#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yqs n PRO 4 N 0.00 -0.00 -2.06 3.23 -0.02 -1.26 -4.95 135.00 129.94 1yqs n PRO 4 Ca 0.00 0.07 -0.41 0.00 -2.02 0.00 0.00 63.50 61.14 1yqs n PRO 4 Cb 0.00 -2.20 -0.02 0.00 -0.02 0.00 0.00 33.50 31.26 1yqs n PRO 4 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1yqs s ALA 5 N -2.23 3.53 0.60 3.55 0.00 -1.26 -4.78 121.76 121.17 1yqs s ALA 5 Ca 0.67 1.31 -0.19 0.00 0.00 0.00 0.00 51.96 53.76 1yqs s ALA 5 Cb -0.27 -3.51 -0.04 0.00 0.00 0.00 0.00 23.12 19.30 1yqs s ALA 5 CO 0.57 -0.71 1.15 -2.30 0.00 0.00 0.00 175.76 174.46 1yqs n PRO 6 N 1.12 1.13 -3.55 0.00 -0.02 -1.26 -3.99 135.00 128.43 1yqs n PRO 6 Ca 0.02 0.43 -0.41 0.00 -2.02 0.00 0.00 63.50 61.52 1yqs n PRO 6 Cb 0.41 -2.36 -0.07 0.00 -0.02 0.00 0.00 33.50 31.46 1yqs n PRO 6 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1yqs s ASP 7 N -1.21 5.80 0.29 2.55 2.15 -0.38 -4.87 116.67 120.99 1yqs s ASP 7 Ca 0.77 -2.32 0.06 0.00 0.43 0.00 0.00 52.55 51.49 1yqs s ASP 7 Cb -0.41 -2.01 0.44 0.00 -0.30 0.00 0.00 42.92 40.64 1yqs s ASP 7 CO 0.45 -0.58 1.69 0.44 -0.17 0.00 0.00 175.17 177.00 1yqs h ASP 8 N 7.94 0.26 -0.60 -0.34 5.19 -1.93 -0.65 116.42 126.30 1yqs h ASP 8 Ca -0.10 -0.11 -0.03 0.00 -0.62 0.00 0.00 57.03 56.18 1yqs h ASP 8 Cb 1.03 -0.07 -0.03 0.00 0.18 0.00 0.00 39.33 40.44 1yqs h ASP 8 CO 0.80 0.65 0.28 0.74 -3.12 0.00 0.00 179.24 178.59 1yqs h THR 9 N 0.21 1.22 -0.35 0.35 2.02 -1.99 0.84 112.91 115.20 1yqs h THR 9 Ca 0.02 -0.63 -0.02 0.00 0.77 0.00 0.00 66.41 66.54 1yqs h THR 9 Cb 0.83 0.52 -0.02 0.00 -1.74 0.00 0.00 68.15 67.74 1yqs h THR 9 CO 0.07 0.25 0.13 1.23 0.37 0.00 0.00 175.52 177.57 1yqs h GLY 10 N 0.83 0.57 0.80 2.16 0.00 -1.87 -1.88 103.07 103.68 1yqs h GLY 10 Ca 0.21 -0.32 0.03 0.00 0.00 0.00 0.00 47.33 47.25 1yqs h GLY 10 CO -0.02 0.30 0.28 1.41 0.00 0.00 0.00 176.54 178.51 1yqs h LEU 11 N 0.42 0.43 -0.61 3.11 3.38 -0.82 -1.17 115.31 120.06 1yqs h LEU 11 Ca 0.12 0.02 0.07 0.00 0.09 0.00 0.00 57.88 58.17 1yqs h LEU 11 Cb 0.21 -0.07 -0.06 0.00 0.09 0.00 0.00 40.66 40.83 1yqs h LEU 11 CO -0.01 0.30 0.30 -0.61 0.09 0.00 0.00 178.44 178.52 1yqs h GLN 12 N 0.56 0.54 -0.79 1.13 4.15 -0.62 -1.53 115.11 118.56 1yqs h GLN 12 Ca 0.22 -0.03 -0.04 0.00 0.77 0.00 0.00 58.65 59.56 1yqs h GLN 12 Cb 0.08 -0.12 -0.04 0.00 0.21 0.00 0.00 27.48 27.61 1yqs h GLN 12 CO -0.12 0.36 0.33 0.00 -1.93 0.00 0.00 178.83 177.47 1yqs h ALA 13 N 1.35 1.02 -0.12 3.38 0.00 -0.83 -0.94 119.26 123.12 1yqs h ALA 13 Ca 0.28 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1yqs h ALA 13 Cb 0.23 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1yqs h ALA 13 CO -0.21 0.63 0.08 0.28 0.00 0.00 0.00 179.25 180.03 1yqs h VAL 14 N 1.13 1.04 -0.73 0.00 2.07 -0.61 -0.39 116.25 118.76 1yqs h VAL 14 Ca 0.26 -0.09 -0.04 0.00 0.82 0.00 0.00 66.70 67.66 1yqs h VAL 14 Cb 0.19 0.89 -0.03 0.00 -1.52 0.00 0.00 31.29 30.81 1yqs h VAL 14 CO -0.03 0.04 0.31 -0.07 0.02 0.00 0.00 177.57 177.85 1yqs h LEU 15 N 0.15 0.99 -0.86 2.57 3.38 -1.05 -0.71 115.31 119.79 1yqs h LEU 15 Ca 0.04 -0.16 -0.03 0.00 0.09 0.00 0.00 57.88 57.82 1yqs h LEU 15 Cb -0.00 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.45 1yqs h LEU 15 CO -0.01 0.88 0.39 -0.74 0.09 0.00 0.00 178.44 179.05 1yqs h HIS 16 N 1.05 1.22 -0.51 1.13 2.76 -0.94 -1.31 115.15 118.55 1yqs h HIS 16 Ca 0.25 -0.07 -0.03 0.00 -2.20 0.00 0.00 60.37 58.32 1yqs h HIS 16 Cb 0.18 -0.38 -0.02 0.00 1.55 0.00 0.00 27.41 28.74 1yqs h HIS 16 CO 0.01 0.89 0.20 1.15 -1.30 0.00 0.00 177.93 178.89 1yqs h THR 17 N 1.20 1.22 -0.88 6.26 2.02 -0.71 -1.58 112.91 120.44 1yqs h THR 17 Ca 0.29 -0.67 0.02 0.00 0.77 0.00 0.00 66.41 66.82 1yqs h THR 17 Cb 0.14 0.70 -0.05 0.00 -1.74 0.00 0.00 68.15 67.20 1yqs h THR 17 CO -0.03 0.25 0.58 0.00 0.37 0.00 0.00 175.52 176.69 1yqs h ALA 18 N 1.05 1.13 -0.70 6.16 0.00 -0.58 -1.26 119.26 125.07 1yqs h ALA 18 Ca 0.17 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 1yqs h ALA 18 Cb 0.20 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 1yqs h ALA 18 CO -0.01 0.48 0.43 -0.07 0.00 0.00 0.00 179.25 180.07 1yqs h LEU 19 N 1.16 0.83 -2.34 0.00 4.07 -0.97 -1.69 115.31 116.36 1yqs h LEU 19 Ca 0.33 -0.05 -0.00 0.00 0.08 0.00 0.00 57.88 58.24 1yqs h LEU 19 Cb -0.08 -0.21 -0.00 0.00 1.08 0.00 0.00 40.66 41.45 1yqs h LEU 19 CO -0.09 0.64 -0.00 0.77 -1.08 0.00 0.00 178.44 178.68 1yqs h SER 20 N 0.95 0.00 0.01 -0.43 4.64 -0.25 -2.02 113.55 116.45 1yqs h SER 20 Ca 0.25 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.57 1yqs h SER 20 Cb -0.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.04 1yqs h SER 20 CO -0.05 0.00 -0.30 0.00 -0.87 0.00 0.00 176.83 175.61 1yqs n GLN 21 N -3.10 1.48 0.00 4.77 6.02 -0.70 -4.96 117.38 120.89 1yqs n GLN 21 Ca -0.01 -1.18 0.00 0.00 -0.01 0.00 0.00 57.00 55.80 1yqs n GLN 21 Cb 0.17 -1.48 0.00 0.00 1.02 0.00 0.00 30.24 29.96 1yqs n GLN 21 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1yqs n GLY 22 N 1.38 0.77 3.69 1.08 0.00 -0.76 -4.74 105.19 106.61 1yqs n GLY 22 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 1yqs n GLY 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yqs s ALA 23 N -1.74 3.48 0.29 4.61 0.00 -0.70 -4.92 121.76 122.79 1yqs s ALA 23 Ca 0.00 0.72 -0.01 0.00 0.00 0.00 0.00 51.96 52.67 1yqs s ALA 23 Cb 0.00 -3.51 0.44 0.00 0.00 0.00 0.00 23.12 20.04 1yqs s ALA 23 CO 0.00 -0.71 1.90 -1.35 0.00 0.00 0.00 175.76 175.60 1yqs h PRO 24 N 7.36 0.94 -3.69 0.00 0.11 -1.86 -3.37 132.00 131.49 1yqs h PRO 24 Ca -0.37 -0.12 -0.12 0.00 0.11 0.00 0.00 66.00 65.50 1yqs h PRO 24 Cb 1.18 -0.18 -0.17 0.00 0.11 0.00 0.00 31.00 31.94 1yqs h PRO 24 CO 0.87 0.72 -0.46 0.20 -0.21 0.00 0.00 178.00 179.12 1yqs s GLY 25 N -3.48 0.11 -0.11 -0.55 0.00 -1.18 -1.06 107.32 101.05 1yqs s GLY 25 Ca -0.11 -0.43 -0.18 0.00 0.00 0.00 0.00 44.72 44.01 1yqs s GLY 25 CO 0.79 -0.58 0.44 0.00 0.00 0.00 0.00 173.10 173.75 1yqs s ALA 26 N -2.61 -1.11 0.17 3.20 0.00 -0.39 -2.09 121.76 118.94 1yqs s ALA 26 Ca -0.05 0.99 -0.18 0.00 0.00 0.00 0.00 51.96 52.73 1yqs s ALA 26 Cb -0.01 -0.39 0.04 0.00 0.00 0.00 0.00 23.12 22.75 1yqs s ALA 26 CO -0.04 -0.25 0.51 0.00 0.00 0.00 0.00 175.76 175.97 1yqs s MET 27 N -0.44 1.30 -0.17 0.00 0.23 0.14 -0.87 119.30 119.49 1yqs s MET 27 Ca -0.06 -0.77 -0.18 0.00 -1.03 0.00 0.00 55.69 53.65 1yqs s MET 27 Cb -0.03 0.52 0.05 0.00 -1.53 0.00 0.00 34.83 33.83 1yqs s MET 27 CO 0.03 -0.55 0.50 0.54 -2.03 0.00 0.00 175.02 173.51 1yqs s VAL 28 N -3.84 0.00 -0.06 5.16 0.11 -0.09 -1.07 120.40 120.61 1yqs s VAL 28 Ca 0.07 -0.03 0.03 0.00 -2.93 0.00 0.00 61.98 59.12 1yqs s VAL 28 Cb -0.00 -0.71 0.01 0.00 -1.53 0.00 0.00 36.38 34.15 1yqs s VAL 28 CO -0.06 -0.01 -0.14 -0.60 -3.33 0.00 0.00 175.10 170.96 1yqs s ARG 29 N 0.12 1.75 -0.13 1.54 3.52 -0.29 -1.43 118.95 124.03 1yqs s ARG 29 Ca -0.01 -0.47 0.00 0.00 -0.13 0.00 0.00 55.73 55.12 1yqs s ARG 29 Cb -0.03 -1.45 -0.01 0.00 -1.56 0.00 0.00 34.95 31.89 1yqs s ARG 29 CO 0.01 0.08 -0.13 0.08 -0.81 0.00 0.00 175.30 174.53 1yqs s VAL 30 N 0.50 3.02 -0.46 7.11 1.01 0.24 -1.59 120.40 130.24 1yqs s VAL 30 Ca -0.12 -0.68 -0.11 0.00 0.00 0.00 0.00 61.98 61.07 1yqs s VAL 30 Cb -0.15 -2.26 0.09 0.00 0.00 0.00 0.00 36.38 34.06 1yqs s VAL 30 CO 0.04 0.53 0.34 -0.62 0.00 0.00 0.00 175.10 175.38 1yqs s ASP 31 N 0.31 5.84 -1.05 3.32 2.15 -0.01 -0.77 116.67 126.46 1yqs s ASP 31 Ca -0.10 -1.58 -0.10 0.00 0.43 0.00 0.00 52.55 51.20 1yqs s ASP 31 Cb -0.16 -2.07 0.27 0.00 -0.30 0.00 0.00 42.92 40.66 1yqs s ASP 31 CO 0.06 -0.63 1.04 -0.62 -0.17 0.00 0.00 175.17 174.84 1yqs s ASP 32 N 2.52 7.18 -1.52 -0.34 2.15 0.18 -1.59 116.67 125.25 1yqs s ASP 32 Ca 0.04 -3.43 -0.07 0.00 0.43 0.00 0.00 52.55 49.52 1yqs s ASP 32 Cb -0.25 -2.20 0.06 0.00 -0.30 0.00 0.00 42.92 40.23 1yqs s ASP 32 CO 0.03 -0.34 0.55 -3.20 -0.17 0.00 0.00 175.17 172.04 1yqs n ASN 33 N 2.93 -1.47 0.00 -0.34 4.05 0.12 -1.44 115.26 119.11 1yqs n ASN 33 Ca 0.22 -1.01 0.00 0.00 0.45 0.00 0.00 54.58 54.24 1yqs n ASN 33 Cb 0.41 -2.95 0.00 0.00 1.23 0.00 0.00 39.78 38.47 1yqs n ASN 33 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1yqs n GLY 34 N -1.80 0.43 3.40 8.20 0.00 -1.26 -5.05 105.19 109.10 1yqs n GLY 34 Ca -0.17 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.52 1yqs n GLY 34 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1yqs s THR 35 N -2.16 3.41 -0.04 2.61 2.01 -0.52 -5.10 115.64 115.85 1yqs s THR 35 Ca 0.00 -0.52 -0.13 0.00 0.31 0.00 0.00 61.69 61.35 1yqs s THR 35 Cb 0.00 -2.48 -0.05 0.00 0.01 0.00 0.00 72.50 69.98 1yqs s THR 35 CO 0.00 0.49 0.35 -0.63 -0.69 0.00 0.00 174.62 174.14 1yqs s ILE 36 N 0.62 5.15 -0.09 1.82 -1.09 -1.26 -0.65 121.20 125.69 1yqs s ILE 36 Ca -0.05 0.70 0.03 0.00 -2.23 0.00 0.00 60.65 59.11 1yqs s ILE 36 Cb -0.15 -3.65 -0.01 0.00 -1.58 0.00 0.00 42.46 37.07 1yqs s ILE 36 CO 0.03 0.56 -0.20 -1.00 -1.23 0.00 0.00 174.94 173.10 1yqs s HIS 37 N -0.87 2.62 -0.12 3.97 3.76 0.05 -4.99 115.29 119.71 1yqs s HIS 37 Ca 0.22 -0.75 -0.05 0.00 -0.15 0.00 0.00 55.06 54.32 1yqs s HIS 37 Cb -0.15 -1.71 0.05 0.00 1.11 0.00 0.00 32.58 31.88 1yqs s HIS 37 CO 0.11 -0.24 0.26 1.14 -0.85 0.00 0.00 174.74 175.16 1yqs s GLN 38 N 0.10 0.20 0.01 1.40 -2.07 -1.26 -0.59 119.66 117.45 1yqs s GLN 38 Ca -0.09 0.63 -0.01 0.00 -1.82 0.00 0.00 55.36 54.06 1yqs s GLN 38 Cb -0.16 -0.08 -0.01 0.00 -1.09 0.00 0.00 33.01 31.67 1yqs s GLN 38 CO 0.06 -0.20 0.00 -0.51 -1.32 0.00 0.00 175.29 173.31 1yqs s LEU 39 N 1.68 2.08 -0.02 2.60 1.02 -0.52 -5.02 118.68 120.49 1yqs s LEU 39 Ca -0.06 -0.31 -0.17 0.00 0.02 0.00 0.00 54.13 53.61 1yqs s LEU 39 Cb -0.11 0.15 0.03 0.00 0.02 0.00 0.00 46.19 46.28 1yqs s LEU 39 CO -0.09 -0.22 0.37 -0.94 0.02 0.00 0.00 176.35 175.49 1yqs s SER 40 N -1.02 -0.27 -0.03 2.29 1.04 -1.26 -0.91 113.70 113.54 1yqs s SER 40 Ca -0.11 0.20 -0.04 0.00 0.48 0.00 0.00 55.95 56.48 1yqs s SER 40 Cb -0.07 0.36 0.01 0.00 0.10 0.00 0.00 66.02 66.42 1yqs s SER 40 CO -0.00 -0.46 0.09 -0.70 0.98 0.00 0.00 173.24 173.15 1yqs s GLU 41 N -1.26 0.19 1.36 4.02 2.12 -0.05 -5.00 118.70 120.09 1yqs s GLU 41 Ca -0.13 -0.02 0.00 0.00 0.36 0.00 0.00 54.97 55.18 1yqs s GLU 41 Cb -0.04 0.08 0.00 0.00 0.26 0.00 0.00 34.13 34.43 1yqs s GLU 41 CO 0.05 -0.03 0.00 0.41 -0.54 0.00 0.00 175.26 175.15 1yqs n GLY 42 N 2.64 -1.17 3.35 -1.50 0.00 -1.26 -1.26 105.19 105.98 1yqs n GLY 42 Ca -0.15 -1.54 -0.31 0.00 0.00 0.00 0.00 46.02 44.02 1yqs n GLY 42 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1yqs s VAL 43 N 0.00 2.30 0.14 1.61 -7.23 -0.22 -1.27 120.40 115.73 1yqs s VAL 43 Ca 0.00 -1.01 -0.03 0.00 -1.81 0.00 0.00 61.98 59.12 1yqs s VAL 43 Cb 0.00 -1.82 -0.17 0.00 0.56 0.00 0.00 36.38 34.94 1yqs s VAL 43 CO 0.00 0.58 1.32 0.00 -0.31 0.00 0.00 175.10 176.69 1yqs h ALA 44 N 5.46 0.39 -3.28 1.32 0.00 -0.71 -3.13 119.26 119.31 1yqs h ALA 44 Ca -0.44 -0.71 -0.51 0.00 0.00 0.00 0.00 54.91 53.26 1yqs h ALA 44 Cb 1.13 -0.03 -0.39 0.00 0.00 0.00 0.00 17.79 18.50 1yqs h ALA 44 CO 0.48 0.83 -0.77 0.34 0.00 0.00 0.00 179.25 180.12 1yqs s ASP 45 N -7.06 2.57 0.26 0.00 -1.08 -1.10 -0.91 116.67 109.35 1yqs s ASP 45 Ca -0.05 -0.61 0.26 0.00 -0.52 0.00 0.00 52.55 51.63 1yqs s ASP 45 Cb 0.09 -0.63 0.74 0.00 -1.46 0.00 0.00 42.92 41.66 1yqs s ASP 45 CO 0.86 -0.25 1.75 0.08 0.52 0.00 0.00 175.17 178.12 1yqs h ARG 46 N 8.24 0.00 0.16 4.34 0.11 -1.87 0.69 114.38 126.05 1yqs h ARG 46 Ca -0.19 0.00 -0.35 0.00 0.10 0.00 0.00 59.98 59.55 1yqs h ARG 46 Cb 1.12 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.20 1yqs h ARG 46 CO 0.33 0.00 -1.78 0.00 0.10 0.00 0.00 179.97 178.63 1yqs h ALA 47 N 2.40 0.23 0.00 0.08 0.00 -1.97 -3.35 119.26 116.65 1yqs h ALA 47 Ca 0.00 -1.20 -0.01 0.00 0.00 0.00 0.00 54.91 53.70 1yqs h ALA 47 Cb 0.77 0.53 -0.00 0.00 0.00 0.00 0.00 17.79 19.09 1yqs h ALA 47 CO 0.00 1.07 -0.77 1.79 0.00 0.00 0.00 179.25 181.34 1yqs h THR 48 N 0.04 0.02 0.00 0.00 1.35 -2.00 -3.48 112.91 108.85 1yqs h THR 48 Ca -0.36 -1.04 0.00 0.00 -0.55 0.00 0.00 66.41 64.45 1yqs h THR 48 Cb 2.04 1.64 0.00 0.00 -1.73 0.00 0.00 68.15 70.10 1yqs h THR 48 CO 0.14 0.01 0.00 0.61 -0.25 0.00 0.00 175.52 176.03 1yqs n GLY 49 N 1.17 0.82 3.69 5.82 0.00 0.22 -5.01 105.19 111.89 1yqs n GLY 49 Ca 0.01 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.58 1yqs n GLY 49 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1yqs n ARG 50 N -2.22 2.38 -2.23 1.61 0.63 -1.13 -4.87 116.66 110.82 1yqs n ARG 50 Ca 0.00 0.86 -0.38 0.00 -0.92 0.00 0.00 57.85 57.41 1yqs n ARG 50 Cb 0.00 -2.66 -0.01 0.00 0.45 0.00 0.00 32.46 30.24 1yqs n ARG 50 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1yqs s ALA 51 N 1.23 3.12 0.44 5.13 0.00 -1.26 -0.17 121.76 130.26 1yqs s ALA 51 Ca 0.78 1.01 -0.21 0.00 0.00 0.00 0.00 51.96 53.55 1yqs s ALA 51 Cb -0.62 -3.40 -0.10 0.00 0.00 0.00 0.00 23.12 19.00 1yqs s ALA 51 CO 0.37 -0.63 0.99 -1.50 0.00 0.00 0.00 175.76 174.99 1yqs s ILE 52 N -1.41 4.08 0.05 0.00 2.07 -0.40 -4.08 121.20 121.51 1yqs s ILE 52 Ca 0.59 1.34 -0.07 0.00 -1.41 0.00 0.00 60.65 61.10 1yqs s ILE 52 Cb -0.32 -3.57 -0.01 0.00 0.13 0.00 0.00 42.46 38.70 1yqs s ILE 52 CO 0.40 -0.23 0.13 0.42 -1.91 0.00 0.00 174.94 173.74 1yqs s THR 53 N -2.02 0.14 -1.28 4.00 -4.23 -1.26 -4.71 115.64 106.28 1yqs s THR 53 Ca 0.63 -1.14 0.15 0.00 -1.18 0.00 0.00 61.69 60.15 1yqs s THR 53 Cb -0.14 -1.08 0.21 0.00 1.34 0.00 0.00 72.50 72.84 1yqs s THR 53 CO 0.18 -0.63 1.43 0.35 -0.54 0.00 0.00 174.62 175.41 1yqs n THR 54 N 0.47 0.73 1.23 3.99 -2.24 -1.26 -1.27 114.28 115.92 1yqs n THR 54 Ca -0.17 0.18 0.13 0.00 -2.27 0.00 0.00 64.05 61.92 1yqs n THR 54 Cb 0.60 -0.93 0.35 0.00 -2.10 0.00 0.00 70.33 68.25 1yqs n THR 54 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1yqs n THR 55 N -1.36 0.00 -2.20 4.28 -2.24 -1.26 -4.18 114.28 107.32 1yqs n THR 55 Ca 0.06 -0.14 -0.42 0.00 -2.27 0.00 0.00 64.05 61.28 1yqs n THR 55 Cb 0.14 0.46 -0.03 0.00 -2.10 0.00 0.00 70.33 68.80 1yqs n THR 55 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1yqs s ASP 56 N -2.49 6.86 0.67 3.42 1.01 -0.40 -4.94 116.67 120.80 1yqs s ASP 56 Ca 0.24 2.31 -0.14 0.00 0.71 0.00 0.00 52.55 55.68 1yqs s ASP 56 Cb 0.19 -2.59 0.00 0.00 1.01 0.00 0.00 42.92 41.53 1yqs s ASP 56 CO 0.52 -0.62 1.09 -0.13 0.21 0.00 0.00 175.17 176.24 1yqs s ARG 57 N 0.89 2.85 0.22 8.23 0.52 -0.60 -4.65 118.95 126.40 1yqs s ARG 57 Ca 0.63 1.24 -0.20 0.00 -0.52 0.00 0.00 55.73 56.87 1yqs s ARG 57 Cb -0.36 -1.97 0.03 0.00 0.52 0.00 0.00 34.95 33.18 1yqs s ARG 57 CO 0.32 -1.19 0.61 -0.59 0.02 0.00 0.00 175.30 174.46 1yqs s PHE 58 N -2.58 -0.23 -0.22 -0.53 -0.12 -0.35 -1.28 117.98 112.68 1yqs s PHE 58 Ca 0.64 -0.12 -0.25 0.00 -0.05 0.00 0.00 56.93 57.15 1yqs s PHE 58 Cb -0.18 0.53 -0.01 0.00 -0.63 0.00 0.00 43.02 42.73 1yqs s PHE 58 CO 0.45 -1.01 0.83 1.03 -0.05 0.00 0.00 175.22 176.47 1yqs s ARG 59 N -3.86 4.23 0.00 1.99 0.52 -1.26 -1.27 118.95 119.29 1yqs s ARG 59 Ca 0.08 0.97 0.28 0.00 -0.52 0.00 0.00 55.73 56.54 1yqs s ARG 59 Cb -0.03 -3.62 1.07 0.00 0.52 0.00 0.00 34.95 32.89 1yqs s ARG 59 CO -0.02 -0.45 1.77 1.33 0.02 0.00 0.00 175.30 177.95 1yqs n VAL 60 N 5.06 0.00 -1.34 3.52 0.24 -0.72 -4.83 118.33 120.25 1yqs n VAL 60 Ca 0.05 -0.07 0.00 0.00 -2.04 0.00 0.00 64.34 62.28 1yqs n VAL 60 Cb 0.48 0.01 0.00 0.00 -1.47 0.00 0.00 33.84 32.86 1yqs n VAL 60 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1yqs n GLY 61 N 1.32 2.98 0.00 7.63 0.00 -1.22 -2.17 105.19 113.73 1yqs n GLY 61 Ca 0.13 -0.17 0.04 0.00 0.00 0.00 0.00 46.02 46.02 1yqs n GLY 61 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1yqs n SER 62 N 2.36 0.00 0.16 1.61 7.64 -1.19 -1.02 113.62 123.18 1yqs n SER 62 Ca 0.00 0.20 0.18 0.00 1.01 0.00 0.00 58.87 60.26 1yqs n SER 62 Cb 0.00 -0.31 0.79 0.00 -1.01 0.00 0.00 64.21 63.67 1yqs n SER 62 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 1yqs h VAL 63 N 0.00 0.51 -0.94 0.44 2.07 -0.95 -1.16 116.25 116.22 1yqs h VAL 63 Ca 0.00 0.00 0.25 0.00 0.82 0.00 0.00 66.70 67.77 1yqs h VAL 63 Cb 0.09 0.80 -0.05 0.00 -1.52 0.00 0.00 31.29 30.61 1yqs h VAL 63 CO 0.00 0.00 0.65 0.74 0.02 0.00 0.00 177.57 178.98 1yqs h THR 64 N 0.00 0.57 -0.65 2.57 2.02 -1.29 -1.06 112.91 115.07 1yqs h THR 64 Ca 0.12 -0.05 0.06 0.00 0.77 0.00 0.00 66.41 67.31 1yqs h THR 64 Cb 0.65 0.40 -0.04 0.00 -1.74 0.00 0.00 68.15 67.42 1yqs h THR 64 CO -0.00 0.03 0.43 0.11 0.37 0.00 0.00 175.52 176.46 1yqs h LYS 65 N 0.15 0.63 -0.37 6.66 1.57 -1.39 -0.95 116.57 122.88 1yqs h LYS 65 Ca 0.47 -0.04 -0.10 0.00 -1.87 0.00 0.00 60.65 59.11 1yqs h LYS 65 Cb 1.59 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 33.74 1yqs h LYS 65 CO -0.08 0.42 -0.16 0.77 -0.57 0.00 0.00 179.45 179.82 1yqs h SER 66 N 0.65 0.68 -0.23 0.86 0.02 -1.20 0.14 113.55 114.47 1yqs h SER 66 Ca 0.28 -0.21 -0.01 0.00 -0.84 0.00 0.00 61.79 61.00 1yqs h SER 66 Cb 0.27 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 62.61 1yqs h SER 66 CO -0.09 0.85 0.09 -0.26 -1.14 0.00 0.00 176.83 176.28 1yqs h PHE 67 N 0.61 0.35 -0.88 3.45 -1.00 -1.28 -1.03 116.94 117.17 1yqs h PHE 67 Ca 0.10 -0.03 0.00 0.00 2.81 0.00 0.00 57.97 60.86 1yqs h PHE 67 Cb 0.62 -0.10 -0.04 0.00 3.61 0.00 0.00 35.95 40.03 1yqs h PHE 67 CO 0.03 0.38 0.56 0.77 -1.61 0.00 0.00 178.31 178.44 1yqs h SER 68 N 0.21 1.02 -0.66 2.17 0.02 -1.06 -2.26 113.55 113.00 1yqs h SER 68 Ca 0.08 -0.04 -0.04 0.00 -0.84 0.00 0.00 61.79 60.94 1yqs h SER 68 Cb 0.18 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.44 1yqs h SER 68 CO -0.01 0.76 0.24 0.00 -1.14 0.00 0.00 176.83 176.68 1yqs h ALA 69 N 1.31 0.86 -0.59 3.77 0.00 -0.81 -1.52 119.26 122.28 1yqs h ALA 69 Ca 0.32 -0.19 0.01 0.00 0.00 0.00 0.00 54.91 55.05 1yqs h ALA 69 Cb -0.11 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.40 1yqs h ALA 69 CO -0.07 0.50 0.39 0.28 0.00 0.00 0.00 179.25 180.35 1yqs h VAL 70 N 0.94 1.13 -0.07 0.00 2.07 -0.87 -0.09 116.25 119.37 1yqs h VAL 70 Ca 0.22 -0.27 0.01 0.00 0.82 0.00 0.00 66.70 67.48 1yqs h VAL 70 Cb 0.25 0.28 -0.01 0.00 -1.52 0.00 0.00 31.29 30.29 1yqs h VAL 70 CO -0.01 0.14 0.00 0.58 0.02 0.00 0.00 177.57 178.30 1yqs h VAL 71 N 0.78 0.96 -0.88 2.57 2.07 -1.13 -0.80 116.25 119.83 1yqs h VAL 71 Ca 0.22 -0.01 0.02 0.00 0.82 0.00 0.00 66.70 67.75 1yqs h VAL 71 Cb -0.07 0.93 -0.05 0.00 -1.52 0.00 0.00 31.29 30.59 1yqs h VAL 71 CO -0.06 0.01 0.58 -0.07 0.02 0.00 0.00 177.57 178.04 1yqs h LEU 72 N 0.03 0.98 -0.97 2.57 3.38 -0.98 -1.49 115.31 118.84 1yqs h LEU 72 Ca 0.03 -0.02 -0.11 0.00 0.09 0.00 0.00 57.88 57.88 1yqs h LEU 72 Cb 0.03 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 1yqs h LEU 72 CO -0.05 0.70 -0.42 -0.07 0.09 0.00 0.00 178.44 178.69 1yqs h LEU 73 N 1.15 0.21 -0.90 1.67 3.38 -0.70 -1.08 115.31 119.04 1yqs h LEU 73 Ca 0.33 -0.09 -0.08 0.00 0.09 0.00 0.00 57.88 58.14 1yqs h LEU 73 Cb -0.08 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 1yqs h LEU 73 CO -0.09 0.61 -0.03 1.56 0.09 0.00 0.00 178.44 180.58 1yqs h GLN 74 N 0.17 0.77 -0.34 1.13 4.20 -0.62 -1.20 115.11 119.22 1yqs h GLN 74 Ca 0.01 -0.22 -0.04 0.00 0.06 0.00 0.00 58.65 58.47 1yqs h GLN 74 Cb 0.81 -0.08 -0.02 0.00 0.30 0.00 0.00 27.48 28.49 1yqs h GLN 74 CO 0.06 0.80 0.04 -0.07 -0.67 0.00 0.00 178.83 179.00 1yqs h LEU 75 N 0.72 0.46 -0.06 1.46 3.38 -0.46 -1.13 115.31 119.68 1yqs h LEU 75 Ca 0.13 -0.07 -0.00 0.00 0.09 0.00 0.00 57.88 58.03 1yqs h LEU 75 Cb 0.49 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.11 1yqs h LEU 75 CO 0.02 0.51 0.02 0.58 0.09 0.00 0.00 178.44 179.66 1yqs h VAL 76 N 0.49 1.14 -0.80 1.22 2.07 -0.74 -0.60 116.25 119.03 1yqs h VAL 76 Ca 0.11 -0.42 0.13 0.00 0.82 0.00 0.00 66.70 67.35 1yqs h VAL 76 Cb 0.26 1.31 -0.06 0.00 -1.52 0.00 0.00 31.29 31.29 1yqs h VAL 76 CO 0.00 0.12 0.52 0.44 0.02 0.00 0.00 177.57 178.67 1yqs h ASP 77 N -0.07 0.53 0.22 0.57 3.32 -0.74 -1.40 116.42 118.86 1yqs h ASP 77 Ca 0.02 0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.10 1yqs h ASP 77 Cb 0.17 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 39.64 1yqs h ASP 77 CO -0.00 0.29 -0.06 -0.62 -1.72 0.00 0.00 179.24 177.12 1yqs n GLU 78 N -4.51 0.92 -0.76 3.56 1.02 -0.47 -4.91 120.64 115.48 1yqs n GLU 78 Ca 0.15 -0.30 0.00 0.00 -0.02 0.00 0.00 57.16 56.99 1yqs n GLU 78 Cb 0.46 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.38 1yqs n GLU 78 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1yqs n GLY 79 N 1.20 0.58 0.00 0.62 0.00 -0.53 -4.94 105.19 102.13 1yqs n GLY 79 Ca 0.17 -0.32 0.11 0.00 0.00 0.00 0.00 46.02 45.99 1yqs n GLY 79 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1yqs n LYS 80 N -2.76 0.05 -3.78 1.61 5.02 -0.28 -4.92 118.16 113.09 1yqs n LYS 80 Ca 0.00 -0.01 -0.13 0.00 -2.02 0.00 0.00 58.31 56.16 1yqs n LYS 80 Cb 0.00 -1.51 -0.12 0.00 -0.02 0.00 0.00 35.03 33.38 1yqs n LYS 80 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 1yqs s LEU 81 N -3.13 0.95 -0.20 -0.35 2.96 -1.19 -4.95 118.68 112.76 1yqs s LEU 81 Ca 0.08 0.44 -0.02 0.00 -0.22 0.00 0.00 54.13 54.40 1yqs s LEU 81 Cb 0.16 0.69 -0.00 0.00 0.50 0.00 0.00 46.19 47.54 1yqs s LEU 81 CO 0.82 -0.10 -0.09 -0.62 -1.32 0.00 0.00 176.35 175.03 1yqs s ASP 82 N 0.51 3.95 0.53 3.68 -1.08 -1.26 -4.21 116.67 118.79 1yqs s ASP 82 Ca -0.03 -0.46 0.22 0.00 -0.52 0.00 0.00 52.55 51.76 1yqs s ASP 82 Cb -0.05 -1.66 1.44 0.00 -1.46 0.00 0.00 42.92 41.20 1yqs s ASP 82 CO -0.03 -0.00 2.16 -0.07 0.52 0.00 0.00 175.17 177.75 1yqs h LEU 83 N 7.96 0.00 -1.94 -1.34 3.38 -1.99 -2.18 115.31 119.20 1yqs h LEU 83 Ca -0.42 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.55 1yqs h LEU 83 Cb 1.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.91 1yqs h LEU 83 CO 0.61 0.04 0.00 0.47 0.09 0.00 0.00 178.44 179.65 1yqs n ASP 84 N -4.17 2.90 -4.80 -0.43 8.00 -1.26 -0.36 116.55 116.43 1yqs n ASP 84 Ca -0.03 -1.91 -0.33 0.00 0.71 0.00 0.00 54.79 53.22 1yqs n ASP 84 Cb 0.13 -0.20 -0.02 0.00 -0.02 0.00 0.00 41.12 41.00 1yqs n ASP 84 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1yqs s ALA 85 N -1.59 2.84 0.35 2.24 0.00 -0.82 -4.84 121.76 119.94 1yqs s ALA 85 Ca 0.36 0.51 -0.28 0.00 0.00 0.00 0.00 51.96 52.55 1yqs s ALA 85 Cb 0.21 -3.24 -0.11 0.00 0.00 0.00 0.00 23.12 19.99 1yqs s ALA 85 CO 0.30 -0.46 1.41 0.45 0.00 0.00 0.00 175.76 177.45 1yqs s SER 86 N -2.32 6.54 0.26 0.00 0.15 -1.26 -1.95 113.70 115.12 1yqs s SER 86 Ca 0.65 2.88 -0.02 0.00 0.70 0.00 0.00 55.95 60.17 1yqs s SER 86 Cb -0.16 -2.66 0.52 0.00 -1.71 0.00 0.00 66.02 62.01 1yqs s SER 86 CO 0.26 -0.72 1.75 0.58 1.20 0.00 0.00 173.24 176.31 1yqs h VAL 87 N 3.02 0.69 0.00 4.45 2.07 -1.29 -1.05 116.25 124.15 1yqs h VAL 87 Ca -0.50 -0.19 0.00 0.00 0.82 0.00 0.00 66.70 66.83 1yqs h VAL 87 Cb 1.23 0.09 0.00 0.00 -1.52 0.00 0.00 31.29 31.10 1yqs h VAL 87 CO 0.65 0.10 0.00 0.59 0.02 0.00 0.00 177.57 178.93 1yqs n ASN 88 N -4.92 0.39 -0.08 0.57 3.02 -1.26 -1.52 115.26 111.46 1yqs n ASN 88 Ca 0.16 0.61 -0.06 0.00 -0.03 0.00 0.00 54.58 55.26 1yqs n ASN 88 Cb 0.44 -0.69 0.13 0.00 -0.61 0.00 0.00 39.78 39.05 1yqs n ASN 88 CO 0.00 0.00 0.00 0.74 -2.62 0.00 0.00 177.26 175.38 1yqs h THR 89 N 0.00 1.26 0.00 3.41 2.02 -1.55 -2.81 112.91 115.24 1yqs h THR 89 Ca 0.00 -1.23 -0.24 0.00 0.77 0.00 0.00 66.41 65.71 1yqs h THR 89 Cb 0.25 1.14 -0.04 0.00 -1.74 0.00 0.00 68.15 67.76 1yqs h THR 89 CO 0.00 0.41 -1.56 1.88 0.37 0.00 0.00 175.52 176.62 1yqs h TYR 90 N 0.65 0.00 -2.47 3.16 0.05 -1.40 -3.41 116.97 113.56 1yqs h TYR 90 Ca 0.10 0.00 -0.60 0.00 0.05 0.00 0.00 58.73 58.29 1yqs h TYR 90 Cb 0.64 0.00 -0.40 0.00 1.01 0.00 0.00 36.73 37.98 1yqs h TYR 90 CO 0.03 0.83 -0.79 1.28 -1.05 0.00 0.00 178.16 178.46 1yqs n LEU 91 N -3.00 1.68 -4.72 3.88 4.77 -0.58 -4.99 117.00 114.03 1yqs n LEU 91 Ca -0.13 -4.94 -0.42 0.00 -0.03 0.00 0.00 56.01 50.49 1yqs n LEU 91 Cb 0.96 -0.10 -0.01 0.00 -2.33 0.00 0.00 43.42 41.94 1yqs n LEU 91 CO 0.44 1.92 1.12 -2.65 -1.33 0.00 0.00 177.39 176.89 1yqs n PRO 92 N 1.83 2.45 -1.01 3.23 -0.02 -1.06 -1.82 135.00 138.60 1yqs n PRO 92 Ca 0.25 0.87 -0.00 0.00 -2.02 0.00 0.00 63.50 62.59 1yqs n PRO 92 Cb 0.43 -2.58 -0.00 0.00 -0.02 0.00 0.00 33.50 31.33 1yqs n PRO 92 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1yqs n GLY 93 N 1.68 0.32 0.09 -1.23 0.00 -1.26 -4.92 105.19 99.87 1yqs n GLY 93 Ca 0.08 -0.03 -0.13 0.00 0.00 0.00 0.00 46.02 45.94 1yqs n GLY 93 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1yqs h LEU 94 N 0.00 0.17 -9.49 0.99 5.85 -1.69 -3.45 115.31 107.69 1yqs h LEU 94 Ca -0.01 -0.47 -0.61 0.00 0.84 0.00 0.00 57.88 57.63 1yqs h LEU 94 Cb 0.43 -0.05 -0.11 0.00 0.37 0.00 0.00 40.66 41.29 1yqs h LEU 94 CO 0.01 0.60 -0.66 -0.76 -0.34 0.00 0.00 178.44 177.29 1yqs s LEU 95 N -9.21 3.32 0.53 2.25 1.43 -1.26 -5.02 118.68 110.73 1yqs s LEU 95 Ca -0.15 -0.36 0.34 0.00 -1.03 0.00 0.00 54.13 52.93 1yqs s LEU 95 Cb 0.03 -1.99 1.49 0.00 0.03 0.00 0.00 46.19 45.76 1yqs s LEU 95 CO 0.71 0.10 2.01 1.55 0.23 0.00 0.00 176.35 180.96 1yqs h PRO 96 N 2.84 0.00 -4.55 1.29 0.13 -2.01 -3.41 132.00 126.29 1yqs h PRO 96 Ca -0.47 0.00 -0.61 0.00 -0.87 0.00 0.00 66.00 64.05 1yqs h PRO 96 Cb 1.20 0.00 -0.37 0.00 0.13 0.00 0.00 31.00 31.96 1yqs h PRO 96 CO 0.58 0.00 -0.81 0.34 -0.23 0.00 0.00 178.00 177.88 1yqs s ASP 97 N -5.41 3.22 0.57 1.44 -1.08 -1.26 -4.98 116.67 109.15 1yqs s ASP 97 Ca 0.00 -0.80 0.38 0.00 -0.52 0.00 0.00 52.55 51.62 1yqs s ASP 97 Cb 0.10 -1.19 1.95 0.00 -1.46 0.00 0.00 42.92 42.32 1yqs s ASP 97 CO 0.50 -0.13 2.15 0.44 0.52 0.00 0.00 175.17 178.64 1yqs h ASP 98 N 8.00 0.00 1.08 -0.34 5.19 -2.02 -2.94 116.42 125.39 1yqs h ASP 98 Ca -0.29 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.12 1yqs h ASP 98 Cb 1.11 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.62 1yqs h ASP 98 CO 0.48 0.00 -0.02 0.54 -3.12 0.00 0.00 179.24 177.12 1yqs n ARG 99 N -2.89 0.05 -2.38 3.56 1.74 -1.26 -4.60 116.66 110.88 1yqs n ARG 99 Ca -0.02 0.04 -0.43 0.00 -0.77 0.00 0.00 57.85 56.68 1yqs n ARG 99 Cb 0.11 -1.56 -0.02 0.00 -1.02 0.00 0.00 32.46 29.97 1yqs n ARG 99 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1yqs s ILE 100 N -3.02 4.17 0.34 0.55 1.01 -1.11 -4.90 121.20 118.23 1yqs s ILE 100 Ca 0.13 1.45 0.07 0.00 0.00 0.00 0.00 60.65 62.31 1yqs s ILE 100 Cb 0.18 -3.94 -0.02 0.00 0.01 0.00 0.00 42.46 38.69 1yqs s ILE 100 CO 0.55 -0.08 0.34 0.42 0.00 0.00 0.00 174.94 176.17 1yqs s THR 101 N 3.06 3.69 0.20 2.92 -4.23 -1.26 -0.91 115.64 119.11 1yqs s THR 101 Ca 0.57 -1.27 -0.11 0.00 -1.18 0.00 0.00 61.69 59.71 1yqs s THR 101 Cb -0.24 -3.25 0.12 0.00 1.34 0.00 0.00 72.50 70.47 1yqs s THR 101 CO 0.19 -0.17 1.83 0.58 -0.54 0.00 0.00 174.62 176.51 1yqs h VAL 102 N 1.15 1.05 -0.88 2.29 2.07 -1.33 -1.56 116.25 119.05 1yqs h VAL 102 Ca -0.45 -0.26 -0.00 0.00 0.82 0.00 0.00 66.70 66.81 1yqs h VAL 102 Cb 1.25 0.24 -0.04 0.00 -1.52 0.00 0.00 31.29 31.22 1yqs h VAL 102 CO 0.57 0.14 0.54 -0.09 0.02 0.00 0.00 177.57 178.74 1yqs h ARG 103 N 0.74 1.18 -0.53 1.57 2.43 -0.99 -0.70 114.38 118.09 1yqs h ARG 103 Ca 0.27 -0.10 -0.02 0.00 -0.81 0.00 0.00 59.98 59.32 1yqs h ARG 103 Cb 0.07 -0.25 -0.02 0.00 -0.42 0.00 0.00 29.97 29.34 1yqs h ARG 103 CO -0.13 0.82 0.26 1.96 -1.51 0.00 0.00 179.97 181.37 1yqs h GLN 104 N 1.20 0.76 -0.46 0.20 4.20 -1.72 -2.41 115.11 116.88 1yqs h GLN 104 Ca 0.32 -0.11 -0.00 0.00 0.06 0.00 0.00 58.65 58.91 1yqs h GLN 104 Cb -0.06 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 27.56 1yqs h GLN 104 CO -0.06 0.62 0.27 0.28 -0.67 0.00 0.00 178.83 179.27 1yqs h VAL 105 N 0.71 1.15 0.00 -0.54 2.07 -0.79 0.57 116.25 119.42 1yqs h VAL 105 Ca 0.18 -0.36 0.00 0.00 0.82 0.00 0.00 66.70 67.34 1yqs h VAL 105 Cb 0.11 0.55 0.00 0.00 -1.52 0.00 0.00 31.29 30.43 1yqs h VAL 105 CO -0.02 0.16 0.00 0.24 0.02 0.00 0.00 177.57 177.96 1yqs h MET 106 N 0.62 0.00 -0.41 1.57 2.86 -0.92 -2.63 114.93 116.02 1yqs h MET 106 Ca 0.17 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.81 1yqs h MET 106 Cb 0.01 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.67 1yqs h MET 106 CO -0.03 0.00 0.00 -1.13 1.06 0.00 0.00 176.91 176.81 1yqs n SER 107 N -2.65 3.10 -3.42 1.22 3.41 -0.93 -1.51 113.62 112.84 1yqs n SER 107 Ca 0.01 -1.97 -0.23 0.00 -0.26 0.00 0.00 58.87 56.42 1yqs n SER 107 Cb 0.25 -0.27 0.07 0.00 -0.26 0.00 0.00 64.21 64.00 1yqs n SER 107 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1yqs n HIS 108 N 0.77 -2.69 -0.84 7.33 8.25 -0.90 -4.82 115.22 122.34 1yqs n HIS 108 Ca 0.14 0.93 0.08 0.00 -0.26 0.00 0.00 57.72 58.61 1yqs n HIS 108 Cb 0.46 -4.84 0.15 0.00 1.12 0.00 0.00 29.99 26.88 1yqs n HIS 108 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 1yqs n ARG 109 N -4.74 2.07 0.17 -0.41 1.74 0.14 -0.77 116.66 114.86 1yqs n ARG 109 Ca -0.01 -2.46 0.11 0.00 -0.77 0.00 0.00 57.85 54.73 1yqs n ARG 109 Cb 0.57 -1.50 0.09 0.00 -1.02 0.00 0.00 32.46 30.59 1yqs n ARG 109 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1yqs h SER 110 N 0.62 0.00 0.00 0.55 4.64 -1.79 0.30 113.55 117.87 1yqs h SER 110 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1yqs h SER 110 Cb 1.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.12 1yqs h SER 110 CO 0.06 0.04 0.00 0.61 -0.87 0.00 0.00 176.83 176.67 1yqs n GLY 111 N 1.14 1.27 3.70 -0.77 0.00 -1.26 -4.51 105.19 104.76 1yqs n GLY 111 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 1yqs n GLY 111 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1yqs s LEU 112 N 0.00 4.35 0.34 0.99 1.43 -1.26 -0.63 118.68 123.90 1yqs s LEU 112 Ca 0.00 2.32 -0.29 0.00 -1.03 0.00 0.00 54.13 55.13 1yqs s LEU 112 Cb 0.00 -3.58 -0.11 0.00 0.03 0.00 0.00 46.19 42.54 1yqs s LEU 112 CO 0.00 -0.73 1.43 -0.47 0.23 0.00 0.00 176.35 176.81 1yqs s TYR 113 N 1.73 2.82 -0.60 0.29 5.04 -1.26 -4.81 117.35 120.56 1yqs s TYR 113 Ca 0.66 1.20 -0.25 0.00 -2.44 0.00 0.00 57.07 56.25 1yqs s TYR 113 Cb -0.36 -3.88 0.04 0.00 0.35 0.00 0.00 41.96 38.11 1yqs s TYR 113 CO 0.30 -2.60 1.04 0.34 -1.34 0.00 0.00 175.55 173.29 1yqs s ASP 114 N -0.14 6.31 0.59 4.32 -1.08 -1.26 -4.66 116.67 120.74 1yqs s ASP 114 Ca 0.53 -0.37 0.29 0.00 -0.52 0.00 0.00 52.55 52.48 1yqs s ASP 114 Cb -0.44 -2.47 1.64 0.00 -1.46 0.00 0.00 42.92 40.19 1yqs s ASP 114 CO 0.56 -1.40 2.07 0.10 0.52 0.00 0.00 175.17 177.02 1yqs h TYR 115 N 9.50 0.00 0.00 -5.34 -0.00 -1.91 -1.41 116.97 117.81 1yqs h TYR 115 Ca -0.27 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.46 1yqs h TYR 115 Cb 1.07 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.80 1yqs h TYR 115 CO 0.98 0.00 0.00 1.79 -0.00 0.00 0.00 178.16 180.93 1yqs h THR 116 N 0.00 0.00 0.00 -0.90 1.35 -1.95 -1.47 112.91 109.94 1yqs h THR 116 Ca 0.10 -0.26 -0.04 0.00 -0.55 0.00 0.00 66.41 65.66 1yqs h THR 116 Cb 0.57 1.18 -0.01 0.00 -1.73 0.00 0.00 68.15 68.16 1yqs h THR 116 CO -0.00 0.00 -0.18 0.78 -0.25 0.00 0.00 175.52 175.87 1yqs h ASN 117 N 0.00 0.00 0.05 5.36 4.21 -1.64 -0.47 115.58 123.09 1yqs h ASN 117 Ca 0.00 0.00 -0.12 0.00 1.21 0.00 0.00 56.30 57.39 1yqs h ASN 117 Cb 0.28 0.00 0.01 0.00 -1.12 0.00 0.00 38.32 37.50 1yqs h ASN 117 CO 0.00 0.18 -0.49 0.44 -1.29 0.00 0.00 177.43 176.27 1yqs h ASP 118 N 0.00 0.34 -0.62 5.81 3.32 -1.47 -3.23 116.42 120.56 1yqs h ASP 118 Ca -0.00 -0.88 -0.06 0.00 0.02 0.00 0.00 57.03 56.11 1yqs h ASP 118 Cb 0.35 -0.11 -0.03 0.00 0.22 0.00 0.00 39.33 39.76 1yqs h ASP 118 CO 0.02 1.19 0.17 0.24 -1.72 0.00 0.00 179.24 179.14 1yqs h MET 119 N -0.46 1.01 -0.13 3.56 2.86 -1.01 -3.21 114.93 117.54 1yqs h MET 119 Ca -0.08 -0.22 -0.06 0.00 -2.06 0.00 0.00 59.70 57.29 1yqs h MET 119 Cb 1.31 -0.15 -0.03 0.00 0.06 0.00 0.00 31.60 32.79 1yqs h MET 119 CO 0.09 0.88 -0.25 1.19 1.06 0.00 0.00 176.91 179.89 1yqs n PHE 120 N -4.25 0.41 -0.32 -0.22 3.72 -0.24 -4.21 117.46 112.34 1yqs n PHE 120 Ca 0.05 -1.40 0.13 0.00 -0.05 0.00 0.00 57.45 56.19 1yqs n PHE 120 Cb 0.24 -0.31 0.32 0.00 -0.94 0.00 0.00 39.48 38.78 1yqs n PHE 120 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1yqs h ALA 121 N 0.89 1.56 -3.13 4.37 0.00 -1.57 -3.34 119.26 118.05 1yqs h ALA 121 Ca 0.07 0.12 -0.66 0.00 0.00 0.00 0.00 54.91 54.44 1yqs h ALA 121 Cb 1.24 0.03 -0.30 0.00 0.00 0.00 0.00 17.79 18.76 1yqs h ALA 121 CO 0.14 -0.22 -0.79 -0.65 0.00 0.00 0.00 179.25 177.73 1yqs s GLN 122 N -5.86 3.24 0.03 0.00 -0.21 -1.26 -5.07 119.66 110.53 1yqs s GLN 122 Ca -0.11 -0.72 -0.31 0.00 0.02 0.00 0.00 55.36 54.24 1yqs s GLN 122 Cb 0.25 -2.72 -0.17 0.00 1.00 0.00 0.00 33.01 31.37 1yqs s GLN 122 CO 0.79 -0.06 1.28 1.15 -2.12 0.00 0.00 175.29 176.33 1yqs h THR 123 N 5.69 0.00 -0.09 -0.19 2.02 -1.94 -0.56 112.91 117.84 1yqs h THR 123 Ca -0.37 -0.18 -0.07 0.00 0.77 0.00 0.00 66.41 66.56 1yqs h THR 123 Cb 1.18 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.59 1yqs h THR 123 CO 0.59 0.00 -0.22 0.58 0.37 0.00 0.00 175.52 176.84 1yqs h VAL 124 N -1.30 1.40 -0.98 3.16 2.07 -1.94 -1.46 116.25 117.20 1yqs h VAL 124 Ca -0.11 -1.54 0.10 0.00 0.82 0.00 0.00 66.70 65.97 1yqs h VAL 124 Cb 0.86 2.16 -0.07 0.00 -1.52 0.00 0.00 31.29 32.72 1yqs h VAL 124 CO 0.19 0.44 0.63 -0.65 0.02 0.00 0.00 177.57 178.20 1yqs h PRO 125 N -0.14 1.00 -0.54 1.57 0.11 -1.97 -0.14 132.00 131.90 1yqs h PRO 125 Ca -0.00 -0.06 -0.05 0.00 0.11 0.00 0.00 66.00 66.00 1yqs h PRO 125 Cb 0.82 -0.23 -0.02 0.00 0.11 0.00 0.00 31.00 31.68 1yqs h PRO 125 CO 0.05 0.66 0.16 0.78 -0.21 0.00 0.00 178.00 179.44 1yqs h GLY 126 N 1.03 0.90 0.85 -0.55 0.00 -1.00 -0.47 103.07 103.84 1yqs h GLY 126 Ca 0.46 -0.55 0.02 0.00 0.00 0.00 0.00 47.33 47.26 1yqs h GLY 126 CO -0.21 0.51 0.08 -2.75 0.00 0.00 0.00 176.54 174.16 1yqs h PHE 127 N 0.74 0.14 0.00 5.60 3.57 -0.66 -2.06 116.94 124.27 1yqs h PHE 127 Ca 0.17 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.67 1yqs h PHE 127 Cb 0.30 -0.03 -0.00 0.00 2.79 0.00 0.00 35.95 39.00 1yqs h PHE 127 CO 0.02 0.07 -0.03 1.49 -2.23 0.00 0.00 178.31 177.62 1yqs h GLU 128 N 0.18 0.00 -0.24 1.11 4.81 -0.75 -0.09 114.58 119.59 1yqs h GLU 128 Ca 0.09 0.00 -0.09 0.00 -0.13 0.00 0.00 59.36 59.22 1yqs h GLU 128 Cb 0.05 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.43 1yqs h GLU 128 CO -0.08 0.03 -0.22 0.77 -0.73 0.00 0.00 179.01 178.78 1yqs h SER 129 N 0.00 0.60 0.41 1.04 0.02 -0.58 -3.37 113.55 111.67 1yqs h SER 129 Ca -0.00 -0.47 -0.05 0.00 -0.84 0.00 0.00 61.79 60.43 1yqs h SER 129 Cb 0.06 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.42 1yqs h SER 129 CO 0.00 0.94 -1.63 1.33 -1.14 0.00 0.00 176.83 176.33 1yqs n VAL 130 N -4.39 0.45 0.15 2.27 0.24 -0.82 -4.60 118.33 111.63 1yqs n VAL 130 Ca -0.05 -0.57 0.06 0.00 -2.04 0.00 0.00 64.34 61.75 1yqs n VAL 130 Cb 0.42 -0.23 0.53 0.00 -1.47 0.00 0.00 33.84 33.09 1yqs n VAL 130 CO 0.00 0.00 0.00 0.08 -2.14 0.00 0.00 176.83 174.77 1yqs h ARG 131 N 0.00 0.23 -0.21 7.34 0.11 -1.18 -1.84 114.38 118.82 1yqs h ARG 131 Ca -0.06 -0.02 -0.03 0.00 0.10 0.00 0.00 59.98 59.97 1yqs h ARG 131 Cb 1.17 -0.05 -0.02 0.00 1.11 0.00 0.00 29.97 32.18 1yqs h ARG 131 CO 0.01 0.17 -0.02 0.27 0.10 0.00 0.00 179.97 180.50 1yqs n ASN 132 N -4.49 3.32 -4.93 0.08 6.94 -1.26 -0.87 115.26 114.05 1yqs n ASN 132 Ca -0.00 -3.16 -0.29 0.00 -0.02 0.00 0.00 54.58 51.10 1yqs n ASN 132 Cb 0.10 -0.53 -0.04 0.00 -2.36 0.00 0.00 39.78 36.95 1yqs n ASN 132 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 1yqs s LYS 133 N -2.91 3.45 -0.22 -3.83 1.02 -0.69 -5.01 119.74 111.55 1yqs s LYS 133 Ca 0.40 -0.47 -0.00 0.00 0.02 0.00 0.00 55.97 55.92 1yqs s LYS 133 Cb 0.34 -3.01 0.02 0.00 -0.52 0.00 0.00 37.83 34.66 1yqs s LYS 133 CO 0.06 0.57 -0.12 0.08 -0.92 0.00 0.00 175.35 175.02 1yqs s VAL 134 N -1.59 2.56 0.01 3.17 1.01 -1.26 -4.42 120.40 119.87 1yqs s VAL 134 Ca 0.35 -0.97 0.01 0.00 0.00 0.00 0.00 61.98 61.37 1yqs s VAL 134 Cb -0.12 -2.21 -0.04 0.00 0.00 0.00 0.00 36.38 34.01 1yqs s VAL 134 CO 0.28 0.35 0.05 -0.36 0.00 0.00 0.00 175.10 175.42 1yqs s PHE 135 N 1.31 3.20 0.70 5.22 0.08 -1.26 -5.11 117.98 122.12 1yqs s PHE 135 Ca 0.02 0.14 -0.11 0.00 0.12 0.00 0.00 56.93 57.10 1yqs s PHE 135 Cb -0.15 -1.69 0.01 0.00 -0.57 0.00 0.00 43.02 40.62 1yqs s PHE 135 CO -0.08 0.52 1.08 -1.54 -0.10 0.00 0.00 175.22 175.10 1yqs s SER 136 N -1.78 5.44 0.17 1.36 1.04 -1.26 -4.97 113.70 113.70 1yqs s SER 136 Ca 0.23 1.25 -0.14 0.00 0.48 0.00 0.00 55.95 57.76 1yqs s SER 136 Cb -0.12 -2.09 0.11 0.00 0.10 0.00 0.00 66.02 64.02 1yqs s SER 136 CO 0.14 -1.36 1.76 1.88 0.98 0.00 0.00 173.24 176.64 1yqs h TYR 137 N -0.66 0.32 -0.88 5.02 0.05 -1.96 -2.34 116.97 116.53 1yqs h TYR 137 Ca -0.45 0.02 0.05 0.00 0.05 0.00 0.00 58.73 58.40 1yqs h TYR 137 Cb 1.24 -0.08 -0.05 0.00 1.01 0.00 0.00 36.73 38.85 1yqs h TYR 137 CO 0.53 0.14 0.57 0.37 -1.05 0.00 0.00 178.16 178.73 1yqs h GLN 138 N 0.37 1.02 -0.60 4.88 5.75 -1.96 -1.61 115.11 122.94 1yqs h GLN 138 Ca 0.20 -0.06 0.07 0.00 -0.15 0.00 0.00 58.65 58.71 1yqs h GLN 138 Cb 0.16 -0.23 -0.06 0.00 1.07 0.00 0.00 27.48 28.42 1yqs h GLN 138 CO -0.18 0.67 0.27 -0.44 -2.65 0.00 0.00 178.83 176.51 1yqs h ASP 139 N 1.05 0.35 -0.33 -0.69 3.32 -1.80 0.16 116.42 118.47 1yqs h ASP 139 Ca 0.36 0.05 -0.10 0.00 0.02 0.00 0.00 57.03 57.36 1yqs h ASP 139 Cb 0.10 -0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.64 1yqs h ASP 139 CO -0.12 0.22 -0.19 -0.07 -1.72 0.00 0.00 179.24 177.36 1yqs h LEU 140 N 0.50 0.75 -0.50 1.55 3.38 -1.18 -1.83 115.31 117.97 1yqs h LEU 140 Ca 0.29 -0.42 0.02 0.00 0.09 0.00 0.00 57.88 57.85 1yqs h LEU 140 Cb 0.28 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.79 1yqs h LEU 140 CO -0.24 1.00 0.31 0.40 0.09 0.00 0.00 178.44 180.01 1yqs h ILE 141 N 0.49 1.08 -0.93 1.22 1.08 -0.96 -1.96 117.51 117.54 1yqs h ILE 141 Ca 0.07 -0.22 0.05 0.00 -0.39 0.00 0.00 64.86 64.37 1yqs h ILE 141 Cb 0.74 0.39 -0.06 0.00 -3.07 0.00 0.00 36.82 34.82 1yqs h ILE 141 CO 0.06 0.12 0.60 0.74 -0.69 0.00 0.00 178.15 178.97 1yqs h THR 142 N 0.63 1.12 -0.66 -0.27 2.02 -0.81 -0.44 112.91 114.51 1yqs h THR 142 Ca 0.20 -0.39 -0.02 0.00 0.77 0.00 0.00 66.41 66.97 1yqs h THR 142 Cb -0.02 -0.11 -0.03 0.00 -1.74 0.00 0.00 68.15 66.25 1yqs h THR 142 CO -0.07 0.21 0.35 -0.07 0.37 0.00 0.00 175.52 176.30 1yqs h LEU 143 N 1.13 0.83 -0.60 2.58 3.38 -0.89 -2.18 115.31 119.56 1yqs h LEU 143 Ca 0.38 -0.11 0.02 0.00 0.09 0.00 0.00 57.88 58.27 1yqs h LEU 143 Cb 0.07 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 40.57 1yqs h LEU 143 CO -0.14 0.70 0.37 -1.28 0.09 0.00 0.00 178.44 178.18 1yqs h SER 144 N 0.90 0.61 0.39 -0.43 0.87 -0.60 -3.05 113.55 112.25 1yqs h SER 144 Ca 0.23 -0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.79 1yqs h SER 144 Cb 0.06 -0.13 0.00 0.00 -0.44 0.00 0.00 62.40 61.89 1yqs h SER 144 CO -0.03 0.43 0.00 0.18 -0.53 0.00 0.00 176.83 176.88 1yqs n LEU 145 N -4.72 0.00 0.27 2.23 4.77 -0.25 -1.43 117.00 117.87 1yqs n LEU 145 Ca 0.05 0.24 0.18 0.00 -0.03 0.00 0.00 56.01 56.46 1yqs n LEU 145 Cb 0.07 -0.24 0.93 0.00 -2.33 0.00 0.00 43.42 41.84 1yqs n LEU 145 CO 0.33 -0.05 1.05 0.11 -1.33 0.00 0.00 177.39 177.50 1yqs h LYS 146 N 0.00 0.00 -6.46 3.23 1.57 -1.30 -3.43 116.57 110.19 1yqs h LYS 146 Ca 0.00 0.00 -0.64 0.00 -1.87 0.00 0.00 60.65 58.14 1yqs h LYS 146 Cb 0.20 0.00 -0.14 0.00 0.08 0.00 0.00 32.23 32.37 1yqs h LYS 146 CO 0.00 0.00 -0.71 -1.01 -0.57 0.00 0.00 179.45 177.16 1yqs s HIS 147 N -3.86 2.74 0.79 -1.35 3.76 -0.52 -5.12 115.29 111.74 1yqs s HIS 147 Ca -0.02 -0.17 -0.11 0.00 -0.15 0.00 0.00 55.06 54.61 1yqs s HIS 147 Cb 0.10 -1.38 0.07 0.00 1.11 0.00 0.00 32.58 32.49 1yqs s HIS 147 CO 0.39 0.48 1.09 0.20 -0.85 0.00 0.00 174.74 176.05 1yqs s GLY 148 N -2.60 1.67 0.77 -2.22 0.00 -1.26 -4.81 107.32 98.87 1yqs s GLY 148 Ca 0.24 0.25 -0.13 0.00 0.00 0.00 0.00 44.72 45.08 1yqs s GLY 148 CO 0.16 0.62 1.16 -1.34 0.00 0.00 0.00 173.10 173.70 1yqs s VAL 149 N -2.90 2.50 -0.65 1.40 -7.23 -1.26 -4.45 120.40 107.81 1yqs s VAL 149 Ca 0.62 0.21 0.22 0.00 -1.81 0.00 0.00 61.98 61.22 1yqs s VAL 149 Cb -0.17 -2.63 -0.18 0.00 0.56 0.00 0.00 36.38 33.96 1yqs s VAL 149 CO 0.56 -0.16 0.92 0.35 -0.31 0.00 0.00 175.10 176.46 1yqs n THR 150 N -3.16 0.08 -3.63 5.32 -2.24 0.20 -4.98 114.28 105.88 1yqs n THR 150 Ca 0.12 -0.20 -0.08 0.00 -2.27 0.00 0.00 64.05 61.62 1yqs n THR 150 Cb 0.51 0.41 -0.02 0.00 -2.10 0.00 0.00 70.33 69.13 1yqs n THR 150 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1yqs s ASN 151 N -3.70 -0.36 0.69 3.42 2.20 -1.26 -5.03 114.94 110.89 1yqs s ASN 151 Ca 0.03 -0.25 -0.14 0.00 -0.94 0.00 0.00 52.86 51.56 1yqs s ASN 151 Cb 0.15 0.57 0.02 0.00 -2.00 0.00 0.00 41.25 39.98 1yqs s ASN 151 CO 0.83 -0.99 1.12 0.00 -2.94 0.00 0.00 177.10 175.13 1yqs s ALA 152 N -3.57 2.37 0.05 3.54 0.00 -1.26 -4.35 121.76 118.55 1yqs s ALA 152 Ca 0.07 0.56 -0.34 0.00 0.00 0.00 0.00 51.96 52.25 1yqs s ALA 152 Cb -0.02 -3.34 -0.13 0.00 0.00 0.00 0.00 23.12 19.63 1yqs s ALA 152 CO -0.03 -1.45 1.68 -2.30 0.00 0.00 0.00 175.76 173.66 1yqs n PRO 153 N -2.63 2.08 -0.38 0.00 -0.02 -1.26 -1.55 135.00 131.25 1yqs n PRO 153 Ca 0.11 0.76 0.00 0.00 -2.02 0.00 0.00 63.50 62.34 1yqs n PRO 153 Cb 0.52 -2.54 0.00 0.00 -0.02 0.00 0.00 33.50 31.45 1yqs n PRO 153 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1yqs n GLY 154 N 3.75 1.93 0.14 -1.23 0.00 0.11 -4.91 105.19 104.97 1yqs n GLY 154 Ca 0.19 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.24 1yqs n GLY 154 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yqs h ALA 155 N 0.00 0.70 -2.19 4.61 0.00 -1.39 -3.47 119.26 117.53 1yqs h ALA 155 Ca 0.00 -0.48 -0.08 0.00 0.00 0.00 0.00 54.91 54.36 1yqs h ALA 155 Cb 0.00 -0.08 -0.20 0.00 0.00 0.00 0.00 17.79 17.51 1yqs h ALA 155 CO 0.00 0.66 0.03 0.00 0.00 0.00 0.00 179.25 179.94 1yqs s ALA 156 N -3.05 -1.46 -0.05 0.00 0.00 -1.26 -5.02 121.76 110.92 1yqs s ALA 156 Ca 0.03 1.13 -0.29 0.00 0.00 0.00 0.00 51.96 52.83 1yqs s ALA 156 Cb 0.08 -0.17 -0.02 0.00 0.00 0.00 0.00 23.12 23.01 1yqs s ALA 156 CO 0.74 -0.32 0.97 -0.47 0.00 0.00 0.00 175.76 176.67 1yqs s TYR 157 N -0.94 3.59 -0.26 0.00 5.04 -1.26 -4.12 117.35 119.40 1yqs s TYR 157 Ca -0.10 1.61 -0.01 0.00 -2.44 0.00 0.00 57.07 56.13 1yqs s TYR 157 Cb -0.02 -3.12 0.14 0.00 0.35 0.00 0.00 41.96 39.31 1yqs s TYR 157 CO 0.07 -0.10 0.40 0.45 -1.34 0.00 0.00 175.55 175.03 1yqs s SER 158 N 1.04 0.23 0.23 4.32 0.15 0.05 -5.02 113.70 114.70 1yqs s SER 158 Ca 0.49 0.06 -0.32 0.00 0.70 0.00 0.00 55.95 56.88 1yqs s SER 158 Cb -0.20 1.15 -0.13 0.00 -1.71 0.00 0.00 66.02 65.14 1yqs s SER 158 CO 0.23 -0.32 1.60 0.00 1.20 0.00 0.00 173.24 175.95 1yqs n TYR 159 N 5.36 2.57 -3.70 3.44 9.36 -1.26 -4.68 117.16 128.25 1yqs n TYR 159 Ca -0.02 0.22 -0.12 0.00 3.32 0.00 0.00 57.90 61.30 1yqs n TYR 159 Cb 0.50 -2.59 -0.13 0.00 -0.63 0.00 0.00 39.34 36.50 1yqs n TYR 159 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 1yqs s SER 160 N 0.77 -0.13 0.45 2.98 0.15 -1.26 -4.81 113.70 111.84 1yqs s SER 160 Ca 0.72 0.61 0.14 0.00 0.70 0.00 0.00 55.95 58.11 1yqs s SER 160 Cb -0.57 0.57 1.06 0.00 -1.71 0.00 0.00 66.02 65.37 1yqs s SER 160 CO 0.41 -0.19 2.01 0.78 1.20 0.00 0.00 173.24 177.44 1yqs h ASN 161 N 7.52 0.32 -0.88 5.45 2.35 -1.92 -1.82 115.58 126.60 1yqs h ASN 161 Ca -0.32 0.00 0.17 0.00 -0.55 0.00 0.00 56.30 55.60 1yqs h ASN 161 Cb 1.15 -0.06 -0.07 0.00 0.05 0.00 0.00 38.32 39.38 1yqs h ASN 161 CO 0.29 0.20 0.57 0.74 -1.65 0.00 0.00 177.43 177.58 1yqs h THR 162 N 0.36 0.77 -0.99 2.81 2.02 -1.89 -1.01 112.91 114.97 1yqs h THR 162 Ca 0.24 -0.19 0.03 0.00 0.77 0.00 0.00 66.41 67.25 1yqs h THR 162 Cb 0.46 0.15 -0.06 0.00 -1.74 0.00 0.00 68.15 66.96 1yqs h THR 162 CO -0.06 0.10 0.65 0.78 0.37 0.00 0.00 175.52 177.37 1yqs h ASN 163 N 0.57 1.10 0.33 4.18 -0.26 -1.63 -1.25 115.58 118.61 1yqs h ASN 163 Ca 0.45 -0.01 0.00 0.00 -0.56 0.00 0.00 56.30 56.18 1yqs h ASN 163 Cb 0.90 -0.26 0.00 0.00 -1.06 0.00 0.00 38.32 37.90 1yqs h ASN 163 CO -0.20 0.76 -0.51 0.49 -1.06 0.00 0.00 177.43 176.91 1yqs n PHE 164 N -4.43 0.00 -0.03 1.19 3.01 -0.45 -1.70 117.46 115.06 1yqs n PHE 164 Ca 0.13 0.00 -0.12 0.00 1.01 0.00 0.00 57.45 58.47 1yqs n PHE 164 Cb 0.08 -0.17 -0.07 0.00 -0.01 0.00 0.00 39.48 39.32 1yqs n PHE 164 CO 0.00 0.00 0.00 0.28 1.01 0.00 0.00 176.76 178.05 1yqs h VAL 165 N 0.46 1.22 -0.75 -4.37 2.07 -0.95 -2.40 116.25 111.54 1yqs h VAL 165 Ca 0.00 -0.69 0.11 0.00 0.82 0.00 0.00 66.70 66.93 1yqs h VAL 165 Cb 0.52 1.50 -0.08 0.00 -1.52 0.00 0.00 31.29 31.71 1yqs h VAL 165 CO 0.00 0.20 0.37 0.58 0.02 0.00 0.00 177.57 178.74 1yqs h VAL 166 N -0.08 0.82 -0.49 2.57 2.07 -1.08 -1.63 116.25 118.42 1yqs h VAL 166 Ca 0.03 -0.21 0.07 0.00 0.82 0.00 0.00 66.70 67.41 1yqs h VAL 166 Cb 0.30 0.16 -0.06 0.00 -1.52 0.00 0.00 31.29 30.16 1yqs h VAL 166 CO 0.00 0.11 0.15 0.00 0.02 0.00 0.00 177.57 177.85 1yqs h ALA 167 N 1.46 0.59 -0.51 1.67 0.00 -1.23 -0.19 119.26 121.06 1yqs h ALA 167 Ca 0.38 0.08 -0.08 0.00 0.00 0.00 0.00 54.91 55.29 1yqs h ALA 167 Cb 0.43 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 1yqs h ALA 167 CO -0.29 -0.25 0.01 0.78 0.00 0.00 0.00 179.25 179.50 1yqs h GLY 168 N 0.31 0.92 1.20 0.00 0.00 -0.85 -0.93 103.07 103.72 1yqs h GLY 168 Ca 0.24 -0.62 -0.05 0.00 0.00 0.00 0.00 47.33 46.90 1yqs h GLY 168 CO -0.27 0.57 0.21 1.98 0.00 0.00 0.00 176.54 179.03 1yqs h MET 169 N 0.79 1.01 -0.26 4.80 -1.53 -0.64 -1.20 114.93 117.90 1yqs h MET 169 Ca 0.15 -0.20 -0.04 0.00 -3.44 0.00 0.00 59.70 56.18 1yqs h MET 169 Cb 0.46 -0.15 -0.01 0.00 -0.55 0.00 0.00 31.60 31.35 1yqs h MET 169 CO 0.02 0.86 0.02 -0.07 0.14 0.00 0.00 176.91 177.88 1yqs h LEU 170 N 0.97 0.43 -0.17 3.39 3.38 -0.75 -0.77 115.31 121.79 1yqs h LEU 170 Ca 0.22 -0.28 0.04 0.00 0.09 0.00 0.00 57.88 57.94 1yqs h LEU 170 Cb 0.27 -0.11 -0.04 0.00 0.09 0.00 0.00 40.66 40.87 1yqs h LEU 170 CO -0.01 0.61 -0.08 0.40 0.09 0.00 0.00 178.44 179.44 1yqs h ILE 171 N 0.24 0.74 -0.49 1.22 2.04 -0.89 -0.95 117.51 119.40 1yqs h ILE 171 Ca 0.08 0.00 -0.13 0.00 1.00 0.00 0.00 64.86 65.81 1yqs h ILE 171 Cb 0.37 0.74 -0.01 0.00 -0.74 0.00 0.00 36.82 37.17 1yqs h ILE 171 CO 0.01 0.00 -0.18 -0.33 0.00 0.00 0.00 178.15 177.65 1yqs h GLU 172 N -0.06 0.99 0.06 2.37 5.08 -1.13 -1.73 114.58 120.15 1yqs h GLU 172 Ca 0.09 -0.40 -0.00 0.00 -1.00 0.00 0.00 59.36 58.05 1yqs h GLU 172 Cb 0.20 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.41 1yqs h GLU 172 CO -0.21 1.08 -0.03 -0.22 -1.00 0.00 0.00 179.01 178.63 1yqs h LYS 173 N 0.86 -0.07 -0.01 2.33 1.63 -0.98 -0.69 116.57 119.65 1yqs h LYS 173 Ca 0.12 0.01 -0.13 0.00 -0.85 0.00 0.00 60.65 59.79 1yqs h LYS 173 Cb 0.75 0.02 -0.02 0.00 -0.60 0.00 0.00 32.23 32.38 1yqs h LYS 173 CO 0.06 0.08 -0.63 -0.07 -3.45 0.00 0.00 179.45 175.44 1yqs h LEU 174 N -0.21 0.02 0.00 5.20 3.38 -1.11 -3.24 115.31 119.35 1yqs h LEU 174 Ca -0.01 -0.01 -0.09 0.00 0.09 0.00 0.00 57.88 57.86 1yqs h LEU 174 Cb 0.18 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 40.91 1yqs h LEU 174 CO 0.01 0.64 -1.77 0.35 0.09 0.00 0.00 178.44 177.76 1yqs n THR 175 N -3.80 0.56 -1.04 0.22 -2.24 -0.66 -4.98 114.28 102.34 1yqs n THR 175 Ca -0.01 -0.60 -0.01 0.00 -2.27 0.00 0.00 64.05 61.15 1yqs n THR 175 Cb 0.62 -0.27 -0.01 0.00 -2.10 0.00 0.00 70.33 68.58 1yqs n THR 175 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1yqs n GLY 176 N 1.35 0.47 3.45 3.38 0.00 -0.27 -5.02 105.19 108.55 1yqs n GLY 176 Ca -0.09 -0.18 -0.22 0.00 0.00 0.00 0.00 46.02 45.53 1yqs n GLY 176 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1yqs s HIS 177 N -1.83 2.06 0.71 1.61 3.76 -1.23 -5.05 115.29 115.32 1yqs s HIS 177 Ca 0.00 -0.59 -0.13 0.00 -0.15 0.00 0.00 55.06 54.19 1yqs s HIS 177 Cb 0.00 -1.11 0.03 0.00 1.11 0.00 0.00 32.58 32.61 1yqs s HIS 177 CO 0.00 0.42 1.10 -1.54 -0.85 0.00 0.00 174.74 173.87 1yqs s SER 178 N -3.47 4.85 0.34 1.40 1.04 -1.26 -4.20 113.70 112.39 1yqs s SER 178 Ca 0.29 1.91 0.02 0.00 0.48 0.00 0.00 55.95 58.65 1yqs s SER 178 Cb 0.02 -2.54 0.59 0.00 0.10 0.00 0.00 66.02 64.19 1yqs s SER 178 CO 0.13 -1.80 1.97 -0.37 0.98 0.00 0.00 173.24 174.14 1yqs h VAL 179 N -0.51 1.18 -0.47 5.02 -1.51 -1.94 -1.91 116.25 116.11 1yqs h VAL 179 Ca -0.45 -0.43 0.04 0.00 -1.23 0.00 0.00 66.70 64.63 1yqs h VAL 179 Cb 1.24 0.37 -0.04 0.00 -2.13 0.00 0.00 31.29 30.72 1yqs h VAL 179 CO 0.53 0.19 0.23 0.00 -1.23 0.00 0.00 177.57 177.29 1yqs h ALA 180 N 1.55 0.60 -0.57 5.19 0.00 -1.92 0.74 119.26 124.85 1yqs h ALA 180 Ca 0.21 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1yqs h ALA 180 Cb 0.01 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 1yqs h ALA 180 CO -0.04 -0.12 0.37 1.15 0.00 0.00 0.00 179.25 180.62 1yqs h THR 181 N 0.46 1.15 -0.39 0.00 2.02 -1.79 -1.04 112.91 113.32 1yqs h THR 181 Ca 0.21 -0.29 -0.09 0.00 0.77 0.00 0.00 66.41 67.01 1yqs h THR 181 Cb 0.13 0.32 -0.01 0.00 -1.74 0.00 0.00 68.15 66.84 1yqs h THR 181 CO -0.15 0.15 -0.09 -0.33 0.37 0.00 0.00 175.52 175.46 1yqs h GLU 182 N 0.78 0.76 -0.58 6.66 4.39 -0.83 -0.21 114.58 125.55 1yqs h GLU 182 Ca 0.21 -0.29 -0.00 0.00 0.34 0.00 0.00 59.36 59.62 1yqs h GLU 182 Cb -0.08 -0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 28.50 1yqs h GLU 182 CO -0.04 0.89 0.34 1.88 -1.16 0.00 0.00 179.01 180.92 1yqs h TYR 183 N 0.57 0.77 -0.01 4.33 0.05 -0.78 -0.79 116.97 121.10 1yqs h TYR 183 Ca 0.10 -0.00 -0.00 0.00 0.05 0.00 0.00 58.73 58.88 1yqs h TYR 183 Cb 0.61 -0.25 -0.00 0.00 1.01 0.00 0.00 36.73 38.10 1yqs h TYR 183 CO 0.05 0.53 0.00 0.37 -1.05 0.00 0.00 178.16 178.06 1yqs h GLN 184 N 0.78 0.01 -0.01 4.88 5.75 -0.93 0.10 115.11 125.69 1yqs h GLN 184 Ca 0.21 -0.00 -0.19 0.00 -0.15 0.00 0.00 58.65 58.52 1yqs h GLN 184 Cb -0.01 -0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.53 1yqs h GLN 184 CO -0.04 0.09 -0.82 -0.91 -2.65 0.00 0.00 178.83 174.49 1yqs h ASN 185 N -0.06 0.28 0.58 -0.69 -0.26 -0.93 0.23 115.58 114.73 1yqs h ASN 185 Ca 0.00 -0.21 -0.03 0.00 -0.56 0.00 0.00 56.30 55.50 1yqs h ASN 185 Cb 0.08 -0.08 -0.01 0.00 -1.06 0.00 0.00 38.32 37.25 1yqs h ASN 185 CO -0.00 0.98 -1.44 0.54 -1.06 0.00 0.00 177.43 176.45 1yqs n ARG 186 N -3.71 0.63 0.09 0.81 1.74 -0.31 -4.49 116.66 111.41 1yqs n ARG 186 Ca -0.03 0.02 0.00 0.00 -0.77 0.00 0.00 57.85 57.06 1yqs n ARG 186 Cb 0.77 -1.71 0.00 0.00 -1.02 0.00 0.00 32.46 30.50 1yqs n ARG 186 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 1yqs n ILE 187 N -2.56 0.42 -0.06 0.55 5.41 -0.36 -4.78 119.36 117.99 1yqs n ILE 187 Ca -0.04 0.14 -0.11 0.00 1.00 0.00 0.00 62.75 63.74 1yqs n ILE 187 Cb 0.61 -0.85 -0.05 0.00 -0.71 0.00 0.00 39.64 38.63 1yqs n ILE 187 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 176.55 176.29 1yqs h PHE 188 N 0.00 0.33 0.06 1.39 0.04 -0.97 -1.97 116.94 115.82 1yqs h PHE 188 Ca 0.00 -0.05 -0.00 0.00 2.80 0.00 0.00 57.97 60.72 1yqs h PHE 188 Cb 0.00 -0.09 0.00 0.00 2.20 0.00 0.00 35.95 38.06 1yqs h PHE 188 CO 0.00 0.46 -0.03 1.15 -0.60 0.00 0.00 178.31 179.29 1yqs h THR 189 N 0.11 1.21 -0.46 -1.55 2.02 -1.18 0.07 112.91 113.13 1yqs h THR 189 Ca 0.06 -1.02 0.04 0.00 0.77 0.00 0.00 66.41 66.25 1yqs h THR 189 Cb 0.31 1.87 -0.03 0.00 -1.74 0.00 0.00 68.15 68.56 1yqs h THR 189 CO 0.00 0.25 0.31 -0.65 0.37 0.00 0.00 175.52 175.80 1yqs h PRO 190 N -0.55 0.48 -0.03 6.66 0.11 -1.76 -1.50 132.00 135.40 1yqs h PRO 190 Ca -0.01 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.07 1yqs h PRO 190 Cb 0.48 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 31.48 1yqs h PRO 190 CO 0.01 0.31 0.00 1.28 -0.21 0.00 0.00 178.00 179.40 1yqs n LEU 191 N -4.48 1.87 -3.67 2.35 4.77 -0.74 -4.97 117.00 112.13 1yqs n LEU 191 Ca 0.05 -0.64 -0.21 0.00 -0.03 0.00 0.00 56.01 55.18 1yqs n LEU 191 Cb 0.16 -0.01 0.04 0.00 -2.33 0.00 0.00 43.42 41.28 1yqs n LEU 191 CO 0.35 0.32 -0.05 -3.20 -1.33 0.00 0.00 177.39 173.47 1yqs n ASN 192 N 0.46 -1.48 -4.41 -1.43 4.05 -0.57 -4.88 115.26 107.01 1yqs n ASN 192 Ca 0.18 -0.81 -0.43 0.00 0.45 0.00 0.00 54.58 53.96 1yqs n ASN 192 Cb 0.41 -4.14 0.00 0.00 1.23 0.00 0.00 39.78 37.29 1yqs n ASN 192 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 177.26 174.39 1yqs n LEU 193 N -4.23 5.34 0.08 1.20 4.77 -0.09 -4.81 117.00 119.27 1yqs n LEU 193 Ca -0.29 -4.26 0.10 0.00 -0.03 0.00 0.00 56.01 51.53 1yqs n LEU 193 Cb 0.67 -1.66 0.43 0.00 -2.33 0.00 0.00 43.42 40.53 1yqs n LEU 193 CO 0.68 0.60 0.81 0.35 -1.33 0.00 0.00 177.39 178.49 1yqs n THR 194 N 5.17 0.87 -0.26 -5.08 -2.24 -1.26 -1.79 114.28 109.69 1yqs n THR 194 Ca 0.42 0.22 0.09 0.00 -2.27 0.00 0.00 64.05 62.52 1yqs n THR 194 Cb 0.43 -1.08 0.24 0.00 -2.10 0.00 0.00 70.33 67.83 1yqs n THR 194 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1yqs n ASP 195 N -1.96 3.48 -4.40 3.42 8.00 -1.26 -4.99 116.55 118.84 1yqs n ASP 195 Ca 0.03 -1.99 -0.33 0.00 0.71 0.00 0.00 54.79 53.21 1yqs n ASP 195 Cb 0.21 -0.37 -0.14 0.00 -0.02 0.00 0.00 41.12 40.81 1yqs n ASP 195 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1yqs s THR 196 N -1.01 3.09 0.05 -3.53 2.01 -0.74 -3.92 115.64 111.58 1yqs s THR 196 Ca 0.37 -0.66 -0.07 0.00 0.31 0.00 0.00 61.69 61.64 1yqs s THR 196 Cb 0.20 -2.28 -0.00 0.00 0.01 0.00 0.00 72.50 70.42 1yqs s THR 196 CO 0.26 0.54 0.14 -0.36 -0.69 0.00 0.00 174.62 174.51 1yqs s PHE 197 N 0.06 0.15 -0.29 4.92 0.40 -0.29 -5.00 117.98 117.93 1yqs s PHE 197 Ca -0.05 -0.44 -0.02 0.00 -0.60 0.00 0.00 56.93 55.82 1yqs s PHE 197 Cb -0.14 -0.10 0.09 0.00 0.51 0.00 0.00 43.02 43.38 1yqs s PHE 197 CO 0.04 -0.41 0.10 -0.47 0.70 0.00 0.00 175.22 175.18 1yqs s TYR 198 N -2.79 1.16 -0.98 0.36 6.14 -1.26 -1.05 117.35 118.94 1yqs s TYR 198 Ca -0.03 -1.34 0.09 0.00 0.64 0.00 0.00 57.07 56.43 1yqs s TYR 198 Cb -0.00 -1.36 0.15 0.00 0.42 0.00 0.00 41.96 41.17 1yqs s TYR 198 CO -0.05 -0.82 0.97 1.33 0.64 0.00 0.00 175.55 177.62 1yqs n VAL 199 N 5.01 0.44 -1.55 3.14 0.24 -1.26 -4.85 118.33 119.50 1yqs n VAL 199 Ca -0.04 -0.72 -0.49 0.00 -2.04 0.00 0.00 64.34 61.05 1yqs n VAL 199 Cb 0.43 0.89 -0.04 0.00 -1.47 0.00 0.00 33.84 33.65 1yqs n VAL 199 CO 0.00 0.00 0.00 1.57 -2.14 0.00 0.00 176.83 176.26 1yqs n HIS 200 N 0.44 0.97 -0.18 6.34 -0.00 -1.26 -0.90 115.22 120.63 1yqs n HIS 200 Ca 0.07 0.76 0.05 0.00 -0.00 0.00 0.00 57.72 58.60 1yqs n HIS 200 Cb 0.30 -2.21 0.27 0.00 -0.00 0.00 0.00 29.99 28.35 1yqs n HIS 200 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.34 175.99 1yqs n PRO 201 N 1.42 3.42 -1.86 1.57 -0.04 -1.26 -5.09 135.00 133.16 1yqs n PRO 201 Ca 0.15 -2.08 -0.39 0.00 -0.04 0.00 0.00 63.50 61.13 1yqs n PRO 201 Cb 0.25 -1.93 0.02 0.00 -0.04 0.00 0.00 33.50 31.80 1yqs n PRO 201 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1yqs s ASP 202 N -0.59 5.86 0.01 3.54 -1.08 -0.08 -4.48 116.67 119.85 1yqs s ASP 202 Ca 0.36 2.82 0.22 0.00 -0.52 0.00 0.00 52.55 55.43 1yqs s ASP 202 Cb 0.27 -2.65 -0.10 0.00 -1.46 0.00 0.00 42.92 38.98 1yqs s ASP 202 CO 0.13 -1.17 0.92 0.35 0.52 0.00 0.00 175.17 175.91 1yqs n THR 203 N -0.29 0.05 -2.84 1.71 -2.24 -1.26 -4.62 114.28 104.79 1yqs n THR 203 Ca 0.06 -0.15 -0.40 0.00 -2.27 0.00 0.00 64.05 61.29 1yqs n THR 203 Cb 0.43 0.54 -0.06 0.00 -2.10 0.00 0.00 70.33 69.14 1yqs n THR 203 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1yqs s VAL 204 N -3.14 4.26 -0.31 2.28 1.01 -1.26 -3.57 120.40 119.66 1yqs s VAL 204 Ca 0.04 1.92 -0.17 0.00 0.00 0.00 0.00 61.98 63.77 1yqs s VAL 204 Cb 0.15 -4.25 -0.02 0.00 0.00 0.00 0.00 36.38 32.27 1yqs s VAL 204 CO 0.84 0.48 0.48 -0.63 0.00 0.00 0.00 175.10 176.27 1yqs s ILE 205 N -0.98 5.07 0.32 2.22 1.01 -1.26 -5.02 121.20 122.55 1yqs s ILE 205 Ca 0.40 0.52 -0.29 0.00 0.00 0.00 0.00 60.65 61.27 1yqs s ILE 205 Cb -0.24 -3.87 -0.10 0.00 0.01 0.00 0.00 42.46 38.25 1yqs s ILE 205 CO 0.29 -0.06 1.41 -2.84 0.00 0.00 0.00 174.94 173.74 1yqs s PRO 206 N 2.30 4.25 1.11 2.79 0.02 -1.26 -4.81 135.00 139.40 1yqs s PRO 206 Ca 0.18 2.35 0.00 0.00 0.02 0.00 0.00 61.00 63.56 1yqs s PRO 206 Cb -0.16 -3.05 0.00 0.00 0.02 0.00 0.00 34.50 31.31 1yqs s PRO 206 CO 0.11 -0.36 0.00 0.41 -0.33 0.00 0.00 177.00 176.83 1yqs n GLY 207 N 1.14 -1.71 3.72 0.52 0.00 -1.26 -4.80 105.19 102.80 1yqs n GLY 207 Ca 0.02 -1.26 -0.42 0.00 0.00 0.00 0.00 46.02 44.36 1yqs n GLY 207 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1yqs s THR 208 N -0.41 2.98 0.06 2.61 2.01 -1.26 -4.93 115.64 116.70 1yqs s THR 208 Ca 0.00 0.73 -0.07 0.00 0.31 0.00 0.00 61.69 62.66 1yqs s THR 208 Cb 0.00 -3.47 -0.01 0.00 0.01 0.00 0.00 72.50 69.03 1yqs s THR 208 CO 0.00 0.07 0.14 -1.38 -0.69 0.00 0.00 174.62 172.77 1yqs s HIS 209 N 0.83 0.18 0.16 4.92 -0.00 -1.26 -1.56 115.29 118.56 1yqs s HIS 209 Ca 0.65 -0.54 -0.30 0.00 -0.00 0.00 0.00 55.06 54.86 1yqs s HIS 209 Cb -0.40 -0.11 -0.07 0.00 -0.00 0.00 0.00 32.58 32.00 1yqs s HIS 209 CO 0.33 -0.46 1.11 0.00 -0.00 0.00 0.00 174.74 175.72 1yqs s ALA 210 N -3.26 3.36 0.51 -1.38 0.00 -0.41 -4.83 121.76 115.75 1yqs s ALA 210 Ca 0.00 0.81 -0.19 0.00 0.00 0.00 0.00 51.96 52.59 1yqs s ALA 210 Cb 0.02 -3.36 -0.08 0.00 0.00 0.00 0.00 23.12 19.71 1yqs s ALA 210 CO -0.08 -0.24 1.02 -0.80 0.00 0.00 0.00 175.76 175.66 1yqs s ASN 211 N 0.08 6.36 -0.07 0.00 -0.87 -0.09 -4.81 114.94 115.54 1yqs s ASN 211 Ca 0.51 1.80 -0.04 0.00 -1.57 0.00 0.00 52.86 53.55 1yqs s ASN 211 Cb -0.29 -2.54 -0.04 0.00 -0.02 0.00 0.00 41.25 38.36 1yqs s ASN 211 CO 0.34 -0.77 0.11 -0.83 -2.57 0.00 0.00 177.10 173.39 1yqs s GLY 212 N -2.40 2.08 -0.22 0.66 0.00 -1.26 -4.81 107.32 101.37 1yqs s GLY 212 Ca 0.64 -0.74 -0.00 0.00 0.00 0.00 0.00 44.72 44.62 1yqs s GLY 212 CO 0.25 -0.53 -0.03 -0.19 0.00 0.00 0.00 173.10 172.59 1yqs s TYR 213 N -1.09 2.04 -0.12 1.90 2.02 -0.83 -0.71 117.35 120.56 1yqs s TYR 213 Ca 0.19 -1.50 -0.28 0.00 -0.37 0.00 0.00 57.07 55.10 1yqs s TYR 213 Cb -0.12 -1.44 -0.01 0.00 -0.40 0.00 0.00 41.96 39.99 1yqs s TYR 213 CO 0.08 -0.73 0.96 -1.17 -1.57 0.00 0.00 175.55 173.13 1yqs s LEU 214 N 1.52 4.23 -0.02 -1.29 2.96 0.58 -2.82 118.68 123.84 1yqs s LEU 214 Ca -0.04 1.44 -0.30 0.00 -0.22 0.00 0.00 54.13 55.02 1yqs s LEU 214 Cb -0.18 -3.47 -0.03 0.00 0.50 0.00 0.00 46.19 43.01 1yqs s LEU 214 CO -0.07 -0.43 0.97 -0.89 -1.32 0.00 0.00 176.35 174.61 1yqs s THR 215 N 2.00 4.87 0.79 3.68 2.01 -0.88 -1.78 115.64 126.33 1yqs s THR 215 Ca 0.46 2.02 -0.11 0.00 0.31 0.00 0.00 61.69 64.37 1yqs s THR 215 Cb -0.18 -4.30 0.06 0.00 0.01 0.00 0.00 72.50 68.09 1yqs s THR 215 CO 0.17 0.15 1.08 -2.16 -0.69 0.00 0.00 174.62 173.17 1yqs s PRO 216 N 1.13 2.16 0.50 4.92 0.04 -1.26 -4.72 135.00 137.77 1yqs s PRO 216 Ca 0.51 0.94 0.26 0.00 0.04 0.00 0.00 61.00 62.75 1yqs s PRO 216 Cb -0.20 -1.90 1.32 0.00 0.04 0.00 0.00 34.50 33.76 1yqs s PRO 216 CO 0.26 -1.64 2.02 -0.44 0.04 0.00 0.00 177.00 177.23 1yqs h ASP 217 N -1.12 0.00 -3.20 6.66 3.32 -1.96 -3.42 116.42 116.70 1yqs h ASP 217 Ca -0.46 0.00 -0.58 0.00 0.02 0.00 0.00 57.03 56.02 1yqs h ASP 217 Cb 1.24 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 40.73 1yqs h ASP 217 CO 0.55 0.15 0.61 -1.61 -1.72 0.00 0.00 179.24 177.22 1yqs s GLU 218 N -4.09 4.30 0.28 3.56 8.01 -1.26 -4.98 118.70 124.51 1yqs s GLU 218 Ca -0.02 1.24 -0.30 0.00 0.01 0.00 0.00 54.97 55.90 1yqs s GLU 218 Cb 0.13 -3.60 -0.13 0.00 -4.31 0.00 0.00 34.13 26.21 1yqs s GLU 218 CO 0.60 -0.47 1.37 0.00 0.01 0.00 0.00 175.26 176.77 1yqs n ALA 219 N 5.72 1.23 -0.71 5.21 0.00 -1.26 -1.37 120.51 129.33 1yqs n ALA 219 Ca 0.09 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.92 1yqs n ALA 219 Cb 0.47 -2.27 0.00 0.00 0.00 0.00 0.00 19.45 17.65 1yqs n ALA 219 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yqs n GLY 220 N 1.70 1.47 3.76 0.00 0.00 -1.26 -5.01 105.19 105.84 1yqs n GLY 220 Ca 0.09 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.79 1yqs n GLY 220 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1yqs s GLY 221 N -2.00 2.04 0.35 -0.02 0.00 -0.47 -4.97 107.32 102.24 1yqs s GLY 221 Ca 0.00 0.53 -0.28 0.00 0.00 0.00 0.00 44.72 44.96 1yqs s GLY 221 CO 0.00 0.89 1.42 0.00 0.00 0.00 0.00 173.10 175.41 1yqs s ALA 222 N -2.45 3.56 0.50 3.20 0.00 -1.26 -4.67 121.76 120.64 1yqs s ALA 222 Ca 0.66 1.44 -0.21 0.00 0.00 0.00 0.00 51.96 53.86 1yqs s ALA 222 Cb -0.21 -3.56 -0.07 0.00 0.00 0.00 0.00 23.12 19.28 1yqs s ALA 222 CO 0.46 -0.88 1.11 -0.51 0.00 0.00 0.00 175.76 175.95 1yqs s LEU 223 N -1.81 3.86 -0.16 0.00 1.43 -1.26 -4.49 118.68 116.25 1yqs s LEU 223 Ca 0.52 2.14 -0.03 0.00 -1.03 0.00 0.00 54.13 55.73 1yqs s LEU 223 Cb -0.44 -4.47 -0.02 0.00 0.03 0.00 0.00 46.19 41.29 1yqs s LEU 223 CO 0.58 -1.00 -0.05 -0.69 0.23 0.00 0.00 176.35 175.41 1yqs s VAL 224 N -1.75 3.71 -0.27 -1.59 1.01 -0.73 -4.94 120.40 115.83 1yqs s VAL 224 Ca 0.68 -0.42 -0.29 0.00 0.00 0.00 0.00 61.98 61.96 1yqs s VAL 224 Cb -0.23 -2.62 -0.02 0.00 0.00 0.00 0.00 36.38 33.51 1yqs s VAL 224 CO 0.27 0.49 1.57 -0.62 0.00 0.00 0.00 175.10 176.82 1yqs s ASP 225 N 0.46 6.33 -0.12 3.32 -1.08 -1.26 -0.31 116.67 124.01 1yqs s ASP 225 Ca -0.05 1.40 0.15 0.00 -0.52 0.00 0.00 52.55 53.53 1yqs s ASP 225 Cb -0.15 -2.53 0.40 0.00 -1.46 0.00 0.00 42.92 39.18 1yqs s ASP 225 CO 0.03 -1.33 1.30 -1.54 0.52 0.00 0.00 175.17 174.15 1yqs n SER 226 N 8.68 3.24 -0.07 -0.34 3.41 0.12 -4.80 113.62 123.86 1yqs n SER 226 Ca 0.19 -2.75 -0.07 0.00 -0.26 0.00 0.00 58.87 55.97 1yqs n SER 226 Cb 0.46 -0.42 -0.01 0.00 -0.26 0.00 0.00 64.21 63.98 1yqs n SER 226 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 1yqs h THR 227 N 1.34 0.66 -3.57 6.66 2.02 -1.84 -3.40 112.91 114.77 1yqs h THR 227 Ca 0.00 0.00 -0.71 0.00 0.77 0.00 0.00 66.41 66.47 1yqs h THR 227 Cb 1.14 0.66 -0.23 0.00 -1.74 0.00 0.00 68.15 67.98 1yqs h THR 227 CO 0.12 0.00 -0.49 -1.61 0.37 0.00 0.00 175.52 173.91 1yqs s GLU 228 N -6.19 2.95 0.18 6.66 2.02 -1.26 -4.88 118.70 118.18 1yqs s GLU 228 Ca -0.14 -1.01 -0.18 0.00 0.02 0.00 0.00 54.97 53.67 1yqs s GLU 228 Cb 0.12 -3.79 0.03 0.00 0.10 0.00 0.00 34.13 30.59 1yqs s GLU 228 CO 0.69 -0.68 0.50 1.14 0.02 0.00 0.00 175.26 176.94 1yqs s GLN 229 N 1.61 1.30 0.24 1.61 -2.07 -1.23 -4.96 119.66 116.16 1yqs s GLN 229 Ca 0.03 -0.80 0.10 0.00 -1.82 0.00 0.00 55.36 52.88 1yqs s GLN 229 Cb -0.19 0.51 0.24 0.00 -1.09 0.00 0.00 33.01 32.48 1yqs s GLN 229 CO 0.08 -0.55 1.54 1.79 -1.32 0.00 0.00 175.29 176.83 1yqs h THR 230 N 2.22 1.45 -2.45 3.63 1.35 -1.23 -3.37 112.91 114.51 1yqs h THR 230 Ca -0.30 -2.39 -0.39 0.00 -0.55 0.00 0.00 66.41 62.78 1yqs h THR 230 Cb 1.26 2.30 -0.07 0.00 -1.73 0.00 0.00 68.15 69.92 1yqs h THR 230 CO 0.39 0.67 -0.45 0.52 -0.25 0.00 0.00 175.52 176.41 1yqs n VAL 231 N -3.65 -0.59 0.25 6.82 0.31 -1.26 -4.70 118.33 115.49 1yqs n VAL 231 Ca -0.01 0.00 0.13 0.00 -0.01 0.00 0.00 64.34 64.45 1yqs n VAL 231 Cb 0.69 -2.42 0.54 0.00 -0.91 0.00 0.00 33.84 31.74 1yqs n VAL 231 CO 0.00 0.00 0.00 -1.28 -1.32 0.00 0.00 176.83 174.23 1yqs h SER 232 N 0.00 0.00 0.49 4.52 0.87 -1.87 -0.89 113.55 116.67 1yqs h SER 232 Ca -0.43 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.13 1yqs h SER 232 Cb 1.31 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.27 1yqs h SER 232 CO 0.55 0.12 0.00 4.11 -0.53 0.00 0.00 176.83 181.08 1yqs h TRP 233 N 0.00 0.00 0.00 2.24 5.08 -1.87 -3.36 115.95 118.04 1yqs h TRP 233 Ca -0.00 0.00 -0.04 0.00 1.08 0.00 0.00 58.89 59.93 1yqs h TRP 233 Cb 0.66 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.81 1yqs h TRP 233 CO 0.00 0.00 -1.12 0.00 -1.28 0.00 0.00 178.44 176.04 1yqs n ALA 234 N -1.97 2.55 -0.64 0.11 0.00 -0.65 -5.02 120.51 114.89 1yqs n ALA 234 Ca -0.00 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.35 1yqs n ALA 234 Cb 0.17 0.46 0.00 0.00 0.00 0.00 0.00 19.45 20.09 1yqs n ALA 234 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1yqs n GLN 235 N -2.92 0.00 0.00 0.00 6.02 -0.43 -0.69 117.38 119.36 1yqs n GLN 235 Ca -0.04 0.00 0.07 0.00 -0.01 0.00 0.00 57.00 57.02 1yqs n GLN 235 Cb 0.53 0.00 0.40 0.00 1.02 0.00 0.00 30.24 32.20 1yqs n GLN 235 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92 1yqs n SER 236 N 6.69 0.00 0.01 1.08 3.41 -1.26 -0.79 113.62 122.76 1yqs n SER 236 Ca 0.00 -0.17 0.11 0.00 -0.26 0.00 0.00 58.87 58.55 1yqs n SER 236 Cb 0.00 -0.16 0.05 0.00 -0.26 0.00 0.00 64.21 63.84 1yqs n SER 236 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1yqs n ALA 237 N -1.16 3.83 -1.09 7.33 0.00 0.13 -4.26 120.51 125.29 1yqs n ALA 237 Ca 0.09 -0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.08 1yqs n ALA 237 Cb 0.09 -0.96 0.00 0.00 0.00 0.00 0.00 19.45 18.58 1yqs n ALA 237 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yqs n GLY 238 N 1.45 0.54 1.24 0.00 0.00 -0.24 -4.10 105.19 104.08 1yqs n GLY 238 Ca 0.04 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.17 1yqs n GLY 238 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yqs n ALA 239 N 0.00 2.38 -1.77 4.61 0.00 0.03 -3.42 120.51 122.35 1yqs n ALA 239 Ca 0.00 -1.17 -0.38 0.00 0.00 0.00 0.00 53.44 51.89 1yqs n ALA 239 Cb 0.21 -0.88 -0.02 0.00 0.00 0.00 0.00 19.45 18.77 1yqs n ALA 239 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1yqs s VAL 240 N -1.19 3.10 -0.10 0.00 1.01 -1.26 -4.67 120.40 117.28 1yqs s VAL 240 Ca 0.44 0.92 -0.03 0.00 0.00 0.00 0.00 61.98 63.31 1yqs s VAL 240 Cb 0.24 -3.51 -0.03 0.00 0.00 0.00 0.00 36.38 33.07 1yqs s VAL 240 CO 0.32 0.08 0.00 -0.63 0.00 0.00 0.00 175.10 174.87 1yqs s ILE 241 N -1.41 4.31 0.00 2.22 1.01 -0.21 -1.75 121.20 125.36 1yqs s ILE 241 Ca 0.58 -0.24 0.00 0.00 0.00 0.00 0.00 60.65 60.99 1yqs s ILE 241 Cb -0.31 -2.83 0.00 0.00 0.01 0.00 0.00 42.46 39.33 1yqs s ILE 241 CO 0.39 0.58 0.00 -0.24 0.00 0.00 0.00 174.94 175.67 1yqs n SER 242 N 2.41 0.00 -4.24 3.58 2.88 -0.40 -1.14 113.62 116.72 1yqs n SER 242 Ca -0.18 -0.43 -0.13 0.00 -1.33 0.00 0.00 58.87 56.79 1yqs n SER 242 Cb 0.53 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.89 1yqs n SER 242 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1yqs s SER 243 N 0.59 0.89 0.20 -3.46 1.04 -1.26 -1.21 113.70 110.48 1yqs s SER 243 Ca 0.00 -1.27 -0.10 0.00 0.48 0.00 0.00 55.95 55.06 1yqs s SER 243 Cb 0.00 0.20 0.13 0.00 0.10 0.00 0.00 66.02 66.45 1yqs s SER 243 CO 0.00 -0.68 1.82 0.71 0.98 0.00 0.00 173.24 176.07 1yqs h THR 244 N 2.63 1.22 -0.44 2.02 1.35 -1.83 -0.87 112.91 116.98 1yqs h THR 244 Ca -0.37 -0.52 -0.01 0.00 -0.55 0.00 0.00 66.41 64.96 1yqs h THR 244 Cb 1.22 0.25 -0.02 0.00 -1.73 0.00 0.00 68.15 67.88 1yqs h THR 244 CO 0.60 0.23 0.24 -0.61 -0.25 0.00 0.00 175.52 175.73 1yqs h GLN 245 N 0.99 0.62 -0.23 4.72 4.15 -1.95 -1.89 115.11 121.52 1yqs h GLN 245 Ca 0.25 -0.08 -0.16 0.00 0.77 0.00 0.00 58.65 59.44 1yqs h GLN 245 Cb 0.02 -0.12 -0.01 0.00 0.21 0.00 0.00 27.48 27.58 1yqs h GLN 245 CO -0.04 0.50 -0.51 -0.44 -1.93 0.00 0.00 178.83 176.41 1yqs h ASP 246 N 0.57 0.71 -0.12 -0.69 5.19 -1.89 -0.74 116.42 119.45 1yqs h ASP 246 Ca 0.15 -0.36 -0.11 0.00 -0.62 0.00 0.00 57.03 56.09 1yqs h ASP 246 Cb 0.06 -0.20 -0.01 0.00 0.18 0.00 0.00 39.33 39.36 1yqs h ASP 246 CO -0.02 1.09 -0.28 -0.07 -3.12 0.00 0.00 179.24 176.84 1yqs h LEU 247 N 0.50 0.59 -0.29 1.55 3.38 -1.11 -0.04 115.31 119.89 1yqs h LEU 247 Ca 0.02 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 57.77 1yqs h LEU 247 Cb 1.06 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.63 1yqs h LEU 247 CO 0.10 0.85 0.18 0.44 0.09 0.00 0.00 178.44 180.10 1yqs h ASP 248 N 0.50 0.35 -0.33 -0.43 3.32 -1.12 -0.95 116.42 117.75 1yqs h ASP 248 Ca 0.07 -0.03 0.04 0.00 0.02 0.00 0.00 57.03 57.12 1yqs h ASP 248 Cb 0.74 -0.09 -0.04 0.00 0.22 0.00 0.00 39.33 40.17 1yqs h ASP 248 CO 0.06 0.28 0.12 0.74 -1.72 0.00 0.00 179.24 178.72 1yqs h THR 249 N 0.38 0.92 0.44 0.35 2.02 -0.84 -0.97 112.91 115.21 1yqs h THR 249 Ca 0.11 -0.09 -0.02 0.00 0.77 0.00 0.00 66.41 67.17 1yqs h THR 249 Cb -0.01 0.63 0.00 0.00 -1.74 0.00 0.00 68.15 67.03 1yqs h THR 249 CO -0.02 0.05 -0.21 0.15 0.37 0.00 0.00 175.52 175.86 1yqs h PHE 250 N 0.27 -0.55 -0.03 3.16 3.57 -0.75 -0.71 116.94 121.90 1yqs h PHE 250 Ca 0.15 -0.01 -0.11 0.00 3.53 0.00 0.00 57.97 61.52 1yqs h PHE 250 Cb 0.11 0.18 -0.01 0.00 2.79 0.00 0.00 35.95 39.02 1yqs h PHE 250 CO -0.13 -0.34 -0.50 0.74 -2.23 0.00 0.00 178.31 175.84 1yqs h PHE 251 N -0.59 0.08 -0.55 0.41 0.04 -1.14 -0.34 116.94 114.85 1yqs h PHE 251 Ca -0.06 -0.03 -0.05 0.00 2.80 0.00 0.00 57.97 60.64 1yqs h PHE 251 Cb 0.45 -0.02 -0.02 0.00 2.20 0.00 0.00 35.95 38.56 1yqs h PHE 251 CO -0.05 0.56 0.16 0.77 -0.60 0.00 0.00 178.31 179.15 1yqs h SER 252 N 0.05 0.81 -0.75 2.17 0.02 -1.09 -1.50 113.55 113.26 1yqs h SER 252 Ca -0.00 -0.22 -0.06 0.00 -0.84 0.00 0.00 61.79 60.67 1yqs h SER 252 Cb 0.91 -0.21 -0.03 0.00 0.14 0.00 0.00 62.40 63.21 1yqs h SER 252 CO 0.07 0.82 0.24 0.00 -1.14 0.00 0.00 176.83 176.81 1yqs h ALA 253 N 1.03 0.99 0.63 3.77 0.00 -0.74 -1.44 119.26 123.51 1yqs h ALA 253 Ca 0.18 -0.23 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 1yqs h ALA 253 Cb 0.31 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.81 1yqs h ALA 253 CO -0.00 0.67 -0.32 1.25 0.00 0.00 0.00 179.25 180.85 1yqs h LEU 254 N 1.12 -0.76 -1.03 0.00 5.85 -0.90 -0.28 115.31 119.32 1yqs h LEU 254 Ca 0.24 0.03 -0.10 0.00 0.84 0.00 0.00 57.88 58.90 1yqs h LEU 254 Cb 0.31 0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.52 1yqs h LEU 254 CO -0.01 -0.53 -0.46 0.24 -0.34 0.00 0.00 178.44 177.34 1yqs h MET 255 N -0.86 0.00 -0.01 1.25 2.86 -1.19 -2.38 114.93 114.59 1yqs h MET 255 Ca -0.08 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.56 1yqs h MET 255 Cb 0.67 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.33 1yqs h MET 255 CO 0.13 0.46 0.00 -1.13 1.06 0.00 0.00 176.91 177.43 1yqs n SER 256 N -3.86 0.46 0.00 1.22 3.41 -0.55 -4.52 113.62 109.79 1yqs n SER 256 Ca -0.01 -1.22 0.00 0.00 -0.26 0.00 0.00 58.87 57.37 1yqs n SER 256 Cb 0.50 -0.01 0.00 0.00 -0.26 0.00 0.00 64.21 64.45 1yqs n SER 256 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1yqs n GLY 257 N 1.02 0.92 0.08 5.00 0.00 -0.89 -4.99 105.19 106.32 1yqs n GLY 257 Ca 0.21 -0.09 0.12 0.00 0.00 0.00 0.00 46.02 46.26 1yqs n GLY 257 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1yqs n GLN 258 N -2.15 0.24 0.00 1.61 6.02 -0.14 -4.40 117.38 118.56 1yqs n GLN 258 Ca 0.00 -0.16 0.05 0.00 -0.01 0.00 0.00 57.00 56.89 1yqs n GLN 258 Cb 0.00 -1.50 0.03 0.00 1.02 0.00 0.00 30.24 29.79 1yqs n GLN 258 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1yqs n LEU 259 N -1.24 1.61 -3.79 1.08 4.77 -1.25 -5.00 117.00 113.17 1yqs n LEU 259 Ca 0.07 -0.90 -0.01 0.00 -0.03 0.00 0.00 56.01 55.14 1yqs n LEU 259 Cb 0.34 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.44 1yqs n LEU 259 CO 0.34 0.31 0.89 0.00 -1.33 0.00 0.00 177.39 177.61 1yqs s MET 260 N -1.11 0.91 0.81 3.23 0.23 -1.26 -4.77 119.30 117.34 1yqs s MET 260 Ca 0.11 -0.54 -0.11 0.00 -1.03 0.00 0.00 55.69 54.12 1yqs s MET 260 Cb 0.09 0.28 0.08 0.00 -1.53 0.00 0.00 34.83 33.75 1yqs s MET 260 CO 0.19 -0.42 1.11 -1.54 -2.03 0.00 0.00 175.02 172.33 1yqs s SER 261 N -3.23 4.04 0.27 -1.18 1.04 -1.26 -4.83 113.70 108.55 1yqs s SER 261 Ca 0.18 1.95 -0.02 0.00 0.48 0.00 0.00 55.95 58.55 1yqs s SER 261 Cb 0.00 -2.54 0.44 0.00 0.10 0.00 0.00 66.02 64.03 1yqs s SER 261 CO 0.01 -2.35 1.86 0.00 0.98 0.00 0.00 173.24 173.74 1yqs h ALA 262 N -1.29 1.39 -0.50 5.32 0.00 -2.00 -1.36 119.26 120.83 1yqs h ALA 262 Ca -0.44 -0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.48 1yqs h ALA 262 Cb 1.24 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.75 1yqs h ALA 262 CO 0.48 0.33 0.32 0.00 0.00 0.00 0.00 179.25 180.38 1yqs h ALA 263 N 1.48 0.63 -0.06 0.00 0.00 -2.00 -1.29 119.26 118.02 1yqs h ALA 263 Ca 0.45 -0.03 -0.17 0.00 0.00 0.00 0.00 54.91 55.16 1yqs h ALA 263 Cb 0.29 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1yqs h ALA 263 CO -0.21 0.05 -0.69 1.96 0.00 0.00 0.00 179.25 180.36 1yqs h GLN 264 N 0.65 0.27 -0.62 0.00 7.50 -1.79 -2.08 115.11 119.03 1yqs h GLN 264 Ca 0.19 -0.21 -0.04 0.00 0.50 0.00 0.00 58.65 59.09 1yqs h GLN 264 Cb -0.05 0.04 -0.03 0.00 0.05 0.00 0.00 27.48 27.49 1yqs h GLN 264 CO -0.05 0.86 0.24 1.25 -1.50 0.00 0.00 178.83 179.62 1yqs h LEU 265 N 0.18 0.84 -0.78 1.46 5.85 -1.01 -0.57 115.31 121.27 1yqs h LEU 265 Ca -0.02 -0.12 -0.03 0.00 0.84 0.00 0.00 57.88 58.55 1yqs h LEU 265 Cb 1.24 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 42.02 1yqs h LEU 265 CO 0.11 0.76 0.36 0.00 -0.34 0.00 0.00 178.44 179.33 1yqs h ALA 266 N 1.36 1.01 -0.85 1.25 0.00 -0.97 -2.01 119.26 119.05 1yqs h ALA 266 Ca 0.21 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 1yqs h ALA 266 Cb 0.19 -0.31 -0.04 0.00 0.00 0.00 0.00 17.79 17.63 1yqs h ALA 266 CO -0.02 0.59 0.47 1.96 0.00 0.00 0.00 179.25 182.25 1yqs h GLN 267 N 1.12 1.19 -0.04 0.00 1.08 -0.85 -2.44 115.11 115.16 1yqs h GLN 267 Ca 0.27 -0.14 0.00 0.00 -1.45 0.00 0.00 58.65 57.33 1yqs h GLN 267 Cb 0.14 -0.23 -0.00 0.00 -0.05 0.00 0.00 27.48 27.34 1yqs h GLN 267 CO -0.03 0.87 0.03 1.98 -0.95 0.00 0.00 178.83 180.73 1yqs h MET 268 N 1.19 0.05 -0.61 1.46 4.05 -0.57 -2.51 114.93 117.99 1yqs h MET 268 Ca 0.30 -0.00 -0.04 0.00 -0.28 0.00 0.00 59.70 59.68 1yqs h MET 268 Cb 0.03 -0.01 -0.02 0.00 -0.80 0.00 0.00 31.60 30.80 1yqs h MET 268 CO -0.05 0.03 0.05 1.04 0.23 0.00 0.00 176.91 178.21 1yqs n GLN 269 N -4.53 4.75 -2.67 0.39 6.02 -0.81 -1.44 117.38 119.09 1yqs n GLN 269 Ca -0.02 -3.17 -0.42 0.00 -0.01 0.00 0.00 57.00 53.38 1yqs n GLN 269 Cb 0.09 -2.27 -0.03 0.00 1.02 0.00 0.00 30.24 29.05 1yqs n GLN 269 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 1yqs s GLN 270 N -2.82 3.44 -0.06 -1.09 -0.21 -0.95 -4.97 119.66 113.01 1yqs s GLN 270 Ca 0.55 0.07 -0.26 0.00 0.02 0.00 0.00 55.36 55.74 1yqs s GLN 270 Cb 0.42 -4.03 -0.03 0.00 1.00 0.00 0.00 33.01 30.37 1yqs s GLN 270 CO 0.16 -1.63 0.81 -1.58 -2.12 0.00 0.00 175.29 170.93 1yqs s TRP 271 N 4.64 3.58 -0.14 0.91 0.52 -1.26 -4.29 118.94 122.90 1yqs s TRP 271 Ca 0.39 1.39 -0.21 0.00 0.02 0.00 0.00 56.10 57.69 1yqs s TRP 271 Cb -0.09 -2.94 -0.03 0.00 -1.15 0.00 0.00 33.47 29.26 1yqs s TRP 271 CO 0.23 0.00 0.61 0.99 0.02 0.00 0.00 176.95 178.81 1yqs s THR 272 N 1.08 5.07 0.20 2.01 2.01 0.60 -4.87 115.64 121.74 1yqs s THR 272 Ca 0.42 1.20 -0.31 0.00 0.31 0.00 0.00 61.69 63.31 1yqs s THR 272 Cb -0.19 -3.94 -0.11 0.00 0.01 0.00 0.00 72.50 68.28 1yqs s THR 272 CO 0.20 0.20 1.58 -0.89 -0.69 0.00 0.00 174.62 175.03 1yqs s THR 273 N 1.28 2.45 -0.22 -0.82 2.01 -1.26 -0.85 115.64 118.23 1yqs s THR 273 Ca 0.30 0.34 -0.11 0.00 0.31 0.00 0.00 61.69 62.53 1yqs s THR 273 Cb -0.16 -3.22 -0.10 0.00 0.01 0.00 0.00 72.50 69.04 1yqs s THR 273 CO 0.12 0.03 -0.29 0.52 -0.69 0.00 0.00 174.62 174.32 1yqs n VAL 274 N 3.55 1.25 -3.43 3.82 0.31 -0.09 -4.83 118.33 118.91 1yqs n VAL 274 Ca 0.13 -0.30 -0.03 0.00 -0.01 0.00 0.00 64.34 64.12 1yqs n VAL 274 Cb 0.38 -1.82 0.00 0.00 -0.91 0.00 0.00 33.84 31.49 1yqs n VAL 274 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 1yqs n ASN 275 N -4.03 -0.53 0.00 4.52 0.23 -0.93 -4.98 115.26 109.55 1yqs n ASN 275 Ca -0.44 -1.48 0.06 0.00 -0.53 0.00 0.00 54.58 52.19 1yqs n ASN 275 Cb 0.80 0.91 0.28 0.00 -2.08 0.00 0.00 39.78 39.69 1yqs n ASN 275 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 1yqs n SER 276 N -1.51 0.00 -0.10 0.53 3.41 -1.26 -2.39 113.62 112.31 1yqs n SER 276 Ca -0.01 0.41 0.03 0.00 -0.26 0.00 0.00 58.87 59.04 1yqs n SER 276 Cb 0.16 -0.45 0.05 0.00 -0.26 0.00 0.00 64.21 63.71 1yqs n SER 276 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1yqs n THR 277 N -1.45 0.99 -3.79 6.66 -2.24 -1.26 -5.01 114.28 108.18 1yqs n THR 277 Ca 0.04 -1.12 -0.13 0.00 -2.27 0.00 0.00 64.05 60.57 1yqs n THR 277 Cb 0.13 0.33 -0.10 0.00 -2.10 0.00 0.00 70.33 68.59 1yqs n THR 277 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1yqs s GLN 278 N -1.33 0.46 0.19 -0.78 -0.21 -1.01 -0.54 119.66 116.45 1yqs s GLN 278 Ca 0.11 0.06 0.02 0.00 0.02 0.00 0.00 55.36 55.57 1yqs s GLN 278 Cb 0.09 0.21 -0.05 0.00 1.00 0.00 0.00 33.01 34.27 1yqs s GLN 278 CO 0.01 -0.10 0.00 0.20 -2.12 0.00 0.00 175.29 173.29 1yqs s GLY 279 N -0.60 1.33 -0.07 3.09 0.00 -0.71 -0.92 107.32 109.45 1yqs s GLY 279 Ca -0.07 -1.65 0.02 0.00 0.00 0.00 0.00 44.72 43.02 1yqs s GLY 279 CO 0.02 -1.57 -0.12 -0.47 0.00 0.00 0.00 173.10 170.96 1yqs s TYR 280 N -3.60 1.52 0.00 1.90 5.04 -0.03 -1.17 117.35 121.01 1yqs s TYR 280 Ca 0.26 -0.59 0.00 0.00 -2.44 0.00 0.00 57.07 54.30 1yqs s TYR 280 Cb 0.06 -1.12 0.00 0.00 0.35 0.00 0.00 41.96 41.25 1yqs s TYR 280 CO 0.06 -0.31 0.00 0.41 -1.34 0.00 0.00 175.55 174.37 1yqs n GLY 281 N 3.91 0.41 3.08 8.97 0.00 0.54 -0.29 105.19 121.81 1yqs n GLY 281 Ca -0.22 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.46 1yqs n GLY 281 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1yqs s LEU 282 N 0.00 5.05 -1.48 0.99 1.43 -0.52 -4.04 118.68 120.11 1yqs s LEU 282 Ca 0.00 -2.29 -0.07 0.00 -1.03 0.00 0.00 54.13 50.74 1yqs s LEU 282 Cb 0.00 -1.77 0.01 0.00 0.03 0.00 0.00 46.19 44.46 1yqs s LEU 282 CO 0.00 -0.45 0.87 0.61 0.23 0.00 0.00 176.35 177.61 1yqs n GLY 283 N 4.19 -0.54 3.37 -3.19 0.00 -0.57 -4.86 105.19 103.59 1yqs n GLY 283 Ca 0.02 0.19 -0.14 0.00 0.00 0.00 0.00 46.02 46.09 1yqs n GLY 283 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1yqs s LEU 284 N -6.98 0.20 0.09 0.99 2.96 -1.26 -3.39 118.68 111.29 1yqs s LEU 284 Ca 0.44 0.78 0.08 0.00 -0.22 0.00 0.00 54.13 55.21 1yqs s LEU 284 Cb -0.19 1.68 -0.04 0.00 0.50 0.00 0.00 46.19 48.14 1yqs s LEU 284 CO 0.54 -0.27 -0.17 -0.13 -1.32 0.00 0.00 176.35 175.00 1yqs s ARG 285 N -0.19 1.91 -0.11 1.98 0.52 0.78 -0.34 118.95 123.50 1yqs s ARG 285 Ca -0.04 -1.10 0.01 0.00 -0.52 0.00 0.00 55.73 54.09 1yqs s ARG 285 Cb -0.03 -2.16 -0.02 0.00 0.52 0.00 0.00 34.95 33.26 1yqs s ARG 285 CO 0.02 0.50 -0.15 0.50 0.02 0.00 0.00 175.30 176.20 1yqs s ARG 286 N -1.92 3.18 -0.09 3.54 3.52 -0.31 -1.04 118.95 125.81 1yqs s ARG 286 Ca 0.17 -0.71 0.03 0.00 -0.13 0.00 0.00 55.73 55.09 1yqs s ARG 286 Cb -0.11 -2.54 0.00 0.00 -1.56 0.00 0.00 34.95 30.75 1yqs s ARG 286 CO 0.09 0.29 -0.21 1.03 -0.81 0.00 0.00 175.30 175.69 1yqs s ARG 287 N 0.14 2.69 -0.28 5.12 0.52 -0.23 -1.74 118.95 125.18 1yqs s ARG 287 Ca -0.08 -0.75 -0.15 0.00 -0.52 0.00 0.00 55.73 54.23 1yqs s ARG 287 Cb -0.15 -2.08 -0.03 0.00 0.52 0.00 0.00 34.95 33.21 1yqs s ARG 287 CO 0.05 0.12 0.37 -0.51 0.02 0.00 0.00 175.30 175.35 1yqs s ASP 288 N 0.47 6.24 0.46 0.23 1.01 0.30 -0.68 116.67 124.70 1yqs s ASP 288 Ca -0.17 0.22 -0.01 0.00 0.71 0.00 0.00 52.55 53.30 1yqs s ASP 288 Cb -0.17 -2.21 -0.01 0.00 1.01 0.00 0.00 42.92 41.54 1yqs s ASP 288 CO 0.07 -0.21 0.70 -0.76 0.21 0.00 0.00 175.17 175.18 1yqs s LEU 289 N 2.07 3.64 0.53 1.23 1.43 0.93 -4.92 118.68 123.58 1yqs s LEU 289 Ca 0.15 0.42 0.18 0.00 -1.03 0.00 0.00 54.13 53.85 1yqs s LEU 289 Cb -0.16 -3.29 1.34 0.00 0.03 0.00 0.00 46.19 44.11 1yqs s LEU 289 CO 0.10 -0.69 2.15 0.77 0.23 0.00 0.00 176.35 178.91 1yqs h SER 290 N 0.35 0.00 -0.39 2.29 4.64 -1.98 -1.08 113.55 117.38 1yqs h SER 290 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 1yqs h SER 290 Cb 1.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 1yqs h SER 290 CO 0.59 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.55 1yqs n GLY 292 N 1.05 0.53 3.86 0.00 0.00 -0.41 -5.06 105.19 105.15 1yqs n GLY 292 Ca 0.14 -0.82 -0.37 0.00 0.00 0.00 0.00 46.02 44.97 1yqs n GLY 292 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1yqs s ILE 293 N -2.00 5.48 0.03 -0.61 1.01 -1.25 -4.95 121.20 118.91 1yqs s ILE 293 Ca 0.00 0.20 0.01 0.00 0.00 0.00 0.00 60.65 60.87 1yqs s ILE 293 Cb 0.00 -3.40 -0.04 0.00 0.01 0.00 0.00 42.46 39.03 1yqs s ILE 293 CO 0.00 0.60 0.06 -0.44 0.00 0.00 0.00 174.94 175.15 1yqs s SER 294 N -0.85 5.46 0.17 3.58 0.01 -1.26 -0.05 113.70 120.76 1yqs s SER 294 Ca 0.14 0.04 0.05 0.00 1.31 0.00 0.00 55.95 57.49 1yqs s SER 294 Cb -0.12 -1.49 -0.05 0.00 0.21 0.00 0.00 66.02 64.58 1yqs s SER 294 CO 0.03 0.24 -0.09 0.68 0.41 0.00 0.00 173.24 174.51 1yqs s VAL 295 N -1.23 1.20 -0.03 3.43 -7.23 0.14 -4.46 120.40 112.23 1yqs s VAL 295 Ca 0.24 -2.07 0.01 0.00 -1.81 0.00 0.00 61.98 58.35 1yqs s VAL 295 Cb -0.12 -1.96 0.02 0.00 0.56 0.00 0.00 36.38 34.88 1yqs s VAL 295 CO 0.16 -0.65 -0.01 -0.31 -0.31 0.00 0.00 175.10 173.97 1yqs s TYR 296 N -3.31 0.39 0.00 2.82 2.02 -0.12 -1.06 117.35 118.09 1yqs s TYR 296 Ca 0.19 -0.05 0.00 0.00 -0.37 0.00 0.00 57.07 56.85 1yqs s TYR 296 Cb 0.03 -0.42 0.00 0.00 -0.40 0.00 0.00 41.96 41.17 1yqs s TYR 296 CO 0.03 -0.12 0.00 0.41 -1.57 0.00 0.00 175.55 174.30 1yqs n GLY 297 N 3.90 -0.58 3.46 0.71 0.00 -0.21 -0.61 105.19 111.86 1yqs n GLY 297 Ca -0.24 -0.25 -0.16 0.00 0.00 0.00 0.00 46.02 45.37 1yqs n GLY 297 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1yqs s HIS 298 N -2.71 -0.56 0.45 1.61 2.46 0.06 -0.16 115.29 116.44 1yqs s HIS 298 Ca 0.00 0.84 -0.03 0.00 0.47 0.00 0.00 55.06 56.33 1yqs s HIS 298 Cb 0.00 0.39 -0.03 0.00 -0.13 0.00 0.00 32.58 32.81 1yqs s HIS 298 CO 0.00 -0.63 0.72 0.95 -2.47 0.00 0.00 174.74 173.32 1yqs s THR 299 N -1.75 4.78 -0.02 0.89 -4.23 -1.26 -1.57 115.64 112.48 1yqs s THR 299 Ca -0.09 -0.05 0.01 0.00 -1.18 0.00 0.00 61.69 60.39 1yqs s THR 299 Cb -0.01 -3.80 0.01 0.00 1.34 0.00 0.00 72.50 70.05 1yqs s THR 299 CO 0.05 -0.70 -0.04 -0.83 -0.54 0.00 0.00 174.62 172.55 1yqs s GLY 300 N -4.11 0.33 0.02 3.99 0.00 0.33 -2.20 107.32 105.67 1yqs s GLY 300 Ca 0.46 -0.08 0.04 0.00 0.00 0.00 0.00 44.72 45.14 1yqs s GLY 300 CO 0.42 0.21 -0.12 -0.51 0.00 0.00 0.00 173.10 173.09 1yqs s THR 301 N 0.51 0.98 0.06 0.90 -4.23 -1.26 -0.67 115.64 111.92 1yqs s THR 301 Ca -0.06 -0.75 -0.26 0.00 -1.18 0.00 0.00 61.69 59.44 1yqs s THR 301 Cb -0.09 -0.86 0.09 0.00 1.34 0.00 0.00 72.50 72.97 1yqs s THR 301 CO -0.00 0.11 0.75 0.54 -0.54 0.00 0.00 174.62 175.47 1yqs s VAL 302 N -0.59 0.00 0.02 2.29 0.11 -1.08 -3.16 120.40 117.99 1yqs s VAL 302 Ca 0.02 0.00 -0.31 0.00 -2.93 0.00 0.00 61.98 58.76 1yqs s VAL 302 Cb -0.06 -1.00 -0.10 0.00 -1.53 0.00 0.00 36.38 33.69 1yqs s VAL 302 CO 0.00 0.00 1.93 0.00 -3.33 0.00 0.00 175.10 173.70 1yqs n GLN 303 N -0.16 2.70 -0.63 1.54 3.00 -1.26 -1.41 117.38 121.16 1yqs n GLN 303 Ca -0.13 0.99 0.00 0.00 -0.01 0.00 0.00 57.00 57.84 1yqs n GLN 303 Cb 0.63 -2.91 0.00 0.00 0.00 0.00 0.00 30.24 27.96 1yqs n GLN 303 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1yqs n GLY 304 N 4.46 0.81 2.82 1.08 0.00 -1.26 -4.72 105.19 108.37 1yqs n GLY 304 Ca 0.20 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.06 1yqs n GLY 304 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1yqs s TYR 305 N -3.19 -0.08 -0.16 1.61 1.51 -0.50 -1.76 117.35 114.78 1yqs s TYR 305 Ca 0.00 0.39 -0.01 0.00 -1.01 0.00 0.00 57.07 56.44 1yqs s TYR 305 Cb 0.00 -0.24 -0.01 0.00 -0.11 0.00 0.00 41.96 41.60 1yqs s TYR 305 CO 0.00 -0.18 -0.11 0.71 -1.11 0.00 0.00 175.55 174.86 1yqs s TYR 306 N 1.62 2.85 0.00 2.71 2.02 -0.29 -2.63 117.35 123.62 1yqs s TYR 306 Ca -0.03 -0.87 0.07 0.00 -0.37 0.00 0.00 57.07 55.87 1yqs s TYR 306 Cb -0.12 -1.93 -0.02 0.00 -0.40 0.00 0.00 41.96 39.49 1yqs s TYR 306 CO -0.05 -0.40 -0.23 0.99 -1.57 0.00 0.00 175.55 174.30 1yqs s THR 307 N 0.82 1.82 -0.11 -0.71 2.01 0.15 -1.27 115.64 118.35 1yqs s THR 307 Ca -0.04 -1.06 0.03 0.00 0.31 0.00 0.00 61.69 60.92 1yqs s THR 307 Cb -0.15 -1.53 0.01 0.00 0.01 0.00 0.00 72.50 70.84 1yqs s THR 307 CO 0.01 0.44 -0.19 -0.31 -0.69 0.00 0.00 174.62 173.88 1yqs s TYR 308 N -0.61 2.26 -0.20 4.92 1.51 -0.34 -0.51 117.35 124.37 1yqs s TYR 308 Ca 0.09 -1.02 -0.04 0.00 -1.01 0.00 0.00 57.07 55.09 1yqs s TYR 308 Cb -0.09 -1.56 0.07 0.00 -0.11 0.00 0.00 41.96 40.27 1yqs s TYR 308 CO -0.00 -0.47 0.07 0.00 -1.11 0.00 0.00 175.55 174.04 1yqs s ALA 309 N 0.71 0.80 0.02 3.71 0.00 -0.61 -0.67 121.76 125.72 1yqs s ALA 309 Ca -0.11 -0.67 -0.00 0.00 0.00 0.00 0.00 51.96 51.17 1yqs s ALA 309 Cb -0.16 -1.18 -0.02 0.00 0.00 0.00 0.00 23.12 21.75 1yqs s ALA 309 CO 0.02 -1.26 -0.03 -0.06 0.00 0.00 0.00 175.76 174.43 1yqs s PHE 310 N 1.97 0.31 0.11 0.00 0.40 -0.36 -0.76 117.98 119.64 1yqs s PHE 310 Ca 0.02 -0.59 0.04 0.00 -0.60 0.00 0.00 56.93 55.80 1yqs s PHE 310 Cb -0.17 -0.22 -0.04 0.00 0.51 0.00 0.00 43.02 43.11 1yqs s PHE 310 CO -0.13 -0.21 -0.10 0.00 0.70 0.00 0.00 175.22 175.49 1yqs s ALA 311 N -1.73 1.17 0.98 5.36 0.00 0.22 -0.64 121.76 127.11 1yqs s ALA 311 Ca -0.13 -1.26 -0.12 0.00 0.00 0.00 0.00 51.96 50.45 1yqs s ALA 311 Cb -0.08 0.04 0.18 0.00 0.00 0.00 0.00 23.12 23.26 1yqs s ALA 311 CO -0.02 -0.06 1.08 -1.54 0.00 0.00 0.00 175.76 175.22 1yqs s SER 312 N -2.63 2.69 0.40 0.00 1.04 0.05 -0.94 113.70 114.32 1yqs s SER 312 Ca 0.08 1.51 0.07 0.00 0.48 0.00 0.00 55.95 58.10 1yqs s SER 312 Cb -0.01 -2.18 0.84 0.00 0.10 0.00 0.00 66.02 64.77 1yqs s SER 312 CO -0.00 -3.13 2.03 0.50 0.98 0.00 0.00 173.24 173.62 1yqs h LYS 313 N -1.89 0.49 -0.29 4.02 1.63 -1.91 0.17 116.57 118.79 1yqs h LYS 313 Ca -0.52 -0.04 0.00 0.00 -0.85 0.00 0.00 60.65 59.23 1yqs h LYS 313 Cb 1.30 -0.10 0.00 0.00 -0.60 0.00 0.00 32.23 32.83 1yqs h LYS 313 CO 0.53 0.37 0.00 -0.40 -3.45 0.00 0.00 179.45 176.49 1yqs n ASP 314 N -4.44 2.46 0.00 4.20 5.68 -1.26 -4.61 116.55 118.57 1yqs n ASP 314 Ca 0.02 -1.86 0.00 0.00 -0.50 0.00 0.00 54.79 52.46 1yqs n ASP 314 Cb 0.10 -0.18 0.00 0.00 -1.14 0.00 0.00 41.12 39.89 1yqs n ASP 314 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1yqs n GLY 315 N 1.29 0.56 0.17 6.12 0.00 0.05 -4.08 105.19 109.30 1yqs n GLY 315 Ca 0.17 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.23 1yqs n GLY 315 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1yqs h LYS 316 N 1.60 0.00 -5.21 1.61 1.57 -1.89 -3.41 116.57 110.83 1yqs h LYS 316 Ca 0.00 0.00 -0.65 0.00 -1.87 0.00 0.00 60.65 58.13 1yqs h LYS 316 Cb 0.09 0.00 -0.33 0.00 0.08 0.00 0.00 32.23 32.07 1yqs h LYS 316 CO 0.00 0.43 -0.87 0.50 -0.57 0.00 0.00 179.45 178.94 1yqs s ARG 317 N -3.45 2.84 0.06 3.15 3.52 -1.26 -0.70 118.95 123.12 1yqs s ARG 317 Ca 0.01 -0.81 0.04 0.00 -0.13 0.00 0.00 55.73 54.84 1yqs s ARG 317 Cb 0.10 -2.18 -0.03 0.00 -1.56 0.00 0.00 34.95 31.29 1yqs s ARG 317 CO 0.71 0.14 -0.12 -1.54 -0.81 0.00 0.00 175.30 173.68 1yqs s SER 318 N 0.43 1.37 -0.01 -2.12 1.04 -0.62 -0.77 113.70 113.01 1yqs s SER 318 Ca -0.17 -0.61 0.00 0.00 0.48 0.00 0.00 55.95 55.65 1yqs s SER 318 Cb -0.17 -0.01 0.01 0.00 0.10 0.00 0.00 66.02 65.95 1yqs s SER 318 CO 0.07 -0.14 -0.00 -0.69 0.98 0.00 0.00 173.24 173.46 1yqs s VAL 319 N -1.41 0.13 -0.07 5.02 1.01 0.18 -0.83 120.40 124.44 1yqs s VAL 319 Ca -0.04 0.03 0.01 0.00 0.00 0.00 0.00 61.98 61.97 1yqs s VAL 319 Cb -0.09 -0.18 0.02 0.00 0.00 0.00 0.00 36.38 36.13 1yqs s VAL 319 CO 0.01 0.09 -0.07 -0.89 0.00 0.00 0.00 175.10 174.25 1yqs s THR 320 N 0.53 0.80 0.04 3.92 2.01 -0.62 -1.22 115.64 121.11 1yqs s THR 320 Ca -0.05 -0.23 0.08 0.00 0.31 0.00 0.00 61.69 61.80 1yqs s THR 320 Cb -0.08 -0.81 -0.03 0.00 0.01 0.00 0.00 72.50 71.60 1yqs s THR 320 CO -0.01 0.30 -0.24 0.00 -0.69 0.00 0.00 174.62 173.98 1yqs s ALA 321 N 1.19 2.03 -0.02 7.40 0.00 0.15 -1.14 121.76 131.37 1yqs s ALA 321 Ca -0.06 -1.17 -0.01 0.00 0.00 0.00 0.00 51.96 50.73 1yqs s ALA 321 Cb -0.14 -0.42 0.02 0.00 0.00 0.00 0.00 23.12 22.58 1yqs s ALA 321 CO -0.02 0.47 0.04 -1.17 0.00 0.00 0.00 175.76 175.09 1yqs s LEU 322 N -1.18 1.28 -0.06 0.00 1.98 -0.24 -1.20 118.68 119.25 1yqs s LEU 322 Ca 0.10 0.07 0.06 0.00 -2.89 0.00 0.00 54.13 51.47 1yqs s LEU 322 Cb -0.09 0.03 -0.01 0.00 0.66 0.00 0.00 46.19 46.78 1yqs s LEU 322 CO 0.02 -0.10 -0.25 0.00 -1.89 0.00 0.00 176.35 174.13 1yqs s ALA 323 N 0.77 2.16 -0.53 5.97 0.00 -0.40 -0.69 121.76 129.05 1yqs s ALA 323 Ca -0.06 -1.03 -0.04 0.00 0.00 0.00 0.00 51.96 50.83 1yqs s ALA 323 Cb -0.09 -0.69 0.10 0.00 0.00 0.00 0.00 23.12 22.43 1yqs s ALA 323 CO -0.02 0.40 2.67 0.27 0.00 0.00 0.00 175.76 179.07 1yqs n ASN 324 N 3.04 6.65 -4.22 0.00 6.94 -0.89 -1.14 115.26 125.64 1yqs n ASN 324 Ca -0.18 -3.28 -0.13 0.00 -0.02 0.00 0.00 54.58 50.98 1yqs n ASN 324 Cb 0.52 -1.22 -0.10 0.00 -2.36 0.00 0.00 39.78 36.62 1yqs n ASN 324 CO 0.00 0.00 0.00 0.28 -1.03 0.00 0.00 177.26 176.51 1yqs s THR 325 N -2.53 0.23 0.34 5.53 -1.32 -0.72 -1.96 115.64 115.21 1yqs s THR 325 Ca 0.58 -1.98 0.00 0.00 -1.21 0.00 0.00 61.69 59.08 1yqs s THR 325 Cb 0.38 -2.39 0.00 0.00 -1.51 0.00 0.00 72.50 68.98 1yqs s THR 325 CO -0.24 -0.16 0.44 -1.54 -2.21 0.00 0.00 174.62 170.92 1yqs n SER 326 N -0.27 -1.22 -3.73 8.08 3.41 -1.13 -2.72 113.62 116.04 1yqs n SER 326 Ca -0.01 -2.94 -0.25 0.00 -0.26 0.00 0.00 58.87 55.42 1yqs n SER 326 Cb 0.65 2.34 0.05 0.00 -0.26 0.00 0.00 64.21 66.99 1yqs n SER 326 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1yqs n ASN 327 N -1.65 -3.72 -3.35 4.04 5.15 -1.26 -2.08 115.26 112.39 1yqs n ASN 327 Ca 0.02 -0.73 -0.19 0.00 -0.60 0.00 0.00 54.58 53.08 1yqs n ASN 327 Cb 0.58 -4.31 -0.08 0.00 -0.53 0.00 0.00 39.78 35.44 1yqs n ASN 327 CO 0.00 0.00 0.00 0.21 1.40 0.00 0.00 177.26 178.87 1yqs s ASN 328 N -3.75 1.34 0.49 1.20 3.84 -1.26 -4.63 114.94 112.17 1yqs s ASN 328 Ca 0.38 -1.87 0.18 0.00 0.21 0.00 0.00 52.86 51.76 1yqs s ASN 328 Cb -0.18 0.37 1.21 0.00 -0.55 0.00 0.00 41.25 42.10 1yqs s ASN 328 CO 0.79 -0.24 2.06 -0.37 -2.79 0.00 0.00 177.10 176.55 1yqs h VAL 329 N 4.97 0.96 -0.34 -5.21 -1.51 -1.98 -1.35 116.25 111.79 1yqs h VAL 329 Ca 0.08 -0.42 0.00 0.00 -1.23 0.00 0.00 66.70 65.13 1yqs h VAL 329 Cb 1.03 1.23 -0.02 0.00 -2.13 0.00 0.00 31.29 31.41 1yqs h VAL 329 CO 0.22 0.11 0.21 0.78 -1.23 0.00 0.00 177.57 177.66 1yqs h ASN 330 N 0.00 0.40 -0.46 4.19 2.35 -1.95 -0.07 115.58 120.03 1yqs h ASN 330 Ca -0.00 -0.03 -0.02 0.00 -0.55 0.00 0.00 56.30 55.70 1yqs h ASN 330 Cb 0.22 -0.10 -0.02 0.00 0.05 0.00 0.00 38.32 38.47 1yqs h ASN 330 CO 0.02 0.31 0.20 0.58 -1.65 0.00 0.00 177.43 176.88 1yqs h VAL 331 N 0.45 1.20 -0.46 2.81 2.07 -1.67 -0.36 116.25 120.29 1yqs h VAL 331 Ca 0.12 -0.60 0.03 0.00 0.82 0.00 0.00 66.70 67.07 1yqs h VAL 331 Cb -0.03 0.74 -0.04 0.00 -1.52 0.00 0.00 31.29 30.45 1yqs h VAL 331 CO -0.02 0.23 0.25 0.25 0.02 0.00 0.00 177.57 178.29 1yqs h LEU 332 N 0.60 0.38 -0.40 2.57 5.85 -0.89 -0.02 115.31 123.40 1yqs h LEU 332 Ca 0.15 0.02 -0.08 0.00 0.84 0.00 0.00 57.88 58.81 1yqs h LEU 332 Cb 0.17 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.13 1yqs h LEU 332 CO -0.02 0.27 -0.06 0.78 -0.34 0.00 0.00 178.44 179.07 1yqs h ASN 333 N 0.50 0.74 -0.56 1.25 -0.26 -0.84 -2.93 115.58 113.48 1yqs h ASN 333 Ca 0.19 -0.35 0.00 0.00 -0.56 0.00 0.00 56.30 55.59 1yqs h ASN 333 Cb 0.07 -0.20 -0.03 0.00 -1.06 0.00 0.00 38.32 37.10 1yqs h ASN 333 CO -0.11 0.91 0.36 0.74 -1.06 0.00 0.00 177.43 178.27 1yqs h THR 334 N 0.56 1.15 0.00 2.81 2.02 -0.67 -2.71 112.91 116.07 1yqs h THR 334 Ca 0.10 -0.30 -0.02 0.00 0.77 0.00 0.00 66.41 66.96 1yqs h THR 334 Cb 0.57 0.36 -0.00 0.00 -1.74 0.00 0.00 68.15 67.33 1yqs h THR 334 CO 0.03 0.15 -0.12 0.24 0.37 0.00 0.00 175.52 176.19 1yqs h MET 335 N 0.75 0.00 -0.02 6.66 2.86 -0.86 -0.14 114.93 124.19 1yqs h MET 335 Ca 0.20 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.85 1yqs h MET 335 Cb -0.06 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.60 1yqs h MET 335 CO -0.04 0.12 0.02 0.00 1.06 0.00 0.00 176.91 178.06 1yqs h ALA 336 N 1.88 1.65 0.00 6.32 0.00 -1.31 -1.82 119.26 125.99 1yqs h ALA 336 Ca -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1yqs h ALA 336 Cb 0.25 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1yqs h ALA 336 CO 0.02 -0.03 0.00 0.00 0.00 0.00 0.00 179.25 179.24 1yqs h ARG 337 N 0.00 0.00 -0.44 0.00 3.08 -1.09 -1.93 114.38 114.00 1yqs h ARG 337 Ca 0.01 0.00 0.07 0.00 0.07 0.00 0.00 59.98 60.13 1yqs h ARG 337 Cb 0.04 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.07 1yqs h ARG 337 CO -0.00 0.00 0.30 1.79 -1.07 0.00 0.00 179.97 180.99 1yqs h THR 338 N 0.00 0.93 -0.49 2.04 1.35 -1.47 -1.81 112.91 113.46 1yqs h THR 338 Ca 0.00 -0.10 -0.13 0.00 -0.55 0.00 0.00 66.41 65.63 1yqs h THR 338 Cb 0.26 0.60 -0.01 0.00 -1.73 0.00 0.00 68.15 67.27 1yqs h THR 338 CO 0.00 0.05 -0.20 -0.07 -0.25 0.00 0.00 175.52 175.06 1yqs h LEU 339 N 0.30 1.02 0.46 3.87 3.38 -1.55 -0.32 115.31 122.46 1yqs h LEU 339 Ca 0.20 -0.38 -0.02 0.00 0.09 0.00 0.00 57.88 57.78 1yqs h LEU 339 Cb 0.41 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.87 1yqs h LEU 339 CO -0.04 1.17 -0.28 -0.33 0.09 0.00 0.00 178.44 179.05 1yqs h GLU 340 N 0.86 -0.68 -0.55 1.13 4.39 -1.52 -0.84 114.58 117.38 1yqs h GLU 340 Ca 0.12 0.05 -0.06 0.00 0.34 0.00 0.00 59.36 59.80 1yqs h GLU 340 Cb 0.77 0.15 -0.02 0.00 -0.10 0.00 0.00 28.75 29.55 1yqs h GLU 340 CO 0.06 -0.45 0.09 0.77 -1.16 0.00 0.00 179.01 178.32 1yqs h SER 341 N -0.70 0.83 0.41 1.42 0.02 -1.23 0.60 113.55 114.89 1yqs h SER 341 Ca -0.05 -0.17 -0.23 0.00 -0.84 0.00 0.00 61.79 60.50 1yqs h SER 341 Cb 0.57 -0.22 0.00 0.00 0.14 0.00 0.00 62.40 62.90 1yqs h SER 341 CO 0.06 0.84 -0.98 0.00 -1.14 0.00 0.00 176.83 175.60 1yqs h ALA 342 N 1.27 0.34 0.00 3.77 0.00 -0.98 -0.96 119.26 122.69 1yqs h ALA 342 Ca 0.17 -0.74 -0.43 0.00 0.00 0.00 0.00 54.91 53.91 1yqs h ALA 342 Cb 0.37 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.07 1yqs h ALA 342 CO 0.01 0.85 -2.51 1.19 0.00 0.00 0.00 179.25 178.79 1yqs n PHE 343 N -3.70 0.00 0.11 0.00 3.72 -0.33 -4.06 117.46 113.21 1yqs n PHE 343 Ca -0.07 0.00 0.02 0.00 -0.05 0.00 0.00 57.45 57.35 1yqs n PHE 343 Cb 0.86 -0.99 -0.00 0.00 -0.94 0.00 0.00 39.48 38.41 1yqs n PHE 343 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1yqs n GLY 345 N 1.26 -1.22 3.77 0.00 0.00 -0.99 -4.77 105.19 103.23 1yqs n GLY 345 Ca -0.01 -1.23 -0.39 0.00 0.00 0.00 0.00 46.02 44.39 1yqs n GLY 345 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1yqs s LYS 346 N 0.00 3.80 0.00 1.61 1.02 -1.26 -4.72 119.74 120.19 1yqs s LYS 346 Ca 0.00 2.19 0.00 0.00 0.02 0.00 0.00 55.97 58.18 1yqs s LYS 346 Cb 0.00 -2.65 0.00 0.00 -0.52 0.00 0.00 37.83 34.66 1yqs s LYS 346 CO 0.00 -0.64 0.18 -2.30 -0.92 0.00 0.00 175.35 171.67