#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1cqj s ILE 2 N 0.00 2.09 0.00 2.46 -4.36 -1.26 -4.91 121.20 115.21 1cqj s ILE 2 Ca 0.00 -1.94 0.00 0.00 -0.26 0.00 0.00 60.65 58.45 1cqj s ILE 2 Cb 0.00 -2.98 0.00 0.00 1.25 0.00 0.00 42.46 40.73 1cqj s ILE 2 CO 0.00 -0.01 0.00 0.18 0.24 0.00 0.00 174.94 175.35 1cqj n LEU 3 N -1.02 0.00 -4.26 0.37 4.77 -1.26 -4.69 117.00 110.92 1cqj n LEU 3 Ca -0.04 0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 55.80 1cqj n LEU 3 Cb 0.66 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.65 1cqj n LEU 3 CO 0.48 0.00 -0.28 0.27 -1.33 0.00 0.00 177.39 176.53 1cqj s ILE 4 N 0.00 0.45 0.18 -0.08 -4.36 -1.26 -5.04 121.20 111.09 1cqj s ILE 4 Ca 0.00 -1.99 -0.18 0.00 -0.26 0.00 0.00 60.65 58.23 1cqj s ILE 4 Cb 0.00 -2.42 0.06 0.00 1.25 0.00 0.00 42.46 41.36 1cqj s ILE 4 CO 0.00 -0.17 0.87 -0.90 0.24 0.00 0.00 174.94 174.97 1cqj n ASP 5 N -0.33 -1.56 0.10 4.36 5.68 -1.26 -4.82 116.55 118.70 1cqj n ASP 5 Ca -0.02 -1.86 0.20 0.00 -0.50 0.00 0.00 54.79 52.61 1cqj n ASP 5 Cb 0.65 2.55 0.69 0.00 -1.14 0.00 0.00 41.12 43.87 1cqj n ASP 5 CO 0.00 0.00 0.00 0.07 -1.33 0.00 0.00 177.20 175.94 1cqj h LYS 6 N 0.00 0.00 0.00 0.11 2.10 -1.94 -0.68 116.57 116.16 1cqj h LYS 6 Ca -0.24 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.41 1cqj h LYS 6 Cb 1.04 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.37 1cqj h LYS 6 CO 0.32 0.00 -0.78 0.09 -2.00 0.00 0.00 179.45 177.08 1cqj n ASN 7 N -3.46 0.65 -4.65 7.07 3.02 -1.26 -4.76 115.26 111.87 1cqj n ASN 7 Ca 0.08 -0.03 -0.42 0.00 -0.03 0.00 0.00 54.58 54.18 1cqj n ASN 7 Cb 0.72 0.42 -0.03 0.00 -0.61 0.00 0.00 39.78 40.28 1cqj n ASN 7 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1cqj s THR 8 N -3.17 3.29 -0.13 3.41 2.01 -0.26 -4.99 115.64 115.80 1cqj s THR 8 Ca 0.05 0.35 -0.17 0.00 0.31 0.00 0.00 61.69 62.23 1cqj s THR 8 Cb 0.14 -3.25 -0.04 0.00 0.01 0.00 0.00 72.50 69.36 1cqj s THR 8 CO 0.75 -0.06 0.42 -0.54 -0.69 0.00 0.00 174.62 174.51 1cqj s LYS 9 N 4.56 4.31 -0.03 4.92 1.02 -1.26 -4.19 119.74 129.07 1cqj s LYS 9 Ca 0.83 0.34 0.06 0.00 0.02 0.00 0.00 55.97 57.22 1cqj s LYS 9 Cb -0.36 -3.44 -0.01 0.00 -0.52 0.00 0.00 37.83 33.50 1cqj s LYS 9 CO 0.35 0.17 -0.22 0.08 -0.92 0.00 0.00 175.35 174.81 1cqj s VAL 10 N 0.62 1.76 0.17 3.17 1.01 0.27 -2.27 120.40 125.12 1cqj s VAL 10 Ca 0.23 -0.93 0.09 0.00 0.00 0.00 0.00 61.98 61.37 1cqj s VAL 10 Cb -0.14 -1.47 -0.04 0.00 0.00 0.00 0.00 36.38 34.72 1cqj s VAL 10 CO 0.08 0.50 -0.09 0.27 0.00 0.00 0.00 175.10 175.86 1cqj s ILE 11 N -0.34 3.26 -0.13 2.22 -4.36 -0.44 -0.72 121.20 120.68 1cqj s ILE 11 Ca 0.04 -1.59 0.03 0.00 -0.26 0.00 0.00 60.65 58.86 1cqj s ILE 11 Cb -0.10 -2.61 0.01 0.00 1.25 0.00 0.00 42.46 41.01 1cqj s ILE 11 CO 0.01 -0.09 -0.22 0.00 0.24 0.00 0.00 174.94 174.88 1cqj s GLN 13 N 0.76 4.21 0.00 0.00 -0.21 0.42 -0.50 119.66 124.33 1cqj s GLN 13 Ca -0.09 0.49 0.00 0.00 0.02 0.00 0.00 55.36 55.78 1cqj s GLN 13 Cb -0.16 -3.56 0.00 0.00 1.00 0.00 0.00 33.01 30.30 1cqj s GLN 13 CO -0.01 -0.15 0.00 0.41 -2.12 0.00 0.00 175.29 173.42 1cqj n GLY 14 N 3.81 0.80 0.33 3.09 0.00 -0.13 -1.17 105.19 111.92 1cqj n GLY 14 Ca -0.04 -0.20 0.18 0.00 0.00 0.00 0.00 46.02 45.97 1cqj n GLY 14 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1cqj h PHE 15 N 0.00 0.84 -0.17 1.61 3.57 -1.65 -2.28 116.94 118.87 1cqj h PHE 15 Ca 0.00 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.54 1cqj h PHE 15 Cb 0.00 -0.22 0.00 0.00 2.79 0.00 0.00 35.95 38.52 1cqj h PHE 15 CO 0.00 -0.07 0.00 0.25 -2.23 0.00 0.00 178.31 176.26 1cqj n THR 16 N -5.01 0.22 -2.53 4.41 -2.24 -1.26 -2.44 114.28 105.43 1cqj n THR 16 Ca 0.27 -0.28 -0.24 0.00 -2.27 0.00 0.00 64.05 61.53 1cqj n THR 16 Cb 0.80 0.17 0.10 0.00 -2.10 0.00 0.00 70.33 69.30 1cqj n THR 16 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1cqj s GLY 17 N -1.34 1.77 0.00 3.38 0.00 -0.86 -4.79 107.32 105.48 1cqj s GLY 17 Ca 0.25 -1.58 -0.01 0.00 0.00 0.00 0.00 44.72 43.38 1cqj s GLY 17 CO 0.19 -1.06 1.02 1.76 0.00 0.00 0.00 173.10 175.01 1cqj h SER 18 N -0.50 -0.05 -0.88 1.64 0.02 -1.91 0.33 113.55 112.20 1cqj h SER 18 Ca -0.38 0.01 0.02 0.00 -0.84 0.00 0.00 61.79 60.59 1cqj h SER 18 Cb 1.27 0.02 -0.05 0.00 0.14 0.00 0.00 62.40 63.79 1cqj h SER 18 CO 0.43 -0.01 0.58 1.56 -1.14 0.00 0.00 176.83 178.25 1cqj h GLN 19 N -0.02 1.13 0.19 3.45 1.08 -1.92 -2.22 115.11 116.81 1cqj h GLN 19 Ca 0.00 -0.07 0.01 0.00 -1.45 0.00 0.00 58.65 57.14 1cqj h GLN 19 Cb 0.02 -0.26 -0.02 0.00 -0.05 0.00 0.00 27.48 27.18 1cqj h GLN 19 CO -0.01 0.75 -0.20 0.78 -0.95 0.00 0.00 178.83 179.19 1cqj h GLY 20 N 1.17 -0.43 0.18 3.46 0.00 -1.68 -0.68 103.07 105.09 1cqj h GLY 20 Ca 0.33 0.23 -0.00 0.00 0.00 0.00 0.00 47.33 47.89 1cqj h GLY 20 CO -0.08 -0.19 -0.26 -0.84 0.00 0.00 0.00 176.54 175.17 1cqj h THR 21 N -0.43 0.00 -0.07 4.70 2.02 0.01 -2.66 112.91 116.47 1cqj h THR 21 Ca 0.00 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.19 1cqj h THR 21 Cb 0.41 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 66.81 1cqj h THR 21 CO -0.06 0.00 -0.09 0.15 0.37 0.00 0.00 175.52 175.89 1cqj h PHE 22 N -0.45 -0.28 0.00 3.16 3.04 -1.34 -1.20 116.94 119.86 1cqj h PHE 22 Ca -0.02 0.01 0.00 0.00 3.98 0.00 0.00 57.97 61.94 1cqj h PHE 22 Cb 0.41 0.13 0.00 0.00 2.56 0.00 0.00 35.95 39.06 1cqj h PHE 22 CO -0.24 -0.08 0.02 0.72 -2.02 0.00 0.00 178.31 176.70 1cqj n HIS 23 N -3.16 0.00 0.02 0.41 8.25 -0.27 -1.37 115.22 119.10 1cqj n HIS 23 Ca -0.01 0.00 -0.22 0.00 -0.26 0.00 0.00 57.72 57.23 1cqj n HIS 23 Cb 0.06 -0.30 -0.14 0.00 1.12 0.00 0.00 29.99 30.73 1cqj n HIS 23 CO 0.00 0.00 0.00 0.77 0.64 0.00 0.00 176.34 177.75 1cqj h SER 24 N 0.00 0.46 -0.81 0.41 0.02 -0.86 -2.96 113.55 109.81 1cqj h SER 24 Ca 0.00 -0.93 0.02 0.00 -0.84 0.00 0.00 61.79 60.04 1cqj h SER 24 Cb 0.03 -0.15 -0.04 0.00 0.14 0.00 0.00 62.40 62.38 1cqj h SER 24 CO 0.00 1.81 0.52 -0.33 -1.14 0.00 0.00 176.83 177.69 1cqj h GLU 25 N 0.01 1.01 -0.27 3.45 5.08 -0.76 0.37 114.58 123.48 1cqj h GLU 25 Ca -0.39 -0.06 -0.03 0.00 -1.00 0.00 0.00 59.36 57.88 1cqj h GLU 25 Cb 2.01 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 31.01 1cqj h GLU 25 CO 0.10 0.67 0.04 1.96 -1.00 0.00 0.00 179.01 180.78 1cqj h GLN 26 N 1.05 0.39 0.07 2.33 1.08 -1.59 0.77 115.11 119.21 1cqj h GLN 26 Ca 0.31 -0.06 -0.25 0.00 -1.45 0.00 0.00 58.65 57.20 1cqj h GLN 26 Cb -0.06 -0.07 -0.01 0.00 -0.05 0.00 0.00 27.48 27.29 1cqj h GLN 26 CO -0.09 0.39 -1.19 0.00 -0.95 0.00 0.00 178.83 176.99 1cqj h ALA 27 N 1.66 0.24 0.87 3.87 0.00 -1.02 -2.30 119.26 122.59 1cqj h ALA 27 Ca 0.09 -0.94 -0.04 0.00 0.00 0.00 0.00 54.91 54.02 1cqj h ALA 27 Cb 0.20 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 17.98 1cqj h ALA 27 CO 0.00 1.13 -0.42 0.82 0.00 0.00 0.00 179.25 180.78 1cqj h ILE 28 N 0.04 0.03 -0.92 0.00 2.04 0.13 0.24 117.51 119.07 1cqj h ILE 28 Ca -0.10 -0.13 0.13 0.00 1.00 0.00 0.00 64.86 65.75 1cqj h ILE 28 Cb 1.90 0.03 -0.07 0.00 -0.74 0.00 0.00 36.82 37.93 1cqj h ILE 28 CO 0.16 0.00 0.59 0.00 0.00 0.00 0.00 178.15 178.91 1cqj h ALA 29 N -1.27 1.69 0.00 1.87 0.00 -0.97 0.79 119.26 121.38 1cqj h ALA 29 Ca -0.12 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1cqj h ALA 29 Cb 0.90 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.52 1cqj h ALA 29 CO 0.20 0.07 0.00 0.98 0.00 0.00 0.00 179.25 180.50 1cqj n TYR 30 N -4.57 0.25 -0.14 0.00 9.36 -0.86 -4.87 117.16 116.33 1cqj n TYR 30 Ca 0.17 0.10 0.00 0.00 3.32 0.00 0.00 57.90 61.49 1cqj n TYR 30 Cb 0.40 -0.65 0.00 0.00 -0.63 0.00 0.00 39.34 38.45 1cqj n TYR 30 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1cqj n GLY 31 N 0.15 0.93 3.77 2.98 0.00 0.28 -4.91 105.19 108.39 1cqj n GLY 31 Ca 0.03 -0.01 -0.40 0.00 0.00 0.00 0.00 46.02 45.65 1cqj n GLY 31 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1cqj s THR 32 N -2.00 2.96 -1.27 2.61 2.01 0.81 -4.90 115.64 115.87 1cqj s THR 32 Ca 0.00 0.89 -0.19 0.00 0.31 0.00 0.00 61.69 62.70 1cqj s THR 32 Cb 0.00 -3.53 0.05 0.00 0.01 0.00 0.00 72.50 69.03 1cqj s THR 32 CO 0.00 0.15 1.74 -0.54 -0.69 0.00 0.00 174.62 175.28 1cqj s LYS 33 N -2.01 3.80 -0.50 4.92 1.02 -1.26 -4.46 119.74 121.26 1cqj s LYS 33 Ca 0.53 -1.84 -0.26 0.00 0.02 0.00 0.00 55.97 54.42 1cqj s LYS 33 Cb -0.35 -5.49 0.03 0.00 -0.52 0.00 0.00 37.83 31.50 1cqj s LYS 33 CO 0.45 -2.44 0.97 -1.64 -0.92 0.00 0.00 175.35 171.77 1cqj s MET 34 N 4.53 3.49 0.00 1.68 -1.94 -1.26 -0.57 119.30 125.23 1cqj s MET 34 Ca 0.55 0.09 0.24 0.00 -1.71 0.00 0.00 55.69 54.87 1cqj s MET 34 Cb 0.03 -3.97 0.40 0.00 2.01 0.00 0.00 34.83 33.31 1cqj s MET 34 CO 0.07 -1.34 1.34 1.33 -0.01 0.00 0.00 175.02 176.41 1cqj n VAL 35 N 6.42 0.00 0.00 -6.03 0.24 0.10 -4.92 118.33 114.14 1cqj n VAL 35 Ca 0.06 -0.02 0.00 0.00 -2.04 0.00 0.00 64.34 62.34 1cqj n VAL 35 Cb 0.48 0.41 0.00 0.00 -1.47 0.00 0.00 33.84 33.26 1cqj n VAL 35 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1cqj n GLY 36 N 1.48 -0.04 3.24 7.63 0.00 -1.24 -4.38 105.19 111.88 1cqj n GLY 36 Ca 0.06 -1.47 -0.09 0.00 0.00 0.00 0.00 46.02 44.52 1cqj n GLY 36 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1cqj s GLY 37 N 0.00 0.67 -0.13 -0.02 0.00 -0.71 -1.56 107.32 105.57 1cqj s GLY 37 Ca 0.00 -1.14 0.02 0.00 0.00 0.00 0.00 44.72 43.60 1cqj s GLY 37 CO 0.00 -1.09 -0.19 0.14 0.00 0.00 0.00 173.10 171.96 1cqj s VAL 38 N -3.99 2.40 -0.31 1.40 1.01 0.34 0.09 120.40 121.34 1cqj s VAL 38 Ca 0.19 -0.88 0.02 0.00 0.00 0.00 0.00 61.98 61.30 1cqj s VAL 38 Cb 0.05 -1.97 0.15 0.00 0.00 0.00 0.00 36.38 34.62 1cqj s VAL 38 CO -0.00 0.54 0.39 -0.89 0.00 0.00 0.00 175.10 175.13 1cqj s THR 39 N 0.53 -0.55 -0.45 3.92 2.01 -0.79 -0.96 115.64 119.35 1cqj s THR 39 Ca -0.12 -0.44 -0.42 0.00 0.31 0.00 0.00 61.69 61.02 1cqj s THR 39 Cb -0.17 -0.90 -0.17 0.00 0.01 0.00 0.00 72.50 71.28 1cqj s THR 39 CO 0.04 -0.37 2.11 -2.65 -0.69 0.00 0.00 174.62 173.07 1cqj n PRO 40 N 5.13 0.32 0.00 4.92 -0.02 -1.25 -0.65 135.00 143.44 1cqj n PRO 40 Ca 0.02 0.09 0.00 0.00 -2.02 0.00 0.00 63.50 61.59 1cqj n PRO 40 Cb 0.48 -1.77 0.00 0.00 -0.02 0.00 0.00 33.50 32.19 1cqj n PRO 40 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1cqj n GLY 41 N 6.93 0.72 0.16 -1.23 0.00 -1.26 -4.91 105.19 105.60 1cqj n GLY 41 Ca 0.49 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.55 1cqj n GLY 41 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1cqj n LYS 42 N -1.08 1.14 -2.02 1.61 5.02 0.18 -5.05 118.16 117.96 1cqj n LYS 42 Ca 0.00 -1.74 -0.37 0.00 -2.02 0.00 0.00 58.31 54.17 1cqj n LYS 42 Cb 0.00 -1.04 0.02 0.00 -0.02 0.00 0.00 35.03 33.99 1cqj n LYS 42 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 1cqj s GLY 43 N -1.73 2.80 0.00 0.72 0.00 -1.25 -3.46 107.32 104.40 1cqj s GLY 43 Ca 0.14 1.09 0.00 0.00 0.00 0.00 0.00 44.72 45.96 1cqj s GLY 43 CO 0.01 1.55 0.00 0.61 0.00 0.00 0.00 173.10 175.27 1cqj n GLY 44 N 0.56 0.65 3.34 0.20 0.00 0.34 -4.83 105.19 105.46 1cqj n GLY 44 Ca 0.10 -0.75 -0.11 0.00 0.00 0.00 0.00 46.02 45.27 1cqj n GLY 44 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1cqj s THR 45 N -2.20 0.00 0.17 2.61 -4.23 -1.22 -5.00 115.64 105.78 1cqj s THR 45 Ca 0.00 -1.78 0.11 0.00 -1.18 0.00 0.00 61.69 58.84 1cqj s THR 45 Cb 0.00 -2.38 -0.04 0.00 1.34 0.00 0.00 72.50 71.42 1cqj s THR 45 CO 0.00 -0.01 -0.22 0.42 -0.54 0.00 0.00 174.62 174.27 1cqj s THR 46 N -4.10 2.49 -0.20 3.99 -4.23 -1.26 0.63 115.64 112.96 1cqj s THR 46 Ca 0.33 -1.89 -0.10 0.00 -1.18 0.00 0.00 61.69 58.84 1cqj s THR 46 Cb 0.04 -2.18 0.07 0.00 1.34 0.00 0.00 72.50 71.77 1cqj s THR 46 CO 0.11 -0.06 0.47 -2.28 -0.54 0.00 0.00 174.62 172.32 1cqj s HIS 47 N -1.53 -0.73 -1.44 3.99 5.04 -0.59 -4.85 115.29 115.19 1cqj s HIS 47 Ca 0.20 1.50 -0.08 0.00 -1.54 0.00 0.00 55.06 55.13 1cqj s HIS 47 Cb -0.09 0.36 0.05 0.00 0.04 0.00 0.00 32.58 32.93 1cqj s HIS 47 CO 0.10 -0.40 0.68 1.28 -2.34 0.00 0.00 174.74 174.06 1cqj n LEU 48 N 4.40 -2.30 0.00 8.88 4.77 -1.26 -1.79 117.00 129.70 1cqj n LEU 48 Ca -0.21 -0.43 0.00 0.00 -0.03 0.00 0.00 56.01 55.33 1cqj n LEU 48 Cb 0.55 -2.59 0.00 0.00 -2.33 0.00 0.00 43.42 39.05 1cqj n LEU 48 CO 0.05 0.28 0.00 0.61 -1.33 0.00 0.00 177.39 177.00 1cqj n GLY 49 N -1.47 1.10 4.00 -0.72 0.00 -1.26 -4.98 105.19 101.86 1cqj n GLY 49 Ca -0.04 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.80 1cqj n GLY 49 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1cqj s LEU 50 N 0.00 3.70 0.28 0.99 1.43 -0.74 -5.06 118.68 119.29 1cqj s LEU 50 Ca 0.00 -0.31 -0.23 0.00 -1.03 0.00 0.00 54.13 52.55 1cqj s LEU 50 Cb 0.00 -2.71 -0.09 0.00 0.03 0.00 0.00 46.19 43.42 1cqj s LEU 50 CO 0.00 -0.71 0.85 -2.16 0.23 0.00 0.00 176.35 174.56 1cqj s PRO 51 N -4.35 4.45 -0.12 1.29 0.04 -1.26 -1.54 135.00 133.51 1cqj s PRO 51 Ca 0.53 1.14 -0.00 0.00 0.04 0.00 0.00 61.00 62.70 1cqj s PRO 51 Cb -0.10 -2.84 -0.02 0.00 0.04 0.00 0.00 34.50 31.58 1cqj s PRO 51 CO 0.33 0.33 -0.12 0.08 0.04 0.00 0.00 177.00 177.67 1cqj s VAL 52 N -1.57 3.18 0.26 -0.36 1.01 0.21 -1.74 120.40 121.38 1cqj s VAL 52 Ca 0.47 -0.62 0.09 0.00 0.00 0.00 0.00 61.98 61.91 1cqj s VAL 52 Cb -0.18 -2.33 -0.04 0.00 0.00 0.00 0.00 36.38 33.83 1cqj s VAL 52 CO 0.23 0.53 0.07 -0.36 0.00 0.00 0.00 175.10 175.57 1cqj s PHE 53 N 0.21 2.86 0.09 5.22 0.40 0.11 -0.50 117.98 126.36 1cqj s PHE 53 Ca -0.07 -0.18 -0.01 0.00 -0.60 0.00 0.00 56.93 56.07 1cqj s PHE 53 Cb -0.15 -1.27 -0.26 0.00 0.51 0.00 0.00 43.02 41.84 1cqj s PHE 53 CO 0.05 0.58 1.17 -0.91 0.70 0.00 0.00 175.22 176.81 1cqj h ASN 54 N 1.75 0.29 -4.17 1.36 2.35 -1.87 -2.09 115.58 113.20 1cqj h ASN 54 Ca -0.46 -0.32 -0.34 0.00 -0.55 0.00 0.00 56.30 54.63 1cqj h ASN 54 Cb 1.24 -0.10 -0.17 0.00 0.05 0.00 0.00 38.32 39.35 1cqj h ASN 54 CO 0.60 1.25 -0.73 0.42 -1.65 0.00 0.00 177.43 177.32 1cqj s THR 55 N -2.67 1.10 0.39 2.81 -4.23 -1.26 -3.86 115.64 107.92 1cqj s THR 55 Ca -0.03 -1.80 0.10 0.00 -1.18 0.00 0.00 61.69 58.78 1cqj s THR 55 Cb 0.08 -1.57 0.16 0.00 1.34 0.00 0.00 72.50 72.51 1cqj s THR 55 CO 0.86 -0.60 1.92 0.58 -0.54 0.00 0.00 174.62 176.85 1cqj h VAL 56 N 3.28 1.17 0.24 2.29 2.07 -1.91 -2.76 116.25 120.64 1cqj h VAL 56 Ca -0.38 -0.77 -0.01 0.00 0.82 0.00 0.00 66.70 66.36 1cqj h VAL 56 Cb 1.19 1.20 0.00 0.00 -1.52 0.00 0.00 31.29 32.17 1cqj h VAL 56 CO 0.56 0.24 -0.11 -0.09 0.02 0.00 0.00 177.57 178.19 1cqj h ARG 57 N 0.23 -0.31 -1.01 1.57 2.43 -1.88 -1.50 114.38 113.91 1cqj h ARG 57 Ca 0.05 0.02 0.25 0.00 -0.81 0.00 0.00 59.98 59.49 1cqj h ARG 57 Cb 0.37 0.07 -0.12 0.00 -0.42 0.00 0.00 29.97 29.86 1cqj h ARG 57 CO 0.02 0.02 0.60 0.93 -1.51 0.00 0.00 179.97 180.03 1cqj h GLU 58 N -0.66 0.54 -0.01 0.20 5.08 -1.93 0.07 114.58 117.87 1cqj h GLU 58 Ca -0.03 -0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.29 1cqj h GLU 58 Cb 0.47 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.59 1cqj h GLU 58 CO 0.05 0.36 0.00 0.00 -1.00 0.00 0.00 179.01 178.43 1cqj h ALA 59 N 1.73 0.02 -0.40 3.43 0.00 -1.32 -1.41 119.26 121.32 1cqj h ALA 59 Ca 0.65 -0.14 0.05 0.00 0.00 0.00 0.00 54.91 55.47 1cqj h ALA 59 Cb 1.26 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.03 1cqj h ALA 59 CO -0.48 -0.34 0.27 0.28 0.00 0.00 0.00 179.25 178.98 1cqj h VAL 60 N -0.24 0.97 0.03 0.00 2.07 0.03 -1.41 116.25 117.69 1cqj h VAL 60 Ca 0.00 -0.11 -0.00 0.00 0.82 0.00 0.00 66.70 67.41 1cqj h VAL 60 Cb 0.27 0.62 0.00 0.00 -1.52 0.00 0.00 31.29 30.67 1cqj h VAL 60 CO 0.00 0.06 -0.01 0.00 0.02 0.00 0.00 177.57 177.64 1cqj h ALA 61 N 1.79 -0.47 0.00 1.67 0.00 -0.89 0.20 119.26 121.55 1cqj h ALA 61 Ca 0.17 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1cqj h ALA 61 Cb 0.28 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1cqj h ALA 61 CO -0.04 -0.47 0.30 0.00 0.00 0.00 0.00 179.25 179.04 1cqj n ALA 62 N -2.04 0.53 0.00 0.00 0.00 -0.55 -3.10 120.51 115.34 1cqj n ALA 62 Ca -0.00 0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.49 1cqj n ALA 62 Cb 0.01 -0.60 0.00 0.00 0.00 0.00 0.00 19.45 18.86 1cqj n ALA 62 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1cqj n THR 63 N -1.63 0.00 -1.86 0.00 -2.24 -0.55 -5.03 114.28 102.98 1cqj n THR 63 Ca -0.00 0.00 -0.09 0.00 -2.27 0.00 0.00 64.05 61.69 1cqj n THR 63 Cb 0.30 -0.23 -0.02 0.00 -2.10 0.00 0.00 70.33 68.29 1cqj n THR 63 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1cqj n GLY 64 N 1.15 0.36 3.69 3.38 0.00 0.06 -5.01 105.19 108.82 1cqj n GLY 64 Ca 0.00 -0.56 -0.30 0.00 0.00 0.00 0.00 46.02 45.15 1cqj n GLY 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1cqj s ALA 65 N -2.40 1.49 0.00 4.61 0.00 -1.26 -4.96 121.76 119.24 1cqj s ALA 65 Ca 0.00 0.19 0.00 0.00 0.00 0.00 0.00 51.96 52.15 1cqj s ALA 65 Cb 0.00 -3.29 0.00 0.00 0.00 0.00 0.00 23.12 19.83 1cqj s ALA 65 CO 0.00 -2.47 0.12 0.25 0.00 0.00 0.00 175.76 173.66 1cqj n THR 66 N -3.99 0.00 -4.36 0.00 -2.24 -0.96 -4.90 114.28 97.82 1cqj n THR 66 Ca 0.08 -0.27 -0.20 0.00 -2.27 0.00 0.00 64.05 61.40 1cqj n THR 66 Cb 0.54 1.21 -0.13 0.00 -2.10 0.00 0.00 70.33 69.84 1cqj n THR 66 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1cqj s ALA 67 N -0.30 1.12 -0.02 6.98 0.00 -1.20 -0.31 121.76 128.03 1cqj s ALA 67 Ca 0.00 -0.78 0.03 0.00 0.00 0.00 0.00 51.96 51.21 1cqj s ALA 67 Cb 0.00 -0.18 -0.00 0.00 0.00 0.00 0.00 23.12 22.94 1cqj s ALA 67 CO 0.00 0.21 -0.12 0.45 0.00 0.00 0.00 175.76 176.31 1cqj s SER 68 N -1.06 1.46 -0.19 0.00 0.15 0.62 -1.32 113.70 113.37 1cqj s SER 68 Ca 0.01 -0.23 -0.04 0.00 0.70 0.00 0.00 55.95 56.39 1cqj s SER 68 Cb -0.08 -0.32 -0.02 0.00 -1.71 0.00 0.00 66.02 63.89 1cqj s SER 68 CO 0.01 0.11 -0.02 0.54 1.20 0.00 0.00 173.24 175.08 1cqj s VAL 69 N 0.02 3.83 -0.24 4.45 0.11 -0.38 0.72 120.40 128.91 1cqj s VAL 69 Ca -0.01 -0.36 -0.08 0.00 -2.93 0.00 0.00 61.98 58.60 1cqj s VAL 69 Cb -0.08 -2.71 -0.04 0.00 -1.53 0.00 0.00 36.38 32.02 1cqj s VAL 69 CO 0.00 0.45 0.10 -0.63 -3.33 0.00 0.00 175.10 171.70 1cqj s ILE 70 N 0.82 4.72 -0.42 7.04 1.01 0.72 -0.44 121.20 134.65 1cqj s ILE 70 Ca -0.00 -0.04 0.08 0.00 0.00 0.00 0.00 60.65 60.69 1cqj s ILE 70 Cb -0.14 -3.20 0.42 0.00 0.01 0.00 0.00 42.46 39.54 1cqj s ILE 70 CO 0.02 0.35 1.04 -1.22 0.00 0.00 0.00 174.94 175.12 1cqj n TYR 71 N 4.59 2.81 -4.65 3.97 4.01 -0.31 -2.01 117.16 125.57 1cqj n TYR 71 Ca -0.16 -3.16 -0.33 0.00 -0.16 0.00 0.00 57.90 54.09 1cqj n TYR 71 Cb 0.52 -0.21 -0.13 0.00 -0.31 0.00 0.00 39.34 39.21 1cqj n TYR 71 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 1cqj s VAL 72 N -4.73 3.42 0.37 -0.72 1.01 -1.26 -4.63 120.40 113.86 1cqj s VAL 72 Ca 0.43 -0.54 -0.25 0.00 0.00 0.00 0.00 61.98 61.61 1cqj s VAL 72 Cb 0.40 -2.44 -0.12 0.00 0.00 0.00 0.00 36.38 34.21 1cqj s VAL 72 CO -0.13 0.53 0.87 -0.81 0.00 0.00 0.00 175.10 175.57 1cqj n PRO 73 N 3.22 1.09 -0.35 2.72 -0.04 -1.26 -4.56 135.00 135.83 1cqj n PRO 73 Ca -0.18 0.39 0.02 0.00 -0.04 0.00 0.00 63.50 63.70 1cqj n PRO 73 Cb 0.53 -1.80 0.08 0.00 -0.04 0.00 0.00 33.50 32.27 1cqj n PRO 73 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1cqj n ALA 74 N -0.33 0.06 -0.19 0.55 0.00 -1.26 -1.50 120.51 117.84 1cqj n ALA 74 Ca 0.10 0.97 0.30 0.00 0.00 0.00 0.00 53.44 54.81 1cqj n ALA 74 Cb 0.36 -0.51 0.72 0.00 0.00 0.00 0.00 19.45 20.02 1cqj n ALA 74 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1cqj h PRO 75 N 0.00 0.00 -0.11 0.00 0.11 -1.90 -1.54 132.00 128.56 1cqj h PRO 75 Ca 0.38 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.49 1cqj h PRO 75 Cb 0.62 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.73 1cqj h PRO 75 CO -0.94 0.00 0.00 1.19 -0.21 0.00 0.00 178.00 178.04 1cqj n PHE 76 N -4.06 0.14 -0.25 0.65 3.72 -0.56 -4.73 117.46 112.36 1cqj n PHE 76 Ca 0.19 -0.24 -0.06 0.00 -0.05 0.00 0.00 57.45 57.29 1cqj n PHE 76 Cb 1.05 -0.02 0.05 0.00 -0.94 0.00 0.00 39.48 39.61 1cqj n PHE 76 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1cqj h LYS 78 N 0.95 1.15 0.04 0.00 3.64 -1.85 0.18 116.57 120.68 1cqj h LYS 78 Ca 0.23 -0.07 -0.00 0.00 -1.27 0.00 0.00 60.65 59.54 1cqj h LYS 78 Cb 0.12 -0.26 0.00 0.00 -0.41 0.00 0.00 32.23 31.68 1cqj h LYS 78 CO -0.03 0.76 -0.02 0.22 -2.27 0.00 0.00 179.45 178.11 1cqj h ASP 79 N 1.18 -0.05 0.21 4.20 3.58 -1.82 -1.36 116.42 122.37 1cqj h ASP 79 Ca 0.34 -0.07 -0.08 0.00 0.42 0.00 0.00 57.03 57.64 1cqj h ASP 79 Cb -0.07 0.01 -0.01 0.00 1.72 0.00 0.00 39.33 40.98 1cqj h ASP 79 CO -0.09 0.04 -0.31 0.77 -2.88 0.00 0.00 179.24 176.77 1cqj h SER 80 N -0.13 0.16 -0.35 2.28 4.64 -0.88 -1.19 113.55 118.08 1cqj h SER 80 Ca -0.01 -0.05 -0.14 0.00 -0.47 0.00 0.00 61.79 61.12 1cqj h SER 80 Cb 0.12 -0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 62.16 1cqj h SER 80 CO 0.01 0.47 -0.33 0.40 -0.87 0.00 0.00 176.83 176.51 1cqj h ILE 81 N 0.14 1.28 0.00 0.95 2.04 -0.43 -2.69 117.51 118.81 1cqj h ILE 81 Ca 0.02 -1.50 -0.09 0.00 1.00 0.00 0.00 64.86 64.29 1cqj h ILE 81 Cb 0.62 1.46 -0.01 0.00 -0.74 0.00 0.00 36.82 38.14 1cqj h ILE 81 CO 0.05 0.49 -0.44 -0.07 0.00 0.00 0.00 178.15 178.18 1cqj h LEU 82 N 0.63 0.00 -0.22 1.44 3.38 -0.93 -1.80 115.31 117.80 1cqj h LEU 82 Ca 0.06 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.83 1cqj h LEU 82 Cb 0.91 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.67 1cqj h LEU 82 CO 0.08 0.44 -0.63 -0.08 0.09 0.00 0.00 178.44 178.34 1cqj h GLU 83 N 0.00 0.82 0.09 1.13 4.81 -1.18 -1.67 114.58 118.57 1cqj h GLU 83 Ca -0.00 -0.59 -0.00 0.00 -0.13 0.00 0.00 59.36 58.64 1cqj h GLU 83 Cb 0.87 0.10 0.00 0.00 0.63 0.00 0.00 28.75 30.35 1cqj h GLU 83 CO 0.06 1.21 -0.04 0.00 -0.73 0.00 0.00 179.01 179.50 1cqj h ALA 84 N 0.61 -0.12 -0.83 2.92 0.00 -1.34 0.22 119.26 120.72 1cqj h ALA 84 Ca -0.02 -0.13 0.18 0.00 0.00 0.00 0.00 54.91 54.94 1cqj h ALA 84 Cb 1.25 0.05 -0.11 0.00 0.00 0.00 0.00 17.79 18.98 1cqj h ALA 84 CO 0.14 -0.45 0.34 0.82 0.00 0.00 0.00 179.25 180.10 1cqj h ILE 85 N -0.36 0.58 -0.36 0.00 2.04 -1.32 -1.70 117.51 116.38 1cqj h ILE 85 Ca -0.01 -0.15 -0.06 0.00 1.00 0.00 0.00 64.86 65.64 1cqj h ILE 85 Cb 0.31 0.10 -0.01 0.00 -0.74 0.00 0.00 36.82 36.48 1cqj h ILE 85 CO 0.02 0.08 0.01 -0.78 0.00 0.00 0.00 178.15 177.48 1cqj h ASP 86 N 0.44 0.62 0.00 1.72 3.58 -0.67 -2.72 116.42 119.38 1cqj h ASP 86 Ca 0.48 -0.30 0.00 0.00 0.42 0.00 0.00 57.03 57.63 1cqj h ASP 86 Cb 0.81 -0.17 0.00 0.00 1.72 0.00 0.00 39.33 41.70 1cqj h ASP 86 CO -0.46 0.77 0.00 0.00 -2.88 0.00 0.00 179.24 176.66 1cqj n ALA 87 N -2.38 2.32 -1.83 -0.78 0.00 0.72 -4.88 120.51 113.68 1cqj n ALA 87 Ca -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.40 1cqj n ALA 87 Cb 0.27 -1.06 0.00 0.00 0.00 0.00 0.00 19.45 18.65 1cqj n ALA 87 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1cqj n GLY 88 N 0.35 0.44 3.73 0.00 0.00 -1.02 -4.85 105.19 103.84 1cqj n GLY 88 Ca 0.03 -0.87 -0.41 0.00 0.00 0.00 0.00 46.02 44.77 1cqj n GLY 88 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1cqj s ILE 89 N -2.00 4.12 -0.48 -0.61 -1.09 -1.06 -4.93 121.20 115.15 1cqj s ILE 89 Ca 0.00 1.77 0.22 0.00 -2.23 0.00 0.00 60.65 60.40 1cqj s ILE 89 Cb 0.00 -4.13 -0.27 0.00 -1.58 0.00 0.00 42.46 36.48 1cqj s ILE 89 CO 0.00 0.28 0.71 0.29 -1.23 0.00 0.00 174.94 174.98 1cqj n LYS 90 N 2.67 0.35 -3.96 2.79 5.02 0.58 -4.67 118.16 120.95 1cqj n LYS 90 Ca 0.03 -0.10 -0.23 0.00 -2.02 0.00 0.00 58.31 55.99 1cqj n LYS 90 Cb 0.47 -1.52 -0.17 0.00 -0.02 0.00 0.00 35.03 33.79 1cqj n LYS 90 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 1cqj s LEU 91 N -3.85 0.99 -0.12 -0.35 2.96 -0.73 -1.78 118.68 115.81 1cqj s LEU 91 Ca -0.00 -0.16 0.03 0.00 -0.22 0.00 0.00 54.13 53.78 1cqj s LEU 91 Cb 0.15 -0.55 0.00 0.00 0.50 0.00 0.00 46.19 46.29 1cqj s LEU 91 CO 0.88 -0.12 -0.22 -0.63 -1.32 0.00 0.00 176.35 174.94 1cqj s ILE 92 N 1.53 2.11 -0.27 6.68 1.01 0.29 -0.27 121.20 132.28 1cqj s ILE 92 Ca -0.01 -0.98 0.01 0.00 0.00 0.00 0.00 60.65 59.67 1cqj s ILE 92 Cb -0.13 -1.83 0.05 0.00 0.01 0.00 0.00 42.46 40.56 1cqj s ILE 92 CO -0.04 0.55 -0.07 -0.63 0.00 0.00 0.00 174.94 174.76 1cqj s ILE 93 N 0.59 2.53 -0.35 2.92 -1.09 0.22 -0.74 121.20 125.28 1cqj s ILE 93 Ca -0.12 -1.47 -0.10 0.00 -2.23 0.00 0.00 60.65 56.73 1cqj s ILE 93 Cb -0.17 -2.44 0.02 0.00 -1.58 0.00 0.00 42.46 38.29 1cqj s ILE 93 CO 0.03 -0.02 0.17 -0.89 -1.23 0.00 0.00 174.94 173.01 1cqj s THR 94 N 1.18 4.45 0.06 2.92 2.01 -0.24 -0.20 115.64 125.83 1cqj s THR 94 Ca -0.06 -0.78 -0.14 0.00 0.31 0.00 0.00 61.69 61.01 1cqj s THR 94 Cb -0.19 -3.43 -0.28 0.00 0.01 0.00 0.00 72.50 68.60 1cqj s THR 94 CO -0.04 -0.14 1.11 0.40 -0.69 0.00 0.00 174.62 175.27 1cqj h ILE 95 N 5.86 1.29 -0.56 1.82 1.08 -1.63 -3.04 117.51 122.33 1cqj h ILE 95 Ca -0.27 -2.45 -0.43 0.00 -0.39 0.00 0.00 64.86 61.31 1cqj h ILE 95 Cb 1.11 2.67 0.03 0.00 -3.07 0.00 0.00 36.82 37.56 1cqj h ILE 95 CO 0.64 0.75 0.01 0.41 -0.69 0.00 0.00 178.15 179.27 1cqj n THR 96 N -3.79 0.08 -4.65 -0.27 -1.04 -1.25 -2.54 114.28 100.82 1cqj n THR 96 Ca -0.13 -0.02 -0.33 0.00 -2.04 0.00 0.00 64.05 61.52 1cqj n THR 96 Cb 0.98 0.00 -0.11 0.00 -1.82 0.00 0.00 70.33 69.37 1cqj n THR 96 CO 0.00 0.00 0.00 -0.70 -0.64 0.00 0.00 175.07 173.73 1cqj s GLU 97 N -0.04 2.68 0.00 -2.82 -6.30 -1.26 0.03 118.70 110.99 1cqj s GLU 97 Ca 0.49 -0.59 0.00 0.00 -2.50 0.00 0.00 54.97 52.37 1cqj s GLU 97 Cb -0.69 -2.54 0.00 0.00 0.00 0.00 0.00 34.13 30.89 1cqj s GLU 97 CO 0.32 0.65 0.00 0.41 0.02 0.00 0.00 175.26 176.66 1cqj n GLY 98 N 2.15 1.09 3.72 -1.50 0.00 -1.26 -4.50 105.19 104.89 1cqj n GLY 98 Ca -0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.43 1cqj n GLY 98 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1cqj s ILE 99 N -2.00 3.98 0.18 -0.61 1.01 -1.26 -4.81 121.20 117.69 1cqj s ILE 99 Ca 0.00 1.44 -0.33 0.00 0.00 0.00 0.00 60.65 61.76 1cqj s ILE 99 Cb 0.00 -3.92 -0.15 0.00 0.01 0.00 0.00 42.46 38.40 1cqj s ILE 99 CO 0.00 0.12 1.28 -2.65 0.00 0.00 0.00 174.94 173.69 1cqj n PRO 100 N 3.80 1.49 -0.20 2.79 -0.02 -1.26 -4.87 135.00 136.73 1cqj n PRO 100 Ca 0.09 0.53 0.00 0.00 -2.02 0.00 0.00 63.50 62.10 1cqj n PRO 100 Cb 0.46 -2.11 0.09 0.00 -0.02 0.00 0.00 33.50 31.92 1cqj n PRO 100 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 1cqj h THR 101 N 2.90 0.48 0.00 3.45 2.02 -2.00 -0.81 112.91 118.95 1cqj h THR 101 Ca -0.44 -0.03 -0.01 0.00 0.77 0.00 0.00 66.41 66.70 1cqj h THR 101 Cb 1.32 0.38 -0.00 0.00 -1.74 0.00 0.00 68.15 68.10 1cqj h THR 101 CO 0.74 0.02 -0.04 -0.07 0.37 0.00 0.00 175.52 176.54 1cqj h LEU 102 N 0.09 0.00 -0.15 2.58 3.38 -2.00 -1.46 115.31 117.76 1cqj h LEU 102 Ca 0.31 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.23 1cqj h LEU 102 Cb 0.50 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.25 1cqj h LEU 102 CO -0.54 0.04 -0.12 0.44 0.09 0.00 0.00 178.44 178.34 1cqj h ASP 103 N 0.00 0.36 -0.43 -0.43 3.32 -1.50 -2.93 116.42 114.80 1cqj h ASP 103 Ca -0.00 -0.46 -0.02 0.00 0.02 0.00 0.00 57.03 56.57 1cqj h ASP 103 Cb 0.08 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 39.51 1cqj h ASP 103 CO 0.00 0.75 0.22 0.24 -1.72 0.00 0.00 179.24 178.73 1cqj h MET 104 N -0.02 0.66 -0.87 3.56 2.86 -1.16 0.77 114.93 120.73 1cqj h MET 104 Ca 0.03 -0.08 0.02 0.00 -2.06 0.00 0.00 59.70 57.60 1cqj h MET 104 Cb 0.64 -0.13 -0.05 0.00 0.06 0.00 0.00 31.60 32.12 1cqj h MET 104 CO 0.03 0.53 0.57 1.25 1.06 0.00 0.00 176.91 180.35 1cqj h LEU 105 N 0.66 0.98 0.07 1.22 6.46 -1.23 0.27 115.31 123.75 1cqj h LEU 105 Ca 0.17 -0.02 -0.00 0.00 -0.12 0.00 0.00 57.88 57.90 1cqj h LEU 105 Cb 0.09 -0.24 0.00 0.00 -0.73 0.00 0.00 40.66 39.78 1cqj h LEU 105 CO -0.02 0.70 -0.03 0.74 -0.62 0.00 0.00 178.44 179.20 1cqj h THR 106 N 1.15 1.21 -0.91 1.05 2.02 -1.19 -3.16 112.91 113.08 1cqj h THR 106 Ca 0.32 -1.35 0.16 0.00 0.77 0.00 0.00 66.41 66.31 1cqj h THR 106 Cb -0.10 2.04 -0.10 0.00 -1.74 0.00 0.00 68.15 68.25 1cqj h THR 106 CO -0.08 0.32 0.50 0.58 0.37 0.00 0.00 175.52 177.20 1cqj h VAL 107 N -0.75 0.72 0.03 3.16 2.07 -0.69 -1.88 116.25 118.92 1cqj h VAL 107 Ca -0.01 -0.23 0.02 0.00 0.82 0.00 0.00 66.70 67.30 1cqj h VAL 107 Cb 0.59 -0.01 -0.02 0.00 -1.52 0.00 0.00 31.29 30.33 1cqj h VAL 107 CO 0.02 0.12 -0.13 0.50 0.02 0.00 0.00 177.57 178.10 1cqj h LYS 108 N 0.67 -0.22 -1.01 1.57 1.63 -0.52 -0.23 116.57 118.47 1cqj h LYS 108 Ca 0.50 0.02 0.11 0.00 -0.85 0.00 0.00 60.65 60.43 1cqj h LYS 108 Cb 0.74 0.05 -0.08 0.00 -0.60 0.00 0.00 32.23 32.34 1cqj h LYS 108 CO -0.37 -0.15 0.64 0.28 -3.45 0.00 0.00 179.45 176.40 1cqj h VAL 109 N -0.23 0.94 -0.09 2.00 2.07 -1.33 -1.44 116.25 118.17 1cqj h VAL 109 Ca 0.04 -0.35 -0.02 0.00 0.82 0.00 0.00 66.70 67.19 1cqj h VAL 109 Cb 0.27 -0.17 -0.00 0.00 -1.52 0.00 0.00 31.29 29.87 1cqj h VAL 109 CO -0.11 0.19 -0.01 0.50 0.02 0.00 0.00 177.57 178.16 1cqj h LYS 110 N 1.02 0.16 -0.15 1.57 1.63 -0.78 -1.79 116.57 118.23 1cqj h LYS 110 Ca 0.49 -0.05 0.05 0.00 -0.85 0.00 0.00 60.65 60.29 1cqj h LYS 110 Cb 0.45 -0.01 -0.07 0.00 -0.60 0.00 0.00 32.23 32.01 1cqj h LYS 110 CO -0.25 0.44 -0.33 -0.07 -3.45 0.00 0.00 179.45 175.79 1cqj h LEU 111 N -0.14 -1.03 -0.25 5.20 3.38 -0.52 0.51 115.31 122.46 1cqj h LEU 111 Ca 0.02 0.15 -0.00 0.00 0.09 0.00 0.00 57.88 58.15 1cqj h LEU 111 Cb 0.38 0.44 -0.01 0.00 0.09 0.00 0.00 40.66 41.56 1cqj h LEU 111 CO 0.01 -0.36 0.15 0.44 0.09 0.00 0.00 178.44 178.77 1cqj h ASP 112 N -0.39 0.30 -0.63 -0.43 5.19 -1.32 -1.47 116.42 117.66 1cqj h ASP 112 Ca 0.10 -0.04 -0.03 0.00 -0.62 0.00 0.00 57.03 56.44 1cqj h ASP 112 Cb 0.55 -0.07 -0.03 0.00 0.18 0.00 0.00 39.33 39.96 1cqj h ASP 112 CO -0.37 0.25 0.28 -0.08 -3.12 0.00 0.00 179.24 176.20 1cqj h GLU 113 N 0.32 0.92 -0.19 3.56 4.81 -0.63 -2.65 114.58 120.72 1cqj h GLU 113 Ca 0.09 -0.15 0.00 0.00 -0.13 0.00 0.00 59.36 59.17 1cqj h GLU 113 Cb 0.01 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.23 1cqj h GLU 113 CO -0.02 0.76 0.00 0.00 -0.73 0.00 0.00 179.01 179.02 1cqj n ALA 114 N -2.36 2.48 -2.03 2.92 0.00 0.17 -4.90 120.51 116.79 1cqj n ALA 114 Ca 0.04 -0.31 -0.19 0.00 0.00 0.00 0.00 53.44 52.98 1cqj n ALA 114 Cb 0.14 -0.99 -0.04 0.00 0.00 0.00 0.00 19.45 18.57 1cqj n ALA 114 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1cqj n GLY 115 N 0.77 0.50 3.94 0.00 0.00 -0.66 -5.00 105.19 104.74 1cqj n GLY 115 Ca 0.06 -0.09 -0.25 0.00 0.00 0.00 0.00 46.02 45.73 1cqj n GLY 115 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1cqj s VAL 116 N -2.85 5.25 -0.12 1.61 1.01 -0.65 -5.02 120.40 119.63 1cqj s VAL 116 Ca 0.00 -0.63 -0.01 0.00 0.00 0.00 0.00 61.98 61.35 1cqj s VAL 116 Cb 0.00 -3.78 -0.02 0.00 0.00 0.00 0.00 36.38 32.58 1cqj s VAL 116 CO 0.00 -0.21 -0.09 -0.60 0.00 0.00 0.00 175.10 174.20 1cqj s ARG 117 N -3.52 3.32 -0.04 2.72 6.06 -0.73 -4.55 118.95 122.20 1cqj s ARG 117 Ca 0.36 -0.61 0.01 0.00 -2.50 0.00 0.00 55.73 52.99 1cqj s ARG 117 Cb -0.10 -2.70 0.02 0.00 0.06 0.00 0.00 34.95 32.23 1cqj s ARG 117 CO 0.29 0.32 -0.04 1.41 -2.50 0.00 0.00 175.30 174.78 1cqj s MET 118 N 0.10 0.81 -0.24 5.12 1.75 -1.26 0.10 119.30 125.68 1cqj s MET 118 Ca -0.04 -0.10 -0.06 0.00 -1.25 0.00 0.00 55.69 54.24 1cqj s MET 118 Cb -0.14 -0.81 -0.02 0.00 2.84 0.00 0.00 34.83 36.70 1cqj s MET 118 CO 0.04 -0.08 0.03 0.42 -0.65 0.00 0.00 175.02 174.78 1cqj s ILE 119 N 0.88 3.95 -1.67 10.11 -1.09 0.08 -2.67 121.20 130.79 1cqj s ILE 119 Ca -0.12 -0.32 0.00 0.00 -2.23 0.00 0.00 60.65 57.98 1cqj s ILE 119 Cb -0.14 -2.85 0.00 0.00 -1.58 0.00 0.00 42.46 37.89 1cqj s ILE 119 CO 0.00 0.35 0.00 0.61 -1.23 0.00 0.00 174.94 174.67 1cqj n GLY 120 N 4.87 0.64 1.34 6.18 0.00 -1.25 -1.08 105.19 115.90 1cqj n GLY 120 Ca -0.17 -2.16 -0.09 0.00 0.00 0.00 0.00 46.02 43.61 1cqj n GLY 120 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1cqj n PRO 121 N 0.00 0.09 -3.20 1.61 -0.04 -1.26 -0.20 135.00 132.00 1cqj n PRO 121 Ca 0.00 -0.86 -0.15 0.00 -0.04 0.00 0.00 63.50 62.45 1cqj n PRO 121 Cb 0.00 -0.31 0.07 0.00 -0.04 0.00 0.00 33.50 33.22 1cqj n PRO 121 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 1cqj n ASN 122 N -3.08 -3.71 -4.01 3.54 5.15 0.10 -4.02 115.26 109.23 1cqj n ASN 122 Ca 0.06 -0.59 -0.09 0.00 -0.60 0.00 0.00 54.58 53.36 1cqj n ASN 122 Cb 0.20 -4.68 -0.08 0.00 -0.53 0.00 0.00 39.78 34.69 1cqj n ASN 122 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1cqj h PRO 124 N 2.70 0.04 0.00 0.00 0.13 -1.90 -3.40 132.00 129.57 1cqj h PRO 124 Ca -0.33 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.77 1cqj h PRO 124 Cb 1.21 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1cqj h PRO 124 CO 0.54 0.67 0.00 0.41 -0.23 0.00 0.00 178.00 179.39 1cqj n GLY 125 N 0.33 0.30 2.90 1.56 0.00 -1.26 -0.50 105.19 108.52 1cqj n GLY 125 Ca -0.01 -2.05 -0.13 0.00 0.00 0.00 0.00 46.02 43.83 1cqj n GLY 125 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1cqj s VAL 126 N -0.23 -0.02 -0.00 1.61 1.01 -0.03 -1.24 120.40 121.49 1cqj s VAL 126 Ca 0.00 0.08 0.01 0.00 0.00 0.00 0.00 61.98 62.07 1cqj s VAL 126 Cb 0.00 -0.12 -0.00 0.00 0.00 0.00 0.00 36.38 36.25 1cqj s VAL 126 CO 0.00 0.03 -0.03 -0.51 0.00 0.00 0.00 175.10 174.59 1cqj s ILE 127 N 0.47 0.26 -0.38 2.22 2.07 -0.70 -1.41 121.20 123.73 1cqj s ILE 127 Ca -0.04 -0.19 0.04 0.00 -1.41 0.00 0.00 60.65 59.05 1cqj s ILE 127 Cb -0.05 -0.24 0.11 0.00 0.13 0.00 0.00 42.46 42.41 1cqj s ILE 127 CO -0.02 0.04 0.11 -0.89 -1.91 0.00 0.00 174.94 172.27 1cqj s THR 128 N -0.16 2.41 -0.15 4.00 2.01 0.70 0.51 115.64 124.96 1cqj s THR 128 Ca 0.00 -2.54 -0.41 0.00 0.31 0.00 0.00 61.69 59.06 1cqj s THR 128 Cb -0.02 -2.75 -0.18 0.00 0.01 0.00 0.00 72.50 69.56 1cqj s THR 128 CO -0.00 -0.65 1.38 -2.65 -0.69 0.00 0.00 174.62 172.02 1cqj n PRO 129 N 4.03 0.47 0.00 4.92 -0.02 -1.25 -0.52 135.00 142.63 1cqj n PRO 129 Ca 0.04 0.17 0.00 0.00 -2.02 0.00 0.00 63.50 61.69 1cqj n PRO 129 Cb 0.40 -1.74 0.00 0.00 -0.02 0.00 0.00 33.50 32.14 1cqj n PRO 129 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1cqj n GLY 130 N 2.84 2.37 0.25 -1.23 0.00 -1.26 -4.39 105.19 103.76 1cqj n GLY 130 Ca 0.24 -0.16 -0.21 0.00 0.00 0.00 0.00 46.02 45.88 1cqj n GLY 130 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1cqj n GLU 131 N 0.00 0.49 -3.86 1.61 1.02 -0.10 -4.99 120.64 114.82 1cqj n GLU 131 Ca 0.00 0.21 -0.12 0.00 -0.02 0.00 0.00 57.16 57.23 1cqj n GLU 131 Cb 0.00 -1.34 -0.13 0.00 -0.02 0.00 0.00 31.44 29.96 1cqj n GLU 131 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1cqj s LYS 133 N -0.28 0.35 -0.27 0.00 2.20 -1.26 -0.22 119.74 120.26 1cqj s LYS 133 Ca -0.03 0.01 0.00 0.00 -0.36 0.00 0.00 55.97 55.59 1cqj s LYS 133 Cb -0.02 -1.31 0.08 0.00 -1.51 0.00 0.00 37.83 35.07 1cqj s LYS 133 CO 0.00 -0.46 0.02 0.42 -0.36 0.00 0.00 175.35 174.97 1cqj s ILE 134 N 2.03 1.28 -5.00 5.43 1.01 -0.50 -4.70 121.20 120.74 1cqj s ILE 134 Ca 0.03 -1.33 0.00 0.00 0.00 0.00 0.00 60.65 59.35 1cqj s ILE 134 Cb -0.14 -1.76 0.00 0.00 0.01 0.00 0.00 42.46 40.57 1cqj s ILE 134 CO -0.06 -0.36 0.00 0.61 0.00 0.00 0.00 174.94 175.13 1cqj n GLY 135 N 4.73 0.34 0.02 6.18 0.00 -1.26 -0.85 105.19 114.34 1cqj n GLY 135 Ca -0.06 -1.71 0.11 0.00 0.00 0.00 0.00 46.02 44.36 1cqj n GLY 135 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1cqj n ILE 136 N 9.00 0.09 -1.57 -0.61 -5.35 0.35 -4.89 119.36 116.38 1cqj n ILE 136 Ca 0.00 -0.29 -0.39 0.00 -0.27 0.00 0.00 62.75 61.80 1cqj n ILE 136 Cb 0.00 0.30 0.03 0.00 -1.74 0.00 0.00 39.64 38.24 1cqj n ILE 136 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1cqj n GLN 137 N -1.99 0.92 -2.58 6.28 0.00 -1.25 -4.92 117.38 113.83 1cqj n GLN 137 Ca 0.00 0.34 -0.43 0.00 0.00 0.00 0.00 57.00 56.92 1cqj n GLN 137 Cb 0.46 -1.97 -0.02 0.00 0.00 0.00 0.00 30.24 28.71 1cqj n GLN 137 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.06 175.81 1cqj s PRO 138 N -2.30 3.83 0.51 2.61 0.04 -1.26 -4.96 135.00 133.48 1cqj s PRO 138 Ca 0.70 0.80 0.17 0.00 0.04 0.00 0.00 61.00 62.71 1cqj s PRO 138 Cb -0.48 -3.86 1.26 0.00 0.04 0.00 0.00 34.50 31.46 1cqj s PRO 138 CO 0.52 -1.23 2.12 0.78 0.04 0.00 0.00 177.00 179.23 1cqj h GLY 139 N 10.94 0.05 -0.40 0.56 0.00 -1.96 -3.20 103.07 109.05 1cqj h GLY 139 Ca -0.23 -0.02 0.00 0.00 0.00 0.00 0.00 47.33 47.09 1cqj h GLY 139 CO 1.09 0.01 0.00 -2.39 0.00 0.00 0.00 176.54 175.25 1cqj n HIS 140 N -4.51 0.00 0.31 5.60 1.44 -1.26 -2.98 115.22 113.82 1cqj n HIS 140 Ca -0.00 0.00 0.03 0.00 -2.01 0.00 0.00 57.72 55.74 1cqj n HIS 140 Cb 0.17 -0.03 -0.01 0.00 0.12 0.00 0.00 29.99 30.25 1cqj n HIS 140 CO 0.00 0.00 0.00 0.44 -2.81 0.00 0.00 176.34 173.97 1cqj n ILE 141 N -0.26 0.00 -3.57 0.61 -5.35 -1.21 -5.00 119.36 104.59 1cqj n ILE 141 Ca 0.00 -0.41 -0.19 0.00 -0.27 0.00 0.00 62.75 61.87 1cqj n ILE 141 Cb 0.08 1.07 -0.01 0.00 -1.74 0.00 0.00 39.64 39.04 1cqj n ILE 141 CO 0.00 0.00 0.00 -1.00 -1.76 0.00 0.00 176.55 173.79 1cqj s HIS 142 N -1.17 3.13 -0.21 4.28 0.09 -1.16 -4.38 115.29 115.87 1cqj s HIS 142 Ca 0.05 -0.20 -0.13 0.00 -0.00 0.00 0.00 55.06 54.78 1cqj s HIS 142 Cb 0.06 -1.92 0.06 0.00 -0.00 0.00 0.00 32.58 30.78 1cqj s HIS 142 CO 0.19 0.07 0.53 -1.59 -0.00 0.00 0.00 174.74 173.93 1cqj s LYS 143 N -4.13 0.54 -0.24 1.40 -2.85 -1.26 -4.95 119.74 108.24 1cqj s LYS 143 Ca 0.43 0.93 -0.43 0.00 -1.00 0.00 0.00 55.97 55.89 1cqj s LYS 143 Cb -0.09 0.09 -0.20 0.00 -2.06 0.00 0.00 37.83 35.57 1cqj s LYS 143 CO 0.30 -0.14 1.33 -2.30 0.10 0.00 0.00 175.35 174.64 1cqj n PRO 144 N 4.01 0.01 0.00 1.78 -0.02 -1.26 0.13 135.00 139.65 1cqj n PRO 144 Ca -0.20 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.28 1cqj n PRO 144 Cb 0.57 -1.51 0.00 0.00 -0.02 0.00 0.00 33.50 32.54 1cqj n PRO 144 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1cqj n GLY 145 N 2.71 3.24 0.00 -1.23 0.00 -0.12 -4.29 105.19 105.50 1cqj n GLY 145 Ca 0.25 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.95 1cqj n GLY 145 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1cqj n LYS 146 N 0.00 0.43 -4.21 1.61 2.85 -0.98 -3.43 118.16 114.42 1cqj n LYS 146 Ca 0.00 -0.72 -0.35 0.00 -1.05 0.00 0.00 58.31 56.19 1cqj n LYS 146 Cb 0.00 -0.88 -0.10 0.00 -0.65 0.00 0.00 35.03 33.40 1cqj n LYS 146 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 177.40 177.43 1cqj s VAL 147 N -0.30 4.48 -0.05 0.58 1.01 -0.88 -0.18 120.40 125.06 1cqj s VAL 147 Ca 0.00 -0.16 -0.00 0.00 0.00 0.00 0.00 61.98 61.82 1cqj s VAL 147 Cb 0.00 -2.96 -0.03 0.00 0.00 0.00 0.00 36.38 33.39 1cqj s VAL 147 CO 0.00 0.53 -0.00 -0.83 0.00 0.00 0.00 175.10 174.80 1cqj s GLY 148 N -0.18 1.85 -0.04 4.51 0.00 -0.67 -0.25 107.32 112.54 1cqj s GLY 148 Ca 0.06 -0.87 0.02 0.00 0.00 0.00 0.00 44.72 43.93 1cqj s GLY 148 CO 0.02 -0.67 -0.10 -0.42 0.00 0.00 0.00 173.10 171.92 1cqj s ILE 149 N -0.96 0.90 -0.11 0.90 1.01 -1.14 -0.92 121.20 120.88 1cqj s ILE 149 Ca 0.16 -0.38 0.03 0.00 0.00 0.00 0.00 60.65 60.46 1cqj s ILE 149 Cb -0.11 -0.82 0.00 0.00 0.01 0.00 0.00 42.46 41.54 1cqj s ILE 149 CO 0.05 0.29 -0.22 0.68 0.00 0.00 0.00 174.94 175.74 1cqj s VAL 150 N 0.45 2.18 -0.05 2.92 -7.23 -0.88 0.50 120.40 118.29 1cqj s VAL 150 Ca -0.08 -0.97 -0.07 0.00 -1.81 0.00 0.00 61.98 59.05 1cqj s VAL 150 Cb -0.12 -1.85 0.01 0.00 0.56 0.00 0.00 36.38 34.98 1cqj s VAL 150 CO 0.02 0.55 0.18 -0.55 -0.31 0.00 0.00 175.10 174.98 1cqj s SER 151 N 0.45 -0.14 0.34 4.85 0.15 -0.05 -0.72 113.70 118.59 1cqj s SER 151 Ca -0.15 0.22 0.18 0.00 0.70 0.00 0.00 55.95 56.90 1cqj s SER 151 Cb -0.17 0.33 0.25 0.00 -1.71 0.00 0.00 66.02 64.72 1cqj s SER 151 CO 0.06 -0.15 1.54 0.03 1.20 0.00 0.00 173.24 175.92 1cqj h ARG 152 N 5.43 0.00 -5.88 5.44 3.08 -1.57 -0.36 114.38 120.52 1cqj h ARG 152 Ca -0.27 0.00 -0.67 0.00 0.07 0.00 0.00 59.98 59.11 1cqj h ARG 152 Cb 1.20 0.00 -0.12 0.00 0.08 0.00 0.00 29.97 31.13 1cqj h ARG 152 CO 0.40 0.33 -0.58 0.45 -1.07 0.00 0.00 179.97 179.50 1cqj s SER 153 N -6.35 5.62 -0.15 7.04 0.15 -1.26 -3.62 113.70 115.13 1cqj s SER 153 Ca 0.04 0.24 -0.21 0.00 0.70 0.00 0.00 55.95 56.72 1cqj s SER 153 Cb 0.07 -1.66 -0.18 0.00 -1.71 0.00 0.00 66.02 62.54 1cqj s SER 153 CO 0.71 0.37 0.46 1.23 1.20 0.00 0.00 173.24 177.21 1cqj h GLY 154 N 4.98 0.00 0.89 9.45 0.00 -1.96 -3.23 103.07 113.19 1cqj h GLY 154 Ca -0.52 0.00 0.02 0.00 0.00 0.00 0.00 47.33 46.83 1cqj h GLY 154 CO 0.56 0.00 0.27 -0.91 0.00 0.00 0.00 176.54 176.46 1cqj h THR 155 N -1.00 1.05 -0.73 4.70 1.35 -2.00 -1.11 112.91 115.16 1cqj h THR 155 Ca -0.06 -0.18 0.13 0.00 -0.55 0.00 0.00 66.41 65.74 1cqj h THR 155 Cb 0.83 0.46 -0.05 0.00 -1.73 0.00 0.00 68.15 67.67 1cqj h THR 155 CO -0.04 0.10 0.49 -0.07 -0.25 0.00 0.00 175.52 175.75 1cqj h LEU 156 N 0.54 0.42 -0.46 3.87 3.38 -2.00 0.14 115.31 121.21 1cqj h LEU 156 Ca 0.18 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.17 1cqj h LEU 156 Cb 0.01 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 1cqj h LEU 156 CO -0.08 0.23 0.30 0.74 0.09 0.00 0.00 178.44 179.72 1cqj h THR 157 N 0.46 1.12 -0.35 0.22 2.02 -1.23 -2.18 112.91 112.98 1cqj h THR 157 Ca 0.36 -0.24 0.05 0.00 0.77 0.00 0.00 66.41 67.35 1cqj h THR 157 Cb 0.74 0.46 -0.02 0.00 -1.74 0.00 0.00 68.15 67.59 1cqj h THR 157 CO -0.12 0.12 0.24 1.88 0.37 0.00 0.00 175.52 178.01 1cqj h TYR 158 N 0.62 0.25 0.57 3.16 0.05 -0.65 0.87 116.97 121.84 1cqj h TYR 158 Ca 0.17 0.01 -0.03 0.00 0.05 0.00 0.00 58.73 58.93 1cqj h TYR 158 Cb -0.06 -0.08 0.01 0.00 1.01 0.00 0.00 36.73 37.60 1cqj h TYR 158 CO -0.04 0.14 -0.28 0.93 -1.05 0.00 0.00 178.16 177.86 1cqj h GLU 159 N 0.25 -0.74 -0.93 4.88 4.39 -1.10 -1.81 114.58 119.52 1cqj h GLU 159 Ca 0.15 0.05 0.08 0.00 0.34 0.00 0.00 59.36 59.98 1cqj h GLU 159 Cb 0.29 0.17 -0.07 0.00 -0.10 0.00 0.00 28.75 29.04 1cqj h GLU 159 CO -0.03 -0.44 0.59 0.00 -1.16 0.00 0.00 179.01 177.97 1cqj h ALA 160 N -0.86 1.31 0.16 3.43 0.00 -0.90 -0.08 119.26 122.32 1cqj h ALA 160 Ca -0.08 -0.00 0.02 0.00 0.00 0.00 0.00 54.91 54.84 1cqj h ALA 160 Cb 0.65 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 18.16 1cqj h ALA 160 CO 0.13 0.31 -0.36 0.28 0.00 0.00 0.00 179.25 179.61 1cqj h VAL 161 N 1.03 0.25 -0.28 0.00 2.07 0.80 -1.32 116.25 118.79 1cqj h VAL 161 Ca 0.42 0.00 0.06 0.00 0.82 0.00 0.00 66.70 68.00 1cqj h VAL 161 Cb 0.24 0.25 -0.07 0.00 -1.52 0.00 0.00 31.29 30.20 1cqj h VAL 161 CO -0.20 0.00 -0.16 0.50 0.02 0.00 0.00 177.57 177.74 1cqj h LYS 162 N -0.61 -0.12 -0.23 1.57 1.63 -0.46 -0.79 116.57 117.56 1cqj h LYS 162 Ca 0.02 0.01 0.04 0.00 -0.85 0.00 0.00 60.65 59.87 1cqj h LYS 162 Cb 0.63 0.03 -0.04 0.00 -0.60 0.00 0.00 32.23 32.24 1cqj h LYS 162 CO -0.19 -0.08 -0.05 1.96 -3.45 0.00 0.00 179.45 177.64 1cqj h GLN 163 N -0.12 0.01 0.00 1.90 4.20 -0.76 -1.65 115.11 118.70 1cqj h GLN 163 Ca 0.15 -0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.86 1cqj h GLN 163 Cb 0.35 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.13 1cqj h GLN 163 CO -0.36 0.01 0.00 1.79 -0.67 0.00 0.00 178.83 179.60 1cqj h THR 164 N 0.01 0.00 0.21 -0.54 1.35 -0.62 0.30 112.91 113.62 1cqj h THR 164 Ca 0.11 -0.30 -0.28 0.00 -0.55 0.00 0.00 66.41 65.39 1cqj h THR 164 Cb 0.16 1.10 0.03 0.00 -1.73 0.00 0.00 68.15 67.72 1cqj h THR 164 CO -0.23 0.00 -1.24 0.74 -0.25 0.00 0.00 175.52 174.54 1cqj h THR 165 N 0.00 1.36 0.06 6.82 2.02 -0.60 0.72 112.91 123.28 1cqj h THR 165 Ca 0.00 -2.63 -0.00 0.00 0.77 0.00 0.00 66.41 64.54 1cqj h THR 165 Cb 0.38 3.10 0.00 0.00 -1.74 0.00 0.00 68.15 69.89 1cqj h THR 165 CO 0.00 0.78 -0.03 0.44 0.37 0.00 0.00 175.52 177.08 1cqj h ASP 166 N -0.05 -0.07 0.00 4.18 3.32 -0.91 -1.50 116.42 121.39 1cqj h ASP 166 Ca -0.22 -0.28 0.00 0.00 0.02 0.00 0.00 57.03 56.55 1cqj h ASP 166 Cb 1.97 0.02 0.00 0.00 0.22 0.00 0.00 39.33 41.54 1cqj h ASP 166 CO 0.23 0.25 0.00 -1.22 -1.72 0.00 0.00 179.24 176.78 1cqj n TYR 167 N -4.98 0.00 0.00 4.55 4.02 0.06 -4.81 117.16 116.00 1cqj n TYR 167 Ca -0.08 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.81 1cqj n TYR 167 Cb 0.19 -0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.51 1cqj n TYR 167 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1cqj n GLY 168 N -0.12 2.19 0.31 2.72 0.00 -0.56 -4.90 105.19 104.83 1cqj n GLY 168 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.06 1cqj n GLY 168 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1cqj h PHE 169 N 0.00 0.84 -0.54 1.61 0.04 -1.59 -3.48 116.94 113.82 1cqj h PHE 169 Ca 0.00 0.03 0.06 0.00 2.80 0.00 0.00 57.97 60.86 1cqj h PHE 169 Cb 0.00 -0.25 -0.02 0.00 2.20 0.00 0.00 35.95 37.88 1cqj h PHE 169 CO 0.00 0.32 -0.12 0.41 -0.60 0.00 0.00 178.31 178.32 1cqj n GLY 170 N -1.32 -1.73 3.15 -1.45 0.00 0.17 -2.31 105.19 101.71 1cqj n GLY 170 Ca 0.14 -1.46 -0.23 0.00 0.00 0.00 0.00 46.02 44.48 1cqj n GLY 170 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1cqj s GLN 171 N -1.72 1.17 0.00 1.61 1.11 0.34 -2.08 119.66 120.09 1cqj s GLN 171 Ca 0.00 -0.66 0.00 0.00 0.01 0.00 0.00 55.36 54.71 1cqj s GLN 171 Cb 0.00 -1.17 0.00 0.00 -1.01 0.00 0.00 33.01 30.83 1cqj s GLN 171 CO 0.00 0.31 0.38 -1.13 0.01 0.00 0.00 175.29 174.86 1cqj n SER 172 N 2.35 0.00 -3.79 5.90 3.41 0.65 -0.95 113.62 121.19 1cqj n SER 172 Ca -0.16 0.59 -0.13 0.00 -0.26 0.00 0.00 58.87 58.91 1cqj n SER 172 Cb 0.54 -0.37 -0.13 0.00 -0.26 0.00 0.00 64.21 63.99 1cqj n SER 172 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1cqj s THR 173 N -1.50 -0.02 -0.27 6.66 2.01 -1.26 -3.81 115.64 117.45 1cqj s THR 173 Ca 0.00 0.07 -0.09 0.00 0.31 0.00 0.00 61.69 61.98 1cqj s THR 173 Cb 0.00 -0.23 -0.03 0.00 0.01 0.00 0.00 72.50 72.25 1cqj s THR 173 CO 0.00 0.03 0.13 0.00 -0.69 0.00 0.00 174.62 174.09 1cqj s VAL 175 N 1.68 2.99 -0.51 0.00 1.01 0.18 -1.72 120.40 124.02 1cqj s VAL 175 Ca 0.06 -0.84 -0.19 0.00 0.00 0.00 0.00 61.98 61.02 1cqj s VAL 175 Cb -0.16 -2.45 0.07 0.00 0.00 0.00 0.00 36.38 33.84 1cqj s VAL 175 CO 0.07 0.29 0.61 -0.83 0.00 0.00 0.00 175.10 175.24 1cqj s GLY 176 N 1.38 1.81 0.00 4.51 0.00 -0.38 -0.87 107.32 113.77 1cqj s GLY 176 Ca 0.02 -1.85 0.28 0.00 0.00 0.00 0.00 44.72 43.17 1cqj s GLY 176 CO -0.05 1.43 1.94 0.29 0.00 0.00 0.00 173.10 176.72 1cqj n ILE 177 N 5.55 0.10 0.00 0.90 -5.35 -0.15 -4.43 119.36 116.00 1cqj n ILE 177 Ca -0.08 0.03 0.00 0.00 -0.27 0.00 0.00 62.75 62.43 1cqj n ILE 177 Cb 0.45 -0.57 0.00 0.00 -1.74 0.00 0.00 39.64 37.78 1cqj n ILE 177 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1cqj n GLY 178 N 1.05 1.28 1.36 3.28 0.00 -1.25 -3.79 105.19 107.10 1cqj n GLY 178 Ca 0.13 -1.80 0.09 0.00 0.00 0.00 0.00 46.02 44.45 1cqj n GLY 178 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1cqj n GLY 179 N 1.22 2.84 3.90 -0.02 0.00 -0.78 -4.59 105.19 107.76 1cqj n GLY 179 Ca 0.00 -0.79 -0.28 0.00 0.00 0.00 0.00 46.02 44.95 1cqj n GLY 179 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1cqj s ASP 180 N -1.03 5.93 0.27 1.61 1.01 -1.26 -0.02 116.67 123.17 1cqj s ASP 180 Ca 0.46 0.92 -0.03 0.00 0.71 0.00 0.00 52.55 54.61 1cqj s ASP 180 Cb 0.29 -2.03 0.36 0.00 1.01 0.00 0.00 42.92 42.54 1cqj s ASP 180 CO 0.23 -0.87 1.86 -0.65 0.21 0.00 0.00 175.17 175.96 1cqj h PRO 181 N -0.07 1.01 -3.10 8.23 0.11 -1.88 -3.38 132.00 132.91 1cqj h PRO 181 Ca -0.46 -0.15 -0.61 0.00 0.11 0.00 0.00 66.00 64.90 1cqj h PRO 181 Cb 1.23 -0.18 -0.40 0.00 0.11 0.00 0.00 31.00 31.76 1cqj h PRO 181 CO 0.61 0.79 -0.74 0.42 -0.21 0.00 0.00 178.00 178.88 1cqj s ILE 182 N -5.53 1.33 0.63 4.15 1.01 -1.26 -5.02 121.20 116.51 1cqj s ILE 182 Ca -0.11 -2.37 -0.07 0.00 0.00 0.00 0.00 60.65 58.10 1cqj s ILE 182 Cb 0.16 -1.94 0.02 0.00 0.01 0.00 0.00 42.46 40.71 1cqj s ILE 182 CO 0.81 -0.86 0.96 -2.16 0.00 0.00 0.00 174.94 173.68 1cqj s PRO 183 N 0.56 2.77 0.50 2.79 0.04 -1.26 -4.80 135.00 135.59 1cqj s PRO 183 Ca 0.16 0.02 0.30 0.00 0.04 0.00 0.00 61.00 61.52 1cqj s PRO 183 Cb -0.23 -2.21 1.01 0.00 0.04 0.00 0.00 34.50 33.11 1cqj s PRO 183 CO -0.03 -0.86 1.85 0.78 0.04 0.00 0.00 177.00 178.78 1cqj h GLY 184 N -0.34 0.00 -6.16 0.56 0.00 -0.74 -3.43 103.07 92.95 1cqj h GLY 184 Ca -0.45 0.00 -0.25 0.00 0.00 0.00 0.00 47.33 46.63 1cqj h GLY 184 CO 0.61 0.00 -0.63 -0.56 0.00 0.00 0.00 176.54 175.96 1cqj s SER 185 N -5.77 -0.07 0.00 0.19 0.01 -1.09 -4.54 113.70 102.43 1cqj s SER 185 Ca 0.03 0.22 0.00 0.00 1.31 0.00 0.00 55.95 57.51 1cqj s SER 185 Cb 0.08 0.13 0.00 0.00 0.21 0.00 0.00 66.02 66.44 1cqj s SER 185 CO 0.58 -0.12 0.00 -0.46 0.41 0.00 0.00 173.24 173.65 1cqj n ASN 186 N 3.98 0.52 0.34 2.44 2.04 -1.26 -4.84 115.26 118.48 1cqj n ASN 186 Ca -0.24 0.00 -0.15 0.00 -0.44 0.00 0.00 54.58 53.75 1cqj n ASN 186 Cb 0.53 0.00 -0.08 0.00 -2.53 0.00 0.00 39.78 37.70 1cqj n ASN 186 CO 0.00 0.00 0.00 -0.26 -0.44 0.00 0.00 177.26 176.56 1cqj h PHE 187 N 0.00 -0.82 -1.03 -2.53 0.04 -2.00 -3.16 116.94 107.44 1cqj h PHE 187 Ca 0.00 -0.02 0.30 0.00 2.80 0.00 0.00 57.97 61.05 1cqj h PHE 187 Cb 0.00 0.27 -0.04 0.00 2.20 0.00 0.00 35.95 38.38 1cqj h PHE 187 CO 0.00 -0.48 0.74 0.82 -0.60 0.00 0.00 178.31 178.79 1cqj h ILE 188 N -1.15 0.49 -0.09 -0.55 2.04 -1.93 0.60 117.51 116.93 1cqj h ILE 188 Ca -0.09 -0.00 -0.20 0.00 1.00 0.00 0.00 64.86 65.57 1cqj h ILE 188 Cb 0.71 0.49 -0.00 0.00 -0.74 0.00 0.00 36.82 37.28 1cqj h ILE 188 CO 0.15 0.00 -0.76 0.44 0.00 0.00 0.00 178.15 177.98 1cqj h ASP 189 N 0.00 0.58 0.50 1.72 3.32 -1.94 -2.80 116.42 117.81 1cqj h ASP 189 Ca 0.49 -0.39 -0.29 0.00 0.02 0.00 0.00 57.03 56.85 1cqj h ASP 189 Cb 1.96 -0.17 -0.03 0.00 0.22 0.00 0.00 39.33 41.30 1cqj h ASP 189 CO -0.01 1.15 -1.60 0.40 -1.72 0.00 0.00 179.24 177.46 1cqj h ILE 190 N 0.33 1.01 0.40 0.35 1.08 -0.93 -3.27 117.51 116.49 1cqj h ILE 190 Ca -0.04 -2.78 -0.01 0.00 -0.39 0.00 0.00 64.86 61.64 1cqj h ILE 190 Cb 1.35 2.57 -0.02 0.00 -3.07 0.00 0.00 36.82 37.65 1cqj h ILE 190 CO 0.14 0.69 -0.46 -0.07 -0.69 0.00 0.00 178.15 177.76 1cqj h LEU 191 N 0.03 -1.28 -1.92 1.44 3.38 0.06 -1.66 115.31 115.36 1cqj h LEU 191 Ca -0.26 0.11 0.03 0.00 0.09 0.00 0.00 57.88 57.86 1cqj h LEU 191 Cb 1.98 0.43 -0.00 0.00 0.09 0.00 0.00 40.66 43.16 1cqj h LEU 191 CO 0.11 -0.59 0.39 -0.08 0.09 0.00 0.00 178.44 178.36 1cqj h GLU 192 N -0.87 0.00 0.00 1.13 4.81 -1.64 0.53 114.58 118.54 1cqj h GLU 192 Ca -0.05 0.00 -0.17 0.00 -0.13 0.00 0.00 59.36 59.01 1cqj h GLU 192 Cb 0.77 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.13 1cqj h GLU 192 CO -0.09 0.00 -0.82 0.52 -0.73 0.00 0.00 179.01 177.89 1cqj h MET 193 N 0.00 0.02 0.08 1.92 2.86 -1.35 -3.29 114.93 115.16 1cqj h MET 193 Ca 0.06 -0.02 -0.00 0.00 -2.06 0.00 0.00 59.70 57.67 1cqj h MET 193 Cb 0.84 0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.50 1cqj h MET 193 CO -0.00 0.82 -0.04 0.74 1.06 0.00 0.00 176.91 179.49 1cqj h PHE 194 N 0.01 -0.10 -1.51 -0.22 0.04 -0.67 -3.14 116.94 111.35 1cqj h PHE 194 Ca -0.01 -0.00 0.45 0.00 2.80 0.00 0.00 57.97 61.21 1cqj h PHE 194 Cb 1.45 0.03 -0.09 0.00 2.20 0.00 0.00 35.95 39.54 1cqj h PHE 194 CO 0.00 0.45 1.05 1.49 -0.60 0.00 0.00 178.31 180.70 1cqj h GLU 195 N -0.81 0.05 -0.62 1.51 4.57 -1.53 2.00 114.58 119.75 1cqj h GLU 195 Ca -0.01 -0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.17 1cqj h GLU 195 Cb 0.60 -0.01 0.00 0.00 -0.16 0.00 0.00 28.75 29.17 1cqj h GLU 195 CO 0.02 0.04 0.00 1.63 -1.18 0.00 0.00 179.01 179.51 1cqj n LYS 196 N -4.30 3.68 -3.80 1.92 5.02 -1.23 -4.88 118.16 114.57 1cqj n LYS 196 Ca 0.36 -2.86 -0.36 0.00 -2.02 0.00 0.00 58.31 53.44 1cqj n LYS 196 Cb 1.56 -1.87 -0.13 0.00 -0.02 0.00 0.00 35.03 34.58 1cqj n LYS 196 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1cqj s ASP 197 N -0.97 4.87 0.08 4.39 2.15 0.68 -4.98 116.67 122.89 1cqj s ASP 197 Ca 0.50 -0.27 -0.28 0.00 0.43 0.00 0.00 52.55 52.93 1cqj s ASP 197 Cb 0.32 -1.87 -0.16 0.00 -0.30 0.00 0.00 42.92 40.92 1cqj s ASP 197 CO 0.24 -0.03 1.67 1.55 -0.17 0.00 0.00 175.17 178.43 1cqj h PRO 198 N 8.20 -0.46 0.00 4.34 0.13 -1.90 -2.53 132.00 139.78 1cqj h PRO 198 Ca -0.39 0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.77 1cqj h PRO 198 Cb 1.17 0.11 0.00 0.00 0.13 0.00 0.00 31.00 32.41 1cqj h PRO 198 CO 0.59 -0.31 0.13 0.94 -0.23 0.00 0.00 178.00 179.11 1cqj n GLN 199 N -5.31 0.00 -3.76 0.86 7.27 -1.26 -4.38 117.38 110.81 1cqj n GLN 199 Ca -0.10 0.35 -0.38 0.00 0.07 0.00 0.00 57.00 56.94 1cqj n GLN 199 Cb 0.22 -1.63 -0.12 0.00 2.41 0.00 0.00 30.24 31.12 1cqj n GLN 199 CO 0.00 0.00 0.00 0.99 0.07 0.00 0.00 177.06 178.12 1cqj s THR 200 N -2.68 3.83 -0.07 1.69 2.01 -0.95 -4.22 115.64 115.25 1cqj s THR 200 Ca 0.00 -0.99 0.11 0.00 0.31 0.00 0.00 61.69 61.12 1cqj s THR 200 Cb 0.00 -3.10 -0.24 0.00 0.01 0.00 0.00 72.50 69.17 1cqj s THR 200 CO 0.00 -0.09 0.57 -0.62 -0.69 0.00 0.00 174.62 173.79 1cqj n GLU 201 N 4.83 0.65 -3.83 4.92 1.02 0.75 -4.83 120.64 124.15 1cqj n GLU 201 Ca -0.13 0.27 -0.09 0.00 -0.02 0.00 0.00 57.16 57.19 1cqj n GLU 201 Cb 0.46 -1.76 -0.07 0.00 -0.02 0.00 0.00 31.44 30.05 1cqj n GLU 201 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1cqj s ALA 202 N -2.58 -0.33 -0.07 0.62 0.00 -1.11 -4.00 121.76 114.29 1cqj s ALA 202 Ca -0.07 -0.52 0.05 0.00 0.00 0.00 0.00 51.96 51.41 1cqj s ALA 202 Cb 0.08 0.50 -0.00 0.00 0.00 0.00 0.00 23.12 23.69 1cqj s ALA 202 CO 0.82 -0.52 -0.23 0.42 0.00 0.00 0.00 175.76 176.25 1cqj s ILE 203 N -3.77 1.91 -0.36 0.00 1.01 0.83 -1.67 121.20 119.15 1cqj s ILE 203 Ca 0.04 -0.97 -0.09 0.00 0.00 0.00 0.00 60.65 59.64 1cqj s ILE 203 Cb 0.04 -1.64 0.03 0.00 0.01 0.00 0.00 42.46 40.91 1cqj s ILE 203 CO -0.11 0.53 0.16 -0.69 0.00 0.00 0.00 174.94 174.83 1cqj s VAL 204 N 0.08 4.20 -0.41 2.92 1.01 -0.10 0.49 120.40 128.58 1cqj s VAL 204 Ca -0.09 -0.98 -0.09 0.00 0.00 0.00 0.00 61.98 60.82 1cqj s VAL 204 Cb -0.15 -3.35 0.07 0.00 0.00 0.00 0.00 36.38 32.95 1cqj s VAL 204 CO 0.05 -0.20 0.25 -0.32 0.00 0.00 0.00 175.10 174.88 1cqj s MET 205 N 1.48 2.60 -0.27 2.72 1.75 -0.15 -2.07 119.30 125.36 1cqj s MET 205 Ca 0.00 -1.43 -0.10 0.00 -1.25 0.00 0.00 55.69 52.91 1cqj s MET 205 Cb -0.19 -3.76 -0.04 0.00 2.84 0.00 0.00 34.83 33.68 1cqj s MET 205 CO 0.05 -0.93 0.15 0.42 -0.65 0.00 0.00 175.02 174.06 1cqj s ILE 206 N 1.42 4.93 0.20 10.11 1.01 0.10 -2.24 121.20 136.73 1cqj s ILE 206 Ca 0.03 0.01 0.01 0.00 0.00 0.00 0.00 60.65 60.70 1cqj s ILE 206 Cb -0.23 -3.35 -0.00 0.00 0.01 0.00 0.00 42.46 38.89 1cqj s ILE 206 CO 0.02 0.26 0.02 0.61 0.00 0.00 0.00 174.94 175.86 1cqj n GLY 207 N 5.01 3.87 2.85 6.18 0.00 -0.66 -1.66 105.19 120.77 1cqj n GLY 207 Ca -0.15 -2.17 -0.08 0.00 0.00 0.00 0.00 46.02 43.62 1cqj n GLY 207 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1cqj n GLU 208 N -0.47 0.79 -0.68 1.61 0.28 -1.26 -1.01 120.64 119.90 1cqj n GLU 208 Ca -0.06 -1.88 -0.29 0.00 -0.16 0.00 0.00 57.16 54.77 1cqj n GLU 208 Cb 0.26 2.16 0.21 0.00 1.43 0.00 0.00 31.44 35.50 1cqj n GLU 208 CO 0.00 0.00 0.00 0.96 -0.16 0.00 0.00 177.13 177.93 1cqj s ILE 209 N -2.43 2.12 0.00 3.84 -4.36 -1.02 -4.84 121.20 114.51 1cqj s ILE 209 Ca 0.15 0.04 0.00 0.00 -0.26 0.00 0.00 60.65 60.58 1cqj s ILE 209 Cb -0.03 -2.13 0.00 0.00 1.25 0.00 0.00 42.46 41.55 1cqj s ILE 209 CO 0.11 -0.05 0.00 0.61 0.24 0.00 0.00 174.94 175.85 1cqj n GLY 210 N 0.36 -2.95 6.33 6.27 0.00 0.12 -4.13 105.19 111.19 1cqj n GLY 210 Ca 0.07 -1.11 0.00 0.00 0.00 0.00 0.00 46.02 44.98 1cqj n GLY 210 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1cqj n GLY 211 N -0.71 -1.99 0.94 -0.02 0.00 -1.26 -4.72 105.19 97.42 1cqj n GLY 211 Ca 0.00 -1.47 0.01 0.00 0.00 0.00 0.00 46.02 44.55 1cqj n GLY 211 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1cqj n SER 212 N 0.78 0.29 -0.13 1.61 3.41 -1.26 -4.22 113.62 114.09 1cqj n SER 212 Ca 0.00 -1.89 -0.06 0.00 -0.26 0.00 0.00 58.87 56.65 1cqj n SER 212 Cb 0.00 -0.17 0.10 0.00 -0.26 0.00 0.00 64.21 63.89 1cqj n SER 212 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1cqj h ALA 213 N 0.39 0.97 0.47 7.33 0.00 -1.98 -1.80 119.26 124.63 1cqj h ALA 213 Ca -0.15 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.44 1cqj h ALA 213 Cb 1.55 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 19.15 1cqj h ALA 213 CO 0.01 0.62 -0.26 0.93 0.00 0.00 0.00 179.25 180.54 1cqj h GLU 214 N 0.80 -0.65 -0.83 0.00 3.07 -1.92 -1.51 114.58 113.53 1cqj h GLU 214 Ca 0.14 0.04 0.18 0.00 -0.50 0.00 0.00 59.36 59.23 1cqj h GLU 214 Cb 0.55 0.15 -0.15 0.00 -0.84 0.00 0.00 28.75 28.45 1cqj h GLU 214 CO 0.03 -0.43 -0.13 0.93 -1.40 0.00 0.00 179.01 178.01 1cqj h GLU 215 N -0.67 0.02 -0.60 2.33 3.07 -1.87 0.20 114.58 117.06 1cqj h GLU 215 Ca -0.06 -0.00 -0.04 0.00 -0.50 0.00 0.00 59.36 58.76 1cqj h GLU 215 Cb 0.53 -0.01 -0.03 0.00 -0.84 0.00 0.00 28.75 28.41 1cqj h GLU 215 CO 0.08 0.02 0.23 0.93 -1.40 0.00 0.00 179.01 178.87 1cqj h GLU 216 N 0.03 0.88 -0.43 2.33 5.08 -1.27 -1.99 114.58 119.21 1cqj h GLU 216 Ca 0.43 -0.14 -0.15 0.00 -1.00 0.00 0.00 59.36 58.50 1cqj h GLU 216 Cb 0.71 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.80 1cqj h GLU 216 CO -0.82 0.73 -0.31 0.00 -1.00 0.00 0.00 179.01 177.61 1cqj h ALA 217 N 1.39 0.62 -0.01 3.43 0.00 0.34 -2.34 119.26 122.68 1cqj h ALA 217 Ca 0.20 -0.43 0.01 0.00 0.00 0.00 0.00 54.91 54.70 1cqj h ALA 217 Cb 0.18 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.79 1cqj h ALA 217 CO -0.02 0.67 -0.36 0.00 0.00 0.00 0.00 179.25 179.54 1cqj h ALA 218 N 0.81 -0.80 -0.88 0.00 0.00 -0.15 0.99 119.26 119.23 1cqj h ALA 218 Ca 0.08 -0.06 0.21 0.00 0.00 0.00 0.00 54.91 55.14 1cqj h ALA 218 Cb 0.90 0.82 -0.12 0.00 0.00 0.00 0.00 17.79 19.39 1cqj h ALA 218 CO 0.08 -0.91 0.38 0.00 0.00 0.00 0.00 179.25 178.81 1cqj h ALA 219 N -0.77 1.38 -0.26 0.00 0.00 -1.38 -0.01 119.26 118.23 1cqj h ALA 219 Ca 0.01 0.15 -0.04 0.00 0.00 0.00 0.00 54.91 55.03 1cqj h ALA 219 Cb 0.48 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 1cqj h ALA 219 CO -0.25 -0.31 0.01 -0.92 0.00 0.00 0.00 179.25 177.78 1cqj h TYR 220 N 0.42 0.49 -0.18 0.00 5.03 -0.35 -3.09 116.97 119.29 1cqj h TYR 220 Ca 0.54 -0.08 0.05 0.00 2.58 0.00 0.00 58.73 61.82 1cqj h TYR 220 Cb 0.99 -0.13 -0.06 0.00 1.55 0.00 0.00 36.73 39.08 1cqj h TYR 220 CO -0.14 0.60 -0.24 0.82 -1.32 0.00 0.00 178.16 177.88 1cqj h ILE 221 N 0.24 0.41 -0.58 1.81 2.04 0.27 0.15 117.51 121.85 1cqj h ILE 221 Ca 0.08 0.00 0.10 0.00 1.00 0.00 0.00 64.86 66.04 1cqj h ILE 221 Cb 0.39 0.41 -0.11 0.00 -0.74 0.00 0.00 36.82 36.77 1cqj h ILE 221 CO 0.01 0.00 -0.32 0.50 0.00 0.00 0.00 178.15 178.34 1cqj h LYS 222 N -0.28 -0.15 0.00 2.37 3.64 -1.23 0.19 116.57 121.11 1cqj h LYS 222 Ca 0.12 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.51 1cqj h LYS 222 Cb 0.45 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.31 1cqj h LYS 222 CO -0.34 -0.10 -0.32 1.49 -2.27 0.00 0.00 179.45 177.91 1cqj h GLU 223 N -0.16 0.00 0.00 1.90 4.81 -1.37 -3.41 114.58 116.35 1cqj h GLU 223 Ca 0.23 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.46 1cqj h GLU 223 Cb 0.55 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.93 1cqj h GLU 223 CO -0.67 0.00 0.00 0.72 -0.73 0.00 0.00 179.01 178.33 1cqj n HIS 224 N -2.79 0.00 -3.74 0.92 8.25 0.47 -5.02 115.22 113.31 1cqj n HIS 224 Ca 0.03 0.00 -0.37 0.00 -0.26 0.00 0.00 57.72 57.13 1cqj n HIS 224 Cb 0.51 0.00 -0.11 0.00 1.12 0.00 0.00 29.99 31.52 1cqj n HIS 224 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1cqj s VAL 225 N -0.06 4.93 -0.26 1.59 1.01 0.65 -4.96 120.40 123.30 1cqj s VAL 225 Ca 0.00 0.03 -0.05 0.00 0.00 0.00 0.00 61.98 61.97 1cqj s VAL 225 Cb 0.00 -3.30 -0.15 0.00 0.00 0.00 0.00 36.38 32.93 1cqj s VAL 225 CO 0.00 0.34 -0.28 0.35 0.00 0.00 0.00 175.10 175.51 1cqj n THR 226 N 4.54 1.49 -1.01 3.92 -2.24 -1.26 -4.71 114.28 115.00 1cqj n THR 226 Ca -0.15 -0.49 -0.34 0.00 -2.27 0.00 0.00 64.05 60.80 1cqj n THR 226 Cb 0.52 -1.61 0.11 0.00 -2.10 0.00 0.00 70.33 67.25 1cqj n THR 226 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1cqj n LYS 227 N -3.68 0.00 -2.16 -0.78 5.02 -1.26 -4.89 118.16 110.41 1cqj n LYS 227 Ca -0.49 0.06 -0.41 0.00 -2.02 0.00 0.00 58.31 55.44 1cqj n LYS 227 Cb 0.94 -2.01 -0.03 0.00 -0.02 0.00 0.00 35.03 33.91 1cqj n LYS 227 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1cqj s PRO 228 N -3.51 4.37 -0.16 1.97 0.04 -1.26 -4.86 135.00 131.58 1cqj s PRO 228 Ca 0.64 2.13 0.01 0.00 0.04 0.00 0.00 61.00 63.81 1cqj s PRO 228 Cb -0.27 -3.16 0.02 0.00 0.04 0.00 0.00 34.50 31.13 1cqj s PRO 228 CO 0.60 -0.26 -0.17 0.08 0.04 0.00 0.00 177.00 177.28 1cqj s VAL 229 N -0.15 1.82 -0.23 -0.36 1.01 -1.26 -0.12 120.40 121.11 1cqj s VAL 229 Ca 0.56 -0.79 -0.05 0.00 0.00 0.00 0.00 61.98 61.69 1cqj s VAL 229 Cb -0.38 -1.67 -0.01 0.00 0.00 0.00 0.00 36.38 34.32 1cqj s VAL 229 CO 0.42 0.50 -0.01 -0.69 0.00 0.00 0.00 175.10 175.32 1cqj s VAL 230 N 1.32 3.64 0.18 2.92 1.01 0.18 -0.53 120.40 129.12 1cqj s VAL 230 Ca 0.04 -0.42 0.11 0.00 0.00 0.00 0.00 61.98 61.70 1cqj s VAL 230 Cb -0.13 -2.68 -0.04 0.00 0.00 0.00 0.00 36.38 33.52 1cqj s VAL 230 CO -0.11 0.38 -0.20 -0.83 0.00 0.00 0.00 175.10 174.34 1cqj s GLY 231 N 1.51 1.70 -0.02 4.51 0.00 -0.29 -0.98 107.32 113.76 1cqj s GLY 231 Ca 0.06 -1.56 0.01 0.00 0.00 0.00 0.00 44.72 43.23 1cqj s GLY 231 CO -0.01 -1.58 -0.02 -0.47 0.00 0.00 0.00 173.10 171.02 1cqj s TYR 232 N -1.57 0.36 -0.19 1.90 5.04 -0.95 -1.85 117.35 120.09 1cqj s TYR 232 Ca 0.21 -0.04 -0.01 0.00 -2.44 0.00 0.00 57.07 54.79 1cqj s TYR 232 Cb -0.09 -0.36 0.01 0.00 0.35 0.00 0.00 41.96 41.87 1cqj s TYR 232 CO 0.11 -0.09 -0.14 0.42 -1.34 0.00 0.00 175.55 174.50 1cqj s ILE 233 N 0.60 2.57 0.14 3.14 -1.09 -1.26 -1.66 121.20 123.65 1cqj s ILE 233 Ca -0.06 -0.77 -0.14 0.00 -2.23 0.00 0.00 60.65 57.45 1cqj s ILE 233 Cb -0.09 -2.11 -0.07 0.00 -1.58 0.00 0.00 42.46 38.61 1cqj s ILE 233 CO -0.01 0.50 0.54 0.00 -1.23 0.00 0.00 174.94 174.74 1cqj s ALA 234 N 1.25 3.59 0.00 9.38 0.00 -0.18 -4.67 121.76 131.12 1cqj s ALA 234 Ca 0.03 -0.15 0.00 0.00 0.00 0.00 0.00 51.96 51.84 1cqj s ALA 234 Cb -0.14 -2.51 0.00 0.00 0.00 0.00 0.00 23.12 20.47 1cqj s ALA 234 CO -0.07 0.46 0.00 0.41 0.00 0.00 0.00 175.76 176.56 1cqj n GLY 235 N 0.79 1.91 0.25 0.00 0.00 -1.26 -2.44 105.19 104.44 1cqj n GLY 235 Ca -0.05 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.84 1cqj n GLY 235 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1cqj h VAL 236 N 0.00 1.28 -0.01 1.61 2.07 -1.95 -2.86 116.25 116.39 1cqj h VAL 236 Ca 0.00 -1.51 0.00 0.00 0.82 0.00 0.00 66.70 66.01 1cqj h VAL 236 Cb 0.00 1.40 0.00 0.00 -1.52 0.00 0.00 31.29 31.17 1cqj h VAL 236 CO 0.00 0.50 0.00 0.35 0.02 0.00 0.00 177.57 178.44 1cqj n THR 237 N -4.12 0.02 -2.46 2.57 -2.24 -1.26 -4.91 114.28 101.88 1cqj n THR 237 Ca -0.02 -0.03 -0.41 0.00 -2.27 0.00 0.00 64.05 61.32 1cqj n THR 237 Cb 0.51 -0.20 -0.04 0.00 -2.10 0.00 0.00 70.33 68.51 1cqj n THR 237 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1cqj s ALA 238 N -1.98 3.39 0.73 6.98 0.00 -1.08 -5.03 121.76 124.77 1cqj s ALA 238 Ca 0.24 0.87 -0.12 0.00 0.00 0.00 0.00 51.96 52.95 1cqj s ALA 238 Cb 0.11 -3.38 0.03 0.00 0.00 0.00 0.00 23.12 19.89 1cqj s ALA 238 CO 0.19 -0.28 1.09 -1.25 0.00 0.00 0.00 175.76 175.51 1cqj s PRO 239 N -0.30 2.51 0.22 0.00 0.04 -1.26 -5.02 135.00 131.19 1cqj s PRO 239 Ca 0.51 1.19 -0.21 0.00 0.04 0.00 0.00 61.00 62.53 1cqj s PRO 239 Cb -0.31 -1.93 -0.08 0.00 0.04 0.00 0.00 34.50 32.22 1cqj s PRO 239 CO 0.36 -1.45 0.75 0.15 0.04 0.00 0.00 177.00 176.84 1cqj s LYS 240 N -4.71 4.32 -1.09 4.56 1.02 -1.26 -4.30 119.74 118.29 1cqj s LYS 240 Ca 0.62 0.95 -0.05 0.00 0.02 0.00 0.00 55.97 57.51 1cqj s LYS 240 Cb -0.17 -2.93 0.01 0.00 -0.52 0.00 0.00 37.83 34.21 1cqj s LYS 240 CO 0.52 0.41 0.94 0.41 -0.92 0.00 0.00 175.35 176.71 1cqj n GLY 241 N 0.85 -0.27 2.84 -3.33 0.00 0.11 -4.97 105.19 100.42 1cqj n GLY 241 Ca -0.03 0.07 -0.15 0.00 0.00 0.00 0.00 46.02 45.91 1cqj n GLY 241 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1cqj s LYS 242 N -5.77 0.03 0.12 1.61 1.02 -1.26 -4.98 119.74 110.50 1cqj s LYS 242 Ca 0.32 0.35 -0.31 0.00 0.02 0.00 0.00 55.97 56.35 1cqj s LYS 242 Cb -0.14 -0.25 -0.09 0.00 -0.52 0.00 0.00 37.83 36.83 1cqj s LYS 242 CO 0.61 -0.20 1.65 0.50 -0.92 0.00 0.00 175.35 176.99 1cqj s ARG 243 N 1.42 4.19 -1.03 1.68 3.52 -1.26 -4.54 118.95 122.93 1cqj s ARG 243 Ca -0.06 2.39 -0.04 0.00 -0.13 0.00 0.00 55.73 57.89 1cqj s ARG 243 Cb -0.12 -3.41 0.28 0.00 -1.56 0.00 0.00 34.95 30.14 1cqj s ARG 243 CO -0.05 -0.71 1.23 -1.33 -0.81 0.00 0.00 175.30 173.63 1cqj n MET 244 N 4.95 3.81 0.00 5.12 2.81 -0.52 -4.89 117.12 128.40 1cqj n MET 244 Ca 0.15 -4.53 0.00 0.00 -1.81 0.00 0.00 57.70 51.51 1cqj n MET 244 Cb 0.39 -2.49 0.00 0.00 -0.71 0.00 0.00 33.22 30.41 1cqj n MET 244 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1cqj n GLY 245 N 1.80 2.09 3.75 3.03 0.00 -1.26 -4.82 105.19 109.77 1cqj n GLY 245 Ca 0.25 0.10 -0.41 0.00 0.00 0.00 0.00 46.02 45.96 1cqj n GLY 245 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1cqj s HIS 246 N 0.00 2.88 0.26 1.61 3.76 -1.26 -4.91 115.29 117.62 1cqj s HIS 246 Ca 0.00 0.87 -0.03 0.00 -0.15 0.00 0.00 55.06 55.75 1cqj s HIS 246 Cb 0.00 -3.96 0.42 0.00 1.11 0.00 0.00 32.58 30.16 1cqj s HIS 246 CO 0.00 -3.20 1.83 0.00 -0.85 0.00 0.00 174.74 172.52 1cqj h ALA 247 N 5.06 1.28 0.00 -1.40 0.00 -1.90 -0.65 119.26 121.66 1cqj h ALA 247 Ca -0.46 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1cqj h ALA 247 Cb 1.22 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.82 1cqj h ALA 247 CO 0.80 0.20 0.00 0.41 0.00 0.00 0.00 179.25 180.66 1cqj n GLY 248 N -1.33 -1.37 3.18 0.00 0.00 0.97 -4.56 105.19 102.07 1cqj n GLY 248 Ca 0.15 -0.10 -0.43 0.00 0.00 0.00 0.00 46.02 45.64 1cqj n GLY 248 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1cqj n ALA 249 N -1.45 4.54 -3.66 4.61 0.00 -0.25 -4.50 120.51 119.79 1cqj n ALA 249 Ca 0.08 -4.08 -0.11 0.00 0.00 0.00 0.00 53.44 49.33 1cqj n ALA 249 Cb 0.29 -3.29 -0.11 0.00 0.00 0.00 0.00 19.45 16.35 1cqj n ALA 249 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 1cqj s ILE 250 N 2.33 -0.02 -0.54 0.00 2.07 -1.26 -1.45 121.20 122.33 1cqj s ILE 250 Ca 0.46 0.08 -0.27 0.00 -1.41 0.00 0.00 60.65 59.51 1cqj s ILE 250 Cb 0.06 -0.61 0.03 0.00 0.13 0.00 0.00 42.46 42.07 1cqj s ILE 250 CO 0.00 0.03 1.12 -0.63 -1.91 0.00 0.00 174.94 173.55 1cqj s ILE 251 N 1.29 4.16 -0.22 2.00 1.01 -1.26 -4.09 121.20 124.09 1cqj s ILE 251 Ca -0.09 0.85 -0.04 0.00 0.00 0.00 0.00 60.65 61.38 1cqj s ILE 251 Cb -0.08 -4.65 -0.01 0.00 0.01 0.00 0.00 42.46 37.74 1cqj s ILE 251 CO -0.11 -1.19 -0.04 0.00 0.00 0.00 0.00 174.94 173.59 1cqj s ALA 252 N 4.58 2.82 -1.07 9.38 0.00 -1.15 -0.71 121.76 135.61 1cqj s ALA 252 Ca 0.41 -1.15 -0.02 0.00 0.00 0.00 0.00 51.96 51.20 1cqj s ALA 252 Cb -0.08 -1.70 0.00 0.00 0.00 0.00 0.00 23.12 21.34 1cqj s ALA 252 CO 0.26 -0.41 0.29 0.41 0.00 0.00 0.00 175.76 176.31 1cqj n GLY 253 N 4.75 -0.13 2.59 0.00 0.00 -1.26 -2.30 105.19 108.84 1cqj n GLY 253 Ca -0.18 -0.22 -0.00 0.00 0.00 0.00 0.00 46.02 45.61 1cqj n GLY 253 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1cqj n GLY 254 N -1.19 0.24 3.88 -0.02 0.00 -1.26 -5.00 105.19 101.84 1cqj n GLY 254 Ca -0.10 -0.01 -0.26 0.00 0.00 0.00 0.00 46.02 45.64 1cqj n GLY 254 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1cqj s LYS 255 N -1.25 3.21 -0.21 1.61 -0.14 -0.97 -4.65 119.74 117.33 1cqj s LYS 255 Ca 0.00 -0.70 -0.01 0.00 -1.36 0.00 0.00 55.97 53.90 1cqj s LYS 255 Cb 0.00 -2.83 0.00 0.00 -1.68 0.00 0.00 37.83 33.32 1cqj s LYS 255 CO 0.00 0.51 0.18 0.41 -0.76 0.00 0.00 175.35 175.69 1cqj n GLY 256 N -0.41 0.59 3.87 -3.33 0.00 -1.26 -2.94 105.19 101.71 1cqj n GLY 256 Ca -0.07 -0.49 -0.31 0.00 0.00 0.00 0.00 46.02 45.15 1cqj n GLY 256 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1cqj s THR 257 N -3.05 4.81 0.26 2.61 -4.23 -1.26 0.15 115.64 114.92 1cqj s THR 257 Ca 0.07 0.62 -0.03 0.00 -1.18 0.00 0.00 61.69 61.17 1cqj s THR 257 Cb -0.03 -3.67 0.25 0.00 1.34 0.00 0.00 72.50 70.39 1cqj s THR 257 CO 0.12 -0.30 1.68 0.00 -0.54 0.00 0.00 174.62 175.58 1cqj h ALA 258 N 1.88 1.07 -0.26 3.99 0.00 -1.87 -2.87 119.26 121.20 1cqj h ALA 258 Ca -0.47 0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.57 1cqj h ALA 258 Cb 1.18 0.22 -0.01 0.00 0.00 0.00 0.00 17.79 19.18 1cqj h ALA 258 CO 0.66 -0.34 0.02 -0.44 0.00 0.00 0.00 179.25 179.14 1cqj h ASP 259 N 0.29 0.43 -0.62 0.00 3.32 -1.93 -2.26 116.42 115.66 1cqj h ASP 259 Ca 0.45 -0.29 0.06 0.00 0.02 0.00 0.00 57.03 57.28 1cqj h ASP 259 Cb 0.80 -0.12 -0.04 0.00 0.22 0.00 0.00 39.33 40.20 1cqj h ASP 259 CO -0.53 0.61 0.41 -0.33 -1.72 0.00 0.00 179.24 177.69 1cqj h GLU 260 N 0.24 0.60 -0.45 3.56 5.08 -1.91 0.11 114.58 121.81 1cqj h GLU 260 Ca 0.08 -0.04 -0.07 0.00 -1.00 0.00 0.00 59.36 58.33 1cqj h GLU 260 Cb 0.38 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.48 1cqj h GLU 260 CO 0.01 0.40 -0.01 0.87 -1.00 0.00 0.00 179.01 179.28 1cqj h LYS 261 N 0.62 0.79 0.90 2.33 1.57 -1.36 -1.39 116.57 120.03 1cqj h LYS 261 Ca 0.27 -0.26 -0.04 0.00 -1.87 0.00 0.00 60.65 58.75 1cqj h LYS 261 Cb 0.27 -0.07 0.01 0.00 0.08 0.00 0.00 32.23 32.52 1cqj h LYS 261 CO -0.08 0.86 -0.43 0.74 -0.57 0.00 0.00 179.45 179.97 1cqj h PHE 262 N 0.64 -1.13 -0.96 -1.35 0.04 -0.77 -1.48 116.94 111.93 1cqj h PHE 262 Ca 0.13 -0.03 0.16 0.00 2.80 0.00 0.00 57.97 61.03 1cqj h PHE 262 Cb 0.51 0.37 -0.16 0.00 2.20 0.00 0.00 35.95 38.87 1cqj h PHE 262 CO 0.04 -0.70 -0.35 0.00 -0.60 0.00 0.00 178.31 176.70 1cqj h ALA 263 N -1.21 0.27 0.00 2.45 0.00 -0.73 0.41 119.26 120.44 1cqj h ALA 263 Ca -0.12 0.30 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 1cqj h ALA 263 Cb 0.93 0.93 -0.00 0.00 0.00 0.00 0.00 17.79 19.65 1cqj h ALA 263 CO 0.20 -0.57 -0.08 0.00 0.00 0.00 0.00 179.25 178.81 1cqj h ALA 264 N 1.50 1.00 0.02 0.00 0.00 -1.20 -1.83 119.26 118.75 1cqj h ALA 264 Ca 0.37 -0.07 -0.21 0.00 0.00 0.00 0.00 54.91 55.00 1cqj h ALA 264 Cb 0.62 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 1cqj h ALA 264 CO -0.97 0.10 -0.97 -0.07 0.00 0.00 0.00 179.25 177.34 1cqj h LEU 265 N 0.00 0.16 -0.25 0.00 3.38 0.84 -3.13 115.31 116.31 1cqj h LEU 265 Ca -0.00 -0.15 -0.12 0.00 0.09 0.00 0.00 57.88 57.71 1cqj h LEU 265 Cb 0.67 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.37 1cqj h LEU 265 CO 0.01 1.03 -0.30 -0.33 0.09 0.00 0.00 178.44 178.94 1cqj h GLU 266 N 0.05 0.65 -0.87 1.13 5.08 -0.78 -1.26 114.58 118.58 1cqj h GLU 266 Ca -0.04 -0.36 0.12 0.00 -1.00 0.00 0.00 59.36 58.08 1cqj h GLU 266 Cb 1.66 0.02 -0.07 0.00 0.50 0.00 0.00 28.75 30.86 1cqj h GLU 266 CO 0.14 0.97 0.56 0.00 -1.00 0.00 0.00 179.01 179.68 1cqj h ALA 267 N 0.67 1.75 -0.08 3.43 0.00 -1.38 1.06 119.26 124.71 1cqj h ALA 267 Ca 0.03 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1cqj h ALA 267 Cb 0.87 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.51 1cqj h ALA 267 CO 0.07 0.04 0.00 0.00 0.00 0.00 0.00 179.25 179.36 1cqj n ALA 268 N -2.43 2.52 -2.68 0.00 0.00 -1.06 -4.88 120.51 111.98 1cqj n ALA 268 Ca 0.16 -0.20 -0.02 0.00 0.00 0.00 0.00 53.44 53.38 1cqj n ALA 268 Cb 0.39 -1.09 0.01 0.00 0.00 0.00 0.00 19.45 18.76 1cqj n ALA 268 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1cqj n GLY 269 N 0.75 -0.95 3.28 0.00 0.00 0.37 -4.44 105.19 104.19 1cqj n GLY 269 Ca 0.08 0.31 -0.27 0.00 0.00 0.00 0.00 46.02 46.13 1cqj n GLY 269 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1cqj s VAL 270 N -3.04 1.82 -0.88 1.61 1.01 -0.50 -4.83 120.40 115.59 1cqj s VAL 270 Ca 0.05 -1.21 -0.25 0.00 0.00 0.00 0.00 61.98 60.57 1cqj s VAL 270 Cb -0.01 -1.56 0.02 0.00 0.00 0.00 0.00 36.38 34.83 1cqj s VAL 270 CO 0.56 0.30 1.56 -0.75 0.00 0.00 0.00 175.10 176.77 1cqj s LYS 271 N -1.08 3.17 0.40 2.72 2.36 0.31 -4.46 119.74 123.16 1cqj s LYS 271 Ca 0.09 -0.55 -0.20 0.00 -2.55 0.00 0.00 55.97 52.77 1cqj s LYS 271 Cb -0.09 -4.91 -0.10 0.00 -1.05 0.00 0.00 37.83 31.68 1cqj s LYS 271 CO 0.01 -2.50 0.89 0.95 1.55 0.00 0.00 175.35 176.26 1cqj s THR 272 N 6.68 4.46 -0.08 3.43 -4.23 -1.26 -1.14 115.64 123.49 1cqj s THR 272 Ca 0.51 1.36 0.01 0.00 -1.18 0.00 0.00 61.69 62.39 1cqj s THR 272 Cb -0.05 -3.62 0.02 0.00 1.34 0.00 0.00 72.50 70.19 1cqj s THR 272 CO 0.01 -0.26 -0.10 -0.69 -0.54 0.00 0.00 174.62 173.04 1cqj s VAL 273 N -2.10 1.08 -0.66 2.29 1.01 -0.77 -4.92 120.40 116.33 1cqj s VAL 273 Ca 0.59 -0.40 0.25 0.00 0.00 0.00 0.00 61.98 62.42 1cqj s VAL 273 Cb -0.10 -1.03 0.22 0.00 0.00 0.00 0.00 36.38 35.48 1cqj s VAL 273 CO 0.15 0.36 1.62 0.03 0.00 0.00 0.00 175.10 177.25 1cqj h ARG 274 N 7.40 0.00 -4.86 2.72 2.47 -1.96 -3.43 114.38 116.73 1cqj h ARG 274 Ca -0.31 0.00 -0.62 0.00 -1.26 0.00 0.00 59.98 57.79 1cqj h ARG 274 Cb 1.17 0.00 -0.35 0.00 -1.65 0.00 0.00 29.97 29.14 1cqj h ARG 274 CO 0.45 0.00 -0.84 0.45 0.56 0.00 0.00 179.97 180.59 1cqj s SER 275 N -4.68 2.70 0.00 7.04 0.15 -1.26 -4.98 113.70 112.67 1cqj s SER 275 Ca 0.09 -0.50 0.09 0.00 0.70 0.00 0.00 55.95 56.33 1cqj s SER 275 Cb 0.12 -1.22 0.55 0.00 -1.71 0.00 0.00 66.02 63.76 1cqj s SER 275 CO 0.64 0.01 1.04 0.00 1.20 0.00 0.00 173.24 176.13 1cqj n LEU 276 N 4.33 0.00 0.01 3.45 -0.00 -1.26 -1.46 117.00 122.07 1cqj n LEU 276 Ca -0.19 0.04 -0.15 0.00 -0.00 0.00 0.00 56.01 55.71 1cqj n LEU 276 Cb 0.51 -0.04 -0.04 0.00 -0.00 0.00 0.00 43.42 43.85 1cqj n LEU 276 CO 0.24 -0.03 0.27 0.00 -0.00 0.00 0.00 177.39 177.87 1cqj h ALA 277 N 2.57 0.38 -0.71 1.47 0.00 -1.97 -3.31 119.26 117.69 1cqj h ALA 277 Ca 0.00 -0.62 -0.50 0.00 0.00 0.00 0.00 54.91 53.79 1cqj h ALA 277 Cb 0.01 -0.02 -0.21 0.00 0.00 0.00 0.00 17.79 17.57 1cqj h ALA 277 CO 0.00 0.72 0.63 -0.25 0.00 0.00 0.00 179.25 180.35 1cqj n ASP 278 N -3.88 7.02 0.01 0.00 8.00 -0.54 -4.43 116.55 122.73 1cqj n ASP 278 Ca -0.07 -3.40 -0.18 0.00 0.71 0.00 0.00 54.79 51.86 1cqj n ASP 278 Cb 0.76 -1.04 -0.13 0.00 -0.02 0.00 0.00 41.12 40.69 1cqj n ASP 278 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 1cqj h ILE 279 N 1.12 1.55 0.09 0.53 2.04 -1.74 -3.00 117.51 118.09 1cqj h ILE 279 Ca 0.44 -2.29 0.01 0.00 1.00 0.00 0.00 64.86 64.02 1cqj h ILE 279 Cb 0.81 3.02 -0.02 0.00 -0.74 0.00 0.00 36.82 39.90 1cqj h ILE 279 CO 1.14 0.64 -0.13 1.23 0.00 0.00 0.00 178.15 181.02 1cqj h GLY 280 N -0.44 -0.24 -0.42 5.37 0.00 -1.88 -2.81 103.07 102.65 1cqj h GLY 280 Ca -0.08 0.15 0.21 0.00 0.00 0.00 0.00 47.33 47.61 1cqj h GLY 280 CO 0.10 -0.13 0.13 0.83 0.00 0.00 0.00 176.54 177.47 1cqj h GLU 281 N -0.27 0.16 0.00 4.80 4.39 -1.85 0.38 114.58 122.18 1cqj h GLU 281 Ca 0.02 -0.01 -0.02 0.00 0.34 0.00 0.00 59.36 59.69 1cqj h GLU 281 Cb 0.28 -0.04 -0.00 0.00 -0.10 0.00 0.00 28.75 28.89 1cqj h GLU 281 CO -0.07 0.11 -0.09 0.00 -1.16 0.00 0.00 179.01 177.80 1cqj h ALA 282 N 1.75 1.04 0.00 3.43 0.00 -1.35 -2.63 119.26 121.50 1cqj h ALA 282 Ca 0.49 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 55.28 1cqj h ALA 282 Cb 0.94 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.71 1cqj h ALA 282 CO -0.66 0.11 -0.20 -0.07 0.00 0.00 0.00 179.25 178.43 1cqj h LEU 283 N 0.00 0.00 -1.62 0.00 3.38 -0.78 -2.98 115.31 113.31 1cqj h LEU 283 Ca -0.00 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.92 1cqj h LEU 283 Cb 0.56 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.30 1cqj h LEU 283 CO 0.01 0.20 -0.21 0.50 0.09 0.00 0.00 178.44 179.03 1cqj h LYS 284 N 0.00 0.00 -1.08 1.13 3.64 -1.19 -1.54 116.57 117.53 1cqj h LYS 284 Ca -0.00 0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 59.32 1cqj h LYS 284 Cb 1.10 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.89 1cqj h LYS 284 CO 0.03 0.21 0.07 2.41 -2.27 0.00 0.00 179.45 179.90 1cqj n THR 285 N -3.98 1.32 0.00 1.00 -1.04 -1.13 -5.15 114.28 105.30 1cqj n THR 285 Ca -0.02 -0.26 0.00 0.00 -2.04 0.00 0.00 64.05 61.73 1cqj n THR 285 Cb 0.29 -0.99 0.00 0.00 -1.82 0.00 0.00 70.33 67.81 1cqj n THR 285 CO 0.00 0.00 0.00 1.33 -0.64 0.00 0.00 175.07 175.76