84 -1.58 112.91 114.25 1bqc h THR 144 Ca 0.15 -1.20 0.04 0.00 0.77 0.00 0.00 66.41 66.17 1bqc h THR 144 Cb 0.45 1.30 -0.04 0.00 -1.74 0.00 0.00 68.15 68.12 1bqc h THR 144 CO 0.02 0.40 0.37 0.28 0.37 0.00 0.00 175.52 176.95 1bqc h SER 145 N 0.51 0.58 -0.77 4.18 0.02 -0.96 -0.99 113.55 116.13 1bqc h SER 145 Ca 0.09 0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 61.03 1bqc h SER 145 Cb 0.64 -0.11 -0.04 0.00 0.14 0.00 0.00 62.40 63.03 1bqc h SER 145 CO 0.04 0.40 0.38 0.00 -1.14 0.00 0.00 176.83 176.51 1bqc h ALA 146 N 1.29 0.99 -0.31 3.77 0.00 -1.01 -0.02 119.26 123.98 1bqc h ALA 146 Ca 0.26 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 1bqc h ALA 146 Cb 0.08 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 1bqc h ALA 146 CO -0.13 0.54 0.08 0.00 0.00 0.00 0.00 179.25 179.74 1bqc h ALA 147 N 1.19 0.41 -0.27 0.00 0.00 -0.89 -0.91 119.26 118.79 1bqc h ALA 147 Ca 0.27 -0.17 0.03 0.00 0.00 0.00 0.00 54.91 55.03 1bqc h ALA 147 Cb 0.10 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 1bqc h ALA 147 CO -0.04 0.07 0.10 0.82 0.00 0.00 0.00 179.25 180.21 1bqc h ILE 148 N 0.35 0.94 -0.66 0.00 2.04 -0.95 -1.67 117.51 117.56 1bqc h ILE 148 Ca 0.10 -0.08 -0.02 0.00 1.00 0.00 0.00 64.86 65.86 1bqc h ILE 148 Cb 0.29 0.69 -0.03 0.00 -0.74 0.00 0.00 36.82 37.02 1bqc h ILE 148 CO 0.00 0.04 0.35 1.56 0.00 0.00 0.00 178.15 180.10 1bqc h GLN 149 N 0.23 0.91 -0.31 2.37 4.20 -0.71 -1.47 115.11 120.33 1bqc h GLN 149 Ca 0.12 -0.10 -0.04 0.00 0.06 0.00 0.00 58.65 58.69 1bqc h GLN 149 Cb 0.08 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 27.66 1bqc h GLN 149 CO -0.11 0.68 0.05 0.00 -0.67 0.00 0.00 178.83 178.78 1bqc h ARG 150 N 0.92 0.52 -0.57 1.46 3.08 -0.85 -1.07 114.38 117.86 1bqc h ARG 150 Ca 0.23 -0.14 0.01 0.00 0.07 0.00 0.00 59.98 60.16 1bqc h ARG 150 Cb 0.04 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.00 1bqc h ARG 150 CO -0.04 0.61 0.37 -0.07 -1.07 0.00 0.00 179.97 179.77 1bqc h LEU 151 N 0.35 0.63 -0.65 3.04 3.38 -0.92 -0.83 115.31 120.31 1bqc h LEU 151 Ca 0.10 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 58.00 1bqc h LEU 151 Cb 0.34 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.91 1bqc h LEU 151 CO 0.01 0.45 0.20 0.03 0.09 0.00 0.00 178.44 179.21 1bqc h ARG 152 N 0.75 1.01 0.00 1.13 2.47 -1.15 -1.54 114.38 117.05 1bqc h ARG 152 Ca 0.22 -0.22 -0.06 0.00 -1.26 0.00 0.00 59.98 58.66 1bqc h ARG 152 Cb -0.06 -0.14 -0.01 0.00 -1.65 0.00 0.00 29.97 28.11 1bqc h ARG 152 CO -0.06 0.89 -0.29 0.00 0.56 0.00 0.00 179.97 181.07 1bqc h ALA 153 N 1.07 1.09 -0.00 0.04 0.00 -0.93 -1.78 119.26 118.74 1bqc h ALA 153 Ca 0.21 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1bqc h ALA 153 Cb 0.30 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1bqc h ALA 153 CO -0.01 0.36 0.00 0.00 0.00 0.00 0.00 179.25 179.60 1bqc n ALA 154 N -2.29 2.66 -0.28 0.00 0.00 -0.34 -4.90 120.51 115.36 1bqc n ALA 154 Ca -0.01 -0.25 0.00 0.00 0.00 0.00 0.00 53.44 53.19 1bqc n ALA 154 Cb 0.43 -1.44 0.00 0.00 0.00 0.00 0.00 19.45 18.44 1bqc n ALA 154 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bqc n GLY 155 N 1.03 0.85 3.71 0.00 0.00 -0.67 -5.06 105.19 105.04 1bqc n GLY 155 Ca 0.23 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.83 1bqc n GLY 155 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1bqc s PHE 156 N -2.03 3.62 -0.34 1.61 0.40 -0.62 -4.90 117.98 115.71 1bqc s PHE 156 Ca 0.00 1.61 0.03 0.00 -0.60 0.00 0.00 56.93 57.97 1bqc s PHE 156 Cb 0.00 -3.19 0.04 0.00 0.51 0.00 0.00 43.02 40.38 1bqc s PHE 156 CO 0.00 -0.30 0.73 0.39 0.70 0.00 0.00 175.22 176.74 1bqc n GLU 157 N 3.74 0.43 -1.11 0.44 1.02 -1.26 -4.39 120.64 119.50 1bqc n GLU 157 Ca 0.06 -0.96 -0.32 0.00 -0.02 0.00 0.00 57.16 55.92 1bqc n GLU 157 Cb 0.50 -1.06 0.12 0.00 -0.02 0.00 0.00 31.44 30.98 1bqc n GLU 157 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 1bqc s HIS 158 N -0.47 1.96 0.14 -0.32 3.76 -1.26 -4.63 115.29 114.48 1bqc s HIS 158 Ca 0.04 1.67 -0.30 0.00 -0.15 0.00 0.00 55.06 56.32 1bqc s HIS 158 Cb 0.03 -3.35 -0.07 0.00 1.11 0.00 0.00 32.58 30.29 1bqc s HIS 158 CO 0.04 -2.55 1.23 0.99 -0.85 0.00 0.00 174.74 173.60 1bqc s THR 159 N -2.40 3.63 -0.07 1.30 2.01 -1.25 -4.93 115.64 113.94 1bqc s THR 159 Ca 0.69 1.28 -0.03 0.00 0.31 0.00 0.00 61.69 63.95 1bqc s THR 159 Cb -0.25 -3.82 -0.04 0.00 0.01 0.00 0.00 72.50 68.41 1bqc s THR 159 CO 0.52 0.16 0.07 -0.76 -0.69 0.00 0.00 174.62 173.93 1bqc s LEU 160 N 0.28 3.94 -0.14 4.42 1.43 0.03 -2.08 118.68 126.57 1bqc s LEU 160 Ca 0.56 0.25 0.01 0.00 -1.03 0.00 0.00 54.13 53.92 1bqc s LEU 160 Cb -0.33 -2.07 0.00 0.00 0.03 0.00 0.00 46.19 43.83 1bqc s LEU 160 CO 0.34 0.35 -0.18 -0.69 0.23 0.00 0.00 176.35 176.40 1bqc s VAL 161 N -1.04 2.42 -0.07 -1.59 1.01 0.64 -0.40 120.40 121.36 1bqc s VAL 161 Ca 0.17 -0.86 0.05 0.00 0.00 0.00 0.00 61.98 61.35 1bqc s VAL 161 Cb -0.12 -1.99 -0.01 0.00 0.00 0.00 0.00 36.38 34.26 1bqc s VAL 161 CO 0.07 0.53 -0.24 0.68 0.00 0.00 0.00 175.10 176.14 1bqc s VAL 162 N 0.76 2.08 0.44 2.92 -7.23 -0.05 -1.28 120.40 118.05 1bqc s VAL 162 Ca -0.07 -1.04 -0.04 0.00 -1.81 0.00 0.00 61.98 59.02 1bqc s VAL 162 Cb -0.16 -1.76 -0.04 0.00 0.56 0.00 0.00 36.38 34.98 1bqc s VAL 162 CO 0.00 0.57 0.72 -1.81 -0.31 0.00 0.00 175.10 174.27 1bqc s ASP 163 N 0.01 6.28 0.57 4.85 1.11 -1.26 -0.53 116.67 127.70 1bqc s ASP 163 Ca -0.09 0.81 -0.06 0.00 0.18 0.00 0.00 52.55 53.38 1bqc s ASP 163 Cb -0.15 -2.19 -0.01 0.00 1.07 0.00 0.00 42.92 41.64 1bqc s ASP 163 CO 0.06 -0.49 0.89 0.00 1.18 0.00 0.00 175.17 176.80 1bqc s ALA 164 N -2.61 3.30 1.03 5.23 0.00 -1.21 -4.71 121.76 122.81 1bqc s ALA 164 Ca 0.45 -0.59 -0.07 0.00 0.00 0.00 0.00 51.96 51.75 1bqc s ALA 164 Cb -0.10 -2.65 0.10 0.00 0.00 0.00 0.00 23.12 20.47 1bqc s ALA 164 CO 0.42 -0.68 0.51 -0.35 0.00 0.00 0.00 175.76 175.65 1bqc n PRO 165 N -2.52 -0.98 -3.50 0.00 -0.04 -1.26 -2.65 135.00 124.04 1bqc n PRO 165 Ca 0.04 -0.79 -0.19 0.00 -0.04 0.00 0.00 63.50 62.51 1bqc n PRO 165 Cb 0.57 -0.59 0.08 0.00 -0.04 0.00 0.00 33.50 33.51 1bqc n PRO 165 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1bqc n ASN 166 N -3.49 -2.96 -3.63 3.54 4.13 -0.54 -1.72 115.26 110.59 1bqc n ASN 166 Ca 0.07 -0.62 -0.26 0.00 1.68 0.00 0.00 54.58 55.44 1bqc n ASN 166 Cb 0.24 -5.00 0.05 0.00 -1.54 0.00 0.00 39.78 33.53 1bqc n ASN 166 CO 0.00 0.00 0.00 0.79 0.28 0.00 0.00 177.26 178.33 1bqc n TRP 167 N -4.34 -2.55 0.00 3.10 7.02 0.37 -1.45 117.44 119.58 1bqc n TRP 167 Ca -0.22 0.90 0.00 0.00 -1.02 0.00 0.00 57.50 57.16 1bqc n TRP 167 Cb 0.64 -4.53 0.00 0.00 -2.42 0.00 0.00 31.31 25.00 1bqc n TRP 167 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1bqc n GLY 168 N -1.82 2.98 0.00 6.99 0.00 -1.01 -4.87 105.19 107.46 1bqc n GLY 168 Ca 0.01 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.15 1bqc n GLY 168 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1bqc n GLN 169 N -2.00 0.01 -4.02 1.61 6.02 -0.53 -1.23 117.38 117.24 1bqc n GLN 169 Ca 0.00 0.00 -0.30 0.00 -0.01 0.00 0.00 57.00 56.69 1bqc n GLN 169 Cb 0.00 -1.50 -0.00 0.00 1.02 0.00 0.00 30.24 29.75 1bqc n GLN 169 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 1bqc n ASP 170 N -1.52 -2.71 0.19 1.08 2.03 -0.70 -4.83 116.55 110.09 1bqc n ASP 170 Ca 0.05 -0.93 0.14 0.00 0.52 0.00 0.00 54.79 54.58 1bqc n ASP 170 Cb 0.34 -3.27 0.56 0.00 -0.72 0.00 0.00 41.12 38.03 1bqc n ASP 170 CO 0.00 0.00 0.00 4.11 -1.92 0.00 0.00 177.20 179.39 1bqc h TRP 171 N -1.79 0.00 -0.00 -0.67 5.08 -1.84 0.10 115.95 116.83 1bqc h TRP 171 Ca -0.60 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.37 1bqc h TRP 171 Cb 1.38 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.54 1bqc h TRP 171 CO 0.56 0.00 -0.16 0.25 -1.28 0.00 0.00 178.44 177.81 1bqc n THR 172 N -2.58 0.00 -2.48 0.12 -2.24 -1.26 -4.92 114.28 100.91 1bqc n THR 172 Ca 0.02 -0.03 -0.20 0.00 -2.27 0.00 0.00 64.05 61.57 1bqc n THR 172 Cb 0.27 -0.16 -0.00 0.00 -2.10 0.00 0.00 70.33 68.34 1bqc n THR 172 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1bqc n ASN 173 N -1.25 -5.75 -0.07 3.42 3.02 0.36 -4.90 115.26 110.09 1bqc n ASN 173 Ca 0.10 -0.06 -0.13 0.00 -0.03 0.00 0.00 54.58 54.47 1bqc n ASN 173 Cb 0.31 -4.74 -0.06 0.00 -0.61 0.00 0.00 39.78 34.68 1bqc n ASN 173 CO 0.00 0.00 0.00 0.74 -2.62 0.00 0.00 177.26 175.38 1bqc h THR 174 N -0.22 1.32 -0.43 3.41 2.02 -1.92 -0.31 112.91 116.78 1bqc h THR 174 Ca -0.48 -1.19 -0.13 0.00 0.77 0.00 0.00 66.41 65.38 1bqc h THR 174 Cb 1.35 1.70 -0.01 0.00 -1.74 0.00 0.00 68.15 69.45 1bqc h THR 174 CO 0.56 0.36 -0.23 -0.03 0.37 0.00 0.00 175.52 176.54 1bqc h MET 175 N 0.08 0.91 -0.64 6.66 1.85 -1.90 -1.47 114.93 120.42 1bqc h MET 175 Ca 0.04 -0.41 0.09 0.00 -0.61 0.00 0.00 59.70 58.81 1bqc h MET 175 Cb 0.60 -0.02 -0.07 0.00 0.43 0.00 0.00 31.60 32.54 1bqc h MET 175 CO 0.03 1.06 0.27 -0.09 -0.40 0.00 0.00 176.91 177.78 1bqc h ARG 176 N 0.73 0.46 -0.00 0.39 2.43 -1.88 0.24 114.38 116.76 1bqc h ARG 176 Ca 0.09 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.23 1bqc h ARG 176 Cb 0.80 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 30.25 1bqc h ARG 176 CO 0.07 0.30 -0.47 0.09 -1.51 0.00 0.00 179.97 178.45 1bqc n ASN 177 N -4.95 0.79 0.00 -3.80 3.02 -0.14 -4.15 115.26 106.03 1bqc n ASN 177 Ca 0.09 -0.59 0.00 0.00 -0.03 0.00 0.00 54.58 54.06 1bqc n ASN 177 Cb 0.27 0.30 0.00 0.00 -0.61 0.00 0.00 39.78 39.74 1bqc n ASN 177 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1bqc n ASN 178 N -1.16 1.23 0.11 6.41 3.02 -0.57 -4.76 115.26 119.54 1bqc n ASN 178 Ca 0.08 -1.47 0.04 0.00 -0.03 0.00 0.00 54.58 53.20 1bqc n ASN 178 Cb 0.34 0.00 0.46 0.00 -0.61 0.00 0.00 39.78 39.98 1bqc n ASN 178 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1bqc h ALA 179 N 0.00 1.69 -0.71 5.41 0.00 -1.11 -2.28 119.26 122.27 1bqc h ALA 179 Ca 0.00 -0.09 0.02 0.00 0.00 0.00 0.00 54.91 54.84 1bqc h ALA 179 Cb 0.43 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.08 1bqc h ALA 179 CO 0.00 0.24 0.45 0.38 0.00 0.00 0.00 179.25 180.32 1bqc h ASP 180 N 0.30 0.76 -0.73 0.00 3.04 -1.85 0.18 116.42 118.11 1bqc h ASP 180 Ca 0.07 -0.01 -0.01 0.00 -3.24 0.00 0.00 57.03 53.85 1bqc h ASP 180 Cb 0.12 -0.17 -0.04 0.00 -1.04 0.00 0.00 39.33 38.20 1bqc h ASP 180 CO -0.00 0.53 0.43 -0.61 -2.04 0.00 0.00 179.24 177.55 1bqc h GLN 181 N 0.90 1.00 -0.24 4.15 4.15 -1.77 -0.81 115.11 122.49 1bqc h GLN 181 Ca 0.27 -0.10 -0.09 0.00 0.77 0.00 0.00 58.65 59.51 1bqc h GLN 181 Cb -0.03 -0.21 -0.00 0.00 0.21 0.00 0.00 27.48 27.45 1bqc h GLN 181 CO -0.09 0.71 -0.20 0.28 -1.93 0.00 0.00 178.83 177.60 1bqc h VAL 182 N 1.00 1.32 -0.88 2.39 2.07 -1.22 -2.66 116.25 118.26 1bqc h VAL 182 Ca 0.26 -1.35 -0.00 0.00 0.82 0.00 0.00 66.70 66.43 1bqc h VAL 182 Cb -0.02 1.67 -0.04 0.00 -1.52 0.00 0.00 31.29 31.37 1bqc h VAL 182 CO -0.05 0.42 0.54 0.22 0.02 0.00 0.00 177.57 178.72 1bqc h TYR 183 N 0.26 1.15 -0.23 1.57 3.20 -0.50 -1.49 116.97 120.93 1bqc h TYR 183 Ca 0.04 0.00 0.02 0.00 3.14 0.00 0.00 58.73 61.93 1bqc h TYR 183 Cb 0.75 -0.38 -0.01 0.00 1.54 0.00 0.00 36.73 38.63 1bqc h TYR 183 CO 0.07 0.76 0.15 0.00 -1.64 0.00 0.00 178.16 177.51 1bqc h ALA 184 N 1.30 1.92 0.00 1.82 0.00 -1.04 -2.32 119.26 120.94 1bqc h ALA 184 Ca 0.32 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.22 1bqc h ALA 184 Cb -0.07 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.66 1bqc h ALA 184 CO -0.06 0.06 0.00 -1.13 0.00 0.00 0.00 179.25 178.11 1bqc n SER 185 N -4.50 0.68 -4.31 0.00 3.41 -0.56 -4.22 113.62 104.11 1bqc n SER 185 Ca 0.01 0.67 -0.46 0.00 -0.26 0.00 0.00 58.87 58.83 1bqc n SER 185 Cb 0.13 -0.82 -0.05 0.00 -0.26 0.00 0.00 64.21 63.22 1bqc n SER 185 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1bqc s ASP 186 N -4.27 6.28 0.64 4.04 -1.08 -0.87 -4.67 116.67 116.73 1bqc s ASP 186 Ca 0.04 -2.00 0.40 0.00 -0.52 0.00 0.00 52.55 50.46 1bqc s ASP 186 Cb 0.09 -2.20 2.20 0.00 -1.46 0.00 0.00 42.92 41.55 1bqc s ASP 186 CO 0.39 -0.78 2.32 -0.65 0.52 0.00 0.00 175.17 176.97 1bqc h PRO 187 N 8.61 0.00 0.00 4.34 0.11 -1.83 -0.82 132.00 142.41 1bqc h PRO 187 Ca -0.20 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.86 1bqc h PRO 187 Cb 1.08 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 1bqc h PRO 187 CO 0.96 0.00 -0.37 1.79 -0.21 0.00 0.00 178.00 180.17 1bqc h THR 188 N 0.00 0.34 0.00 -1.15 1.35 -1.93 -3.47 112.91 108.05 1bqc h THR 188 Ca -0.00 -1.49 0.00 0.00 -0.55 0.00 0.00 66.41 64.37 1bqc h THR 188 Cb 0.03 2.10 0.00 0.00 -1.73 0.00 0.00 68.15 68.55 1bqc h THR 188 CO 0.00 0.19 0.00 0.61 -0.25 0.00 0.00 175.52 176.07 1bqc n GLY 189 N 1.17 0.66 2.61 5.82 0.00 -0.32 -4.90 105.19 110.23 1bqc n GLY 189 Ca 0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 1bqc n GLY 189 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1bqc n ASN 190 N -0.02 7.50 -3.99 1.61 3.02 -1.26 -4.43 115.26 117.68 1bqc n ASN 190 Ca 0.00 -3.43 -0.21 0.00 -0.03 0.00 0.00 54.58 50.91 1bqc n ASN 190 Cb 0.01 -1.27 -0.16 0.00 -0.61 0.00 0.00 39.78 37.76 1bqc n ASN 190 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1bqc s THR 191 N -2.77 0.82 -0.06 3.41 2.01 -1.26 -0.78 115.64 117.00 1bqc s THR 191 Ca 0.45 -0.36 0.05 0.00 0.31 0.00 0.00 61.69 62.14 1bqc s THR 191 Cb 0.18 -0.74 -0.01 0.00 0.01 0.00 0.00 72.50 71.94 1bqc s THR 191 CO -0.10 0.26 -0.21 -0.69 -0.69 0.00 0.00 174.62 173.19 1bqc s VAL 192 N 0.34 1.76 0.28 3.82 1.01 0.47 -4.71 120.40 123.37 1bqc s VAL 192 Ca -0.06 -0.90 -0.15 0.00 0.00 0.00 0.00 61.98 60.88 1bqc s VAL 192 Cb -0.10 -1.51 -0.08 0.00 0.00 0.00 0.00 36.38 34.68 1bqc s VAL 192 CO 0.01 0.50 0.69 -0.36 0.00 0.00 0.00 175.10 175.94 1bqc s PHE 193 N 0.00 3.44 -0.08 5.22 0.08 -0.47 -0.87 117.98 125.30 1bqc s PHE 193 Ca -0.06 1.18 -0.00 0.00 0.12 0.00 0.00 56.93 58.18 1bqc s PHE 193 Cb -0.13 -2.50 0.02 0.00 -0.57 0.00 0.00 43.02 39.84 1bqc s PHE 193 CO 0.04 0.18 -0.05 0.45 -0.10 0.00 0.00 175.22 175.73 1bqc s SER 194 N -2.15 1.75 -0.05 1.36 0.15 0.31 -0.87 113.70 114.20 1bqc s SER 194 Ca 0.50 -0.21 -0.04 0.00 0.70 0.00 0.00 55.95 56.91 1bqc s SER 194 Cb -0.12 -0.65 -0.04 0.00 -1.71 0.00 0.00 66.02 63.50 1bqc s SER 194 CO 0.19 -0.11 0.13 -0.51 1.20 0.00 0.00 173.24 174.14 1bqc s ILE 195 N 1.53 5.22 -0.22 6.45 1.10 -0.47 -3.28 121.20 131.53 1bqc s ILE 195 Ca -0.00 -0.10 -0.05 0.00 -0.51 0.00 0.00 60.65 59.99 1bqc s ILE 195 Cb -0.13 -3.36 -0.02 0.00 0.15 0.00 0.00 42.46 39.10 1bqc s ILE 195 CO -0.05 0.45 0.00 -1.00 -2.11 0.00 0.00 174.94 172.24 1bqc s HIS 196 N -1.16 3.01 -0.36 3.50 3.76 -0.37 -1.36 115.29 122.32 1bqc s HIS 196 Ca 0.21 -0.68 -0.05 0.00 -0.15 0.00 0.00 55.06 54.40 1bqc s HIS 196 Cb -0.12 -2.14 0.06 0.00 1.11 0.00 0.00 32.58 31.49 1bqc s HIS 196 CO 0.11 -0.42 0.12 -1.64 -0.85 0.00 0.00 174.74 172.06 1bqc s MET 197 N 1.42 2.42 0.00 1.40 -1.94 -0.02 -3.83 119.30 118.75 1bqc s MET 197 Ca 0.05 -1.40 0.00 0.00 -1.71 0.00 0.00 55.69 52.63 1bqc s MET 197 Cb -0.15 -3.46 0.00 0.00 2.01 0.00 0.00 34.83 33.23 1bqc s MET 197 CO 0.00 -0.79 0.00 0.66 -0.01 0.00 0.00 175.02 174.88 1bqc n TYR 198 N 4.73 0.00 0.11 -0.03 4.01 -1.26 -3.00 117.16 121.71 1bqc n TYR 198 Ca -0.10 0.00 0.19 0.00 -0.16 0.00 0.00 57.90 57.83 1bqc n TYR 198 Cb 0.43 0.00 0.76 0.00 -0.31 0.00 0.00 39.34 40.22 1bqc n TYR 198 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 1bqc h GLY 199 N 0.00 0.00 2.00 2.72 0.00 -1.76 -0.52 103.07 105.51 1bqc h GLY 199 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.30 1bqc h GLY 199 CO 0.00 0.00 -0.14 -2.08 0.00 0.00 0.00 176.54 174.32 1bqc h VAL 200 N 0.00 0.72 -1.26 4.60 2.07 -1.93 -3.20 116.25 117.24 1bqc h VAL 200 Ca 0.17 -0.55 -0.66 0.00 0.82 0.00 0.00 66.70 66.48 1bqc h VAL 200 Cb 0.82 1.33 -0.33 0.00 -1.52 0.00 0.00 31.29 31.59 1bqc h VAL 200 CO -0.00 0.13 0.33 -1.22 0.02 0.00 0.00 177.57 176.84 1bqc n TYR 201 N -3.83 3.09 0.23 1.57 4.01 -0.20 -4.58 117.16 117.45 1bqc n TYR 201 Ca -0.02 -2.69 0.12 0.00 -0.16 0.00 0.00 57.90 55.15 1bqc n TYR 201 Cb 0.24 -0.96 0.17 0.00 -0.31 0.00 0.00 39.34 38.47 1bqc n TYR 201 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 1bqc h SER 202 N 2.36 0.00 -3.22 7.72 4.64 -1.70 -2.35 113.55 121.00 1bqc h SER 202 Ca 0.51 -0.00 -0.60 0.00 -0.47 0.00 0.00 61.79 61.22 1bqc h SER 202 Cb 0.79 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 62.78 1bqc h SER 202 CO 1.27 0.00 -0.38 -1.10 -0.87 0.00 0.00 176.83 175.75 1bqc s GLN 203 N -3.22 4.16 0.26 4.77 -1.52 -1.26 -4.28 119.66 118.57 1bqc s GLN 203 Ca 0.07 -0.00 -0.05 0.00 -1.95 0.00 0.00 55.36 53.43 1bqc s GLN 203 Cb 0.06 -3.40 0.31 0.00 -0.22 0.00 0.00 33.01 29.76 1bqc s GLN 203 CO 0.68 0.32 1.92 0.00 -0.25 0.00 0.00 175.29 177.95 1bqc h ALA 204 N 6.46 1.32 -0.77 6.09 0.00 -1.95 -2.20 119.26 128.20 1bqc h ALA 204 Ca -0.43 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.42 1bqc h ALA 204 Cb 1.17 -0.38 -0.04 0.00 0.00 0.00 0.00 17.79 18.54 1bqc h ALA 204 CO 0.74 0.61 0.46 0.66 0.00 0.00 0.00 179.25 181.72 1bqc h SER 205 N 1.31 0.93 -0.30 0.00 4.64 -1.99 -0.48 113.55 117.66 1bqc h SER 205 Ca 0.38 -0.05 -0.15 0.00 -0.47 0.00 0.00 61.79 61.50 1bqc h SER 205 Cb -0.07 -0.23 -0.01 0.00 -0.31 0.00 0.00 62.40 61.78 1bqc h SER 205 CO -0.10 0.71 -0.37 0.74 -0.87 0.00 0.00 176.83 176.94 1bqc h THR 206 N 1.07 1.28 0.32 2.95 2.02 -1.81 -1.07 112.91 117.67 1bqc h THR 206 Ca 0.28 -1.54 -0.02 0.00 0.77 0.00 0.00 66.41 65.90 1bqc h THR 206 Cb -0.04 1.40 0.00 0.00 -1.74 0.00 0.00 68.15 67.77 1bqc h THR 206 CO -0.05 0.51 -0.15 0.40 0.37 0.00 0.00 175.52 176.59 1bqc h ILE 207 N 0.69 0.70 -0.87 3.11 2.04 -1.03 -2.37 117.51 119.77 1bqc h ILE 207 Ca 0.06 -0.12 -0.01 0.00 1.00 0.00 0.00 64.86 65.78 1bqc h ILE 207 Cb 0.94 0.77 -0.04 0.00 -0.74 0.00 0.00 36.82 37.74 1bqc h ILE 207 CO 0.09 0.03 0.49 0.74 0.00 0.00 0.00 178.15 179.49 1bqc h THR 208 N -0.50 1.25 -0.54 -0.27 2.02 -1.06 -1.28 112.91 112.53 1bqc h THR 208 Ca -0.04 -0.61 0.02 0.00 0.77 0.00 0.00 66.41 66.55 1bqc h THR 208 Cb 0.38 0.07 -0.04 0.00 -1.74 0.00 0.00 68.15 66.82 1bqc h THR 208 CO 0.07 0.28 0.32 -1.28 0.37 0.00 0.00 175.52 175.28 1bqc h SER 209 N 1.21 0.52 -0.07 4.18 0.87 -1.17 -0.05 113.55 119.05 1bqc h SER 209 Ca 0.31 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.86 1bqc h SER 209 Cb 0.02 -0.11 -0.00 0.00 -0.44 0.00 0.00 62.40 61.87 1bqc h SER 209 CO -0.05 0.37 0.01 0.22 -0.53 0.00 0.00 176.83 176.84 1bqc h TYR 210 N 0.64 0.12 -0.56 2.24 5.03 -0.86 -1.63 116.97 121.95 1bqc h TYR 210 Ca 0.22 -0.02 -0.08 0.00 2.58 0.00 0.00 58.73 61.43 1bqc h TYR 210 Cb 0.02 -0.03 -0.02 0.00 1.55 0.00 0.00 36.73 38.25 1bqc h TYR 210 CO -0.06 0.35 0.04 -0.07 -1.32 0.00 0.00 178.16 177.10 1bqc h LEU 211 N -0.14 0.94 -1.17 2.82 3.38 -1.10 -2.61 115.31 117.43 1bqc h LEU 211 Ca 0.02 -0.29 -0.09 0.00 0.09 0.00 0.00 57.88 57.61 1bqc h LEU 211 Cb 0.30 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 1bqc h LEU 211 CO 0.00 1.00 -0.41 -0.33 0.09 0.00 0.00 178.44 178.79 1bqc h GLU 212 N 0.86 0.01 -0.20 1.13 5.08 -1.02 -1.61 114.58 118.83 1bqc h GLU 212 Ca 0.16 -0.00 0.03 0.00 -1.00 0.00 0.00 59.36 58.55 1bqc h GLU 212 Cb 0.49 -0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.71 1bqc h GLU 212 CO 0.02 0.42 0.02 1.25 -1.00 0.00 0.00 179.01 179.71 1bqc h HIS 213 N 0.01 0.02 -0.21 4.33 2.76 -0.90 0.23 115.15 121.39 1bqc h HIS 213 Ca -0.00 0.01 -0.03 0.00 -2.20 0.00 0.00 60.37 58.15 1bqc h HIS 213 Cb 0.72 0.02 -0.01 0.00 1.55 0.00 0.00 27.41 29.70 1bqc h HIS 213 CO 0.00 -0.01 -0.00 0.74 -1.30 0.00 0.00 177.93 177.36 1bqc h PHE 214 N 0.09 0.41 -0.18 5.26 -1.00 -1.37 -2.43 116.94 117.72 1bqc h PHE 214 Ca 0.09 -0.07 -0.00 0.00 2.81 0.00 0.00 57.97 60.80 1bqc h PHE 214 Cb 0.10 -0.11 -0.01 0.00 3.61 0.00 0.00 35.95 39.55 1bqc h PHE 214 CO -0.16 0.57 0.10 0.28 -1.61 0.00 0.00 178.31 177.48 1bqc h VAL 215 N 0.14 1.10 -0.28 -0.55 2.07 -1.01 -0.54 116.25 117.18 1bqc h VAL 215 Ca 0.06 -0.27 -0.01 0.00 0.82 0.00 0.00 66.70 67.30 1bqc h VAL 215 Cb 0.41 0.95 -0.01 0.00 -1.52 0.00 0.00 31.29 31.12 1bqc h VAL 215 CO 0.01 0.09 0.13 0.78 0.02 0.00 0.00 177.57 178.60 1bqc h ASN 216 N 0.19 0.34 0.65 0.57 2.35 -0.58 -2.43 115.58 116.66 1bqc h ASN 216 Ca 0.06 -0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.79 1bqc h ASN 216 Cb 0.06 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 38.35 1bqc h ASN 216 CO -0.01 0.30 -0.34 0.00 -1.65 0.00 0.00 177.43 175.72 1bqc n ALA 217 N -2.49 3.17 -1.04 -0.83 0.00 -0.92 -4.94 120.51 113.46 1bqc n ALA 217 Ca 0.01 -0.27 -0.01 0.00 0.00 0.00 0.00 53.44 53.16 1bqc n ALA 217 Cb 0.11 -1.23 -0.00 0.00 0.00 0.00 0.00 19.45 18.33 1bqc n ALA 217 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bqc n GLY 218 N 1.50 0.47 3.61 0.00 0.00 -0.56 -5.01 105.19 105.19 1bqc n GLY 218 Ca 0.06 -1.04 -0.41 0.00 0.00 0.00 0.00 46.02 44.63 1bqc n GLY 218 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1bqc s LEU 219 N -0.26 4.12 0.33 0.99 1.43 -0.32 -3.92 118.68 121.04 1bqc s LEU 219 Ca 0.00 0.55 -0.29 0.00 -1.03 0.00 0.00 54.13 53.36 1bqc s LEU 219 Cb 0.00 -2.94 -0.11 0.00 0.03 0.00 0.00 46.19 43.17 1bqc s LEU 219 CO 0.00 -0.54 1.48 -2.16 0.23 0.00 0.00 176.35 175.36 1bqc s PRO 220 N 2.77 4.17 -0.07 1.29 0.04 -1.25 -4.39 135.00 137.57 1bqc s PRO 220 Ca 0.29 2.48 -0.12 0.00 0.04 0.00 0.00 61.00 63.69 1bqc s PRO 220 Cb -0.15 -3.02 0.02 0.00 0.04 0.00 0.00 34.50 31.40 1bqc s PRO 220 CO 0.12 -0.49 0.29 -1.17 0.04 0.00 0.00 177.00 175.79 1bqc s LEU 221 N -1.41 0.91 0.16 -3.56 2.96 -1.26 -1.37 118.68 115.11 1bqc s LEU 221 Ca 0.56 0.37 0.07 0.00 -0.22 0.00 0.00 54.13 54.90 1bqc s LEU 221 Cb -0.45 1.08 -0.04 0.00 0.50 0.00 0.00 46.19 47.27 1bqc s LEU 221 CO 0.55 -0.24 -0.14 0.27 -1.32 0.00 0.00 176.35 175.47 1bqc s ILE 222 N -0.46 1.51 -0.89 6.68 -4.36 -0.05 -4.18 121.20 119.46 1bqc s ILE 222 Ca -0.06 -1.98 -0.15 0.00 -0.26 0.00 0.00 60.65 58.21 1bqc s ILE 222 Cb -0.04 -1.81 0.20 0.00 1.25 0.00 0.00 42.46 42.07 1bqc s ILE 222 CO 0.02 -0.52 0.90 -0.63 0.24 0.00 0.00 174.94 174.95 1bqc s ILE 223 N -2.62 5.42 -0.06 8.37 1.01 -0.06 -1.37 121.20 131.90 1bqc s ILE 223 Ca 0.16 -2.35 0.31 0.00 0.00 0.00 0.00 60.65 58.77 1bqc s ILE 223 Cb -0.02 -4.57 0.36 0.00 0.01 0.00 0.00 42.46 38.24 1bqc s ILE 223 CO 0.04 -1.18 1.90 1.23 0.00 0.00 0.00 174.94 176.94 1bqc h GLY 224 N 8.37 0.00 -4.89 6.18 0.00 -1.47 0.12 103.07 111.38 1bqc h GLY 224 Ca 0.13 0.00 -0.13 0.00 0.00 0.00 0.00 47.33 47.33 1bqc h GLY 224 CO 0.87 0.00 -0.32 -0.54 0.00 0.00 0.00 176.54 176.55 1bqc s GLU 225 N -3.55 0.52 0.02 4.80 2.02 -1.15 -4.49 118.70 116.87 1bqc s GLU 225 Ca 0.02 0.08 -0.28 0.00 0.02 0.00 0.00 54.97 54.81 1bqc s GLU 225 Cb 0.09 0.24 0.08 0.00 0.10 0.00 0.00 34.13 34.63 1bqc s GLU 225 CO 0.54 -0.12 0.71 -0.59 0.02 0.00 0.00 175.26 175.82 1bqc s PHE 226 N -0.66 -0.54 0.00 1.61 -0.71 -1.20 -0.84 117.98 115.64 1bqc s PHE 226 Ca -0.08 0.67 0.00 0.00 -1.04 0.00 0.00 56.93 56.48 1bqc s PHE 226 Cb -0.04 0.49 0.00 0.00 -1.21 0.00 0.00 43.02 42.25 1bqc s PHE 226 CO 0.02 -0.66 0.00 0.41 -1.34 0.00 0.00 175.22 173.65 1bqc n GLY 227 N 0.28 6.09 3.57 1.99 0.00 -1.16 -2.03 105.19 113.93 1bqc n GLY 227 Ca -0.16 -2.09 -0.26 0.00 0.00 0.00 0.00 46.02 43.51 1bqc n GLY 227 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1bqc s HIS 228 N 0.44 2.38 -1.29 1.61 -3.43 -1.26 -4.34 115.29 109.40 1bqc s HIS 228 Ca 0.00 -0.72 0.10 0.00 -0.80 0.00 0.00 55.06 53.64 1bqc s HIS 228 Cb 0.00 -1.63 0.50 0.00 -1.43 0.00 0.00 32.58 30.01 1bqc s HIS 228 CO 0.00 0.36 1.26 -0.40 -2.00 0.00 0.00 174.74 173.96 1bqc n ASP 229 N -0.89 0.00 -1.26 7.38 5.68 -0.91 -0.90 116.55 125.65 1bqc n ASP 229 Ca -0.04 0.26 0.11 0.00 -0.50 0.00 0.00 54.79 54.61 1bqc n ASP 229 Cb 0.67 -0.36 0.30 0.00 -1.14 0.00 0.00 41.12 40.59 1bqc n ASP 229 CO 0.00 0.00 0.00 1.41 -1.33 0.00 0.00 177.20 177.28 1bqc n HIS 230 N -1.36 0.91 -4.06 2.11 8.25 -1.26 -4.52 115.22 115.29 1bqc n HIS 230 Ca 0.04 -0.50 -0.22 0.00 -0.26 0.00 0.00 57.72 56.78 1bqc n HIS 230 Cb 0.09 -0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.16 1bqc n HIS 230 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1bqc s SER 231 N -1.00 5.78 -0.43 0.41 0.15 -0.08 -4.99 113.70 113.55 1bqc s SER 231 Ca 0.46 -0.13 -0.42 0.00 0.70 0.00 0.00 55.95 56.56 1bqc s SER 231 Cb 0.24 -1.56 -0.17 0.00 -1.71 0.00 0.00 66.02 62.82 1bqc s SER 231 CO 0.31 -0.03 2.00 -0.67 1.20 0.00 0.00 173.24 176.05 1bqc n ASP 232 N -1.14 1.43 0.00 5.45 2.03 -1.26 0.79 116.55 123.86 1bqc n ASP 232 Ca -0.08 0.76 0.00 0.00 0.52 0.00 0.00 54.79 55.99 1bqc n ASP 232 Cb 0.57 -1.03 0.00 0.00 -0.72 0.00 0.00 41.12 39.95 1bqc n ASP 232 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1bqc n GLY 233 N 6.17 3.36 3.08 0.27 0.00 -1.26 -3.83 105.19 112.97 1bqc n GLY 233 Ca 0.43 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.31 1bqc n GLY 233 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1bqc n ASN 234 N 0.01 -4.53 -4.73 1.61 4.13 0.24 -4.34 115.26 107.64 1bqc n ASN 234 Ca 0.00 -0.59 -0.40 0.00 1.68 0.00 0.00 54.58 55.26 1bqc n ASN 234 Cb 0.00 -4.62 0.02 0.00 -1.54 0.00 0.00 39.78 33.64 1bqc n ASN 234 CO 0.00 0.00 0.00 -0.81 0.28 0.00 0.00 177.26 176.73 1bqc n PRO 235 N -3.30 2.04 -2.75 3.52 -0.04 -1.25 -4.19 135.00 129.01 1bqc n PRO 235 Ca -0.14 0.73 -0.43 0.00 -0.04 0.00 0.00 63.50 63.62 1bqc n PRO 235 Cb 0.62 -2.51 -0.02 0.00 -0.04 0.00 0.00 33.50 31.56 1bqc n PRO 235 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1bqc s ASP 236 N -0.55 6.74 0.42 3.54 -1.08 -0.88 -2.14 116.67 122.72 1bqc s ASP 236 Ca 0.62 -2.18 0.12 0.00 -0.52 0.00 0.00 52.55 50.58 1bqc s ASP 236 Cb -0.47 -2.49 0.89 0.00 -1.46 0.00 0.00 42.92 39.39 1bqc s ASP 236 CO 0.57 -1.14 1.96 1.05 0.52 0.00 0.00 175.17 178.13 1bqc h GLU 237 N 8.44 0.15 -0.50 4.34 9.09 -1.90 -1.41 114.58 132.79 1bqc h GLU 237 Ca 0.27 -0.03 0.02 0.00 0.05 0.00 0.00 59.36 59.67 1bqc h GLU 237 Cb 0.95 -0.02 -0.03 0.00 -1.65 0.00 0.00 28.75 28.00 1bqc h GLU 237 CO 1.30 0.29 0.31 -0.44 0.05 0.00 0.00 179.01 180.52 1bqc h ASP 238 N 0.14 0.51 -0.39 3.06 3.32 -1.94 -0.14 116.42 120.99 1bqc h ASP 238 Ca 0.03 -0.00 -0.16 0.00 0.02 0.00 0.00 57.03 56.92 1bqc h ASP 238 Cb 0.32 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.76 1bqc h ASP 238 CO 0.02 0.37 -0.38 0.74 -1.72 0.00 0.00 179.24 178.26 1bqc h THR 239 N 0.62 1.27 -0.16 0.35 2.02 -1.86 -1.07 112.91 114.09 1bqc h THR 239 Ca 0.19 -1.56 0.02 0.00 0.77 0.00 0.00 66.41 65.84 1bqc h THR 239 Cb -0.02 1.38 -0.02 0.00 -1.74 0.00 0.00 68.15 67.75 1bqc h THR 239 CO -0.07 0.52 0.03 0.40 0.37 0.00 0.00 175.52 176.77 1bqc h ILE 240 N 0.77 0.92 -0.37 3.11 2.04 -0.99 0.40 117.51 123.39 1bqc h ILE 240 Ca 0.06 -0.03 -0.16 0.00 1.00 0.00 0.00 64.86 65.73 1bqc h ILE 240 Cb 0.98 0.82 -0.01 0.00 -0.74 0.00 0.00 36.82 37.88 1bqc h ILE 240 CO 0.10 0.02 -0.40 0.24 0.00 0.00 0.00 178.15 178.10 1bqc h MET 241 N 0.09 0.92 -0.43 2.37 2.86 -1.03 -0.84 114.93 118.86 1bqc h MET 241 Ca 0.07 -0.49 -0.07 0.00 -2.06 0.00 0.00 59.70 57.15 1bqc h MET 241 Cb 0.07 0.02 -0.02 0.00 0.06 0.00 0.00 31.60 31.73 1bqc h MET 241 CO -0.10 1.14 -0.00 0.00 1.06 0.00 0.00 176.91 179.01 1bqc h ALA 242 N 0.79 0.59 -0.25 6.32 0.00 -1.05 -1.82 119.26 123.83 1bqc h ALA 242 Ca 0.06 -0.27 -0.15 0.00 0.00 0.00 0.00 54.91 54.55 1bqc h ALA 242 Cb 0.99 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 1bqc h ALA 242 CO 0.10 0.38 -0.45 0.93 0.00 0.00 0.00 179.25 180.20 1bqc h GLU 243 N 0.61 0.64 -0.76 0.00 4.39 -0.88 0.79 114.58 119.36 1bqc h GLU 243 Ca 0.12 -0.35 -0.00 0.00 0.34 0.00 0.00 59.36 59.47 1bqc h GLU 243 Cb 0.49 0.02 -0.04 0.00 -0.10 0.00 0.00 28.75 29.12 1bqc h GLU 243 CO 0.02 0.96 0.46 0.00 -1.16 0.00 0.00 179.01 179.29 1bqc h ALA 244 N 0.99 0.97 -0.30 3.43 0.00 -1.07 0.56 119.26 123.84 1bqc h ALA 244 Ca 0.03 -0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.80 1bqc h ALA 244 Cb 0.98 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 1bqc h ALA 244 CO 0.09 0.44 -0.03 1.49 0.00 0.00 0.00 179.25 181.24 1bqc h GLU 245 N 1.04 0.55 -0.62 0.00 4.57 -1.12 0.18 114.58 119.19 1bqc h GLU 245 Ca 0.27 -0.19 -0.01 0.00 -1.18 0.00 0.00 59.36 58.25 1bqc h GLU 245 Cb -0.03 -0.04 -0.03 0.00 -0.16 0.00 0.00 28.75 28.48 1bqc h GLU 245 CO -0.05 0.72 0.33 -0.09 -1.18 0.00 0.00 179.01 178.74 1bqc h ARG 246 N 0.33 0.87 -0.07 1.92 2.43 -0.46 -2.60 114.38 116.81 1bqc h ARG 246 Ca 0.08 -0.11 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 1bqc h ARG 246 Cb 0.49 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 29.87 1bqc h ARG 246 CO 0.02 0.67 0.00 1.28 -1.51 0.00 0.00 179.97 180.43 1bqc n LEU 247 N -4.54 1.42 -3.57 3.80 4.77 0.15 -4.95 117.00 114.08 1bqc n LEU 247 Ca 0.04 -0.53 -0.22 0.00 -0.03 0.00 0.00 56.01 55.27 1bqc n LEU 247 Cb 0.10 -0.04 0.05 0.00 -2.33 0.00 0.00 43.42 41.20 1bqc n LEU 247 CO 0.37 0.26 -0.04 0.29 -1.33 0.00 0.00 177.39 176.95 1bqc n LYS 248 N 0.12 -3.40 -4.52 3.23 5.02 -0.25 -5.01 118.16 113.35 1bqc n LYS 248 Ca 0.18 0.65 -0.31 0.00 -2.02 0.00 0.00 58.31 56.81 1bqc n LYS 248 Cb 0.32 -5.09 -0.11 0.00 -0.02 0.00 0.00 35.03 30.13 1bqc n LYS 248 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1bqc s LEU 249 N -6.30 2.93 0.54 -0.35 1.43 0.48 -4.98 118.68 112.44 1bqc s LEU 249 Ca 0.24 -0.28 -0.19 0.00 -1.03 0.00 0.00 54.13 52.86 1bqc s LEU 249 Cb -0.06 -1.70 -0.06 0.00 0.03 0.00 0.00 46.19 44.40 1bqc s LEU 249 CO 0.80 0.26 1.11 -0.83 0.23 0.00 0.00 176.35 177.93 1bqc s GLY 250 N -1.50 2.57 0.00 -3.19 0.00 -1.26 -4.58 107.32 99.35 1bqc s GLY 250 Ca 0.17 0.76 -0.03 0.00 0.00 0.00 0.00 44.72 45.61 1bqc s GLY 250 CO 0.07 1.11 0.06 -2.52 0.00 0.00 0.00 173.10 171.81 1bqc s TYR 251 N -1.86 0.10 -0.16 1.90 -0.85 -0.31 -0.88 117.35 115.28 1bqc s TYR 251 Ca 0.71 -0.21 -0.03 0.00 -0.52 0.00 0.00 57.07 57.02 1bqc s TYR 251 Cb -0.22 -0.09 0.05 0.00 0.38 0.00 0.00 41.96 42.09 1bqc s TYR 251 CO 0.27 -0.19 0.04 0.42 -1.52 0.00 0.00 175.55 174.57 1bqc s ILE 252 N -1.07 0.33 0.65 -3.49 1.01 0.42 -2.12 121.20 116.93 1bqc s ILE 252 Ca -0.12 -0.31 -0.11 0.00 0.00 0.00 0.00 60.65 60.11 1bqc s ILE 252 Cb -0.07 -0.81 -0.02 0.00 0.01 0.00 0.00 42.46 41.58 1bqc s ILE 252 CO 0.00 -0.13 1.04 -0.83 0.00 0.00 0.00 174.94 175.03 1bqc s GLY 253 N 1.96 1.69 -0.18 6.18 0.00 -0.43 -2.93 107.32 113.60 1bqc s GLY 253 Ca 0.01 0.02 -0.01 0.00 0.00 0.00 0.00 44.72 44.73 1bqc s GLY 253 CO -0.08 0.30 -0.11 0.86 0.00 0.00 0.00 173.10 174.08 1bqc s TRP 254 N -3.08 2.86 0.26 1.90 -0.11 -0.86 -1.39 118.94 118.52 1bqc s TRP 254 Ca 0.57 -1.04 -0.14 0.00 1.22 0.00 0.00 56.10 56.70 1bqc s TRP 254 Cb -0.13 -1.98 0.00 0.00 -1.50 0.00 0.00 33.47 29.86 1bqc s TRP 254 CO 0.53 -0.52 0.53 -1.54 -4.62 0.00 0.00 176.95 171.33 1bqc s SER 255 N 1.11 -0.12 0.11 5.86 1.04 -0.50 -4.72 113.70 116.49 1bqc s SER 255 Ca 0.01 -0.87 -0.28 0.00 0.48 0.00 0.00 55.95 55.29 1bqc s SER 255 Cb -0.14 0.62 -0.09 0.00 0.10 0.00 0.00 66.02 66.50 1bqc s SER 255 CO -0.03 -1.19 1.63 -0.25 0.98 0.00 0.00 173.24 174.38 1bqc h TRP 256 N 2.20 -0.77 -2.44 5.02 -0.00 -1.30 -1.15 115.95 117.50 1bqc h TRP 256 Ca -0.25 0.02 0.14 0.00 -0.00 0.00 0.00 58.89 58.80 1bqc h TRP 256 Cb 1.25 0.32 -0.03 0.00 -0.00 0.00 0.00 29.16 30.71 1bqc h TRP 256 CO 0.42 -0.39 0.53 0.45 -0.00 0.00 0.00 178.44 179.44 1bqc n SER 257 N -5.40 -1.53 -0.25 2.65 2.88 -1.26 -1.17 113.62 109.54 1bqc n SER 257 Ca -0.07 -1.79 -0.03 0.00 -1.33 0.00 0.00 58.87 55.64 1bqc n SER 257 Cb 0.31 2.48 -0.01 0.00 -0.75 0.00 0.00 64.21 66.24 1bqc n SER 257 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1bqc n GLY 258 N -0.65 0.64 3.76 0.46 0.00 -1.26 -4.70 105.19 103.44 1bqc n GLY 258 Ca -0.02 -0.63 -0.39 0.00 0.00 0.00 0.00 46.02 44.98 1bqc n GLY 258 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1bqc s ASN 259 N -2.70 5.77 1.06 1.61 0.01 -1.26 -4.98 114.94 114.45 1bqc s ASN 259 Ca 0.00 2.81 -0.17 0.00 -0.71 0.00 0.00 52.86 54.80 1bqc s ASN 259 Cb 0.00 -2.64 0.23 0.00 0.41 0.00 0.00 41.25 39.24 1bqc s ASN 259 CO 0.00 -1.24 1.19 -0.83 -1.51 0.00 0.00 177.10 174.71 1bqc s GLY 260 N -0.71 1.65 0.23 0.66 0.00 -1.26 -4.51 107.32 103.38 1bqc s GLY 260 Ca 0.64 -0.93 -0.07 0.00 0.00 0.00 0.00 44.72 44.36 1bqc s GLY 260 CO 0.52 -0.16 1.30 0.61 0.00 0.00 0.00 173.10 175.37 1bqc n GLY 261 N -2.14 -1.39 0.15 0.20 0.00 -1.26 -0.27 105.19 100.47 1bqc n GLY 261 Ca 0.12 0.89 0.13 0.00 0.00 0.00 0.00 46.02 47.16 1bqc n GLY 261 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1bqc h GLY 262 N 0.00 0.00 -3.69 -0.02 0.00 -2.03 -3.36 103.07 93.97 1bqc h GLY 262 Ca 0.40 0.00 -0.28 0.00 0.00 0.00 0.00 47.33 47.45 1bqc h GLY 262 CO -0.86 0.00 -0.91 -0.62 0.00 0.00 0.00 176.54 174.15 1bqc n VAL 263 N -2.43 1.54 0.27 4.60 0.31 0.62 -4.85 118.33 118.39 1bqc n VAL 263 Ca 0.04 -2.96 0.10 0.00 -0.01 0.00 0.00 64.34 61.51 1bqc n VAL 263 Cb 0.35 0.27 0.73 0.00 -0.91 0.00 0.00 33.84 34.29 1bqc n VAL 263 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 1bqc h GLU 264 N 1.88 0.00 0.00 5.55 5.08 -1.69 1.07 114.58 126.47 1bqc h GLU 264 Ca 0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1bqc h GLU 264 Cb 1.43 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.68 1bqc h GLU 264 CO 0.30 0.03 0.00 2.48 -1.00 0.00 0.00 179.01 180.82 1bqc n TYR 265 N -4.22 0.48 0.75 4.33 0.18 -1.26 -1.24 117.16 116.17 1bqc n TYR 265 Ca -0.03 0.22 0.09 0.00 1.88 0.00 0.00 57.90 60.06 1bqc n TYR 265 Cb 0.11 -0.85 0.27 0.00 -0.38 0.00 0.00 39.34 38.49 1bqc n TYR 265 CO 0.00 0.00 0.00 1.28 -2.08 0.00 0.00 176.86 176.06 1bqc n LEU 266 N -1.96 2.33 -4.73 -3.48 4.77 0.37 -4.85 117.00 109.45 1bqc n LEU 266 Ca 0.01 -1.08 -0.42 0.00 -0.03 0.00 0.00 56.01 54.50 1bqc n LEU 266 Cb 0.11 -0.22 -0.03 0.00 -2.33 0.00 0.00 43.42 40.94 1bqc n LEU 266 CO 0.11 0.54 0.88 -1.81 -1.33 0.00 0.00 177.39 175.78 1bqc s ASP 267 N -1.28 7.10 0.01 -1.43 1.01 -0.38 -1.40 116.67 120.30 1bqc s ASP 267 Ca 0.32 2.12 0.02 0.00 0.71 0.00 0.00 52.55 55.73 1bqc s ASP 267 Cb 0.18 -2.59 -0.25 0.00 1.01 0.00 0.00 42.92 41.26 1bqc s ASP 267 CO 0.25 -0.40 0.88 0.24 0.21 0.00 0.00 175.17 176.35 1bqc h MET 268 N 5.93 0.14 -5.60 8.23 2.86 -0.29 -3.39 114.93 122.81 1bqc h MET 268 Ca -0.43 -0.24 -0.45 0.00 -2.06 0.00 0.00 59.70 56.52 1bqc h MET 268 Cb 1.21 0.09 -0.18 0.00 0.06 0.00 0.00 31.60 32.79 1bqc h MET 268 CO 0.77 0.95 -0.76 0.14 1.06 0.00 0.00 176.91 179.07 1bqc s VAL 269 N -2.63 1.53 -0.16 -2.22 -7.23 -0.32 -1.18 120.40 108.19 1bqc s VAL 269 Ca -0.06 -1.83 -0.23 0.00 -1.81 0.00 0.00 61.98 58.04 1bqc s VAL 269 Cb 0.08 -1.69 -0.02 0.00 0.56 0.00 0.00 36.38 35.30 1bqc s VAL 269 CO 0.84 -0.40 0.73 -0.31 -0.31 0.00 0.00 175.10 175.64 1bqc s TYR 270 N -2.21 3.44 -1.53 2.82 2.02 -0.51 -4.31 117.35 117.06 1bqc s TYR 270 Ca 0.13 1.14 -0.10 0.00 -0.37 0.00 0.00 57.07 57.86 1bqc s TYR 270 Cb -0.05 -2.89 0.08 0.00 -0.40 0.00 0.00 41.96 38.70 1bqc s TYR 270 CO 0.04 -0.15 0.75 0.09 -1.57 0.00 0.00 175.55 174.71 1bqc n ASN 271 N 4.87 -2.79 -2.02 2.29 3.02 -1.26 -1.69 115.26 117.68 1bqc n ASN 271 Ca 0.01 -0.92 -0.18 0.00 -0.03 0.00 0.00 54.58 53.46 1bqc n ASN 271 Cb 0.50 -3.33 -0.04 0.00 -0.61 0.00 0.00 39.78 36.29 1bqc n ASN 271 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1bqc n PHE 272 N -4.47 -0.68 -3.22 3.10 3.01 -1.26 -4.94 117.46 109.00 1bqc n PHE 272 Ca -0.07 0.00 -0.44 0.00 1.01 0.00 0.00 57.45 57.95 1bqc n PHE 272 Cb 0.57 -3.43 -0.07 0.00 -0.01 0.00 0.00 39.48 36.54 1bqc n PHE 272 CO 0.00 0.00 0.00 0.34 1.01 0.00 0.00 176.76 178.11 1bqc s ASP 273 N -2.27 6.22 0.38 4.37 -1.08 -0.68 -4.89 116.67 118.71 1bqc s ASP 273 Ca 0.00 -0.84 0.25 0.00 -0.52 0.00 0.00 52.55 51.44 1bqc s ASP 273 Cb 0.00 -2.26 1.38 0.00 -1.46 0.00 0.00 42.92 40.57 1bqc s ASP 273 CO 0.00 -0.78 1.78 1.23 0.52 0.00 0.00 175.17 177.92 1bqc h GLY 274 N 9.44 0.00 -1.39 2.66 0.00 -1.92 -1.34 103.07 110.52 1bqc h GLY 274 Ca -0.27 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.06 1bqc h GLY 274 CO 0.91 0.00 0.00 1.22 0.00 0.00 0.00 176.54 178.67 1bqc n ASP 275 N -2.39 2.44 -3.82 0.19 8.00 -1.26 -4.70 116.55 115.01 1bqc n ASP 275 Ca -0.02 -1.81 -0.28 0.00 0.71 0.00 0.00 54.79 53.39 1bqc n ASP 275 Cb 0.04 -0.03 -0.12 0.00 -0.02 0.00 0.00 41.12 40.99 1bqc n ASP 275 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 1bqc s ASN 276 N -1.92 4.24 0.40 -2.24 3.04 -0.50 -5.10 114.94 112.86 1bqc s ASN 276 Ca 0.33 -3.64 -0.23 0.00 0.04 0.00 0.00 52.86 49.36 1bqc s ASN 276 Cb 0.20 -1.44 -0.10 0.00 -1.54 0.00 0.00 41.25 38.38 1bqc s ASN 276 CO 0.31 -0.11 0.99 -0.76 -3.04 0.00 0.00 177.10 174.49 1bqc s LEU 277 N -1.09 4.10 0.72 3.21 1.43 -1.26 -1.43 118.68 124.36 1bqc s LEU 277 Ca 0.25 1.87 -0.04 0.00 -1.03 0.00 0.00 54.13 55.18 1bqc s LEU 277 Cb -0.05 -4.29 0.11 0.00 0.03 0.00 0.00 46.19 41.99 1bqc s LEU 277 CO -0.15 -0.37 1.00 -0.94 0.23 0.00 0.00 176.35 176.12 1bqc s SER 278 N -1.81 4.45 0.32 2.29 1.04 -0.32 -4.85 113.70 114.82 1bqc s SER 278 Ca 0.58 -0.04 0.01 0.00 0.48 0.00 0.00 55.95 56.98 1bqc s SER 278 Cb -0.17 -0.44 0.56 0.00 0.10 0.00 0.00 66.02 66.07 1bqc s SER 278 CO 0.21 -1.79 1.97 -0.65 0.98 0.00 0.00 173.24 173.95 1bqc h PRO 279 N -0.59 0.94 -0.30 4.02 0.11 -1.89 0.52 132.00 134.82 1bqc h PRO 279 Ca -0.40 -0.06 -0.04 0.00 0.11 0.00 0.00 66.00 65.61 1bqc h PRO 279 Cb 1.28 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 32.16 1bqc h PRO 279 CO 0.46 0.62 0.04 2.35 -0.21 0.00 0.00 178.00 181.27 1bqc h TRP 280 N 0.97 0.54 -0.44 0.65 -0.00 -1.88 0.06 115.95 115.85 1bqc h TRP 280 Ca 0.31 -0.08 0.03 0.00 -0.00 0.00 0.00 58.89 59.15 1bqc h TRP 280 Cb 0.02 -0.15 -0.04 0.00 -0.00 0.00 0.00 29.16 29.00 1bqc h TRP 280 CO -0.00 0.60 0.23 0.78 -0.00 0.00 0.00 178.44 180.06 1bqc h GLY 281 N 0.32 0.61 0.84 2.65 0.00 -1.30 -0.50 103.07 105.69 1bqc h GLY 281 Ca 0.09 -0.17 0.03 0.00 0.00 0.00 0.00 47.33 47.29 1bqc h GLY 281 CO 0.01 0.12 0.35 0.83 0.00 0.00 0.00 176.54 177.85 1bqc h GLU 282 N 0.47 0.67 0.10 4.80 4.39 -0.83 -1.44 114.58 122.75 1bqc h GLU 282 Ca 0.19 -0.04 -0.01 0.00 0.34 0.00 0.00 59.36 59.84 1bqc h GLU 282 Cb 0.07 -0.15 0.00 0.00 -0.10 0.00 0.00 28.75 28.57 1bqc h GLU 282 CO -0.12 0.44 -0.05 -0.09 -1.16 0.00 0.00 179.01 178.03 1bqc h ARG 283 N 0.69 -0.13 -0.03 2.33 9.65 -0.50 0.21 114.38 126.60 1bqc h ARG 283 Ca 0.24 0.01 -0.17 0.00 -1.10 0.00 0.00 59.98 58.96 1bqc h ARG 283 Cb 0.05 0.03 -0.01 0.00 -1.39 0.00 0.00 29.97 28.65 1bqc h ARG 283 CO -0.11 -0.03 -0.75 0.97 2.80 0.00 0.00 179.97 182.85 1bqc h ILE 284 N -0.20 1.44 0.14 1.20 2.10 -1.05 -1.81 117.51 119.32 1bqc h ILE 284 Ca -0.01 -2.32 -0.30 0.00 1.08 0.00 0.00 64.86 63.31 1bqc h ILE 284 Cb 0.16 2.25 0.00 0.00 -1.09 0.00 0.00 36.82 38.14 1bqc h ILE 284 CO 0.02 0.68 -1.51 -0.26 -1.08 0.00 0.00 178.15 176.00 1bqc h PHE 285 N 0.14 0.53 -0.00 2.19 0.04 -1.29 0.10 116.94 118.65 1bqc h PHE 285 Ca -0.03 -0.38 0.00 0.00 2.80 0.00 0.00 57.97 60.36 1bqc h PHE 285 Cb 1.32 -0.02 0.00 0.00 2.20 0.00 0.00 35.95 39.45 1bqc h PHE 285 CO 0.03 1.59 -0.10 0.66 -0.60 0.00 0.00 178.31 179.88 1bqc n TYR 286 N -3.82 0.00 -2.03 -0.55 4.01 0.72 -0.51 117.16 114.97 1bqc n TYR 286 Ca -0.25 0.00 -0.19 0.00 -0.16 0.00 0.00 57.90 57.30 1bqc n TYR 286 Cb 0.95 0.00 0.12 0.00 -0.31 0.00 0.00 39.34 40.10 1bqc n TYR 286 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1bqc n GLY 287 N 0.66 -0.48 3.65 2.72 0.00 -0.68 -4.90 105.19 106.16 1bqc n GLY 287 Ca 0.03 -1.84 -0.47 0.00 0.00 0.00 0.00 46.02 43.75 1bqc n GLY 287 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1bqc n PRO 288 N -2.72 1.92 -1.64 1.61 -0.02 -1.26 -1.12 135.00 131.76 1bqc n PRO 288 Ca 0.12 0.69 -0.19 0.00 -2.02 0.00 0.00 63.50 62.10 1bqc n PRO 288 Cb 0.42 -2.38 -0.07 0.00 -0.02 0.00 0.00 33.50 31.44 1bqc n PRO 288 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1bqc n ASN 289 N 2.78 -5.30 -4.68 2.55 3.02 -1.26 -4.85 115.26 107.53 1bqc n ASN 289 Ca 0.15 0.41 -0.29 0.00 -0.03 0.00 0.00 54.58 54.82 1bqc n ASN 289 Cb 0.28 -4.45 0.14 0.00 -0.61 0.00 0.00 39.78 35.14 1bqc n ASN 289 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1bqc s GLY 290 N -2.73 1.60 0.09 7.41 0.00 -0.28 -4.84 107.32 108.57 1bqc s GLY 290 Ca 0.00 -0.63 -0.19 0.00 0.00 0.00 0.00 44.72 43.90 1bqc s GLY 290 CO 0.00 -0.04 1.60 -2.22 0.00 0.00 0.00 173.10 172.44 1bqc h ILE 291 N -1.53 1.20 -0.49 0.90 2.04 -0.70 -2.07 117.51 116.86 1bqc h ILE 291 Ca -0.49 -0.64 -0.05 0.00 1.00 0.00 0.00 64.86 64.68 1bqc h ILE 291 Cb 1.32 1.17 -0.02 0.00 -0.74 0.00 0.00 36.82 38.55 1bqc h ILE 291 CO 0.59 0.21 0.08 0.00 0.00 0.00 0.00 178.15 179.02 1bqc h ALA 292 N 0.89 1.23 0.00 1.87 0.00 -0.93 0.24 119.26 122.56 1bqc h ALA 292 Ca 0.08 -0.21 -0.05 0.00 0.00 0.00 0.00 54.91 54.72 1bqc h ALA 292 Cb 0.25 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1bqc h ALA 292 CO -0.00 0.52 -0.31 0.66 0.00 0.00 0.00 179.25 180.12 1bqc h SER 293 N 0.73 0.00 0.00 0.00 4.64 -1.70 -3.39 113.55 113.82 1bqc h SER 293 Ca 0.16 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.41 1bqc h SER 293 Cb 0.33 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.41 1bqc h SER 293 CO 0.00 0.24 -1.37 0.35 -0.87 0.00 0.00 176.83 175.18 1bqc n THR 294 N -3.13 0.23 -2.31 2.95 -2.24 -0.79 -5.01 114.28 103.99 1bqc n THR 294 Ca 0.02 -0.21 -0.40 0.00 -2.27 0.00 0.00 64.05 61.19 1bqc n THR 294 Cb 0.63 -0.30 -0.03 0.00 -2.10 0.00 0.00 70.33 68.53 1bqc n THR 294 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1bqc s ALA 295 N -2.29 3.39 -0.08 6.98 0.00 0.05 -5.05 121.76 124.76 1bqc s ALA 295 Ca -0.03 1.04 0.05 0.00 0.00 0.00 0.00 51.96 53.02 1bqc s ALA 295 Cb 0.03 -3.39 -0.00 0.00 0.00 0.00 0.00 23.12 19.75 1bqc s ALA 295 CO 0.26 -0.40 -0.23 0.15 0.00 0.00 0.00 175.76 175.54 1bqc s LYS 296 N -1.73 2.68 0.59 0.00 -0.14 -1.26 -4.98 119.74 114.90 1bqc s LYS 296 Ca 0.48 -0.85 -0.20 0.00 -1.36 0.00 0.00 55.97 54.04 1bqc s LYS 296 Cb -0.34 -2.14 -0.04 0.00 -1.68 0.00 0.00 37.83 33.63 1bqc s LYS 296 CO 0.45 0.26 1.30 -1.91 -0.76 0.00 0.00 175.35 174.68 1bqc n GLU 297 N 3.27 1.41 -1.88 1.68 2.13 -1.26 -4.77 120.64 121.22 1bqc n GLU 297 Ca -0.18 0.53 -0.41 0.00 0.66 0.00 0.00 57.16 57.75 1bqc n GLU 297 Cb 0.52 -2.52 -0.02 0.00 0.27 0.00 0.00 31.44 29.70 1bqc n GLU 297 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1bqc s ALA 298 N -1.34 3.66 -0.09 4.31 0.00 -1.26 -4.89 121.76 122.14 1bqc s ALA 298 Ca 0.76 1.48 0.30 0.00 0.00 0.00 0.00 51.96 54.50 1bqc s ALA 298 Cb -0.41 -3.60 1.30 0.00 0.00 0.00 0.00 23.12 20.42 1bqc s ALA 298 CO 0.46 -0.90 1.90 -0.39 0.00 0.00 0.00 175.76 176.82 1bqc h VAL 299 N 3.31 0.00 -0.14 0.00 -1.51 -1.96 -2.89 116.25 113.07 1bqc h VAL 299 Ca -0.48 -0.34 0.04 0.00 -1.23 0.00 0.00 66.70 64.70 1bqc h VAL 299 Cb 1.22 1.21 -0.01 0.00 -2.13 0.00 0.00 31.29 31.58 1bqc h VAL 299 CO 0.75 0.00 0.12 -0.29 -1.23 0.00 0.00 177.57 176.91 1bqc h ILE 300 N 0.00 0.78 0.00 7.19 6.09 -1.93 -1.01 117.51 128.62 1bqc h ILE 300 Ca 0.00 0.00 -0.00 0.00 -1.37 0.00 0.00 64.86 63.49 1bqc h ILE 300 Cb 0.39 0.92 -0.00 0.00 0.47 0.00 0.00 36.82 38.59 1bqc h ILE 300 CO 0.00 0.00 -0.00 -0.26 -3.07 0.00 0.00 178.15 174.82 1bqc h PHE 301 N 0.00 0.00 -0.02 2.19 0.04 -1.90 -3.53 116.94 113.71 1bqc h PHE 301 Ca 0.07 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.84 1bqc h PHE 301 Cb 0.30 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.45 1bqc h PHE 301 CO 0.00 0.00 0.00 0.41 -0.60 0.00 0.00 178.31 178.12